| 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 | 40.3 | Very low | 39.4 | Very low | 254 Ų | 254 | 161.2 Ų | 161.2 | 100% | 1.251 | 83% | 0.829 | S | S | * | * | 0 | 123.6 | 0 | -81.4 | 178.2 | 165.4 | 0 | 0 | 108.4 | |||||
| 2 | T | 40.8 | Very low | 38.7 | Very low | 133 Ų | 133 | 161.6 Ų | 161.6 | 82% | 0.816 | 82% | 0.82 | S | S | * | * | trans | -92.8 | 145.1 | -172.9 | 39 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 3 | T | 40.2 | Very low | 38.2 | Very low | 136 Ų | 136 | 157.4 Ų | 157.4 | 83% | 0.834 | 82% | 0.815 | S | S | * | * | trans | 164.4 | 108.5 | 143.6 | 44.6 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 4 | K | 40.6 | Very low | 37.7 | Very low | 195 Ų | 195 | 153.6 Ų | 153.6 | 85% | 0.848 | 82% | 0.818 | S | S | * | * | cis | 52.9 | 101.7 | 49.9 | -152.7 | 174.1 | -169.7 | 169.8 | 0 | 114.1 | ||||
| 5 | N | 43.6 | Very low | 37.2 | Very low | 172 Ų | 172 | 150.1 Ų | 150.1 | 92% | 0.92 | 82% | 0.82 | S | S | * | * | trans | -139.7 | 117.5 | 157.5 | -95.3 | -21.8 | 0 | 0 | 0 | 111.7 | ||||
| 6 | R | 41.6 | Very low | 36.9 | Very low | 184 Ų | 184 | 146.5 Ų | 146.5 | 69% | 0.694 | 82% | 0.816 | S | S | * | * | trans | -121.9 | 149.1 | 160.8 | 166.8 | -178.2 | -177.7 | 172 | 4.4 | 104.5 | ||||
| 7 | P | 50.1 | Low | 36.4 | Very low | 127 Ų | 127 | 144.9 Ų | 144.9 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -117.3 | 143.7 | 145.9 | 14.1 | 5.2 | 0 | 0 | 0 | 112.4 | ||||
| 8 | K | 38.3 | Very low | 36 | Very low | 161 Ų | 161 | 148.3 Ų | 148.3 | 70% | 0.7 | 83% | 0.825 | S | S | * | * | trans | -94.1 | 139.9 | 172.5 | -81.2 | 173 | 167.4 | 178.1 | 0 | 109.1 | ||||
| 9 | N | 33.6 | Very low | 35.6 | Very low | 154 Ų | 154 | 148.7 Ų | 148.7 | 82% | 0.824 | 83% | 0.826 | S | S | * | * | 10.2 | 138.8 | 128.9 | -154.7 | 20.9 | 0 | 0 | 0 | 120.7 | |||||
| 10 | S | 33.9 | Very low | 35.3 | Very low | 91 Ų | 91 | 148.9 Ų | 148.9 | 64% | 0.636 | 83% | 0.825 | S | S | * | * | trans | -172.1 | 118.5 | 138.6 | 57.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 11 | E | 30.1 | Very low | 35.1 | Very low | 166 Ų | 166 | 145.5 Ų | 145.5 | 78% | 0.776 | 82% | 0.816 | S | S | * | * | 86.2 | 147 | 105.9 | -72.5 | -167.4 | 133.5 | 0 | 0 | 113.8 | |||||
| 12 | K | 31.7 | Very low | 34.5 | Very low | 166 Ų | 166 | 138.2 Ų | 138.2 | 72% | 0.722 | 79% | 0.791 | S | S | * | * | cis | 173.9 | 149.8 | 1.1 | 162 | 171.8 | -179.9 | 177.2 | 0 | 108.5 | ||||
| 13 | S | 32.1 | Very low | 34.1 | Very low | 107 Ų | 107 | 141 Ų | 141 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | trans | 72.4 | 147.3 | 160.7 | -69 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 14 | A | 30.3 | Very low | 33.7 | Very low | 104 Ų | 104 | 144.5 Ų | 144.5 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | cis | -155.4 | 170.2 | 14.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 15 | A | 31 | Very low | 33.3 | Very low | 102 Ų | 102 | 140.4 Ų | 140.4 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -85.6 | 163.3 | -174 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 16 | A | 31.9 | Very low | 32.7 | Very low | 92 Ų | 92 | 141.8 Ų | 141.8 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | trans | -163.7 | 109 | 140.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 17 | S | 28.6 | Very low | 32 | Very low | 119 Ų | 119 | 142.5 Ų | 142.5 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | 56 | 107.6 | 94.9 | -72.9 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 18 | Q | 29.7 | Very low | 31 | Very low | 206 Ų | 206 | 142.1 Ų | 142.1 | 96% | 0.963 | 80% | 0.801 | S | S | * | * | -164.2 | 124.5 | 123.3 | -113.3 | 177.8 | -28.6 | 0 | 0 | 110.8 | |||||
| 19 | D | 28.3 | Very low | 30.5 | Very low | 156 Ų | 156 | 138.4 Ų | 138.4 | 83% | 0.834 | 81% | 0.807 | S | S | * | * | trans | -118.9 | 159.4 | 172.6 | -149.3 | -19.8 | 0 | 0 | 0 | 107.5 | ||||
| 20 | D | 28.7 | Very low | 30.1 | Very low | 152 Ų | 152 | 134.9 Ų | 134.9 | 81% | 0.813 | 81% | 0.808 | S | S | * | * | trans | 89.3 | 136.1 | 160.5 | -116.2 | -37.8 | 0 | 0 | 0 | 122.9 | ||||
| 21 | A | 30.9 | Very low | 29.8 | Very low | 78 Ų | 78 | 134.8 Ų | 134.8 | 65% | 0.645 | 81% | 0.813 | S | S | * | * | trans | -88.7 | 166.7 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 22 | S | 29.2 | Very low | 29.8 | Very low | 102 Ų | 102 | 132.7 Ų | 132.7 | 71% | 0.713 | 81% | 0.811 | S | S | * | * | 168.6 | 134.4 | 124.6 | -84 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 23 | K | 31 | Very low | 29.8 | Very low | 190 Ų | 190 | 132.9 Ų | 132.9 | 83% | 0.826 | 82% | 0.82 | S | S | * | * | 76.8 | 108.5 | 129.6 | -69.8 | 175.2 | 179.4 | 170.8 | 0 | 123 | |||||
| 24 | K | 32.1 | Very low | 29.6 | Very low | 211 Ų | 211 | 131.6 Ų | 131.6 | 92% | 0.917 | 82% | 0.824 | S | S | * | * | -19.4 | 131.9 | 127.6 | -173.4 | -179.9 | -171.9 | 176.1 | 0 | 117.2 | |||||
| 25 | S | 32.6 | Very low | 29.5 | Very low | 108 Ų | 108 | 133.2 Ų | 133.2 | 76% | 0.755 | 82% | 0.823 | S | S | * | * | trans | -171.7 | 135.8 | 143.4 | 59.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 26 | Q | 30.2 | Very low | 29.6 | Very low | 201 Ų | 201 | 134.1 Ų | 134.1 | 94% | 0.939 | 82% | 0.823 | S | S | * | * | trans | -169.3 | 106.4 | 134.8 | -112.6 | 176.3 | -36.5 | 0 | 0 | 112.1 | ||||
| 27 | K | 27.3 | Very low | 29.3 | Very low | 199 Ų | 199 | 133.1 Ų | 133.1 | 87% | 0.865 | 82% | 0.822 | S | S | * | * | trans | -161.4 | 136.4 | 143.5 | -169.4 | 169.4 | -178 | 176.2 | 0 | 110.5 | ||||
| 28 | S | 28.6 | Very low | 29.6 | Very low | 120 Ų | 120 | 134.1 Ų | 134.1 | 84% | 0.839 | 83% | 0.825 | S | S | * | * | trans | 125.7 | 141.9 | 141.8 | 75.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 29 | G | 28 | Very low | 29.6 | Very low | 82 Ų | 82 | 127.8 Ų | 127.8 | 85% | 0.845 | 82% | 0.816 | S | S | * | * | trans | 93 | 119.8 | 168 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 30 | G | 26.5 | Very low | 30.4 | Very low | 81 Ų | 81 | 126.6 Ų | 126.6 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | cis | 120 | 113.9 | 17.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 31 | A | 27.5 | Very low | 30.5 | Very low | 89 Ų | 89 | 131.5 Ų | 131.5 | 74% | 0.736 | 82% | 0.824 | S | S | * | * | trans | 162.2 | 121 | 146.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 32 | T | 30.3 | Very low | 30.4 | Very low | 122 Ų | 122 | 131.1 Ų | 131.1 | 75% | 0.748 | 83% | 0.827 | S | S | * | * | trans | 52.1 | 121.6 | 132.8 | 66.4 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 33 | N | 30.6 | Very low | 31.3 | Very low | 169 Ų | 169 | 131.8 Ų | 131.8 | 90% | 0.904 | 83% | 0.829 | S | S | * | * | trans | 155.9 | 138.3 | 134.7 | -80.8 | -14.3 | 0 | 0 | 0 | 107.7 | ||||
| 34 | G | 27.8 | Very low | 31.2 | Very low | 81 Ų | 81 | 134 Ų | 134 | 84% | 0.835 | 83% | 0.832 | S | S | * | * | cis | -179.7 | 150.2 | 4.8 | 0 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 35 | V | 27.9 | Very low | 31.4 | Very low | 138 Ų | 138 | 129.9 Ų | 129.9 | 84% | 0.836 | 83% | 0.83 | S | S | * | * | trans | -116.1 | 151.3 | -175 | 88.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 36 | S | 33.1 | Very low | 31.2 | Very low | 120 Ų | 120 | 128.2 Ų | 128.2 | 84% | 0.839 | 83% | 0.83 | S | S | * | * | trans | 98.6 | 132 | 155.9 | -66.8 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 37 | G | 27.4 | Very low | 31.6 | Very low | 72 Ų | 72 | 124.5 Ų | 124.5 | 74% | 0.742 | 83% | 0.826 | S | S | * | * | trans | 133.3 | 128.4 | 150.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 38 | P | 33.4 | Very low | 32.4 | Very low | 139 Ų | 139 | 120.3 Ų | 120.3 | 90% | 0.903 | 82% | 0.821 | S | S | * | * | -138.7 | 166.4 | 57.9 | 33.1 | -12.7 | 0 | 0 | 0 | 116.4 | |||||
| 39 | G | 29.8 | Very low | 33.1 | Very low | 74 Ų | 74 | 122.8 Ų | 122.8 | 76% | 0.763 | 82% | 0.824 | S | S | * | * | trans | -93.9 | -169.7 | -167.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 40 | P | 46.6 | Very low | 33.9 | Very low | 131 Ų | 131 | 121.6 Ų | 121.6 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | trans | -105.9 | 160 | -159.5 | 38.9 | -32.2 | 0 | 0 | 0 | 114.9 | ||||
| 41 | R | 30.6 | Very low | 35.1 | Very low | 254 Ų | 254 | 123.9 Ų | 123.9 | 96% | 0.958 | 80% | 0.804 | S | S | * | * | trans | -156.8 | 121.7 | 160.2 | -119.4 | 178.9 | 179.9 | -158.3 | 0.1 | 110.4 | ||||
| 42 | G | 28.2 | Very low | 36.3 | Very low | 70 Ų | 70 | 126.7 Ų | 126.7 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | trans | -87.4 | -160 | 162.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 43 | P | 48.5 | Very low | 37.5 | Very low | 116 Ų | 116 | 126.5 Ų | 126.5 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | cis | -144.2 | -179.2 | 0.8 | 42.6 | -23.4 | 0 | 0 | 0 | 116.7 | ||||
| 44 | R | 28.7 | Very low | 38.5 | Very low | 237 Ų | 237 | 122.7 Ų | 122.7 | 89% | 0.894 | 78% | 0.784 | S | S | * | * | trans | 71.7 | 120.1 | 149.2 | -79.3 | 175.7 | 147.8 | 142.7 | -1.2 | 121.8 | ||||
| 45 | S | 35.3 | Very low | 39.9 | Very low | 124 Ų | 124 | 121.3 Ų | 121.3 | 87% | 0.867 | 77% | 0.765 | S | S | * | * | 143 | 124.6 | 109.8 | -164.4 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 46 | G | 30 | Very low | 41.4 | Very low | 73 Ų | 73 | 119.6 Ų | 119.6 | 75% | 0.753 | 75% | 0.754 | S | S | * | * | trans | 91.8 | 114.2 | 135.7 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 47 | S | 36.8 | Very low | 42.7 | Very low | 123 Ų | 123 | 120.2 Ų | 120.2 | 86% | 0.86 | 74% | 0.742 | S | S | * | * | trans | 100.5 | 105.6 | 141.8 | -139.9 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 48 | C | 44.7 | Very low | 44.2 | Very low | 111 Ų | 111 | 123.4 Ų | 123.4 | 75% | 0.75 | 73% | 0.733 | S | S | * | * | trans | -81.4 | 117 | 174.9 | -60.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 49 | L | 44.5 | Very low | 45.6 | Very low | 173 Ų | 173 | 119.8 Ų | 119.8 | 91% | 0.906 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -177.4 | -6.6 | 141 | -118.7 | 117.1 | 0 | 0 | 0 | 114.1 | ||
| 50 | G | 44 | Very low | 47.1 | Very low | 57 Ų | 57 | 119.1 Ų | 119.1 | 59% | 0.588 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -97.8 | -7.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | N54 | G50-N54 WeakPolarHBondContact O-CB 3.47Å; G50-N54 PolarHBondContact O-N 3.13Å |
| 51 | L | 50.9 | Low | 47.9 | Very low | 129 Ų | 129 | 118 Ų | 118 | 68% | 0.675 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -78.4 | -29.2 | -168.1 | -108.1 | 150.3 | 0 | 0 | 0 | 114.2 | A55 | L51-A55 WeakPolarHBondContact O-CB 3.37Å; L51-A55 PolarHBondContact O-N 3.46Å |
| 52 | L | 52.5 | Low | 49.6 | Very low | 148 Ų | 148 | 111.6 Ų | 111.6 | 78% | 0.775 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -75.2 | -41.4 | -177.9 | -81.6 | 160.2 | 0 | 0 | 0 | 112.6 | V56 | L52-V56 VanDerWaalsContact O-CG2 3.28Å; L52-V56 WeakPolarHBondContact O-CG2 3.49Å; L52-V56 PolarHBondContact O-N 3.32Å; L52-V56 VanDerWaalsContact O-N 3.12Å |
| 53 | V | 56.1 | Low | 51.1 | Low | 118 Ų | 118 | 110.4 Ų | 110.4 | 72% | 0.715 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -70.6 | -39.2 | 178 | 178.3 | 0 | 0 | 0 | 0 | 111 | F57 | V53-F57 WeakPolarHBondContact O-CB 3.25Å; V53-F57 PolarHBondContact O-N 2.82Å; V53-F57 VanDerWaalsContact O-N 3.1Å |
| 54 | N | 52.4 | Low | 51.6 | Low | 88 Ų | 88 | 107.7 Ų | 107.7 | 47% | 0.471 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -72 | -39.4 | 178.1 | -143.9 | 17.1 | 0 | 0 | 0 | 111.5 | G50 F57 Y58 | G50-N54 WeakPolarHBondContact O-CB 3.47Å; G50-N54 PolarHBondContact O-N 3.13Å; N54-F57 PolarHBondContact O-N 2.89Å; N54-Y58 WeakPolarHBondContact O-CD2 3.27Å; N54-Y58 PolarHBondContact O-N 3.4Å; N54-Y58 WeakPolarHBondContact OD1-CE2 3.44Å |
| 55 | A | 55.7 | Low | 53.2 | Low | 53 Ų | 53 | 99.2 Ų | 99.2 | 44% | 0.438 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -65.4 | -38.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L51 A59 | L51-A55 WeakPolarHBondContact O-CB 3.37Å; L51-A55 PolarHBondContact O-N 3.46Å; A55-A59 WeakPolarHBondContact O-CB 3.05Å; A55-A59 PolarHBondContact O-N 3.44Å |
| 56 | V | 60.7 | Low | 54.2 | Low | 101 Ų | 101 | 95.2 Ų | 95.2 | 61% | 0.612 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -68.6 | -39.3 | 175.4 | 174.9 | 0 | 0 | 0 | 0 | 111 | L52 A59 A60 | L52-V56 VanDerWaalsContact O-CG2 3.28Å; L52-V56 WeakPolarHBondContact O-CG2 3.49Å; L52-V56 PolarHBondContact O-N 3.32Å; L52-V56 VanDerWaalsContact O-N 3.12Å; V56-A59 PolarHBondContact O-N 2.78Å; V56-A60 WeakPolarHBondContact O-CB 3.29Å; V56-A60 PolarHBondContact O-N 2.94Å |
| 57 | F | 59.2 | Low | 55.7 | Low | 133 Ų | 133 | 98.7 Ų | 98.7 | 58% | 0.583 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.7 | -42.2 | 176.5 | -163.5 | -97.8 | 0 | 0 | 0 | 112.4 | V53 N54 A60 M61 | V53-F57 WeakPolarHBondContact O-CB 3.25Å; V53-F57 PolarHBondContact O-N 2.82Å; V53-F57 VanDerWaalsContact O-N 3.1Å; N54-F57 PolarHBondContact O-N 2.89Å; F57-A60 PolarHBondContact O-N 3.43Å; F57-M61 HydrophobicContact CD1-CG 4.12Å; F57-M61 HydrophobicContact CE1-CG 3.95Å; F57-M61 HydrophobicContact CZ-CG 4.49Å; F57-M61 WeakPolarHBondContact O-CB 3.49Å; F57-M61 WeakPolarHBondContact O-CG 3.42Å; F57-M61 PolarHBondContact O-N 2.91Å |
| 58 | Y | 59.3 | Low | 57 | Low | 140 Ų | 140 | 95.2 Ų | 95.2 | 55% | 0.549 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -68.1 | -37.6 | 173.4 | -83.8 | -75.5 | 0 | 0 | 0 | 112.5 | N54 M61 I62 | N54-Y58 WeakPolarHBondContact O-CD2 3.27Å; N54-Y58 PolarHBondContact O-N 3.4Å; N54-Y58 WeakPolarHBondContact OD1-CE2 3.44Å; Y58-M61 PolarHBondContact O-N 3.23Å; Y58-I62 VanDerWaalsContact O-CB 3.27Å; Y58-I62 WeakPolarHBondContact O-CB 3.21Å; Y58-I62 VanDerWaalsContact O-CD1 3.31Å; Y58-I62 WeakPolarHBondContact O-CD1 3.28Å; Y58-I62 WeakPolarHBondContact O-CG1 3.4Å; Y58-I62 PolarHBondContact O-N 3.29Å |
| 59 | A | 64 | Low | 57.7 | Low | 62 Ų | 62 | 92.3 Ų | 92.3 | 51% | 0.512 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.9 | -39 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A55 V56 G63 | A55-A59 WeakPolarHBondContact O-CB 3.05Å; A55-A59 PolarHBondContact O-N 3.44Å; V56-A59 PolarHBondContact O-N 2.78Å; A59-G63 PolarHBondContact O-N 3.4Å |
| 60 | A | 60.7 | Low | 59 | Low | 60 Ų | 60 | 90 Ų | 90 | 50% | 0.496 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67 | -41.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | V56 F57 G63 A64 | V56-A60 WeakPolarHBondContact O-CB 3.29Å; V56-A60 PolarHBondContact O-N 2.94Å; F57-A60 PolarHBondContact O-N 3.43Å; A60-G63 PolarHBondContact O-N 2.86Å; A60-A64 VanDerWaalsContact O-CB 3.31Å; A60-A64 WeakPolarHBondContact O-CB 3.34Å; A60-A64 PolarHBondContact O-N 2.93Å |
| 61 | M | 63.8 | Low | 60.2 | Low | 108 Ų | 108 | 94.1 Ų | 94.1 | 53% | 0.532 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.8 | -37.7 | 175.4 | -73.6 | -69.2 | -74.9 | 0 | 0 | 112.4 | F57 Y58 A65 | F57-M61 HydrophobicContact CD1-CG 4.12Å; F57-M61 HydrophobicContact CE1-CG 3.95Å; F57-M61 HydrophobicContact CZ-CG 4.49Å; F57-M61 WeakPolarHBondContact O-CB 3.49Å; F57-M61 WeakPolarHBondContact O-CG 3.42Å; F57-M61 PolarHBondContact O-N 2.91Å; Y58-M61 PolarHBondContact O-N 3.23Å; M61-A65 WeakPolarHBondContact O-CB 3.34Å; M61-A65 PolarHBondContact O-N 3.49Å |
| 62 | I | 65.9 | Low | 61.1 | Low | 120 Ų | 120 | 93.6 Ų | 93.6 | 62% | 0.615 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -70 | -37.4 | 175.1 | -68.6 | 163.2 | 0 | 0 | 0 | 110.5 | Y58 G66 | Y58-I62 VanDerWaalsContact O-CB 3.27Å; Y58-I62 WeakPolarHBondContact O-CB 3.21Å; Y58-I62 VanDerWaalsContact O-CD1 3.31Å; Y58-I62 WeakPolarHBondContact O-CD1 3.28Å; Y58-I62 WeakPolarHBondContact O-CG1 3.4Å; Y58-I62 PolarHBondContact O-N 3.29Å; I62-G66 PolarHBondContact O-N 3.09Å |
| 63 | G | 59.6 | Low | 61.5 | Low | 44 Ų | 44 | 92.6 Ų | 92.6 | 45% | 0.454 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.5 | -46.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A59 A60 G66 F67 | A59-G63 PolarHBondContact O-N 3.4Å; A60-G63 PolarHBondContact O-N 2.86Å; G63-G66 PolarHBondContact O-N 3.14Å; G63-F67 PolarHBondContact O-N 3.36Å |
| 64 | A | 58.8 | Low | 62.2 | Low | 59 Ų | 59 | 91.1 Ų | 91.1 | 49% | 0.488 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.2 | -41.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A60 F67 A68 | A60-A64 VanDerWaalsContact O-CB 3.31Å; A60-A64 WeakPolarHBondContact O-CB 3.34Å; A60-A64 PolarHBondContact O-N 2.93Å; A64-F67 PolarHBondContact O-N 3.49Å; A64-A68 WeakPolarHBondContact O-CB 3.47Å; A64-A68 PolarHBondContact O-N 2.85Å |
| 65 | A | 61.5 | Low | 63 | Low | 60 Ų | 60 | 90.8 Ų | 90.8 | 50% | 0.496 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.3 | -36.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | M61 A69 | M61-A65 WeakPolarHBondContact O-CB 3.34Å; M61-A65 PolarHBondContact O-N 3.49Å; A65-A69 WeakPolarHBondContact O-CB 3.26Å; A65-A69 PolarHBondContact O-N 2.82Å |
| 66 | G | 58 | Low | 63.7 | Low | 40 Ų | 40 | 91 Ų | 91 | 41% | 0.412 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.3 | -41.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | I62 G63 A69 F70 | I62-G66 PolarHBondContact O-N 3.09Å; G63-G66 PolarHBondContact O-N 3.14Å; G66-A69 PolarHBondContact O-N 3.28Å; G66-F70 WeakPolarHBondContact O-CB 3.22Å; G66-F70 PolarHBondContact O-N 3.31Å |
| 67 | F | 61 | Low | 64 | Low | 146 Ų | 146 | 91.8 Ų | 91.8 | 64% | 0.64 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -70.2 | -39.4 | 177.1 | -131.9 | -96.1 | 0 | 0 | 0 | 112.2 | G63 A64 F70 Y71 | G63-F67 PolarHBondContact O-N 3.36Å; A64-F67 PolarHBondContact O-N 3.49Å; F67-F70 PolarHBondContact O-N 2.88Å; F67-Y71 HydrophobicContact CD1-CD2 4.11Å; F67-Y71 HydrophobicContact CD1-CE2 4.1Å; F67-Y71 HydrophobicContact CE1-CD2 4.33Å; F67-Y71 AromaticContact CE1-CE2 3.88Å; F67-Y71 HydrophobicContact CE1-CE2 3.88Å; F67-Y71 PolarHBondContact O-N 3.1Å |
| 68 | A | 63.2 | Low | 64.1 | Low | 50 Ų | 50 | 89.1 Ų | 89.1 | 41% | 0.413 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.4 | -40.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | A64 F70 Y71 L72 | A64-A68 WeakPolarHBondContact O-CB 3.47Å; A64-A68 PolarHBondContact O-N 2.85Å; A68-F70 VanDerWaalsContact C-N 3.34Å; A68-Y71 PolarHBondContact O-N 3.18Å; A68-L72 VanDerWaalsContact O-CB 3.32Å; A68-L72 WeakPolarHBondContact O-CB 3.35Å; A68-L72 WeakPolarHBondContact O-CD1 3.28Å; A68-L72 WeakPolarHBondContact O-CG 3.47Å; A68-L72 PolarHBondContact O-N 3.12Å |
| 69 | A | 60.3 | Low | 64.3 | Low | 49 Ų | 49 | 86.5 Ų | 86.5 | 41% | 0.405 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.5 | -38.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | A65 G66 Q73 | A65-A69 WeakPolarHBondContact O-CB 3.26Å; A65-A69 PolarHBondContact O-N 2.82Å; G66-A69 PolarHBondContact O-N 3.28Å; A69-Q73 WeakPolarHBondContact O-CB 3.42Å; A69-Q73 PolarHBondContact O-N 2.91Å |
| 70 | F | 72.3 | Confident | 64.2 | Low | 124 Ų | 124 | 91.9 Ų | 91.9 | 54% | 0.544 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.9 | -44.8 | 175.4 | -173.2 | -98.2 | 0 | 0 | 0 | 112.1 | G66 F67 A68 Q73 Q74 | G66-F70 WeakPolarHBondContact O-CB 3.22Å; G66-F70 PolarHBondContact O-N 3.31Å; F67-F70 PolarHBondContact O-N 2.88Å; A68-F70 VanDerWaalsContact C-N 3.34Å; F70-Q73 PolarHBondContact O-N 3.19Å; F70-Q74 VanDerWaalsContact O-CB 3.31Å; F70-Q74 WeakPolarHBondContact O-CB 3.49Å; F70-Q74 PolarHBondContact O-N 3.34Å |
| 71 | Y | 68.1 | Low | 64.1 | Low | 145 Ų | 145 | 95 Ų | 95 | 57% | 0.569 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.6 | -41.8 | 175.3 | -98.4 | -90.7 | 0 | 0 | 0 | 112.9 | F67 A68 Q73 Q74 V75 | F67-Y71 HydrophobicContact CD1-CD2 4.11Å; F67-Y71 HydrophobicContact CD1-CE2 4.1Å; F67-Y71 HydrophobicContact CE1-CD2 4.33Å; F67-Y71 AromaticContact CE1-CE2 3.88Å; F67-Y71 HydrophobicContact CE1-CE2 3.88Å; F67-Y71 PolarHBondContact O-N 3.1Å; A68-Y71 PolarHBondContact O-N 3.18Å; Y71-Q73 VanDerWaalsContact C-N 3.28Å; Y71-Q73 PolarHBondContact O-N 2.86Å; Y71-Q74 PolarHBondContact O-N 3.38Å; Y71-V75 WeakPolarHBondContact O-CB 3.28Å; Y71-V75 VanDerWaalsContact O-CG2 3.26Å; Y71-V75 WeakPolarHBondContact O-CG2 3.22Å; Y71-V75 PolarHBondContact O-N 2.98Å |
| 72 | L | 69.9 | Low | 64.1 | Low | 118 Ų | 118 | 95 Ų | 95 | 62% | 0.618 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.5 | -36.3 | 173.1 | -83.7 | 155.2 | 0 | 0 | 0 | 111.3 | A68 V76 | A68-L72 VanDerWaalsContact O-CB 3.32Å; A68-L72 WeakPolarHBondContact O-CB 3.35Å; A68-L72 WeakPolarHBondContact O-CD1 3.28Å; A68-L72 WeakPolarHBondContact O-CG 3.47Å; A68-L72 PolarHBondContact O-N 3.12Å; L72-V76 WeakPolarHBondContact O-CB 3.36Å; L72-V76 WeakPolarHBondContact O-CG2 3.31Å; L72-V76 PolarHBondContact O-N 2.88Å |
| 73 | Q | 60.8 | Low | 63.5 | Low | 126 Ų | 126 | 95.7 Ų | 95.7 | 59% | 0.589 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -75.4 | -31 | 178.9 | -166.8 | 160.8 | -26.6 | 0 | 0 | 112.3 | A69 F70 Y71 Q77 | A69-Q73 WeakPolarHBondContact O-CB 3.42Å; A69-Q73 PolarHBondContact O-N 2.91Å; F70-Q73 PolarHBondContact O-N 3.19Å; Y71-Q73 VanDerWaalsContact C-N 3.28Å; Y71-Q73 PolarHBondContact O-N 2.86Å; Q73-Q77 WeakPolarHBondContact O-CB 3.08Å; Q73-Q77 VanDerWaalsContact O-CG 3.32Å; Q73-Q77 WeakPolarHBondContact O-CG 3.34Å; Q73-Q77 PolarHBondContact O-N 3.4Å |
| 74 | Q | 70.7 | Confident | 63.3 | Low | 87 Ų | 87 | 95.8 Ų | 95.8 | 41% | 0.407 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -73.9 | -43.7 | 173.4 | -169.2 | 152.8 | -10.9 | 0 | 0 | 111.5 | F70 Y71 V76 Q77 D78 | F70-Q74 VanDerWaalsContact O-CB 3.31Å; F70-Q74 WeakPolarHBondContact O-CB 3.49Å; F70-Q74 PolarHBondContact O-N 3.34Å; Y71-Q74 PolarHBondContact O-N 3.38Å; Q74-V76 VanDerWaalsContact C-N 3.34Å; Q74-V76 PolarHBondContact O-N 2.81Å; Q74-Q77 PolarHBondContact O-N 2.87Å; Q74-Q77 VanDerWaalsContact O-N 3.17Å; Q74-D78 WeakPolarHBondContact O-CB 3.46Å; Q74-D78 PolarHBondContact O-N 3.24Å |
| 75 | V | 70.2 | Confident | 63.2 | Low | 81 Ų | 81 | 99.5 Ų | 99.5 | 49% | 0.491 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.2 | -36.8 | 172.9 | 173.6 | 0 | 0 | 0 | 0 | 111.4 | Y71 V79 | Y71-V75 WeakPolarHBondContact O-CB 3.28Å; Y71-V75 VanDerWaalsContact O-CG2 3.26Å; Y71-V75 WeakPolarHBondContact O-CG2 3.22Å; Y71-V75 PolarHBondContact O-N 2.98Å; V75-V79 HydrophobicContact CG1-CG2 4.3Å; V75-V79 VanDerWaalsContact O-CB 3.27Å; V75-V79 WeakPolarHBondContact O-CB 3.31Å; V75-V79 WeakPolarHBondContact O-CG2 3.35Å; V75-V79 PolarHBondContact O-N 3.25Å |
| 76 | V | 69.6 | Low | 62.9 | Low | 59 Ų | 59 | 103.2 Ų | 103.2 | 36% | 0.358 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -70.7 | -30.9 | 173.9 | 165.6 | 0 | 0 | 0 | 0 | 112 | L72 Q74 R80 | L72-V76 WeakPolarHBondContact O-CB 3.36Å; L72-V76 WeakPolarHBondContact O-CG2 3.31Å; L72-V76 PolarHBondContact O-N 2.88Å; Q74-V76 VanDerWaalsContact C-N 3.34Å; Q74-V76 PolarHBondContact O-N 2.81Å; V76-R80 VanDerWaalsContact O-CB 3.32Å; V76-R80 WeakPolarHBondContact O-CB 3.32Å; V76-R80 WeakPolarHBondContact O-CG 3.11Å; V76-R80 PolarHBondContact O-N 2.9Å |
| 77 | Q | 66.9 | Low | 62.8 | Low | 116 Ų | 116 | 106.8 Ų | 106.8 | 54% | 0.542 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -71.8 | -42.9 | 172.1 | -84 | -178.6 | -15.5 | 0 | 0 | 111.8 | Q73 Q74 R80 Q81 | Q73-Q77 WeakPolarHBondContact O-CB 3.08Å; Q73-Q77 VanDerWaalsContact O-CG 3.32Å; Q73-Q77 WeakPolarHBondContact O-CG 3.34Å; Q73-Q77 PolarHBondContact O-N 3.4Å; Q74-Q77 PolarHBondContact O-N 2.87Å; Q74-Q77 VanDerWaalsContact O-N 3.17Å; Q77-R80 CarbonylContact O-C 3.57Å; Q77-R80 PolarHBondContact O-N 3.48Å; Q77-Q81 WeakPolarHBondContact O-CB 3.27Å; Q77-Q81 PolarHBondContact O-N 2.8Å |
| 78 | D | 61 | Low | 62.4 | Low | 77 Ų | 77 | 104.4 Ų | 104.4 | 41% | 0.412 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65 | -41.1 | 175.5 | -72.2 | -18.2 | 0 | 0 | 0 | 111.2 | Q74 R80 Q81 I82 | Q74-D78 WeakPolarHBondContact O-CB 3.46Å; Q74-D78 PolarHBondContact O-N 3.24Å; D78-R80 PolarHBondContact O-N 2.9Å; D78-Q81 PolarHBondContact O-N 3.37Å; D78-I82 WeakPolarHBondContact O-CB 3.38Å; D78-I82 WeakPolarHBondContact O-CD1 3.44Å; D78-I82 WeakPolarHBondContact O-CG1 3.39Å; D78-I82 PolarHBondContact O-N 2.95Å |
| 79 | V | 64.8 | Low | 62 | Low | 85 Ų | 85 | 104 Ų | 104 | 52% | 0.515 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.6 | -37.1 | 173.5 | 170 | 0 | 0 | 0 | 0 | 111.3 | V75 H83 | V75-V79 HydrophobicContact CG1-CG2 4.3Å; V75-V79 VanDerWaalsContact O-CB 3.27Å; V75-V79 WeakPolarHBondContact O-CB 3.31Å; V75-V79 WeakPolarHBondContact O-CG2 3.35Å; V75-V79 PolarHBondContact O-N 3.25Å; V79-H83 VanDerWaalsContact O-CB 3.27Å; V79-H83 WeakPolarHBondContact O-CB 3.4Å; V79-H83 PolarHBondContact O-N 3.08Å |
| 80 | R | 62 | Low | 61.9 | Low | 175 Ų | 175 | 104.7 Ų | 104.7 | 66% | 0.66 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -70.6 | -32.1 | 173.8 | -79.1 | 175.3 | -178.8 | 147.9 | 2.6 | 112.9 | V76 Q77 D78 H83 A84 | V76-R80 VanDerWaalsContact O-CB 3.32Å; V76-R80 WeakPolarHBondContact O-CB 3.32Å; V76-R80 WeakPolarHBondContact O-CG 3.11Å; V76-R80 PolarHBondContact O-N 2.9Å; Q77-R80 CarbonylContact O-C 3.57Å; Q77-R80 PolarHBondContact O-N 3.48Å; D78-R80 PolarHBondContact O-N 2.9Å; R80-H83 PolarHBondContact O-N 2.87Å; R80-A84 WeakPolarHBondContact O-CB 3.34Å; R80-A84 PolarHBondContact O-N 3.4Å |
| 81 | Q | 58.6 | Low | 61.2 | Low | 125 Ų | 125 | 106.5 Ų | 106.5 | 58% | 0.584 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -73.8 | -37.5 | 176.4 | -168.8 | 166.8 | -4.4 | 0 | 0 | 111.4 | Q77 D78 Q85 | Q77-Q81 WeakPolarHBondContact O-CB 3.27Å; Q77-Q81 PolarHBondContact O-N 2.8Å; D78-Q81 PolarHBondContact O-N 3.37Å; Q81-Q85 PolarHBondContact O-N 3.27Å; Q81-Q85 VanDerWaalsContact O-N 3.11Å |
| 82 | I | 61.9 | Low | 61.1 | Low | 108 Ų | 108 | 106.6 Ų | 106.6 | 55% | 0.554 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -67.9 | -39.9 | 170.1 | -67.4 | 164.4 | 0 | 0 | 0 | 110.5 | D78 Q85 H86 | D78-I82 WeakPolarHBondContact O-CB 3.38Å; D78-I82 WeakPolarHBondContact O-CD1 3.44Å; D78-I82 WeakPolarHBondContact O-CG1 3.39Å; D78-I82 PolarHBondContact O-N 2.95Å; I82-Q85 PolarHBondContact O-N 2.79Å; I82-H86 WeakPolarHBondContact O-CB 3.31Å; I82-H86 PolarHBondContact O-N 3.3Å |
| 83 | H | 54.3 | Low | 60.8 | Low | 135 Ų | 135 | 103 Ų | 103 | 63% | 0.625 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -68.9 | -37 | 177.6 | -137.6 | 23.4 | 0 | 0 | 0 | 112.1 | V79 R80 H86 E87 | V79-H83 VanDerWaalsContact O-CB 3.27Å; V79-H83 WeakPolarHBondContact O-CB 3.4Å; V79-H83 PolarHBondContact O-N 3.08Å; R80-H83 PolarHBondContact O-N 2.87Å; H83-H86 PolarHBondContact O-N 2.83Å; H83-E87 WeakPolarHBondContact O-CB 3.49Å; H83-E87 PolarHBondContact O-N 3.28Å |
| 84 | A | 55.1 | Low | 61 | Low | 47 Ų | 47 | 99.8 Ų | 99.8 | 39% | 0.388 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63 | -39.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | R80 E88 | R80-A84 WeakPolarHBondContact O-CB 3.34Å; R80-A84 PolarHBondContact O-N 3.4Å; A84-E88 WeakPolarHBondContact O-CG 3.47Å; A84-E88 PolarHBondContact O-N 2.8Å; A84-E88 VanDerWaalsContact O-N 3.1Å |
| 85 | Q | 57.2 | Low | 60.8 | Low | 137 Ų | 137 | 100.2 Ų | 100.2 | 64% | 0.64 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -71.6 | -30.8 | 174.1 | -75.2 | -168.7 | -15.6 | 0 | 0 | 113.3 | Q81 I82 G89 | Q81-Q85 PolarHBondContact O-N 3.27Å; Q81-Q85 VanDerWaalsContact O-N 3.11Å; I82-Q85 PolarHBondContact O-N 2.79Å; Q85-G89 PolarHBondContact O-N 2.91Å |
| 86 | H | 54.8 | Low | 60.9 | Low | 137 Ų | 137 | 102 Ų | 102 | 63% | 0.634 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -77.5 | -27.9 | 175.5 | -146.2 | -73 | 0 | 0 | 0 | 112.7 | I82 H83 G89 A90 | I82-H86 WeakPolarHBondContact O-CB 3.31Å; I82-H86 PolarHBondContact O-N 3.3Å; H83-H86 PolarHBondContact O-N 2.83Å; H86-G89 PolarHBondContact O-N 3.08Å; H86-A90 WeakPolarHBondContact O-CB 3.29Å; H86-A90 PolarHBondContact O-N 3.3Å |
| 87 | E | 55.3 | Low | 61.2 | Low | 115 Ų | 115 | 101 Ų | 101 | 54% | 0.537 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -73.8 | -32.9 | 172.2 | -152.1 | 177.5 | -176.7 | 0 | 0 | 111.3 | H83 R91 | H83-E87 WeakPolarHBondContact O-CB 3.49Å; H83-E87 PolarHBondContact O-N 3.28Å; E87-R91 WeakPolarHBondContact O-CB 3.37Å; E87-R91 WeakPolarHBondContact O-CG 3.49Å; E87-R91 PolarHBondContact O-N 3.47Å |
| 88 | E | 53.5 | Low | 61.7 | Low | 97 Ų | 97 | 99 Ų | 99 | 45% | 0.453 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -70.7 | -36.5 | 168.2 | -75.9 | -177.3 | -169.3 | 0 | 0 | 113 | A84 R91 R92 | A84-E88 WeakPolarHBondContact O-CG 3.47Å; A84-E88 PolarHBondContact O-N 2.8Å; A84-E88 VanDerWaalsContact O-N 3.1Å; E88-R91 PolarHBondContact O-N 2.87Å; E88-R92 WeakPolarHBondContact O-CB 3.37Å; E88-R92 VanDerWaalsContact O-CG 3.29Å; E88-R92 WeakPolarHBondContact O-CG 3.3Å; E88-R92 PolarHBondContact O-N 3.24Å; E88-R92 IonicContact OE2-NH2 3.24Å; E88-R92 PolarHBondContact OE2-NH2 3.17Å; E88-R92 VanDerWaalsContact OE2-NH2 3.15Å |
| 89 | G | 55.5 | Low | 62.7 | Low | 41 Ų | 41 | 101 Ų | 101 | 42% | 0.423 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.4 | -41.3 | 173 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q85 H86 R92 G93 | Q85-G89 PolarHBondContact O-N 2.91Å; H86-G89 PolarHBondContact O-N 3.08Å; G89-R92 PolarHBondContact O-N 2.84Å; G89-G93 PolarHBondContact O-N 3.36Å |
| 90 | A | 56.4 | Low | 63.2 | Low | 64 Ų | 64 | 103.1 Ų | 103.1 | 53% | 0.529 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -68.6 | -35.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | H86 A94 | H86-A90 WeakPolarHBondContact O-CB 3.29Å; H86-A90 PolarHBondContact O-N 3.3Å; A90-A94 VanDerWaalsContact O-CB 3.31Å; A90-A94 WeakPolarHBondContact O-CB 3.21Å; A90-A94 PolarHBondContact O-N 2.89Å |
| 91 | R | 59 | Low | 64.1 | Low | 162 Ų | 162 | 100.9 Ų | 100.9 | 61% | 0.611 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -67.7 | -43 | 171.1 | -82.4 | -178.6 | 175.8 | 156.1 | 4.9 | 112.6 | E87 E88 G93 A94 E95 | E87-R91 WeakPolarHBondContact O-CB 3.37Å; E87-R91 WeakPolarHBondContact O-CG 3.49Å; E87-R91 PolarHBondContact O-N 3.47Å; E88-R91 PolarHBondContact O-N 2.87Å; R91-G93 VanDerWaalsContact C-N 3.34Å; R91-A94 PolarHBondContact O-N 3.39Å; R91-E95 WeakPolarHBondContact O-CB 3.44Å; R91-E95 VanDerWaalsContact O-CG 3.29Å; R91-E95 WeakPolarHBondContact O-CG 3.16Å; R91-E95 PolarHBondContact O-N 3.15Å |
| 92 | R | 64.5 | Low | 65.3 | Low | 147 Ų | 147 | 99.6 Ų | 99.6 | 56% | 0.555 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.5 | -35.1 | 174.5 | -74.5 | 178.8 | -163.1 | 147.6 | 15.2 | 112.2 | E88 G89 E95 L96 | E88-R92 WeakPolarHBondContact O-CB 3.37Å; E88-R92 VanDerWaalsContact O-CG 3.29Å; E88-R92 WeakPolarHBondContact O-CG 3.3Å; E88-R92 PolarHBondContact O-N 3.24Å; E88-R92 IonicContact OE2-NH2 3.24Å; E88-R92 PolarHBondContact OE2-NH2 3.17Å; E88-R92 VanDerWaalsContact OE2-NH2 3.15Å; G89-R92 PolarHBondContact O-N 2.84Å; R92-E95 PolarHBondContact O-N 3.18Å; R92-L96 VanDerWaalsContact O-CB 3.27Å; R92-L96 WeakPolarHBondContact O-CB 3.18Å; R92-L96 PolarHBondContact O-N 2.83Å |
| 93 | G | 65 | Low | 66.3 | Low | 41 Ų | 41 | 98.1 Ų | 98.1 | 42% | 0.423 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -68.4 | -38.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113 | G89 R91 L96 G97 | G89-G93 PolarHBondContact O-N 3.36Å; R91-G93 VanDerWaalsContact C-N 3.34Å; G93-L96 PolarHBondContact O-N 2.91Å; G93-G97 PolarHBondContact O-N 3.16Å |
| 94 | A | 64.3 | Low | 67.8 | Low | 59 Ų | 59 | 96.9 Ų | 96.9 | 49% | 0.488 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -70.3 | -36 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A90 R91 T98 | A90-A94 VanDerWaalsContact O-CB 3.31Å; A90-A94 WeakPolarHBondContact O-CB 3.21Å; A90-A94 PolarHBondContact O-N 2.89Å; R91-A94 PolarHBondContact O-N 3.39Å; A94-T98 WeakPolarHBondContact O-CB 3.27Å; A94-T98 VanDerWaalsContact O-CG2 3.25Å; A94-T98 WeakPolarHBondContact O-CG2 3.33Å; A94-T98 PolarHBondContact O-N 3.36Å; A94-T98 PolarHBondContact O-OG1 2.93Å |
