| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.3 | Very low | 47.1 | Very low | 241 Ų | 241 | 149.2 Ų | 149.2 | 100% | 1.187 | 80% | 0.803 | S | S | * | * | 0 | 144 | 0 | -72.4 | 113.7 | 120.7 | 0 | 0 | 109 | |||||
| 2 | S | 40.4 | Very low | 47 | Very low | 91 Ų | 91 | 150.8 Ų | 150.8 | 64% | 0.636 | 80% | 0.797 | S | S | * | * | trans | 26.7 | 122.5 | 178.2 | -73.6 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 3 | S | 46.8 | Very low | 46.4 | Very low | 108 Ų | 108 | 148.2 Ų | 148.2 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | cis | 68.1 | 72.7 | 40 | -167.1 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 4 | Y | 52 | Low | 45.3 | Very low | 200 Ų | 200 | 144.8 Ų | 144.8 | 78% | 0.784 | 80% | 0.801 | S | S | * | * | trans | -147.3 | 130.3 | 148.2 | -57.7 | -73.3 | 0 | 0 | 0 | 106 | ||||
| 5 | Y | 54.9 | Low | 45.2 | Very low | 206 Ų | 206 | 143.3 Ų | 143.3 | 81% | 0.808 | 81% | 0.805 | S | S | * | * | cis | -134.7 | 160.1 | -2 | -123.9 | -85.5 | 0 | 0 | 0 | 109.4 | ||||
| 6 | V | 48.5 | Very low | 45.2 | Very low | 126 Ų | 126 | 139.1 Ų | 139.1 | 76% | 0.764 | 80% | 0.803 | S | S | * | * | trans | -123.9 | 121.5 | 158.5 | 175.2 | 0 | 0 | 0 | 0 | 106 | ||||
| 7 | D | 40.3 | Very low | 45 | Very low | 144 Ų | 144 | 138.1 Ų | 138.1 | 77% | 0.77 | 81% | 0.806 | S | S | * | * | trans | -158.2 | 148.1 | 143.1 | -121.4 | -36.2 | 0 | 0 | 0 | 113.3 | ||||
| 8 | S | 48.2 | Very low | 45.2 | Very low | 100 Ų | 100 | 136.1 Ų | 136.1 | 70% | 0.699 | 80% | 0.801 | S | S | * | * | trans | -100.3 | -157.2 | 176.1 | -66.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 9 | L | 49.5 | Very low | 45.1 | Very low | 161 Ų | 161 | 137.3 Ų | 137.3 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | 75 | 114.6 | -177.4 | -40.2 | 175.5 | 0 | 0 | 0 | 111.2 | ||||
| 10 | L | 51.4 | Low | 45 | Very low | 129 Ų | 129 | 140.2 Ų | 140.2 | 68% | 0.675 | 81% | 0.806 | S | S | * | * | cis | -145.8 | 105.4 | 33.8 | -174.9 | 70.5 | 0 | 0 | 0 | 112.1 | K12 | L10-K12 HydrophobicContact CD1-CB 4.23Å; L10-K12 HydrophobicContact CD1-CD 4.21Å; L10-K12 HydrophobicContact CD2-CB 4.48Å; L10-K12 HydrophobicContact CG-CB 4.14Å | ||
| 11 | C | 44.7 | Very low | 45.3 | Very low | 135 Ų | 135 | 139.1 Ų | 139.1 | 91% | 0.912 | 80% | 0.804 | S | S | * | * | trans | -91.6 | 113 | 153.9 | -165.6 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 12 | K | 46.4 | Very low | 45.3 | Very low | 168 Ų | 168 | 135.4 Ų | 135.4 | 73% | 0.73 | 79% | 0.787 | S | S | * | * | trans | -127.6 | 106.2 | 173.4 | -155.9 | 102.7 | 83.9 | -173.5 | 0 | 108.9 | L10 | L10-K12 HydrophobicContact CD1-CB 4.23Å; L10-K12 HydrophobicContact CD1-CD 4.21Å; L10-K12 HydrophobicContact CD2-CB 4.48Å; L10-K12 HydrophobicContact CG-CB 4.14Å | ||
| 13 | S | 38.4 | Very low | 45.4 | Very low | 117 Ų | 117 | 137.2 Ų | 137.2 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -70.1 | 128.4 | 170.1 | 35.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 14 | A | 31.8 | Very low | 45.4 | Very low | 101 Ų | 101 | 141.1 Ų | 141.1 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | -111.2 | 114 | 161.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 15 | S | 43.2 | Very low | 44.9 | Very low | 123 Ų | 123 | 143.1 Ų | 143.1 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | -74 | 156.5 | 175.4 | -171 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 16 | G | 45.3 | Very low | 43.8 | Very low | 75 Ų | 75 | 137.8 Ų | 137.8 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | -57.1 | 146.7 | -164.2 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 17 | S | 41.1 | Very low | 43.3 | Very low | 122 Ų | 122 | 136.8 Ų | 136.8 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | trans | -134.8 | 110.2 | 152.8 | 41.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 18 | S | 49.7 | Very low | 43.2 | Very low | 103 Ų | 103 | 135.6 Ų | 135.6 | 72% | 0.72 | 81% | 0.805 | S | S | * | * | trans | -63.2 | 157.3 | 159.4 | 180 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 19 | L | 42.2 | Very low | 42.6 | Very low | 159 Ų | 159 | 133.8 Ų | 133.8 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | trans | 142.1 | 113.6 | 142.4 | -74.4 | 162.6 | 0 | 0 | 0 | 111.2 | ||||
| 20 | F | 44.8 | Very low | 42.2 | Very low | 195 Ų | 195 | 134.7 Ų | 134.7 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | trans | -77.1 | 132.9 | 165.3 | -63 | -97.8 | 0 | 0 | 0 | 109.7 | ||||
| 21 | P | 49.7 | Very low | 41.6 | Very low | 118 Ų | 118 | 131.6 Ų | 131.6 | 77% | 0.766 | 81% | 0.806 | S | S | * | * | trans | -80.7 | 117.2 | 151.7 | 31.5 | -27.3 | 0 | 0 | 0 | 107.7 | ||||
| 22 | I | 42.1 | Very low | 42.5 | Very low | 162 Ų | 162 | 132 Ų | 132 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | 63.5 | 124.7 | 76.6 | -63.3 | 179.6 | 0 | 0 | 0 | 112.2 | |||||
| 23 | V | 43.1 | Very low | 41.8 | Very low | 130 Ų | 130 | 127.8 Ų | 127.8 | 79% | 0.788 | 81% | 0.811 | S | S | * | * | trans | -93.9 | 140.7 | -173.9 | 64.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 24 | E | 46.2 | Very low | 41.8 | Very low | 190 Ų | 190 | 125.5 Ų | 125.5 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | trans | -126.3 | 171.4 | 163 | -75.5 | -145.8 | 130.6 | 0 | 0 | 111.7 | ||||
| 25 | R | 40.4 | Very low | 42.2 | Very low | 241 Ų | 241 | 130.2 Ų | 130.2 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | trans | -144.2 | 151 | -138.6 | 172.8 | -177.3 | 174.5 | 160.4 | -0.6 | 112.9 | ||||
| 26 | A | 33.9 | Very low | 41.9 | Very low | 95 Ų | 95 | 131 Ų | 131 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | 74.4 | 160.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 27 | S | 36 | Very low | 41.7 | Very low | 105 Ų | 105 | 138 Ų | 138 | 73% | 0.734 | 81% | 0.808 | S | S | * | * | cis | -152.7 | 177.1 | 11.9 | -154.1 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 28 | C | 38.9 | Very low | 41.9 | Very low | 118 Ų | 118 | 142.8 Ų | 142.8 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | -24 | 165.4 | 173.9 | 55.1 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 29 | G | 36.5 | Very low | 41.5 | Very low | 62 Ų | 62 | 144.7 Ų | 144.7 | 64% | 0.639 | 82% | 0.815 | S | S | * | * | cis | -160.4 | 170.5 | 10.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 30 | I | 41.3 | Very low | 41.5 | Very low | 180 Ų | 180 | 141.7 Ų | 141.7 | 92% | 0.923 | 81% | 0.813 | S | S | * | * | 54 | 126.4 | 95.5 | -48.9 | 169.8 | 0 | 0 | 0 | 112.7 | |||||
| 31 | G | 37.4 | Very low | 41.8 | Very low | 65 Ų | 65 | 136.8 Ų | 136.8 | 67% | 0.67 | 81% | 0.808 | S | S | * | * | cis | -174.3 | -168.9 | 10.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 32 | P | 63.7 | Low | 41.8 | Very low | 142 Ų | 142 | 138.5 Ų | 138.5 | 92% | 0.922 | 81% | 0.809 | S | S | * | * | trans | -118.3 | 174 | -151 | 42.6 | -35.3 | 0 | 0 | 0 | 118.4 | ||||
| 33 | G | 32.1 | Very low | 41.9 | Very low | 81 Ų | 81 | 137.2 Ų | 137.2 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | trans | 145.4 | 146.4 | 165.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 34 | G | 38 | Very low | 42.2 | Very low | 68 Ų | 68 | 140 Ų | 140 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | cis | 170 | 154.1 | -5.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 35 | E | 41.3 | Very low | 42.3 | Very low | 200 Ų | 200 | 141.3 Ų | 141.3 | 94% | 0.935 | 81% | 0.808 | S | S | * | * | trans | 68.4 | 145.9 | 165.5 | -63.2 | -178.8 | 153.1 | 0 | 0 | 117.6 | ||||
| 36 | D | 36.9 | Very low | 43.2 | Very low | 139 Ų | 139 | 135.8 Ų | 135.8 | 74% | 0.743 | 80% | 0.803 | S | S | * | * | cis | -162.7 | 159.3 | -16.5 | -166.2 | 16.8 | 0 | 0 | 0 | 110.8 | ||||
| 37 | R | 41.3 | Very low | 43.6 | Very low | 222 Ų | 222 | 135.2 Ų | 135.2 | 84% | 0.838 | 79% | 0.793 | S | S | * | * | trans | 127.1 | 92.5 | 162.4 | -71.7 | -177.5 | 169.3 | -175.2 | -2.6 | 119 | ||||
| 38 | R | 43.6 | Very low | 44.1 | Very low | 224 Ų | 224 | 137.3 Ų | 137.3 | 85% | 0.845 | 80% | 0.796 | S | S | * | * | 42.6 | 114 | 124.8 | -56.2 | 175.5 | -170 | -166.1 | 0.4 | 119.5 | |||||
| 39 | T | 41.8 | Very low | 44.5 | Very low | 143 Ų | 143 | 137 Ų | 137 | 88% | 0.877 | 80% | 0.795 | S | S | * | * | -169.5 | 152.1 | 116.8 | -72.9 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 40 | A | 42.4 | Very low | 44.7 | Very low | 96 Ų | 96 | 137.2 Ų | 137.2 | 79% | 0.793 | 80% | 0.797 | S | S | * | * | trans | -19.7 | 144.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 41 | A | 50.6 | Low | 44.6 | Very low | 91 Ų | 91 | 134.6 Ų | 134.6 | 75% | 0.752 | 79% | 0.789 | S | S | * | * | trans | -76.8 | 126.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 42 | I | 50.1 | Low | 44.6 | Very low | 154 Ų | 154 | 141.9 Ų | 141.9 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -134.5 | 105.3 | 145 | -55.8 | 179.3 | 0 | 0 | 0 | 106.8 | F44 | I42-F44 VanDerWaalsContact C-N 3.32Å; I42-F44 PolarHBondContact O-N 3.36Å | ||
| 43 | T | 45.4 | Very low | 43.4 | Very low | 136 Ų | 136 | 140.4 Ų | 140.4 | 83% | 0.834 | 79% | 0.791 | S | S | * | * | trans | -80.6 | 72.5 | -171 | -44 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 44 | F | 47.8 | Very low | 44 | Very low | 189 Ų | 189 | 142.2 Ų | 142.2 | 83% | 0.829 | 79% | 0.786 | S | S | * | * | trans | -90.5 | 107.4 | 160.9 | -124.6 | -88.2 | 0 | 0 | 0 | 108.8 | I42 P46 | I42-F44 VanDerWaalsContact C-N 3.32Å; I42-F44 PolarHBondContact O-N 3.36Å; F44-P46 WeakPolarHBondContact O-CD 3.4Å | ||
| 45 | R | 48.3 | Very low | 44 | Very low | 217 Ų | 217 | 145.8 Ų | 145.8 | 82% | 0.819 | 79% | 0.789 | S | S | * | * | trans | -75.4 | 114 | -179.5 | 179.6 | -175.8 | -179.6 | -172.6 | 0.4 | 110.2 | ||||
| 46 | P | 59.6 | Low | 44.3 | Very low | 124 Ų | 124 | 143.5 Ų | 143.5 | 81% | 0.805 | 78% | 0.783 | S | S | * | * | trans | -98.9 | 113.5 | 173.7 | 32 | -17.9 | 0 | 0 | 0 | 109.6 | F44 | F44-P46 WeakPolarHBondContact O-CD 3.4Š| ||
| 47 | S | 42.8 | Very low | 44.4 | Very low | 83 Ų | 83 | 141.3 Ų | 141.3 | 58% | 0.58 | 78% | 0.784 | S | S | * | * | trans | -168.6 | 131.7 | 175.1 | -179.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 48 | L | 46.8 | Very low | 44.5 | Very low | 150 Ų | 150 | 134.7 Ų | 134.7 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | cis | -153.1 | 162.8 | -9.9 | -110.1 | 172.2 | 0 | 0 | 0 | 107.9 | ||||