| 95 | E | 67.2 | Low | 69.2 | Low | 97 Ų | 97 | 100.8 Ų | 100.8 | 45% | 0.453 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.6 | -37.8 | 172.2 | -77.8 | 178.5 | -161.6 | 0 | 0 | 112.2 | R91 R92 T98 K99 | R91-E95 WeakPolarHBondContact O-CB 3.44Å; R91-E95 VanDerWaalsContact O-CG 3.29Å; R91-E95 WeakPolarHBondContact O-CG 3.16Å; R91-E95 PolarHBondContact O-N 3.15Å; R92-E95 PolarHBondContact O-N 3.18Å; E95-T98 WeakPolarHBondContact CA-OG1 3.42Å; E95-T98 PolarHBondContact O-OG1 2.89Å; E95-T98 VanDerWaalsContact O-OG1 3.11Å; E95-K99 WeakPolarHBondContact O-CB 3.37Å; E95-K99 VanDerWaalsContact O-CD 3.32Å; E95-K99 WeakPolarHBondContact O-CD 3.49Å; E95-K99 WeakPolarHBondContact O-CG 3.44Å; E95-K99 PolarHBondContact O-N 2.87Å; E95-K99 IonicContact OE2-NZ 2.69Å |
| 96 | L | 71.4 | Confident | 70.6 | Confident | 119 Ų | 119 | 100.1 Ų | 100.1 | 62% | 0.623 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -70.3 | -39.8 | 172.7 | -92.6 | 155.3 | 0 | 0 | 0 | 111.4 | R92 G93 K99 M100 | R92-L96 VanDerWaalsContact O-CB 3.27Å; R92-L96 WeakPolarHBondContact O-CB 3.18Å; R92-L96 PolarHBondContact O-N 2.83Å; G93-L96 PolarHBondContact O-N 2.91Å; L96-K99 PolarHBondContact O-N 3.22Å; L96-M100 WeakPolarHBondContact O-CB 3.26Å; L96-M100 PolarHBondContact O-N 3.2Å |
| 97 | G | 76.3 | Confident | 72.2 | Confident | 36 Ų | 36 | 97.8 Ų | 97.8 | 37% | 0.371 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.3 | -47.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | G93 M100 E101 | G93-G97 PolarHBondContact O-N 3.16Å; G97-M100 PolarHBondContact O-N 2.92Å; G97-E101 WeakPolarHBondContact O-CB 3.29Å; G97-E101 PolarHBondContact O-N 3.31Å |
| 98 | T | 77.5 | Confident | 73.5 | Confident | 74 Ų | 74 | 97.9 Ų | 97.9 | 45% | 0.454 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -69.9 | -35.2 | 176.5 | 51 | 0 | 0 | 0 | 0 | 112.8 | A94 E95 N102 | A94-T98 WeakPolarHBondContact O-CB 3.27Å; A94-T98 VanDerWaalsContact O-CG2 3.25Å; A94-T98 WeakPolarHBondContact O-CG2 3.33Å; A94-T98 PolarHBondContact O-N 3.36Å; A94-T98 PolarHBondContact O-OG1 2.93Å; E95-T98 WeakPolarHBondContact CA-OG1 3.42Å; E95-T98 PolarHBondContact O-OG1 2.89Å; E95-T98 VanDerWaalsContact O-OG1 3.11Å; T98-N102 VanDerWaalsContact O-CB 3.26Å; T98-N102 WeakPolarHBondContact O-CB 3.48Å; T98-N102 VanDerWaalsContact O-CG 3.25Å; T98-N102 PolarHBondContact O-N 3.24Å; T98-N102 PolarHBondContact O-ND2 2.82Å |
| 99 | K | 81.4 | Confident | 74.9 | Confident | 120 Ų | 120 | 95.7 Ų | 95.7 | 52% | 0.522 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.9 | -42 | 171.4 | -75.4 | 167.5 | -172 | 168 | 0 | 111.7 | E95 L96 N102 V103 | E95-K99 WeakPolarHBondContact O-CB 3.37Å; E95-K99 VanDerWaalsContact O-CD 3.32Å; E95-K99 WeakPolarHBondContact O-CD 3.49Å; E95-K99 WeakPolarHBondContact O-CG 3.44Å; E95-K99 PolarHBondContact O-N 2.87Å; E95-K99 IonicContact OE2-NZ 2.69Å; L96-K99 PolarHBondContact O-N 3.22Å; K99-N102 PolarHBondContact O-N 3.39Å; K99-V103 WeakPolarHBondContact O-CB 3.39Å; K99-V103 VanDerWaalsContact O-CG2 3.26Å; K99-V103 WeakPolarHBondContact O-CG2 3.46Å; K99-V103 PolarHBondContact O-N 2.86Å |
| 100 | M | 76.6 | Confident | 76.2 | Confident | 130 Ų | 130 | 99 Ų | 99 | 64% | 0.64 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.2 | -41.6 | 176.2 | -172.6 | 92.6 | 112.7 | 0 | 0 | 111 | L96 G97 V103 L104 | L96-M100 WeakPolarHBondContact O-CB 3.26Å; L96-M100 PolarHBondContact O-N 3.2Å; G97-M100 PolarHBondContact O-N 2.92Å; M100-V103 PolarHBondContact O-N 3.47Å; M100-L104 HydrophobicContact CG-CD1 4.41Å; M100-L104 WeakPolarHBondContact O-CB 3.46Å; M100-L104 VanDerWaalsContact O-CG 3.31Å; M100-L104 WeakPolarHBondContact O-CG 3.46Å; M100-L104 PolarHBondContact O-N 2.78Å |
| 101 | E | 81.3 | Confident | 77.7 | Confident | 127 Ų | 127 | 103.1 Ų | 103.1 | 59% | 0.593 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -69.1 | -36.3 | 177.2 | -164.7 | 159.4 | -160.1 | 0 | 0 | 111.5 | G97 L104 Q105 | G97-E101 WeakPolarHBondContact O-CB 3.29Å; G97-E101 PolarHBondContact O-N 3.31Å; E101-L104 PolarHBondContact O-N 3.48Å; E101-Q105 WeakPolarHBondContact O-CB 3.36Å; E101-Q105 PolarHBondContact O-N 2.86Å |
| 102 | N | 82.9 | Confident | 79.1 | Confident | 99 Ų | 99 | 98.9 Ų | 98.9 | 53% | 0.529 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.3 | -40.6 | 168.8 | -82.3 | -17.2 | 0 | 0 | 0 | 112.3 | T98 K99 Q105 Q106 | T98-N102 VanDerWaalsContact O-CB 3.26Å; T98-N102 WeakPolarHBondContact O-CB 3.48Å; T98-N102 VanDerWaalsContact O-CG 3.25Å; T98-N102 PolarHBondContact O-N 3.24Å; T98-N102 PolarHBondContact O-ND2 2.82Å; K99-N102 PolarHBondContact O-N 3.39Å; N102-Q105 PolarHBondContact O-N 2.93Å; N102-Q106 WeakPolarHBondContact O-CB 3.32Å; N102-Q106 PolarHBondContact O-N 3.41Å |
| 103 | V | 83.3 | Confident | 80.2 | Confident | 76 Ų | 76 | 96.6 Ų | 96.6 | 46% | 0.461 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.8 | -41.2 | 175.8 | 167.4 | 0 | 0 | 0 | 0 | 110.7 | K99 M100 Q106 V107 | K99-V103 WeakPolarHBondContact O-CB 3.39Å; K99-V103 VanDerWaalsContact O-CG2 3.26Å; K99-V103 WeakPolarHBondContact O-CG2 3.46Å; K99-V103 PolarHBondContact O-N 2.86Å; M100-V103 PolarHBondContact O-N 3.47Å; V103-Q106 CarbonylContact O-C 3.58Å; V103-Q106 WeakPolarHBondContact O-CB 3.44Å; V103-Q106 PolarHBondContact O-N 2.98Å; V103-Q106 VanDerWaalsContact O-N 3.14Å; V103-V107 HydrophobicContact CG1-CG2 4.49Å; V103-V107 WeakPolarHBondContact O-CG2 3.44Å; V103-V107 PolarHBondContact O-N 3.33Å |
| 104 | L | 84.2 | Confident | 81.3 | Confident | 109 Ų | 109 | 98.5 Ų | 98.5 | 57% | 0.571 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.7 | -42.8 | 174.2 | -74.8 | 171.6 | 0 | 0 | 0 | 111.2 | M100 E101 Q106 V107 E108 | M100-L104 HydrophobicContact CG-CD1 4.41Å; M100-L104 WeakPolarHBondContact O-CB 3.46Å; M100-L104 VanDerWaalsContact O-CG 3.31Å; M100-L104 WeakPolarHBondContact O-CG 3.46Å; M100-L104 PolarHBondContact O-N 2.78Å; E101-L104 PolarHBondContact O-N 3.48Å; L104-Q106 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 3.28Å; L104-V107 PolarHBondContact O-N 2.73Å; L104-E108 WeakPolarHBondContact O-CB 3.04Å; L104-E108 PolarHBondContact O-N 3.41Å |
| 105 | Q | 84.8 | Confident | 82.3 | Confident | 129 Ų | 129 | 99.6 Ų | 99.6 | 60% | 0.603 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.4 | -36.9 | 170.6 | -92.5 | -177.5 | -10.6 | 0 | 0 | 112.3 | E101 N102 E108 S109 | E101-Q105 WeakPolarHBondContact O-CB 3.36Å; E101-Q105 PolarHBondContact O-N 2.86Å; N102-Q105 PolarHBondContact O-N 2.93Å; Q105-E108 PolarHBondContact O-N 3.44Å; Q105-S109 VanDerWaalsContact O-CB 3.26Å; Q105-S109 WeakPolarHBondContact O-CB 3.34Å; Q105-S109 PolarHBondContact O-N 2.86Å; Q105-S109 PolarHBondContact O-OG 2.93Å |
| 106 | Q | 87.8 | Confident | 83.2 | Confident | 124 Ų | 124 | 96.9 Ų | 96.9 | 58% | 0.579 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -66.1 | -42.4 | 176.6 | -126.2 | 177.5 | -6.3 | 0 | 0 | 111.2 | N102 V103 L104 S109 L110 | N102-Q106 WeakPolarHBondContact O-CB 3.32Å; N102-Q106 PolarHBondContact O-N 3.41Å; V103-Q106 CarbonylContact O-C 3.58Å; V103-Q106 WeakPolarHBondContact O-CB 3.44Å; V103-Q106 PolarHBondContact O-N 2.98Å; V103-Q106 VanDerWaalsContact O-N 3.14Å; L104-Q106 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 3.28Å; Q106-S109 PolarHBondContact O-N 3.41Å; Q106-S109 PolarHBondContact O-OG 3.42Å; Q106-L110 WeakPolarHBondContact O-CB 3.49Å; Q106-L110 PolarHBondContact O-N 2.92Å |
| 107 | V | 87 | Confident | 83.8 | Confident | 88 Ų | 88 | 96.6 Ų | 96.6 | 53% | 0.533 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.9 | -41.4 | 175.7 | 171.3 | 0 | 0 | 0 | 0 | 111 | V103 L104 S109 L110 R111 | V103-V107 HydrophobicContact CG1-CG2 4.49Å; V103-V107 WeakPolarHBondContact O-CG2 3.44Å; V103-V107 PolarHBondContact O-N 3.33Å; L104-V107 PolarHBondContact O-N 2.73Å; V107-S109 VanDerWaalsContact C-N 3.32Å; V107-S109 PolarHBondContact O-N 3.5Å; V107-L110 PolarHBondContact O-N 2.85Å; V107-R111 VanDerWaalsContact O-CB 3.23Å; V107-R111 WeakPolarHBondContact O-CB 3.32Å; V107-R111 PolarHBondContact O-N 2.97Å |
| 108 | E | 84.5 | Confident | 84.3 | Confident | 116 Ų | 116 | 101.2 Ų | 101.2 | 54% | 0.542 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.3 | -37.8 | 174.6 | -158.7 | 70.5 | -135.7 | 0 | 0 | 111 | L104 Q105 R111 S112 | L104-E108 WeakPolarHBondContact O-CB 3.04Å; L104-E108 PolarHBondContact O-N 3.41Å; Q105-E108 PolarHBondContact O-N 3.44Å; E108-R111 PolarHBondContact O-N 2.91Å; E108-S112 WeakPolarHBondContact O-CB 3.31Å; E108-S112 PolarHBondContact O-N 3.36Å |
| 109 | S | 81.3 | Confident | 84.5 | Confident | 52 Ų | 52 | 101.5 Ų | 101.5 | 36% | 0.364 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -69.3 | -37.9 | 173.9 | 81.6 | 0 | 0 | 0 | 0 | 112.3 | Q105 Q106 V107 S112 N113 | Q105-S109 VanDerWaalsContact O-CB 3.26Å; Q105-S109 WeakPolarHBondContact O-CB 3.34Å; Q105-S109 PolarHBondContact O-N 2.86Å; Q105-S109 PolarHBondContact O-OG 2.93Å; Q106-S109 PolarHBondContact O-N 3.41Å; Q106-S109 PolarHBondContact O-OG 3.42Å; V107-S109 VanDerWaalsContact C-N 3.32Å; V107-S109 PolarHBondContact O-N 3.5Å; S109-S112 PolarHBondContact O-N 2.87Å; S109-N113 WeakPolarHBondContact O-CB 3.35Å; S109-N113 PolarHBondContact O-N 2.96Å; S109-N113 PolarHBondContact O-ND2 2.97Å; S109-N113 PolarHBondContact O-OD1 2.86Å |
| 110 | L | 83.1 | Confident | 84.5 | Confident | 110 Ų | 110 | 98.4 Ų | 98.4 | 58% | 0.576 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66.1 | -43.1 | 174.7 | -123.2 | 84.4 | 0 | 0 | 0 | 110.1 | Q106 V107 N113 V114 | Q106-L110 WeakPolarHBondContact O-CB 3.49Å; Q106-L110 PolarHBondContact O-N 2.92Å; V107-L110 PolarHBondContact O-N 2.85Å; L110-N113 CarbonylContact O-C 3.52Å; L110-N113 PolarHBondContact O-N 3.36Å; L110-V114 WeakPolarHBondContact O-CB 3.4Å; L110-V114 VanDerWaalsContact O-CG2 3.24Å; L110-V114 WeakPolarHBondContact O-CG2 3.42Å; L110-V114 PolarHBondContact O-N 2.78Å |
| 111 | R | 89.4 | Confident | 84.9 | Confident | 150 Ų | 150 | 97.7 Ų | 97.7 | 57% | 0.566 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.4 | -46.4 | 175.8 | -173.5 | -174 | -179.1 | 178.7 | 3.9 | 110.9 | V107 E108 N113 V114 D115 | V107-R111 VanDerWaalsContact O-CB 3.23Å; V107-R111 WeakPolarHBondContact O-CB 3.32Å; V107-R111 PolarHBondContact O-N 2.97Å; E108-R111 PolarHBondContact O-N 2.91Å; R111-N113 VanDerWaalsContact C-N 3.3Å; R111-N113 PolarHBondContact O-N 3.44Å; R111-V114 CarbonylContact O-C 3.6Å; R111-V114 PolarHBondContact O-N 3.27Å; R111-D115 WeakPolarHBondContact O-CB 3.47Å; R111-D115 PolarHBondContact O-N 3.32Å |
| 112 | S | 87.6 | Confident | 85.1 | Confident | 74 Ų | 74 | 93.3 Ų | 93.3 | 52% | 0.517 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.6 | -37.4 | 174 | 177.8 | 0 | 0 | 0 | 0 | 112.6 | E108 S109 G116 | E108-S112 WeakPolarHBondContact O-CB 3.31Å; E108-S112 PolarHBondContact O-N 3.36Å; S109-S112 PolarHBondContact O-N 2.87Å; S112-G116 PolarHBondContact O-N 2.9Å |
| 113 | N | 87.9 | Confident | 85.2 | Confident | 99 Ų | 99 | 92.1 Ų | 92.1 | 53% | 0.529 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.8 | -35.1 | 176.3 | -70.1 | -19.2 | 0 | 0 | 0 | 111.3 | S109 L110 R111 L117 | S109-N113 WeakPolarHBondContact O-CB 3.35Å; S109-N113 PolarHBondContact O-N 2.96Å; S109-N113 PolarHBondContact O-ND2 2.97Å; S109-N113 PolarHBondContact O-OD1 2.86Å; L110-N113 CarbonylContact O-C 3.52Å; L110-N113 PolarHBondContact O-N 3.36Å; R111-N113 VanDerWaalsContact C-N 3.3Å; R111-N113 PolarHBondContact O-N 3.44Å; N113-L117 VanDerWaalsContact O-CB 3.3Å; N113-L117 WeakPolarHBondContact O-CB 3.4Å; N113-L117 VanDerWaalsContact O-CG 3.25Å; N113-L117 WeakPolarHBondContact O-CG 3.36Å; N113-L117 PolarHBondContact O-N 2.8Å |
| 114 | V | 87.1 | Confident | 85.1 | Confident | 80 Ų | 80 | 92.1 Ų | 92.1 | 49% | 0.485 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.2 | -45.1 | 174.2 | 168.4 | 0 | 0 | 0 | 0 | 110.9 | L110 R111 G116 L117 E118 | L110-V114 WeakPolarHBondContact O-CB 3.4Å; L110-V114 VanDerWaalsContact O-CG2 3.24Å; L110-V114 WeakPolarHBondContact O-CG2 3.42Å; L110-V114 PolarHBondContact O-N 2.78Å; R111-V114 CarbonylContact O-C 3.6Å; R111-V114 PolarHBondContact O-N 3.27Å; V114-G116 VanDerWaalsContact C-N 3.29Å; V114-G116 PolarHBondContact O-N 2.89Å; V114-L117 CarbonylContact O-C 3.57Å; V114-L117 WeakPolarHBondContact O-CB 3.46Å; V114-L117 PolarHBondContact O-N 3.16Å; V114-L117 VanDerWaalsContact O-N 3.16Å; V114-E118 WeakPolarHBondContact O-CB 3.11Å; V114-E118 PolarHBondContact O-N 2.86Å |
| 115 | D | 86.8 | Confident | 85.3 | Confident | 83 Ų | 83 | 94.6 Ų | 94.6 | 44% | 0.444 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.4 | -38 | 174.5 | -70.5 | -17.8 | 0 | 0 | 0 | 110.7 | R111 S119 | R111-D115 WeakPolarHBondContact O-CB 3.47Å; R111-D115 PolarHBondContact O-N 3.32Å; D115-S119 VanDerWaalsContact O-CB 3.25Å; D115-S119 WeakPolarHBondContact O-CB 3.48Å; D115-S119 PolarHBondContact O-N 2.7Å |
| 116 | G | 86 | Confident | 85.4 | Confident | 40 Ų | 40 | 93 Ų | 93 | 41% | 0.412 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.5 | -39.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S112 V114 S120 | S112-G116 PolarHBondContact O-N 2.9Å; V114-G116 VanDerWaalsContact C-N 3.29Å; V114-G116 PolarHBondContact O-N 2.89Å; G116-S120 VanDerWaalsContact O-CB 3.28Å; G116-S120 WeakPolarHBondContact O-CB 3.47Å; G116-S120 PolarHBondContact O-N 3.36Å; G116-S120 PolarHBondContact O-OG 3.48Å |
| 117 | L | 82.8 | Confident | 85.4 | Confident | 113 Ų | 113 | 92.8 Ų | 92.8 | 59% | 0.592 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -68 | -43.8 | 174.4 | -81.7 | 166.5 | 0 | 0 | 0 | 111.5 | N113 V114 S120 L121 | N113-L117 VanDerWaalsContact O-CB 3.3Å; N113-L117 WeakPolarHBondContact O-CB 3.4Å; N113-L117 VanDerWaalsContact O-CG 3.25Å; N113-L117 WeakPolarHBondContact O-CG 3.36Å; N113-L117 PolarHBondContact O-N 2.8Å; V114-L117 CarbonylContact O-C 3.57Å; V114-L117 WeakPolarHBondContact O-CB 3.46Å; V114-L117 PolarHBondContact O-N 3.16Å; V114-L117 VanDerWaalsContact O-N 3.16Å; L117-S120 WeakPolarHBondContact CA-OG 3.18Å; L117-S120 CarbonylContact O-C 3.59Å; L117-S120 PolarHBondContact O-N 3.01Å; L117-S120 PolarHBondContact O-OG 2.9Å; L117-L121 VanDerWaalsContact O-CB 3.23Å; L117-L121 WeakPolarHBondContact O-CB 3.41Å; L117-L121 PolarHBondContact O-N 3.45Å |
| 118 | E | 86.3 | Confident | 85.4 | Confident | 132 Ų | 132 | 94.1 Ų | 94.1 | 62% | 0.617 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.3 | -42.9 | 176.2 | -173.1 | 177.8 | -177.9 | 0 | 0 | 110.8 | V114 S120 L121 G122 | V114-E118 WeakPolarHBondContact O-CB 3.11Å; V114-E118 PolarHBondContact O-N 2.86Å; E118-S120 PolarHBondContact O-N 2.77Å; E118-L121 PolarHBondContact O-N 3.32Å; E118-G122 PolarHBondContact O-N 2.98Å |
| 119 | S | 83.6 | Confident | 85.6 | Confident | 81 Ų | 81 | 93.8 Ų | 93.8 | 57% | 0.566 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.8 | -41.6 | 172.9 | -173.2 | 0 | 0 | 0 | 0 | 111.5 | D115 G122 V123 | D115-S119 VanDerWaalsContact O-CB 3.25Å; D115-S119 WeakPolarHBondContact O-CB 3.48Å; D115-S119 PolarHBondContact O-N 2.7Å; S119-G122 PolarHBondContact O-N 3.35Å; S119-V123 VanDerWaalsContact O-CG2 3.27Å; S119-V123 WeakPolarHBondContact O-CG2 3.33Å; S119-V123 PolarHBondContact O-N 3.33Å |
| 120 | S | 80.3 | Confident | 85.8 | Confident | 54 Ų | 54 | 92.7 Ų | 92.7 | 38% | 0.378 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -69.5 | -33.5 | 177.5 | 78.1 | 0 | 0 | 0 | 0 | 112.4 | G116 L117 E118 V123 T124 | G116-S120 VanDerWaalsContact O-CB 3.28Å; G116-S120 WeakPolarHBondContact O-CB 3.47Å; G116-S120 PolarHBondContact O-N 3.36Å; G116-S120 PolarHBondContact O-OG 3.48Å; L117-S120 WeakPolarHBondContact CA-OG 3.18Å; L117-S120 CarbonylContact O-C 3.59Å; L117-S120 PolarHBondContact O-N 3.01Å; L117-S120 PolarHBondContact O-OG 2.9Å; E118-S120 PolarHBondContact O-N 2.77Å; S120-V123 PolarHBondContact O-N 2.9Å; S120-T124 WeakPolarHBondContact O-CB 3.47Å; S120-T124 VanDerWaalsContact O-CG2 3.29Å; S120-T124 WeakPolarHBondContact O-CG2 3.46Å; S120-T124 PolarHBondContact O-N 3.32Å; S120-T124 PolarHBondContact O-OG1 2.88Å |
| 121 | L | 84.9 | Confident | 85.7 | Confident | 116 Ų | 116 | 89.8 Ų | 89.8 | 61% | 0.607 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -73.2 | -36 | 176.3 | -168.4 | 127.2 | 0 | 0 | 0 | 110.7 | L117 E118 T124 R125 | L117-L121 VanDerWaalsContact O-CB 3.23Å; L117-L121 WeakPolarHBondContact O-CB 3.41Å; L117-L121 PolarHBondContact O-N 3.45Å; E118-L121 PolarHBondContact O-N 3.32Å; L121-T124 VanDerWaalsContact CA-OG1 3.3Å; L121-T124 WeakPolarHBondContact CA-OG1 3.33Å; L121-T124 PolarHBondContact O-OG1 2.81Å; L121-T124 VanDerWaalsContact O-OG1 3.07Å; L121-R125 WeakPolarHBondContact O-CB 3.44Å; L121-R125 PolarHBondContact O-N 3.47Å |
| 122 | G | 85.9 | Confident | 85.6 | Confident | 34 Ų | 34 | 85.4 Ų | 85.4 | 35% | 0.351 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.7 | -46.1 | 168.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | E118 S119 R125 V126 | E118-G122 PolarHBondContact O-N 2.98Å; S119-G122 PolarHBondContact O-N 3.35Å; G122-R125 PolarHBondContact O-N 3.38Å; G122-V126 WeakPolarHBondContact O-CG2 3.32Å; G122-V126 PolarHBondContact O-N 3.45Å |
| 123 | V | 84.1 | Confident | 85.5 | Confident | 75 Ų | 75 | 85.2 Ų | 85.2 | 46% | 0.455 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.9 | -49.1 | 176.5 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | S119 S120 R125 V126 E127 | S119-V123 VanDerWaalsContact O-CG2 3.27Å; S119-V123 WeakPolarHBondContact O-CG2 3.33Å; S119-V123 PolarHBondContact O-N 3.33Å; S120-V123 PolarHBondContact O-N 2.9Å; V123-R125 VanDerWaalsContact C-N 3.3Å; V123-R125 PolarHBondContact O-N 3.36Å; V123-V126 PolarHBondContact O-N 2.9Å; V123-E127 HydrophobicContact CG1-CG 4.37Å; V123-E127 WeakPolarHBondContact O-CB 3.45Å; V123-E127 WeakPolarHBondContact O-CG 3.45Å; V123-E127 PolarHBondContact O-N 3.43Å |
| 124 | T | 81.3 | Confident | 85.3 | Confident | 76 Ų | 76 | 88.3 Ų | 88.3 | 47% | 0.466 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.1 | -33 | 179.4 | 52.6 | 0 | 0 | 0 | 0 | 112.4 | S120 L121 E127 L128 | S120-T124 WeakPolarHBondContact O-CB 3.47Å; S120-T124 VanDerWaalsContact O-CG2 3.29Å; S120-T124 WeakPolarHBondContact O-CG2 3.46Å; S120-T124 PolarHBondContact O-N 3.32Å; S120-T124 PolarHBondContact O-OG1 2.88Å; L121-T124 VanDerWaalsContact CA-OG1 3.3Å; L121-T124 WeakPolarHBondContact CA-OG1 3.33Å; L121-T124 PolarHBondContact O-OG1 2.81Å; L121-T124 VanDerWaalsContact O-OG1 3.07Å; T124-E127 PolarHBondContact O-N 2.85Å; T124-L128 WeakPolarHBondContact O-CB 3.26Å; T124-L128 PolarHBondContact O-N 3.17Å |
| 125 | R | 88.3 | Confident | 85.3 | Confident | 161 Ų | 161 | 90 Ų | 90 | 61% | 0.608 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.2 | -45.5 | 172.4 | -178.1 | 178.2 | 178.7 | 169.7 | 3.4 | 112.2 | L121 G122 V123 E127 L128 E129 | L121-R125 WeakPolarHBondContact O-CB 3.44Å; L121-R125 PolarHBondContact O-N 3.47Å; G122-R125 PolarHBondContact O-N 3.38Å; V123-R125 VanDerWaalsContact C-N 3.3Å; V123-R125 PolarHBondContact O-N 3.36Å; R125-E127 VanDerWaalsContact C-N 3.32Å; R125-L128 PolarHBondContact O-N 3.45Å; R125-E129 IonicContact NE-OE1 2.88Å; R125-E129 WeakPolarHBondContact O-CG 3.44Å; R125-E129 PolarHBondContact O-N 3.02Å |
| 126 | V | 88.2 | Confident | 85.3 | Confident | 95 Ų | 95 | 92.3 Ų | 92.3 | 58% | 0.576 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.8 | -40 | 176.7 | 171.4 | 0 | 0 | 0 | 0 | 110.6 | G122 V123 E129 A130 | G122-V126 WeakPolarHBondContact O-CG2 3.32Å; G122-V126 PolarHBondContact O-N 3.45Å; V123-V126 PolarHBondContact O-N 2.9Å; V126-E129 PolarHBondContact O-N 2.82Å; V126-A130 VanDerWaalsContact O-CB 3.27Å; V126-A130 WeakPolarHBondContact O-CB 3.36Å; V126-A130 PolarHBondContact O-N 3.38Å |
| 127 | E | 88.1 | Confident | 85.3 | Confident | 119 Ų | 119 | 98.4 Ų | 98.4 | 56% | 0.556 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.6 | -38 | 174.7 | -73.7 | -177.5 | 169.4 | 0 | 0 | 112.4 | V123 T124 R125 A130 A131 | V123-E127 HydrophobicContact CG1-CG 4.37Å; V123-E127 WeakPolarHBondContact O-CB 3.45Å; V123-E127 WeakPolarHBondContact O-CG 3.45Å; V123-E127 PolarHBondContact O-N 3.43Å; T124-E127 PolarHBondContact O-N 2.85Å; R125-E127 VanDerWaalsContact C-N 3.32Å; E127-A130 CarbonylContact O-C 3.58Å; E127-A130 PolarHBondContact O-N 2.89Å; E127-A131 VanDerWaalsContact O-CB 3.31Å; E127-A131 WeakPolarHBondContact O-CB 3.34Å; E127-A131 PolarHBondContact O-N 2.98Å |
| 128 | L | 85.3 | Confident | 85.5 | Confident | 116 Ų | 116 | 94.3 Ų | 94.3 | 61% | 0.607 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.4 | -45.4 | 174.8 | -174.7 | 68.9 | 0 | 0 | 0 | 111.4 | T124 R125 A130 A131 V132 | T124-L128 WeakPolarHBondContact O-CB 3.26Å; T124-L128 PolarHBondContact O-N 3.17Å; R125-L128 PolarHBondContact O-N 3.45Å; L128-A130 VanDerWaalsContact C-N 3.28Å; L128-A130 PolarHBondContact O-N 3.45Å; L128-A131 PolarHBondContact O-N 3.29Å; L128-V132 WeakPolarHBondContact O-CB 3.42Å; L128-V132 VanDerWaalsContact O-CG2 3.28Å; L128-V132 WeakPolarHBondContact O-CG2 3.5Å; L128-V132 PolarHBondContact O-N 3.27Å |
| 129 | E | 89.6 | Confident | 85.3 | Confident | 109 Ų | 109 | 92 Ų | 92 | 51% | 0.509 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.6 | -36.8 | 174.3 | -75.4 | 179.9 | -170 | 0 | 0 | 111.6 | R125 V126 S133 | R125-E129 IonicContact NE-OE1 2.88Å; R125-E129 WeakPolarHBondContact O-CG 3.44Å; R125-E129 PolarHBondContact O-N 3.02Å; V126-E129 PolarHBondContact O-N 2.82Å; E129-S133 WeakPolarHBondContact O-CB 3.14Å; E129-S133 PolarHBondContact O-N 2.85Å; E129-S133 PolarHBondContact O-OG 3.07Å |
| 130 | A | 86 | Confident | 85.5 | Confident | 30 Ų | 30 | 91.2 Ų | 91.2 | 25% | 0.248 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -68.3 | -39.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V126 E127 L128 S133 R134 | V126-A130 VanDerWaalsContact O-CB 3.27Å; V126-A130 WeakPolarHBondContact O-CB 3.36Å; V126-A130 PolarHBondContact O-N 3.38Å; E127-A130 CarbonylContact O-C 3.58Å; E127-A130 PolarHBondContact O-N 2.89Å; L128-A130 VanDerWaalsContact C-N 3.28Å; L128-A130 PolarHBondContact O-N 3.45Å; A130-S133 PolarHBondContact O-N 2.83Å; A130-R134 VanDerWaalsContact C-NH1 3.32Å; A130-R134 WeakPolarHBondContact O-CG 3.27Å; A130-R134 PolarHBondContact O-N 3.03Å; A130-R134 PolarHBondContact O-NH1 3Å |
| 131 | A | 80.6 | Confident | 85.8 | Confident | 48 Ų | 48 | 93.6 Ų | 93.6 | 40% | 0.397 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66 | -43.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | E127 L128 S133 R134 M135 | E127-A131 VanDerWaalsContact O-CB 3.31Å; E127-A131 WeakPolarHBondContact O-CB 3.34Å; E127-A131 PolarHBondContact O-N 2.98Å; L128-A131 PolarHBondContact O-N 3.29Å; A131-S133 VanDerWaalsContact C-N 3.3Å; A131-S133 PolarHBondContact O-N 2.93Å; A131-R134 PolarHBondContact O-N 2.86Å; A131-M135 WeakPolarHBondContact O-CB 3.22Å; A131-M135 PolarHBondContact O-N 3.24Å |
| 132 | V | 86.4 | Confident | 85.9 | Confident | 58 Ų | 58 | 92.2 Ų | 92.2 | 35% | 0.352 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.2 | -39.9 | 174.3 | 169.7 | 0 | 0 | 0 | 0 | 111 | L128 M135 K136 | L128-V132 WeakPolarHBondContact O-CB 3.42Å; L128-V132 VanDerWaalsContact O-CG2 3.28Å; L128-V132 WeakPolarHBondContact O-CG2 3.5Å; L128-V132 PolarHBondContact O-N 3.27Å; V132-M135 HydrophobicContact CG1-CE 4.44Å; V132-M135 PolarHBondContact O-N 3.46Å; V132-K136 WeakPolarHBondContact O-CG 3.48Å; V132-K136 PolarHBondContact O-N 3.31Å |
| 133 | S | 86.4 | Confident | 86 | Confident | 70 Ų | 70 | 97 Ų | 97 | 49% | 0.49 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.6 | -38.3 | 175.9 | -61.7 | 0 | 0 | 0 | 0 | 112.5 | E129 A130 A131 R137 | E129-S133 WeakPolarHBondContact O-CB 3.14Å; E129-S133 PolarHBondContact O-N 2.85Å; E129-S133 PolarHBondContact O-OG 3.07Å; A130-S133 PolarHBondContact O-N 2.83Å; A131-S133 VanDerWaalsContact C-N 3.3Å; A131-S133 PolarHBondContact O-N 2.93Å; S133-R137 PolarHBondContact O-N 3.32Å; S133-R137 VanDerWaalsContact O-N 3.12Å |
| 134 | R | 84.4 | Confident | 86.3 | Confident | 164 Ų | 164 | 101.1 Ų | 101.1 | 62% | 0.619 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.5 | -39.6 | 172.3 | -71.6 | -180 | -162.7 | 99.2 | -4 | 111.7 | A130 A131 R137 G138 | A130-R134 VanDerWaalsContact C-NH1 3.32Å; A130-R134 WeakPolarHBondContact O-CG 3.27Å; A130-R134 PolarHBondContact O-N 3.03Å; A130-R134 PolarHBondContact O-NH1 3Å; A131-R134 PolarHBondContact O-N 2.86Å; R134-R137 WeakPolarHBondContact O-CB 3.32Å; R134-R137 PolarHBondContact O-N 2.79Å; R134-G138 PolarHBondContact O-N 3.05Å |
| 135 | M | 85.9 | Confident | 86.8 | Confident | 117 Ų | 117 | 101.7 Ų | 101.7 | 58% | 0.576 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.8 | -47.9 | 176.4 | -179.4 | -168.6 | 73.4 | 0 | 0 | 111.5 | A131 V132 R137 G138 E139 | A131-M135 WeakPolarHBondContact O-CB 3.22Å; A131-M135 PolarHBondContact O-N 3.24Å; V132-M135 HydrophobicContact CG1-CE 4.44Å; V132-M135 PolarHBondContact O-N 3.46Å; M135-R137 PolarHBondContact O-N 2.91Å; M135-G138 CarbonylContact O-C 3.54Å; M135-G138 WeakPolarHBondContact O-CA 3.46Å; M135-G138 PolarHBondContact O-N 3.34Å; M135-E139 PolarHBondContact O-N 3.01Å |
| 136 | K | 87.5 | Confident | 86.9 | Confident | 131 Ų | 131 | 100 Ų | 100 | 57% | 0.57 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.4 | -35.6 | 175.6 | -75.8 | -172.9 | 177 | -178.4 | 0 | 112.3 | V132 E139 V140 | V132-K136 WeakPolarHBondContact O-CG 3.48Å; V132-K136 PolarHBondContact O-N 3.31Å; K136-E139 PolarHBondContact O-N 3.46Å; K136-V140 WeakPolarHBondContact O-CG2 3.32Å; K136-V140 PolarHBondContact O-N 3.26Å |
| 137 | R | 86.7 | Confident | 87.1 | Confident | 167 Ų | 167 | 101.8 Ų | 101.8 | 63% | 0.63 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.1 | -44.7 | 172.7 | -170.3 | -178.7 | -58.4 | 174.5 | 2.1 | 111.4 | S133 R134 M135 E139 V140 E141 | S133-R137 PolarHBondContact O-N 3.32Å; S133-R137 VanDerWaalsContact O-N 3.12Å; R134-R137 WeakPolarHBondContact O-CB 3.32Å; R134-R137 PolarHBondContact O-N 2.79Å; M135-R137 PolarHBondContact O-N 2.91Å; R137-E139 VanDerWaalsContact C-N 3.32Å; R137-E139 PolarHBondContact O-N 3.15Å; R137-V140 PolarHBondContact O-N 3Å; R137-E141 WeakPolarHBondContact O-CG 3.34Å; R137-E141 PolarHBondContact O-N 3.29Å |
| 138 | G | 85.8 | Confident | 87.3 | Confident | 28 Ų | 28 | 98.9 Ų | 98.9 | 29% | 0.289 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.4 | -40.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | R134 M135 V140 E141 T142 | R134-G138 PolarHBondContact O-N 3.05Å; M135-G138 CarbonylContact O-C 3.54Å; M135-G138 WeakPolarHBondContact O-CA 3.46Å; M135-G138 PolarHBondContact O-N 3.34Å; G138-V140 PolarHBondContact O-N 2.89Å; G138-E141 CarbonylContact O-C 3.54Å; G138-E141 PolarHBondContact O-N 2.98Å; G138-T142 WeakPolarHBondContact O-CG2 3.19Å; G138-T142 PolarHBondContact O-N 3.45Å; G138-T142 PolarHBondContact O-OG1 3.38Å |
| 139 | E | 83.3 | Confident | 87.6 | Confident | 83 Ų | 83 | 98.4 Ų | 98.4 | 39% | 0.388 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.2 | -38.1 | 177.4 | -166.4 | -172.1 | 160.4 | 0 | 0 | 112.4 | M135 K136 R137 T142 R143 | M135-E139 PolarHBondContact O-N 3.01Å; K136-E139 PolarHBondContact O-N 3.46Å; R137-E139 VanDerWaalsContact C-N 3.32Å; R137-E139 PolarHBondContact O-N 3.15Å; E139-T142 VanDerWaalsContact CA-OG1 3.28Å; E139-T142 WeakPolarHBondContact CA-OG1 3.36Å; E139-T142 PolarHBondContact O-OG1 2.81Å; E139-R143 WeakPolarHBondContact O-CG 3.47Å; E139-R143 PolarHBondContact O-N 3.37Å; E139-R143 IonicContact OE1-CZ 3.15Å; E139-R143 IonicContact OE1-NH1 3.52Å; E139-R143 IonicContact OE1-NH2 3.9Å; E139-R143 PolarHBondContact OE1-NH2 3.5Å |
| 140 | V | 87.6 | Confident | 87.7 | Confident | 65 Ų | 65 | 99.2 Ų | 99.2 | 39% | 0.394 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -70 | -38.8 | 174.2 | 173.7 | 0 | 0 | 0 | 0 | 111 | K136 R137 G138 R143 R144 | K136-V140 WeakPolarHBondContact O-CG2 3.32Å; K136-V140 PolarHBondContact O-N 3.26Å; R137-V140 PolarHBondContact O-N 3Å; G138-V140 PolarHBondContact O-N 2.89Å; V140-R143 PolarHBondContact O-N 3.17Å; V140-R144 WeakPolarHBondContact O-CG 3.34Å; V140-R144 PolarHBondContact O-N 2.89Å |
| 141 | E | 86.7 | Confident | 88.1 | Confident | 103 Ų | 103 | 104.5 Ų | 104.5 | 48% | 0.481 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66 | -39.9 | 174.9 | -73.2 | 170.6 | -169.7 | 0 | 0 | 111.5 | R137 G138 R144 V145 | R137-E141 WeakPolarHBondContact O-CG 3.34Å; R137-E141 PolarHBondContact O-N 3.29Å; G138-E141 CarbonylContact O-C 3.54Å; G138-E141 PolarHBondContact O-N 2.98Å; E141-R144 PolarHBondContact O-N 3.02Å; E141-V145 WeakPolarHBondContact O-CB 3.39Å; E141-V145 VanDerWaalsContact O-CG2 3.26Å; E141-V145 WeakPolarHBondContact O-CG2 3.45Å; E141-V145 PolarHBondContact O-N 2.92Å |
| 142 | T | 85.8 | Confident | 88.6 | Confident | 87 Ų | 87 | 107.1 Ų | 107.1 | 53% | 0.534 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.8 | -40.2 | 174.6 | 51.5 | 0 | 0 | 0 | 0 | 111.8 | G138 E139 V145 E146 | G138-T142 WeakPolarHBondContact O-CG2 3.19Å; G138-T142 PolarHBondContact O-N 3.45Å; G138-T142 PolarHBondContact O-OG1 3.38Å; E139-T142 VanDerWaalsContact CA-OG1 3.28Å; E139-T142 WeakPolarHBondContact CA-OG1 3.36Å; E139-T142 PolarHBondContact O-OG1 2.81Å; T142-V145 PolarHBondContact O-N 3.18Å; T142-E146 WeakPolarHBondContact O-CB 3.45Å; T142-E146 PolarHBondContact O-N 3.34Å |
| 143 | R | 89 | Confident | 89 | Confident | 136 Ų | 136 | 110.1 Ų | 110.1 | 51% | 0.513 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64 | -41.2 | 173.3 | -74.6 | -179.1 | -176.7 | 150.1 | 10.4 | 112.2 | E139 V140 E146 E147 | E139-R143 WeakPolarHBondContact O-CG 3.47Å; E139-R143 PolarHBondContact O-N 3.37Å; E139-R143 IonicContact OE1-CZ 3.15Å; E139-R143 IonicContact OE1-NH1 3.52Å; E139-R143 IonicContact OE1-NH2 3.9Å; E139-R143 PolarHBondContact OE1-NH2 3.5Å; V140-R143 PolarHBondContact O-N 3.17Å; R143-E146 PolarHBondContact O-N 2.86Å; R143-E147 WeakPolarHBondContact O-CB 3.45Å; R143-E147 WeakPolarHBondContact O-CG 3.36Å; R143-E147 PolarHBondContact O-N 2.87Å |
| 144 | R | 90 | Very high | 89.4 | Confident | 161 Ų | 161 | 111.5 Ų | 111.5 | 61% | 0.608 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.2 | -37.7 | 175.1 | -77.5 | 178 | -179.7 | 158.4 | 0.3 | 112.7 | V140 E141 A148 | V140-R144 WeakPolarHBondContact O-CG 3.34Å; V140-R144 PolarHBondContact O-N 2.89Å; E141-R144 PolarHBondContact O-N 3.02Å; R144-A148 VanDerWaalsContact O-CB 3.3Å; R144-A148 WeakPolarHBondContact O-CB 3.4Å; R144-A148 PolarHBondContact O-N 3.35Å |
| 145 | V | 91.8 | Very high | 89.9 | Confident | 87 Ų | 87 | 105.6 Ų | 105.6 | 53% | 0.527 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67 | -41.3 | 174.6 | 169.4 | 0 | 0 | 0 | 0 | 110.3 | E141 T142 A148 L149 | E141-V145 WeakPolarHBondContact O-CB 3.39Å; E141-V145 VanDerWaalsContact O-CG2 3.26Å; E141-V145 WeakPolarHBondContact O-CG2 3.45Å; E141-V145 PolarHBondContact O-N 2.92Å; T142-V145 PolarHBondContact O-N 3.18Å; V145-A148 PolarHBondContact O-N 3.42Å; V145-L149 HydrophobicContact CG1-CD1 4.07Å; V145-L149 HydrophobicContact CG1-CG 4.46Å; V145-L149 WeakPolarHBondContact O-CB 3.47Å; V145-L149 WeakPolarHBondContact O-CG 3.38Å; V145-L149 PolarHBondContact O-N 2.89Å |
| 146 | E | 89.3 | Confident | 90.1 | Very high | 126 Ų | 126 | 105.5 Ų | 105.5 | 59% | 0.589 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62 | -46.4 | 174.8 | -172 | 173.3 | -165.7 | 0 | 0 | 111.4 | T142 R143 A148 L149 Q150 | T142-E146 WeakPolarHBondContact O-CB 3.45Å; T142-E146 PolarHBondContact O-N 3.34Å; R143-E146 PolarHBondContact O-N 2.86Å; E146-A148 VanDerWaalsContact C-N 3.33Å; E146-A148 PolarHBondContact O-N 3.44Å; E146-L149 PolarHBondContact O-N 2.99Å; E146-Q150 WeakPolarHBondContact O-CB 3.32Å; E146-Q150 PolarHBondContact O-N 3.36Å |
| 147 | E | 93.9 | Very high | 90.3 | Very high | 133 Ų | 133 | 104.3 Ų | 104.3 | 62% | 0.621 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.3 | -41.7 | 172.6 | -74.1 | 171 | -171.4 | 0 | 0 | 112.2 | R143 Q150 K151 | R143-E147 WeakPolarHBondContact O-CB 3.45Å; R143-E147 WeakPolarHBondContact O-CG 3.36Å; R143-E147 PolarHBondContact O-N 2.87Å; E147-Q150 PolarHBondContact O-N 2.93Å; E147-K151 VanDerWaalsContact O-CB 3.24Å; E147-K151 WeakPolarHBondContact O-CB 3.27Å; E147-K151 PolarHBondContact O-N 3.45Å |
| 148 | A | 92 | Very high | 90.7 | Very high | 57 Ų | 57 | 102.2 Ų | 102.2 | 47% | 0.471 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.7 | -38.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | R144 V145 E146 L152 | R144-A148 VanDerWaalsContact O-CB 3.3Å; R144-A148 WeakPolarHBondContact O-CB 3.4Å; R144-A148 PolarHBondContact O-N 3.35Å; V145-A148 PolarHBondContact O-N 3.42Å; E146-A148 VanDerWaalsContact C-N 3.33Å; E146-A148 PolarHBondContact O-N 3.44Å; A148-L152 VanDerWaalsContact O-CB 3.23Å; A148-L152 WeakPolarHBondContact O-CB 3.43Å; A148-L152 PolarHBondContact O-N 2.98Å |
| 149 | L | 90.8 | Very high | 91.1 | Very high | 107 Ų | 107 | 105.3 Ų | 105.3 | 56% | 0.56 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.6 | -42.5 | 175.2 | -75.9 | 170.9 | 0 | 0 | 0 | 111.6 | V145 E146 K151 L152 Q153 | V145-L149 HydrophobicContact CG1-CD1 4.07Å; V145-L149 HydrophobicContact CG1-CG 4.46Å; V145-L149 WeakPolarHBondContact O-CB 3.47Å; V145-L149 WeakPolarHBondContact O-CG 3.38Å; V145-L149 PolarHBondContact O-N 2.89Å; E146-L149 PolarHBondContact O-N 2.99Å; L149-K151 VanDerWaalsContact C-N 3.3Å; L149-K151 PolarHBondContact O-N 3.14Å; L149-L152 PolarHBondContact O-N 3.07Å; L149-Q153 WeakPolarHBondContact O-CB 3.33Å; L149-Q153 PolarHBondContact O-N 3.17Å |
| 150 | Q | 92.2 | Very high | 91.4 | Very high | 125 Ų | 125 | 106.7 Ų | 106.7 | 58% | 0.584 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.7 | -43.8 | 175.3 | -161.5 | 90.8 | 8.7 | 0 | 0 | 110.7 | E146 E147 Q153 N154 | E146-Q150 WeakPolarHBondContact O-CB 3.32Å; E146-Q150 PolarHBondContact O-N 3.36Å; E147-Q150 PolarHBondContact O-N 2.93Å; Q150-Q153 PolarHBondContact O-N 2.99Å; Q150-N154 WeakPolarHBondContact O-CB 3.47Å; Q150-N154 PolarHBondContact O-N 3.06Å |
| 151 | K | 94.4 | Very high | 91.4 | Very high | 141 Ų | 141 | 106.6 Ų | 106.6 | 61% | 0.613 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -66.7 | -45.4 | 177.5 | -172 | 175.1 | -179.5 | -179.2 | 0 | 111.6 | E147 L149 Q153 N154 D155 | E147-K151 VanDerWaalsContact O-CB 3.24Å; E147-K151 WeakPolarHBondContact O-CB 3.27Å; E147-K151 PolarHBondContact O-N 3.45Å; L149-K151 VanDerWaalsContact C-N 3.3Å; L149-K151 PolarHBondContact O-N 3.14Å; K151-Q153 VanDerWaalsContact C-N 3.32Å; K151-Q153 PolarHBondContact O-N 3.3Å; K151-N154 PolarHBondContact O-N 3.05Å; K151-D155 WeakPolarHBondContact O-CB 3.49Å; K151-D155 VanDerWaalsContact O-CG 3.24Å; K151-D155 PolarHBondContact O-N 3.36Å |
| 152 | L | 91.8 | Very high | 91.8 | Very high | 103 Ų | 103 | 106.2 Ų | 106.2 | 54% | 0.539 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 175.7 | -178.3 | 65.6 | 0 | 0 | 0 | 111.2 | A148 L149 N154 D155 L156 | A148-L152 VanDerWaalsContact O-CB 3.23Å; A148-L152 WeakPolarHBondContact O-CB 3.43Å; A148-L152 PolarHBondContact O-N 2.98Å; L149-L152 PolarHBondContact O-N 3.07Å; L152-N154 VanDerWaalsContact C-N 3.35Å; L152-D155 PolarHBondContact O-N 3.09Å; L152-L156 VanDerWaalsContact O-CB 3.32Å; L152-L156 WeakPolarHBondContact O-CB 3.41Å; L152-L156 PolarHBondContact O-N 2.75Å |
| 153 | Q | 93.6 | Very high | 92.2 | Very high | 121 Ų | 121 | 103.3 Ų | 103.3 | 57% | 0.565 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.3 | -42.8 | 175.6 | -176.1 | -178.3 | 49.6 | 0 | 0 | 111.5 | L149 Q150 K151 L156 L157 | L149-Q153 WeakPolarHBondContact O-CB 3.33Å; L149-Q153 PolarHBondContact O-N 3.17Å; Q150-Q153 PolarHBondContact O-N 2.99Å; K151-Q153 VanDerWaalsContact C-N 3.32Å; K151-Q153 PolarHBondContact O-N 3.3Å; Q153-L156 PolarHBondContact O-N 3.26Å; Q153-L157 HydrophobicContact CG-CD1 4.3Å; Q153-L157 WeakPolarHBondContact O-CB 3.35Å; Q153-L157 VanDerWaalsContact O-CG 3.28Å; Q153-L157 WeakPolarHBondContact O-CG 3.24Å; Q153-L157 PolarHBondContact O-N 2.89Å |
| 154 | N | 95 | Very high | 92.2 | Very high | 99 Ų | 99 | 101.2 Ų | 101.2 | 53% | 0.529 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.9 | -43.9 | 177.8 | -165.4 | -87.7 | 0 | 0 | 0 | 111.8 | Q150 K151 L152 L157 R158 | Q150-N154 WeakPolarHBondContact O-CB 3.47Å; Q150-N154 PolarHBondContact O-N 3.06Å; K151-N154 PolarHBondContact O-N 3.05Å; L152-N154 VanDerWaalsContact C-N 3.35Å; N154-L157 PolarHBondContact O-N 3.49Å; N154-R158 WeakPolarHBondContact O-CB 3.37Å; N154-R158 PolarHBondContact O-N 3.4Å |
| 155 | D | 94.9 | Very high | 92.4 | Very high | 41 Ų | 41 | 101.6 Ų | 101.6 | 22% | 0.219 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -64.8 | -43.5 | 176.9 | -69.2 | -22.1 | 0 | 0 | 0 | 110.6 | K151 L152 L157 R158 D159 | K151-D155 WeakPolarHBondContact O-CB 3.49Å; K151-D155 VanDerWaalsContact O-CG 3.24Å; K151-D155 PolarHBondContact O-N 3.36Å; L152-D155 PolarHBondContact O-N 3.09Å; D155-L157 VanDerWaalsContact C-N 3.34Å; D155-L157 PolarHBondContact O-N 3.01Å; D155-R158 PolarHBondContact O-N 3.39Å; D155-R158 IonicContact OD1-CZ 3.98Å; D155-R158 IonicContact OD1-NH1 3.92Å; D155-R158 PolarHBondContact OD1-NH1 3.06Å; D155-R158 IonicContact OD1-NH2 2.86Å; D155-R158 PolarHBondContact OD1-NH2 3.06Å; D155-D159 WeakPolarHBondContact O-CB 3.36Å; D155-D159 PolarHBondContact O-N 3.11Å |
| 156 | L | 89.7 | Confident | 92.5 | Very high | 115 Ų | 115 | 103 Ų | 103 | 60% | 0.602 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.3 | -39.2 | 177.2 | -142 | 98.7 | 0 | 0 | 0 | 112.3 | L152 Q153 L160 | L152-L156 VanDerWaalsContact O-CB 3.32Å; L152-L156 WeakPolarHBondContact O-CB 3.41Å; L152-L156 PolarHBondContact O-N 2.75Å; Q153-L156 PolarHBondContact O-N 3.26Å; L156-L160 WeakPolarHBondContact O-CB 3.47Å; L156-L160 PolarHBondContact O-N 2.82Å |
| 157 | L | 91.9 | Very high | 92.7 | Very high | 105 Ų | 105 | 101 Ų | 101 | 55% | 0.55 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.9 | -38.3 | 175.8 | -74.2 | 173.5 | 0 | 0 | 0 | 111.7 | Q153 N154 D155 A161 | Q153-L157 HydrophobicContact CG-CD1 4.3Å; Q153-L157 WeakPolarHBondContact O-CB 3.35Å; Q153-L157 VanDerWaalsContact O-CG 3.28Å; Q153-L157 WeakPolarHBondContact O-CG 3.24Å; Q153-L157 PolarHBondContact O-N 2.89Å; N154-L157 PolarHBondContact O-N 3.49Å; D155-L157 VanDerWaalsContact C-N 3.34Å; D155-L157 PolarHBondContact O-N 3.01Å; L157-A161 VanDerWaalsContact O-CB 3.27Å; L157-A161 WeakPolarHBondContact O-CB 3.4Å; L157-A161 PolarHBondContact O-N 3.21Å |
| 158 | R | 94.7 | Very high | 92.7 | Very high | 124 Ų | 124 | 100.9 Ų | 100.9 | 47% | 0.468 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.4 | -49.9 | 175.8 | -175.4 | 178.3 | 64.5 | -124.9 | -5.9 | 110.9 | N154 D155 L160 A161 E162 | N154-R158 WeakPolarHBondContact O-CB 3.37Å; N154-R158 PolarHBondContact O-N 3.4Å; D155-R158 PolarHBondContact O-N 3.39Å; D155-R158 IonicContact OD1-CZ 3.98Å; D155-R158 IonicContact OD1-NH1 3.92Å; D155-R158 PolarHBondContact OD1-NH1 3.06Å; D155-R158 IonicContact OD1-NH2 2.86Å; D155-R158 PolarHBondContact OD1-NH2 3.06Å; R158-L160 VanDerWaalsContact C-N 3.28Å; R158-L160 PolarHBondContact O-N 3.49Å; R158-A161 PolarHBondContact O-N 3Å; R158-A161 VanDerWaalsContact O-N 3.13Å; R158-E162 WeakPolarHBondContact O-CB 3.38Å; R158-E162 PolarHBondContact O-N 2.84Å |
| 159 | D | 94.2 | Very high | 92.7 | Very high | 93 Ų | 93 | 103.6 Ų | 103.6 | 50% | 0.497 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.9 | -35.8 | 179.5 | -66.2 | 1.5 | 0 | 0 | 0 | 111 | D155 G163 | D155-D159 WeakPolarHBondContact O-CB 3.36Å; D155-D159 PolarHBondContact O-N 3.11Å; D159-G163 PolarHBondContact O-N 3.47Å |
| 160 | L | 90.8 | Very high | 92.8 | Very high | 111 Ų | 111 | 100.8 Ų | 100.8 | 58% | 0.581 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -68.6 | -41.7 | 173.4 | -175.5 | 65 | 0 | 0 | 0 | 111.9 | L156 R158 V164 | L156-L160 WeakPolarHBondContact O-CB 3.47Å; L156-L160 PolarHBondContact O-N 2.82Å; R158-L160 VanDerWaalsContact C-N 3.28Å; R158-L160 PolarHBondContact O-N 3.49Å; L160-V164 HydrophobicContact CD1-CG2 4.46Å; L160-V164 WeakPolarHBondContact O-CB 3.43Å; L160-V164 WeakPolarHBondContact O-CG2 3.37Å; L160-V164 PolarHBondContact O-N 2.86Å |
| 161 | A | 87.9 | Confident | 92.6 | Very high | 63 Ų | 63 | 102.2 Ų | 102.2 | 52% | 0.521 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.1 | -41.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L157 R158 W165 | L157-A161 VanDerWaalsContact O-CB 3.27Å; L157-A161 WeakPolarHBondContact O-CB 3.4Å; L157-A161 PolarHBondContact O-N 3.21Å; R158-A161 PolarHBondContact O-N 3Å; R158-A161 VanDerWaalsContact O-N 3.13Å; A161-W165 WeakPolarHBondContact O-CB 3.4Å; A161-W165 PolarHBondContact O-N 2.84Å |
| 162 | E | 94.3 | Very high | 92.3 | Very high | 96 Ų | 96 | 101.3 Ų | 101.3 | 45% | 0.449 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.8 | -48.6 | 175.7 | -168.1 | 160.9 | -148 | 0 | 0 | 110.6 | R158 V164 W165 E166 | R158-E162 WeakPolarHBondContact O-CB 3.38Å; R158-E162 PolarHBondContact O-N 2.84Å; E162-V164 PolarHBondContact O-N 3.45Å; E162-W165 CarbonylContact O-C 3.51Å; E162-W165 WeakPolarHBondContact O-CA 3.31Å; E162-W165 WeakPolarHBondContact O-CB 3.49Å; E162-W165 PolarHBondContact O-N 2.87Å; E162-E166 WeakPolarHBondContact O-CG 3.33Å; E162-E166 PolarHBondContact O-N 3.35Å |
| 163 | G | 94.1 | Very high | 92.3 | Very high | 26 Ų | 26 | 103.7 Ų | 103.7 | 27% | 0.268 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.9 | -37.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | D159 W165 V167 | D159-G163 PolarHBondContact O-N 3.47Å; G163-W165 VanDerWaalsContact C-N 3.32Å; G163-V167 WeakPolarHBondContact O-CB 3.4Å; G163-V167 VanDerWaalsContact O-CG2 3.26Å; G163-V167 WeakPolarHBondContact O-CG2 3.29Å; G163-V167 PolarHBondContact O-N 3.22Å |
| 164 | V | 89.3 | Confident | 92.3 | Very high | 92 Ų | 92 | 102.8 Ų | 102.8 | 56% | 0.558 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.8 | -38.1 | 172.7 | 167.8 | 0 | 0 | 0 | 0 | 111 | L160 E162 K168 | L160-V164 HydrophobicContact CD1-CG2 4.46Å; L160-V164 WeakPolarHBondContact O-CB 3.43Å; L160-V164 WeakPolarHBondContact O-CG2 3.37Å; L160-V164 PolarHBondContact O-N 2.86Å; E162-V164 PolarHBondContact O-N 3.45Å; V164-K168 VanDerWaalsContact O-CB 3.24Å; V164-K168 WeakPolarHBondContact O-CB 3.36Å; V164-K168 PolarHBondContact O-N 3.1Å |
| 165 | W | 94.6 | Very high | 92.1 | Very high | 169 Ų | 169 | 104.2 Ų | 104.2 | 64% | 0.64 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -69.8 | -45 | 177.7 | -172.3 | 36.7 | 0 | 0 | 0 | 111.9 | A161 E162 G163 V167 K168 E169 | A161-W165 WeakPolarHBondContact O-CB 3.4Å; A161-W165 PolarHBondContact O-N 2.84Å; E162-W165 CarbonylContact O-C 3.51Å; E162-W165 WeakPolarHBondContact O-CA 3.31Å; E162-W165 WeakPolarHBondContact O-CB 3.49Å; E162-W165 PolarHBondContact O-N 2.87Å; G163-W165 VanDerWaalsContact C-N 3.32Å; W165-V167 PolarHBondContact O-N 3.32Å; W165-K168 WeakPolarHBondContact O-CB 3.31Å; W165-K168 PolarHBondContact O-N 3.49Å; W165-K168 VanDerWaalsContact O-N 3.16Å; W165-E169 WeakPolarHBondContact O-CB 3.29Å; W165-E169 PolarHBondContact O-N 2.9Å |
| 166 | E | 93.9 | Very high | 91.7 | Very high | 115 Ų | 115 | 105.4 Ų | 105.4 | 54% | 0.537 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.7 | -45.2 | 175.3 | -72.9 | -179.5 | 174.2 | 0 | 0 | 111.9 | E162 K168 E169 A170 | E162-E166 WeakPolarHBondContact O-CG 3.33Å; E162-E166 PolarHBondContact O-N 3.35Å; E166-K168 VanDerWaalsContact C-N 3.31Å; E166-K168 PolarHBondContact O-N 2.89Å; E166-E169 PolarHBondContact O-N 2.88Å; E166-A170 WeakPolarHBondContact O-CB 3.42Å; E166-A170 PolarHBondContact O-N 3.38Å |
| 167 | V | 92.4 | Very high | 91.5 | Very high | 84 Ų | 84 | 102.7 Ų | 102.7 | 51% | 0.509 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.1 | -38.1 | 176.2 | 169.9 | 0 | 0 | 0 | 0 | 111.1 | G163 W165 R171 | G163-V167 WeakPolarHBondContact O-CB 3.4Å; G163-V167 VanDerWaalsContact O-CG2 3.26Å; G163-V167 WeakPolarHBondContact O-CG2 3.29Å; G163-V167 PolarHBondContact O-N 3.22Å; W165-V167 PolarHBondContact O-N 3.32Å; V167-R171 WeakPolarHBondContact O-CB 3.43Å; V167-R171 WeakPolarHBondContact O-CG 3.35Å; V167-R171 PolarHBondContact O-N 3.21Å |
| 168 | K | 94.1 | Very high | 91.3 | Very high | 132 Ų | 132 | 102.5 Ų | 102.5 | 57% | 0.574 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.3 | -46.3 | 177.1 | -174.2 | -178.5 | 176.2 | -172.9 | 0 | 111 | V164 W165 E166 R171 E172 | V164-K168 VanDerWaalsContact O-CB 3.24Å; V164-K168 WeakPolarHBondContact O-CB 3.36Å; V164-K168 PolarHBondContact O-N 3.1Å; W165-K168 WeakPolarHBondContact O-CB 3.31Å; W165-K168 PolarHBondContact O-N 3.49Å; W165-K168 VanDerWaalsContact O-N 3.16Å; E166-K168 VanDerWaalsContact C-N 3.31Å; E166-K168 PolarHBondContact O-N 2.89Å; K168-R171 PolarHBondContact O-N 3.05Å; K168-E172 WeakPolarHBondContact O-CB 3.49Å; K168-E172 PolarHBondContact O-N 3.38Å |
| 169 | E | 93.1 | Very high | 91 | Very high | 113 Ų | 113 | 102.2 Ų | 102.2 | 53% | 0.528 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.1 | -44 | 177.2 | -176.5 | 177.5 | -172.4 | 0 | 0 | 111.5 | W165 E166 R171 E172 K173 | W165-E169 WeakPolarHBondContact O-CB 3.29Å; W165-E169 PolarHBondContact O-N 2.9Å; E166-E169 PolarHBondContact O-N 2.88Å; E169-R171 VanDerWaalsContact C-N 3.34Å; E169-R171 PolarHBondContact O-N 2.74Å; E169-E172 PolarHBondContact O-N 3.13Å; E169-K173 VanDerWaalsContact O-CB 3.29Å; E169-K173 WeakPolarHBondContact O-CB 3.25Å; E169-K173 PolarHBondContact O-N 3.32Å |
| 170 | A | 91.9 | Very high | 90.8 | Very high | 48 Ų | 48 | 104.5 Ų | 104.5 | 40% | 0.397 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.9 | -45 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | E166 K173 D174 | E166-A170 WeakPolarHBondContact O-CB 3.42Å; E166-A170 PolarHBondContact O-N 3.38Å; A170-K173 PolarHBondContact O-N 3.49Å; A170-D174 WeakPolarHBondContact O-CB 3.47Å; A170-D174 PolarHBondContact O-N 2.89Å |
| 171 | R | 87.6 | Confident | 90.9 | Very high | 155 Ų | 155 | 102.7 Ų | 102.7 | 59% | 0.585 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.3 | -45.2 | 174.7 | -81.2 | -175.7 | -179.8 | -109.7 | 1.5 | 112.2 | V167 K168 E169 K173 D174 F175 | V167-R171 WeakPolarHBondContact O-CB 3.43Å; V167-R171 WeakPolarHBondContact O-CG 3.35Å; V167-R171 PolarHBondContact O-N 3.21Å; K168-R171 PolarHBondContact O-N 3.05Å; E169-R171 VanDerWaalsContact C-N 3.34Å; E169-R171 PolarHBondContact O-N 2.74Å; R171-K173 VanDerWaalsContact C-N 3.31Å; R171-K173 PolarHBondContact O-N 2.96Å; R171-D174 PolarHBondContact O-N 3.05Å; R171-F175 HydrophobicContact CB-CD2 4.26Å; R171-F175 HydrophobicContact CB-CE2 4.25Å; R171-F175 WeakPolarHBondContact O-CB 3.36Å; R171-F175 WeakPolarHBondContact O-CD2 3.42Å; R171-F175 WeakPolarHBondContact O-CG 3.41Å; R171-F175 PolarHBondContact O-N 2.83Å |
| 172 | E | 89.6 | Confident | 90.9 | Very high | 122 Ų | 122 | 103.1 Ų | 103.1 | 57% | 0.57 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.2 | -41.5 | -179.6 | -165.2 | 156.9 | -172.5 | 0 | 0 | 110.7 | K168 E169 F175 S176 | K168-E172 WeakPolarHBondContact O-CB 3.49Å; K168-E172 PolarHBondContact O-N 3.38Å; E169-E172 PolarHBondContact O-N 3.13Å; E172-F175 PolarHBondContact O-N 2.9Å; E172-S176 WeakPolarHBondContact O-CB 3.41Å; E172-S176 PolarHBondContact O-N 3.39Å; E172-S176 PolarHBondContact O-OG 3.06Å; E172-S176 VanDerWaalsContact O-OG 3.06Å |
| 173 | K | 92.1 | Very high | 90.7 | Very high | 153 Ų | 153 | 104.2 Ų | 104.2 | 67% | 0.665 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64 | -43.4 | 172.9 | -173.6 | 171 | -177.2 | 163 | 0 | 112.8 | E169 A170 R171 S176 S177 | E169-K173 VanDerWaalsContact O-CB 3.29Å; E169-K173 WeakPolarHBondContact O-CB 3.25Å; E169-K173 PolarHBondContact O-N 3.32Å; A170-K173 PolarHBondContact O-N 3.49Å; R171-K173 VanDerWaalsContact C-N 3.31Å; R171-K173 PolarHBondContact O-N 2.96Å; K173-S176 PolarHBondContact O-N 3.35Å; K173-S177 VanDerWaalsContact O-CB 3.26Å; K173-S177 WeakPolarHBondContact O-CB 3.16Å; K173-S177 PolarHBondContact O-N 3.24Å; K173-S177 PolarHBondContact O-OG 3.1Å |
| 174 | D | 91.8 | Very high | 90.6 | Very high | 102 Ų | 102 | 108 Ų | 108 | 55% | 0.545 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.4 | -44.1 | 176.9 | -74.2 | -14 | 0 | 0 | 0 | 110.6 | A170 R171 S177 L178 | A170-D174 WeakPolarHBondContact O-CB 3.47Å; A170-D174 PolarHBondContact O-N 2.89Å; R171-D174 PolarHBondContact O-N 3.05Å; D174-S177 WeakPolarHBondContact CA-OG 3.32Å; D174-S177 PolarHBondContact O-N 3.27Å; D174-S177 PolarHBondContact O-OG 3.11Å; D174-L178 VanDerWaalsContact O-CB 3.22Å; D174-L178 WeakPolarHBondContact O-CB 3.06Å; D174-L178 PolarHBondContact O-N 2.86Å |
| 175 | F | 90.6 | Very high | 90.5 | Very high | 129 Ų | 129 | 111 Ų | 111 | 57% | 0.566 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63 | -45 | 175.1 | -79.8 | -62.5 | 0 | 0 | 0 | 112 | R171 E172 S177 L178 E179 | R171-F175 HydrophobicContact CB-CD2 4.26Å; R171-F175 HydrophobicContact CB-CE2 4.25Å; R171-F175 WeakPolarHBondContact O-CB 3.36Å; R171-F175 WeakPolarHBondContact O-CD2 3.42Å; R171-F175 WeakPolarHBondContact O-CG 3.41Å; R171-F175 PolarHBondContact O-N 2.83Å; E172-F175 PolarHBondContact O-N 2.9Å; F175-S177 VanDerWaalsContact C-N 3.34Å; F175-S177 PolarHBondContact O-N 3.32Å; F175-L178 PolarHBondContact O-N 2.82Å; F175-E179 VanDerWaalsContact O-CB 3.28Å; F175-E179 WeakPolarHBondContact O-CB 3.36Å; F175-E179 PolarHBondContact O-N 3.28Å |
| 176 | S | 87.8 | Confident | 90.1 | Very high | 67 Ų | 67 | 108.4 Ų | 108.4 | 47% | 0.469 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.2 | -37 | 175.1 | -64 | 0 | 0 | 0 | 0 | 112.4 | E172 K173 K180 | E172-S176 WeakPolarHBondContact O-CB 3.41Å; E172-S176 PolarHBondContact O-N 3.39Å; E172-S176 PolarHBondContact O-OG 3.06Å; E172-S176 VanDerWaalsContact O-OG 3.06Å; K173-S176 PolarHBondContact O-N 3.35Å; S176-K180 WeakPolarHBondContact O-CB 3.33Å; S176-K180 PolarHBondContact O-N 2.93Å |
| 177 | S | 84.5 | Confident | 89.8 | Confident | 58 Ų | 58 | 105.6 Ų | 105.6 | 41% | 0.406 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.4 | -36.9 | 176.2 | 77.4 | 0 | 0 | 0 | 0 | 111.9 | K173 D174 F175 T181 | K173-S177 VanDerWaalsContact O-CB 3.26Å; K173-S177 WeakPolarHBondContact O-CB 3.16Å; K173-S177 PolarHBondContact O-N 3.24Å; K173-S177 PolarHBondContact O-OG 3.1Å; D174-S177 WeakPolarHBondContact CA-OG 3.32Å; D174-S177 PolarHBondContact O-N 3.27Å; D174-S177 PolarHBondContact O-OG 3.11Å; F175-S177 VanDerWaalsContact C-N 3.34Å; F175-S177 PolarHBondContact O-N 3.32Å; S177-T181 VanDerWaalsContact O-CB 3.29Å; S177-T181 WeakPolarHBondContact O-CB 3.39Å; S177-T181 PolarHBondContact O-N 2.97Å; S177-T181 PolarHBondContact O-OG1 3.42Å |
| 178 | L | 87.9 | Confident | 89.6 | Confident | 100 Ų | 100 | 105.5 Ų | 105.5 | 52% | 0.524 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -70.7 | -44.3 | 176.4 | -177.3 | 65.4 | 0 | 0 | 0 | 110.6 | D174 F175 T181 V182 | D174-L178 VanDerWaalsContact O-CB 3.22Å; D174-L178 WeakPolarHBondContact O-CB 3.06Å; D174-L178 PolarHBondContact O-N 2.86Å; F175-L178 PolarHBondContact O-N 2.82Å; L178-T181 PolarHBondContact O-N 3.13Å; L178-V182 HydrophobicContact CD1-CG2 4.22Å; L178-V182 HydrophobicContact CG-CG2 4.32Å; L178-V182 VanDerWaalsContact O-CB 3.3Å; L178-V182 WeakPolarHBondContact O-CB 3.27Å; L178-V182 WeakPolarHBondContact O-CG2 3.44Å; L178-V182 PolarHBondContact O-N 2.92Å |
| 179 | E | 88.6 | Confident | 89.3 | Confident | 118 Ų | 118 | 103 Ų | 103 | 55% | 0.551 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -57.7 | -50.3 | 174.2 | -177.5 | 173.5 | -161 | 0 | 0 | 110.3 | F175 T181 V182 E183 | F175-E179 VanDerWaalsContact O-CB 3.28Å; F175-E179 WeakPolarHBondContact O-CB 3.36Å; F175-E179 PolarHBondContact O-N 3.28Å; E179-T181 VanDerWaalsContact C-N 3.34Å; E179-T181 PolarHBondContact O-N 2.92Å; E179-V182 PolarHBondContact O-N 3.37Å; E179-E183 WeakPolarHBondContact O-CB 3.3Å; E179-E183 WeakPolarHBondContact O-CG 3.48Å; E179-E183 PolarHBondContact O-N 3.4Å |
| 180 | K | 90.9 | Very high | 88.7 | Confident | 142 Ų | 142 | 101.1 Ų | 101.1 | 62% | 0.617 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.6 | -43.7 | 175.6 | -172.8 | -179.4 | 178 | -176.2 | 0 | 112.3 | S176 V182 E183 E184 | S176-K180 WeakPolarHBondContact O-CB 3.33Å; S176-K180 PolarHBondContact O-N 2.93Å; K180-V182 VanDerWaalsContact C-N 3.34Å; K180-E183 PolarHBondContact O-N 3.17Å; K180-E184 WeakPolarHBondContact O-CB 3.5Å; K180-E184 PolarHBondContact O-N 2.79Å |
| 181 | T | 91.3 | Very high | 88.5 | Confident | 73 Ų | 73 | 105.6 Ų | 105.6 | 45% | 0.448 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.1 | -39.3 | 177.8 | -58.6 | 0 | 0 | 0 | 0 | 111.1 | S177 L178 E179 R185 | S177-T181 VanDerWaalsContact O-CB 3.29Å; S177-T181 WeakPolarHBondContact O-CB 3.39Å; S177-T181 PolarHBondContact O-N 2.97Å; S177-T181 PolarHBondContact O-OG1 3.42Å; L178-T181 PolarHBondContact O-N 3.13Å; E179-T181 VanDerWaalsContact C-N 3.34Å; E179-T181 PolarHBondContact O-N 2.92Å; T181-R185 HydrophobicContact CG2-CG 4.35Å; T181-R185 VanDerWaalsContact O-CB 3.27Å; T181-R185 WeakPolarHBondContact O-CB 3.34Å; T181-R185 WeakPolarHBondContact O-CG 3.44Å; T181-R185 PolarHBondContact O-N 3.44Å |
| 182 | V | 89.4 | Confident | 88.6 | Confident | 71 Ų | 71 | 101.4 Ų | 101.4 | 43% | 0.43 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -69.6 | -42.2 | 177.8 | 167.7 | 0 | 0 | 0 | 0 | 110.6 | L178 E179 K180 R185 L186 | L178-V182 HydrophobicContact CD1-CG2 4.22Å; L178-V182 HydrophobicContact CG-CG2 4.32Å; L178-V182 VanDerWaalsContact O-CB 3.3Å; L178-V182 WeakPolarHBondContact O-CB 3.27Å; L178-V182 WeakPolarHBondContact O-CG2 3.44Å; L178-V182 PolarHBondContact O-N 2.92Å; E179-V182 PolarHBondContact O-N 3.37Å; K180-V182 VanDerWaalsContact C-N 3.34Å; V182-R185 PolarHBondContact O-N 3.46Å; V182-L186 HydrophobicContact CG1-CD1 3.79Å; V182-L186 HydrophobicContact CG1-CG 4.35Å; V182-L186 VanDerWaalsContact O-CB 3.25Å; V182-L186 WeakPolarHBondContact O-CB 3.42Å; V182-L186 VanDerWaalsContact O-CG 3.24Å; V182-L186 WeakPolarHBondContact O-CG 3.21Å; V182-L186 PolarHBondContact O-N 3.4Å |
| 183 | E | 90.3 | Very high | 88.2 | Confident | 120 Ų | 120 | 99.8 Ų | 99.8 | 56% | 0.561 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.7 | -46.5 | 173.5 | -76.5 | -172.5 | 158.3 | 0 | 0 | 111.5 | E179 K180 L186 A187 | E179-E183 WeakPolarHBondContact O-CB 3.3Å; E179-E183 WeakPolarHBondContact O-CG 3.48Å; E179-E183 PolarHBondContact O-N 3.4Å; K180-E183 PolarHBondContact O-N 3.17Å; E183-L186 PolarHBondContact O-N 3.3Å; E183-A187 VanDerWaalsContact O-CB 3.31Å; E183-A187 WeakPolarHBondContact O-CB 3.36Å; E183-A187 PolarHBondContact O-N 3.44Å |
| 184 | E | 90.5 | Very high | 87.8 | Confident | 106 Ų | 106 | 95.9 Ų | 95.9 | 50% | 0.495 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.1 | -44.1 | 177.6 | -171.6 | 165.1 | -159.3 | 0 | 0 | 110.8 | K180 A187 E188 | K180-E184 WeakPolarHBondContact O-CB 3.5Å; K180-E184 PolarHBondContact O-N 2.79Å; E184-A187 PolarHBondContact O-N 2.88Å; E184-E188 VanDerWaalsContact O-CB 3.31Å; E184-E188 WeakPolarHBondContact O-CB 3.26Å; E184-E188 VanDerWaalsContact O-CG 3.29Å; E184-E188 WeakPolarHBondContact O-CG 3.26Å; E184-E188 PolarHBondContact O-N 3.47Å |
| 185 | R | 87.4 | Confident | 87.3 | Confident | 154 Ų | 154 | 93 Ų | 93 | 58% | 0.581 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.2 | -37.9 | 174.7 | -72.1 | -62.2 | -172.6 | -162.8 | 2 | 113 | T181 V182 E188 V189 | T181-R185 HydrophobicContact CG2-CG 4.35Å; T181-R185 VanDerWaalsContact O-CB 3.27Å; T181-R185 WeakPolarHBondContact O-CB 3.34Å; T181-R185 WeakPolarHBondContact O-CG 3.44Å; T181-R185 PolarHBondContact O-N 3.44Å; V182-R185 PolarHBondContact O-N 3.46Å; R185-E188 IonicContact CZ-OE2 3.83Å; R185-E188 IonicContact NE-OE2 3.38Å; R185-E188 IonicContact NH1-OE2 2.85Å; R185-E188 PolarHBondContact NH1-OE2 3.13Å; R185-V189 VanDerWaalsContact O-CB 3.24Å; R185-V189 WeakPolarHBondContact O-CB 3.31Å; R185-V189 WeakPolarHBondContact O-CG2 3.46Å; R185-V189 PolarHBondContact O-N 3.43Å |
| 186 | L | 86.8 | Confident | 86.8 | Confident | 114 Ų | 114 | 89.9 Ų | 89.9 | 60% | 0.597 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67.4 | -40.3 | 175.6 | -80 | 168.8 | 0 | 0 | 0 | 111.1 | V182 E183 S190 | V182-L186 HydrophobicContact CG1-CD1 3.79Å; V182-L186 HydrophobicContact CG1-CG 4.35Å; V182-L186 VanDerWaalsContact O-CB 3.25Å; V182-L186 WeakPolarHBondContact O-CB 3.42Å; V182-L186 VanDerWaalsContact O-CG 3.24Å; V182-L186 WeakPolarHBondContact O-CG 3.21Å; V182-L186 PolarHBondContact O-N 3.4Å; E183-L186 PolarHBondContact O-N 3.3Å; L186-S190 WeakPolarHBondContact O-CB 3.31Å; L186-S190 PolarHBondContact O-N 3.27Å |
| 187 | A | 86.7 | Confident | 86.2 | Confident | 57 Ų | 57 | 93 Ų | 93 | 47% | 0.471 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66 | -47.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | E183 E184 V189 S190 Q191 | E183-A187 VanDerWaalsContact O-CB 3.31Å; E183-A187 WeakPolarHBondContact O-CB 3.36Å; E183-A187 PolarHBondContact O-N 3.44Å; E184-A187 PolarHBondContact O-N 2.88Å; A187-V189 PolarHBondContact O-N 3.01Å; A187-S190 PolarHBondContact O-N 3.35Å; A187-Q191 WeakPolarHBondContact O-CB 3.12Å; A187-Q191 PolarHBondContact O-N 3.43Å |
| 188 | E | 88.8 | Confident | 86 | Confident | 82 Ų | 82 | 92.8 Ų | 92.8 | 38% | 0.383 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.3 | -44.6 | 175.7 | -79.1 | -179.7 | 171.6 | 0 | 0 | 111.8 | E184 R185 Q191 S192 | E184-E188 VanDerWaalsContact O-CB 3.31Å; E184-E188 WeakPolarHBondContact O-CB 3.26Å; E184-E188 VanDerWaalsContact O-CG 3.29Å; E184-E188 WeakPolarHBondContact O-CG 3.26Å; E184-E188 PolarHBondContact O-N 3.47Å; R185-E188 IonicContact CZ-OE2 3.83Å; R185-E188 IonicContact NE-OE2 3.38Å; R185-E188 IonicContact NH1-OE2 2.85Å; R185-E188 PolarHBondContact NH1-OE2 3.13Å; E188-Q191 PolarHBondContact O-N 3.16Å; E188-S192 WeakPolarHBondContact O-CA 3.49Å; E188-S192 WeakPolarHBondContact O-CB 3.26Å; E188-S192 PolarHBondContact O-N 3.48Å |
| 189 | V | 87.6 | Confident | 85.6 | Confident | 78 Ų | 78 | 94.4 Ų | 94.4 | 47% | 0.473 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.9 | -43.1 | 178.5 | 168.8 | 0 | 0 | 0 | 0 | 110.7 | R185 A187 Q191 S192 I193 | R185-V189 VanDerWaalsContact O-CB 3.24Å; R185-V189 WeakPolarHBondContact O-CB 3.31Å; R185-V189 WeakPolarHBondContact O-CG2 3.46Å; R185-V189 PolarHBondContact O-N 3.43Å; A187-V189 PolarHBondContact O-N 3.01Å; V189-Q191 VanDerWaalsContact C-N 3.32Å; V189-Q191 PolarHBondContact O-N 3.06Å; V189-S192 PolarHBondContact O-N 2.96Å; V189-I193 HydrophobicContact CG1-CD1 3.57Å; V189-I193 HydrophobicContact CG1-CG1 4.22Å; V189-I193 VanDerWaalsContact O-CB 3.3Å; V189-I193 WeakPolarHBondContact O-CB 3.45Å; V189-I193 WeakPolarHBondContact O-CG1 3.41Å; V189-I193 PolarHBondContact O-N 3.48Å |
| 190 | S | 81.3 | Confident | 85.1 | Confident | 74 Ų | 74 | 95.7 Ų | 95.7 | 52% | 0.517 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.6 | -43.2 | 175.4 | -177.6 | 0 | 0 | 0 | 0 | 111.5 | L186 A187 S194 | L186-S190 WeakPolarHBondContact O-CB 3.31Å; L186-S190 PolarHBondContact O-N 3.27Å; A187-S190 PolarHBondContact O-N 3.35Å; S190-S194 VanDerWaalsContact O-CB 3.27Å; S190-S194 WeakPolarHBondContact O-CB 3.31Å; S190-S194 PolarHBondContact O-N 2.99Å; S190-S194 PolarHBondContact O-OG 3.24Å |
| 191 | Q | 88.1 | Confident | 84.3 | Confident | 142 Ų | 142 | 91.8 Ų | 91.8 | 66% | 0.664 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -70.2 | -40.7 | 177 | -173 | 174.5 | 5.6 | 0 | 0 | 112 | A187 E188 V189 S194 A195 | A187-Q191 WeakPolarHBondContact O-CB 3.12Å; A187-Q191 PolarHBondContact O-N 3.43Å; E188-Q191 PolarHBondContact O-N 3.16Å; V189-Q191 VanDerWaalsContact C-N 3.32Å; V189-Q191 PolarHBondContact O-N 3.06Å; Q191-S194 PolarHBondContact O-N 2.86Å; Q191-A195 WeakPolarHBondContact O-CB 3.4Å; Q191-A195 PolarHBondContact O-N 3.15Å |
| 192 | S | 87.7 | Confident | 83.6 | Confident | 68 Ų | 68 | 94.5 Ų | 94.5 | 48% | 0.476 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.3 | -39.1 | 177.2 | 177.2 | 0 | 0 | 0 | 0 | 111.4 | E188 V189 S196 | E188-S192 WeakPolarHBondContact O-CA 3.49Å; E188-S192 WeakPolarHBondContact O-CB 3.26Å; E188-S192 PolarHBondContact O-N 3.48Å; V189-S192 PolarHBondContact O-N 2.96Å; S192-S196 WeakPolarHBondContact O-CA 3.43Å; S192-S196 WeakPolarHBondContact O-CB 3.46Å; S192-S196 PolarHBondContact O-N 2.95Å; S192-S196 PolarHBondContact O-OG 3.3Å |
| 193 | I | 81.9 | Confident | 82.9 | Confident | 88 Ų | 88 | 92.9 Ų | 92.9 | 45% | 0.451 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.4 | -43 | 172.4 | -69.7 | 168.9 | 0 | 0 | 0 | 110.1 | V189 S196 M197 | V189-I193 HydrophobicContact CG1-CD1 3.57Å; V189-I193 HydrophobicContact CG1-CG1 4.22Å; V189-I193 VanDerWaalsContact O-CB 3.3Å; V189-I193 WeakPolarHBondContact O-CB 3.45Å; V189-I193 WeakPolarHBondContact O-CG1 3.41Å; V189-I193 PolarHBondContact O-N 3.48Å; I193-S196 PolarHBondContact O-N 3.2Å; I193-M197 HydrophobicContact CG2-CG 4.24Å; I193-M197 HydrophobicContact CG2-SD 3.93Å; I193-M197 VanDerWaalsContact O-CB 3.24Å; I193-M197 WeakPolarHBondContact O-CB 3.39Å; I193-M197 VanDerWaalsContact O-CG 3.26Å; I193-M197 WeakPolarHBondContact O-CG 3.43Å; I193-M197 PolarHBondContact O-N 3.41Å |
| 194 | S | 83.5 | Confident | 82 | Confident | 70 Ų | 70 | 92.4 Ų | 92.4 | 49% | 0.49 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 177.8 | -61.2 | 0 | 0 | 0 | 0 | 111.7 | S190 Q191 M197 A198 | S190-S194 VanDerWaalsContact O-CB 3.27Å; S190-S194 WeakPolarHBondContact O-CB 3.31Å; S190-S194 PolarHBondContact O-N 2.99Å; S190-S194 PolarHBondContact O-OG 3.24Å; Q191-S194 PolarHBondContact O-N 2.86Å; S194-M197 PolarHBondContact O-N 3.46Å; S194-A198 VanDerWaalsContact O-CB 3.26Å; S194-A198 WeakPolarHBondContact O-CB 3.33Å; S194-A198 PolarHBondContact O-N 3.39Å |
| 195 | A | 82.4 | Confident | 81.3 | Confident | 43 Ų | 43 | 88.5 Ų | 88.5 | 36% | 0.355 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.8 | -44.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q191 M197 A198 E199 | Q191-A195 WeakPolarHBondContact O-CB 3.4Å; Q191-A195 PolarHBondContact O-N 3.15Å; A195-M197 VanDerWaalsContact C-N 3.33Å; A195-M197 PolarHBondContact O-N 2.9Å; A195-A198 CarbonylContact O-C 3.58Å; A195-A198 PolarHBondContact O-N 2.78Å; A195-E199 VanDerWaalsContact O-CB 3.3Å; A195-E199 WeakPolarHBondContact O-CB 3.38Å; A195-E199 WeakPolarHBondContact O-CG 3.47Å; A195-E199 PolarHBondContact O-N 2.86Å |
| 196 | S | 79.9 | Confident | 80.4 | Confident | 63 Ų | 63 | 85.5 Ų | 85.5 | 44% | 0.441 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.4 | -35.2 | 176.5 | -59.8 | 0 | 0 | 0 | 0 | 112 | S192 I193 F200 | S192-S196 WeakPolarHBondContact O-CA 3.43Å; S192-S196 WeakPolarHBondContact O-CB 3.46Å; S192-S196 PolarHBondContact O-N 2.95Å; S192-S196 PolarHBondContact O-OG 3.3Å; I193-S196 PolarHBondContact O-N 3.2Å; S196-F200 WeakPolarHBondContact O-CA 3.26Å; S196-F200 WeakPolarHBondContact O-CB 3.38Å; S196-F200 PolarHBondContact O-N 3.47Å |
| 197 | M | 75.4 | Confident | 79.5 | Confident | 131 Ų | 131 | 82.3 Ų | 82.3 | 65% | 0.645 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -72.8 | -35.3 | 174.3 | -77.9 | -177.5 | 65.4 | 0 | 0 | 111.7 | I193 S194 A195 A201 | I193-M197 HydrophobicContact CG2-CG 4.24Å; I193-M197 HydrophobicContact CG2-SD 3.93Å; I193-M197 VanDerWaalsContact O-CB 3.24Å; I193-M197 WeakPolarHBondContact O-CB 3.39Å; I193-M197 VanDerWaalsContact O-CG 3.26Å; I193-M197 WeakPolarHBondContact O-CG 3.43Å; I193-M197 PolarHBondContact O-N 3.41Å; S194-M197 PolarHBondContact O-N 3.46Å; A195-M197 VanDerWaalsContact C-N 3.33Å; A195-M197 PolarHBondContact O-N 2.9Å; M197-A201 WeakPolarHBondContact O-CB 3.35Å; M197-A201 PolarHBondContact O-N 2.91Å |