| 49 | S | 46.2 | Very low | 44.5 | Very low | 111 Ų | 111 | 135 Ų | 135 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | trans | -79.5 | 144 | 164.6 | 42.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 50 | G | 41 | Very low | 44.7 | Very low | 67 Ų | 67 | 137 Ų | 137 | 69% | 0.691 | 78% | 0.779 | S | S | * | * | trans | 75.6 | 153.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 51 | V | 38.6 | Very low | 44.8 | Very low | 124 Ų | 124 | 137.3 Ų | 137.3 | 75% | 0.752 | 78% | 0.776 | S | S | * | * | cis | -142.8 | 153.8 | 2.2 | -74.9 | 0 | 0 | 0 | 0 | 109.7 | S53 | V51-S53 PolarHBondContact O-N 3.47Š| ||
| 52 | Y | 38.8 | Very low | 44.4 | Very low | 218 Ų | 218 | 140 Ų | 140 | 86% | 0.855 | 78% | 0.777 | S | S | * | * | trans | -65 | 127.9 | 159.7 | 45 | -86.5 | 0 | 0 | 0 | 108.3 | ||||
| 53 | S | 37.3 | Very low | 44.2 | Very low | 112 Ų | 112 | 140.5 Ų | 140.5 | 78% | 0.783 | 78% | 0.781 | S | S | * | * | trans | -146.9 | 149.5 | 164.6 | -162.3 | 0 | 0 | 0 | 0 | 109.6 | V51 | V51-S53 PolarHBondContact O-N 3.47Š| ||
| 54 | V | 44.5 | Very low | 44.4 | Very low | 119 Ų | 119 | 139.6 Ų | 139.6 | 72% | 0.721 | 78% | 0.777 | S | S | * | * | trans | -118.8 | 162.1 | -154.7 | -170.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 55 | N | 37.8 | Very low | 44.2 | Very low | 143 Ų | 143 | 136.5 Ų | 136.5 | 77% | 0.765 | 77% | 0.774 | S | S | * | * | trans | 88 | 93 | 170.6 | -66 | -26.9 | 0 | 0 | 0 | 119.2 | ||||
| 56 | N | 47.9 | Very low | 43.7 | Very low | 152 Ų | 152 | 136.3 Ų | 136.3 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | 36.3 | 106 | 99.3 | -168.5 | 25.6 | 0 | 0 | 0 | 118.6 | |||||
| 57 | A | 39.8 | Very low | 42.7 | Very low | 92 Ų | 92 | 136.4 Ų | 136.4 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | trans | -157.6 | 146.9 | 145.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 58 | A | 42.4 | Very low | 42.8 | Very low | 84 Ų | 84 | 136.9 Ų | 136.9 | 69% | 0.694 | 78% | 0.781 | S | S | * | * | trans | 60.6 | 113.8 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 59 | Y | 43.9 | Very low | 42.3 | Very low | 230 Ų | 230 | 133 Ų | 133 | 90% | 0.902 | 78% | 0.777 | S | S | * | * | cis | -120.5 | 139.7 | 32 | -88.7 | -103.4 | 0 | 0 | 0 | 114.7 | ||||
| 60 | Q | 46.9 | Very low | 42.3 | Very low | 184 Ų | 184 | 137.8 Ų | 137.8 | 86% | 0.86 | 78% | 0.78 | S | S | * | * | trans | -66.2 | 138 | 151 | -62.9 | 161.8 | 4.5 | 0 | 0 | 108.4 | ||||
| 61 | S | 43.5 | Very low | 42.2 | Very low | 103 Ų | 103 | 138.2 Ų | 138.2 | 72% | 0.72 | 78% | 0.783 | S | S | * | * | trans | 159.2 | 142.8 | 135.1 | -166.8 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 62 | L | 42.9 | Very low | 42.5 | Very low | 149 Ų | 149 | 141 Ų | 141 | 78% | 0.78 | 79% | 0.793 | S | S | * | * | trans | 64.6 | 78.9 | 162.6 | -66.4 | 154.3 | 0 | 0 | 0 | 118.5 | P64 | L62-P64 WeakPolarHBondContact O-CD 3.33Š| ||
| 63 | N | 45.8 | Very low | 42.2 | Very low | 163 Ų | 163 | 133.8 Ų | 133.8 | 87% | 0.872 | 79% | 0.785 | S | S | * | * | trans | -91 | 109.3 | 139.2 | -75.9 | -40.4 | 0 | 0 | 0 | 108.6 | ||||
| 64 | P | 49.2 | Very low | 42.3 | Very low | 117 Ų | 117 | 140.1 Ų | 140.1 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | trans | -75 | 122.8 | 159.8 | 29.5 | -29.7 | 0 | 0 | 0 | 109.3 | L62 | L62-P64 WeakPolarHBondContact O-CD 3.33Š| ||
| 65 | V | 43.4 | Very low | 42 | Very low | 125 Ų | 125 | 142 Ų | 142 | 76% | 0.758 | 80% | 0.798 | S | S | * | * | trans | -62.7 | 147.9 | 175.7 | 170.1 | 0 | 0 | 0 | 0 | 110.6 | T67 | V65-T67 PolarHBondContact O-N 2.7Š| ||
| 66 | F | 39.6 | Very low | 42.2 | Very low | 212 Ų | 212 | 142.9 Ų | 142.9 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | trans | -60.5 | 99.7 | 167.6 | -105 | -98.6 | 0 | 0 | 0 | 110.4 | ||||
| 67 | T | 37.9 | Very low | 41.6 | Very low | 127 Ų | 127 | 143.3 Ų | 143.3 | 78% | 0.779 | 80% | 0.798 | S | S | * | * | trans | -90.5 | 105.5 | 164.9 | -59.4 | 0 | 0 | 0 | 0 | 108.8 | V65 G69 | V65-T67 PolarHBondContact O-N 2.7Å; T67-G69 PolarHBondContact O-N 2.87Å | ||
| 68 | S | 43.9 | Very low | 41.7 | Very low | 93 Ų | 93 | 143.5 Ų | 143.5 | 65% | 0.65 | 79% | 0.79 | S | S | * | * | trans | -70 | 117.8 | 165.5 | -171.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 69 | G | 36.4 | Very low | 41.5 | Very low | 67 Ų | 67 | 148.7 Ų | 148.7 | 69% | 0.691 | 80% | 0.8 | S | S | * | * | trans | -127.2 | 97 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111 | T67 | T67-G69 PolarHBondContact O-N 2.87Š| ||
| 70 | Y | 46.4 | Very low | 41.1 | Very low | 213 Ų | 213 | 144.1 Ų | 144.1 | 84% | 0.835 | 79% | 0.791 | S | S | * | * | trans | -70.6 | 121.3 | 168.7 | 15.8 | -93.4 | 0 | 0 | 0 | 109.2 | ||||
| 71 | G | 39 | Very low | 40.3 | Very low | 75 Ų | 75 | 140.8 Ų | 140.8 | 77% | 0.773 | 79% | 0.787 | S | S | * | * | trans | -137.4 | 123.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 72 | L | 45.2 | Very low | 39.9 | Very low | 182 Ų | 182 | 141.3 Ų | 141.3 | 95% | 0.953 | 79% | 0.79 | S | S | * | * | trans | -80.3 | 138 | -172.1 | -74.8 | 152.5 | 0 | 0 | 0 | 113.1 | ||||
| 73 | G | 32.1 | Very low | 40 | Very low | 67 Ų | 67 | 139.8 Ų | 139.8 | 69% | 0.691 | 79% | 0.792 | S | S | * | * | trans | 73.3 | 119.7 | 130.1 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 74 | R | 40.1 | Very low | 40.3 | Very low | 246 Ų | 246 | 138 Ų | 138 | 93% | 0.928 | 79% | 0.789 | S | S | * | * | -168.4 | 117.7 | 122.1 | -113.3 | 172.3 | 161 | 174.3 | -6.7 | 112.6 | |||||
| 75 | D | 38.8 | Very low | 40 | Very low | 157 Ų | 157 | 140.2 Ų | 140.2 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | -79.7 | 134 | 170.8 | -47.2 | -90.7 | 0 | 0 | 0 | 110.9 | ||||
| 76 | I | 40.3 | Very low | 39.8 | Very low | 162 Ų | 162 | 139.7 Ų | 139.7 | 83% | 0.831 | 79% | 0.787 | S | S | * | * | trans | -135.8 | 98.6 | 156.8 | -61.9 | -174.6 | 0 | 0 | 0 | 109.5 | ||||
| 77 | H | 36.5 | Very low | 39.9 | Very low | 162 Ų | 162 | 137.8 Ų | 137.8 | 75% | 0.75 | 78% | 0.781 | S | S | * | * | trans | 22.4 | 112.7 | 143.7 | -135.6 | 75.5 | 0 | 0 | 0 | 120.7 | ||||
| 78 | T | 40.6 | Very low | 39.8 | Very low | 96 Ų | 96 | 135.6 Ų | 135.6 | 59% | 0.589 | 78% | 0.784 | S | S | * | * | trans | 3.7 | 132.8 | 133.4 | -32.3 | 0 | 0 | 0 | 0 | 119 | ||||
| 79 | Q | 39.1 | Very low | 39.8 | Very low | 193 Ų | 193 | 139.3 Ų | 139.3 | 90% | 0.902 | 80% | 0.795 | S | S | * | * | trans | -151.3 | 113.3 | 145.8 | -129.3 | 153.6 | 84.7 | 0 | 0 | 111.1 | ||||
| 80 | D | 34.7 | Very low | 39.9 | Very low | 134 Ų | 134 | 142.3 Ų | 142.3 | 72% | 0.717 | 80% | 0.796 | S | S | * | * | trans | -71.9 | 156.5 | 166.8 | -78.4 | -64.2 | 0 | 0 | 0 | 111.1 | ||||
| 81 | C | 30.5 | Very low | 39.5 | Very low | 114 Ų | 114 | 140.9 Ų | 140.9 | 77% | 0.77 | 80% | 0.797 | S | S | * | * | 161.8 | 118.7 | 114.5 | -89.1 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 82 | S | 36.3 | Very low | 39.4 | Very low | 113 Ų | 113 | 140.5 Ų | 140.5 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | 41.1 | 125.2 | 126.1 | -50.9 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 83 | S | 44.5 | Very low | 39.3 | Very low | 118 Ų | 118 | 143.1 Ų | 143.1 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | trans | -54.5 | 160.1 | 159.5 | -45.1 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 84 | P | 51.3 | Low | 39.8 | Very low | 126 Ų | 126 | 147.8 Ų | 147.8 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -114.1 | 147.3 | 136.3 | -0 | 20.4 | 0 | 0 | 0 | 113.1 | ||||
| 85 | L | 43.9 | Very low | 40 | Very low | 162 Ų | 162 | 140.8 Ų | 140.8 | 85% | 0.848 | 78% | 0.782 | S | S | * | * | trans | -59.2 | 146.7 | 163.3 | -178.4 | 69.1 | 0 | 0 | 0 | 111.2 | ||||
| 86 | D | 38.1 | Very low | 40 | Very low | 115 Ų | 115 | 138.8 Ų | 138.8 | 62% | 0.615 | 78% | 0.781 | S | S | * | * | 180 | 143.7 | 116.9 | -157.8 | 37 | 0 | 0 | 0 | 116 | |||||
| 87 | Q | 41.8 | Very low | 39.8 | Very low | 171 Ų | 171 | 138.7 Ų | 138.7 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | trans | 35.3 | 133 | 157.2 | -77.3 | 161 | 61.1 | 0 | 0 | 124.3 | ||||
| 88 | G | 35.8 | Very low | 39.8 | Very low | 82 Ų | 82 | 135.4 Ų | 135.4 | 85% | 0.845 | 77% | 0.772 | S | S | * | * | trans | 165.7 | 103.9 | 159.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 89 | L | 45 | Very low | 39.7 | Very low | 170 Ų | 170 | 135.3 Ų | 135.3 | 89% | 0.89 | 78% | 0.775 | S | S | * | * | trans | -85 | 155.7 | 174.7 | -103.2 | 132 | 0 | 0 | 0 | 112.2 | ||||
| 90 | D | 37.4 | Very low | 39.7 | Very low | 131 Ų | 131 | 131.6 Ų | 131.6 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | trans | 91.8 | 142.1 | 149.2 | -110 | -41.8 | 0 | 0 | 0 | 122.8 | ||||
| 91 | Q | 38.8 | Very low | 40.4 | Very low | 183 Ų | 183 | 133.3 Ų | 133.3 | 86% | 0.855 | 77% | 0.772 | S | S | * | * | trans | 68 | 135.1 | 161.7 | -62.8 | 173 | 44.5 | 0 | 0 | 121.4 | ||||
| 92 | G | 36.8 | Very low | 41.2 | Very low | 67 Ų | 67 | 133.9 Ų | 133.9 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | trans | 117.8 | 68.9 | 150.8 | 0 | 0 | 0 | 0 | 0 | 117.7 | L94 | G92-L94 VanDerWaalsContact C-N 3.28Å; G92-L94 PolarHBondContact O-N 3.26Å | ||
| 93 | R | 43.7 | Very low | 41.4 | Very low | 237 Ų | 237 | 131.9 Ų | 131.9 | 89% | 0.894 | 77% | 0.772 | S | S | * | * | trans | -70 | 79.7 | 165.4 | -174.3 | -172.8 | -173.2 | -109 | 6 | 110.6 | ||||
| 94 | L | 42.9 | Very low | 42 | Very low | 165 Ų | 165 | 132.8 Ų | 132.8 | 86% | 0.864 | 78% | 0.775 | S | S | * | * | trans | -85.7 | 126.6 | 171.3 | -72.9 | 178.9 | 0 | 0 | 0 | 111.5 | G92 S96 | G92-L94 VanDerWaalsContact C-N 3.28Å; G92-L94 PolarHBondContact O-N 3.26Å; L94-S96 PolarHBondContact O-N 3.26Å | ||
| 95 | V | 44 | Very low | 41.8 | Very low | 98 Ų | 98 | 130.2 Ų | 130.2 | 59% | 0.594 | 77% | 0.771 | S | S | * | * | trans | -71.3 | 112.7 | 174.6 | 174.4 | 0 | 0 | 0 | 0 | 108.6 | E97 | V95-E97 VanDerWaalsContact C-N 3.29Å; V95-E97 HydrophobicContact CG1-CB 4.18Å; V95-E97 HydrophobicContact CG1-CG 3.82Å; V95-E97 WeakPolarHBondContact CG1-OE2 3.3Å; V95-E97 PolarHBondContact O-N 3.37Å | ||
| 96 | S | 38.2 | Very low | 42.1 | Very low | 116 Ų | 116 | 128.7 Ų | 128.7 | 81% | 0.811 | 77% | 0.77 | S | S | * | * | trans | -89.2 | 67.2 | 171.7 | -163.3 | 0 | 0 | 0 | 0 | 110.7 | L94 S98 | L94-S96 PolarHBondContact O-N 3.26Å; S96-S98 VanDerWaalsContact C-N 3.34Å; S96-S98 PolarHBondContact O-N 3.09Å | ||
| 97 | E | 36.6 | Very low | 43.1 | Very low | 159 Ų | 159 | 130.7 Ų | 130.7 | 74% | 0.743 | 78% | 0.78 | S | S | * | * | trans | -81.8 | 86.9 | 159.2 | -81.3 | 179.2 | 106.5 | 0 | 0 | 107.9 | V95 C99 | V95-E97 VanDerWaalsContact C-N 3.29Å; V95-E97 HydrophobicContact CG1-CB 4.18Å; V95-E97 HydrophobicContact CG1-CG 3.82Å; V95-E97 WeakPolarHBondContact CG1-OE2 3.3Å; V95-E97 PolarHBondContact O-N 3.37Å; E97-C99 PolarHBondContact O-N 2.9Å | ||