| 198 | A | 79.1 | Confident | 78.7 | Confident | 54 Ų | 54 | 86.2 Ų | 86.2 | 45% | 0.446 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.5 | -47.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | S194 A195 F200 A201 E202 | S194-A198 VanDerWaalsContact O-CB 3.26Å; S194-A198 WeakPolarHBondContact O-CB 3.33Å; S194-A198 PolarHBondContact O-N 3.39Å; A195-A198 CarbonylContact O-C 3.58Å; A195-A198 PolarHBondContact O-N 2.78Å; A198-F200 VanDerWaalsContact C-N 3.29Å; A198-F200 PolarHBondContact O-N 2.84Å; A198-A201 PolarHBondContact O-N 3.43Å; A198-E202 WeakPolarHBondContact O-CB 3.26Å; A198-E202 PolarHBondContact O-N 3.49Å |
| 199 | E | 79.9 | Confident | 78 | Confident | 135 Ų | 135 | 91.2 Ų | 91.2 | 63% | 0.631 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.4 | -31.5 | 173.3 | -74.9 | -179.3 | -177.3 | 0 | 0 | 112 | A195 G203 | A195-E199 VanDerWaalsContact O-CB 3.3Å; A195-E199 WeakPolarHBondContact O-CB 3.38Å; A195-E199 WeakPolarHBondContact O-CG 3.47Å; A195-E199 PolarHBondContact O-N 2.86Å; E199-G203 WeakPolarHBondContact O-CA 3.39Å; E199-G203 PolarHBondContact O-N 3.06Å |
| 200 | F | 77.4 | Confident | 77.3 | Confident | 145 Ų | 145 | 92 Ų | 92 | 64% | 0.636 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -74.5 | -39.1 | 172.9 | -177.7 | -94.5 | 0 | 0 | 0 | 111.5 | S196 A198 G203 Q204 | S196-F200 WeakPolarHBondContact O-CA 3.26Å; S196-F200 WeakPolarHBondContact O-CB 3.38Å; S196-F200 PolarHBondContact O-N 3.47Å; A198-F200 VanDerWaalsContact C-N 3.29Å; A198-F200 PolarHBondContact O-N 2.84Å; F200-G203 CarbonylContact O-C 3.52Å; F200-Q204 WeakPolarHBondContact O-CA 3.38Å; F200-Q204 WeakPolarHBondContact O-CB 3.36Å; F200-Q204 PolarHBondContact O-N 2.84Å |
| 201 | A | 75.5 | Confident | 76.8 | Confident | 60 Ų | 60 | 94.1 Ų | 94.1 | 50% | 0.496 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -71.6 | -41.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | M197 A198 Q204 G205 | M197-A201 WeakPolarHBondContact O-CB 3.35Å; M197-A201 PolarHBondContact O-N 2.91Å; A198-A201 PolarHBondContact O-N 3.43Å; A201-Q204 PolarHBondContact O-N 3.15Å; A201-G205 PolarHBondContact O-N 3.46Å |
| 202 | E | 75.7 | Confident | 76 | Confident | 130 Ų | 130 | 90.4 Ų | 90.4 | 61% | 0.607 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.3 | -49.8 | 170.9 | -174.2 | 170.8 | -164.7 | 0 | 0 | 109.3 | A198 Q204 G205 E206 | A198-E202 WeakPolarHBondContact O-CB 3.26Å; A198-E202 PolarHBondContact O-N 3.49Å; E202-Q204 VanDerWaalsContact C-N 3.26Å; E202-Q204 PolarHBondContact O-N 3.33Å; E202-G205 CarbonylContact O-C 3.59Å; E202-G205 PolarHBondContact O-N 3.46Å; E202-E206 WeakPolarHBondContact O-CA 3.37Å; E202-E206 WeakPolarHBondContact O-CB 3.33Å; E202-E206 PolarHBondContact O-N 3.34Å |
| 203 | G | 76 | Confident | 75 | Confident | 36 Ų | 36 | 91 Ų | 91 | 37% | 0.371 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.4 | -30.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | E199 F200 A207 | E199-G203 WeakPolarHBondContact O-CA 3.39Å; E199-G203 PolarHBondContact O-N 3.06Å; F200-G203 CarbonylContact O-C 3.52Å; G203-A207 WeakPolarHBondContact O-CA 3.5Å; G203-A207 WeakPolarHBondContact O-CB 3.44Å; G203-A207 PolarHBondContact O-N 3.46Å |
| 204 | Q | 69.9 | Low | 74.1 | Confident | 110 Ų | 110 | 91.6 Ų | 91.6 | 51% | 0.514 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -76.2 | -38.4 | 173.4 | -173.5 | 179.1 | 1.8 | 0 | 0 | 111.5 | F200 A201 E202 Q208 | F200-Q204 WeakPolarHBondContact O-CA 3.38Å; F200-Q204 WeakPolarHBondContact O-CB 3.36Å; F200-Q204 PolarHBondContact O-N 2.84Å; A201-Q204 PolarHBondContact O-N 3.15Å; E202-Q204 VanDerWaalsContact C-N 3.26Å; E202-Q204 PolarHBondContact O-N 3.33Å; Q204-Q208 WeakPolarHBondContact O-CB 3.23Å; Q204-Q208 PolarHBondContact O-N 2.89Å |
| 205 | G | 75.8 | Confident | 73.1 | Confident | 25 Ų | 25 | 98.3 Ų | 98.3 | 26% | 0.258 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -72.3 | -36.4 | 174 | 0 | 0 | 0 | 0 | 0 | 113.5 | A201 E202 R209 | A201-G205 PolarHBondContact O-N 3.46Å; E202-G205 CarbonylContact O-C 3.59Å; E202-G205 PolarHBondContact O-N 3.46Å; G205-R209 WeakPolarHBondContact O-CB 3.37Å; G205-R209 PolarHBondContact O-N 2.82Å |
| 206 | E | 70.2 | Confident | 72.2 | Confident | 90 Ų | 90 | 99.1 Ų | 99.1 | 42% | 0.421 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -70.3 | -46.3 | 173.4 | -169.7 | 84.2 | -155.9 | 0 | 0 | 109 | E202 Q208 R209 Q210 | E202-E206 WeakPolarHBondContact O-CA 3.37Å; E202-E206 WeakPolarHBondContact O-CB 3.33Å; E202-E206 PolarHBondContact O-N 3.34Å; E206-Q208 VanDerWaalsContact C-N 3.32Å; E206-Q208 PolarHBondContact O-N 3.09Å; E206-R209 CarbonylContact O-C 3.59Å; E206-R209 PolarHBondContact O-N 3.36Å; E206-Q210 HydrophobicContact CG-CG 4.29Å; E206-Q210 WeakPolarHBondContact O-CA 3.44Å; E206-Q210 WeakPolarHBondContact O-CB 3.44Å; E206-Q210 VanDerWaalsContact O-CG 3.22Å; E206-Q210 WeakPolarHBondContact O-CG 3.31Å; E206-Q210 PolarHBondContact O-N 2.94Å; E206-Q210 PolarHBondContact OE1-NE2 2.79Å |
| 207 | A | 67.9 | Low | 71 | Confident | 47 Ų | 47 | 103.8 Ų | 103.8 | 39% | 0.388 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.6 | -33.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G203 L211 | G203-A207 WeakPolarHBondContact O-CA 3.5Å; G203-A207 WeakPolarHBondContact O-CB 3.44Å; G203-A207 PolarHBondContact O-N 3.46Å; A207-L211 WeakPolarHBondContact O-CB 3.32Å; A207-L211 PolarHBondContact O-N 2.81Å |
| 208 | Q | 69.6 | Low | 70.1 | Confident | 140 Ų | 140 | 104.6 Ų | 104.6 | 65% | 0.654 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -69.4 | -40.7 | 170.7 | -100.6 | -178.8 | -17.4 | 0 | 0 | 112.5 | Q204 E206 L211 A212 | Q204-Q208 WeakPolarHBondContact O-CB 3.23Å; Q204-Q208 PolarHBondContact O-N 2.89Å; E206-Q208 VanDerWaalsContact C-N 3.32Å; E206-Q208 PolarHBondContact O-N 3.09Å; Q208-L211 PolarHBondContact O-N 3.02Å; Q208-A212 WeakPolarHBondContact O-CB 3.46Å; Q208-A212 PolarHBondContact O-N 3.36Å |
| 209 | R | 72.9 | Confident | 69 | Low | 187 Ų | 187 | 105 Ų | 105 | 71% | 0.706 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -66.2 | -45.2 | 174.2 | -93.8 | -171.1 | 171.3 | 90.6 | -0.9 | 111.9 | G205 E206 A212 D213 | G205-R209 WeakPolarHBondContact O-CB 3.37Å; G205-R209 PolarHBondContact O-N 2.82Å; E206-R209 CarbonylContact O-C 3.59Å; E206-R209 PolarHBondContact O-N 3.36Å; R209-A212 CarbonylContact O-C 3.55Å; R209-A212 PolarHBondContact O-N 2.82Å; R209-D213 VanDerWaalsContact O-CB 3.24Å; R209-D213 WeakPolarHBondContact O-CB 3.45Å; R209-D213 PolarHBondContact O-N 3.48Å |
| 210 | Q | 73.4 | Confident | 67.9 | Low | 95 Ų | 95 | 105.8 Ų | 105.8 | 44% | 0.444 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -69.4 | -31.1 | 175.9 | -70.6 | 179.1 | 3.7 | 0 | 0 | 110.8 | E206 L214 | E206-Q210 HydrophobicContact CG-CG 4.29Å; E206-Q210 WeakPolarHBondContact O-CA 3.44Å; E206-Q210 WeakPolarHBondContact O-CB 3.44Å; E206-Q210 VanDerWaalsContact O-CG 3.22Å; E206-Q210 WeakPolarHBondContact O-CG 3.31Å; E206-Q210 PolarHBondContact O-N 2.94Å; E206-Q210 PolarHBondContact OE1-NE2 2.79Å; Q210-L214 WeakPolarHBondContact O-CA 3.41Å; Q210-L214 WeakPolarHBondContact O-CB 3.3Å; Q210-L214 WeakPolarHBondContact O-CD1 3.43Å; Q210-L214 WeakPolarHBondContact O-CG 3.24Å; Q210-L214 PolarHBondContact O-N 3.45Å |
| 211 | L | 70.7 | Confident | 66.8 | Low | 117 Ų | 117 | 102.8 Ų | 102.8 | 61% | 0.613 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -67.2 | -39.5 | 167.7 | -104.3 | 159.2 | 0 | 0 | 0 | 111.6 | A207 Q208 R215 | A207-L211 WeakPolarHBondContact O-CB 3.32Å; A207-L211 PolarHBondContact O-N 2.81Å; Q208-L211 PolarHBondContact O-N 3.02Å; L211-R215 WeakPolarHBondContact O-CB 3.35Å; L211-R215 PolarHBondContact O-N 2.9Å |
| 212 | A | 70.7 | Confident | 65.9 | Low | 64 Ų | 64 | 104.4 Ų | 104.4 | 53% | 0.529 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -70.2 | -39.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | Q208 R209 R215 A216 | Q208-A212 WeakPolarHBondContact O-CB 3.46Å; Q208-A212 PolarHBondContact O-N 3.36Å; R209-A212 CarbonylContact O-C 3.55Å; R209-A212 PolarHBondContact O-N 2.82Å; A212-R215 PolarHBondContact O-N 3.43Å; A212-A216 PolarHBondContact O-N 2.86Å |
| 213 | D | 67.2 | Low | 65.4 | Low | 82 Ų | 82 | 102.9 Ų | 102.9 | 44% | 0.439 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -76 | -40.8 | 178.4 | -166.1 | 59.9 | 0 | 0 | 0 | 111.5 | R209 R215 A216 R217 | R209-D213 VanDerWaalsContact O-CB 3.24Å; R209-D213 WeakPolarHBondContact O-CB 3.45Å; R209-D213 PolarHBondContact O-N 3.48Å; D213-R215 VanDerWaalsContact C-N 3.32Å; D213-A216 CarbonylContact O-C 3.52Å; D213-A216 WeakPolarHBondContact O-CB 3.25Å; D213-A216 PolarHBondContact O-N 3.18Å; D213-A216 VanDerWaalsContact O-N 3.16Å; D213-R217 VanDerWaalsContact O-CB 3.27Å; D213-R217 WeakPolarHBondContact O-CB 3.45Å; D213-R217 VanDerWaalsContact O-CG 3.27Å; D213-R217 WeakPolarHBondContact O-CG 3.32Å; D213-R217 PolarHBondContact O-N 3.36Å; D213-R217 VanDerWaalsContact OD2-CD 3.24Å; D213-R217 WeakPolarHBondContact OD2-CD 3.33Å; D213-R217 IonicContact OD2-CZ 3.86Å; D213-R217 IonicContact OD2-NE 2.68Å; D213-R217 PolarHBondContact OD2-NE 3.31Å |
| 214 | L | 63.5 | Low | 65.1 | Low | 100 Ų | 100 | 106 Ų | 106 | 52% | 0.524 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -65.4 | -34.5 | 168.4 | -74 | 165.8 | 0 | 0 | 0 | 110.7 | Q210 A216 R217 L218 | Q210-L214 WeakPolarHBondContact O-CA 3.41Å; Q210-L214 WeakPolarHBondContact O-CB 3.3Å; Q210-L214 WeakPolarHBondContact O-CD1 3.43Å; Q210-L214 WeakPolarHBondContact O-CG 3.24Å; Q210-L214 PolarHBondContact O-N 3.45Å; L214-A216 VanDerWaalsContact C-N 3.26Å; L214-A216 PolarHBondContact O-N 2.8Å; L214-R217 PolarHBondContact O-N 2.99Å; L214-L218 WeakPolarHBondContact O-CA 3.49Å; L214-L218 WeakPolarHBondContact O-CB 3.5Å; L214-L218 PolarHBondContact O-N 3.27Å |
| 215 | R | 61.7 | Low | 65.3 | Low | 211 Ų | 211 | 103.8 Ų | 103.8 | 80% | 0.796 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -68.1 | -28.3 | 172.7 | -170.1 | 177 | -167 | 131 | 1.2 | 112.2 | L211 A212 D213 | L211-R215 WeakPolarHBondContact O-CB 3.35Å; L211-R215 PolarHBondContact O-N 2.9Å; A212-R215 PolarHBondContact O-N 3.43Å; D213-R215 VanDerWaalsContact C-N 3.32Å |
| 216 | A | 63.4 | Low | 65.3 | Low | 60 Ų | 60 | 107.5 Ų | 107.5 | 50% | 0.496 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -79 | -42.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A212 D213 L214 G219 D220 | A212-A216 PolarHBondContact O-N 2.86Å; D213-A216 CarbonylContact O-C 3.52Å; D213-A216 WeakPolarHBondContact O-CB 3.25Å; D213-A216 PolarHBondContact O-N 3.18Å; D213-A216 VanDerWaalsContact O-N 3.16Å; L214-A216 VanDerWaalsContact C-N 3.26Å; L214-A216 PolarHBondContact O-N 2.8Å; A216-G219 PolarHBondContact O-N 3.02Å; A216-D220 PolarHBondContact O-N 3.45Å |
| 217 | R | 55.3 | Low | 65.7 | Low | 161 Ų | 161 | 107.3 Ų | 107.3 | 61% | 0.608 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -76.5 | -38.8 | -178.4 | -73.8 | 174.1 | 170.2 | -100 | -1.7 | 113.6 | D213 L214 G219 D220 A221 | D213-R217 VanDerWaalsContact O-CB 3.27Å; D213-R217 WeakPolarHBondContact O-CB 3.45Å; D213-R217 VanDerWaalsContact O-CG 3.27Å; D213-R217 WeakPolarHBondContact O-CG 3.32Å; D213-R217 PolarHBondContact O-N 3.36Å; D213-R217 VanDerWaalsContact OD2-CD 3.24Å; D213-R217 WeakPolarHBondContact OD2-CD 3.33Å; D213-R217 IonicContact OD2-CZ 3.86Å; D213-R217 IonicContact OD2-NE 2.68Å; D213-R217 PolarHBondContact OD2-NE 3.31Å; L214-R217 PolarHBondContact O-N 2.99Å; R217-G219 PolarHBondContact O-N 2.99Å; R217-D220 PolarHBondContact O-N 2.93Å; R217-D220 VanDerWaalsContact O-N 3.07Å; R217-A221 PolarHBondContact O-N 3.48Å |
| 218 | L | 57.1 | Low | 66.4 | Low | 148 Ų | 148 | 112.9 Ų | 112.9 | 78% | 0.775 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -19.9 | 169.8 | -160.1 | 83.7 | 0 | 0 | 0 | 111.1 | L214 | L214-L218 WeakPolarHBondContact O-CA 3.49Å; L214-L218 WeakPolarHBondContact O-CB 3.5Å; L214-L218 PolarHBondContact O-N 3.27Å |
| 219 | G | 54.6 | Low | 67.1 | Low | 62 Ų | 62 | 112.8 Ų | 112.8 | 64% | 0.639 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | -23 | 169.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | A216 R217 | A216-G219 PolarHBondContact O-N 3.02Å; R217-G219 PolarHBondContact O-N 2.99Å |
| 220 | D | 57.9 | Low | 67.7 | Low | 151 Ų | 151 | 110.3 Ų | 110.3 | 81% | 0.807 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.6 | -17.5 | -165 | -137.3 | 23 | 0 | 0 | 0 | 116.7 | A216 R217 | A216-D220 PolarHBondContact O-N 3.45Å; R217-D220 PolarHBondContact O-N 2.93Å; R217-D220 VanDerWaalsContact O-N 3.07Å |
| 221 | A | 54.3 | Low | 68.3 | Low | 82 Ų | 82 | 111.3 Ų | 111.3 | 68% | 0.678 | 62% | 0.621 | S | S | * | * | trans | -166.3 | 112.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | R217 | R217-A221 PolarHBondContact O-N 3.48Š| ||
| 222 | A | 56.6 | Low | 69.1 | Low | 94 Ų | 94 | 109.5 Ų | 109.5 | 78% | 0.777 | 62% | 0.618 | S | S | * | * | trans | -96 | 103.3 | 164.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | P224 | A222-P224 WeakPolarHBondContact O-CD 3.28Š| ||
| 223 | D | 65.3 | Low | 70.1 | Confident | 98 Ų | 98 | 108.8 Ų | 108.8 | 52% | 0.524 | 61% | 0.612 | S | S | . | * | trans | -88.9 | 109.3 | 164.9 | -169.2 | -11.8 | 0 | 0 | 0 | 109.2 | A225 L226 | D223-A225 PolarHBondContact O-N 3.47Å; D223-A225 VanDerWaalsContact O-N 3.07Å; D223-A225 PolarHBondContact OD1-N 3.17Å; D223-L226 PolarHBondContact O-N 3.18Å | ||
| 224 | P | 69.6 | Low | 71 | Confident | 103 Ų | 103 | 109 Ų | 109 | 67% | 0.669 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -63.1 | -13.4 | -176.7 | 23.6 | -32.5 | 0 | 0 | 0 | 114.3 | A222 K228 | A222-P224 WeakPolarHBondContact O-CD 3.28Å; P224-K228 PolarHBondContact O-N 3.08Å |
| 225 | A | 73.1 | Confident | 72.3 | Confident | 62 Ų | 62 | 107.1 Ų | 107.1 | 51% | 0.512 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -69.6 | -41.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | D223 K228 Q229 | D223-A225 PolarHBondContact O-N 3.47Å; D223-A225 VanDerWaalsContact O-N 3.07Å; D223-A225 PolarHBondContact OD1-N 3.17Å; A225-K228 PolarHBondContact O-N 3.2Å; A225-Q229 PolarHBondContact O-N 3.35Å |
| 226 | L | 77.3 | Confident | 73.8 | Confident | 104 Ų | 104 | 103 Ų | 103 | 55% | 0.545 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -67.8 | -42.4 | -178.8 | -81.9 | 160.6 | 0 | 0 | 0 | 111.9 | D223 K228 Q229 E230 | D223-L226 PolarHBondContact O-N 3.18Å; L226-K228 VanDerWaalsContact C-N 3.26Å; L226-K228 PolarHBondContact O-N 3.26Å; L226-Q229 WeakPolarHBondContact O-CB 3.25Å; L226-Q229 PolarHBondContact O-N 3.19Å; L226-Q229 VanDerWaalsContact O-N 3.1Å; L226-E230 PolarHBondContact O-N 2.86Å |
| 227 | V | 78.3 | Confident | 75.3 | Confident | 85 Ų | 85 | 103.6 Ų | 103.6 | 52% | 0.515 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -60.5 | -38 | 176.9 | 176.8 | 0 | 0 | 0 | 0 | 111.4 | L231 | V227-L231 HydrophobicContact CG1-CD1 4.09Å; V227-L231 WeakPolarHBondContact O-CB 3.4Å; V227-L231 PolarHBondContact O-N 3.06Å |
| 228 | K | 81.8 | Confident | 77.1 | Confident | 164 Ų | 164 | 100 Ų | 100 | 71% | 0.713 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -68.2 | -36.6 | 176.9 | -170.7 | 179.2 | 177.4 | -175.5 | 0 | 112.1 | P224 A225 L226 S232 | P224-K228 PolarHBondContact O-N 3.08Å; A225-K228 PolarHBondContact O-N 3.2Å; L226-K228 VanDerWaalsContact C-N 3.26Å; L226-K228 PolarHBondContact O-N 3.26Å; K228-S232 WeakPolarHBondContact O-CB 3.49Å; K228-S232 PolarHBondContact O-N 2.74Å |
| 229 | Q | 85.3 | Confident | 78.8 | Confident | 138 Ų | 138 | 95.5 Ų | 95.5 | 65% | 0.645 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65.9 | -45.6 | 176.4 | -176.7 | 177.5 | -16 | 0 | 0 | 111.4 | A225 L226 S232 A233 | A225-Q229 PolarHBondContact O-N 3.35Å; L226-Q229 WeakPolarHBondContact O-CB 3.25Å; L226-Q229 PolarHBondContact O-N 3.19Å; L226-Q229 VanDerWaalsContact O-N 3.1Å; Q229-S232 WeakPolarHBondContact O-CB 3.44Å; Q229-S232 PolarHBondContact O-N 3.35Å; Q229-A233 PolarHBondContact O-N 3.11Å |
| 230 | E | 84.6 | Confident | 80.7 | Confident | 136 Ų | 136 | 98.3 Ų | 98.3 | 64% | 0.636 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65.4 | -41.9 | 177.7 | -68.4 | -174.5 | 164.5 | 0 | 0 | 112.4 | L226 S232 A233 V234 | L226-E230 PolarHBondContact O-N 2.86Å; E230-S232 VanDerWaalsContact C-N 3.27Å; E230-S232 PolarHBondContact O-N 2.8Å; E230-A233 PolarHBondContact O-N 2.78Å; E230-V234 WeakPolarHBondContact O-CG2 3.3Å; E230-V234 PolarHBondContact O-N 2.88Å |
| 231 | L | 85.1 | Confident | 82.3 | Confident | 116 Ų | 116 | 96.1 Ų | 96.1 | 61% | 0.607 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -60.4 | -36.8 | 173.2 | -92.6 | 158.2 | 0 | 0 | 0 | 112.5 | V227 A235 | V227-L231 HydrophobicContact CG1-CD1 4.09Å; V227-L231 WeakPolarHBondContact O-CB 3.4Å; V227-L231 PolarHBondContact O-N 3.06Å; L231-A235 WeakPolarHBondContact O-CB 3.44Å; L231-A235 PolarHBondContact O-N 3.47Å |
| 232 | S | 89 | Confident | 84.2 | Confident | 78 Ų | 78 | 98.6 Ų | 98.6 | 55% | 0.545 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.8 | -42.9 | 175.4 | -165.7 | 0 | 0 | 0 | 0 | 111.7 | K228 Q229 E230 A235 E236 | K228-S232 WeakPolarHBondContact O-CB 3.49Å; K228-S232 PolarHBondContact O-N 2.74Å; Q229-S232 WeakPolarHBondContact O-CB 3.44Å; Q229-S232 PolarHBondContact O-N 3.35Å; E230-S232 VanDerWaalsContact C-N 3.27Å; E230-S232 PolarHBondContact O-N 2.8Å; S232-A235 PolarHBondContact O-N 2.89Å; S232-E236 PolarHBondContact O-N 3.5Å |
| 233 | A | 90.4 | Very high | 86 | Confident | 49 Ų | 49 | 98.3 Ų | 98.3 | 41% | 0.405 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -65.1 | -41.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q229 E230 A235 E236 V237 | Q229-A233 PolarHBondContact O-N 3.11Å; E230-A233 PolarHBondContact O-N 2.78Å; A233-A235 VanDerWaalsContact C-N 3.33Å; A233-A235 PolarHBondContact O-N 3.26Å; A233-E236 PolarHBondContact O-N 2.84Å; A233-V237 WeakPolarHBondContact O-CG2 3.31Å; A233-V237 PolarHBondContact O-N 3.21Å |
| 234 | V | 85.9 | Confident | 87.3 | Confident | 88 Ų | 88 | 96.7 Ų | 96.7 | 53% | 0.533 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -63 | -40.6 | 174.5 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | E230 E236 V237 V238 | E230-V234 WeakPolarHBondContact O-CG2 3.3Å; E230-V234 PolarHBondContact O-N 2.88Å; V234-E236 VanDerWaalsContact C-N 3.32Å; V234-E236 PolarHBondContact O-N 3.49Å; V234-V237 PolarHBondContact O-N 2.95Å; V234-V238 HydrophobicContact CG1-CG2 4.4Å; V234-V238 WeakPolarHBondContact O-CB 3.48Å; V234-V238 VanDerWaalsContact O-CG2 3.26Å; V234-V238 WeakPolarHBondContact O-CG2 3.48Å; V234-V238 PolarHBondContact O-N 3.02Å |
| 235 | A | 91.1 | Very high | 88.4 | Confident | 60 Ų | 60 | 98.1 Ų | 98.1 | 50% | 0.496 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.4 | -37.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L231 S232 A233 A239 | L231-A235 WeakPolarHBondContact O-CB 3.44Å; L231-A235 PolarHBondContact O-N 3.47Å; S232-A235 PolarHBondContact O-N 2.89Å; A233-A235 VanDerWaalsContact C-N 3.33Å; A233-A235 PolarHBondContact O-N 3.26Å; A235-A239 PolarHBondContact O-N 3Å |
| 236 | E | 93.9 | Very high | 89.5 | Confident | 123 Ų | 123 | 100.7 Ų | 100.7 | 58% | 0.575 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.4 | -49.5 | 175.4 | -172 | 167.4 | -160.7 | 0 | 0 | 111.5 | S232 A233 V234 V238 A239 E240 | S232-E236 PolarHBondContact O-N 3.5Å; A233-E236 PolarHBondContact O-N 2.84Å; V234-E236 VanDerWaalsContact C-N 3.32Å; V234-E236 PolarHBondContact O-N 3.49Å; E236-V238 VanDerWaalsContact C-N 3.3Å; E236-V238 PolarHBondContact O-N 2.87Å; E236-A239 WeakPolarHBondContact O-CA 3.27Å; E236-A239 WeakPolarHBondContact O-CB 3.41Å; E236-A239 PolarHBondContact O-N 3.16Å; E236-E240 PolarHBondContact O-N 3.36Å |
| 237 | V | 94.4 | Very high | 90.3 | Very high | 73 Ų | 73 | 98.4 Ų | 98.4 | 44% | 0.442 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -59.4 | -39.5 | 175.7 | 173.2 | 0 | 0 | 0 | 0 | 111.7 | A233 V234 A239 E240 I241 | A233-V237 WeakPolarHBondContact O-CG2 3.31Å; A233-V237 PolarHBondContact O-N 3.21Å; V234-V237 PolarHBondContact O-N 2.95Å; V237-A239 VanDerWaalsContact C-N 3.32Å; V237-A239 PolarHBondContact O-N 3.36Å; V237-E240 PolarHBondContact O-N 3.37Å; V237-I241 HydrophobicContact CG1-CD1 3.84Å; V237-I241 HydrophobicContact CG1-CG1 4.34Å; V237-I241 WeakPolarHBondContact O-CB 3.3Å; V237-I241 VanDerWaalsContact O-CG1 3.28Å; V237-I241 WeakPolarHBondContact O-CG1 3.48Å; V237-I241 PolarHBondContact O-N 3.28Å |
| 238 | V | 92.9 | Very high | 91 | Very high | 86 Ų | 86 | 97.2 Ų | 97.2 | 52% | 0.521 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.8 | -36.8 | 175.5 | 168.8 | 0 | 0 | 0 | 0 | 111.6 | V234 E236 K242 | V234-V238 HydrophobicContact CG1-CG2 4.4Å; V234-V238 WeakPolarHBondContact O-CB 3.48Å; V234-V238 VanDerWaalsContact O-CG2 3.26Å; V234-V238 WeakPolarHBondContact O-CG2 3.48Å; V234-V238 PolarHBondContact O-N 3.02Å; E236-V238 VanDerWaalsContact C-N 3.3Å; E236-V238 PolarHBondContact O-N 2.87Å; V238-K242 WeakPolarHBondContact O-CB 3.43Å; V238-K242 PolarHBondContact O-N 3.31Å |
| 239 | A | 93.6 | Very high | 91.6 | Very high | 53 Ų | 53 | 93.1 Ų | 93.1 | 44% | 0.438 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.7 | -39.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | A235 E236 V237 K242 T243 | A235-A239 PolarHBondContact O-N 3Å; E236-A239 WeakPolarHBondContact O-CA 3.27Å; E236-A239 WeakPolarHBondContact O-CB 3.41Å; E236-A239 PolarHBondContact O-N 3.16Å; V237-A239 VanDerWaalsContact C-N 3.32Å; V237-A239 PolarHBondContact O-N 3.36Å; A239-K242 PolarHBondContact O-N 3.19Å; A239-T243 PolarHBondContact O-N 3.14Å; A239-T243 PolarHBondContact O-OG1 2.81Å |
| 240 | E | 94 | Very high | 92.1 | Very high | 121 Ų | 121 | 89.4 Ų | 89.4 | 57% | 0.565 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.8 | -47.9 | 173.6 | -69.5 | -177.9 | 173.6 | 0 | 0 | 111.8 | E236 V237 K242 T243 A244 | E236-E240 PolarHBondContact O-N 3.36Å; V237-E240 PolarHBondContact O-N 3.37Å; E240-K242 VanDerWaalsContact C-N 3.27Å; E240-K242 PolarHBondContact O-N 2.91Å; E240-T243 WeakPolarHBondContact O-CB 3.23Å; E240-T243 PolarHBondContact O-N 3.22Å; E240-T243 VanDerWaalsContact O-N 3.09Å; E240-A244 WeakPolarHBondContact O-CB 3.29Å; E240-A244 PolarHBondContact O-N 3.08Å |
| 241 | I | 91.9 | Very high | 92.6 | Very high | 106 Ų | 106 | 87 Ų | 87 | 54% | 0.544 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -57.6 | -42 | 175.6 | -71.1 | 168.4 | 0 | 0 | 0 | 110.8 | V237 T243 A244 K245 | V237-I241 HydrophobicContact CG1-CD1 3.84Å; V237-I241 HydrophobicContact CG1-CG1 4.34Å; V237-I241 WeakPolarHBondContact O-CB 3.3Å; V237-I241 VanDerWaalsContact O-CG1 3.28Å; V237-I241 WeakPolarHBondContact O-CG1 3.48Å; V237-I241 PolarHBondContact O-N 3.28Å; I241-T243 VanDerWaalsContact C-N 3.32Å; I241-T243 PolarHBondContact O-N 3.24Å; I241-A244 PolarHBondContact O-N 3.46Å; I241-K245 WeakPolarHBondContact O-CB 3.48Å; I241-K245 PolarHBondContact O-N 3.37Å |
| 242 | K | 94.1 | Very high | 93.1 | Very high | 133 Ų | 133 | 84.3 Ų | 84.3 | 58% | 0.578 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.2 | -41.4 | 177.7 | -175.8 | 176.2 | 179.6 | 176.6 | 0 | 111.6 | V238 A239 E240 Q246 | V238-K242 WeakPolarHBondContact O-CB 3.43Å; V238-K242 PolarHBondContact O-N 3.31Å; A239-K242 PolarHBondContact O-N 3.19Å; E240-K242 VanDerWaalsContact C-N 3.27Å; E240-K242 PolarHBondContact O-N 2.91Å; K242-Q246 WeakPolarHBondContact O-CG 3.48Å; K242-Q246 PolarHBondContact O-N 3.41Å |
| 243 | T | 95.1 | Very high | 93.4 | Very high | 89 Ų | 89 | 84.5 Ų | 84.5 | 55% | 0.546 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.4 | -44.4 | 177.7 | -54.3 | 0 | 0 | 0 | 0 | 111.1 | A239 E240 I241 K245 Q246 A247 | A239-T243 PolarHBondContact O-N 3.14Å; A239-T243 PolarHBondContact O-OG1 2.81Å; E240-T243 WeakPolarHBondContact O-CB 3.23Å; E240-T243 PolarHBondContact O-N 3.22Å; E240-T243 VanDerWaalsContact O-N 3.09Å; I241-T243 VanDerWaalsContact C-N 3.32Å; I241-T243 PolarHBondContact O-N 3.24Å; T243-K245 VanDerWaalsContact C-N 3.32Å; T243-K245 PolarHBondContact O-N 3.36Å; T243-Q246 PolarHBondContact O-N 2.87Å; T243-A247 PolarHBondContact O-N 3.45Å |
| 244 | A | 92.7 | Very high | 93.8 | Very high | 63 Ų | 63 | 84.9 Ų | 84.9 | 52% | 0.521 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.7 | -41.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | E240 I241 A247 A248 | E240-A244 WeakPolarHBondContact O-CB 3.29Å; E240-A244 PolarHBondContact O-N 3.08Å; I241-A244 PolarHBondContact O-N 3.46Å; A244-A247 PolarHBondContact O-N 2.77Å; A244-A248 WeakPolarHBondContact O-CB 3.41Å; A244-A248 PolarHBondContact O-N 2.9Å |
| 245 | K | 92.9 | Very high | 94.2 | Very high | 134 Ų | 134 | 85 Ų | 85 | 58% | 0.583 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60 | -47.1 | 173.5 | -178.3 | -172.7 | 173.5 | -176.2 | 0 | 111.5 | I241 T243 A247 A248 D249 | I241-K245 WeakPolarHBondContact O-CB 3.48Å; I241-K245 PolarHBondContact O-N 3.37Å; T243-K245 VanDerWaalsContact C-N 3.32Å; T243-K245 PolarHBondContact O-N 3.36Å; K245-A247 VanDerWaalsContact C-N 3.29Å; K245-A247 PolarHBondContact O-N 3.3Å; K245-A248 WeakPolarHBondContact O-CB 3.47Å; K245-A248 PolarHBondContact O-N 3.35Å; K245-A248 VanDerWaalsContact O-N 3.16Å; K245-D249 WeakPolarHBondContact O-CB 3.36Å; K245-D249 PolarHBondContact O-N 3.21Å |
| 246 | Q | 95.3 | Very high | 94.5 | Very high | 115 Ų | 115 | 90 Ų | 90 | 54% | 0.537 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.7 | -39.6 | 178.4 | -74.2 | 175.7 | -21.6 | 0 | 0 | 111.9 | K242 T243 D249 A250 | K242-Q246 WeakPolarHBondContact O-CG 3.48Å; K242-Q246 PolarHBondContact O-N 3.41Å; T243-Q246 PolarHBondContact O-N 2.87Å; Q246-D249 PolarHBondContact O-N 2.86Å; Q246-A250 WeakPolarHBondContact O-CB 3.48Å; Q246-A250 PolarHBondContact O-N 3.43Å |
| 247 | A | 93.5 | Very high | 94.6 | Very high | 57 Ų | 57 | 89.8 Ų | 89.8 | 47% | 0.471 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.8 | -40 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | T243 A244 K245 A250 T251 | T243-A247 PolarHBondContact O-N 3.45Å; A244-A247 PolarHBondContact O-N 2.77Å; K245-A247 VanDerWaalsContact C-N 3.29Å; K245-A247 PolarHBondContact O-N 3.3Å; A247-A250 PolarHBondContact O-N 3.44Å; A247-T251 PolarHBondContact O-N 3.37Å; A247-T251 PolarHBondContact O-OG1 3.25Å |
| 248 | A | 93.1 | Very high | 94.7 | Very high | 59 Ų | 59 | 91.6 Ų | 91.6 | 49% | 0.488 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.8 | -42.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | A244 K245 T251 S252 | A244-A248 WeakPolarHBondContact O-CB 3.41Å; A244-A248 PolarHBondContact O-N 2.9Å; K245-A248 WeakPolarHBondContact O-CB 3.47Å; K245-A248 PolarHBondContact O-N 3.35Å; K245-A248 VanDerWaalsContact O-N 3.16Å; A248-T251 PolarHBondContact O-N 2.92Å; A248-S252 WeakPolarHBondContact O-CB 3.34Å; A248-S252 PolarHBondContact O-N 3.25Å |
| 249 | D | 94.7 | Very high | 94.8 | Very high | 78 Ų | 78 | 91.6 Ų | 91.6 | 42% | 0.417 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.8 | -42.7 | 176 | -73.9 | -25.8 | 0 | 0 | 0 | 111 | K245 Q246 T251 S252 N253 | K245-D249 WeakPolarHBondContact O-CB 3.36Å; K245-D249 PolarHBondContact O-N 3.21Å; Q246-D249 PolarHBondContact O-N 2.86Å; D249-T251 VanDerWaalsContact C-N 3.35Å; D249-T251 PolarHBondContact O-N 2.98Å; D249-S252 PolarHBondContact O-N 3.01Å; D249-N253 VanDerWaalsContact O-CG 3.29Å; D249-N253 PolarHBondContact O-N 3Å; D249-N253 PolarHBondContact O-ND2 3.45Å |
| 250 | A | 95.6 | Very high | 95 | Very high | 61 Ų | 61 | 90.4 Ų | 90.4 | 50% | 0.504 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.3 | -42.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q246 A247 N253 S254 | Q246-A250 WeakPolarHBondContact O-CB 3.48Å; Q246-A250 PolarHBondContact O-N 3.43Å; A247-A250 PolarHBondContact O-N 3.44Å; A250-N253 PolarHBondContact O-N 3.06Å; A250-S254 PolarHBondContact O-N 3.14Å |
| 251 | T | 95.3 | Very high | 95.1 | Very high | 84 Ų | 84 | 87.4 Ų | 87.4 | 52% | 0.515 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65 | -42.1 | 176.4 | -53.9 | 0 | 0 | 0 | 0 | 111.4 | A247 A248 D249 N253 S254 L255 | A247-T251 PolarHBondContact O-N 3.37Å; A247-T251 PolarHBondContact O-OG1 3.25Å; A248-T251 PolarHBondContact O-N 2.92Å; D249-T251 VanDerWaalsContact C-N 3.35Å; D249-T251 PolarHBondContact O-N 2.98Å; T251-N253 VanDerWaalsContact C-N 3.35Å; T251-N253 PolarHBondContact O-N 2.9Å; T251-S254 PolarHBondContact O-N 2.78Å; T251-L255 HydrophobicContact CG2-CD1 4.35Å; T251-L255 WeakPolarHBondContact O-CG 3.45Å; T251-L255 PolarHBondContact O-N 2.82Å |
| 252 | S | 95.2 | Very high | 95.4 | Very high | 60 Ų | 60 | 86.2 Ų | 86.2 | 42% | 0.42 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.3 | -41.2 | 177 | -169.8 | 0 | 0 | 0 | 0 | 112.1 | A248 D249 L255 R256 | A248-S252 WeakPolarHBondContact O-CB 3.34Å; A248-S252 PolarHBondContact O-N 3.25Å; D249-S252 PolarHBondContact O-N 3.01Å; S252-L255 PolarHBondContact O-N 2.99Å; S252-R256 PolarHBondContact O-N 2.89Å |
| 253 | N | 96.6 | Very high | 95.5 | Very high | 82 Ų | 82 | 88.1 Ų | 88.1 | 44% | 0.439 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65 | -45.7 | 175.4 | -69.2 | -28 | 0 | 0 | 0 | 111.4 | D249 A250 T251 L255 R256 D257 | D249-N253 VanDerWaalsContact O-CG 3.29Å; D249-N253 PolarHBondContact O-N 3Å; D249-N253 PolarHBondContact O-ND2 3.45Å; A250-N253 PolarHBondContact O-N 3.06Å; T251-N253 VanDerWaalsContact C-N 3.35Å; T251-N253 PolarHBondContact O-N 2.9Å; N253-L255 VanDerWaalsContact C-N 3.33Å; N253-L255 PolarHBondContact O-N 3.29Å; N253-R256 WeakPolarHBondContact O-CB 3.47Å; N253-R256 PolarHBondContact O-N 2.84Å; N253-R256 VanDerWaalsContact O-N 3.12Å; N253-D257 PolarHBondContact O-N 3.43Å |
| 254 | S | 97.4 | Very high | 95.6 | Very high | 57 Ų | 57 | 90.5 Ų | 90.5 | 40% | 0.399 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.1 | -41.8 | 175.3 | -178.8 | 0 | 0 | 0 | 0 | 112.6 | A250 T251 R256 D257 Q258 | A250-S254 PolarHBondContact O-N 3.14Å; T251-S254 PolarHBondContact O-N 2.78Å; S254-R256 VanDerWaalsContact C-N 3.34Å; S254-D257 PolarHBondContact O-N 3.42Å; S254-Q258 WeakPolarHBondContact O-CG 3.36Å; S254-Q258 PolarHBondContact O-N 2.8Å |
| 255 | L | 95.6 | Very high | 95.8 | Very high | 92 Ų | 92 | 93.6 Ų | 93.6 | 48% | 0.482 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.4 | -39.5 | 176 | -77.8 | 169.4 | 0 | 0 | 0 | 111.6 | T251 S252 N253 D257 Q258 I259 | T251-L255 HydrophobicContact CG2-CD1 4.35Å; T251-L255 WeakPolarHBondContact O-CG 3.45Å; T251-L255 PolarHBondContact O-N 2.82Å; S252-L255 PolarHBondContact O-N 2.99Å; N253-L255 VanDerWaalsContact C-N 3.33Å; N253-L255 PolarHBondContact O-N 3.29Å; L255-D257 VanDerWaalsContact C-N 3.34Å; L255-Q258 PolarHBondContact O-N 2.88Å; L255-I259 WeakPolarHBondContact O-CB 3.45Å; L255-I259 WeakPolarHBondContact O-CD1 3.21Å; L255-I259 WeakPolarHBondContact O-CG1 3.21Å; L255-I259 PolarHBondContact O-N 3.25Å |
| 256 | R | 96.1 | Very high | 96 | Very high | 165 Ų | 165 | 92.6 Ų | 92.6 | 62% | 0.623 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.6 | -43.4 | 175.7 | -175.5 | -178.4 | -63.2 | 174.7 | 3.2 | 111.5 | S252 N253 S254 I259 G260 | S252-R256 PolarHBondContact O-N 2.89Å; N253-R256 WeakPolarHBondContact O-CB 3.47Å; N253-R256 PolarHBondContact O-N 2.84Å; N253-R256 VanDerWaalsContact O-N 3.12Å; S254-R256 VanDerWaalsContact C-N 3.34Å; R256-I259 PolarHBondContact O-N 3.24Å; R256-G260 PolarHBondContact O-N 3.42Å |
| 257 | D | 96.9 | Very high | 96.1 | Very high | 117 Ų | 117 | 92.7 Ų | 92.7 | 63% | 0.626 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.5 | -43.1 | 178.5 | -66 | -18.5 | 0 | 0 | 0 | 111.2 | N253 S254 L255 G260 A261 | N253-D257 PolarHBondContact O-N 3.43Å; S254-D257 PolarHBondContact O-N 3.42Å; L255-D257 VanDerWaalsContact C-N 3.34Å; D257-G260 WeakPolarHBondContact O-CA 3.43Å; D257-G260 PolarHBondContact O-N 2.84Å; D257-G260 VanDerWaalsContact O-N 3.15Å; D257-A261 PolarHBondContact O-N 3.43Å |
| 258 | Q | 97.1 | Very high | 96.3 | Very high | 111 Ų | 111 | 93.4 Ų | 93.4 | 52% | 0.519 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 174.5 | -73 | 176.5 | 8.2 | 0 | 0 | 112.4 | S254 L255 G260 A261 V262 | S254-Q258 WeakPolarHBondContact O-CG 3.36Å; S254-Q258 PolarHBondContact O-N 2.8Å; L255-Q258 PolarHBondContact O-N 2.88Å; Q258-G260 PolarHBondContact O-N 2.81Å; Q258-A261 PolarHBondContact O-N 3.43Å; Q258-V262 WeakPolarHBondContact O-CG2 3.42Å; Q258-V262 PolarHBondContact O-N 2.91Å |
| 259 | I | 94.7 | Very high | 96.5 | Very high | 86 Ų | 86 | 96.5 Ų | 96.5 | 44% | 0.441 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.7 | -37.6 | 174.8 | -70.4 | 165.4 | 0 | 0 | 0 | 110.5 | L255 R256 R263 | L255-I259 WeakPolarHBondContact O-CB 3.45Å; L255-I259 WeakPolarHBondContact O-CD1 3.21Å; L255-I259 WeakPolarHBondContact O-CG1 3.21Å; L255-I259 PolarHBondContact O-N 3.25Å; R256-I259 PolarHBondContact O-N 3.24Å; I259-R263 WeakPolarHBondContact O-CG 3.48Å; I259-R263 PolarHBondContact O-N 2.97Å; I259-R263 VanDerWaalsContact O-N 3.08Å |
| 260 | G | 97.4 | Very high | 96.5 | Very high | 28 Ų | 28 | 98.3 Ų | 98.3 | 29% | 0.289 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59 | -53.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112 | R256 D257 Q258 V262 R263 E264 | R256-G260 PolarHBondContact O-N 3.42Å; D257-G260 WeakPolarHBondContact O-CA 3.43Å; D257-G260 PolarHBondContact O-N 2.84Å; D257-G260 VanDerWaalsContact O-N 3.15Å; Q258-G260 PolarHBondContact O-N 2.81Å; G260-V262 PolarHBondContact O-N 2.95Å; G260-R263 WeakPolarHBondContact O-CB 3.39Å; G260-R263 PolarHBondContact O-N 3.3Å; G260-E264 PolarHBondContact O-N 2.78Å; G260-E264 VanDerWaalsContact O-N 3.11Å |
| 261 | A | 96.9 | Very high | 96.6 | Very high | 59 Ų | 59 | 101.7 Ų | 101.7 | 49% | 0.488 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.4 | -45.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | D257 Q258 R263 E264 E265 | D257-A261 PolarHBondContact O-N 3.43Å; Q258-A261 PolarHBondContact O-N 3.43Å; A261-R263 VanDerWaalsContact C-N 3.3Å; A261-R263 PolarHBondContact O-N 3.03Å; A261-E264 PolarHBondContact O-N 3.3Å; A261-E265 PolarHBondContact O-N 3.43Å |
| 262 | V | 97.4 | Very high | 96.7 | Very high | 80 Ų | 80 | 102.3 Ų | 102.3 | 49% | 0.485 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.2 | -36.8 | 177.5 | 170.3 | 0 | 0 | 0 | 0 | 111.6 | Q258 G260 E265 L266 | Q258-V262 WeakPolarHBondContact O-CG2 3.42Å; Q258-V262 PolarHBondContact O-N 2.91Å; G260-V262 PolarHBondContact O-N 2.95Å; V262-E265 PolarHBondContact O-N 3.44Å; V262-L266 HydrophobicContact CG1-CD1 4.31Å; V262-L266 WeakPolarHBondContact O-CB 3.37Å; V262-L266 PolarHBondContact O-N 3.24Å |
| 263 | R | 96.6 | Very high | 96.8 | Very high | 173 Ų | 173 | 103.2 Ų | 103.2 | 65% | 0.653 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.6 | -41.2 | 175.2 | -79.9 | 179.5 | -176.2 | 143.5 | 1.6 | 112.4 | I259 G260 A261 L266 Q267 | I259-R263 WeakPolarHBondContact O-CG 3.48Å; I259-R263 PolarHBondContact O-N 2.97Å; I259-R263 VanDerWaalsContact O-N 3.08Å; G260-R263 WeakPolarHBondContact O-CB 3.39Å; G260-R263 PolarHBondContact O-N 3.3Å; A261-R263 VanDerWaalsContact C-N 3.3Å; A261-R263 PolarHBondContact O-N 3.03Å; R263-L266 PolarHBondContact O-N 3.34Å; R263-Q267 WeakPolarHBondContact O-CB 3.31Å; R263-Q267 PolarHBondContact O-N 2.8Å |
| 264 | E | 97.4 | Very high | 96.8 | Very high | 139 Ų | 139 | 102 Ų | 102 | 65% | 0.65 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.5 | -40.7 | 176.8 | -69.2 | -172.3 | 169.9 | 0 | 0 | 111.7 | G260 A261 Q267 T268 | G260-E264 PolarHBondContact O-N 2.78Å; G260-E264 VanDerWaalsContact O-N 3.11Å; A261-E264 PolarHBondContact O-N 3.3Å; E264-Q267 PolarHBondContact O-N 2.75Å; E264-T268 PolarHBondContact O-N 3.45Å; E264-T268 PolarHBondContact O-OG1 2.9Å |
| 265 | E | 96.7 | Very high | 96.7 | Very high | 129 Ų | 129 | 102.9 Ų | 102.9 | 60% | 0.603 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.5 | -47 | 174.3 | -170.9 | 179.8 | 174.1 | 0 | 0 | 111.3 | A261 V262 Q267 T268 R269 | A261-E265 PolarHBondContact O-N 3.43Å; V262-E265 PolarHBondContact O-N 3.44Å; E265-Q267 VanDerWaalsContact C-N 3.31Å; E265-Q267 PolarHBondContact O-N 3.48Å; E265-T268 PolarHBondContact O-N 3.46Å; E265-T268 VanDerWaalsContact O-N 3.14Å; E265-R269 WeakPolarHBondContact O-CB 3.38Å; E265-R269 WeakPolarHBondContact O-CG 3.27Å; E265-R269 PolarHBondContact O-N 2.88Å |
| 266 | L | 96.3 | Very high | 96.7 | Very high | 113 Ų | 113 | 103.3 Ų | 103.3 | 59% | 0.592 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -57.6 | -43.1 | 174.8 | -103.8 | 161.9 | 0 | 0 | 0 | 112.1 | V262 R263 T268 N270 | V262-L266 HydrophobicContact CG1-CD1 4.31Å; V262-L266 WeakPolarHBondContact O-CB 3.37Å; V262-L266 PolarHBondContact O-N 3.24Å; R263-L266 PolarHBondContact O-N 3.34Å; L266-T268 VanDerWaalsContact C-N 3.32Å; L266-T268 PolarHBondContact O-N 2.84Å; L266-N270 VanDerWaalsContact O-CB 3.3Å; L266-N270 WeakPolarHBondContact O-CB 3.3Å; L266-N270 PolarHBondContact O-N 3.47Å |
| 267 | Q | 97.1 | Very high | 96.6 | Very high | 117 Ų | 117 | 99.2 Ų | 99.2 | 55% | 0.547 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.6 | -38.9 | 177.8 | -171.5 | -178.1 | -2.5 | 0 | 0 | 111.6 | R263 E264 E265 N270 K271 | R263-Q267 WeakPolarHBondContact O-CB 3.31Å; R263-Q267 PolarHBondContact O-N 2.8Å; E264-Q267 PolarHBondContact O-N 2.75Å; E265-Q267 VanDerWaalsContact C-N 3.31Å; E265-Q267 PolarHBondContact O-N 3.48Å; Q267-N270 PolarHBondContact O-N 3.5Å; Q267-K271 WeakPolarHBondContact O-CG 3.49Å; Q267-K271 PolarHBondContact O-N 2.85Å |
| 268 | T | 97.8 | Very high | 96.7 | Very high | 71 Ų | 71 | 100.7 Ų | 100.7 | 44% | 0.436 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.9 | -49.7 | 177.1 | -58.4 | 0 | 0 | 0 | 0 | 110.9 | E264 E265 L266 N270 K271 E272 | E264-T268 PolarHBondContact O-N 3.45Å; E264-T268 PolarHBondContact O-OG1 2.9Å; E265-T268 PolarHBondContact O-N 3.46Å; E265-T268 VanDerWaalsContact O-N 3.14Å; L266-T268 VanDerWaalsContact C-N 3.32Å; L266-T268 PolarHBondContact O-N 2.84Å; T268-N270 VanDerWaalsContact C-N 3.25Å; T268-N270 PolarHBondContact O-N 2.78Å; T268-K271 WeakPolarHBondContact O-CB 3.28Å; T268-K271 PolarHBondContact O-N 3.32Å; T268-E272 PolarHBondContact O-N 3.44Å |
| 269 | R | 96.8 | Very high | 96.6 | Very high | 125 Ų | 125 | 101.1 Ų | 101.1 | 47% | 0.472 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -57.2 | -37.9 | 174.8 | -73.2 | -69.6 | -63 | 127.2 | 1.5 | 112.3 | E265 K271 E272 V273 | E265-R269 WeakPolarHBondContact O-CB 3.38Å; E265-R269 WeakPolarHBondContact O-CG 3.27Å; E265-R269 PolarHBondContact O-N 2.88Å; R269-K271 PolarHBondContact O-N 3.41Å; R269-E272 WeakPolarHBondContact CD-OE2 3.42Å; R269-E272 IonicContact CZ-OE2 3.69Å; R269-E272 IonicContact NH1-OE2 2.75Å; R269-E272 PolarHBondContact NH1-OE2 2.83Å; R269-E272 PolarHBondContact O-N 3.42Å; R269-V273 WeakPolarHBondContact O-CB 3.46Å; R269-V273 VanDerWaalsContact O-CG2 3.29Å; R269-V273 WeakPolarHBondContact O-CG2 3.43Å; R269-V273 PolarHBondContact O-N 3.4Å |
| 270 | N | 96.7 | Very high | 96.6 | Very high | 115 Ų | 115 | 101.2 Ų | 101.2 | 62% | 0.615 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.3 | -40.1 | 177.3 | -157.7 | -29.7 | 0 | 0 | 0 | 111.7 | L266 Q267 T268 V273 A274 | L266-N270 VanDerWaalsContact O-CB 3.3Å; L266-N270 WeakPolarHBondContact O-CB 3.3Å; L266-N270 PolarHBondContact O-N 3.47Å; Q267-N270 PolarHBondContact O-N 3.5Å; T268-N270 VanDerWaalsContact C-N 3.25Å; T268-N270 PolarHBondContact O-N 2.78Å; N270-V273 PolarHBondContact O-N 3.31Å; N270-A274 PolarHBondContact O-N 2.94Å |
| 271 | K | 97.1 | Very high | 96.5 | Very high | 133 Ų | 133 | 105.1 Ų | 105.1 | 58% | 0.578 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.7 | -41.6 | 173 | -67.3 | 172.6 | -175.1 | 170.4 | 0 | 112.1 | Q267 T268 R269 A274 S275 | Q267-K271 WeakPolarHBondContact O-CG 3.49Å; Q267-K271 PolarHBondContact O-N 2.85Å; T268-K271 WeakPolarHBondContact O-CB 3.28Å; T268-K271 PolarHBondContact O-N 3.32Å; R269-K271 PolarHBondContact O-N 3.41Å; K271-A274 PolarHBondContact O-N 3.25Å; K271-S275 PolarHBondContact O-N 2.92Å |
| 272 | E | 97 | Very high | 96.5 | Very high | 96 Ų | 96 | 105.8 Ų | 105.8 | 45% | 0.449 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.9 | -43 | 176 | -69.5 | 174 | -178.1 | 0 | 0 | 111.9 | T268 R269 A274 S275 L276 | T268-E272 PolarHBondContact O-N 3.44Å; R269-E272 WeakPolarHBondContact CD-OE2 3.42Å; R269-E272 IonicContact CZ-OE2 3.69Å; R269-E272 IonicContact NH1-OE2 2.75Å; R269-E272 PolarHBondContact NH1-OE2 2.83Å; R269-E272 PolarHBondContact O-N 3.42Å; E272-A274 VanDerWaalsContact C-N 3.33Å; E272-A274 PolarHBondContact O-N 3.19Å; E272-S275 PolarHBondContact O-N 3.05Å; E272-L276 WeakPolarHBondContact O-CB 3.38Å; E272-L276 PolarHBondContact O-N 2.98Å |
| 273 | V | 97.3 | Very high | 96.4 | Very high | 79 Ų | 79 | 106.2 Ų | 106.2 | 48% | 0.479 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 176 | 169.2 | 0 | 0 | 0 | 0 | 110.9 | R269 N270 L276 S277 | R269-V273 WeakPolarHBondContact O-CB 3.46Å; R269-V273 VanDerWaalsContact O-CG2 3.29Å; R269-V273 WeakPolarHBondContact O-CG2 3.43Å; R269-V273 PolarHBondContact O-N 3.4Å; N270-V273 PolarHBondContact O-N 3.31Å; V273-L276 PolarHBondContact O-N 3.31Å; V273-S277 WeakPolarHBondContact O-CB 3.47Å; V273-S277 PolarHBondContact O-N 2.81Å |
| 274 | A | 96 | Very high | 96.3 | Very high | 58 Ų | 58 | 105.3 Ų | 105.3 | 48% | 0.479 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.6 | -43.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | N270 K271 E272 S277 Q278 | N270-A274 PolarHBondContact O-N 2.94Å; K271-A274 PolarHBondContact O-N 3.25Å; E272-A274 VanDerWaalsContact C-N 3.33Å; E272-A274 PolarHBondContact O-N 3.19Å; A274-S277 PolarHBondContact O-N 3.04Å; A274-Q278 PolarHBondContact O-N 3.48Å; A274-Q278 VanDerWaalsContact O-N 3.1Å |
| 275 | S | 95.6 | Very high | 96.3 | Very high | 75 Ų | 75 | 101.4 Ų | 101.4 | 52% | 0.524 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.9 | -44.7 | 176.1 | -170.9 | 0 | 0 | 0 | 0 | 112 | K271 E272 S277 Q278 E279 | K271-S275 PolarHBondContact O-N 2.92Å; E272-S275 PolarHBondContact O-N 3.05Å; S275-S277 VanDerWaalsContact C-N 3.34Å; S275-S277 PolarHBondContact O-N 2.92Å; S275-Q278 WeakPolarHBondContact O-CB 3.43Å; S275-Q278 PolarHBondContact O-N 3.4Å; S275-E279 PolarHBondContact O-N 2.81Å |
| 276 | L | 96.3 | Very high | 96.4 | Very high | 100 Ų | 100 | 99.3 Ų | 99.3 | 52% | 0.524 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.7 | -40 | 178.3 | -176.2 | 64.8 | 0 | 0 | 0 | 111.1 | E272 V273 Q278 E279 V280 | E272-L276 WeakPolarHBondContact O-CB 3.38Å; E272-L276 PolarHBondContact O-N 2.98Å; V273-L276 PolarHBondContact O-N 3.31Å; L276-Q278 VanDerWaalsContact C-N 3.27Å; L276-Q278 PolarHBondContact O-N 2.86Å; L276-E279 PolarHBondContact O-N 2.82Å; L276-V280 WeakPolarHBondContact O-CG2 3.27Å; L276-V280 PolarHBondContact O-N 2.86Å |
| 277 | S | 94.3 | Very high | 96.3 | Very high | 80 Ų | 80 | 100.3 Ų | 100.3 | 56% | 0.559 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60.1 | -38.7 | 174.3 | -173.2 | 0 | 0 | 0 | 0 | 111.8 | V273 A274 S275 E281 | V273-S277 WeakPolarHBondContact O-CB 3.47Å; V273-S277 PolarHBondContact O-N 2.81Å; A274-S277 PolarHBondContact O-N 3.04Å; S275-S277 VanDerWaalsContact C-N 3.34Å; S275-S277 PolarHBondContact O-N 2.92Å; S277-E281 PolarHBondContact O-N 3.21Å; S277-E281 VanDerWaalsContact O-N 3.11Å |
| 278 | Q | 97.5 | Very high | 96.3 | Very high | 148 Ų | 148 | 101.2 Ų | 101.2 | 69% | 0.692 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -69.3 | -40 | 176.4 | -175 | -179.6 | -18.5 | 0 | 0 | 111.8 | A274 S275 L276 E281 S282 | A274-Q278 PolarHBondContact O-N 3.48Å; A274-Q278 VanDerWaalsContact O-N 3.1Å; S275-Q278 WeakPolarHBondContact O-CB 3.43Å; S275-Q278 PolarHBondContact O-N 3.4Å; L276-Q278 VanDerWaalsContact C-N 3.27Å; L276-Q278 PolarHBondContact O-N 2.86Å; Q278-E281 PolarHBondContact O-N 2.78Å; Q278-S282 PolarHBondContact O-N 3.17Å |
| 279 | E | 95.1 | Very high | 96.2 | Very high | 119 Ų | 119 | 102.5 Ų | 102.5 | 56% | 0.556 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.5 | -45.4 | 175.3 | -174.8 | 176.8 | -177.6 | 0 | 0 | 111.5 | S275 L276 E281 S282 V283 | S275-E279 PolarHBondContact O-N 2.81Å; L276-E279 PolarHBondContact O-N 2.82Å; E279-E281 VanDerWaalsContact C-N 3.32Å; E279-E281 PolarHBondContact O-N 3.45Å; E279-S282 WeakPolarHBondContact O-CB 3.42Å; E279-S282 PolarHBondContact O-N 3.18Å; E279-S282 VanDerWaalsContact O-N 3.17Å; E279-V283 WeakPolarHBondContact O-CG2 3.38Å; E279-V283 PolarHBondContact O-N 3.47Å |
| 280 | V | 94.8 | Very high | 96.1 | Very high | 88 Ų | 88 | 100.6 Ų | 100.6 | 53% | 0.533 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -59.2 | -42.9 | 175.9 | 169.2 | 0 | 0 | 0 | 0 | 111.3 | L276 V283 R284 | L276-V280 WeakPolarHBondContact O-CG2 3.27Å; L276-V280 PolarHBondContact O-N 2.86Å; V280-V283 PolarHBondContact O-N 3.28Å; V280-R284 WeakPolarHBondContact O-CB 3.34Å; V280-R284 PolarHBondContact O-N 3.4Å |
| 281 | E | 97 | Very high | 96 | Very high | 110 Ų | 110 | 97 Ų | 97 | 51% | 0.514 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.8 | -39 | 177.2 | -166.9 | 59 | -147 | 0 | 0 | 111.7 | S277 Q278 E279 R284 S285 | S277-E281 PolarHBondContact O-N 3.21Å; S277-E281 VanDerWaalsContact O-N 3.11Å; Q278-E281 PolarHBondContact O-N 2.78Å; E279-E281 VanDerWaalsContact C-N 3.32Å; E279-E281 PolarHBondContact O-N 3.45Å; E281-R284 WeakPolarHBondContact O-CB 3.37Å; E281-R284 PolarHBondContact O-N 3.47Å; E281-S285 PolarHBondContact O-N 3.04Å |
| 282 | S | 96.4 | Very high | 96.1 | Very high | 73 Ų | 73 | 92.4 Ų | 92.4 | 51% | 0.51 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 173.8 | -173.6 | 0 | 0 | 0 | 0 | 112 | Q278 E279 R284 S285 V286 | Q278-S282 PolarHBondContact O-N 3.17Å; E279-S282 WeakPolarHBondContact O-CB 3.42Å; E279-S282 PolarHBondContact O-N 3.18Å; E279-S282 VanDerWaalsContact O-N 3.17Å; S282-R284 VanDerWaalsContact C-N 3.31Å; S282-R284 PolarHBondContact O-N 3.43Å; S282-S285 PolarHBondContact O-N 2.84Å; S282-V286 WeakPolarHBondContact O-CG2 3.5Å; S282-V286 PolarHBondContact O-N 2.96Å; S282-V286 VanDerWaalsContact O-N 3.07Å |
| 283 | V | 94.6 | Very high | 96.1 | Very high | 89 Ų | 89 | 91.4 Ų | 91.4 | 54% | 0.539 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 176.8 | 170.4 | 0 | 0 | 0 | 0 | 110.4 | E279 V280 S285 V286 M287 | E279-V283 WeakPolarHBondContact O-CG2 3.38Å; E279-V283 PolarHBondContact O-N 3.47Å; V280-V283 PolarHBondContact O-N 3.28Å; V283-S285 PolarHBondContact O-N 3.34Å; V283-V286 PolarHBondContact O-N 2.84Å; V283-M287 WeakPolarHBondContact O-CB 3.47Å; V283-M287 PolarHBondContact O-N 2.81Å |
| 284 | R | 95.6 | Very high | 96 | Very high | 154 Ų | 154 | 93.5 Ų | 93.5 | 58% | 0.581 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -60 | -45.5 | 176.5 | -171.8 | -175.6 | -169.1 | 175.2 | 4.4 | 112 | V280 E281 S282 M287 Q288 | V280-R284 WeakPolarHBondContact O-CB 3.34Å; V280-R284 PolarHBondContact O-N 3.4Å; E281-R284 WeakPolarHBondContact O-CB 3.37Å; E281-R284 PolarHBondContact O-N 3.47Å; S282-R284 VanDerWaalsContact C-N 3.31Å; S282-R284 PolarHBondContact O-N 3.43Å; R284-M287 PolarHBondContact O-N 2.98Å; R284-Q288 WeakPolarHBondContact O-CB 3.37Å; R284-Q288 PolarHBondContact O-N 3.41Å |
| 285 | S | 97.1 | Very high | 96 | Very high | 58 Ų | 58 | 99.3 Ų | 99.3 | 41% | 0.406 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.3 | -50.1 | 176.4 | -171.5 | 0 | 0 | 0 | 0 | 111.3 | E281 S282 V283 M287 Q288 D289 | E281-S285 PolarHBondContact O-N 3.04Å; S282-S285 PolarHBondContact O-N 2.84Å; V283-S285 PolarHBondContact O-N 3.34Å; S285-M287 VanDerWaalsContact C-N 3.29Å; S285-M287 PolarHBondContact O-N 2.85Å; S285-Q288 PolarHBondContact O-N 3Å; S285-Q288 VanDerWaalsContact O-N 3.13Å; S285-D289 PolarHBondContact O-N 3.26Å |
| 286 | V | 97.3 | Very high | 96.1 | Very high | 85 Ų | 85 | 102.8 Ų | 102.8 | 52% | 0.515 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 178.7 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | S282 V283 Q288 D289 T290 | S282-V286 WeakPolarHBondContact O-CG2 3.5Å; S282-V286 PolarHBondContact O-N 2.96Å; S282-V286 VanDerWaalsContact O-N 3.07Å; V283-V286 PolarHBondContact O-N 2.84Å; V286-Q288 VanDerWaalsContact C-N 3.35Å; V286-D289 PolarHBondContact O-N 2.92Å; V286-T290 VanDerWaalsContact O-CB 3.3Å; V286-T290 WeakPolarHBondContact O-CB 3.46Å; V286-T290 PolarHBondContact O-N 3.33Å; V286-T290 PolarHBondContact O-OG1 3.31Å |
| 287 | M | 94.8 | Very high | 96 | Very high | 134 Ų | 134 | 100.9 Ų | 100.9 | 66% | 0.66 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.4 | -40.7 | 177.1 | -167.3 | 178.2 | 87.8 | 0 | 0 | 111.5 | V283 R284 S285 T290 A291 | V283-M287 WeakPolarHBondContact O-CB 3.47Å; V283-M287 PolarHBondContact O-N 2.81Å; R284-M287 PolarHBondContact O-N 2.98Å; S285-M287 VanDerWaalsContact C-N 3.29Å; S285-M287 PolarHBondContact O-N 2.85Å; M287-T290 PolarHBondContact O-N 2.75Å; M287-A291 VanDerWaalsContact O-CB 3.27Å; M287-A291 WeakPolarHBondContact O-CB 3.38Å; M287-A291 PolarHBondContact O-N 3.44Å |
| 288 | Q | 96.9 | Very high | 96.1 | Very high | 135 Ų | 135 | 101.8 Ų | 101.8 | 63% | 0.631 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.6 | -44.4 | 176.8 | -175.9 | 174.2 | -12 | 0 | 0 | 111.8 | R284 S285 V286 T290 A291 G292 | R284-Q288 WeakPolarHBondContact O-CB 3.37Å; R284-Q288 PolarHBondContact O-N 3.41Å; S285-Q288 PolarHBondContact O-N 3Å; S285-Q288 VanDerWaalsContact O-N 3.13Å; V286-Q288 VanDerWaalsContact C-N 3.35Å; Q288-T290 VanDerWaalsContact C-N 3.35Å; Q288-A291 PolarHBondContact O-N 3.5Å; Q288-G292 PolarHBondContact O-N 3.44Å |
| 289 | D | 97.1 | Very high | 96 | Very high | 98 Ų | 98 | 98.1 Ų | 98.1 | 52% | 0.524 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.4 | -42.3 | 177.2 | -68.7 | -24.5 | 0 | 0 | 0 | 111.5 | S285 V286 G292 S293 | S285-D289 PolarHBondContact O-N 3.26Å; V286-D289 PolarHBondContact O-N 2.92Å; D289-G292 PolarHBondContact O-N 2.86Å; D289-S293 WeakPolarHBondContact O-CB 3.47Å; D289-S293 PolarHBondContact O-N 2.77Å; D289-S293 PolarHBondContact O-OG 2.9Å |
| 290 | T | 94.5 | Very high | 96.1 | Very high | 86 Ų | 86 | 95.6 Ų | 95.6 | 53% | 0.528 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.4 | -45.5 | 176.6 | -57.2 | 0 | 0 | 0 | 0 | 110.8 | V286 M287 Q288 G292 S293 L294 | V286-T290 VanDerWaalsContact O-CB 3.3Å; V286-T290 WeakPolarHBondContact O-CB 3.46Å; V286-T290 PolarHBondContact O-N 3.33Å; V286-T290 PolarHBondContact O-OG1 3.31Å; M287-T290 PolarHBondContact O-N 2.75Å; Q288-T290 VanDerWaalsContact C-N 3.35Å; T290-G292 VanDerWaalsContact C-N 3.34Å; T290-G292 PolarHBondContact O-N 3.16Å; T290-S293 PolarHBondContact O-N 2.9Å; T290-L294 WeakPolarHBondContact O-CB 3.4Å; T290-L294 PolarHBondContact O-N 3.49Å |
| 291 | A | 94.6 | Very high | 96 | Very high | 39 Ų | 39 | 94 Ų | 94 | 32% | 0.322 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.1 | -38.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | M287 Q288 R295 | M287-A291 VanDerWaalsContact O-CB 3.27Å; M287-A291 WeakPolarHBondContact O-CB 3.38Å; M287-A291 PolarHBondContact O-N 3.44Å; Q288-A291 PolarHBondContact O-N 3.5Å; A291-R295 WeakPolarHBondContact O-CG 3.44Å; A291-R295 PolarHBondContact O-N 3.39Å |
| 292 | G | 97.6 | Very high | 96 | Very high | 37 Ų | 37 | 94.3 Ų | 94.3 | 38% | 0.381 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.3 | -47.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q288 D289 T290 L294 R295 Q296 | Q288-G292 PolarHBondContact O-N 3.44Å; D289-G292 PolarHBondContact O-N 2.86Å; T290-G292 VanDerWaalsContact C-N 3.34Å; T290-G292 PolarHBondContact O-N 3.16Å; G292-L294 PolarHBondContact O-N 2.89Å; G292-R295 PolarHBondContact O-N 3.41Å; G292-Q296 PolarHBondContact O-N 3.02Å |
| 293 | S | 97 | Very high | 96 | Very high | 74 Ų | 74 | 93.8 Ų | 93.8 | 52% | 0.517 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.1 | -41.8 | 178 | -57.5 | 0 | 0 | 0 | 0 | 112 | D289 T290 Q296 A297 | D289-S293 WeakPolarHBondContact O-CB 3.47Å; D289-S293 PolarHBondContact O-N 2.77Å; D289-S293 PolarHBondContact O-OG 2.9Å; T290-S293 PolarHBondContact O-N 2.9Å; S293-Q296 PolarHBondContact O-N 3.49Å; S293-A297 WeakPolarHBondContact O-CB 3.39Å; S293-A297 PolarHBondContact O-N 3.21Å |
| 294 | L | 96.3 | Very high | 96.1 | Very high | 124 Ų | 124 | 91.2 Ų | 91.2 | 65% | 0.649 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.5 | -41.4 | 177.8 | -172.6 | 65.3 | 0 | 0 | 0 | 111.8 | T290 G292 Q296 A297 L298 | T290-L294 WeakPolarHBondContact O-CB 3.4Å; T290-L294 PolarHBondContact O-N 3.49Å; G292-L294 PolarHBondContact O-N 2.89Å; L294-Q296 VanDerWaalsContact C-N 3.34Å; L294-Q296 PolarHBondContact O-N 3.43Å; L294-A297 PolarHBondContact O-N 3.39Å; L294-L298 WeakPolarHBondContact O-CB 3.43Å; L294-L298 PolarHBondContact O-N 3.02Å |
| 295 | R | 95.8 | Very high | 96.1 | Very high | 179 Ų | 179 | 88.4 Ų | 88.4 | 68% | 0.675 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.9 | -44.3 | 173.4 | -79.9 | -175.5 | 176 | 108.3 | -1.9 | 111.6 | A291 G292 L298 S299 | A291-R295 WeakPolarHBondContact O-CG 3.44Å; A291-R295 PolarHBondContact O-N 3.39Å; G292-R295 PolarHBondContact O-N 3.41Å; R295-L298 PolarHBondContact O-N 3.31Å; R295-S299 PolarHBondContact O-N 3.27Å; R295-S299 PolarHBondContact O-OG 3.5Å |
| 296 | Q | 97.4 | Very high | 96.1 | Very high | 149 Ų | 149 | 90.2 Ų | 90.2 | 70% | 0.696 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.1 | -42.3 | 179 | -169.8 | 175.7 | 11.6 | 0 | 0 | 112 | G292 S293 L294 L298 S299 A300 | G292-Q296 PolarHBondContact O-N 3.02Å; S293-Q296 PolarHBondContact O-N 3.49Å; L294-Q296 VanDerWaalsContact C-N 3.34Å; L294-Q296 PolarHBondContact O-N 3.43Å; Q296-L298 VanDerWaalsContact C-N 3.33Å; Q296-S299 PolarHBondContact O-N 2.85Å; Q296-A300 WeakPolarHBondContact O-CB 3.48Å; Q296-A300 PolarHBondContact O-N 2.93Å |
| 297 | A | 94.1 | Very high | 96 | Very high | 59 Ų | 59 | 88.5 Ų | 88.5 | 49% | 0.488 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.8 | -40.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | S293 L294 A300 A301 | S293-A297 WeakPolarHBondContact O-CB 3.39Å; S293-A297 PolarHBondContact O-N 3.21Å; L294-A297 PolarHBondContact O-N 3.39Å; A297-A300 PolarHBondContact O-N 3.35Å; A297-A301 WeakPolarHBondContact O-CB 3.37Å; A297-A301 PolarHBondContact O-N 3.11Å |
| 298 | L | 96 | Very high | 96.1 | Very high | 100 Ų | 100 | 87.1 Ų | 87.1 | 52% | 0.524 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.2 | -48 | 176.1 | -176.1 | 64.3 | 0 | 0 | 0 | 111.4 | L294 R295 Q296 A300 A301 E302 | L294-L298 WeakPolarHBondContact O-CB 3.43Å; L294-L298 PolarHBondContact O-N 3.02Å; R295-L298 PolarHBondContact O-N 3.31Å; Q296-L298 VanDerWaalsContact C-N 3.33Å; L298-A300 VanDerWaalsContact C-N 3.29Å; L298-A300 PolarHBondContact O-N 2.92Å; L298-A301 WeakPolarHBondContact O-CB 3.33Å; L298-A301 PolarHBondContact O-N 3.5Å; L298-A301 VanDerWaalsContact O-N 3.12Å; L298-E302 WeakPolarHBondContact O-CG 3.42Å; L298-E302 PolarHBondContact O-N 3.41Å |
| 299 | S | 97 | Very high | 96 | Very high | 71 Ų | 71 | 86.3 Ų | 86.3 | 50% | 0.497 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.9 | -36.4 | 176.8 | -61.4 | 0 | 0 | 0 | 0 | 112.7 | R295 Q296 A303 | R295-S299 PolarHBondContact O-N 3.27Å; R295-S299 PolarHBondContact O-OG 3.5Å; Q296-S299 PolarHBondContact O-N 2.85Å; S299-A303 WeakPolarHBondContact O-CB 3.28Å; S299-A303 PolarHBondContact O-N 2.93Å |
| 300 | A | 96.3 | Very high | 96 | Very high | 65 Ų | 65 | 85.9 Ų | 85.9 | 54% | 0.537 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.1 | -39.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q296 A297 L298 A303 G304 | Q296-A300 WeakPolarHBondContact O-CB 3.48Å; Q296-A300 PolarHBondContact O-N 2.93Å; A297-A300 PolarHBondContact O-N 3.35Å; L298-A300 VanDerWaalsContact C-N 3.29Å; L298-A300 PolarHBondContact O-N 2.92Å; A300-A303 PolarHBondContact O-N 3.11Å; A300-G304 PolarHBondContact O-N 3.44Å |
| 301 | A | 93.6 | Very high | 96.1 | Very high | 56 Ų | 56 | 87.5 Ų | 87.5 | 46% | 0.463 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.2 | -43.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A297 L298 A303 G304 V305 | A297-A301 WeakPolarHBondContact O-CB 3.37Å; A297-A301 PolarHBondContact O-N 3.11Å; L298-A301 WeakPolarHBondContact O-CB 3.33Å; L298-A301 PolarHBondContact O-N 3.5Å; L298-A301 VanDerWaalsContact O-N 3.12Å; A301-A303 VanDerWaalsContact C-N 3.35Å; A301-A303 PolarHBondContact O-N 3.34Å; A301-G304 PolarHBondContact O-N 3.19Å; A301-G304 VanDerWaalsContact O-N 3.14Å; A301-V305 WeakPolarHBondContact O-CG2 3.33Å; A301-V305 PolarHBondContact O-N 2.8Å |
| 302 | E | 95.7 | Very high | 96.2 | Very high | 115 Ų | 115 | 89.7 Ų | 89.7 | 54% | 0.537 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -58.5 | -45.1 | 174.8 | -73.5 | 171.7 | 168.1 | 0 | 0 | 111.5 | L298 G304 V305 Q306 | L298-E302 WeakPolarHBondContact O-CG 3.42Å; L298-E302 PolarHBondContact O-N 3.41Å; E302-G304 VanDerWaalsContact C-N 3.32Å; E302-G304 PolarHBondContact O-N 3.49Å; E302-V305 PolarHBondContact O-N 3.32Å; E302-Q306 PolarHBondContact O-N 2.97Å |
| 303 | A | 96.3 | Very high | 96.1 | Very high | 63 Ų | 63 | 90.7 Ų | 90.7 | 52% | 0.521 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.8 | -39.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S299 A300 A301 Q306 A307 | S299-A303 WeakPolarHBondContact O-CB 3.28Å; S299-A303 PolarHBondContact O-N 2.93Å; A300-A303 PolarHBondContact O-N 3.11Å; A301-A303 VanDerWaalsContact C-N 3.35Å; A301-A303 PolarHBondContact O-N 3.34Å; A303-Q306 PolarHBondContact O-N 2.97Å; A303-A307 PolarHBondContact O-N 3.15Å |
| 304 | G | 96.7 | Very high | 96.1 | Very high | 34 Ų | 34 | 91 Ų | 91 | 35% | 0.351 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.1 | -40.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | A300 A301 E302 A307 L308 | A300-G304 PolarHBondContact O-N 3.44Å; A301-G304 PolarHBondContact O-N 3.19Å; A301-G304 VanDerWaalsContact O-N 3.14Å; E302-G304 VanDerWaalsContact C-N 3.32Å; E302-G304 PolarHBondContact O-N 3.49Å; G304-A307 PolarHBondContact O-N 2.94Å; G304-L308 WeakPolarHBondContact O-CG 3.48Å; G304-L308 PolarHBondContact O-N 3.43Å |
| 305 | V | 96 | Very high | 96.1 | Very high | 95 Ų | 95 | 90.6 Ų | 90.6 | 58% | 0.576 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.4 | -42.3 | 175.4 | 170.7 | 0 | 0 | 0 | 0 | 111.1 | A301 E302 A307 L308 Q309 | A301-V305 WeakPolarHBondContact O-CG2 3.33Å; A301-V305 PolarHBondContact O-N 2.8Å; E302-V305 PolarHBondContact O-N 3.32Å; V305-A307 VanDerWaalsContact C-N 3.34Å; V305-A307 PolarHBondContact O-N 2.75Å; V305-L308 PolarHBondContact O-N 3.12Å; V305-Q309 PolarHBondContact O-N 3.01Å |
| 306 | Q | 96.6 | Very high | 96.1 | Very high | 97 Ų | 97 | 87.6 Ų | 87.6 | 45% | 0.453 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 176.2 | -167.3 | 62.1 | 46.4 | 0 | 0 | 111.4 | E302 A303 L308 Q309 D310 | E302-Q306 PolarHBondContact O-N 2.97Å; A303-Q306 PolarHBondContact O-N 2.97Å; Q306-L308 VanDerWaalsContact C-N 3.32Å; Q306-L308 PolarHBondContact O-N 2.92Å; Q306-Q309 VanDerWaalsContact NE2-OE1 3.17Å; Q306-Q309 WeakPolarHBondContact O-CB 3.26Å; Q306-Q309 PolarHBondContact O-N 3.49Å; Q306-Q309 VanDerWaalsContact O-N 3.13Å; Q306-D310 VanDerWaalsContact O-CG 3.31Å; Q306-D310 PolarHBondContact O-N 3.07Å |
| 307 | A | 96.6 | Very high | 96 | Very high | 49 Ų | 49 | 83.8 Ų | 83.8 | 41% | 0.405 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.8 | -38.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A303 G304 V305 D310 Q311 | A303-A307 PolarHBondContact O-N 3.15Å; G304-A307 PolarHBondContact O-N 2.94Å; V305-A307 VanDerWaalsContact C-N 3.34Å; V305-A307 PolarHBondContact O-N 2.75Å; A307-D310 PolarHBondContact O-N 2.86Å; A307-Q311 WeakPolarHBondContact O-CG 3.38Å; A307-Q311 PolarHBondContact O-N 2.79Å |
| 308 | L | 95 | Very high | 96.1 | Very high | 105 Ų | 105 | 84.5 Ų | 84.5 | 55% | 0.55 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.9 | -36.6 | 174.1 | -76.3 | 173.6 | 0 | 0 | 0 | 112.3 | G304 V305 Q306 Q311 T312 | G304-L308 WeakPolarHBondContact O-CG 3.48Å; G304-L308 PolarHBondContact O-N 3.43Å; V305-L308 PolarHBondContact O-N 3.12Å; Q306-L308 VanDerWaalsContact C-N 3.32Å; Q306-L308 PolarHBondContact O-N 2.92Å; L308-Q311 PolarHBondContact O-N 2.9Å; L308-T312 WeakPolarHBondContact O-CB 3.48Å; L308-T312 PolarHBondContact O-N 3.14Å; L308-T312 PolarHBondContact O-OG1 3.47Å |
| 309 | Q | 96.2 | Very high | 96.1 | Very high | 117 Ų | 117 | 85.6 Ų | 85.6 | 55% | 0.547 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.4 | -44.6 | 174.5 | -171.3 | 177.1 | 20.9 | 0 | 0 | 111 | V305 Q306 Q311 T312 A313 | V305-Q309 PolarHBondContact O-N 3.01Å; Q306-Q309 VanDerWaalsContact NE2-OE1 3.17Å; Q306-Q309 WeakPolarHBondContact O-CB 3.26Å; Q306-Q309 PolarHBondContact O-N 3.49Å; Q306-Q309 VanDerWaalsContact O-N 3.13Å; Q309-Q311 PolarHBondContact O-N 3.03Å; Q309-T312 WeakPolarHBondContact O-CB 3.4Å; Q309-T312 PolarHBondContact O-N 3.05Å; Q309-A313 PolarHBondContact O-N 3.35Å |
| 310 | D | 97.1 | Very high | 96.1 | Very high | 89 Ų | 89 | 87.4 Ų | 87.4 | 48% | 0.476 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 177.8 | -62.6 | -18.3 | 0 | 0 | 0 | 111.6 | Q306 A307 T312 A313 T314 | Q306-D310 VanDerWaalsContact O-CG 3.31Å; Q306-D310 PolarHBondContact O-N 3.07Å; A307-D310 PolarHBondContact O-N 2.86Å; D310-T312 VanDerWaalsContact C-N 3.34Å; D310-T312 PolarHBondContact O-N 3.41Å; D310-A313 PolarHBondContact O-N 3.38Å; D310-T314 PolarHBondContact O-N 3Å; D310-T314 PolarHBondContact O-OG1 3.25Å |
| 311 | Q | 97.3 | Very high | 96.1 | Very high | 121 Ų | 121 | 90.6 Ų | 90.6 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63 | -40.2 | 173.6 | -75.7 | -176.8 | -0.9 | 0 | 0 | 112.3 | A307 L308 Q309 T314 L315 | A307-Q311 WeakPolarHBondContact O-CG 3.38Å; A307-Q311 PolarHBondContact O-N 2.79Å; L308-Q311 PolarHBondContact O-N 2.9Å; Q309-Q311 PolarHBondContact O-N 3.03Å; Q311-T314 WeakPolarHBondContact O-CB 3.41Å; Q311-T314 PolarHBondContact O-N 3.38Å; Q311-L315 WeakPolarHBondContact O-CG 3.35Å; Q311-L315 PolarHBondContact O-N 3.43Å |
| 312 | T | 95.3 | Very high | 96.2 | Very high | 85 Ų | 85 | 92 Ų | 92 | 52% | 0.521 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 177.6 | -58.7 | 0 | 0 | 0 | 0 | 111.1 | L308 Q309 D310 T314 L315 Q316 | L308-T312 WeakPolarHBondContact O-CB 3.48Å; L308-T312 PolarHBondContact O-N 3.14Å; L308-T312 PolarHBondContact O-OG1 3.47Å; Q309-T312 WeakPolarHBondContact O-CB 3.4Å; Q309-T312 PolarHBondContact O-N 3.05Å; D310-T312 VanDerWaalsContact C-N 3.34Å; D310-T312 PolarHBondContact O-N 3.41Å; T312-T314 VanDerWaalsContact C-N 3.3Å; T312-T314 PolarHBondContact O-N 3.13Å; T312-L315 PolarHBondContact O-N 3.25Å; T312-Q316 WeakPolarHBondContact O-CB 3.35Å; T312-Q316 PolarHBondContact O-N 2.99Å |
| 313 | A | 96.1 | Very high | 96.3 | Very high | 58 Ų | 58 | 90 Ų | 90 | 48% | 0.479 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.9 | -39.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q309 D310 Q316 S317 | Q309-A313 PolarHBondContact O-N 3.35Å; D310-A313 PolarHBondContact O-N 3.38Å; A313-Q316 PolarHBondContact O-N 2.99Å; A313-S317 PolarHBondContact O-N 3.05Å; A313-S317 VanDerWaalsContact O-N 3.11Å |
| 314 | T | 96.9 | Very high | 96.3 | Very high | 80 Ų | 80 | 91.9 Ų | 91.9 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.2 | -49.2 | 175.8 | -52.5 | 0 | 0 | 0 | 0 | 111.1 | D310 Q311 T312 Q316 S317 D318 | D310-T314 PolarHBondContact O-N 3Å; D310-T314 PolarHBondContact O-OG1 3.25Å; Q311-T314 WeakPolarHBondContact O-CB 3.41Å; Q311-T314 PolarHBondContact O-N 3.38Å; T312-T314 VanDerWaalsContact C-N 3.3Å; T312-T314 PolarHBondContact O-N 3.13Å; T314-Q316 VanDerWaalsContact C-N 3.26Å; T314-Q316 PolarHBondContact O-N 2.95Å; T314-S317 WeakPolarHBondContact O-CB 3.46Å; T314-S317 PolarHBondContact O-N 2.95Å; T314-S317 VanDerWaalsContact O-N 3.11Å; T314-D318 PolarHBondContact O-N 3.39Å |