| 98 | S | 36.1 | Very low | 43.8 | Very low | 94 Ų | 94 | 130.2 Ų | 130.2 | 66% | 0.657 | 78% | 0.782 | S | S | * | * | trans | -77.5 | 90.3 | 176.2 | -165.9 | 0 | 0 | 0 | 0 | 110.3 | S96 C100 | S96-S98 VanDerWaalsContact C-N 3.34Å; S96-S98 PolarHBondContact O-N 3.09Å; S98-C100 VanDerWaalsContact C-N 3.32Å; S98-C100 PolarHBondContact O-N 3.29Å | ||
| 99 | C | 38.9 | Very low | 44.1 | Very low | 94 Ų | 94 | 131.8 Ų | 131.8 | 64% | 0.635 | 78% | 0.78 | S | S | * | * | trans | -71.7 | 79.1 | 175.9 | -56.6 | 0 | 0 | 0 | 0 | 111.2 | E97 H101 | E97-C99 PolarHBondContact O-N 2.9Å; C99-H101 PolarHBondContact O-CD2 3.28Å; C99-H101 VanDerWaalsContact O-CD2 3.28Å; C99-H101 PolarHBondContact O-N 3Å | ||
| 100 | C | 39.2 | Very low | 45 | Very low | 115 Ų | 115 | 129.3 Ų | 129.3 | 78% | 0.777 | 77% | 0.774 | S | S | * | * | trans | -69.8 | 95 | 174.4 | -72.2 | 0 | 0 | 0 | 0 | 111.4 | S98 | S98-C100 VanDerWaalsContact C-N 3.32Å; S98-C100 PolarHBondContact O-N 3.29Å | ||
| 101 | H | 47.7 | Very low | 46 | Very low | 169 Ų | 169 | 129 Ų | 129 | 78% | 0.782 | 78% | 0.779 | S | S | * | * | trans | -61.4 | 139.8 | 172.7 | -66.7 | -92.7 | 0 | 0 | 0 | 112.2 | C99 G103 | C99-H101 PolarHBondContact O-CD2 3.28Å; C99-H101 VanDerWaalsContact O-CD2 3.28Å; C99-H101 PolarHBondContact O-N 3Å; H101-G103 PolarHBondContact O-N 2.95Å | ||
| 102 | P | 48.3 | Very low | 46.4 | Very low | 126 Ų | 126 | 127.4 Ų | 127.4 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -82.3 | 108.1 | 165.3 | 31.7 | -30.1 | 0 | 0 | 0 | 110.5 | ||||
| 103 | G | 39.8 | Very low | 47.2 | Very low | 72 Ų | 72 | 133.2 Ų | 133.2 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | trans | -79.9 | 140.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | H101 | H101-G103 PolarHBondContact O-N 2.95Š| ||
| 104 | P | 58.7 | Low | 47.9 | Very low | 137 Ų | 137 | 130.1 Ų | 130.1 | 89% | 0.89 | 78% | 0.778 | S | S | * | * | trans | -96.7 | 130.9 | 179.8 | 34.2 | -31.7 | 0 | 0 | 0 | 114.3 | ||||
| 105 | G | 45.5 | Very low | 48.8 | Very low | 71 Ų | 71 | 131.7 Ų | 131.7 | 73% | 0.732 | 77% | 0.774 | S | S | * | * | trans | 120.6 | 167.1 | 160 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 106 | P | 51 | Low | 50.1 | Low | 130 Ų | 130 | 137.7 Ų | 137.7 | 84% | 0.844 | 79% | 0.786 | S | S | * | * | cis | -118.9 | -176.3 | -6.6 | 38.4 | -23.3 | 0 | 0 | 0 | 113.8 | ||||
| 107 | L | 60 | Low | 51.9 | Low | 157 Ų | 157 | 136.5 Ų | 136.5 | 82% | 0.822 | 77% | 0.769 | S | S | * | * | trans | -87.4 | 159.8 | -175.5 | -81.4 | -85.1 | 0 | 0 | 0 | 113 | ||||
| 108 | I | 54.8 | Low | 54.1 | Low | 161 Ų | 161 | 135.7 Ų | 135.7 | 83% | 0.826 | 76% | 0.76 | S | S | * | * | trans | 121.2 | 103.8 | 153.8 | -61.6 | 158.3 | 0 | 0 | 0 | 114.8 | ||||
| 109 | S | 42.3 | Very low | 56.3 | Low | 115 Ų | 115 | 136.5 Ų | 136.5 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | 176.6 | 124.4 | 126.5 | 39.3 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 110 | P | 63.8 | Low | 58.4 | Low | 118 Ų | 118 | 141.7 Ų | 141.7 | 77% | 0.766 | 77% | 0.77 | S | S | * | * | trans | -117.9 | 168.1 | 153.1 | 38.4 | -29.1 | 0 | 0 | 0 | 110.7 | ||||
| 111 | P | 58.1 | Low | 60.5 | Low | 125 Ų | 125 | 140 Ų | 140 | 81% | 0.812 | 75% | 0.751 | S | S | * | * | cis | -121.8 | 139.7 | -8.2 | 36.1 | -21 | 0 | 0 | 0 | 112.6 | ||||
| 112 | D | 48.8 | Very low | 62 | Low | 150 Ų | 150 | 140.1 Ų | 140.1 | 80% | 0.802 | 75% | 0.745 | S | S | * | * | trans | -130.3 | 148.1 | 150 | -159.2 | -4.9 | 0 | 0 | 0 | 109.6 | Q114 | D112-Q114 PolarHBondContact O-N 3.34Š| ||
| 113 | K | 53.8 | Low | 63.1 | Low | 188 Ų | 188 | 138.8 Ų | 138.8 | 82% | 0.817 | 74% | 0.744 | S | S | * | * | trans | -78.3 | 44.2 | -175.1 | -61.7 | 177.2 | -175.5 | 173.5 | 0 | 110.9 | Y115 | K113-Y115 VanDerWaalsContact C-N 3.28Å; K113-Y115 WeakPolarHBondContact O-CD2 3.42Å; K113-Y115 PolarHBondContact O-N 3.33Å | ||
| 114 | Q | 57.8 | Low | 64.6 | Low | 173 Ų | 173 | 138.2 Ų | 138.2 | 81% | 0.808 | 73% | 0.729 | S | S | * | * | trans | -68 | 91 | 174.1 | -164.5 | 171.3 | 26.4 | 0 | 0 | 107.9 | D112 R116 | D112-Q114 PolarHBondContact O-N 3.34Å; Q114-R116 PolarHBondContact O-N 2.94Å | ||
| 115 | Y | 61 | Low | 65 | Low | 197 Ų | 197 | 133.5 Ų | 133.5 | 77% | 0.773 | 71% | 0.705 | S | S | * | * | trans | -44.2 | 106.5 | 174.5 | -84.5 | -99.9 | 0 | 0 | 0 | 108.5 | K113 M117 | K113-Y115 VanDerWaalsContact C-N 3.28Å; K113-Y115 WeakPolarHBondContact O-CD2 3.42Å; K113-Y115 PolarHBondContact O-N 3.33Å; Y115-M117 PolarHBondContact O-N 3.3Å | ||
| 116 | R | 71 | Confident | 65.9 | Low | 224 Ų | 224 | 136.8 Ų | 136.8 | 85% | 0.845 | 71% | 0.713 | S | S | * | * | trans | -66 | 88.6 | 171 | -85.6 | -160.9 | 174.5 | -146.1 | 1.7 | 106.9 | Q114 Y118 | Q114-R116 PolarHBondContact O-N 2.94Å; R116-Y118 VanDerWaalsContact C-N 3.25Å; R116-Y118 WeakPolarHBondContact O-CD2 3.35Å; R116-Y118 WeakPolarHBondContact O-CE2 3.15Å; R116-Y118 PolarHBondContact O-N 3.12Å | ||
| 117 | M | 77.3 | Confident | 66.2 | Low | 92 Ų | 92 | 138.1 Ų | 138.1 | 45% | 0.453 | 71% | 0.713 | S | S | . | * | trans | -65 | 93.6 | 171.7 | -74 | -65.5 | 176.4 | 0 | 0 | 107.6 | Y115 M121 R122 | Y115-M117 PolarHBondContact O-N 3.3Å; M117-M121 HydrophobicContact SD-CB 4.1Å; M117-M121 HydrophobicContact SD-CE 4.5Å; M117-R122 HydrophobicContact CB-CG 4.4Å; M117-R122 PolarHBondContact O-NE 2.96Å | ||
| 118 | Y | 83 | Confident | 66.4 | Low | 141 Ų | 141 | 139.2 Ų | 139.2 | 55% | 0.553 | 71% | 0.707 | S | S | * | * | trans | -49.6 | 146.7 | 176.4 | -66.6 | -105.7 | 0 | 0 | 0 | 108.7 | R116 W120 M121 R122 | R116-Y118 VanDerWaalsContact C-N 3.25Å; R116-Y118 WeakPolarHBondContact O-CD2 3.35Å; R116-Y118 WeakPolarHBondContact O-CE2 3.15Å; R116-Y118 PolarHBondContact O-N 3.12Å; Y118-W120 VanDerWaalsContact CB-NE1 3.31Å; Y118-W120 AromaticContact CG-NE1 3.83Å; Y118-W120 PolarHBondContact O-N 3.26Å; Y118-M121 HydrophobicContact CD2-CE 3.41Å; Y118-M121 VanDerWaalsContact CD2-CE 3.41Å; Y118-M121 HydrophobicContact CE2-CE 4.12Å; Y118-M121 HydrophobicContact CG-CE 4.28Å; Y118-M121 WeakPolarHBondContact O-CA 3.39Å; Y118-M121 PolarHBondContact O-N 2.99Å; Y118-R122 PolarHBondContact O-N 3.33Å | ||
| 119 | P | 81.6 | Confident | 66.8 | Low | 112 Ų | 112 | 140.7 Ų | 140.7 | 73% | 0.727 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.4 | -30.7 | -172.4 | -30.4 | 36.6 | 0 | 0 | 0 | 115 | ||
| 120 | W | 83.1 | Confident | 68.3 | Low | 202 Ų | 202 | 146.6 Ų | 146.6 | 77% | 0.765 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.7 | -25.2 | 175.8 | 63 | -95.1 | 0 | 0 | 0 | 114.7 | Y118 | Y118-W120 VanDerWaalsContact CB-NE1 3.31Å; Y118-W120 AromaticContact CG-NE1 3.83Å; Y118-W120 PolarHBondContact O-N 3.26Å |
| 121 | M | 82.7 | Confident | 69.1 | Low | 79 Ų | 79 | 144.6 Ų | 144.6 | 39% | 0.389 | 71% | 0.712 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84.5 | -10.2 | 174.2 | -76.5 | -156.6 | -75.4 | 0 | 0 | 113.6 | M117 Y118 A123 | M117-M121 HydrophobicContact SD-CB 4.1Å; M117-M121 HydrophobicContact SD-CE 4.5Å; Y118-M121 HydrophobicContact CD2-CE 3.41Å; Y118-M121 VanDerWaalsContact CD2-CE 3.41Å; Y118-M121 HydrophobicContact CE2-CE 4.12Å; Y118-M121 HydrophobicContact CG-CE 4.28Å; Y118-M121 WeakPolarHBondContact O-CA 3.39Å; Y118-M121 PolarHBondContact O-N 2.99Å; M121-A123 PolarHBondContact O-N 2.83Å |
| 122 | R | 80.7 | Confident | 70.5 | Confident | 173 Ų | 173 | 148.7 Ų | 148.7 | 65% | 0.653 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -63.3 | 106.4 | 178.6 | -67.6 | -174 | 177.5 | -150.4 | -1.7 | 109 | M117 Y118 S124 | M117-R122 HydrophobicContact CB-CG 4.4Å; M117-R122 PolarHBondContact O-NE 2.96Å; Y118-R122 PolarHBondContact O-N 3.33Å; R122-S124 VanDerWaalsContact C-N 3.33Å; R122-S124 PolarHBondContact O-N 3.19Å |
| 123 | A | 71.3 | Confident | 72.6 | Confident | 98 Ų | 98 | 148.4 Ų | 148.4 | 81% | 0.81 | 71% | 0.705 | S | S | * | * | trans | -53.6 | 101.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | M121 G125 | M121-A123 PolarHBondContact O-N 2.83Å; A123-G125 PolarHBondContact O-N 2.71Å | ||
| 124 | S | 70.7 | Confident | 74.6 | Confident | 60 Ų | 60 | 145 Ų | 145 | 42% | 0.42 | 70% | 0.701 | S | S | . | * | trans | -56 | 114.6 | 175.9 | -76 | 0 | 0 | 0 | 0 | 106.9 | R122 R128 | R122-S124 VanDerWaalsContact C-N 3.33Å; R122-S124 PolarHBondContact O-N 3.19Å; S124-R128 PolarHBondContact OG-NH1 3.11Å | ||
| 125 | G | 66.8 | Low | 76.5 | Confident | 37 Ų | 37 | 139.7 Ų | 139.7 | 38% | 0.381 | 67% | 0.674 | S | S | . | * | trans | -50.5 | 161.1 | -161.6 | 0 | 0 | 0 | 0 | 0 | 114 | A123 N127 R128 | A123-G125 PolarHBondContact O-N 2.71Å; G125-N127 PolarHBondContact O-N 3.03Å; G125-R128 PolarHBondContact O-N 3.37Å | ||
| 126 | P | 64 | Low | 78.3 | Confident | 140 Ų | 140 | 133.5 Ų | 133.5 | 91% | 0.909 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -48.2 | -26.2 | -157.5 | 12 | -28.3 | 0 | 0 | 0 | 116.7 | ||
| 127 | N | 58 | Low | 79.6 | Confident | 158 Ų | 158 | 132.2 Ų | 132.2 | 85% | 0.845 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | -77.3 | -6.8 | 175.6 | -155 | -5.9 | 0 | 0 | 0 | 115.7 | G125 | G125-N127 PolarHBondContact O-N 3.03Š|
| 128 | R | 63.4 | Low | 80.6 | Confident | 181 Ų | 181 | 133.1 Ų | 133.1 | 68% | 0.683 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -94.3 | -7.1 | -174.2 | -64.3 | -163.8 | 71.3 | -146 | 14.5 | 115.2 | S124 G125 R130 | S124-R128 PolarHBondContact OG-NH1 3.11Å; G125-R128 PolarHBondContact O-N 3.37Å; R128-R130 PolarHBondContact O-N 3.46Å |
| 129 | K | 64.3 | Low | 81.4 | Confident | 192 Ų | 192 | 128 Ų | 128 | 84% | 0.835 | 64% | 0.638 | S | S | * | * | trans | -76.9 | 71.5 | 171.1 | -74.6 | 177.3 | 177.8 | 174.4 | 0 | 110.6 | G131 | K129-G131 PolarHBondContact O-N 2.99Š| ||
| 130 | R | 73.4 | Confident | 82.2 | Confident | 239 Ų | 239 | 124.7 Ų | 124.7 | 90% | 0.902 | 62% | 0.616 | S | S | * | * | trans | -60.7 | 108.6 | 167.2 | -76.1 | -174.5 | 174.9 | -170.1 | -2.4 | 108.5 | R128 R132 | R128-R130 PolarHBondContact O-N 3.46Å; R130-R132 PolarHBondContact O-N 3.17Å | ||
| 131 | G | 79.7 | Confident | 82.9 | Confident | 75 Ų | 75 | 118.6 Ų | 118.6 | 77% | 0.773 | 60% | 0.598 | S | S | * | * | trans | -53.9 | 133.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111 | K129 Q133 | K129-G131 PolarHBondContact O-N 2.99Å; G131-Q133 PolarHBondContact O-N 3.14Å | ||
| 132 | R | 88.5 | Confident | 83.7 | Confident | 212 Ų | 212 | 117.5 Ų | 117.5 | 80% | 0.8 | 59% | 0.592 | S | S | * | * | trans | -80.6 | 102.5 | -178.3 | -162.3 | -175.8 | -162.9 | -73.5 | 6.9 | 108.9 | R130 T134 | R130-R132 PolarHBondContact O-N 3.17Å; R132-T134 PolarHBondContact O-N 2.81Å | ||