| 315 | L | 95.5 | Very high | 96.3 | Very high | 115 Ų | 115 | 92.7 Ų | 92.7 | 60% | 0.602 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.2 | -35.7 | 177 | -76.6 | 173.1 | 0 | 0 | 0 | 112.7 | Q311 T312 D318 L319 | Q311-L315 WeakPolarHBondContact O-CG 3.35Å; Q311-L315 PolarHBondContact O-N 3.43Å; T312-L315 PolarHBondContact O-N 3.25Å; L315-D318 PolarHBondContact O-N 3.47Å; L315-L319 VanDerWaalsContact O-CB 3.31Å; L315-L319 WeakPolarHBondContact O-CB 3.39Å; L315-L319 PolarHBondContact O-N 3.2Å |
| 316 | Q | 96.2 | Very high | 96.3 | Very high | 116 Ų | 116 | 91.6 Ų | 91.6 | 54% | 0.542 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.4 | -45 | 174.9 | -173.9 | -177.9 | -24.8 | 0 | 0 | 111.4 | T312 A313 T314 D318 L319 E320 | T312-Q316 WeakPolarHBondContact O-CB 3.35Å; T312-Q316 PolarHBondContact O-N 2.99Å; A313-Q316 PolarHBondContact O-N 2.99Å; T314-Q316 VanDerWaalsContact C-N 3.26Å; T314-Q316 PolarHBondContact O-N 2.95Å; Q316-D318 VanDerWaalsContact C-N 3.35Å; Q316-D318 PolarHBondContact O-N 3.47Å; Q316-L319 PolarHBondContact O-N 3.36Å; Q316-E320 PolarHBondContact NE2-OE1 3.4Å; Q316-E320 WeakPolarHBondContact O-CG 3.33Å; Q316-E320 PolarHBondContact O-N 3.48Å |
| 317 | S | 96.6 | Very high | 96.3 | Very high | 70 Ų | 70 | 95.3 Ų | 95.3 | 49% | 0.49 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.4 | -43.2 | 175 | -175 | 0 | 0 | 0 | 0 | 111.8 | A313 T314 L319 E320 Q321 | A313-S317 PolarHBondContact O-N 3.05Å; A313-S317 VanDerWaalsContact O-N 3.11Å; T314-S317 WeakPolarHBondContact O-CB 3.46Å; T314-S317 PolarHBondContact O-N 2.95Å; T314-S317 VanDerWaalsContact O-N 3.11Å; S317-L319 VanDerWaalsContact C-N 3.33Å; S317-L319 PolarHBondContact O-N 2.91Å; S317-E320 PolarHBondContact O-N 3.02Å; S317-Q321 WeakPolarHBondContact O-CB 3.46Å; S317-Q321 PolarHBondContact O-N 3.42Å |
| 318 | D | 95.7 | Very high | 96.3 | Very high | 74 Ų | 74 | 96.2 Ų | 96.2 | 40% | 0.396 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.7 | -40.6 | 178 | -69.2 | -16.6 | 0 | 0 | 0 | 111 | T314 L315 Q316 Q321 V322 | T314-D318 PolarHBondContact O-N 3.39Å; L315-D318 PolarHBondContact O-N 3.47Å; Q316-D318 VanDerWaalsContact C-N 3.35Å; Q316-D318 PolarHBondContact O-N 3.47Å; D318-Q321 WeakPolarHBondContact O-CB 3.48Å; D318-Q321 PolarHBondContact O-N 2.85Å; D318-V322 VanDerWaalsContact O-CG2 3.32Å; D318-V322 WeakPolarHBondContact O-CG2 3.29Å; D318-V322 PolarHBondContact O-N 2.82Å |
| 319 | L | 95.6 | Very high | 96.4 | Very high | 123 Ų | 123 | 95.3 Ų | 95.3 | 64% | 0.644 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -42.4 | 176.4 | -176.2 | 65.7 | 0 | 0 | 0 | 111.8 | L315 Q316 S317 Q321 V322 S323 | L315-L319 VanDerWaalsContact O-CB 3.31Å; L315-L319 WeakPolarHBondContact O-CB 3.39Å; L315-L319 PolarHBondContact O-N 3.2Å; Q316-L319 PolarHBondContact O-N 3.36Å; S317-L319 VanDerWaalsContact C-N 3.33Å; S317-L319 PolarHBondContact O-N 2.91Å; L319-Q321 VanDerWaalsContact C-N 3.31Å; L319-Q321 PolarHBondContact O-N 2.82Å; L319-V322 PolarHBondContact O-N 3.39Å; L319-S323 VanDerWaalsContact O-CB 3.3Å; L319-S323 WeakPolarHBondContact O-CB 3.49Å; L319-S323 PolarHBondContact O-N 3.32Å |
| 320 | E | 96.8 | Very high | 96.4 | Very high | 109 Ų | 109 | 95 Ų | 95 | 51% | 0.509 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.2 | -41.8 | 173.5 | -75.6 | 176.9 | -164.8 | 0 | 0 | 111.1 | Q316 S317 S323 N324 | Q316-E320 PolarHBondContact NE2-OE1 3.4Å; Q316-E320 WeakPolarHBondContact O-CG 3.33Å; Q316-E320 PolarHBondContact O-N 3.48Å; S317-E320 PolarHBondContact O-N 3.02Å; E320-S323 PolarHBondContact O-N 2.9Å; E320-N324 VanDerWaalsContact O-CG 3.25Å; E320-N324 PolarHBondContact O-N 3.43Å; E320-N324 PolarHBondContact O-ND2 2.9Å; E320-N324 VanDerWaalsContact O-ND2 3.15Å |
| 321 | Q | 97.1 | Very high | 96.4 | Very high | 131 Ų | 131 | 97 Ų | 97 | 61% | 0.612 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.1 | -45.5 | 176.4 | -172.7 | 179.2 | 0.7 | 0 | 0 | 112.1 | S317 D318 L319 S323 N324 A325 | S317-Q321 WeakPolarHBondContact O-CB 3.46Å; S317-Q321 PolarHBondContact O-N 3.42Å; D318-Q321 WeakPolarHBondContact O-CB 3.48Å; D318-Q321 PolarHBondContact O-N 2.85Å; L319-Q321 VanDerWaalsContact C-N 3.31Å; L319-Q321 PolarHBondContact O-N 2.82Å; Q321-S323 VanDerWaalsContact C-N 3.34Å; Q321-N324 PolarHBondContact O-N 3.46Å; Q321-A325 WeakPolarHBondContact O-CB 3.3Å; Q321-A325 PolarHBondContact O-N 2.92Å |
| 322 | V | 95.8 | Very high | 96.3 | Very high | 86 Ų | 86 | 98 Ų | 98 | 52% | 0.521 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 176.4 | 169.6 | 0 | 0 | 0 | 0 | 110.5 | D318 L319 N324 A325 V326 | D318-V322 VanDerWaalsContact O-CG2 3.32Å; D318-V322 WeakPolarHBondContact O-CG2 3.29Å; D318-V322 PolarHBondContact O-N 2.82Å; L319-V322 PolarHBondContact O-N 3.39Å; V322-N324 VanDerWaalsContact C-N 3.34Å; V322-N324 PolarHBondContact O-N 3.3Å; V322-A325 PolarHBondContact O-N 3.3Å; V322-V326 HydrophobicContact CG1-CG2 4.31Å; V322-V326 WeakPolarHBondContact O-CG2 3.3Å; V322-V326 PolarHBondContact O-N 3.02Å |
| 323 | S | 96.6 | Very high | 96.4 | Very high | 73 Ų | 73 | 98 Ų | 98 | 51% | 0.51 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -58 | -46 | 176 | -177.7 | 0 | 0 | 0 | 0 | 111.8 | L319 E320 Q321 A325 V326 R327 | L319-S323 VanDerWaalsContact O-CB 3.3Å; L319-S323 WeakPolarHBondContact O-CB 3.49Å; L319-S323 PolarHBondContact O-N 3.32Å; E320-S323 PolarHBondContact O-N 2.9Å; Q321-S323 VanDerWaalsContact C-N 3.34Å; S323-A325 PolarHBondContact O-N 3.38Å; S323-V326 PolarHBondContact O-N 2.85Å; S323-R327 PolarHBondContact O-N 3.2Å |
| 324 | N | 97.3 | Very high | 96.3 | Very high | 102 Ų | 102 | 100.6 Ų | 100.6 | 55% | 0.545 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.2 | -39.7 | 176.2 | -70.5 | -31.3 | 0 | 0 | 0 | 112.3 | E320 Q321 V322 R327 T328 | E320-N324 VanDerWaalsContact O-CG 3.25Å; E320-N324 PolarHBondContact O-N 3.43Å; E320-N324 PolarHBondContact O-ND2 2.9Å; E320-N324 VanDerWaalsContact O-ND2 3.15Å; Q321-N324 PolarHBondContact O-N 3.46Å; V322-N324 VanDerWaalsContact C-N 3.34Å; V322-N324 PolarHBondContact O-N 3.3Å; N324-R327 PolarHBondContact O-N 2.77Å; N324-T328 PolarHBondContact O-N 3.37Å; N324-T328 PolarHBondContact O-OG1 3.49Å |
| 325 | A | 96.4 | Very high | 96.3 | Very high | 51 Ų | 51 | 100.4 Ų | 100.4 | 42% | 0.421 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65 | -43.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q321 V322 S323 T328 V329 | Q321-A325 WeakPolarHBondContact O-CB 3.3Å; Q321-A325 PolarHBondContact O-N 2.92Å; V322-A325 PolarHBondContact O-N 3.3Å; S323-A325 PolarHBondContact O-N 3.38Å; A325-T328 WeakPolarHBondContact O-CB 3.45Å; A325-T328 PolarHBondContact O-N 3.22Å; A325-V329 WeakPolarHBondContact O-CG2 3.38Å; A325-V329 PolarHBondContact O-N 2.97Å |
| 326 | V | 96.3 | Very high | 96.2 | Very high | 73 Ų | 73 | 97.4 Ų | 97.4 | 44% | 0.442 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60 | -49.2 | 175 | 169.5 | 0 | 0 | 0 | 0 | 110.3 | V322 S323 T328 V329 E330 | V322-V326 HydrophobicContact CG1-CG2 4.31Å; V322-V326 WeakPolarHBondContact O-CG2 3.3Å; V322-V326 PolarHBondContact O-N 3.02Å; S323-V326 PolarHBondContact O-N 2.85Å; V326-T328 VanDerWaalsContact C-N 3.26Å; V326-T328 PolarHBondContact O-N 3.34Å; V326-V329 CarbonylContact O-C 3.58Å; V326-V329 PolarHBondContact O-N 3.46Å; V326-E330 HydrophobicContact CG1-CG 4.36Å; V326-E330 WeakPolarHBondContact O-CG 3.23Å; V326-E330 PolarHBondContact O-N 3.49Å |
| 327 | R | 96.8 | Very high | 96.1 | Very high | 175 Ų | 175 | 94.6 Ų | 94.6 | 66% | 0.66 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -56.4 | -41.5 | 176.5 | -171.3 | -178.3 | -179.4 | 88.7 | 2 | 112.2 | S323 N324 E330 E331 | S323-R327 PolarHBondContact O-N 3.2Å; N324-R327 PolarHBondContact O-N 2.77Å; R327-E330 PolarHBondContact O-N 3.35Å; R327-E331 PolarHBondContact O-N 3.07Å |
| 328 | T | 96.7 | Very high | 96 | Very high | 67 Ų | 67 | 94.2 Ų | 94.2 | 41% | 0.411 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.9 | -40.6 | 176.6 | -56.1 | 0 | 0 | 0 | 0 | 111.8 | N324 A325 V326 E331 K332 | N324-T328 PolarHBondContact O-N 3.37Å; N324-T328 PolarHBondContact O-OG1 3.49Å; A325-T328 WeakPolarHBondContact O-CB 3.45Å; A325-T328 PolarHBondContact O-N 3.22Å; V326-T328 VanDerWaalsContact C-N 3.26Å; V326-T328 PolarHBondContact O-N 3.34Å; T328-E331 PolarHBondContact O-N 2.89Å; T328-K332 WeakPolarHBondContact O-CG 3.47Å; T328-K332 PolarHBondContact O-N 3.42Å |
| 329 | V | 95.6 | Very high | 96 | Very high | 86 Ų | 86 | 96.3 Ų | 96.3 | 52% | 0.521 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67 | -43.2 | 176.5 | 170 | 0 | 0 | 0 | 0 | 110.8 | A325 V326 E331 K332 V333 | A325-V329 WeakPolarHBondContact O-CG2 3.38Å; A325-V329 PolarHBondContact O-N 2.97Å; V326-V329 CarbonylContact O-C 3.58Å; V326-V329 PolarHBondContact O-N 3.46Å; V329-E331 VanDerWaalsContact C-N 3.3Å; V329-E331 PolarHBondContact O-N 2.88Å; V329-K332 PolarHBondContact O-N 3.29Å; V329-V333 HydrophobicContact CG1-CG2 4.23Å; V329-V333 WeakPolarHBondContact O-CB 3.41Å; V329-V333 WeakPolarHBondContact O-CG2 3.33Å; V329-V333 PolarHBondContact O-N 2.82Å |
| 330 | E | 96.1 | Very high | 96 | Very high | 111 Ų | 111 | 93.2 Ų | 93.2 | 52% | 0.519 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57 | -44.1 | 174.9 | -74.1 | 178.8 | 160.7 | 0 | 0 | 111.6 | V326 R327 V333 N334 | V326-E330 HydrophobicContact CG1-CG 4.36Å; V326-E330 WeakPolarHBondContact O-CG 3.23Å; V326-E330 PolarHBondContact O-N 3.49Å; R327-E330 PolarHBondContact O-N 3.35Å; E330-V333 PolarHBondContact O-N 3.35Å; E330-N334 WeakPolarHBondContact O-CB 3.36Å; E330-N334 PolarHBondContact O-N 2.9Å; E330-N334 PolarHBondContact O-ND2 3.46Å |
| 331 | E | 97 | Very high | 95.9 | Very high | 130 Ų | 130 | 93.2 Ų | 93.2 | 61% | 0.607 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.9 | -41.4 | 177.2 | -167 | 167.9 | -165.2 | 0 | 0 | 112 | R327 T328 V329 N334 T335 | R327-E331 PolarHBondContact O-N 3.07Å; T328-E331 PolarHBondContact O-N 2.89Å; V329-E331 VanDerWaalsContact C-N 3.3Å; V329-E331 PolarHBondContact O-N 2.88Å; E331-N334 PolarHBondContact O-N 3.44Å; E331-T335 WeakPolarHBondContact O-CG2 3.24Å; E331-T335 PolarHBondContact O-N 2.88Å; E331-T335 PolarHBondContact O-OG1 3.33Å |
| 332 | K | 96.3 | Very high | 95.8 | Very high | 142 Ų | 142 | 94.6 Ų | 94.6 | 62% | 0.617 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.3 | -39 | 173.4 | -75.3 | -179.2 | 179.2 | 179.1 | 0 | 112.9 | T328 V329 T335 A336 | T328-K332 WeakPolarHBondContact O-CG 3.47Å; T328-K332 PolarHBondContact O-N 3.42Å; V329-K332 PolarHBondContact O-N 3.29Å; K332-T335 VanDerWaalsContact CA-OG1 3.32Å; K332-T335 WeakPolarHBondContact CA-OG1 3.48Å; K332-T335 PolarHBondContact O-OG1 2.88Å; K332-A336 VanDerWaalsContact O-CB 3.26Å; K332-A336 WeakPolarHBondContact O-CB 3.22Å; K332-A336 PolarHBondContact O-N 3.32Å |
| 333 | V | 96 | Very high | 95.8 | Very high | 86 Ų | 86 | 98.6 Ų | 98.6 | 52% | 0.521 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.8 | -44.8 | 176.9 | 167.6 | 0 | 0 | 0 | 0 | 110.4 | V329 E330 T335 A336 A337 | V329-V333 HydrophobicContact CG1-CG2 4.23Å; V329-V333 WeakPolarHBondContact O-CB 3.41Å; V329-V333 WeakPolarHBondContact O-CG2 3.33Å; V329-V333 PolarHBondContact O-N 2.82Å; E330-V333 PolarHBondContact O-N 3.35Å; V333-T335 PolarHBondContact O-N 3.35Å; V333-A336 PolarHBondContact O-N 2.74Å; V333-A337 VanDerWaalsContact O-CB 3.31Å; V333-A337 WeakPolarHBondContact O-CB 3.35Å; V333-A337 PolarHBondContact O-N 3.13Å |
| 334 | N | 95.8 | Very high | 95.8 | Very high | 113 Ų | 113 | 98 Ų | 98 | 60% | 0.604 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.1 | -42.4 | 178.1 | -76.9 | -22.5 | 0 | 0 | 0 | 112.2 | E330 E331 A337 A338 | E330-N334 WeakPolarHBondContact O-CB 3.36Å; E330-N334 PolarHBondContact O-N 2.9Å; E330-N334 PolarHBondContact O-ND2 3.46Å; E331-N334 PolarHBondContact O-N 3.44Å; N334-A337 PolarHBondContact O-N 2.96Å; N334-A338 WeakPolarHBondContact O-CB 3.39Å; N334-A338 PolarHBondContact O-N 3.49Å |
| 335 | T | 96.4 | Very high | 95.7 | Very high | 76 Ų | 76 | 96.6 Ų | 96.6 | 47% | 0.466 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.2 | -41.4 | 175.7 | 49.6 | 0 | 0 | 0 | 0 | 112.1 | E331 K332 V333 A338 Q339 | E331-T335 WeakPolarHBondContact O-CG2 3.24Å; E331-T335 PolarHBondContact O-N 2.88Å; E331-T335 PolarHBondContact O-OG1 3.33Å; K332-T335 VanDerWaalsContact CA-OG1 3.32Å; K332-T335 WeakPolarHBondContact CA-OG1 3.48Å; K332-T335 PolarHBondContact O-OG1 2.88Å; V333-T335 PolarHBondContact O-N 3.35Å; T335-A338 PolarHBondContact O-N 2.88Å; T335-Q339 WeakPolarHBondContact O-CG 3.35Å; T335-Q339 PolarHBondContact O-N 2.92Å |
| 336 | A | 93.4 | Very high | 95.7 | Very high | 52 Ų | 52 | 98.5 Ų | 98.5 | 43% | 0.43 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.9 | -41.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | K332 V333 Q339 A340 | K332-A336 VanDerWaalsContact O-CB 3.26Å; K332-A336 WeakPolarHBondContact O-CB 3.22Å; K332-A336 PolarHBondContact O-N 3.32Å; V333-A336 PolarHBondContact O-N 2.74Å; A336-Q339 PolarHBondContact O-N 2.92Å; A336-A340 WeakPolarHBondContact O-CB 3.39Å; A336-A340 PolarHBondContact O-N 3.06Å |
| 337 | A | 94 | Very high | 95.7 | Very high | 56 Ų | 56 | 99.6 Ų | 99.6 | 46% | 0.463 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.6 | -45 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | V333 N334 Q339 A340 Q341 | V333-A337 VanDerWaalsContact O-CB 3.31Å; V333-A337 WeakPolarHBondContact O-CB 3.35Å; V333-A337 PolarHBondContact O-N 3.13Å; N334-A337 PolarHBondContact O-N 2.96Å; A337-Q339 VanDerWaalsContact C-N 3.33Å; A337-Q339 PolarHBondContact O-N 3.35Å; A337-A340 PolarHBondContact O-N 2.97Å; A337-Q341 PolarHBondContact O-N 2.89Å |
| 338 | A | 95.2 | Very high | 95.6 | Very high | 63 Ų | 63 | 97.4 Ų | 97.4 | 52% | 0.521 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.9 | -40 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | N334 T335 K342 | N334-A338 WeakPolarHBondContact O-CB 3.39Å; N334-A338 PolarHBondContact O-N 3.49Å; T335-A338 PolarHBondContact O-N 2.88Å; A338-K342 PolarHBondContact O-N 3.12Å |
| 339 | Q | 95.9 | Very high | 95.5 | Very high | 118 Ų | 118 | 98.7 Ų | 98.7 | 55% | 0.551 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66.5 | -40.6 | 174.6 | -75.5 | -178 | 3.8 | 0 | 0 | 112.5 | T335 A336 A337 K342 R343 | T335-Q339 WeakPolarHBondContact O-CG 3.35Å; T335-Q339 PolarHBondContact O-N 2.92Å; A336-Q339 PolarHBondContact O-N 2.92Å; A337-Q339 VanDerWaalsContact C-N 3.33Å; A337-Q339 PolarHBondContact O-N 3.35Å; Q339-K342 PolarHBondContact O-N 3.42Å; Q339-R343 WeakPolarHBondContact O-CG 3.44Å; Q339-R343 PolarHBondContact O-N 2.82Å |
| 340 | A | 93.8 | Very high | 95.4 | Very high | 58 Ų | 58 | 102.4 Ų | 102.4 | 48% | 0.479 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.7 | -43.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | A336 A337 R343 S344 | A336-A340 WeakPolarHBondContact O-CB 3.39Å; A336-A340 PolarHBondContact O-N 3.06Å; A337-A340 PolarHBondContact O-N 2.97Å; A340-R343 PolarHBondContact O-N 2.98Å; A340-S344 PolarHBondContact O-N 2.86Å |
| 341 | Q | 95.8 | Very high | 95.3 | Very high | 109 Ų | 109 | 100.8 Ų | 100.8 | 51% | 0.509 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -58.8 | -50 | 174.6 | -172.4 | 62 | 37.2 | 0 | 0 | 111 | A337 R343 S344 D345 | A337-Q341 PolarHBondContact O-N 2.89Å; Q341-R343 VanDerWaalsContact C-N 3.27Å; Q341-R343 PolarHBondContact O-N 3.41Å; Q341-S344 WeakPolarHBondContact O-CA 3.39Å; Q341-S344 VanDerWaalsContact O-CB 3.26Å; Q341-S344 WeakPolarHBondContact O-CB 3.32Å; Q341-S344 PolarHBondContact O-N 3.31Å; Q341-D345 PolarHBondContact NE2-OD1 3.19Å; Q341-D345 VanDerWaalsContact O-CG 3.26Å; Q341-D345 PolarHBondContact O-N 2.89Å |
| 342 | K | 95.9 | Very high | 95.2 | Very high | 159 Ų | 159 | 99.5 Ų | 99.5 | 69% | 0.691 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -58.3 | -38.7 | 178.2 | -172.7 | -178.1 | 179.1 | -177.1 | 0 | 112.7 | A338 Q339 D346 | A338-K342 PolarHBondContact O-N 3.12Å; Q339-K342 PolarHBondContact O-N 3.42Å; K342-D346 WeakPolarHBondContact O-CB 3.45Å; K342-D346 PolarHBondContact O-N 3.39Å |
| 343 | R | 95.8 | Very high | 95 | Very high | 170 Ų | 170 | 96.3 Ų | 96.3 | 64% | 0.642 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -68 | -35.9 | 175.1 | -76.4 | -174.7 | 179.9 | 137.4 | 0.5 | 112.2 | Q339 A340 Q341 L347 | Q339-R343 WeakPolarHBondContact O-CG 3.44Å; Q339-R343 PolarHBondContact O-N 2.82Å; A340-R343 PolarHBondContact O-N 2.98Å; Q341-R343 VanDerWaalsContact C-N 3.27Å; Q341-R343 PolarHBondContact O-N 3.41Å; R343-L347 WeakPolarHBondContact O-CB 3.43Å; R343-L347 WeakPolarHBondContact O-CD1 3.46Å; R343-L347 WeakPolarHBondContact O-CG 3.42Å; R343-L347 PolarHBondContact O-N 3.1Å |
| 344 | S | 95.1 | Very high | 94.6 | Very high | 62 Ų | 62 | 96.3 Ų | 96.3 | 43% | 0.434 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.5 | -49.1 | 173.5 | -168 | 0 | 0 | 0 | 0 | 110.6 | A340 Q341 D346 L347 E348 | A340-S344 PolarHBondContact O-N 2.86Å; Q341-S344 WeakPolarHBondContact O-CA 3.39Å; Q341-S344 VanDerWaalsContact O-CB 3.26Å; Q341-S344 WeakPolarHBondContact O-CB 3.32Å; Q341-S344 PolarHBondContact O-N 3.31Å; S344-D346 VanDerWaalsContact C-N 3.34Å; S344-D346 PolarHBondContact O-N 3.33Å; S344-L347 PolarHBondContact O-N 2.82Å; S344-E348 PolarHBondContact O-N 3.37Å |
| 345 | D | 96.2 | Very high | 94.5 | Very high | 71 Ų | 71 | 96.7 Ų | 96.7 | 38% | 0.38 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.7 | -41.6 | 179.1 | -54.8 | -16.8 | 0 | 0 | 0 | 111.2 | Q341 E348 V349 | Q341-D345 PolarHBondContact NE2-OD1 3.19Å; Q341-D345 VanDerWaalsContact O-CG 3.26Å; Q341-D345 PolarHBondContact O-N 2.89Å; D345-E348 PolarHBondContact O-N 2.97Å; D345-V349 WeakPolarHBondContact O-CG2 3.13Å; D345-V349 PolarHBondContact O-N 3.38Å |
| 346 | D | 96.4 | Very high | 94.2 | Very high | 92 Ų | 92 | 98.1 Ų | 98.1 | 49% | 0.492 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.3 | -43.2 | 174.8 | -178.9 | 83.5 | 0 | 0 | 0 | 112.4 | K342 S344 V349 R350 | K342-D346 WeakPolarHBondContact O-CB 3.45Å; K342-D346 PolarHBondContact O-N 3.39Å; S344-D346 VanDerWaalsContact C-N 3.34Å; S344-D346 PolarHBondContact O-N 3.33Å; D346-V349 PolarHBondContact O-N 3.5Å; D346-R350 VanDerWaalsContact O-CG 3.31Å; D346-R350 WeakPolarHBondContact O-CG 3.48Å; D346-R350 PolarHBondContact O-N 2.87Å |
| 347 | L | 94.8 | Very high | 94 | Very high | 95 Ų | 95 | 97.1 Ų | 97.1 | 50% | 0.497 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.7 | -40.9 | 175.9 | -81.3 | 164.2 | 0 | 0 | 0 | 111.6 | R343 S344 R350 V351 | R343-L347 WeakPolarHBondContact O-CB 3.43Å; R343-L347 WeakPolarHBondContact O-CD1 3.46Å; R343-L347 WeakPolarHBondContact O-CG 3.42Å; R343-L347 PolarHBondContact O-N 3.1Å; S344-L347 PolarHBondContact O-N 2.82Å; L347-R350 PolarHBondContact O-N 2.97Å; L347-V351 WeakPolarHBondContact O-CB 3.28Å; L347-V351 VanDerWaalsContact O-CG2 3.3Å; L347-V351 WeakPolarHBondContact O-CG2 3.26Å; L347-V351 PolarHBondContact O-N 3.23Å |
| 348 | E | 95.5 | Very high | 93.8 | Very high | 129 Ų | 129 | 95.9 Ų | 95.9 | 60% | 0.603 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61 | -47.1 | 176.8 | -174.6 | 170.9 | -168.7 | 0 | 0 | 111.3 | S344 D345 R350 V351 Q352 | S344-E348 PolarHBondContact O-N 3.37Å; D345-E348 PolarHBondContact O-N 2.97Å; E348-R350 VanDerWaalsContact C-N 3.31Å; E348-R350 PolarHBondContact O-N 3.19Å; E348-V351 PolarHBondContact O-N 3.17Å; E348-Q352 WeakPolarHBondContact O-CB 3.49Å; E348-Q352 PolarHBondContact O-N 2.89Å |
| 349 | V | 94.8 | Very high | 93.5 | Very high | 95 Ų | 95 | 99.6 Ų | 99.6 | 58% | 0.576 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59 | -42.6 | 174.9 | 172.2 | 0 | 0 | 0 | 0 | 111.4 | D345 D346 Q352 S353 | D345-V349 WeakPolarHBondContact O-CG2 3.13Å; D345-V349 PolarHBondContact O-N 3.38Å; D346-V349 PolarHBondContact O-N 3.5Å; V349-Q352 PolarHBondContact O-N 3.4Å; V349-S353 WeakPolarHBondContact O-CB 3.47Å; V349-S353 PolarHBondContact O-N 3.34Å |
| 350 | R | 93.8 | Very high | 93.1 | Very high | 163 Ų | 163 | 97.5 Ų | 97.5 | 62% | 0.615 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.1 | -38.3 | 178.2 | -73 | 177.6 | 63.4 | -170.3 | -2.3 | 112.7 | D346 L347 E348 S354 | D346-R350 VanDerWaalsContact O-CG 3.31Å; D346-R350 WeakPolarHBondContact O-CG 3.48Å; D346-R350 PolarHBondContact O-N 2.87Å; L347-R350 PolarHBondContact O-N 2.97Å; E348-R350 VanDerWaalsContact C-N 3.31Å; E348-R350 PolarHBondContact O-N 3.19Å; R350-S354 WeakPolarHBondContact O-CB 3.36Å; R350-S354 PolarHBondContact O-N 3.11Å |
| 351 | V | 94.3 | Very high | 92.9 | Very high | 77 Ų | 77 | 100.8 Ų | 100.8 | 47% | 0.467 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.2 | -49.1 | 175.5 | 167.6 | 0 | 0 | 0 | 0 | 109.7 | L347 E348 S353 S354 E355 | L347-V351 WeakPolarHBondContact O-CB 3.28Å; L347-V351 VanDerWaalsContact O-CG2 3.3Å; L347-V351 WeakPolarHBondContact O-CG2 3.26Å; L347-V351 PolarHBondContact O-N 3.23Å; E348-V351 PolarHBondContact O-N 3.17Å; V351-S353 VanDerWaalsContact C-N 3.33Å; V351-S353 PolarHBondContact O-N 2.89Å; V351-S354 CarbonylContact O-C 3.6Å; V351-S354 WeakPolarHBondContact O-CA 3.19Å; V351-S354 WeakPolarHBondContact O-CB 3.33Å; V351-S354 PolarHBondContact O-N 2.79Å; V351-E355 HydrophobicContact CG1-CG 4.3Å; V351-E355 WeakPolarHBondContact O-CG 3.36Å; V351-E355 PolarHBondContact O-N 3.25Å |
| 352 | Q | 93.8 | Very high | 92.7 | Very high | 104 Ų | 104 | 99.7 Ų | 99.7 | 49% | 0.486 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -57.7 | -45.4 | 177.4 | -173.6 | 178 | -5.6 | 0 | 0 | 111.6 | E348 V349 S354 E355 E356 | E348-Q352 WeakPolarHBondContact O-CB 3.49Å; E348-Q352 PolarHBondContact O-N 2.89Å; V349-Q352 PolarHBondContact O-N 3.4Å; Q352-S354 VanDerWaalsContact C-N 3.29Å; Q352-S354 PolarHBondContact O-N 3.45Å; Q352-E355 PolarHBondContact O-N 3.19Å; Q352-E356 PolarHBondContact NE2-OE1 3.32Å; Q352-E356 WeakPolarHBondContact O-CG 3.41Å; Q352-E356 PolarHBondContact O-N 3.2Å |
| 353 | S | 92.1 | Very high | 92.4 | Very high | 74 Ų | 74 | 94.7 Ų | 94.7 | 52% | 0.517 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.7 | -36.2 | 174.8 | 178.8 | 0 | 0 | 0 | 0 | 112.7 | V349 V351 G357 | V349-S353 WeakPolarHBondContact O-CB 3.47Å; V349-S353 PolarHBondContact O-N 3.34Å; V351-S353 VanDerWaalsContact C-N 3.33Å; V351-S353 PolarHBondContact O-N 2.89Å; S353-G357 PolarHBondContact O-N 3.49Å |
| 354 | S | 89.2 | Confident | 92.1 | Very high | 86 Ų | 86 | 89.3 Ų | 89.3 | 60% | 0.601 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -70.7 | -35.8 | 175.1 | -173.8 | 0 | 0 | 0 | 0 | 112.5 | R350 V351 Q352 G358 | R350-S354 WeakPolarHBondContact O-CB 3.36Å; R350-S354 PolarHBondContact O-N 3.11Å; V351-S354 CarbonylContact O-C 3.6Å; V351-S354 WeakPolarHBondContact O-CA 3.19Å; V351-S354 WeakPolarHBondContact O-CB 3.33Å; V351-S354 PolarHBondContact O-N 2.79Å; Q352-S354 VanDerWaalsContact C-N 3.29Å; Q352-S354 PolarHBondContact O-N 3.45Å; S354-G358 PolarHBondContact O-N 3.22Å |
| 355 | E | 91.9 | Very high | 91.9 | Very high | 121 Ų | 121 | 92.1 Ų | 92.1 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.2 | -49.3 | 175 | -73.2 | 177.6 | 165 | 0 | 0 | 110.2 | V351 Q352 G357 G358 E359 | V351-E355 HydrophobicContact CG1-CG 4.3Å; V351-E355 WeakPolarHBondContact O-CG 3.36Å; V351-E355 PolarHBondContact O-N 3.25Å; Q352-E355 PolarHBondContact O-N 3.19Å; E355-G357 VanDerWaalsContact C-N 3.3Å; E355-G357 PolarHBondContact O-N 3.44Å; E355-G358 CarbonylContact O-C 3.58Å; E355-G358 WeakPolarHBondContact O-CA 3.34Å; E355-G358 PolarHBondContact O-N 3.47Å; E355-E359 WeakPolarHBondContact O-CG 3.27Å; E355-E359 PolarHBondContact O-N 2.8Å |
| 356 | E | 90.7 | Very high | 91.7 | Very high | 106 Ų | 106 | 91.4 Ų | 91.4 | 50% | 0.495 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.8 | -41 | 174.1 | -70.1 | 172.5 | -172.1 | 0 | 0 | 111.6 | Q352 E359 S360 | Q352-E356 PolarHBondContact NE2-OE1 3.32Å; Q352-E356 WeakPolarHBondContact O-CG 3.41Å; Q352-E356 PolarHBondContact O-N 3.2Å; E356-E359 PolarHBondContact O-N 3.07Å; E356-S360 WeakPolarHBondContact O-CB 3.44Å; E356-S360 PolarHBondContact O-N 2.96Å |
| 357 | G | 89.1 | Confident | 91.5 | Very high | 32 Ų | 32 | 90.9 Ų | 90.9 | 33% | 0.33 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.3 | -39.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | S353 E355 S360 L361 | S353-G357 PolarHBondContact O-N 3.49Å; E355-G357 VanDerWaalsContact C-N 3.3Å; E355-G357 PolarHBondContact O-N 3.44Å; G357-S360 PolarHBondContact O-N 3.31Å; G357-L361 WeakPolarHBondContact O-CB 3.19Å; G357-L361 VanDerWaalsContact O-CG 3.31Å; G357-L361 WeakPolarHBondContact O-CG 3.43Å; G357-L361 PolarHBondContact O-N 3Å |
| 358 | G | 89.4 | Confident | 91.3 | Very high | 30 Ų | 30 | 91.1 Ų | 91.1 | 31% | 0.309 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.1 | -40.5 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | S354 E355 L361 T362 | S354-G358 PolarHBondContact O-N 3.22Å; E355-G358 CarbonylContact O-C 3.58Å; E355-G358 WeakPolarHBondContact O-CA 3.34Å; E355-G358 PolarHBondContact O-N 3.47Å; G358-L361 PolarHBondContact O-N 3.06Å; G358-T362 WeakPolarHBondContact O-CB 3.48Å; G358-T362 PolarHBondContact O-N 3.22Å; G358-T362 PolarHBondContact O-OG1 3.34Å |
| 359 | E | 89.4 | Confident | 91.2 | Very high | 141 Ų | 141 | 88 Ų | 88 | 66% | 0.659 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.1 | -44.7 | 172.9 | -71.8 | -176.8 | 172.3 | 0 | 0 | 111.2 | E355 E356 L361 T362 A363 | E355-E359 WeakPolarHBondContact O-CG 3.27Å; E355-E359 PolarHBondContact O-N 2.8Å; E356-E359 PolarHBondContact O-N 3.07Å; E359-L361 VanDerWaalsContact C-N 3.35Å; E359-L361 PolarHBondContact O-N 2.82Å; E359-T362 PolarHBondContact O-N 3.27Å; E359-A363 WeakPolarHBondContact O-CB 3.5Å; E359-A363 PolarHBondContact O-N 3.49Å |
| 360 | S | 86.8 | Confident | 91 | Very high | 74 Ų | 74 | 91.1 Ų | 91.1 | 52% | 0.517 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.5 | -42.8 | 174.9 | -178.4 | 0 | 0 | 0 | 0 | 112.1 | E356 G357 A363 S364 | E356-S360 WeakPolarHBondContact O-CB 3.44Å; E356-S360 PolarHBondContact O-N 2.96Å; G357-S360 PolarHBondContact O-N 3.31Å; S360-A363 PolarHBondContact O-N 2.99Å; S360-S364 WeakPolarHBondContact O-CB 3.41Å; S360-S364 PolarHBondContact O-N 3.42Å; S360-S364 PolarHBondContact O-OG 3.27Å |
| 361 | L | 91.1 | Very high | 91 | Very high | 126 Ų | 126 | 90.3 Ų | 90.3 | 66% | 0.66 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.1 | -42.4 | 174 | -79.4 | 170.9 | 0 | 0 | 0 | 111.6 | G357 G358 E359 S364 L365 | G357-L361 WeakPolarHBondContact O-CB 3.19Å; G357-L361 VanDerWaalsContact O-CG 3.31Å; G357-L361 WeakPolarHBondContact O-CG 3.43Å; G357-L361 PolarHBondContact O-N 3Å; G358-L361 PolarHBondContact O-N 3.06Å; E359-L361 VanDerWaalsContact C-N 3.35Å; E359-L361 PolarHBondContact O-N 2.82Å; L361-S364 PolarHBondContact O-N 3.48Å; L361-L365 WeakPolarHBondContact O-CB 3.46Å; L361-L365 PolarHBondContact O-N 2.81Å |
| 362 | T | 91.4 | Very high | 90.8 | Very high | 87 Ų | 87 | 90.3 Ų | 90.3 | 53% | 0.534 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.7 | -41.2 | 178.2 | -59.4 | 0 | 0 | 0 | 0 | 111.6 | G358 E359 L365 S366 | G358-T362 WeakPolarHBondContact O-CB 3.48Å; G358-T362 PolarHBondContact O-N 3.22Å; G358-T362 PolarHBondContact O-OG1 3.34Å; E359-T362 PolarHBondContact O-N 3.27Å; T362-L365 PolarHBondContact O-N 2.93Å; T362-S366 WeakPolarHBondContact O-CB 3.42Å; T362-S366 PolarHBondContact O-N 2.88Å; T362-S366 PolarHBondContact O-OG 3.26Å |
| 363 | A | 88.1 | Confident | 90.7 | Very high | 54 Ų | 54 | 91.1 Ų | 91.1 | 45% | 0.446 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.7 | -46.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | E359 S360 L365 S366 D367 | E359-A363 WeakPolarHBondContact O-CB 3.5Å; E359-A363 PolarHBondContact O-N 3.49Å; S360-A363 PolarHBondContact O-N 2.99Å; A363-L365 VanDerWaalsContact C-N 3.32Å; A363-L365 PolarHBondContact O-N 3.25Å; A363-S366 WeakPolarHBondContact O-CB 3.47Å; A363-S366 PolarHBondContact O-N 2.86Å; A363-D367 PolarHBondContact O-N 2.94Å |
| 364 | S | 89.9 | Confident | 90.6 | Very high | 56 Ų | 56 | 90.4 Ų | 90.4 | 39% | 0.392 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.5 | -41.1 | 176.2 | -60.3 | 0 | 0 | 0 | 0 | 111.9 | S360 L361 S366 D367 I368 | S360-S364 WeakPolarHBondContact O-CB 3.41Å; S360-S364 PolarHBondContact O-N 3.42Å; S360-S364 PolarHBondContact O-OG 3.27Å; L361-S364 PolarHBondContact O-N 3.48Å; S364-S366 VanDerWaalsContact C-N 3.34Å; S364-D367 PolarHBondContact O-N 2.84Å; S364-I368 WeakPolarHBondContact O-CB 3.33Å; S364-I368 VanDerWaalsContact O-CG1 3.24Å; S364-I368 WeakPolarHBondContact O-CG1 3.24Å; S364-I368 PolarHBondContact O-N 3.42Å |
| 365 | L | 91.6 | Very high | 90.6 | Very high | 121 Ų | 121 | 91.8 Ų | 91.8 | 63% | 0.634 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.9 | -39.9 | 176.8 | -159.2 | 81.2 | 0 | 0 | 0 | 111.2 | L361 T362 A363 I368 S369 | L361-L365 WeakPolarHBondContact O-CB 3.46Å; L361-L365 PolarHBondContact O-N 2.81Å; T362-L365 PolarHBondContact O-N 2.93Å; A363-L365 VanDerWaalsContact C-N 3.32Å; A363-L365 PolarHBondContact O-N 3.25Å; L365-I368 PolarHBondContact O-N 3.48Å; L365-S369 WeakPolarHBondContact O-CB 3.34Å; L365-S369 PolarHBondContact O-N 3.43Å |
| 366 | S | 91.7 | Very high | 90.5 | Very high | 56 Ų | 56 | 90.7 Ų | 90.7 | 39% | 0.392 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.6 | -42.5 | 175.7 | -59.6 | 0 | 0 | 0 | 0 | 111.7 | T362 A363 S364 S369 R370 | T362-S366 WeakPolarHBondContact O-CB 3.42Å; T362-S366 PolarHBondContact O-N 2.88Å; T362-S366 PolarHBondContact O-OG 3.26Å; A363-S366 WeakPolarHBondContact O-CB 3.47Å; A363-S366 PolarHBondContact O-N 2.86Å; S364-S366 VanDerWaalsContact C-N 3.34Å; S366-S369 WeakPolarHBondContact O-CB 3.5Å; S366-S369 PolarHBondContact O-N 3.19Å; S366-R370 WeakPolarHBondContact O-CG 3.48Å; S366-R370 PolarHBondContact O-N 2.93Å |
| 367 | D | 92.4 | Very high | 90.3 | Very high | 82 Ų | 82 | 88.6 Ų | 88.6 | 44% | 0.439 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.1 | -39.2 | 175.8 | -80 | -17.2 | 0 | 0 | 0 | 112.3 | A363 S364 R370 K371 | A363-D367 PolarHBondContact O-N 2.94Å; S364-D367 PolarHBondContact O-N 2.84Å; D367-R370 PolarHBondContact O-N 3.14Å; D367-R370 IonicContact OD1-NH1 2.7Å; D367-R370 PolarHBondContact OD1-NH1 3.49Å; D367-K371 WeakPolarHBondContact O-CG 3.33Å; D367-K371 PolarHBondContact O-N 3.38Å |
| 368 | I | 91.1 | Very high | 90.4 | Very high | 100 Ų | 100 | 93.3 Ų | 93.3 | 51% | 0.513 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.9 | -46.2 | 170.8 | -70.3 | 164.7 | 0 | 0 | 0 | 109.9 | S364 L365 R370 K371 V372 | S364-I368 WeakPolarHBondContact O-CB 3.33Å; S364-I368 VanDerWaalsContact O-CG1 3.24Å; S364-I368 WeakPolarHBondContact O-CG1 3.24Å; S364-I368 PolarHBondContact O-N 3.42Å; L365-I368 PolarHBondContact O-N 3.48Å; I368-R370 VanDerWaalsContact C-N 3.35Å; I368-R370 PolarHBondContact O-N 2.96Å; I368-K371 WeakPolarHBondContact O-CB 3.47Å; I368-K371 PolarHBondContact O-N 2.84Å; I368-K371 VanDerWaalsContact O-N 3.13Å; I368-V372 HydrophobicContact CG2-CG2 4.32Å; I368-V372 WeakPolarHBondContact O-CG2 3.22Å; I368-V372 PolarHBondContact O-N 3.48Å |
| 369 | S | 92.1 | Very high | 90.3 | Very high | 62 Ų | 62 | 99.3 Ų | 99.3 | 43% | 0.434 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -57.9 | -45.9 | 177.9 | -164.4 | 0 | 0 | 0 | 0 | 111.6 | L365 S366 K371 V372 E373 | L365-S369 WeakPolarHBondContact O-CB 3.34Å; L365-S369 PolarHBondContact O-N 3.43Å; S366-S369 WeakPolarHBondContact O-CB 3.5Å; S366-S369 PolarHBondContact O-N 3.19Å; S369-K371 PolarHBondContact O-N 3.11Å; S369-V372 PolarHBondContact O-N 2.97Å; S369-E373 PolarHBondContact O-N 3.26Å |
| 370 | R | 91.8 | Very high | 90.2 | Very high | 162 Ų | 162 | 96.8 Ų | 96.8 | 61% | 0.611 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.2 | -41.3 | 174.7 | -73 | 174.9 | -178.6 | 158.9 | -3.3 | 112.6 | S366 D367 I368 V372 E373 S374 | S366-R370 WeakPolarHBondContact O-CG 3.48Å; S366-R370 PolarHBondContact O-N 2.93Å; D367-R370 PolarHBondContact O-N 3.14Å; D367-R370 IonicContact OD1-NH1 2.7Å; D367-R370 PolarHBondContact OD1-NH1 3.49Å; I368-R370 VanDerWaalsContact C-N 3.35Å; I368-R370 PolarHBondContact O-N 2.96Å; R370-V372 VanDerWaalsContact C-N 3.34Å; R370-E373 PolarHBondContact O-N 3.31Å; R370-S374 WeakPolarHBondContact O-CB 3.4Å; R370-S374 PolarHBondContact O-N 2.87Å |
| 371 | K | 92.4 | Very high | 90 | Very high | 146 Ų | 146 | 95.2 Ų | 95.2 | 64% | 0.635 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.5 | -41.5 | 175.7 | -75.8 | 177.5 | -178.7 | 178.5 | 0 | 111.2 | D367 I368 S369 S374 L375 | D367-K371 WeakPolarHBondContact O-CG 3.33Å; D367-K371 PolarHBondContact O-N 3.38Å; I368-K371 WeakPolarHBondContact O-CB 3.47Å; I368-K371 PolarHBondContact O-N 2.84Å; I368-K371 VanDerWaalsContact O-N 3.13Å; S369-K371 PolarHBondContact O-N 3.11Å; K371-S374 PolarHBondContact O-N 3.33Å; K371-L375 WeakPolarHBondContact O-CB 3.29Å; K371-L375 PolarHBondContact O-N 2.86Å |
| 372 | V | 91.9 | Very high | 89.7 | Confident | 76 Ų | 76 | 95.2 Ų | 95.2 | 46% | 0.461 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.9 | -46.6 | 175.9 | 170.9 | 0 | 0 | 0 | 0 | 111 | I368 S369 R370 S374 L375 L376 | I368-V372 HydrophobicContact CG2-CG2 4.32Å; I368-V372 WeakPolarHBondContact O-CG2 3.22Å; I368-V372 PolarHBondContact O-N 3.48Å; S369-V372 PolarHBondContact O-N 2.97Å; R370-V372 VanDerWaalsContact C-N 3.34Å; V372-S374 VanDerWaalsContact C-N 3.32Å; V372-S374 PolarHBondContact O-N 3.34Å; V372-L375 WeakPolarHBondContact O-CB 3.34Å; V372-L375 PolarHBondContact O-N 2.85Å; V372-L376 HydrophobicContact CG1-CD1 4.15Å; V372-L376 PolarHBondContact O-N 2.85Å |
| 373 | E | 90.4 | Very high | 89.4 | Confident | 121 Ų | 121 | 96.5 Ų | 96.5 | 57% | 0.565 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.3 | -41.7 | 173.9 | -77.5 | 173.8 | 179.2 | 0 | 0 | 112 | S369 R370 L375 L376 A377 | S369-E373 PolarHBondContact O-N 3.26Å; R370-E373 PolarHBondContact O-N 3.31Å; E373-L375 PolarHBondContact O-N 3.04Å; E373-L376 PolarHBondContact O-N 2.92Å; E373-A377 WeakPolarHBondContact O-CB 3.48Å; E373-A377 PolarHBondContact O-N 3.15Å |
| 374 | S | 90.4 | Very high | 89 | Confident | 60 Ų | 60 | 97.8 Ų | 97.8 | 42% | 0.42 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 175.4 | -178.2 | 0 | 0 | 0 | 0 | 112.4 | R370 K371 V372 A377 K378 | R370-S374 WeakPolarHBondContact O-CB 3.4Å; R370-S374 PolarHBondContact O-N 2.87Å; K371-S374 PolarHBondContact O-N 3.33Å; V372-S374 VanDerWaalsContact C-N 3.32Å; V372-S374 PolarHBondContact O-N 3.34Å; S374-A377 PolarHBondContact O-N 3.45Å; S374-K378 WeakPolarHBondContact O-CB 3.38Å; S374-K378 WeakPolarHBondContact O-CG 3.4Å; S374-K378 PolarHBondContact O-N 2.91Å |
| 375 | L | 89.8 | Confident | 88.6 | Confident | 114 Ų | 114 | 98.4 Ų | 98.4 | 60% | 0.597 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.6 | -42.9 | 175 | -91.7 | 149.3 | 0 | 0 | 0 | 111.6 | K371 V372 E373 K378 Y379 | K371-L375 WeakPolarHBondContact O-CB 3.29Å; K371-L375 PolarHBondContact O-N 2.86Å; V372-L375 WeakPolarHBondContact O-CB 3.34Å; V372-L375 PolarHBondContact O-N 2.85Å; E373-L375 PolarHBondContact O-N 3.04Å; L375-K378 PolarHBondContact O-N 2.68Å; L375-Y379 WeakPolarHBondContact O-CB 3.36Å; L375-Y379 PolarHBondContact O-N 2.94Å |
| 376 | L | 88.9 | Confident | 88.1 | Confident | 98 Ų | 98 | 98.4 Ų | 98.4 | 51% | 0.513 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.8 | -47.7 | 174.4 | -78.6 | 164.8 | 0 | 0 | 0 | 111.4 | V372 E373 K378 Y379 D380 | V372-L376 HydrophobicContact CG1-CD1 4.15Å; V372-L376 PolarHBondContact O-N 2.85Å; E373-L376 PolarHBondContact O-N 2.92Å; L376-K378 VanDerWaalsContact C-N 3.31Å; L376-K378 PolarHBondContact O-N 2.9Å; L376-Y379 CarbonylContact O-C 3.58Å; L376-Y379 WeakPolarHBondContact O-CA 3.37Å; L376-Y379 WeakPolarHBondContact O-CB 3.01Å; L376-Y379 PolarHBondContact O-N 2.91Å; L376-D380 PolarHBondContact O-N 3.36Å |
| 377 | A | 87.3 | Confident | 87.4 | Confident | 62 Ų | 62 | 99.9 Ų | 99.9 | 51% | 0.512 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.1 | -38 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | E373 S374 Y379 G381 | E373-A377 WeakPolarHBondContact O-CB 3.48Å; E373-A377 PolarHBondContact O-N 3.15Å; S374-A377 PolarHBondContact O-N 3.45Å; A377-Y379 VanDerWaalsContact C-N 3.34Å; A377-G381 PolarHBondContact O-N 3.26Å |
| 378 | K | 90.2 | Very high | 86.8 | Confident | 132 Ų | 132 | 98.9 Ų | 98.9 | 57% | 0.574 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.1 | -42.3 | 171.4 | -78.3 | -178.7 | -178.9 | -176.9 | 0 | 111.3 | S374 L375 L376 G381 H382 | S374-K378 WeakPolarHBondContact O-CB 3.38Å; S374-K378 WeakPolarHBondContact O-CG 3.4Å; S374-K378 PolarHBondContact O-N 2.91Å; L375-K378 PolarHBondContact O-N 2.68Å; L376-K378 VanDerWaalsContact C-N 3.31Å; L376-K378 PolarHBondContact O-N 2.9Å; K378-G381 PolarHBondContact O-N 3.18Å; K378-H382 PolarHBondContact O-CD2 3.44Å; K378-H382 PolarHBondContact O-N 2.93Å |
| 379 | Y | 87.9 | Confident | 86.1 | Confident | 155 Ų | 155 | 99.4 Ų | 99.4 | 61% | 0.608 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -61.8 | -48.7 | 177.5 | -173.9 | -91.3 | 0 | 0 | 0 | 111.5 | L375 L376 A377 G381 H382 E383 | L375-Y379 WeakPolarHBondContact O-CB 3.36Å; L375-Y379 PolarHBondContact O-N 2.94Å; L376-Y379 CarbonylContact O-C 3.58Å; L376-Y379 WeakPolarHBondContact O-CA 3.37Å; L376-Y379 WeakPolarHBondContact O-CB 3.01Å; L376-Y379 PolarHBondContact O-N 2.91Å; A377-Y379 VanDerWaalsContact C-N 3.34Å; Y379-G381 PolarHBondContact O-N 3.39Å; Y379-H382 CarbonylContact O-C 3.56Å; Y379-H382 WeakPolarHBondContact O-CA 3.47Å; Y379-H382 WeakPolarHBondContact O-CB 3.26Å; Y379-H382 PolarHBondContact O-N 2.92Å; Y379-E383 PolarHBondContact O-N 3.37Å |
| 380 | D | 86.9 | Confident | 85.4 | Confident | 89 Ų | 89 | 98.2 Ų | 98.2 | 48% | 0.476 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.9 | -38.2 | 174.9 | -65.6 | -19.1 | 0 | 0 | 0 | 111.6 | L376 E383 S384 | L376-D380 PolarHBondContact O-N 3.36Å; D380-E383 PolarHBondContact O-N 2.83Å; D380-S384 WeakPolarHBondContact O-CB 3.28Å; D380-S384 PolarHBondContact O-N 2.91Å; D380-S384 PolarHBondContact O-OG 3.47Å |
| 381 | G | 83.1 | Confident | 84.8 | Confident | 40 Ų | 40 | 92.5 Ų | 92.5 | 41% | 0.412 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64 | -41.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | A377 K378 Y379 S385 | A377-G381 PolarHBondContact O-N 3.26Å; K378-G381 PolarHBondContact O-N 3.18Å; Y379-G381 PolarHBondContact O-N 3.39Å; G381-S385 WeakPolarHBondContact O-CB 3.48Å; G381-S385 PolarHBondContact O-N 2.87Å |
| 382 | H | 84.8 | Confident | 84 | Confident | 126 Ų | 126 | 87.9 Ų | 87.9 | 58% | 0.583 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -66.2 | -42.5 | 173.9 | -80.4 | -68.8 | 0 | 0 | 0 | 112 | K378 Y379 S385 L386 | K378-H382 PolarHBondContact O-CD2 3.44Å; K378-H382 PolarHBondContact O-N 2.93Å; Y379-H382 CarbonylContact O-C 3.56Å; Y379-H382 WeakPolarHBondContact O-CA 3.47Å; Y379-H382 WeakPolarHBondContact O-CB 3.26Å; Y379-H382 PolarHBondContact O-N 2.92Å; H382-S385 PolarHBondContact O-N 3.08Å; H382-L386 VanDerWaalsContact O-CB 3.29Å; H382-L386 WeakPolarHBondContact O-CB 3.27Å; H382-L386 PolarHBondContact O-N 2.83Å |
| 383 | E | 84.6 | Confident | 83.3 | Confident | 114 Ų | 114 | 88.3 Ų | 88.3 | 53% | 0.533 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.4 | -43.5 | 175.8 | -176.7 | 171.7 | -169.4 | 0 | 0 | 111.3 | Y379 D380 L386 S387 | Y379-E383 PolarHBondContact O-N 3.37Å; D380-E383 PolarHBondContact O-N 2.83Å; E383-L386 PolarHBondContact O-N 3.26Å; E383-S387 WeakPolarHBondContact O-CB 3.47Å; E383-S387 PolarHBondContact O-N 3.42Å |
| 384 | S | 79.8 | Confident | 82.7 | Confident | 81 Ų | 81 | 87 Ų | 87 | 57% | 0.566 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.8 | -43.1 | 175.1 | -61.7 | 0 | 0 | 0 | 0 | 111.9 | D380 S387 A388 | D380-S384 WeakPolarHBondContact O-CB 3.28Å; D380-S384 PolarHBondContact O-N 2.91Å; D380-S384 PolarHBondContact O-OG 3.47Å; S384-S387 PolarHBondContact O-N 3.37Å; S384-A388 WeakPolarHBondContact O-CB 3.15Å; S384-A388 PolarHBondContact O-N 3.12Å |
| 385 | S | 81.1 | Confident | 82 | Confident | 70 Ų | 70 | 91.6 Ų | 91.6 | 49% | 0.49 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.4 | -40.2 | 175.2 | -171.7 | 0 | 0 | 0 | 0 | 111.7 | G381 H382 A388 Q389 | G381-S385 WeakPolarHBondContact O-CB 3.48Å; G381-S385 PolarHBondContact O-N 2.87Å; H382-S385 PolarHBondContact O-N 3.08Å; S385-A388 PolarHBondContact O-N 3.41Å; S385-Q389 VanDerWaalsContact O-CB 3.26Å; S385-Q389 WeakPolarHBondContact O-CB 3.26Å; S385-Q389 PolarHBondContact O-N 3.46Å |
| 386 | L | 81 | Confident | 81.4 | Confident | 121 Ų | 121 | 90.2 Ų | 90.2 | 63% | 0.634 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.6 | -39.3 | 176.2 | -169.9 | 71.9 | 0 | 0 | 0 | 111.4 | H382 E383 Q389 G390 | H382-L386 VanDerWaalsContact O-CB 3.29Å; H382-L386 WeakPolarHBondContact O-CB 3.27Å; H382-L386 PolarHBondContact O-N 2.83Å; E383-L386 PolarHBondContact O-N 3.26Å; L386-Q389 PolarHBondContact O-N 3Å; L386-G390 PolarHBondContact O-N 3.4Å |
| 387 | S | 78.5 | Confident | 80.8 | Confident | 86 Ų | 86 | 93.2 Ų | 93.2 | 60% | 0.601 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.9 | -44.5 | 173.4 | -171.8 | 0 | 0 | 0 | 0 | 111.7 | E383 S384 Q389 G390 A391 | E383-S387 WeakPolarHBondContact O-CB 3.47Å; E383-S387 PolarHBondContact O-N 3.42Å; S384-S387 PolarHBondContact O-N 3.37Å; S387-Q389 VanDerWaalsContact C-N 3.35Å; S387-Q389 PolarHBondContact O-N 3.25Å; S387-G390 PolarHBondContact O-N 3.38Å; S387-A391 WeakPolarHBondContact O-CB 3.2Å; S387-A391 PolarHBondContact O-N 2.97Å |
| 388 | A | 77.9 | Confident | 80.4 | Confident | 62 Ų | 62 | 93.8 Ų | 93.8 | 51% | 0.512 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.8 | -41.1 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | S384 S385 A391 A392 | S384-A388 WeakPolarHBondContact O-CB 3.15Å; S384-A388 PolarHBondContact O-N 3.12Å; S385-A388 PolarHBondContact O-N 3.41Å; A388-A391 PolarHBondContact O-N 2.98Å; A388-A392 WeakPolarHBondContact O-CB 3.32Å; A388-A392 PolarHBondContact O-N 2.81Å |
| 389 | Q | 77.8 | Confident | 79.8 | Confident | 110 Ų | 110 | 91.7 Ų | 91.7 | 51% | 0.514 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.1 | -41.8 | 173.9 | -174.2 | 178.7 | -1.8 | 0 | 0 | 111.1 | S385 L386 S387 A391 A392 V393 | S385-Q389 VanDerWaalsContact O-CB 3.26Å; S385-Q389 WeakPolarHBondContact O-CB 3.26Å; S385-Q389 PolarHBondContact O-N 3.46Å; L386-Q389 PolarHBondContact O-N 3Å; S387-Q389 VanDerWaalsContact C-N 3.35Å; S387-Q389 PolarHBondContact O-N 3.25Å; Q389-A391 VanDerWaalsContact C-N 3.33Å; Q389-A391 PolarHBondContact O-N 2.91Å; Q389-A392 PolarHBondContact O-N 3.18Å; Q389-V393 WeakPolarHBondContact O-CB 3.28Å; Q389-V393 VanDerWaalsContact O-CG2 3.29Å; Q389-V393 WeakPolarHBondContact O-CG2 3.29Å; Q389-V393 PolarHBondContact O-N 3.4Å |
| 390 | G | 77.4 | Confident | 79.2 | Confident | 37 Ų | 37 | 89 Ų | 89 | 38% | 0.381 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.5 | -42.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L386 S387 V393 E394 | L386-G390 PolarHBondContact O-N 3.4Å; S387-G390 PolarHBondContact O-N 3.38Å; G390-V393 PolarHBondContact O-N 2.69Å; G390-E394 PolarHBondContact O-N 2.88Å |
| 391 | A | 78.4 | Confident | 78.6 | Confident | 43 Ų | 43 | 89.7 Ų | 89.7 | 36% | 0.355 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.5 | -32.4 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | S387 A388 Q389 R395 | S387-A391 WeakPolarHBondContact O-CB 3.2Å; S387-A391 PolarHBondContact O-N 2.97Å; A388-A391 PolarHBondContact O-N 2.98Å; Q389-A391 VanDerWaalsContact C-N 3.33Å; Q389-A391 PolarHBondContact O-N 2.91Å; A391-R395 WeakPolarHBondContact O-CG 3.3Å; A391-R395 PolarHBondContact O-N 2.83Å; A391-R395 VanDerWaalsContact O-N 3.08Å; A391-R395 PolarHBondContact O-NH1 3.47Å |
| 392 | A | 76.4 | Confident | 78.3 | Confident | 48 Ų | 48 | 93.4 Ų | 93.4 | 40% | 0.397 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -70.7 | -41.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | A388 Q389 R395 V396 | A388-A392 WeakPolarHBondContact O-CB 3.32Å; A388-A392 PolarHBondContact O-N 2.81Å; Q389-A392 PolarHBondContact O-N 3.18Å; A392-R395 PolarHBondContact O-N 2.82Å; A392-V396 WeakPolarHBondContact O-CG2 3.4Å; A392-V396 PolarHBondContact O-N 3.4Å |
| 393 | V | 77.3 | Confident | 77.8 | Confident | 86 Ų | 86 | 92.9 Ų | 92.9 | 52% | 0.521 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.6 | -42.8 | 175.2 | 169.1 | 0 | 0 | 0 | 0 | 111 | Q389 G390 V396 R397 | Q389-V393 WeakPolarHBondContact O-CB 3.28Å; Q389-V393 VanDerWaalsContact O-CG2 3.29Å; Q389-V393 WeakPolarHBondContact O-CG2 3.29Å; Q389-V393 PolarHBondContact O-N 3.4Å; G390-V393 PolarHBondContact O-N 2.69Å; V393-V396 PolarHBondContact O-N 2.99Å; V393-R397 VanDerWaalsContact O-CB 3.31Å; V393-R397 WeakPolarHBondContact O-CB 3.43Å; V393-R397 PolarHBondContact O-N 2.91Å |
| 394 | E | 76.7 | Confident | 77.2 | Confident | 94 Ų | 94 | 92.5 Ų | 92.5 | 44% | 0.439 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.6 | -36.4 | 174.7 | -82.8 | -64.4 | 146.6 | 0 | 0 | 112.2 | G390 R397 T398 | G390-E394 PolarHBondContact O-N 2.88Å; E394-R397 WeakPolarHBondContact O-CB 3.24Å; E394-R397 PolarHBondContact O-N 3.41Å; E394-R397 IonicContact OE1-NH1 2.95Å; E394-R397 PolarHBondContact OE1-NH1 3.47Å; E394-R397 IonicContact OE2-NH1 3.16Å; E394-T398 WeakPolarHBondContact O-CG2 3.43Å; E394-T398 PolarHBondContact O-N 2.95Å; E394-T398 PolarHBondContact O-OG1 2.98Å |
| 395 | R | 75.9 | Confident | 76.7 | Confident | 155 Ų | 155 | 93.2 Ų | 93.2 | 59% | 0.585 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.5 | -48.8 | 171.1 | -79.5 | -175.2 | -170.1 | 87.3 | -4.5 | 112.4 | A391 A392 R397 T398 D399 | A391-R395 WeakPolarHBondContact O-CG 3.3Å; A391-R395 PolarHBondContact O-N 2.83Å; A391-R395 VanDerWaalsContact O-N 3.08Å; A391-R395 PolarHBondContact O-NH1 3.47Å; A392-R395 PolarHBondContact O-N 2.82Å; R395-R397 PolarHBondContact O-N 3.19Å; R395-T398 WeakPolarHBondContact CA-OG1 3.46Å; R395-T398 PolarHBondContact O-N 2.95Å; R395-T398 VanDerWaalsContact O-N 3.08Å; R395-T398 PolarHBondContact O-OG1 3.43Å; R395-D399 WeakPolarHBondContact O-CB 3.25Å; R395-D399 PolarHBondContact O-N 3.44Å |
| 396 | V | 77.7 | Confident | 76 | Confident | 85 Ų | 85 | 94.6 Ų | 94.6 | 52% | 0.515 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.2 | -39.2 | 175.8 | 168.4 | 0 | 0 | 0 | 0 | 110.4 | A392 V393 D399 L400 | A392-V396 WeakPolarHBondContact O-CG2 3.4Å; A392-V396 PolarHBondContact O-N 3.4Å; V393-V396 PolarHBondContact O-N 2.99Å; V396-D399 PolarHBondContact O-N 3.01Å; V396-L400 HydrophobicContact CG1-CD1 3.77Å; V396-L400 VanDerWaalsContact O-CB 3.28Å; V396-L400 WeakPolarHBondContact O-CB 3.44Å; V396-L400 PolarHBondContact O-N 2.98Å |
| 397 | R | 76.6 | Confident | 75.4 | Confident | 161 Ų | 161 | 93 Ų | 93 | 61% | 0.608 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.1 | -43 | 175.1 | -173.8 | -173.2 | 179.3 | -173.9 | 0.1 | 112.2 | V393 E394 R395 N401 | V393-R397 VanDerWaalsContact O-CB 3.31Å; V393-R397 WeakPolarHBondContact O-CB 3.43Å; V393-R397 PolarHBondContact O-N 2.91Å; E394-R397 WeakPolarHBondContact O-CB 3.24Å; E394-R397 PolarHBondContact O-N 3.41Å; E394-R397 IonicContact OE1-NH1 2.95Å; E394-R397 PolarHBondContact OE1-NH1 3.47Å; E394-R397 IonicContact OE2-NH1 3.16Å; R395-R397 PolarHBondContact O-N 3.19Å; R397-N401 VanDerWaalsContact O-CB 3.26Å; R397-N401 WeakPolarHBondContact O-CB 3.35Å; R397-N401 PolarHBondContact O-N 3.26Å |
| 398 | T | 78.5 | Confident | 74.8 | Confident | 75 Ų | 75 | 94.2 Ų | 94.2 | 46% | 0.46 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.4 | -41.1 | 176.1 | 52.7 | 0 | 0 | 0 | 0 | 111.7 | E394 R395 N401 Q402 | E394-T398 WeakPolarHBondContact O-CG2 3.43Å; E394-T398 PolarHBondContact O-N 2.95Å; E394-T398 PolarHBondContact O-OG1 2.98Å; R395-T398 WeakPolarHBondContact CA-OG1 3.46Å; R395-T398 PolarHBondContact O-N 2.95Å; R395-T398 VanDerWaalsContact O-N 3.08Å; R395-T398 PolarHBondContact O-OG1 3.43Å; T398-N401 PolarHBondContact O-N 3.48Å; T398-Q402 WeakPolarHBondContact O-CB 3.04Å; T398-Q402 PolarHBondContact O-N 3.47Å |
| 399 | D | 78.3 | Confident | 74.1 | Confident | 87 Ų | 87 | 95 Ų | 95 | 47% | 0.465 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.9 | -46.8 | 179.2 | -63.6 | -12.8 | 0 | 0 | 0 | 110 | R395 V396 N401 Q402 E403 | R395-D399 WeakPolarHBondContact O-CB 3.25Å; R395-D399 PolarHBondContact O-N 3.44Å; V396-D399 PolarHBondContact O-N 3.01Å; D399-N401 VanDerWaalsContact C-N 3.32Å; D399-N401 PolarHBondContact O-N 3.41Å; D399-Q402 WeakPolarHBondContact O-CB 3.45Å; D399-Q402 PolarHBondContact O-N 3.43Å; D399-E403 WeakPolarHBondContact O-CG 3.43Å; D399-E403 PolarHBondContact O-N 3.31Å |
| 400 | L | 74.5 | Confident | 73.3 | Confident | 98 Ų | 98 | 95.9 Ų | 95.9 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.8 | -39.1 | 172.5 | -92.9 | 153.4 | 0 | 0 | 0 | 112.9 | V396 Q402 L404 | V396-L400 HydrophobicContact CG1-CD1 3.77Å; V396-L400 VanDerWaalsContact O-CB 3.28Å; V396-L400 WeakPolarHBondContact O-CB 3.44Å; V396-L400 PolarHBondContact O-N 2.98Å; L400-Q402 VanDerWaalsContact C-N 3.31Å; L400-L404 WeakPolarHBondContact O-CB 3.24Å; L400-L404 PolarHBondContact O-N 3.32Å |
| 401 | N | 74.5 | Confident | 72.1 | Confident | 104 Ų | 104 | 100.9 Ų | 100.9 | 56% | 0.556 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -71.8 | -31.4 | 179.5 | -155.7 | 56.3 | 0 | 0 | 0 | 111.5 | R397 T398 D399 E405 | R397-N401 VanDerWaalsContact O-CB 3.26Å; R397-N401 WeakPolarHBondContact O-CB 3.35Å; R397-N401 PolarHBondContact O-N 3.26Å; T398-N401 PolarHBondContact O-N 3.48Å; D399-N401 VanDerWaalsContact C-N 3.32Å; D399-N401 PolarHBondContact O-N 3.41Å; N401-E405 PolarHBondContact O-N 2.98Å; N401-E405 VanDerWaalsContact O-N 3.14Å |
| 402 | Q | 75.7 | Confident | 70.9 | Confident | 118 Ų | 118 | 106.1 Ų | 106.1 | 55% | 0.551 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -71.9 | -44.5 | 172.8 | -174.4 | 164.4 | -6.1 | 0 | 0 | 111.3 | T398 D399 L400 L404 E405 E406 | T398-Q402 WeakPolarHBondContact O-CB 3.04Å; T398-Q402 PolarHBondContact O-N 3.47Å; D399-Q402 WeakPolarHBondContact O-CB 3.45Å; D399-Q402 PolarHBondContact O-N 3.43Å; L400-Q402 VanDerWaalsContact C-N 3.31Å; Q402-L404 VanDerWaalsContact C-N 3.28Å; Q402-L404 PolarHBondContact O-N 2.85Å; Q402-E405 PolarHBondContact O-N 2.93Å; Q402-E406 WeakPolarHBondContact O-CG 3.22Å; Q402-E406 PolarHBondContact O-N 2.99Å |
| 403 | E | 75.9 | Confident | 69.8 | Low | 115 Ų | 115 | 107.8 Ų | 107.8 | 54% | 0.537 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.6 | -37.2 | 171.9 | -74.5 | -171.5 | 169.8 | 0 | 0 | 111.7 | D399 E406 I407 | D399-E403 WeakPolarHBondContact O-CG 3.43Å; D399-E403 PolarHBondContact O-N 3.31Å; E403-E406 PolarHBondContact O-N 2.91Å; E403-I407 WeakPolarHBondContact O-CB 3.29Å; E403-I407 VanDerWaalsContact O-CG1 3.28Å; E403-I407 WeakPolarHBondContact O-CG1 3.31Å; E403-I407 PolarHBondContact O-N 3.36Å |
| 404 | L | 71.4 | Confident | 68.4 | Low | 106 Ų | 106 | 110.7 Ų | 110.7 | 56% | 0.555 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63.6 | -41.2 | 173.7 | -104.8 | 163.5 | 0 | 0 | 0 | 112.7 | L400 Q402 K408 | L400-L404 WeakPolarHBondContact O-CB 3.24Å; L400-L404 PolarHBondContact O-N 3.32Å; Q402-L404 VanDerWaalsContact C-N 3.28Å; Q402-L404 PolarHBondContact O-N 2.85Å; L404-K408 VanDerWaalsContact O-CB 3.25Å; L404-K408 WeakPolarHBondContact O-CB 3.3Å; L404-K408 PolarHBondContact O-N 2.82Å |
| 405 | E | 68.8 | Low | 66.9 | Low | 96 Ų | 96 | 112.9 Ų | 112.9 | 45% | 0.449 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -71.8 | -32.7 | 174.5 | -74.7 | -67.5 | 141.3 | 0 | 0 | 111.7 | N401 Q402 K408 T409 | N401-E405 PolarHBondContact O-N 2.98Å; N401-E405 VanDerWaalsContact O-N 3.14Å; Q402-E405 PolarHBondContact O-N 2.93Å; E405-K408 PolarHBondContact O-N 2.81Å; E405-K408 WeakPolarHBondContact OE1-CD 3.17Å; E405-K408 IonicContact OE1-NZ 2.82Å; E405-K408 PolarHBondContact OE1-NZ 2.93Å; E405-K408 IonicContact OE2-NZ 3.32Å; E405-K408 PolarHBondContact OE2-NZ 3.38Å; E405-T409 WeakPolarHBondContact O-CG2 3.12Å; E405-T409 PolarHBondContact O-N 3Å; E405-T409 PolarHBondContact O-OG1 3.19Å; E405-T409 VanDerWaalsContact O-OG1 3.09Å |
| 406 | E | 67.4 | Low | 65.1 | Low | 100 Ų | 100 | 113.7 Ų | 113.7 | 47% | 0.467 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65.7 | -42.1 | 171.2 | -76 | -179.9 | -171.9 | 0 | 0 | 112 | Q402 E403 K408 T409 Q410 | Q402-E406 WeakPolarHBondContact O-CG 3.22Å; Q402-E406 PolarHBondContact O-N 2.99Å; E403-E406 PolarHBondContact O-N 2.91Å; E406-K408 VanDerWaalsContact C-N 3.34Å; E406-K408 PolarHBondContact O-N 3.13Å; E406-T409 WeakPolarHBondContact CA-OG1 3.31Å; E406-T409 PolarHBondContact O-N 3.31Å; E406-T409 PolarHBondContact O-OG1 3.07Å; E406-Q410 WeakPolarHBondContact O-CB 3.3Å; E406-Q410 VanDerWaalsContact O-CG 3.27Å; E406-Q410 WeakPolarHBondContact O-CG 3.19Å; E406-Q410 PolarHBondContact O-N 2.83Å |
| 407 | I | 68 | Low | 63.1 | Low | 88 Ų | 88 | 116.4 Ų | 116.4 | 45% | 0.451 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.4 | -39.3 | 173.3 | -70.5 | 166.6 | 0 | 0 | 0 | 110.9 | E403 Q410 M411 | E403-I407 WeakPolarHBondContact O-CB 3.29Å; E403-I407 VanDerWaalsContact O-CG1 3.28Å; E403-I407 WeakPolarHBondContact O-CG1 3.31Å; E403-I407 PolarHBondContact O-N 3.36Å; I407-Q410 CarbonylContact O-C 3.6Å; I407-Q410 PolarHBondContact O-N 2.82Å; I407-M411 VanDerWaalsContact O-CB 3.29Å; I407-M411 WeakPolarHBondContact O-CB 3.19Å; I407-M411 PolarHBondContact O-N 3.16Å |
| 408 | K | 66 | Low | 61 | Low | 111 Ų | 111 | 117.1 Ų | 117.1 | 48% | 0.483 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.3 | -42 | 176.9 | -172.2 | -174.4 | 179.6 | -167.1 | 0 | 111.8 | L404 E405 E406 M411 E412 | L404-K408 VanDerWaalsContact O-CB 3.25Å; L404-K408 WeakPolarHBondContact O-CB 3.3Å; L404-K408 PolarHBondContact O-N 2.82Å; E405-K408 PolarHBondContact O-N 2.81Å; E405-K408 WeakPolarHBondContact OE1-CD 3.17Å; E405-K408 IonicContact OE1-NZ 2.82Å; E405-K408 PolarHBondContact OE1-NZ 2.93Å; E405-K408 IonicContact OE2-NZ 3.32Å; E405-K408 PolarHBondContact OE2-NZ 3.38Å; E406-K408 VanDerWaalsContact C-N 3.34Å; E406-K408 PolarHBondContact O-N 3.13Å; K408-M411 PolarHBondContact O-N 2.88Å; K408-E412 WeakPolarHBondContact O-CB 3.13Å; K408-E412 PolarHBondContact O-N 3.42Å |
| 409 | T | 62.8 | Low | 59.7 | Low | 79 Ų | 79 | 118.3 Ų | 118.3 | 49% | 0.485 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -68.5 | -34.3 | 173.6 | 54 | 0 | 0 | 0 | 0 | 112.6 | E405 E406 E412 A413 | E405-T409 WeakPolarHBondContact O-CG2 3.12Å; E405-T409 PolarHBondContact O-N 3Å; E405-T409 PolarHBondContact O-OG1 3.19Å; E405-T409 VanDerWaalsContact O-OG1 3.09Å; E406-T409 WeakPolarHBondContact CA-OG1 3.31Å; E406-T409 PolarHBondContact O-N 3.31Å; E406-T409 PolarHBondContact O-OG1 3.07Å; T409-E412 PolarHBondContact O-N 3.39Å; T409-A413 PolarHBondContact O-N 3.46Å; T409-A413 VanDerWaalsContact O-N 3.13Å |
| 410 | Q | 60.3 | Low | 58 | Low | 127 Ų | 127 | 119.7 Ų | 119.7 | 59% | 0.593 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -68 | -33.7 | 171.3 | -72.8 | 177.9 | 13.7 | 0 | 0 | 112.5 | E406 I407 A413 L414 | E406-Q410 WeakPolarHBondContact O-CB 3.3Å; E406-Q410 VanDerWaalsContact O-CG 3.27Å; E406-Q410 WeakPolarHBondContact O-CG 3.19Å; E406-Q410 PolarHBondContact O-N 2.83Å; I407-Q410 CarbonylContact O-C 3.6Å; I407-Q410 PolarHBondContact O-N 2.82Å; Q410-A413 PolarHBondContact O-N 3.46Å; Q410-L414 PolarHBondContact O-N 2.8Å |
| 411 | M | 52.9 | Low | 56.1 | Low | 143 Ų | 143 | 119.3 Ų | 119.3 | 70% | 0.704 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -72.6 | -35.9 | 174.8 | -172.9 | 171.4 | 176.4 | 0 | 0 | 111.9 | I407 K408 A413 L414 | I407-M411 VanDerWaalsContact O-CB 3.29Å; I407-M411 WeakPolarHBondContact O-CB 3.19Å; I407-M411 PolarHBondContact O-N 3.16Å; K408-M411 PolarHBondContact O-N 2.88Å; M411-A413 VanDerWaalsContact C-N 3.26Å; M411-A413 PolarHBondContact O-N 2.81Å; M411-L414 PolarHBondContact O-N 3.47Å |
| 412 | E | 54 | Low | 54.3 | Low | 153 Ų | 153 | 124 Ų | 124 | 72% | 0.715 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -69.4 | -24.9 | 174.2 | -137.6 | 160.8 | -162.1 | 0 | 0 | 112.1 | K408 T409 | K408-E412 WeakPolarHBondContact O-CB 3.13Å; K408-E412 PolarHBondContact O-N 3.42Å; T409-E412 PolarHBondContact O-N 3.39Å |
| 413 | A | 52.2 | Low | 52.4 | Low | 82 Ų | 82 | 121.2 Ų | 121.2 | 68% | 0.678 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.4 | -12.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | T409 Q410 M411 | T409-A413 PolarHBondContact O-N 3.46Å; T409-A413 VanDerWaalsContact O-N 3.13Å; Q410-A413 PolarHBondContact O-N 3.46Å; M411-A413 VanDerWaalsContact C-N 3.26Å; M411-A413 PolarHBondContact O-N 2.81Å |
| 414 | L | 48.4 | Very low | 50.9 | Low | 147 Ų | 147 | 121.1 Ų | 121.1 | 77% | 0.77 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -2.3 | -178.1 | -90.6 | 160.7 | 0 | 0 | 0 | 114.4 | Q410 M411 | Q410-L414 PolarHBondContact O-N 2.8Å; M411-L414 PolarHBondContact O-N 3.47Å |
| 415 | D | 44.4 | Very low | 49.9 | Very low | 141 Ų | 141 | 120.9 Ų | 120.9 | 75% | 0.754 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -89.6 | 7.3 | -173.7 | -157.6 | 38.8 | 0 | 0 | 0 | 115.2 | ||
| 416 | Q | 38.4 | Very low | 48.9 | Very low | 172 Ų | 172 | 119.8 Ų | 119.8 | 80% | 0.804 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -134.8 | 110.3 | 170 | -69.6 | -155.6 | 40.9 | 0 | 0 | 113.9 | ||
| 417 | T | 35.7 | Very low | 48.4 | Very low | 141 Ų | 141 | 121.6 Ų | 121.6 | 87% | 0.865 | 69% | 0.689 | S | S | * | * | trans | 95.9 | 107.8 | 154.5 | -12.5 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 418 | Q | 33.5 | Very low | 47.8 | Very low | 176 Ų | 176 | 123.9 Ų | 123.9 | 82% | 0.822 | 70% | 0.698 | S | S | * | * | trans | -70 | 177.2 | 166.2 | -106.7 | -170.4 | -82.2 | 0 | 0 | 113.2 | ||||
| 419 | P | 51.2 | Low | 47.6 | Very low | 101 Ų | 101 | 124.9 Ų | 124.9 | 66% | 0.656 | 71% | 0.708 | S | S | * | * | cis | -126.9 | -162.3 | -48.8 | 38.4 | -19.1 | 0 | 0 | 0 | 109.3 | ||||
| 420 | P | 42.8 | Very low | 47.6 | Very low | 116 Ų | 116 | 126.3 Ų | 126.3 | 75% | 0.753 | 71% | 0.709 | S | S | * | * | cis | -130.4 | 171.9 | -5.6 | 33.5 | -12.4 | 0 | 0 | 0 | 115.7 | ||||
| 421 | A | 33.7 | Very low | 47.8 | Very low | 90 Ų | 90 | 126.2 Ų | 126.2 | 74% | 0.744 | 71% | 0.712 | S | S | * | * | trans | 79.8 | 136.1 | 148.2 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 422 | E | 36 | Very low | 48.4 | Very low | 202 Ų | 202 | 125.3 Ų | 125.3 | 94% | 0.944 | 71% | 0.706 | S | S | * | * | trans | 86.4 | 115.4 | 163.1 | -54.6 | -173.5 | 173.9 | 0 | 0 | 117.7 | ||||
| 423 | G | 35.8 | Very low | 48.9 | Very low | 60 Ų | 60 | 121.8 Ų | 121.8 | 62% | 0.619 | 70% | 0.698 | S | S | * | * | trans | 176.4 | 42.9 | 176 | 0 | 0 | 0 | 0 | 0 | 116.2 | T425 | G423-T425 VanDerWaalsContact C-N 3.26Å; G423-T425 PolarHBondContact O-N 2.81Å | ||
| 424 | S | 44.7 | Very low | 49.9 | Very low | 113 Ų | 113 | 123.4 Ų | 123.4 | 79% | 0.79 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.5 | 28.9 | 179.3 | -55.5 | 0 | 0 | 0 | 0 | 114.7 | ||
| 425 | T | 51.3 | Low | 51 | Low | 101 Ų | 101 | 122.5 Ų | 122.5 | 62% | 0.62 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.1 | -16.4 | -177 | 47.9 | 0 | 0 | 0 | 0 | 114.6 | G423 | G423-T425 VanDerWaalsContact C-N 3.26Å; G423-T425 PolarHBondContact O-N 2.81Å |
| 426 | S | 48.3 | Very low | 52.4 | Low | 73 Ų | 73 | 120.1 Ų | 120.1 | 51% | 0.51 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -78.8 | -43.4 | -177.6 | 167.4 | 0 | 0 | 0 | 0 | 112.9 | Q428 L429 E430 | S426-Q428 PolarHBondContact O-N 3.16Å; S426-Q428 VanDerWaalsContact O-N 3.17Å; S426-L429 PolarHBondContact O-N 3.03Å; S426-E430 PolarHBondContact O-N 3.01Å; S426-E430 VanDerWaalsContact O-N 3.15Å |
| 427 | L | 55.8 | Low | 53.8 | Low | 137 Ų | 137 | 114.1 Ų | 114.1 | 72% | 0.717 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -63.9 | -22.3 | 175.1 | -69.8 | 173.9 | 0 | 0 | 0 | 113.3 | L431 | L427-L431 WeakPolarHBondContact O-CB 3.5Å; L427-L431 PolarHBondContact O-N 2.95Å; L427-L431 VanDerWaalsContact O-N 3.16Å |
| 428 | Q | 56.7 | Low | 55.5 | Low | 137 Ų | 137 | 111.5 Ų | 111.5 | 64% | 0.64 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -80.9 | -31.8 | -179.3 | -148.7 | 171.2 | -1.1 | 0 | 0 | 111.9 | S426 E432 | S426-Q428 PolarHBondContact O-N 3.16Å; S426-Q428 VanDerWaalsContact O-N 3.17Å; Q428-E432 PolarHBondContact O-N 2.92Å |
| 429 | L | 60.8 | Low | 57.4 | Low | 132 Ų | 132 | 107.9 Ų | 107.9 | 69% | 0.691 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -75.5 | -38.5 | 172.8 | -83.7 | 164.4 | 0 | 0 | 0 | 112.1 | S426 L431 E432 S433 | S426-L429 PolarHBondContact O-N 3.03Å; L429-L431 VanDerWaalsContact C-N 3.34Å; L429-E432 PolarHBondContact O-N 3.34Å; L429-S433 WeakPolarHBondContact O-CB 3.05Å; L429-S433 PolarHBondContact O-N 3Å |
| 430 | E | 62.6 | Low | 58.6 | Low | 108 Ų | 108 | 108 Ų | 108 | 51% | 0.505 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -65.7 | -36.6 | 174.2 | -72.5 | -177.6 | 161.2 | 0 | 0 | 112.2 | S426 L434 | S426-E430 PolarHBondContact O-N 3.01Å; S426-E430 VanDerWaalsContact O-N 3.15Å; E430-L434 VanDerWaalsContact O-CB 3.32Å; E430-L434 WeakPolarHBondContact O-CB 3.17Å; E430-L434 PolarHBondContact O-N 3.32Å |
| 431 | L | 65.8 | Low | 60 | Low | 126 Ų | 126 | 107.3 Ų | 107.3 | 66% | 0.66 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -70.7 | -36.5 | 176 | -154.1 | 95.9 | 0 | 0 | 0 | 112.4 | L427 L429 K435 | L427-L431 WeakPolarHBondContact O-CB 3.5Å; L427-L431 PolarHBondContact O-N 2.95Å; L427-L431 VanDerWaalsContact O-N 3.16Å; L429-L431 VanDerWaalsContact C-N 3.34Å; L431-K435 WeakPolarHBondContact O-CB 3.48Å; L431-K435 PolarHBondContact O-N 3.39Å |
| 432 | E | 65.4 | Low | 61.9 | Low | 124 Ų | 124 | 108.3 Ų | 108.3 | 58% | 0.579 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -67.1 | -41.5 | 173.7 | -89.6 | -96.6 | 132.3 | 0 | 0 | 111.7 | Q428 L429 K435 T436 | Q428-E432 PolarHBondContact O-N 2.92Å; L429-E432 PolarHBondContact O-N 3.34Å; E432-K435 PolarHBondContact O-N 2.94Å; E432-T436 PolarHBondContact O-N 3.39Å; E432-T436 PolarHBondContact O-OG1 3.35Å |
| 433 | S | 64 | Low | 63.7 | Low | 78 Ų | 78 | 101.4 Ų | 101.4 | 55% | 0.545 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65 | -45.5 | 175.7 | 178.3 | 0 | 0 | 0 | 0 | 111.8 | L429 K435 T436 A437 | L429-S433 WeakPolarHBondContact O-CB 3.05Å; L429-S433 PolarHBondContact O-N 3Å; S433-K435 VanDerWaalsContact C-N 3.32Å; S433-K435 PolarHBondContact O-N 3.09Å; S433-T436 WeakPolarHBondContact CA-OG1 3.2Å; S433-T436 PolarHBondContact O-N 3.06Å; S433-T436 PolarHBondContact O-OG1 3.45Å; S433-A437 WeakPolarHBondContact O-CB 3.26Å; S433-A437 PolarHBondContact O-N 3.41Å |
| 434 | L | 71.9 | Confident | 65.6 | Low | 116 Ų | 116 | 103.6 Ų | 103.6 | 61% | 0.607 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.8 | -35.1 | 177 | -165.5 | 67.7 | 0 | 0 | 0 | 111.8 | E430 A437 V438 | E430-L434 VanDerWaalsContact O-CB 3.32Å; E430-L434 WeakPolarHBondContact O-CB 3.17Å; E430-L434 PolarHBondContact O-N 3.32Å; L434-A437 PolarHBondContact O-N 2.81Å; L434-V438 WeakPolarHBondContact O-CB 3.26Å; L434-V438 WeakPolarHBondContact O-CG2 3.27Å; L434-V438 PolarHBondContact O-N 3.46Å |