| 133 | Q | 93 | Very high | 84.5 | Confident | 144 Ų | 144 | 109.3 Ų | 109.3 | 67% | 0.673 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 133.5 | 173.5 | -167.7 | 176.1 | 16.8 | 0 | 0 | 110.3 | G131 | G131-Q133 PolarHBondContact O-N 3.14Š|
| 134 | T | 95.8 | Very high | 85.8 | Confident | 117 Ų | 117 | 107.9 Ų | 107.9 | 72% | 0.718 | 54% | 0.538 | S | S | * | . | P | Polyproline II helix | trans | -88.7 | 150.9 | 169.8 | 48.6 | 0 | 0 | 0 | 0 | 109.8 | R132 | R132-T134 PolarHBondContact O-N 2.81Š|
| 135 | Y | 98 | Very high | 87.1 | Confident | 61 Ų | 61 | 110.6 Ų | 110.6 | 24% | 0.239 | 54% | 0.542 | C | S | . | . | P | Polyproline II helix | trans | -87.1 | 147.9 | 173 | -60.1 | -18.9 | 0 | 0 | 0 | 109.8 | L143 L167 Q171 W175 | Y135-L143 HydrophobicContact CD2-CD1 3.93Å; Y135-L143 HydrophobicContact CE2-CD1 4.15Å; Y135-L167 HydrophobicContact CD1-CD2 4.15Å; Y135-L167 HydrophobicContact CD2-CD1 4.47Å; Y135-L167 HydrophobicContact CE1-CD2 3.97Å; Y135-L167 HydrophobicContact CE2-CD1 4.35Å; Y135-Q171 WeakPolarHBondContact OH-CB 3.42Å; Y135-W175 AromaticContact CD2-CD1 3.86Å; Y135-W175 HydrophobicContact CE2-CB 4.22Å; Y135-W175 AromaticContact CE2-CD1 3.56Å; Y135-W175 HydrophobicContact CE2-CG 4.15Å |
| 136 | S | 98.5 | Very high | 88.6 | Confident | 66 Ų | 66 | 109.6 Ų | 109.6 | 46% | 0.462 | 53% | 0.527 | S | S | . | . | P | Polyproline II helix | trans | -61.8 | 157.6 | 173.5 | 174.9 | 0 | 0 | 0 | 0 | 111.2 | H138 Q139 T140 | S136-H138 VanDerWaalsContact C-N 3.26Å; S136-H138 PolarHBondContact O-N 3.06Å; S136-H138 PolarHBondContact OG-N 3.35Å; S136-Q139 PolarHBondContact O-N 3.1Å; S136-T140 PolarHBondContact O-N 2.98Å; S136-T140 PolarHBondContact O-OG1 3.04Å |
| 137 | R | 98.4 | Very high | 90.3 | Very high | 197 Ų | 197 | 103.1 Ų | 103.1 | 74% | 0.743 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -54.9 | -43.8 | 172.4 | -173.7 | 176.5 | -176.5 | -90.5 | -2.2 | 111.2 | T140 L141 | R137-T140 PolarHBondContact O-N 3.44Å; R137-L141 HydrophobicContact CG-CD1 4.07Å; R137-L141 WeakPolarHBondContact O-CG 3.41Å; R137-L141 PolarHBondContact O-N 3.4Å |
| 138 | H | 98.4 | Very high | 92.2 | Very high | 111 Ų | 111 | 101.4 Ų | 101.4 | 51% | 0.514 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.9 | -48.2 | 177.9 | 173.3 | 60.2 | 0 | 0 | 0 | 112.2 | S136 T140 L141 E142 | S136-H138 VanDerWaalsContact C-N 3.26Å; S136-H138 PolarHBondContact O-N 3.06Å; S136-H138 PolarHBondContact OG-N 3.35Å; H138-T140 VanDerWaalsContact C-N 3.28Å; H138-T140 PolarHBondContact O-N 3.44Å; H138-L141 PolarHBondContact O-N 3.19Å; H138-E142 PolarHBondContact O-N 3.04Å; H138-E142 VanDerWaalsContact O-N 3.09Å |
| 139 | Q | 98.6 | Very high | 93.8 | Very high | 35 Ų | 35 | 101 Ų | 101 | 16% | 0.164 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -58 | -41.1 | 176.3 | -68.9 | 174.7 | -39.9 | 0 | 0 | 111.8 | S136 L143 L165 | S136-Q139 PolarHBondContact O-N 3.1Å; Q139-L143 WeakPolarHBondContact O-CB 3.33Å; Q139-L143 WeakPolarHBondContact O-CD1 3.48Å; Q139-L143 WeakPolarHBondContact O-CG 3.46Å; Q139-L143 PolarHBondContact O-N 3.45Å; Q139-L143 VanDerWaalsContact O-N 3.12Å; Q139-L165 HydrophobicContact CG-CB 4.32Å; Q139-L165 PolarHBondContact NE2-O 2.69Å |
| 140 | T | 98.4 | Very high | 95.4 | Very high | 42 Ų | 42 | 95.1 Ų | 95.1 | 26% | 0.258 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -67.2 | -43.5 | 179.9 | -53.6 | 0 | 0 | 0 | 0 | 111.8 | S136 R137 H138 L143 E144 | S136-T140 PolarHBondContact O-N 2.98Å; S136-T140 PolarHBondContact O-OG1 3.04Å; R137-T140 PolarHBondContact O-N 3.44Å; H138-T140 VanDerWaalsContact C-N 3.28Å; H138-T140 PolarHBondContact O-N 3.44Å; T140-L143 PolarHBondContact O-N 3.09Å; T140-E144 WeakPolarHBondContact O-CG 3.48Å; T140-E144 PolarHBondContact O-N 2.9Å |
| 141 | L | 98.5 | Very high | 96.5 | Very high | 74 Ų | 74 | 88.5 Ų | 88.5 | 39% | 0.387 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.7 | -44.5 | 179 | -71.4 | 170.2 | 0 | 0 | 0 | 112.7 | R137 H138 L143 E144 K145 | R137-L141 HydrophobicContact CG-CD1 4.07Å; R137-L141 WeakPolarHBondContact O-CG 3.41Å; R137-L141 PolarHBondContact O-N 3.4Å; H138-L141 PolarHBondContact O-N 3.19Å; L141-L143 VanDerWaalsContact C-N 3.35Å; L141-E144 PolarHBondContact O-N 3.01Å; L141-K145 VanDerWaalsContact O-CB 3.3Å; L141-K145 WeakPolarHBondContact O-CB 3.45Å; L141-K145 PolarHBondContact O-N 3.4Å |
| 142 | E | 98.6 | Very high | 97.4 | Very high | 56 Ų | 56 | 92 Ų | 92 | 26% | 0.262 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -67.1 | -35.7 | 176.9 | -71.9 | -63.7 | 122.9 | 0 | 0 | 112 | H138 K145 E146 L165 | H138-E142 PolarHBondContact O-N 3.04Å; H138-E142 VanDerWaalsContact O-N 3.09Å; E142-K145 WeakPolarHBondContact OE1-CD 3.48Å; E142-K145 IonicContact OE1-NZ 2.87Å; E142-K145 PolarHBondContact OE1-NZ 2.76Å; E142-K145 IonicContact OE2-NZ 2.7Å; E142-K145 PolarHBondContact OE2-NZ 3.11Å; E142-E146 WeakPolarHBondContact O-CB 3.42Å; E142-E146 WeakPolarHBondContact O-CG 3.43Å; E142-E146 PolarHBondContact O-N 3.31Å; E142-L165 HydrophobicContact CB-CD1 4.09Å; E142-L165 HydrophobicContact CB-CD2 3.76Å; E142-L165 HydrophobicContact CG-CD2 4.08Å |
| 143 | L | 98.7 | Very high | 97.9 | Very high | 0 Ų | 0 | 83.3 Ų | 83.3 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -64 | -39.4 | 172.4 | -74.5 | 167.9 | 0 | 0 | 0 | 112.6 | Y135 Q139 T140 L141 F147 I161 L165 L167 I172 W175 F176 | Y135-L143 HydrophobicContact CD2-CD1 3.93Å; Y135-L143 HydrophobicContact CE2-CD1 4.15Å; Q139-L143 WeakPolarHBondContact O-CB 3.33Å; Q139-L143 WeakPolarHBondContact O-CD1 3.48Å; Q139-L143 WeakPolarHBondContact O-CG 3.46Å; Q139-L143 PolarHBondContact O-N 3.45Å; Q139-L143 VanDerWaalsContact O-N 3.12Å; T140-L143 PolarHBondContact O-N 3.09Å; L141-L143 VanDerWaalsContact C-N 3.35Å; L143-F147 WeakPolarHBondContact O-CB 3.4Å; L143-F147 PolarHBondContact O-N 3.1Å; L143-I161 HydrophobicContact CD2-CG2 4.28Å; L143-L165 HydrophobicContact CD2-CD1 4.09Å; L143-L165 HydrophobicContact CG-CD1 3.79Å; L143-L167 HydrophobicContact CD1-CD1 4.29Å; L143-I172 HydrophobicContact CD2-CD1 3.8Å; L143-W175 VanDerWaalsContact C-CH2 3.48Å; L143-W175 HydrophobicContact CB-CD2 3.97Å; L143-W175 HydrophobicContact CB-CE3 3.91Å; L143-W175 HydrophobicContact CB-CH2 3.68Å; L143-W175 HydrophobicContact CB-CZ2 3.72Å; L143-W175 HydrophobicContact CB-CZ3 3.77Å; L143-W175 HydrophobicContact CD1-CD2 3.9Å; L143-W175 HydrophobicContact CD1-CE3 4.49Å; L143-W175 HydrophobicContact CD1-CG 3.9Å; L143-W175 HydrophobicContact CD2-CD2 4.31Å; L143-W175 HydrophobicContact CD2-CE3 4.13Å; L143-W175 HydrophobicContact CG-CD2 4.29Å; L143-W175 HydrophobicContact CG-CE3 4.4Å; L143-W175 WeakPolarHBondContact O-CH2 3.34Å; L143-W175 WeakPolarHBondContact O-CZ3 3.42Å; L143-F176 HydrophobicContact CD2-CD2 4.49Å; L143-F176 HydrophobicContact CD2-CE2 3.97Å |
| 144 | E | 98.6 | Very high | 98.1 | Very high | 69 Ų | 69 | 80.5 Ų | 80.5 | 32% | 0.322 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -69.2 | -46.7 | 176.4 | -74.2 | -179.3 | 164.3 | 0 | 0 | 111.9 | T140 L141 E146 F147 H148 W175 | T140-E144 WeakPolarHBondContact O-CG 3.48Å; T140-E144 PolarHBondContact O-N 2.9Å; L141-E144 PolarHBondContact O-N 3.01Å; E144-E146 VanDerWaalsContact C-N 3.34Å; E144-E146 PolarHBondContact O-N 3.46Å; E144-F147 WeakPolarHBondContact O-CA 3.4Å; E144-F147 WeakPolarHBondContact O-CB 3.4Å; E144-F147 PolarHBondContact O-N 3.04Å; E144-H148 PolarHBondContact O-CD2 2.68Å; E144-H148 PolarHBondContact O-N 2.84Å; E144-W175 HydrophobicContact CG-CH2 3.83Å; E144-W175 HydrophobicContact CG-CZ2 3.85Å |
| 145 | K | 98.4 | Very high | 98.3 | Very high | 116 Ų | 116 | 81.5 Ų | 81.5 | 50% | 0.504 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -52.2 | -49 | 172.6 | 172.2 | -174 | 167.6 | -161.9 | 0 | 112.1 | L141 E142 F147 H148 F149 | L141-K145 VanDerWaalsContact O-CB 3.3Å; L141-K145 WeakPolarHBondContact O-CB 3.45Å; L141-K145 PolarHBondContact O-N 3.4Å; E142-K145 WeakPolarHBondContact OE1-CD 3.48Å; E142-K145 IonicContact OE1-NZ 2.87Å; E142-K145 PolarHBondContact OE1-NZ 2.76Å; E142-K145 IonicContact OE2-NZ 2.7Å; E142-K145 PolarHBondContact OE2-NZ 3.11Å; K145-F147 VanDerWaalsContact C-N 3.34Å; K145-F147 PolarHBondContact O-N 2.88Å; K145-H148 PolarHBondContact O-N 3.04Å; K145-F149 PolarHBondContact O-N 3.23Å |
| 146 | E | 98.4 | Very high | 98.3 | Very high | 16 Ų | 16 | 87.4 Ų | 87.4 | 8% | 0.075 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64.6 | -35.7 | 175.6 | -73.1 | -67.1 | 129.4 | 0 | 0 | 112.6 | E142 E144 F149 N150 R157 I161 F176 | E142-E146 WeakPolarHBondContact O-CB 3.42Å; E142-E146 WeakPolarHBondContact O-CG 3.43Å; E142-E146 PolarHBondContact O-N 3.31Å; E144-E146 VanDerWaalsContact C-N 3.34Å; E144-E146 PolarHBondContact O-N 3.46Å; E146-F149 PolarHBondContact O-N 3.22Å; E146-N150 PolarHBondContact O-N 3.11Å; E146-N150 VanDerWaalsContact O-O 3.12Å; E146-R157 IonicContact OE1-CZ 3.67Å; E146-R157 IonicContact OE1-NE 2.8Å; E146-R157 IonicContact OE1-NH2 2.71Å; E146-R157 PolarHBondContact OE1-NH2 3.33Å; E146-R157 IonicContact OE2-CZ 3.39Å; E146-R157 IonicContact OE2-NE 3.45Å; E146-R157 PolarHBondContact OE2-NE 2.78Å; E146-R157 IonicContact OE2-NH2 3.19Å; E146-R157 PolarHBondContact OE2-NH2 3.06Å; E146-I161 HydrophobicContact CB-CD1 4.05Å; E146-I161 HydrophobicContact CG-CD1 3.7Å; E146-I161 HydrophobicContact CG-CG1 4.06Å; E146-I161 WeakPolarHBondContact OE2-CD1 3.34Å; E146-F176 HydrophobicContact CB-CZ 4.03Å |
| 147 | F | 98.6 | Very high | 98.3 | Very high | 4 Ų | 4 | 88.7 Ų | 88.7 | 2% | 0.018 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -67.6 | -35.6 | 175.9 | -177.5 | -100.4 | 0 | 0 | 0 | 113.1 | L143 E144 K145 N150 R151 W175 F176 R179 R180 W183 | L143-F147 WeakPolarHBondContact O-CB 3.4Å; L143-F147 PolarHBondContact O-N 3.1Å; E144-F147 WeakPolarHBondContact O-CA 3.4Å; E144-F147 WeakPolarHBondContact O-CB 3.4Å; E144-F147 PolarHBondContact O-N 3.04Å; K145-F147 VanDerWaalsContact C-N 3.34Å; K145-F147 PolarHBondContact O-N 2.88Å; F147-N150 CarbonylContact O-C 3.31Å; F147-N150 VanDerWaalsContact O-C 3.31Å; F147-R151 HydrophobicContact CE1-CG 4.29Å; F147-R151 HydrophobicContact CE2-CB 3.94Å; F147-R151 HydrophobicContact CE2-CG 4.05Å; F147-R151 HydrophobicContact CZ-CB 4.24Å; F147-R151 HydrophobicContact CZ-CG 3.88Å; F147-R151 PolarHBondContact O-N 3.42Å; F147-W175 HydrophobicContact CB-CH2 4.32Å; F147-W175 HydrophobicContact CB-CZ3 4.09Å; F147-F176 HydrophobicContact CB-CE1 4.05Å; F147-F176 HydrophobicContact CB-CZ 4.18Å; F147-F176 AromaticContact CD2-CD1 3.95Å; F147-F176 HydrophobicContact CD2-CD1 3.95Å; F147-F176 AromaticContact CD2-CE1 3.85Å; F147-F176 HydrophobicContact CD2-CE1 3.85Å; F147-F176 HydrophobicContact CG-CE1 4.48Å; F147-R179 HydrophobicContact CB-CG 4.43Å; F147-R179 HydrophobicContact CD1-CG 3.65Å; F147-R179 HydrophobicContact CD2-CB 4.3Å; F147-R179 HydrophobicContact CD2-CG 3.76Å; F147-R179 HydrophobicContact CE1-CG 3.76Å; F147-R179 HydrophobicContact CE2-CB 4.34Å; F147-R179 HydrophobicContact CE2-CG 3.89Å; F147-R179 HydrophobicContact CG-CG 3.65Å; F147-R179 HydrophobicContact CZ-CG 3.88Å; F147-R180 HydrophobicContact CE2-CG 3.66Å; F147-R180 HydrophobicContact CZ-CG 4.2Å; F147-W183 HydrophobicContact CE1-CB 4.27Å; F147-W183 HydrophobicContact CE1-CG 4.24Å; F147-W183 HydrophobicContact CZ-CB 4.03Å; F147-W183 HydrophobicContact CZ-CG 4.11Å |
| 148 | H | 97.8 | Very high | 98.3 | Very high | 123 Ų | 123 | 81.7 Ų | 81.7 | 57% | 0.569 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -68.1 | -41 | 173.2 | -77 | -72.7 | 0 | 0 | 0 | 111.7 | E144 K145 | E144-H148 PolarHBondContact O-CD2 2.68Å; E144-H148 PolarHBondContact O-N 2.84Å; K145-H148 PolarHBondContact O-N 3.04Å |
| 149 | F | 97.9 | Very high | 98.3 | Very high | 171 Ų | 171 | 79.2 Ų | 79.2 | 75% | 0.75 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -64.6 | -47.8 | 173.7 | -179 | -102 | 0 | 0 | 0 | 112.1 | K145 E146 | K145-F149 PolarHBondContact O-N 3.23Å; E146-F149 PolarHBondContact O-N 3.22Å |
| 150 | N | 96.8 | Very high | 98.3 | Very high | 70 Ų | 70 | 80.8 Ų | 80.8 | 37% | 0.374 | 36% | 0.359 | S | S | . | . | trans | -148.3 | 118.6 | 175 | -170.2 | -14.8 | 0 | 0 | 0 | 112.1 | E146 F147 Y152 | E146-N150 PolarHBondContact O-N 3.11Å; E146-N150 VanDerWaalsContact O-O 3.12Å; F147-N150 CarbonylContact O-C 3.31Å; F147-N150 VanDerWaalsContact O-C 3.31Å; N150-Y152 PolarHBondContact ND2-O 3.24Å; N150-Y152 VanDerWaalsContact ND2-O 3.16Å; N150-Y152 PolarHBondContact O-N 3.17Å; N150-Y152 PolarHBondContact OD1-N 3.33Å; N150-Y152 PolarHBondContact OD1-O 3.24Å | ||
| 151 | R | 97.7 | Very high | 98.3 | Very high | 100 Ų | 100 | 79.2 Ų | 79.2 | 38% | 0.377 | 35% | 0.349 | S | S | . | . | S | Bend | trans | -62.9 | -15.1 | 178.9 | -67.7 | 168 | 169.6 | 76 | -8.8 | 113.5 | F147 R180 | F147-R151 HydrophobicContact CE1-CG 4.29Å; F147-R151 HydrophobicContact CE2-CB 3.94Å; F147-R151 HydrophobicContact CE2-CG 4.05Å; F147-R151 HydrophobicContact CZ-CB 4.24Å; F147-R151 HydrophobicContact CZ-CG 3.88Å; F147-R151 PolarHBondContact O-N 3.42Å; R151-R180 WeakPolarHBondContact O-CD 3.4Å |
| 152 | Y | 98.3 | Very high | 98.3 | Very high | 147 Ų | 147 | 76 Ų | 76 | 58% | 0.576 | 33% | 0.333 | S | S | * | . | S | Bend | trans | -135 | 121.1 | -176.5 | -66.2 | -110.3 | 0 | 0 | 0 | 111.8 | N150 | N150-Y152 PolarHBondContact ND2-O 3.24Å; N150-Y152 VanDerWaalsContact ND2-O 3.16Å; N150-Y152 PolarHBondContact O-N 3.17Å; N150-Y152 PolarHBondContact OD1-N 3.33Å; N150-Y152 PolarHBondContact OD1-O 3.24Å |
| 153 | L | 98.2 | Very high | 98.3 | Very high | 30 Ų | 30 | 80.2 Ų | 80.2 | 16% | 0.157 | 35% | 0.352 | C | S | . | . | trans | -87.8 | 133.8 | 179.7 | -62.7 | -178.7 | 0 | 0 | 0 | 114.1 | R157 R158 I161 I172 F176 | L153-R157 HydrophobicContact CD2-CB 4.43Å; L153-R157 HydrophobicContact CD2-CG 3.91Å; L153-R158 HydrophobicContact CB-CB 4.45Å; L153-R158 HydrophobicContact CD1-CB 4.36Å; L153-I161 HydrophobicContact CD1-CD1 3.75Å; L153-I161 HydrophobicContact CD2-CD1 3.75Å; L153-I161 HydrophobicContact CG-CD1 4.42Å; L153-I172 HydrophobicContact CD1-CG2 3.48Å; L153-I172 VanDerWaalsContact CD1-CG2 3.48Å; L153-F176 HydrophobicContact CD1-CD1 4.2Å; L153-F176 HydrophobicContact CD1-CD2 3.62Å; L153-F176 HydrophobicContact CD1-CE1 4.05Å; L153-F176 HydrophobicContact CD1-CE2 3.48Å; L153-F176 VanDerWaalsContact CD1-CE2 3.48Å; L153-F176 HydrophobicContact CD1-CG 4Å; L153-F176 HydrophobicContact CD1-CZ 3.71Å; L153-F176 HydrophobicContact CD2-CE1 3.87Å; L153-F176 HydrophobicContact CD2-CE2 4.46Å; L153-F176 HydrophobicContact CD2-CZ 3.83Å; L153-F176 HydrophobicContact CG-CD1 3.82Å; L153-F176 HydrophobicContact CG-CD2 4.18Å; L153-F176 HydrophobicContact CG-CE1 3.61Å; L153-F176 HydrophobicContact CG-CE2 4.01Å; L153-F176 HydrophobicContact CG-CG 4.11Å; L153-F176 HydrophobicContact CG-CZ 3.72Å | ||
| 154 | T | 98.5 | Very high | 98.3 | Very high | 85 Ų | 85 | 83.8 Ų | 83.8 | 52% | 0.521 | 38% | 0.382 | S | S | . | . | trans | -68.6 | 166.4 | 164.8 | 67.9 | 0 | 0 | 0 | 0 | 111.6 | R156 R157 R158 | T154-R156 VanDerWaalsContact C-N 3.34Å; T154-R156 PolarHBondContact O-N 2.94Å; T154-R157 PolarHBondContact OG1-N 3.17Å; T154-R158 WeakPolarHBondContact O-CB 3.36Å; T154-R158 PolarHBondContact O-N 2.97Å; T154-R158 VanDerWaalsContact O-N 3.17Å | ||
| 155 | R | 98.3 | Very high | 98.3 | Very high | 139 Ų | 139 | 81 Ų | 81 | 53% | 0.525 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -58.8 | -44 | 176.4 | 179.8 | 68.4 | -179.4 | 88.8 | -13.1 | 112.1 | I159 E169 | R155-I159 WeakPolarHBondContact O-CG1 3.42Å; R155-I159 PolarHBondContact O-N 2.91Å; R155-E169 IonicContact CZ-OE1 3.43Å; R155-E169 IonicContact CZ-OE2 3.11Å; R155-E169 IonicContact NH1-OE1 2.7Å; R155-E169 PolarHBondContact NH1-OE1 2.83Å; R155-E169 IonicContact NH1-OE2 2.69Å; R155-E169 PolarHBondContact NH1-OE2 3.22Å; R155-E169 IonicContact NH2-OE1 2.78Å; R155-E169 PolarHBondContact NH2-OE1 3.44Å; R155-E169 IonicContact NH2-OE2 3.82Å |
| 156 | R | 98.3 | Very high | 98.3 | Very high | 185 Ų | 185 | 81.1 Ų | 81.1 | 70% | 0.698 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -65.4 | -52.7 | 179.1 | 177.1 | 175.8 | 167.4 | 154.9 | 0.1 | 111.6 | T154 R158 I159 E160 | T154-R156 VanDerWaalsContact C-N 3.34Å; T154-R156 PolarHBondContact O-N 2.94Å; R156-R158 PolarHBondContact O-N 3.27Å; R156-I159 WeakPolarHBondContact O-CB 3.47Å; R156-I159 PolarHBondContact O-N 3.47Å; R156-E160 WeakPolarHBondContact CG-OE1 3.19Å; R156-E160 IonicContact CZ-OE1 3.87Å; R156-E160 IonicContact NE-OE1 3.73Å; R156-E160 PolarHBondContact NE-OE1 3.42Å; R156-E160 IonicContact NH2-OE1 2.81Å; R156-E160 PolarHBondContact NH2-OE1 2.8Å; R156-E160 PolarHBondContact O-N 2.8Å |
| 157 | R | 98.5 | Very high | 98.3 | Very high | 92 Ų | 92 | 81 Ų | 81 | 35% | 0.347 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.6 | -34.1 | -176.9 | -171 | 54.9 | 174.5 | 179.9 | -0.2 | 112.6 | E146 L153 T154 I159 E160 I161 | E146-R157 IonicContact OE1-CZ 3.67Å; E146-R157 IonicContact OE1-NE 2.8Å; E146-R157 IonicContact OE1-NH2 2.71Å; E146-R157 PolarHBondContact OE1-NH2 3.33Å; E146-R157 IonicContact OE2-CZ 3.39Å; E146-R157 IonicContact OE2-NE 3.45Å; E146-R157 PolarHBondContact OE2-NE 2.78Å; E146-R157 IonicContact OE2-NH2 3.19Å; E146-R157 PolarHBondContact OE2-NH2 3.06Å; L153-R157 HydrophobicContact CD2-CB 4.43Å; L153-R157 HydrophobicContact CD2-CG 3.91Å; T154-R157 PolarHBondContact OG1-N 3.17Å; R157-I159 VanDerWaalsContact C-N 3.32Å; R157-I159 PolarHBondContact O-N 3.32Å; R157-E160 WeakPolarHBondContact CD-OE2 3.11Å; R157-E160 IonicContact CZ-OE2 3.74Å; R157-E160 IonicContact NE-OE2 2.76Å; R157-E160 IonicContact NH1-OE2 3.83Å; R157-E160 PolarHBondContact NH1-OE2 2.74Å; R157-E160 PolarHBondContact O-N 2.94Å; R157-I161 HydrophobicContact CG-CD1 3.89Å; R157-I161 HydrophobicContact CG-CG1 4.44Å; R157-I161 WeakPolarHBondContact O-CG1 3.33Å; R157-I161 PolarHBondContact O-N 3.4Å; R157-I161 VanDerWaalsContact O-N 3.1Å |
| 158 | R | 98.6 | Very high | 98.2 | Very high | 50 Ų | 50 | 83.4 Ų | 83.4 | 19% | 0.189 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -62 | -33.8 | 172.8 | 175.5 | 169.2 | 54 | -111.7 | 0.8 | 113.6 | L153 T154 R156 A162 E169 I172 | L153-R158 HydrophobicContact CB-CB 4.45Å; L153-R158 HydrophobicContact CD1-CB 4.36Å; T154-R158 WeakPolarHBondContact O-CB 3.36Å; T154-R158 PolarHBondContact O-N 2.97Å; T154-R158 VanDerWaalsContact O-N 3.17Å; R156-R158 PolarHBondContact O-N 3.27Å; R158-A162 WeakPolarHBondContact O-CB 3.34Å; R158-A162 PolarHBondContact O-N 3.16Å; R158-A162 VanDerWaalsContact O-N 3.11Å; R158-E169 WeakPolarHBondContact CD-O 3.46Å; R158-E169 HydrophobicContact CG-CB 4.08Å; R158-E169 HydrophobicContact CG-CG 4.03Å; R158-E169 IonicContact NE-OE2 2.81Å; R158-E169 PolarHBondContact NE-OE2 3.1Å; R158-I172 HydrophobicContact CG-CB 4.18Å; R158-I172 HydrophobicContact CG-CG2 4.06Å |
| 159 | I | 98.7 | Very high | 98.3 | Very high | 60 Ų | 60 | 80.2 Ų | 80.2 | 31% | 0.308 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.1 | -51.7 | 173.8 | -64.3 | 161 | 0 | 0 | 0 | 109.6 | R155 R156 R157 I161 A162 H163 | R155-I159 WeakPolarHBondContact O-CG1 3.42Å; R155-I159 PolarHBondContact O-N 2.91Å; R156-I159 WeakPolarHBondContact O-CB 3.47Å; R156-I159 PolarHBondContact O-N 3.47Å; R157-I159 VanDerWaalsContact C-N 3.32Å; R157-I159 PolarHBondContact O-N 3.32Å; I159-I161 PolarHBondContact O-N 2.95Å; I159-A162 WeakPolarHBondContact O-CB 3.31Å; I159-A162 PolarHBondContact O-N 2.94Å; I159-A162 VanDerWaalsContact O-N 3.11Å; I159-H163 VanDerWaalsContact CG2-CD2 3.41Å; I159-H163 WeakPolarHBondContact CG2-CD2 3.39Å; I159-H163 WeakPolarHBondContact CG2-NE2 3.31Å; I159-H163 PolarHBondContact O-CD2 3.46Å; I159-H163 PolarHBondContact O-N 3.42Å |
| 160 | E | 98.6 | Very high | 98.3 | Very high | 67 Ų | 67 | 80.6 Ų | 80.6 | 31% | 0.313 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -55 | -48.9 | -177 | -64 | 168.1 | -179.1 | 0 | 0 | 111.4 | R156 R157 A164 | R156-E160 WeakPolarHBondContact CG-OE1 3.19Å; R156-E160 IonicContact CZ-OE1 3.87Å; R156-E160 IonicContact NE-OE1 3.73Å; R156-E160 PolarHBondContact NE-OE1 3.42Å; R156-E160 IonicContact NH2-OE1 2.81Å; R156-E160 PolarHBondContact NH2-OE1 2.8Å; R156-E160 PolarHBondContact O-N 2.8Å; R157-E160 WeakPolarHBondContact CD-OE2 3.11Å; R157-E160 IonicContact CZ-OE2 3.74Å; R157-E160 IonicContact NE-OE2 2.76Å; R157-E160 IonicContact NH1-OE2 3.83Å; R157-E160 PolarHBondContact NH1-OE2 2.74Å; R157-E160 PolarHBondContact O-N 2.94Å; E160-A164 WeakPolarHBondContact O-CB 3.44Å; E160-A164 PolarHBondContact O-N 3.07Å; E160-A164 VanDerWaalsContact O-N 3.11Å |
| 161 | I | 98.5 | Very high | 98.4 | Very high | 9 Ų | 9 | 79.6 Ų | 79.6 | 5% | 0.046 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -67.5 | -38.8 | 177.8 | -58.8 | 162.7 | 0 | 0 | 0 | 111.8 | L143 E146 L153 R157 I159 H163 A164 L165 I172 | L143-I161 HydrophobicContact CD2-CG2 4.28Å; E146-I161 HydrophobicContact CB-CD1 4.05Å; E146-I161 HydrophobicContact CG-CD1 3.7Å; E146-I161 HydrophobicContact CG-CG1 4.06Å; E146-I161 WeakPolarHBondContact OE2-CD1 3.34Å; L153-I161 HydrophobicContact CD1-CD1 3.75Å; L153-I161 HydrophobicContact CD2-CD1 3.75Å; L153-I161 HydrophobicContact CG-CD1 4.42Å; R157-I161 HydrophobicContact CG-CD1 3.89Å; R157-I161 HydrophobicContact CG-CG1 4.44Å; R157-I161 WeakPolarHBondContact O-CG1 3.33Å; R157-I161 PolarHBondContact O-N 3.4Å; R157-I161 VanDerWaalsContact O-N 3.1Å; I159-I161 PolarHBondContact O-N 2.95Å; I161-H163 PolarHBondContact O-N 3.02Å; I161-A164 PolarHBondContact O-N 2.8Å; I161-L165 HydrophobicContact CG2-CD1 3.7Å; I161-L165 HydrophobicContact CG2-CG 4.15Å; I161-L165 WeakPolarHBondContact O-CB 3.34Å; I161-L165 WeakPolarHBondContact O-CG 3.42Å; I161-L165 PolarHBondContact O-N 2.81Å; I161-I172 HydrophobicContact CG2-CD1 3.9Å |