| 435 | K | 71.3 | Confident | 66.8 | Low | 128 Ų | 128 | 100.5 Ų | 100.5 | 56% | 0.557 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -67.4 | -38.6 | 175.7 | -174 | 179.1 | 178.7 | -172.5 | 0 | 112 | L431 E432 S433 V438 E439 | L431-K435 WeakPolarHBondContact O-CB 3.48Å; L431-K435 PolarHBondContact O-N 3.39Å; E432-K435 PolarHBondContact O-N 2.94Å; S433-K435 VanDerWaalsContact C-N 3.32Å; S433-K435 PolarHBondContact O-N 3.09Å; K435-V438 PolarHBondContact O-N 3.42Å; K435-E439 WeakPolarHBondContact O-CB 3.03Å; K435-E439 WeakPolarHBondContact O-CG 3.47Å; K435-E439 PolarHBondContact O-N 2.84Å |
| 436 | T | 74.2 | Confident | 67.9 | Low | 92 Ų | 92 | 100.3 Ų | 100.3 | 56% | 0.564 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -68.9 | -40.6 | 174.1 | 26.9 | 0 | 0 | 0 | 0 | 111.7 | E432 S433 V438 E439 E440 | E432-T436 PolarHBondContact O-N 3.39Å; E432-T436 PolarHBondContact O-OG1 3.35Å; S433-T436 WeakPolarHBondContact CA-OG1 3.2Å; S433-T436 PolarHBondContact O-N 3.06Å; S433-T436 PolarHBondContact O-OG1 3.45Å; T436-V438 PolarHBondContact O-N 3.42Å; T436-E439 PolarHBondContact O-N 2.84Å; T436-E440 WeakPolarHBondContact O-CB 3.35Å; T436-E440 PolarHBondContact O-N 2.81Å |
| 437 | A | 69.3 | Low | 69.4 | Low | 46 Ų | 46 | 100.6 Ų | 100.6 | 38% | 0.38 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | S433 L434 E440 V441 | S433-A437 WeakPolarHBondContact O-CB 3.26Å; S433-A437 PolarHBondContact O-N 3.41Å; L434-A437 PolarHBondContact O-N 2.81Å; A437-E440 PolarHBondContact O-N 2.84Å; A437-V441 VanDerWaalsContact O-CG2 3.3Å; A437-V441 WeakPolarHBondContact O-CG2 2.92Å; A437-V441 PolarHBondContact O-N 3.26Å |
| 438 | V | 70.2 | Confident | 70.3 | Confident | 86 Ų | 86 | 98.6 Ų | 98.6 | 52% | 0.521 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68.4 | -40.1 | 176.1 | 168.6 | 0 | 0 | 0 | 0 | 111.6 | L434 K435 T436 E440 V441 K442 | L434-V438 WeakPolarHBondContact O-CB 3.26Å; L434-V438 WeakPolarHBondContact O-CG2 3.27Å; L434-V438 PolarHBondContact O-N 3.46Å; K435-V438 PolarHBondContact O-N 3.42Å; T436-V438 PolarHBondContact O-N 3.42Å; V438-E440 VanDerWaalsContact C-N 3.33Å; V438-V441 PolarHBondContact O-N 2.79Å; V438-K442 VanDerWaalsContact O-CB 3.27Å; V438-K442 WeakPolarHBondContact O-CB 3.24Å; V438-K442 PolarHBondContact O-N 3.31Å |
| 439 | E | 74.7 | Confident | 71.1 | Confident | 99 Ų | 99 | 97.9 Ų | 97.9 | 46% | 0.463 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.4 | -34.6 | 173.3 | -75.9 | -63 | 154.2 | 0 | 0 | 112 | K435 T436 K442 S443 | K435-E439 WeakPolarHBondContact O-CB 3.03Å; K435-E439 WeakPolarHBondContact O-CG 3.47Å; K435-E439 PolarHBondContact O-N 2.84Å; T436-E439 PolarHBondContact O-N 2.84Å; E439-K442 PolarHBondContact O-N 2.81Å; E439-S443 PolarHBondContact O-N 2.81Å |
| 440 | E | 74.8 | Confident | 71.9 | Confident | 105 Ų | 105 | 95.1 Ų | 95.1 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.7 | -43.2 | 173.8 | -165.3 | -177 | 157.1 | 0 | 0 | 111.7 | T436 A437 V438 K442 S443 K444 | T436-E440 WeakPolarHBondContact O-CB 3.35Å; T436-E440 PolarHBondContact O-N 2.81Å; A437-E440 PolarHBondContact O-N 2.84Å; V438-E440 VanDerWaalsContact C-N 3.33Å; E440-K442 VanDerWaalsContact C-N 3.3Å; E440-K442 PolarHBondContact O-N 3.27Å; E440-S443 PolarHBondContact O-N 3.44Å; E440-S443 PolarHBondContact O-OG 3.06Å; E440-K444 WeakPolarHBondContact O-CG 2.97Å; E440-K444 PolarHBondContact O-N 2.84Å; E440-K444 WeakPolarHBondContact OE1-CE 3.42Å; E440-K444 IonicContact OE1-NZ 3.93Å; E440-K444 PolarHBondContact OE1-NZ 3.31Å |
| 441 | V | 72.3 | Confident | 72.6 | Confident | 101 Ų | 101 | 94.9 Ų | 94.9 | 61% | 0.612 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.3 | -39 | 173.7 | 169.6 | 0 | 0 | 0 | 0 | 111.1 | A437 V438 K444 A445 | A437-V441 VanDerWaalsContact O-CG2 3.3Å; A437-V441 WeakPolarHBondContact O-CG2 2.92Å; A437-V441 PolarHBondContact O-N 3.26Å; V438-V441 PolarHBondContact O-N 2.79Å; V441-K444 PolarHBondContact O-N 2.86Å; V441-A445 WeakPolarHBondContact O-CB 3.44Å; V441-A445 PolarHBondContact O-N 2.94Å |
| 442 | K | 75.1 | Confident | 72.8 | Confident | 110 Ų | 110 | 93 Ų | 93 | 48% | 0.478 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.3 | -44.6 | 175.8 | -171.1 | 177.3 | 177.8 | -175.2 | 0 | 111.7 | V438 E439 E440 K444 A445 D446 | V438-K442 VanDerWaalsContact O-CB 3.27Å; V438-K442 WeakPolarHBondContact O-CB 3.24Å; V438-K442 PolarHBondContact O-N 3.31Å; E439-K442 PolarHBondContact O-N 2.81Å; E440-K442 VanDerWaalsContact C-N 3.3Å; E440-K442 PolarHBondContact O-N 3.27Å; K442-K444 VanDerWaalsContact C-N 3.29Å; K442-K444 PolarHBondContact O-N 3.01Å; K442-A445 WeakPolarHBondContact O-CB 3.11Å; K442-A445 PolarHBondContact O-N 2.86Å; K442-A445 VanDerWaalsContact O-N 3.16Å; K442-D446 VanDerWaalsContact O-CG 3.32Å; K442-D446 PolarHBondContact O-N 2.69Å |
| 443 | S | 72.5 | Confident | 73.4 | Confident | 57 Ų | 57 | 92.7 Ų | 92.7 | 40% | 0.399 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -35.5 | 175.4 | 78.7 | 0 | 0 | 0 | 0 | 112.8 | E439 E440 T447 | E439-S443 PolarHBondContact O-N 2.81Å; E440-S443 PolarHBondContact O-N 3.44Å; E440-S443 PolarHBondContact O-OG 3.06Å; S443-T447 PolarHBondContact O-N 3.47Å; S443-T447 PolarHBondContact O-OG1 3.17Å |
| 444 | K | 76.1 | Confident | 74.1 | Confident | 106 Ų | 106 | 91.6 Ų | 91.6 | 46% | 0.461 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -71.7 | -36.8 | 174.7 | -73.1 | 176.2 | -175.8 | 165.2 | 0 | 111.7 | E440 V441 K442 T447 I448 | E440-K444 WeakPolarHBondContact O-CG 2.97Å; E440-K444 PolarHBondContact O-N 2.84Å; E440-K444 WeakPolarHBondContact OE1-CE 3.42Å; E440-K444 IonicContact OE1-NZ 3.93Å; E440-K444 PolarHBondContact OE1-NZ 3.31Å; V441-K444 PolarHBondContact O-N 2.86Å; K442-K444 VanDerWaalsContact C-N 3.29Å; K442-K444 PolarHBondContact O-N 3.01Å; K444-T447 PolarHBondContact O-N 3.05Å; K444-I448 VanDerWaalsContact O-CG1 3.32Å; K444-I448 WeakPolarHBondContact O-CG1 3.19Å; K444-I448 PolarHBondContact O-N 3.45Å |
| 445 | A | 70.6 | Confident | 74.4 | Confident | 48 Ų | 48 | 90.6 Ų | 90.6 | 40% | 0.397 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 173 | 0 | 0 | 0 | 0 | 0 | 111.5 | V441 K442 T447 I448 E449 | V441-A445 WeakPolarHBondContact O-CB 3.44Å; V441-A445 PolarHBondContact O-N 2.94Å; K442-A445 WeakPolarHBondContact O-CB 3.11Å; K442-A445 PolarHBondContact O-N 2.86Å; K442-A445 VanDerWaalsContact O-N 3.16Å; A445-T447 VanDerWaalsContact C-N 3.27Å; A445-T447 PolarHBondContact O-N 3.29Å; A445-I448 PolarHBondContact O-N 2.94Å; A445-E449 PolarHBondContact O-N 2.75Å |
| 446 | D | 74.6 | Confident | 74.9 | Confident | 97 Ų | 97 | 92.6 Ų | 92.6 | 52% | 0.519 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.7 | -36.5 | 175.3 | -66.8 | -27.1 | 0 | 0 | 0 | 111.5 | K442 E449 S450 | K442-D446 VanDerWaalsContact O-CG 3.32Å; K442-D446 PolarHBondContact O-N 2.69Å; D446-E449 PolarHBondContact O-N 2.75Å; D446-S450 PolarHBondContact O-N 2.86Å |
| 447 | T | 79.5 | Confident | 75.2 | Confident | 79 Ų | 79 | 92.3 Ų | 92.3 | 49% | 0.485 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.7 | -40.4 | 175.5 | -55.2 | 0 | 0 | 0 | 0 | 112 | S443 K444 A445 S450 Q451 | S443-T447 PolarHBondContact O-N 3.47Å; S443-T447 PolarHBondContact O-OG1 3.17Å; K444-T447 PolarHBondContact O-N 3.05Å; A445-T447 VanDerWaalsContact C-N 3.27Å; A445-T447 PolarHBondContact O-N 3.29Å; T447-S450 PolarHBondContact O-N 3.25Å; T447-Q451 WeakPolarHBondContact O-CG 3.22Å; T447-Q451 PolarHBondContact O-N 2.96Å |
| 448 | I | 73.4 | Confident | 75.5 | Confident | 96 Ų | 96 | 95.7 Ų | 95.7 | 49% | 0.492 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.4 | -38.6 | 175.9 | -69.7 | 166.8 | 0 | 0 | 0 | 111 | K444 A445 Q451 N452 | K444-I448 VanDerWaalsContact O-CG1 3.32Å; K444-I448 WeakPolarHBondContact O-CG1 3.19Å; K444-I448 PolarHBondContact O-N 3.45Å; A445-I448 PolarHBondContact O-N 2.94Å; I448-Q451 PolarHBondContact O-N 2.79Å; I448-N452 WeakPolarHBondContact O-CB 3.35Å; I448-N452 PolarHBondContact O-N 2.8Å; I448-N452 PolarHBondContact O-ND2 3.01Å |
| 449 | E | 74.8 | Confident | 75.7 | Confident | 122 Ų | 122 | 97.4 Ų | 97.4 | 57% | 0.57 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62 | -43.7 | 174.5 | -169.2 | 109.6 | -140.6 | 0 | 0 | 110.9 | A445 D446 N452 Q453 | A445-E449 PolarHBondContact O-N 2.75Å; D446-E449 PolarHBondContact O-N 2.75Å; E449-N452 PolarHBondContact O-N 3.31Å; E449-Q453 WeakPolarHBondContact O-CG 3.48Å; E449-Q453 PolarHBondContact O-N 3.46Å |
| 450 | S | 75.9 | Confident | 76.1 | Confident | 73 Ų | 73 | 98.8 Ų | 98.8 | 51% | 0.51 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.6 | -43.2 | 174.4 | -179.8 | 0 | 0 | 0 | 0 | 112.5 | D446 T447 Q453 A454 | D446-S450 PolarHBondContact O-N 2.86Å; T447-S450 PolarHBondContact O-N 3.25Å; S450-Q453 PolarHBondContact O-N 2.88Å; S450-A454 PolarHBondContact O-N 3.39Å |
| 451 | Q | 77.3 | Confident | 76.1 | Confident | 104 Ų | 104 | 95.9 Ų | 95.9 | 49% | 0.486 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.9 | -40.3 | 175.6 | -74.1 | 179.1 | -21.7 | 0 | 0 | 112.1 | T447 I448 Q453 A454 I455 | T447-Q451 WeakPolarHBondContact O-CG 3.22Å; T447-Q451 PolarHBondContact O-N 2.96Å; I448-Q451 PolarHBondContact O-N 2.79Å; Q451-Q453 VanDerWaalsContact C-N 3.33Å; Q451-Q453 PolarHBondContact O-N 3.33Å; Q451-A454 PolarHBondContact O-N 3.49Å; Q451-I455 WeakPolarHBondContact O-CG1 3.34Å; Q451-I455 PolarHBondContact O-N 2.78Å |
| 452 | N | 71.6 | Confident | 76.3 | Confident | 87 Ų | 87 | 96.6 Ų | 96.6 | 47% | 0.465 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.9 | -35.6 | 175.6 | -88.1 | -39.7 | 0 | 0 | 0 | 112.8 | I448 E449 I455 R456 | I448-N452 WeakPolarHBondContact O-CB 3.35Å; I448-N452 PolarHBondContact O-N 2.8Å; I448-N452 PolarHBondContact O-ND2 3.01Å; E449-N452 PolarHBondContact O-N 3.31Å; N452-I455 PolarHBondContact O-N 3.06Å; N452-R456 PolarHBondContact O-N 3.36Å; N452-R456 VanDerWaalsContact O-N 3.15Å |
| 453 | Q | 78.4 | Confident | 76.5 | Confident | 116 Ų | 116 | 97.4 Ų | 97.4 | 54% | 0.542 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.1 | -40.9 | 173 | -72.6 | 178.3 | 0.9 | 0 | 0 | 111.8 | E449 S450 Q451 I455 R456 T457 | E449-Q453 WeakPolarHBondContact O-CG 3.48Å; E449-Q453 PolarHBondContact O-N 3.46Å; S450-Q453 PolarHBondContact O-N 2.88Å; Q451-Q453 VanDerWaalsContact C-N 3.33Å; Q451-Q453 PolarHBondContact O-N 3.33Å; Q453-I455 VanDerWaalsContact C-N 3.32Å; Q453-I455 PolarHBondContact O-N 3.23Å; Q453-R456 PolarHBondContact O-N 3.06Å; Q453-T457 PolarHBondContact O-N 3.44Å; Q453-T457 VanDerWaalsContact O-N 3.11Å; Q453-T457 PolarHBondContact O-OG1 3.46Å |
| 454 | A | 76.8 | Confident | 76.8 | Confident | 56 Ų | 56 | 101.5 Ų | 101.5 | 46% | 0.463 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.2 | -33.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | S450 Q451 T457 L458 | S450-A454 PolarHBondContact O-N 3.39Å; Q451-A454 PolarHBondContact O-N 3.49Å; A454-T457 WeakPolarHBondContact CA-OG1 3.09Å; A454-T457 PolarHBondContact O-OG1 3.01Å; A454-L458 WeakPolarHBondContact O-CB 3.17Å; A454-L458 PolarHBondContact O-N 3.21Å; A454-L458 VanDerWaalsContact O-N 3.14Å |
| 455 | I | 78.3 | Confident | 76.7 | Confident | 95 Ų | 95 | 100.9 Ų | 100.9 | 49% | 0.487 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.8 | -41 | 174.5 | -69.1 | 166.6 | 0 | 0 | 0 | 110.8 | Q451 N452 Q453 L458 Q459 | Q451-I455 WeakPolarHBondContact O-CG1 3.34Å; Q451-I455 PolarHBondContact O-N 2.78Å; N452-I455 PolarHBondContact O-N 3.06Å; Q453-I455 VanDerWaalsContact C-N 3.32Å; Q453-I455 PolarHBondContact O-N 3.23Å; I455-L458 PolarHBondContact O-N 2.91Å; I455-Q459 PolarHBondContact O-N 3.47Å |
| 456 | R | 82.2 | Confident | 77 | Confident | 170 Ų | 170 | 103.1 Ų | 103.1 | 64% | 0.642 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.6 | -44.9 | 177.2 | -76.4 | -176.7 | -176.1 | 153.5 | 4.1 | 112.5 | N452 Q453 L458 Q459 E460 | N452-R456 PolarHBondContact O-N 3.36Å; N452-R456 VanDerWaalsContact O-N 3.15Å; Q453-R456 PolarHBondContact O-N 3.06Å; R456-L458 VanDerWaalsContact C-N 3.28Å; R456-L458 PolarHBondContact O-N 2.67Å; R456-Q459 WeakPolarHBondContact O-CB 2.95Å; R456-Q459 PolarHBondContact O-N 2.85Å; R456-Q459 VanDerWaalsContact O-N 3.17Å; R456-E460 PolarHBondContact O-N 3.01Å |
| 457 | T | 80.4 | Confident | 77.1 | Confident | 86 Ų | 86 | 104.8 Ų | 104.8 | 53% | 0.528 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65 | -34.3 | 178 | 54.6 | 0 | 0 | 0 | 0 | 112 | Q453 A454 A461 | Q453-T457 PolarHBondContact O-N 3.44Å; Q453-T457 VanDerWaalsContact O-N 3.11Å; Q453-T457 PolarHBondContact O-OG1 3.46Å; A454-T457 WeakPolarHBondContact CA-OG1 3.09Å; A454-T457 PolarHBondContact O-OG1 3.01Å; T457-A461 WeakPolarHBondContact O-CB 2.98Å; T457-A461 PolarHBondContact O-N 3.27Å; T457-A461 VanDerWaalsContact O-N 3.09Å |
| 458 | L | 76 | Confident | 76.8 | Confident | 116 Ų | 116 | 103.9 Ų | 103.9 | 61% | 0.607 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.4 | -38.2 | 173.6 | -168.6 | 68.5 | 0 | 0 | 0 | 112.3 | A454 I455 R456 M462 | A454-L458 WeakPolarHBondContact O-CB 3.17Å; A454-L458 PolarHBondContact O-N 3.21Å; A454-L458 VanDerWaalsContact O-N 3.14Å; I455-L458 PolarHBondContact O-N 2.91Å; R456-L458 VanDerWaalsContact C-N 3.28Å; R456-L458 PolarHBondContact O-N 2.67Å; L458-M462 PolarHBondContact O-N 2.71Å |
| 459 | Q | 75.1 | Confident | 76.6 | Confident | 123 Ų | 123 | 105.3 Ų | 105.3 | 58% | 0.575 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -64.5 | -43.4 | 174.9 | -102.8 | 178.9 | -37.5 | 0 | 0 | 112.4 | I455 R456 M462 Q463 | I455-Q459 PolarHBondContact O-N 3.47Å; R456-Q459 WeakPolarHBondContact O-CB 2.95Å; R456-Q459 PolarHBondContact O-N 2.85Å; R456-Q459 VanDerWaalsContact O-N 3.17Å; Q459-M462 PolarHBondContact O-N 2.8Å; Q459-Q463 PolarHBondContact O-N 2.79Å |
| 460 | E | 83.3 | Confident | 76.4 | Confident | 127 Ų | 127 | 102 Ų | 102 | 59% | 0.593 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61.9 | -44.9 | 176 | -74.7 | 175.5 | 172.5 | 0 | 0 | 111.5 | R456 M462 Q463 E464 | R456-E460 PolarHBondContact O-N 3.01Å; E460-M462 VanDerWaalsContact C-N 3.32Å; E460-M462 PolarHBondContact O-N 3.45Å; E460-Q463 PolarHBondContact O-N 3.45Å; E460-E464 PolarHBondContact O-N 2.86Å |
| 461 | A | 74.9 | Confident | 76.1 | Confident | 44 Ų | 44 | 100.5 Ų | 100.5 | 36% | 0.364 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.8 | -36.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | T457 Q463 T465 | T457-A461 WeakPolarHBondContact O-CB 2.98Å; T457-A461 PolarHBondContact O-N 3.27Å; T457-A461 VanDerWaalsContact O-N 3.09Å; A461-Q463 VanDerWaalsContact C-N 3.34Å; A461-T465 WeakPolarHBondContact O-CG2 3.45Å; A461-T465 PolarHBondContact O-N 3.5Å; A461-T465 VanDerWaalsContact O-N 3.1Å; A461-T465 PolarHBondContact O-OG1 2.83Å |
| 462 | M | 75.8 | Confident | 75.4 | Confident | 117 Ų | 117 | 101 Ų | 101 | 58% | 0.576 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.5 | -36.1 | 172.5 | -78.5 | -149.3 | -50.5 | 0 | 0 | 112.5 | L458 Q459 E460 T465 T466 | L458-M462 PolarHBondContact O-N 2.71Å; Q459-M462 PolarHBondContact O-N 2.8Å; E460-M462 VanDerWaalsContact C-N 3.32Å; E460-M462 PolarHBondContact O-N 3.45Å; M462-T465 WeakPolarHBondContact CA-OG1 3.42Å; M462-T465 PolarHBondContact O-OG1 3.36Å; M462-T466 WeakPolarHBondContact O-CB 3.38Å; M462-T466 PolarHBondContact O-N 2.85Å; M462-T466 VanDerWaalsContact O-N 3.07Å; M462-T466 PolarHBondContact O-OG1 3.44Å |
| 463 | Q | 78.6 | Confident | 75 | Confident | 127 Ų | 127 | 100.8 Ų | 100.8 | 59% | 0.593 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -72 | -40.2 | -179.3 | -158.3 | 168.4 | -3.2 | 0 | 0 | 111.5 | Q459 E460 A461 T466 Q467 | Q459-Q463 PolarHBondContact O-N 2.79Å; E460-Q463 PolarHBondContact O-N 3.45Å; A461-Q463 VanDerWaalsContact C-N 3.34Å; Q463-T466 PolarHBondContact O-N 3.3Å; Q463-Q467 PolarHBondContact O-N 3.37Å |
| 464 | E | 78.6 | Confident | 74.1 | Confident | 143 Ų | 143 | 101.6 Ų | 101.6 | 67% | 0.668 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -62.8 | -45.4 | 172.9 | -82.6 | -170.3 | 155.3 | 0 | 0 | 112.4 | E460 T466 Q467 A468 | E460-E464 PolarHBondContact O-N 2.86Å; E464-T466 VanDerWaalsContact C-N 3.28Å; E464-T466 PolarHBondContact O-N 3.17Å; E464-Q467 PolarHBondContact O-N 3.32Å; E464-A468 WeakPolarHBondContact O-CB 3.18Å; E464-A468 PolarHBondContact O-N 3.03Å |
| 465 | T | 75.6 | Confident | 73.4 | Confident | 92 Ų | 92 | 100.8 Ų | 100.8 | 56% | 0.564 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -64.1 | -35.2 | 178.3 | 48.2 | 0 | 0 | 0 | 0 | 112.1 | A461 M462 L469 | A461-T465 WeakPolarHBondContact O-CG2 3.45Å; A461-T465 PolarHBondContact O-N 3.5Å; A461-T465 VanDerWaalsContact O-N 3.1Å; A461-T465 PolarHBondContact O-OG1 2.83Å; M462-T465 WeakPolarHBondContact CA-OG1 3.42Å; M462-T465 PolarHBondContact O-OG1 3.36Å; T465-L469 WeakPolarHBondContact O-CB 3.17Å; T465-L469 PolarHBondContact O-N 3.38Å |
| 466 | T | 76.2 | Confident | 72.4 | Confident | 96 Ų | 96 | 103.8 Ų | 103.8 | 59% | 0.589 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.6 | -41.1 | 174.3 | -55.1 | 0 | 0 | 0 | 0 | 111.8 | M462 Q463 E464 L469 A470 | M462-T466 WeakPolarHBondContact O-CB 3.38Å; M462-T466 PolarHBondContact O-N 2.85Å; M462-T466 VanDerWaalsContact O-N 3.07Å; M462-T466 PolarHBondContact O-OG1 3.44Å; Q463-T466 PolarHBondContact O-N 3.3Å; E464-T466 VanDerWaalsContact C-N 3.28Å; E464-T466 PolarHBondContact O-N 3.17Å; T466-L469 PolarHBondContact O-N 3.1Å; T466-A470 PolarHBondContact O-N 2.78Å; T466-A470 VanDerWaalsContact O-N 3.13Å |
| 467 | Q | 76.1 | Confident | 71.3 | Confident | 132 Ų | 132 | 104.3 Ų | 104.3 | 62% | 0.617 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68.3 | -39.8 | 176.3 | -74.9 | -179 | -0.9 | 0 | 0 | 112.6 | Q463 E464 L469 A470 G471 | Q463-Q467 PolarHBondContact O-N 3.37Å; E464-Q467 PolarHBondContact O-N 3.32Å; Q467-L469 VanDerWaalsContact C-N 3.33Å; Q467-L469 PolarHBondContact O-N 3.36Å; Q467-A470 PolarHBondContact O-N 3.43Å; Q467-G471 PolarHBondContact O-N 3.43Å |
| 468 | A | 73.4 | Confident | 70.2 | Confident | 60 Ų | 60 | 105.4 Ų | 105.4 | 50% | 0.496 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.7 | -38.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | E464 G471 L472 | E464-A468 WeakPolarHBondContact O-CB 3.18Å; E464-A468 PolarHBondContact O-N 3.03Å; A468-G471 PolarHBondContact O-N 3.04Å; A468-L472 PolarHBondContact O-N 2.75Å; A468-L472 VanDerWaalsContact O-N 3.16Å |
| 469 | L | 68.8 | Low | 69.4 | Low | 125 Ų | 125 | 106.8 Ų | 106.8 | 65% | 0.654 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -67.2 | -39.3 | 176.7 | -148 | 78 | 0 | 0 | 0 | 111.8 | T465 T466 Q467 L472 T473 | T465-L469 WeakPolarHBondContact O-CB 3.17Å; T465-L469 PolarHBondContact O-N 3.38Å; T466-L469 PolarHBondContact O-N 3.1Å; Q467-L469 VanDerWaalsContact C-N 3.33Å; Q467-L469 PolarHBondContact O-N 3.36Å; L469-L472 PolarHBondContact O-N 2.73Å; L469-T473 WeakPolarHBondContact O-CG2 3.24Å; L469-T473 PolarHBondContact O-N 3.46Å |
| 470 | A | 71.6 | Confident | 68.6 | Low | 52 Ų | 52 | 103 Ų | 103 | 43% | 0.43 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.5 | -46.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | T466 Q467 L472 T473 E474 | T466-A470 PolarHBondContact O-N 2.78Å; T466-A470 VanDerWaalsContact O-N 3.13Å; Q467-A470 PolarHBondContact O-N 3.43Å; A470-L472 VanDerWaalsContact C-N 3.32Å; A470-L472 PolarHBondContact O-N 2.84Å; A470-T473 PolarHBondContact O-N 2.74Å; A470-T473 VanDerWaalsContact O-N 3.13Å; A470-T473 PolarHBondContact O-OG1 3.21Å; A470-E474 PolarHBondContact O-N 3.43Å |
| 471 | G | 69.3 | Low | 67.6 | Low | 42 Ų | 42 | 105.3 Ų | 105.3 | 43% | 0.433 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.1 | -35 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114 | Q467 A468 T473 E474 G475 | Q467-G471 PolarHBondContact O-N 3.43Å; A468-G471 PolarHBondContact O-N 3.04Å; G471-T473 VanDerWaalsContact C-N 3.32Å; G471-T473 PolarHBondContact O-N 3.36Å; G471-E474 PolarHBondContact O-N 2.73Å; G471-G475 PolarHBondContact O-N 2.73Å |
| 472 | L | 63.4 | Low | 67.2 | Low | 115 Ų | 115 | 106.5 Ų | 106.5 | 60% | 0.602 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67.4 | -30.7 | 175.7 | -113.7 | 144.1 | 0 | 0 | 0 | 113 | A468 L469 A470 | A468-L472 PolarHBondContact O-N 2.75Å; A468-L472 VanDerWaalsContact O-N 3.16Å; L469-L472 PolarHBondContact O-N 2.73Å; A470-L472 VanDerWaalsContact C-N 3.32Å; A470-L472 PolarHBondContact O-N 2.84Å |
| 473 | T | 61.6 | Low | 66.9 | Low | 82 Ų | 82 | 102.7 Ų | 102.7 | 50% | 0.503 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -79.2 | -26.7 | 177.3 | 60 | 0 | 0 | 0 | 0 | 113.9 | L469 A470 G471 | L469-T473 WeakPolarHBondContact O-CG2 3.24Å; L469-T473 PolarHBondContact O-N 3.46Å; A470-T473 PolarHBondContact O-N 2.74Å; A470-T473 VanDerWaalsContact O-N 3.13Å; A470-T473 PolarHBondContact O-OG1 3.21Å; G471-T473 VanDerWaalsContact C-N 3.32Å; G471-T473 PolarHBondContact O-N 3.36Å |
| 474 | E | 60.7 | Low | 66.4 | Low | 133 Ų | 133 | 102.4 Ų | 102.4 | 62% | 0.621 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -78.4 | -43.5 | 172.4 | -83.5 | 179.8 | 154.3 | 0 | 0 | 111.8 | A470 G471 K476 R477 D478 | A470-E474 PolarHBondContact O-N 3.43Å; G471-E474 PolarHBondContact O-N 2.73Å; E474-K476 VanDerWaalsContact C-N 3.31Å; E474-K476 PolarHBondContact O-N 2.75Å; E474-R477 PolarHBondContact O-N 2.9Å; E474-D478 PolarHBondContact O-N 2.85Å |
| 475 | G | 60.8 | Low | 66.2 | Low | 40 Ų | 40 | 100.6 Ų | 100.6 | 41% | 0.412 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -58.3 | -38.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114 | G471 R477 E479 | G471-G475 PolarHBondContact O-N 2.73Å; G475-R477 VanDerWaalsContact C-N 3.33Å; G475-R477 PolarHBondContact O-N 2.81Å; G475-E479 PolarHBondContact O-N 3.32Å |
| 476 | K | 59.2 | Low | 66.2 | Low | 158 Ų | 158 | 100.6 Ų | 100.6 | 69% | 0.687 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -70.8 | -22.4 | 176.3 | -85.1 | -173.5 | 174.1 | -179.4 | 0 | 114.3 | E474 G480 | E474-K476 VanDerWaalsContact C-N 3.31Å; E474-K476 PolarHBondContact O-N 2.75Å; K476-G480 PolarHBondContact O-N 3.07Å |
| 477 | R | 57.6 | Low | 66.1 | Low | 181 Ų | 181 | 101.5 Ų | 101.5 | 68% | 0.683 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -76.8 | -38.5 | 176.1 | -96 | -169.6 | -170.5 | 110 | 0.7 | 112 | E474 G475 G480 R481 | E474-R477 PolarHBondContact O-N 2.9Å; G475-R477 VanDerWaalsContact C-N 3.33Å; G475-R477 PolarHBondContact O-N 2.81Å; R477-G480 PolarHBondContact O-N 3.37Å; R477-R481 WeakPolarHBondContact O-CB 3.27Å; R477-R481 PolarHBondContact O-N 3.27Å; R477-R481 VanDerWaalsContact O-N 3.09Å |
| 478 | D | 58.2 | Low | 66.1 | Low | 109 Ų | 109 | 101.5 Ų | 101.5 | 58% | 0.583 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -76.4 | -33.4 | -177.3 | -73.7 | -17.8 | 0 | 0 | 0 | 112.6 | E474 R481 S482 | E474-D478 PolarHBondContact O-N 2.85Å; D478-R481 PolarHBondContact O-N 2.66Å; D478-S482 WeakPolarHBondContact O-CB 3.27Å; D478-S482 PolarHBondContact O-N 2.78Å; D478-S482 PolarHBondContact O-OG 3.24Å |
| 479 | E | 58.5 | Low | 66.2 | Low | 144 Ų | 144 | 105.3 Ų | 105.3 | 67% | 0.673 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.1 | -40.4 | 170.1 | -78.6 | -176.1 | 157.3 | 0 | 0 | 112.4 | G475 R481 S482 G483 | G475-E479 PolarHBondContact O-N 3.32Å; E479-R481 VanDerWaalsContact C-N 3.33Å; E479-R481 PolarHBondContact O-N 3.17Å; E479-S482 PolarHBondContact O-OG 2.76Å; E479-S482 VanDerWaalsContact O-OG 3.06Å; E479-G483 PolarHBondContact O-N 3.05Å; E479-G483 VanDerWaalsContact O-N 3.17Å |
| 480 | G | 59.3 | Low | 66.7 | Low | 44 Ų | 44 | 107.9 Ų | 107.9 | 45% | 0.454 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.2 | -33.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | K476 R477 L484 | K476-G480 PolarHBondContact O-N 3.07Å; R477-G480 PolarHBondContact O-N 3.37Å; G480-L484 PolarHBondContact O-N 2.68Å |
| 481 | R | 61.4 | Low | 66.8 | Low | 175 Ų | 175 | 111 Ų | 111 | 66% | 0.66 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -77.3 | -40.6 | -179.3 | -154.1 | 174.2 | -172 | 170 | 1.6 | 112.2 | R477 D478 E479 L484 E485 | R477-R481 WeakPolarHBondContact O-CB 3.27Å; R477-R481 PolarHBondContact O-N 3.27Å; R477-R481 VanDerWaalsContact O-N 3.09Å; D478-R481 PolarHBondContact O-N 2.66Å; E479-R481 VanDerWaalsContact C-N 3.33Å; E479-R481 PolarHBondContact O-N 3.17Å; R481-L484 PolarHBondContact O-N 3.4Å; R481-E485 PolarHBondContact O-N 3.48Å; R481-E485 VanDerWaalsContact O-N 3.15Å |
| 482 | S | 65.9 | Low | 67.2 | Low | 69 Ų | 69 | 112.7 Ų | 112.7 | 48% | 0.483 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.8 | -37.5 | 174.9 | 54.7 | 0 | 0 | 0 | 0 | 112.9 | D478 E479 L484 E485 D486 | D478-S482 WeakPolarHBondContact O-CB 3.27Å; D478-S482 PolarHBondContact O-N 2.78Å; D478-S482 PolarHBondContact O-OG 3.24Å; E479-S482 PolarHBondContact O-OG 2.76Å; E479-S482 VanDerWaalsContact O-OG 3.06Å; S482-L484 VanDerWaalsContact C-N 3.34Å; S482-L484 PolarHBondContact O-N 2.95Å; S482-E485 PolarHBondContact O-N 2.69Å; S482-D486 PolarHBondContact O-N 2.97Å |
| 483 | G | 70.2 | Confident | 67.7 | Low | 38 Ų | 38 | 110.1 Ų | 110.1 | 39% | 0.392 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.5 | -31.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | E479 L487 | E479-G483 PolarHBondContact O-N 3.05Å; E479-G483 VanDerWaalsContact O-N 3.17Å; G483-L487 PolarHBondContact O-N 2.67Å |
| 484 | L | 69.2 | Low | 68 | Low | 121 Ų | 121 | 112 Ų | 112 | 63% | 0.634 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -72.4 | -42.1 | 176 | -111.8 | 157.4 | 0 | 0 | 0 | 112.1 | G480 R481 S482 D486 L487 E488 | G480-L484 PolarHBondContact O-N 2.68Å; R481-L484 PolarHBondContact O-N 3.4Å; S482-L484 VanDerWaalsContact C-N 3.34Å; S482-L484 PolarHBondContact O-N 2.95Å; L484-D486 VanDerWaalsContact C-N 3.32Å; L484-D486 PolarHBondContact O-N 3.25Å; L484-L487 PolarHBondContact O-N 2.73Å; L484-E488 PolarHBondContact O-N 3.44Å |
| 485 | E | 74.2 | Confident | 68.5 | Low | 104 Ų | 104 | 112.2 Ų | 112.2 | 49% | 0.486 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -65.7 | -32.7 | 176.8 | -72.8 | 179.7 | -171.2 | 0 | 0 | 112.7 | R481 S482 K489 | R481-E485 PolarHBondContact O-N 3.48Å; R481-E485 VanDerWaalsContact O-N 3.15Å; S482-E485 PolarHBondContact O-N 2.69Å; E485-K489 WeakPolarHBondContact O-CG 3.4Å; E485-K489 PolarHBondContact O-N 3.3Å |
| 486 | D | 74.2 | Confident | 68.9 | Low | 93 Ų | 93 | 117.6 Ų | 117.6 | 50% | 0.497 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -72.3 | -36.8 | 175.6 | -163.3 | 54.8 | 0 | 0 | 0 | 112.1 | S482 L484 R490 | S482-D486 PolarHBondContact O-N 2.97Å; L484-D486 VanDerWaalsContact C-N 3.32Å; L484-D486 PolarHBondContact O-N 3.25Å; D486-R490 VanDerWaalsContact O-CG 3.31Å; D486-R490 WeakPolarHBondContact O-CG 3.42Å; D486-R490 PolarHBondContact O-N 2.71Å; D486-R490 VanDerWaalsContact O-N 3.14Å |
| 487 | L | 75.1 | Confident | 69 | Low | 115 Ų | 115 | 120.9 Ų | 120.9 | 60% | 0.602 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -65.8 | -40.3 | 174.1 | -108.2 | 153 | 0 | 0 | 0 | 112.3 | G483 L484 R490 L491 | G483-L487 PolarHBondContact O-N 2.67Å; L484-L487 PolarHBondContact O-N 2.73Å; L487-R490 PolarHBondContact O-N 3.23Å; L487-L491 PolarHBondContact O-N 2.94Å |
| 488 | E | 75.1 | Confident | 68.6 | Low | 132 Ų | 132 | 122.3 Ų | 122.3 | 62% | 0.617 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -64.2 | -44.6 | 177.3 | -167.5 | 172.3 | -176.6 | 0 | 0 | 111.5 | L484 R490 L491 T492 | L484-E488 PolarHBondContact O-N 3.44Å; E488-R490 VanDerWaalsContact C-N 3.3Å; E488-R490 PolarHBondContact O-N 3.07Å; E488-L491 PolarHBondContact O-N 3.36Å; E488-T492 PolarHBondContact O-N 2.86Å; E488-T492 VanDerWaalsContact O-N 3.08Å; E488-T492 PolarHBondContact O-OG1 3.45Å |
| 489 | K | 77 | Confident | 69.2 | Low | 139 Ų | 139 | 123 Ų | 123 | 60% | 0.604 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -60.6 | -36.7 | 174.5 | -75.2 | 174.9 | -174.9 | 168.4 | 0 | 113.2 | E485 T492 A493 | E485-K489 WeakPolarHBondContact O-CG 3.4Å; E485-K489 PolarHBondContact O-N 3.3Å; K489-T492 WeakPolarHBondContact CA-OG1 3.46Å; K489-T492 PolarHBondContact O-OG1 2.73Å; K489-A493 WeakPolarHBondContact O-CB 3.24Å; K489-A493 PolarHBondContact O-N 3.42Å |
| 490 | R | 78.1 | Confident | 69.7 | Low | 179 Ų | 179 | 121.8 Ų | 121.8 | 68% | 0.675 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -74.4 | -31.1 | 178.3 | -70.1 | -179.6 | 79.5 | -174.9 | 5.2 | 112.4 | D486 L487 E488 L494 | D486-R490 VanDerWaalsContact O-CG 3.31Å; D486-R490 WeakPolarHBondContact O-CG 3.42Å; D486-R490 PolarHBondContact O-N 2.71Å; D486-R490 VanDerWaalsContact O-N 3.14Å; L487-R490 PolarHBondContact O-N 3.23Å; E488-R490 VanDerWaalsContact C-N 3.3Å; E488-R490 PolarHBondContact O-N 3.07Å; R490-L494 PolarHBondContact O-N 3Å |
| 491 | L | 74.7 | Confident | 70.3 | Confident | 118 Ų | 118 | 126.2 Ų | 126.2 | 62% | 0.618 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.2 | -46.9 | 175.1 | -154 | 97.6 | 0 | 0 | 0 | 110.9 | L487 E488 A493 L494 E495 | L487-L491 PolarHBondContact O-N 2.94Å; E488-L491 PolarHBondContact O-N 3.36Å; L491-A493 VanDerWaalsContact C-N 3.3Å; L491-A493 PolarHBondContact O-N 3.44Å; L491-L494 WeakPolarHBondContact O-CB 3.38Å; L491-L494 PolarHBondContact O-N 3.16Å; L491-L494 VanDerWaalsContact O-N 3.08Å; L491-E495 PolarHBondContact O-N 2.72Å; L491-E495 VanDerWaalsContact O-N 3.16Å |
| 492 | T | 77.2 | Confident | 70.8 | Confident | 78 Ų | 78 | 123.3 Ų | 123.3 | 48% | 0.479 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -62.3 | -36.8 | 177.1 | 50.7 | 0 | 0 | 0 | 0 | 112.5 | E488 K489 L494 E495 D496 | E488-T492 PolarHBondContact O-N 2.86Å; E488-T492 VanDerWaalsContact O-N 3.08Å; E488-T492 PolarHBondContact O-OG1 3.45Å; K489-T492 WeakPolarHBondContact CA-OG1 3.46Å; K489-T492 PolarHBondContact O-OG1 2.73Å; T492-L494 VanDerWaalsContact C-N 3.26Å; T492-L494 PolarHBondContact O-N 3.45Å; T492-E495 PolarHBondContact O-N 3.19Å; T492-D496 PolarHBondContact O-N 2.87Å |
| 493 | A | 72.8 | Confident | 71.1 | Confident | 61 Ų | 61 | 126.7 Ų | 126.7 | 50% | 0.504 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -70.2 | -20.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | K489 L491 | K489-A493 WeakPolarHBondContact O-CB 3.24Å; K489-A493 PolarHBondContact O-N 3.42Å; L491-A493 VanDerWaalsContact C-N 3.3Å; L491-A493 PolarHBondContact O-N 3.44Å |
| 494 | L | 68.8 | Low | 71.2 | Confident | 121 Ų | 121 | 132.6 Ų | 132.6 | 63% | 0.634 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -83.5 | -33.1 | 175.9 | -151.7 | 101.4 | 0 | 0 | 0 | 111.4 | R490 L491 T492 R497 | R490-L494 PolarHBondContact O-N 3Å; L491-L494 WeakPolarHBondContact O-CB 3.38Å; L491-L494 PolarHBondContact O-N 3.16Å; L491-L494 VanDerWaalsContact O-N 3.08Å; T492-L494 VanDerWaalsContact C-N 3.26Å; T492-L494 PolarHBondContact O-N 3.45Å; L494-R497 PolarHBondContact O-N 2.86Å |
| 495 | E | 71.5 | Confident | 71.3 | Confident | 137 Ų | 137 | 133.4 Ų | 133.4 | 64% | 0.64 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -71.2 | -34.3 | 178.3 | -162.4 | 159.3 | -169.6 | 0 | 0 | 112.1 | L491 T492 R497 | L491-E495 PolarHBondContact O-N 2.72Å; L491-E495 VanDerWaalsContact O-N 3.16Å; T492-E495 PolarHBondContact O-N 3.19Å; E495-R497 PolarHBondContact O-N 2.95Å |
| 496 | D | 68.9 | Low | 71.1 | Confident | 153 Ų | 153 | 135.7 Ų | 135.7 | 82% | 0.818 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | -8.5 | 172 | -88.8 | -10.9 | 0 | 0 | 0 | 114.2 | T492 | T492-D496 PolarHBondContact O-N 2.87Š|
| 497 | R | 60.5 | Low | 70.9 | Confident | 227 Ų | 227 | 139.3 Ų | 139.3 | 86% | 0.857 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.7 | -2.8 | -174.2 | -153.6 | 177.2 | 169.1 | -173.8 | -3.7 | 113.7 | L494 E495 | L494-R497 PolarHBondContact O-N 2.86Å; E495-R497 PolarHBondContact O-N 2.95Å |
| 498 | M | 50.6 | Low | 70.5 | Confident | 211 Ų | 211 | 141.5 Ų | 141.5 | 100% | 1.039 | 68% | 0.68 | S | S | * | * | trans | -100.5 | 0 | 165.5 | -74.5 | -164.8 | -66.5 | 0 | 0 | 109.6 |
Retrieved 498 of 498 residues in 119.4 ms
(Link to these results)