| 162 | A | 98.6 | Very high | 98.4 | Very high | 7 Ų | 7 | 74.8 Ų | 74.8 | 6% | 0.058 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -59.1 | -45.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | R158 I159 C166 L167 E169 I172 | R158-A162 WeakPolarHBondContact O-CB 3.34Å; R158-A162 PolarHBondContact O-N 3.16Å; R158-A162 VanDerWaalsContact O-N 3.11Å; I159-A162 WeakPolarHBondContact O-CB 3.31Å; I159-A162 PolarHBondContact O-N 2.94Å; I159-A162 VanDerWaalsContact O-N 3.11Å; A162-C166 PolarHBondContact O-N 2.78Å; A162-C166 VanDerWaalsContact O-N 3.17Å; A162-L167 CarbonylContact C-O 3.44Å; A162-L167 VanDerWaalsContact CA-O 3.31Å; A162-L167 WeakPolarHBondContact CA-O 3.13Å; A162-L167 WeakPolarHBondContact CB-O 3.46Å; A162-L167 PolarHBondContact O-N 3.43Å; A162-L167 VanDerWaalsContact O-O 3.05Å; A162-E169 HydrophobicContact CB-CG 4.17Å; A162-I172 HydrophobicContact CB-CG1 4.08Å |
| 163 | H | 98.6 | Very high | 98.4 | Very high | 144 Ų | 144 | 74 Ų | 74 | 67% | 0.667 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -67.6 | -46.9 | 175.6 | -68.1 | -67.5 | 0 | 0 | 0 | 112.2 | I159 I161 L165 C166 | I159-H163 VanDerWaalsContact CG2-CD2 3.41Å; I159-H163 WeakPolarHBondContact CG2-CD2 3.39Å; I159-H163 WeakPolarHBondContact CG2-NE2 3.31Å; I159-H163 PolarHBondContact O-CD2 3.46Å; I159-H163 PolarHBondContact O-N 3.42Å; I161-H163 PolarHBondContact O-N 3.02Å; H163-L165 VanDerWaalsContact C-N 3.26Å; H163-L165 PolarHBondContact O-N 2.87Å; H163-C166 PolarHBondContact O-N 3.41Å |
| 164 | A | 98.3 | Very high | 98.4 | Very high | 75 Ų | 75 | 75.2 Ų | 75.2 | 62% | 0.62 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -59.3 | -34.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | E160 I161 | E160-A164 WeakPolarHBondContact O-CB 3.44Å; E160-A164 PolarHBondContact O-N 3.07Å; E160-A164 VanDerWaalsContact O-N 3.11Å; I161-A164 PolarHBondContact O-N 2.8Å |
| 165 | L | 98.3 | Very high | 98.4 | Very high | 10 Ų | 10 | 72.7 Ų | 72.7 | 5% | 0.052 | 34% | 0.344 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | 2.3 | -177.1 | -57.7 | -173 | 0 | 0 | 0 | 114.2 | Q139 E142 L143 I161 H163 L167 | Q139-L165 HydrophobicContact CG-CB 4.32Å; Q139-L165 PolarHBondContact NE2-O 2.69Å; E142-L165 HydrophobicContact CB-CD1 4.09Å; E142-L165 HydrophobicContact CB-CD2 3.76Å; E142-L165 HydrophobicContact CG-CD2 4.08Å; L143-L165 HydrophobicContact CD2-CD1 4.09Å; L143-L165 HydrophobicContact CG-CD1 3.79Å; I161-L165 HydrophobicContact CG2-CD1 3.7Å; I161-L165 HydrophobicContact CG2-CG 4.15Å; I161-L165 WeakPolarHBondContact O-CB 3.34Å; I161-L165 WeakPolarHBondContact O-CG 3.42Å; I161-L165 PolarHBondContact O-N 2.81Å; H163-L165 VanDerWaalsContact C-N 3.26Å; H163-L165 PolarHBondContact O-N 2.87Å; L165-L167 VanDerWaalsContact C-N 3.26Å; L165-L167 HydrophobicContact CB-CD1 4.21Å; L165-L167 HydrophobicContact CB-CG 4.26Å; L165-L167 PolarHBondContact O-N 3.16Å |
| 166 | C | 98.4 | Very high | 98.5 | Very high | 119 Ų | 119 | 66.5 Ų | 66.5 | 80% | 0.804 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.8 | 42.9 | -172.1 | -53.7 | 0 | 0 | 0 | 0 | 113.2 | A162 H163 | A162-C166 PolarHBondContact O-N 2.78Å; A162-C166 VanDerWaalsContact O-N 3.17Å; H163-C166 PolarHBondContact O-N 3.41Å |
| 167 | L | 98 | Very high | 98.5 | Very high | 14 Ų | 14 | 62.5 Ų | 62.5 | 7% | 0.073 | 31% | 0.31 | C | S | . | . | trans | -117.9 | 148 | 177.6 | -68.9 | 176.3 | 0 | 0 | 0 | 110.2 | Y135 L143 A162 L165 Q171 I172 | Y135-L167 HydrophobicContact CD1-CD2 4.15Å; Y135-L167 HydrophobicContact CD2-CD1 4.47Å; Y135-L167 HydrophobicContact CE1-CD2 3.97Å; Y135-L167 HydrophobicContact CE2-CD1 4.35Å; L143-L167 HydrophobicContact CD1-CD1 4.29Å; A162-L167 CarbonylContact C-O 3.44Å; A162-L167 VanDerWaalsContact CA-O 3.31Å; A162-L167 WeakPolarHBondContact CA-O 3.13Å; A162-L167 WeakPolarHBondContact CB-O 3.46Å; A162-L167 PolarHBondContact O-N 3.43Å; A162-L167 VanDerWaalsContact O-O 3.05Å; L165-L167 VanDerWaalsContact C-N 3.26Å; L165-L167 HydrophobicContact CB-CD1 4.21Å; L165-L167 HydrophobicContact CB-CG 4.26Å; L165-L167 PolarHBondContact O-N 3.16Å; L167-Q171 HydrophobicContact CB-CB 4.33Å; L167-I172 HydrophobicContact CB-CD1 3.89Å; L167-I172 HydrophobicContact CB-CG1 4.43Å; L167-I172 HydrophobicContact CD1-CD1 3.94Å | ||
| 168 | S | 98.5 | Very high | 98.5 | Very high | 54 Ų | 54 | 62 Ų | 62 | 38% | 0.378 | 31% | 0.314 | S | S | . | . | trans | -66.6 | 148.5 | 172.7 | 65.7 | 0 | 0 | 0 | 0 | 111.6 | R170 Q171 I172 | S168-R170 PolarHBondContact O-N 2.7Å; S168-Q171 WeakPolarHBondContact O-CA 3.39Å; S168-Q171 WeakPolarHBondContact O-CB 3.43Å; S168-Q171 PolarHBondContact O-N 3.01Å; S168-Q171 WeakPolarHBondContact OG-CG 3.5Å; S168-Q171 PolarHBondContact OG-N 3.21Å; S168-Q171 PolarHBondContact OG-OE1 3.42Å; S168-I172 PolarHBondContact O-N 3.09Å; S168-I172 VanDerWaalsContact O-N 3.1Å | ||
| 169 | E | 98.6 | Very high | 98.4 | Very high | 56 Ų | 56 | 61.7 Ų | 61.7 | 26% | 0.262 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -50.4 | -34.5 | 171.8 | -74.8 | -158.1 | -121.5 | 0 | 0 | 113.2 | R155 R158 A162 I172 K173 | R155-E169 IonicContact CZ-OE1 3.43Å; R155-E169 IonicContact CZ-OE2 3.11Å; R155-E169 IonicContact NH1-OE1 2.7Å; R155-E169 PolarHBondContact NH1-OE1 2.83Å; R155-E169 IonicContact NH1-OE2 2.69Å; R155-E169 PolarHBondContact NH1-OE2 3.22Å; R155-E169 IonicContact NH2-OE1 2.78Å; R155-E169 PolarHBondContact NH2-OE1 3.44Å; R155-E169 IonicContact NH2-OE2 3.82Å; R158-E169 WeakPolarHBondContact CD-O 3.46Å; R158-E169 HydrophobicContact CG-CB 4.08Å; R158-E169 HydrophobicContact CG-CG 4.03Å; R158-E169 IonicContact NE-OE2 2.81Å; R158-E169 PolarHBondContact NE-OE2 3.1Å; A162-E169 HydrophobicContact CB-CG 4.17Å; E169-I172 PolarHBondContact O-N 3.5Å; E169-K173 WeakPolarHBondContact O-CB 3.46Å; E169-K173 PolarHBondContact O-N 3.45Å |
| 170 | R | 98.1 | Very high | 98.4 | Very high | 179 Ų | 179 | 62.7 Ų | 62.7 | 68% | 0.675 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -64.8 | -41.9 | 176.5 | -175.8 | 178.1 | 178.4 | -82.1 | -2 | 111.7 | S168 K173 I174 | S168-R170 PolarHBondContact O-N 2.7Å; R170-K173 PolarHBondContact O-N 2.87Å; R170-I174 HydrophobicContact CG-CD1 3.91Å; R170-I174 WeakPolarHBondContact O-CB 3.33Å; R170-I174 VanDerWaalsContact O-CG1 3.27Å; R170-I174 WeakPolarHBondContact O-CG1 3.49Å; R170-I174 PolarHBondContact O-N 2.85Å |
| 171 | Q | 98.4 | Very high | 98.4 | Very high | 49 Ų | 49 | 64.9 Ų | 64.9 | 23% | 0.229 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -63.1 | -44.1 | 174.5 | -81.2 | 160.3 | -60 | 0 | 0 | 111.4 | Y135 L167 S168 I174 W175 | Y135-Q171 WeakPolarHBondContact OH-CB 3.42Å; L167-Q171 HydrophobicContact CB-CB 4.33Å; S168-Q171 WeakPolarHBondContact O-CA 3.39Å; S168-Q171 WeakPolarHBondContact O-CB 3.43Å; S168-Q171 PolarHBondContact O-N 3.01Å; S168-Q171 WeakPolarHBondContact OG-CG 3.5Å; S168-Q171 PolarHBondContact OG-N 3.21Å; S168-Q171 PolarHBondContact OG-OE1 3.42Å; Q171-I174 PolarHBondContact O-N 3.21Å; Q171-W175 WeakPolarHBondContact O-CB 3.42Å; Q171-W175 PolarHBondContact O-N 3.4Å |
| 172 | I | 98.6 | Very high | 98.3 | Very high | 0 Ų | 0 | 70.3 Ų | 70.3 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -59.4 | -49.1 | 174.3 | -54.4 | -59.5 | 0 | 0 | 0 | 110.6 | L143 L153 R158 I161 A162 L167 S168 E169 I174 W175 F176 | L143-I172 HydrophobicContact CD2-CD1 3.8Å; L153-I172 HydrophobicContact CD1-CG2 3.48Å; L153-I172 VanDerWaalsContact CD1-CG2 3.48Å; R158-I172 HydrophobicContact CG-CB 4.18Å; R158-I172 HydrophobicContact CG-CG2 4.06Å; I161-I172 HydrophobicContact CG2-CD1 3.9Å; A162-I172 HydrophobicContact CB-CG1 4.08Å; L167-I172 HydrophobicContact CB-CD1 3.89Å; L167-I172 HydrophobicContact CB-CG1 4.43Å; L167-I172 HydrophobicContact CD1-CD1 3.94Å; S168-I172 PolarHBondContact O-N 3.09Å; S168-I172 VanDerWaalsContact O-N 3.1Å; E169-I172 PolarHBondContact O-N 3.5Å; I172-I174 PolarHBondContact O-N 2.93Å; I172-W175 PolarHBondContact O-N 2.95Å; I172-F176 HydrophobicContact CG2-CD2 4.08Å; I172-F176 HydrophobicContact CG2-CE2 4.34Å; I172-F176 PolarHBondContact O-N 3.08Å |
| 173 | K | 98.4 | Very high | 98.1 | Very high | 129 Ų | 129 | 73.6 Ų | 73.6 | 56% | 0.561 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -57.6 | -46.2 | 178 | -179 | -179.1 | 176.9 | -179.1 | 0 | 112.2 | E169 R170 Q177 | E169-K173 WeakPolarHBondContact O-CB 3.46Å; E169-K173 PolarHBondContact O-N 3.45Å; R170-K173 PolarHBondContact O-N 2.87Å; K173-Q177 WeakPolarHBondContact O-CB 3.31Å; K173-Q177 PolarHBondContact O-N 3.34Å |
| 174 | I | 98.4 | Very high | 98 | Very high | 56 Ų | 56 | 72.9 Ų | 72.9 | 29% | 0.287 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -66.5 | -42 | 179.4 | -70.8 | 167.8 | 0 | 0 | 0 | 110.7 | R170 Q171 I172 Q177 N178 | R170-I174 HydrophobicContact CG-CD1 3.91Å; R170-I174 WeakPolarHBondContact O-CB 3.33Å; R170-I174 VanDerWaalsContact O-CG1 3.27Å; R170-I174 WeakPolarHBondContact O-CG1 3.49Å; R170-I174 PolarHBondContact O-N 2.85Å; Q171-I174 PolarHBondContact O-N 3.21Å; I172-I174 PolarHBondContact O-N 2.93Å; I174-Q177 PolarHBondContact O-N 3.49Å; I174-N178 VanDerWaalsContact O-CG 3.23Å; I174-N178 PolarHBondContact O-N 3.41Å; I174-N178 PolarHBondContact O-ND2 3.46Å |
| 175 | W | 98.5 | Very high | 97.8 | Very high | 33 Ų | 33 | 75.1 Ų | 75.1 | 13% | 0.125 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63.2 | -46 | 178.1 | -170.7 | 97 | 0 | 0 | 0 | 111.5 | Y135 L143 E144 F147 Q171 I172 Q177 N178 R179 | Y135-W175 AromaticContact CD2-CD1 3.86Å; Y135-W175 HydrophobicContact CE2-CB 4.22Å; Y135-W175 AromaticContact CE2-CD1 3.56Å; Y135-W175 HydrophobicContact CE2-CG 4.15Å; L143-W175 VanDerWaalsContact C-CH2 3.48Å; L143-W175 HydrophobicContact CB-CD2 3.97Å; L143-W175 HydrophobicContact CB-CE3 3.91Å; L143-W175 HydrophobicContact CB-CH2 3.68Å; L143-W175 HydrophobicContact CB-CZ2 3.72Å; L143-W175 HydrophobicContact CB-CZ3 3.77Å; L143-W175 HydrophobicContact CD1-CD2 3.9Å; L143-W175 HydrophobicContact CD1-CE3 4.49Å; L143-W175 HydrophobicContact CD1-CG 3.9Å; L143-W175 HydrophobicContact CD2-CD2 4.31Å; L143-W175 HydrophobicContact CD2-CE3 4.13Å; L143-W175 HydrophobicContact CG-CD2 4.29Å; L143-W175 HydrophobicContact CG-CE3 4.4Å; L143-W175 WeakPolarHBondContact O-CH2 3.34Å; L143-W175 WeakPolarHBondContact O-CZ3 3.42Å; E144-W175 HydrophobicContact CG-CH2 3.83Å; E144-W175 HydrophobicContact CG-CZ2 3.85Å; F147-W175 HydrophobicContact CB-CH2 4.32Å; F147-W175 HydrophobicContact CB-CZ3 4.09Å; Q171-W175 WeakPolarHBondContact O-CB 3.42Å; Q171-W175 PolarHBondContact O-N 3.4Å; I172-W175 PolarHBondContact O-N 2.95Å; W175-Q177 VanDerWaalsContact C-N 3.27Å; W175-Q177 PolarHBondContact O-N 2.79Å; W175-N178 PolarHBondContact O-N 3.03Å; W175-R179 HydrophobicContact CD2-CB 4.5Å; W175-R179 HydrophobicContact CE3-CB 4.02Å; W175-R179 HydrophobicContact CH2-CB 3.95Å; W175-R179 HydrophobicContact CH2-CG 3.71Å; W175-R179 HydrophobicContact CZ2-CB 4.43Å; W175-R179 HydrophobicContact CZ2-CG 4.39Å; W175-R179 HydrophobicContact CZ3-CB 3.73Å; W175-R179 HydrophobicContact CZ3-CG 3.85Å; W175-R179 WeakPolarHBondContact O-CB 3.32Å; W175-R179 PolarHBondContact O-N 3.21Å |
| 176 | F | 98.8 | Very high | 97.5 | Very high | 8 Ų | 8 | 76.7 Ų | 76.7 | 4% | 0.035 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -65.5 | -26.5 | 175.3 | -91.3 | -100.7 | 0 | 0 | 0 | 113.7 | L143 E146 F147 L153 I172 R180 | L143-F176 HydrophobicContact CD2-CD2 4.49Å; L143-F176 HydrophobicContact CD2-CE2 3.97Å; E146-F176 HydrophobicContact CB-CZ 4.03Å; F147-F176 HydrophobicContact CB-CE1 4.05Å; F147-F176 HydrophobicContact CB-CZ 4.18Å; F147-F176 AromaticContact CD2-CD1 3.95Å; F147-F176 HydrophobicContact CD2-CD1 3.95Å; F147-F176 AromaticContact CD2-CE1 3.85Å; F147-F176 HydrophobicContact CD2-CE1 3.85Å; F147-F176 HydrophobicContact CG-CE1 4.48Å; L153-F176 HydrophobicContact CD1-CD1 4.2Å; L153-F176 HydrophobicContact CD1-CD2 3.62Å; L153-F176 HydrophobicContact CD1-CE1 4.05Å; L153-F176 HydrophobicContact CD1-CE2 3.48Å; L153-F176 VanDerWaalsContact CD1-CE2 3.48Å; L153-F176 HydrophobicContact CD1-CG 4Å; L153-F176 HydrophobicContact CD1-CZ 3.71Å; L153-F176 HydrophobicContact CD2-CE1 3.87Å; L153-F176 HydrophobicContact CD2-CE2 4.46Å; L153-F176 HydrophobicContact CD2-CZ 3.83Å; L153-F176 HydrophobicContact CG-CD1 3.82Å; L153-F176 HydrophobicContact CG-CD2 4.18Å; L153-F176 HydrophobicContact CG-CE1 3.61Å; L153-F176 HydrophobicContact CG-CE2 4.01Å; L153-F176 HydrophobicContact CG-CG 4.11Å; L153-F176 HydrophobicContact CG-CZ 3.72Å; I172-F176 HydrophobicContact CG2-CD2 4.08Å; I172-F176 HydrophobicContact CG2-CE2 4.34Å; I172-F176 PolarHBondContact O-N 3.08Å; F176-R180 WeakPolarHBondContact O-CG 3.33Å; F176-R180 PolarHBondContact O-N 3.4Å; F176-R180 PolarHBondContact O-NE 3.03Å |
| 177 | Q | 98.6 | Very high | 96.8 | Very high | 101 Ų | 101 | 75.2 Ų | 75.2 | 47% | 0.472 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -70.2 | -49.5 | 170 | -171.7 | 170.1 | 5.1 | 0 | 0 | 110.8 | K173 I174 W175 R179 R180 M181 | K173-Q177 WeakPolarHBondContact O-CB 3.31Å; K173-Q177 PolarHBondContact O-N 3.34Å; I174-Q177 PolarHBondContact O-N 3.49Å; W175-Q177 VanDerWaalsContact C-N 3.27Å; W175-Q177 PolarHBondContact O-N 2.79Å; Q177-R179 PolarHBondContact O-N 2.92Å; Q177-R180 PolarHBondContact O-N 3.02Å; Q177-M181 WeakPolarHBondContact O-CG 3.38Å; Q177-M181 PolarHBondContact O-N 3.29Å; Q177-M181 VanDerWaalsContact O-N 3.08Å |
| 178 | N | 98.3 | Very high | 95.8 | Very high | 83 Ų | 83 | 81.9 Ų | 81.9 | 44% | 0.444 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.6 | -42.7 | 178 | -65 | -18.1 | 0 | 0 | 0 | 112.1 | I174 W175 R180 M181 K182 | I174-N178 VanDerWaalsContact O-CG 3.23Å; I174-N178 PolarHBondContact O-N 3.41Å; I174-N178 PolarHBondContact O-ND2 3.46Å; W175-N178 PolarHBondContact O-N 3.03Å; N178-R180 PolarHBondContact O-N 3.23Å; N178-M181 PolarHBondContact O-N 3.48Å; N178-K182 PolarHBondContact O-N 3.18Å |
| 179 | R | 98.4 | Very high | 94.3 | Very high | 42 Ų | 42 | 83.8 Ų | 83.8 | 16% | 0.158 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -64.2 | -40.9 | -179.6 | -173.8 | 63.9 | -175.9 | 114.4 | -9.7 | 112.1 | F147 W175 Q177 K182 W183 D186 | F147-R179 HydrophobicContact CB-CG 4.43Å; F147-R179 HydrophobicContact CD1-CG 3.65Å; F147-R179 HydrophobicContact CD2-CB 4.3Å; F147-R179 HydrophobicContact CD2-CG 3.76Å; F147-R179 HydrophobicContact CE1-CG 3.76Å; F147-R179 HydrophobicContact CE2-CB 4.34Å; F147-R179 HydrophobicContact CE2-CG 3.89Å; F147-R179 HydrophobicContact CG-CG 3.65Å; F147-R179 HydrophobicContact CZ-CG 3.88Å; W175-R179 HydrophobicContact CD2-CB 4.5Å; W175-R179 HydrophobicContact CE3-CB 4.02Å; W175-R179 HydrophobicContact CH2-CB 3.95Å; W175-R179 HydrophobicContact CH2-CG 3.71Å; W175-R179 HydrophobicContact CZ2-CB 4.43Å; W175-R179 HydrophobicContact CZ2-CG 4.39Å; W175-R179 HydrophobicContact CZ3-CB 3.73Å; W175-R179 HydrophobicContact CZ3-CG 3.85Å; W175-R179 WeakPolarHBondContact O-CB 3.32Å; W175-R179 PolarHBondContact O-N 3.21Å; Q177-R179 PolarHBondContact O-N 2.92Å; R179-K182 PolarHBondContact O-N 3.25Å; R179-W183 VanDerWaalsContact O-CB 3.32Å; R179-W183 WeakPolarHBondContact O-CB 3.19Å; R179-W183 PolarHBondContact O-N 3.19Å; R179-D186 IonicContact NH1-OD2 3.58Å |
| 180 | R | 98.1 | Very high | 92.8 | Very high | 81 Ų | 81 | 85.9 Ų | 85.9 | 31% | 0.306 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.3 | -39.2 | 172.4 | -75.1 | -178.1 | -67.8 | 155.7 | 4.2 | 112.8 | F147 R151 F176 Q177 N178 W183 K184 | F147-R180 HydrophobicContact CE2-CG 3.66Å; F147-R180 HydrophobicContact CZ-CG 4.2Å; R151-R180 WeakPolarHBondContact O-CD 3.4Å; F176-R180 WeakPolarHBondContact O-CG 3.33Å; F176-R180 PolarHBondContact O-N 3.4Å; F176-R180 PolarHBondContact O-NE 3.03Å; Q177-R180 PolarHBondContact O-N 3.02Å; N178-R180 PolarHBondContact O-N 3.23Å; R180-W183 PolarHBondContact O-N 3.2Å; R180-K184 WeakPolarHBondContact O-CB 3.37Å; R180-K184 PolarHBondContact O-N 3.23Å |
| 181 | M | 97.9 | Very high | 91.1 | Very high | 113 Ų | 113 | 80.8 Ų | 80.8 | 56% | 0.557 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -64.9 | -40.7 | 176.5 | -67.8 | -64.4 | -77.1 | 0 | 0 | 111.7 | Q177 N178 K185 | Q177-M181 WeakPolarHBondContact O-CG 3.38Å; Q177-M181 PolarHBondContact O-N 3.29Å; Q177-M181 VanDerWaalsContact O-N 3.08Å; N178-M181 PolarHBondContact O-N 3.48Å; M181-K185 PolarHBondContact O-N 3Å |
| 182 | K | 96.4 | Very high | 89.2 | Confident | 124 Ų | 124 | 83.3 Ų | 83.3 | 54% | 0.539 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.1 | -54 | 171.8 | -174.7 | -176.2 | 171.5 | -175 | 0 | 111.1 | N178 R179 K184 K185 D186 | N178-K182 PolarHBondContact O-N 3.18Å; R179-K182 PolarHBondContact O-N 3.25Å; K182-K184 VanDerWaalsContact C-N 3.28Å; K182-K184 PolarHBondContact O-N 3.14Å; K182-K185 WeakPolarHBondContact O-CA 3.35Å; K182-K185 VanDerWaalsContact O-CB 3.31Å; K182-K185 WeakPolarHBondContact O-CB 3.49Å; K182-K185 PolarHBondContact O-N 3.26Å; K182-D186 VanDerWaalsContact CE-OD2 3.31Å; K182-D186 WeakPolarHBondContact CE-OD2 3.27Å; K182-D186 WeakPolarHBondContact CG-OD1 3.48Å; K182-D186 WeakPolarHBondContact CG-OD2 2.73Å; K182-D186 PolarHBondContact O-N 3.25Å |
| 183 | W | 95.7 | Very high | 87.5 | Confident | 75 Ų | 75 | 88.7 Ų | 88.7 | 28% | 0.284 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -52.5 | -42.7 | 179.6 | 176.6 | 75.4 | 0 | 0 | 0 | 113.3 | F147 R179 R180 K185 D186 H187 | F147-W183 HydrophobicContact CE1-CB 4.27Å; F147-W183 HydrophobicContact CE1-CG 4.24Å; F147-W183 HydrophobicContact CZ-CB 4.03Å; F147-W183 HydrophobicContact CZ-CG 4.11Å; R179-W183 VanDerWaalsContact O-CB 3.32Å; R179-W183 WeakPolarHBondContact O-CB 3.19Å; R179-W183 PolarHBondContact O-N 3.19Å; R180-W183 PolarHBondContact O-N 3.2Å; W183-K185 VanDerWaalsContact C-N 3.3Å; W183-K185 PolarHBondContact O-N 3.19Å; W183-D186 PolarHBondContact O-N 3.17Å; W183-H187 AromaticContact CD1-CE1 3.9Å; W183-H187 AromaticContact CD1-NE2 3.72Å; W183-H187 AromaticContact CE2-CD2 3.32Å; W183-H187 AromaticContact CE2-NE2 3.44Å; W183-H187 AromaticContact CZ2-CD2 3.34Å; W183-H187 WeakPolarHBondContact CZ2-CD2 3.46Å; W183-H187 AromaticContact CZ2-NE2 3.69Å; W183-H187 AromaticContact NE1-CD2 3.22Å; W183-H187 PolarHBondContact NE1-CD2 3.37Å; W183-H187 AromaticContact NE1-CE1 3.44Å; W183-H187 PolarHBondContact NE1-CE1 2.9Å; W183-H187 AromaticContact NE1-CG 3.92Å; W183-H187 AromaticContact NE1-NE2 2.83Å; W183-H187 PolarHBondContact NE1-NE2 3.3Å; W183-H187 PolarHBondContact O-N 3.3Å; W183-H187 VanDerWaalsContact O-N 3.1Å |
| 184 | K | 95.6 | Very high | 85.7 | Confident | 130 Ų | 130 | 87.5 Ų | 87.5 | 57% | 0.565 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -65.6 | -29.8 | 175.5 | -170.5 | -170.8 | 69.4 | 170.7 | 0 | 113.2 | R180 K182 | R180-K184 WeakPolarHBondContact O-CB 3.37Å; R180-K184 PolarHBondContact O-N 3.23Å; K182-K184 VanDerWaalsContact C-N 3.28Å; K182-K184 PolarHBondContact O-N 3.14Å |
| 185 | K | 94.6 | Very high | 83.7 | Confident | 122 Ų | 122 | 92.4 Ų | 92.4 | 53% | 0.53 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -73.5 | -55.7 | 175 | -174.4 | -170.7 | 166.5 | -171.3 | 0 | 109.5 | M181 K182 W183 H187 K188 E189 | M181-K185 PolarHBondContact O-N 3Å; K182-K185 WeakPolarHBondContact O-CA 3.35Å; K182-K185 VanDerWaalsContact O-CB 3.31Å; K182-K185 WeakPolarHBondContact O-CB 3.49Å; K182-K185 PolarHBondContact O-N 3.26Å; W183-K185 VanDerWaalsContact C-N 3.3Å; W183-K185 PolarHBondContact O-N 3.19Å; K185-H187 VanDerWaalsContact C-N 3.32Å; K185-H187 PolarHBondContact O-N 3.3Å; K185-K188 PolarHBondContact O-N 2.96Å; K185-E189 VanDerWaalsContact CE-CD 3.41Å; K185-E189 WeakPolarHBondContact CE-OE1 3.49Å; K185-E189 WeakPolarHBondContact CE-OE2 3.46Å; K185-E189 IonicContact NZ-OE1 2.92Å; K185-E189 PolarHBondContact NZ-OE1 2.8Å; K185-E189 IonicContact NZ-OE2 2.6Å; K185-E189 PolarHBondContact O-N 2.8Å |
| 186 | D | 91 | Very high | 81.8 | Confident | 42 Ų | 42 | 99 Ų | 99 | 23% | 0.225 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -50.3 | -51.6 | -177.8 | -52.2 | -14.9 | 0 | 0 | 0 | 110.5 | R179 K182 W183 K188 E189 E190 | R179-D186 IonicContact NH1-OD2 3.58Å; K182-D186 VanDerWaalsContact CE-OD2 3.31Å; K182-D186 WeakPolarHBondContact CE-OD2 3.27Å; K182-D186 WeakPolarHBondContact CG-OD1 3.48Å; K182-D186 WeakPolarHBondContact CG-OD2 2.73Å; K182-D186 PolarHBondContact O-N 3.25Å; W183-D186 PolarHBondContact O-N 3.17Å; D186-K188 VanDerWaalsContact C-N 3.28Å; D186-K188 PolarHBondContact O-N 2.84Å; D186-E189 PolarHBondContact O-N 3.3Å; D186-E189 VanDerWaalsContact O-N 3.09Å; D186-E190 WeakPolarHBondContact O-CG 3.01Å; D186-E190 PolarHBondContact O-N 2.98Å |
| 187 | H | 85.1 | Confident | 79.8 | Confident | 89 Ų | 89 | 105.4 Ų | 105.4 | 41% | 0.412 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.3 | -14.4 | -179.5 | -73 | 7 | 0 | 0 | 0 | 115.9 | W183 K185 E190 | W183-H187 AromaticContact CD1-CE1 3.9Å; W183-H187 AromaticContact CD1-NE2 3.72Å; W183-H187 AromaticContact CE2-CD2 3.32Å; W183-H187 AromaticContact CE2-NE2 3.44Å; W183-H187 AromaticContact CZ2-CD2 3.34Å; W183-H187 WeakPolarHBondContact CZ2-CD2 3.46Å; W183-H187 AromaticContact CZ2-NE2 3.69Å; W183-H187 AromaticContact NE1-CD2 3.22Å; W183-H187 PolarHBondContact NE1-CD2 3.37Å; W183-H187 AromaticContact NE1-CE1 3.44Å; W183-H187 PolarHBondContact NE1-CE1 2.9Å; W183-H187 AromaticContact NE1-CG 3.92Å; W183-H187 AromaticContact NE1-NE2 2.83Å; W183-H187 PolarHBondContact NE1-NE2 3.3Å; W183-H187 PolarHBondContact O-N 3.3Å; W183-H187 VanDerWaalsContact O-N 3.1Å; K185-H187 VanDerWaalsContact C-N 3.32Å; K185-H187 PolarHBondContact O-N 3.3Å; H187-E190 WeakPolarHBondContact CA-OE2 3.48Å; H187-E190 IonicContact CE1-OE2 3.64Å; H187-E190 PolarHBondContact CE1-OE2 3.29Å; H187-E190 IonicContact CG-OE2 3.37Å; H187-E190 IonicContact ND1-OE2 3.97Å; H187-E190 PolarHBondContact ND1-OE2 2.95Å |
| 188 | K | 76.1 | Confident | 77.7 | Confident | 153 Ų | 153 | 108.1 Ų | 108.1 | 67% | 0.665 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -90 | -18.8 | 173.7 | -158.4 | -179.5 | -178.4 | -169.8 | 0 | 111.9 | K185 D186 S191 N192 | K185-K188 PolarHBondContact O-N 2.96Å; D186-K188 VanDerWaalsContact C-N 3.28Å; D186-K188 PolarHBondContact O-N 2.84Å; K188-S191 PolarHBondContact O-OG 3.31Å; K188-N192 PolarHBondContact O-ND2 2.8Å |
| 189 | E | 67.8 | Low | 75.4 | Confident | 94 Ų | 94 | 107.5 Ų | 107.5 | 44% | 0.439 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -84.9 | -42.7 | 172.8 | -67.6 | 174.3 | 170.4 | 0 | 0 | 109.3 | K185 D186 S191 N192 L193 | K185-E189 VanDerWaalsContact CE-CD 3.41Å; K185-E189 WeakPolarHBondContact CE-OE1 3.49Å; K185-E189 WeakPolarHBondContact CE-OE2 3.46Å; K185-E189 IonicContact NZ-OE1 2.92Å; K185-E189 PolarHBondContact NZ-OE1 2.8Å; K185-E189 IonicContact NZ-OE2 2.6Å; K185-E189 PolarHBondContact O-N 2.8Å; D186-E189 PolarHBondContact O-N 3.3Å; D186-E189 VanDerWaalsContact O-N 3.09Å; E189-S191 VanDerWaalsContact C-N 3.32Å; E189-S191 PolarHBondContact O-N 2.73Å; E189-N192 PolarHBondContact O-N 2.82Å; E189-L193 WeakPolarHBondContact O-CD1 3.22Å; E189-L193 PolarHBondContact O-N 2.84Å |
| 190 | E | 66 | Low | 72.8 | Confident | 101 Ų | 101 | 111.7 Ų | 111.7 | 47% | 0.472 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -56.5 | -39.9 | 175.5 | -72.3 | 161.7 | 153.7 | 0 | 0 | 113.1 | D186 H187 N192 L193 E194 | D186-E190 WeakPolarHBondContact O-CG 3.01Å; D186-E190 PolarHBondContact O-N 2.98Å; H187-E190 WeakPolarHBondContact CA-OE2 3.48Å; H187-E190 IonicContact CE1-OE2 3.64Å; H187-E190 PolarHBondContact CE1-OE2 3.29Å; H187-E190 IonicContact CG-OE2 3.37Å; H187-E190 IonicContact ND1-OE2 3.97Å; H187-E190 PolarHBondContact ND1-OE2 2.95Å; E190-N192 PolarHBondContact O-N 2.85Å; E190-L193 PolarHBondContact O-N 2.6Å; E190-E194 PolarHBondContact O-N 2.92Å |
| 191 | S | 61.7 | Low | 70.7 | Confident | 72 Ų | 72 | 114.2 Ų | 114.2 | 50% | 0.503 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.4 | -21.2 | 176.6 | 69.8 | 0 | 0 | 0 | 0 | 114.5 | K188 E189 | K188-S191 PolarHBondContact O-OG 3.31Å; E189-S191 VanDerWaalsContact C-N 3.32Å; E189-S191 PolarHBondContact O-N 2.73Å |
| 192 | N | 59.7 | Low | 68 | Low | 101 Ų | 101 | 116.9 Ų | 116.9 | 54% | 0.54 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -91.9 | -22.7 | 175.8 | -73.6 | -90.7 | 0 | 0 | 0 | 112.3 | K188 E189 E190 | K188-N192 PolarHBondContact O-ND2 2.8Å; E189-N192 PolarHBondContact O-N 2.82Å; E190-N192 PolarHBondContact O-N 2.85Å |
| 193 | L | 63.3 | Low | 65.3 | Low | 113 Ų | 113 | 116.6 Ų | 116.6 | 59% | 0.592 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -82.3 | -32.7 | 178.5 | -89.1 | 87.2 | 0 | 0 | 0 | 113 | E189 E190 E195 M196 | E189-L193 WeakPolarHBondContact O-CD1 3.22Å; E189-L193 PolarHBondContact O-N 2.84Å; E190-L193 PolarHBondContact O-N 2.6Å; L193-E195 VanDerWaalsContact C-N 3.35Å; L193-M196 PolarHBondContact O-N 2.96Å |
| 194 | E | 59 | Low | 63.1 | Low | 105 Ų | 105 | 121.4 Ų | 121.4 | 49% | 0.491 | 61% | 0.611 | S | S | . | * | G | 310 helix | trans | -71.7 | -27.1 | -179.3 | -65.8 | -58.7 | 132.1 | 0 | 0 | 112.7 | E190 M196 K197 | E190-E194 PolarHBondContact O-N 2.92Å; E194-M196 PolarHBondContact O-N 3.27Å; E194-K197 PolarHBondContact O-N 3.21Å; E194-K197 VanDerWaalsContact O-N 3.14Å; E194-K197 IonicContact OE1-NZ 3.82Å; E194-K197 PolarHBondContact OE1-NZ 3.32Å; E194-K197 IonicContact OE2-NZ 2.8Å |
| 195 | E | 57.3 | Low | 60.5 | Low | 159 Ų | 159 | 120.6 Ų | 120.6 | 74% | 0.743 | 62% | 0.621 | S | S | * | * | G | 310 helix | trans | -61 | -27.5 | 169.6 | -73.8 | -172.5 | 155.6 | 0 | 0 | 112.8 | L193 | L193-E195 VanDerWaalsContact C-N 3.35Š|
| 196 | M | 58.8 | Low | 58.5 | Low | 170 Ų | 170 | 119.5 Ų | 119.5 | 84% | 0.837 | 64% | 0.635 | S | S | * | * | G | 310 helix | trans | -82.5 | -12.5 | 177 | -99.7 | 179.8 | 68.6 | 0 | 0 | 114.4 | L193 E194 | L193-M196 PolarHBondContact O-N 2.96Å; E194-M196 PolarHBondContact O-N 3.27Å |
| 197 | K | 56.9 | Low | 56.2 | Low | 143 Ų | 143 | 125.8 Ų | 125.8 | 62% | 0.622 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | -20.3 | 179.2 | -77 | -177.8 | -173.5 | 158.1 | 0 | 114.3 | E194 G199 | E194-K197 PolarHBondContact O-N 3.21Å; E194-K197 VanDerWaalsContact O-N 3.14Å; E194-K197 IonicContact OE1-NZ 3.82Å; E194-K197 PolarHBondContact OE1-NZ 3.32Å; E194-K197 IonicContact OE2-NZ 2.8Å; K197-G199 PolarHBondContact O-N 2.88Å |
| 198 | Q | 53 | Low | 54.3 | Low | 158 Ų | 158 | 125.1 Ų | 125.1 | 74% | 0.738 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 3 | -176.3 | -158.3 | 56.5 | 59.4 | 0 | 0 | 113.6 | ||
| 199 | G | 50.2 | Low | 52.8 | Low | 71 Ų | 71 | 126.9 Ų | 126.9 | 73% | 0.732 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | -6.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | K197 | K197-G199 PolarHBondContact O-N 2.88Š|
| 200 | D | 44.5 | Very low | 52.2 | Low | 130 Ų | 130 | 128.6 Ų | 128.6 | 70% | 0.695 | 72% | 0.716 | S | S | * | * | trans | -130.6 | 61 | -171.7 | -154.3 | 26.3 | 0 | 0 | 0 | 113 | ||||
| 201 | I | 53 | Low | 51.4 | Low | 134 Ų | 134 | 127.5 Ų | 127.5 | 69% | 0.687 | 73% | 0.731 | S | S | * | * | trans | -126.7 | 85.4 | 153.4 | -58.5 | -178.8 | 0 | 0 | 0 | 106.7 | T203 | I201-T203 PolarHBondContact O-N 3.28Š| ||
| 202 | Q | 42.6 | Very low | 50.7 | Low | 169 Ų | 169 | 127.8 Ų | 127.8 | 79% | 0.79 | 75% | 0.746 | S | S | * | * | trans | -73.5 | 97.3 | 164.6 | -65.3 | -177.1 | 14 | 0 | 0 | 108.2 | E204 | Q202-E204 VanDerWaalsContact C-N 3.35Å; Q202-E204 PolarHBondContact O-N 2.95Å; Q202-E204 VanDerWaalsContact O-N 3.16Å | ||
| 203 | T | 39.4 | Very low | 50 | Low | 117 Ų | 117 | 126.3 Ų | 126.3 | 72% | 0.718 | 76% | 0.755 | S | S | * | * | trans | -79 | 93.3 | 161.6 | -56.9 | 0 | 0 | 0 | 0 | 108 | I201 S205 | I201-T203 PolarHBondContact O-N 3.28Å; T203-S205 PolarHBondContact O-N 3.04Å | ||
| 204 | E | 48.5 | Very low | 49.7 | Very low | 177 Ų | 177 | 128.7 Ų | 128.7 | 83% | 0.827 | 77% | 0.768 | S | S | * | * | trans | -61.2 | 115.7 | 161 | 60.6 | -166.1 | 133.1 | 0 | 0 | 109.4 | Q202 | Q202-E204 VanDerWaalsContact C-N 3.35Å; Q202-E204 PolarHBondContact O-N 2.95Å; Q202-E204 VanDerWaalsContact O-N 3.16Å | ||
| 205 | S | 41.8 | Very low | 50.2 | Low | 112 Ų | 112 | 129 Ų | 129 | 78% | 0.783 | 78% | 0.779 | S | S | * | * | trans | -170.4 | 81.5 | 160.9 | -79.8 | 0 | 0 | 0 | 0 | 108.1 | T203 | T203-S205 PolarHBondContact O-N 3.04Š| ||
| 206 | A | 52.5 | Low | 49.9 | Very low | 100 Ų | 100 | 126.3 Ų | 126.3 | 83% | 0.826 | 78% | 0.784 | S | S | * | * | trans | -84.6 | 109.7 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 207 | D | 43.4 | Very low | 49.9 | Very low | 173 Ų | 173 | 125.2 Ų | 125.2 | 93% | 0.925 | 78% | 0.777 | S | S | * | * | trans | -149.6 | 122.9 | 152.4 | -92.1 | -40.1 | 0 | 0 | 0 | 106.7 | ||||
| 208 | G | 44 | Very low | 50.6 | Low | 75 Ų | 75 | 124 Ų | 124 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | trans | -116.3 | 144.7 | -172.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 209 | E | 45.6 | Very low | 50.9 | Low | 190 Ų | 190 | 123.8 Ų | 123.8 | 89% | 0.888 | 78% | 0.781 | S | S | * | * | trans | -147.7 | 116.5 | 167.6 | -112.8 | -105.8 | 106.8 | 0 | 0 | 108.4 | ||||
| 210 | P | 55.5 | Low | 51.2 | Low | 130 Ų | 130 | 132.5 Ų | 132.5 | 84% | 0.844 | 81% | 0.809 | S | S | * | * | trans | -108.5 | 105.7 | 174.2 | 34.7 | -25 | 0 | 0 | 0 | 112 | ||||
| 211 | G | 49.3 | Very low | 51.6 | Low | 78 Ų | 78 | 132.6 Ų | 132.6 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -159.3 | 146.4 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 212 | G | 45.4 | Very low | 51.5 | Low | 78 Ų | 78 | 132.5 Ų | 132.5 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | cis | 154.4 | 102.9 | -2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 213 | G | 46.2 | Very low | 52 | Low | 71 Ų | 71 | 130.5 Ų | 130.5 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | trans | 71.8 | 160.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 214 | D | 57 | Low | 52.7 | Low | 163 Ų | 163 | 131.3 Ų | 131.3 | 87% | 0.872 | 83% | 0.829 | S | S | * | * | cis | -158 | 167.7 | -14.3 | -124.8 | -19.4 | 0 | 0 | 0 | 107.4 | ||||
| 215 | P | 68.3 | Low | 53 | Low | 112 Ų | 112 | 128.4 Ų | 128.4 | 73% | 0.727 | 83% | 0.829 | S | S | * | * | trans | -94.9 | 173.9 | -170.7 | 37.7 | -36.4 | 0 | 0 | 0 | 115.5 | ||||
| 216 | A | 52.6 | Low | 53.7 | Low | 102 Ų | 102 | 129.5 Ų | 129.5 | 84% | 0.843 | 83% | 0.832 | S | S | * | * | trans | 81.1 | 126.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 217 | E | 59.2 | Low | 53.8 | Low | 146 Ų | 146 | 131.6 Ų | 131.6 | 68% | 0.682 | 83% | 0.833 | S | S | * | * | -159.6 | 151 | 67.4 | -133.2 | -167.6 | 165.5 | 0 | 0 | 111.7 | K219 | E217-K219 IonicContact OE1-NZ 3.32Å; E217-K219 PolarHBondContact OE1-NZ 3.44Å; E217-K219 IonicContact OE2-NZ 3.07Å; E217-K219 PolarHBondContact OE2-NZ 2.9Å | |||
| 218 | P | 69.9 | Low | 54.6 | Low | 119 Ų | 119 | 128.5 Ų | 128.5 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | trans | -96.7 | 137.4 | 168.1 | 35.1 | -29.5 | 0 | 0 | 0 | 111.9 | ||||
| 219 | K | 60.8 | Low | 55.5 | Low | 153 Ų | 153 | 132.9 Ų | 132.9 | 67% | 0.665 | 83% | 0.83 | S | S | * | * | trans | -139.3 | 120.8 | 169 | -75 | -171.6 | 168.9 | 125.8 | 0 | 113.7 | E217 | E217-K219 IonicContact OE1-NZ 3.32Å; E217-K219 PolarHBondContact OE1-NZ 3.44Å; E217-K219 IonicContact OE2-NZ 3.07Å; E217-K219 PolarHBondContact OE2-NZ 2.9Å | ||
| 220 | L | 56.2 | Low | 56.4 | Low | 253 Ų | 253 | 127.7 Ų | 127.7 | 100% | 1.325 | 83% | 0.825 | S | S | * | * | trans | 65.1 | 0 | 157.4 | -58.9 | 169.6 | 0 | 0 | 0 | 117.6 |
Retrieved 220 of 220 residues in 496.5 ms
(Link to these results)