| 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 | 35.5 | Very low | 34.8 | Very low | 236 Ų | 236 | 139.4 Ų | 139.4 | 100% | 1.163 | 85% | 0.847 | S | S | * | * | 0 | 108.6 | 0 | -59.4 | -166.6 | -91.3 | 0 | 0 | 106.4 | |||||
| 2 | A | 29.5 | Very low | 34.2 | Very low | 96 Ų | 96 | 137.6 Ų | 137.6 | 79% | 0.793 | 84% | 0.843 | S | S | * | * | cis | 59.7 | 127.2 | 22.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 3 | A | 36.8 | Very low | 34 | Very low | 92 Ų | 92 | 140.1 Ų | 140.1 | 76% | 0.76 | 85% | 0.847 | S | S | * | * | cis | -157.4 | -157.3 | -5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 4 | L | 40.7 | Very low | 33.7 | Very low | 170 Ų | 170 | 135.4 Ų | 135.4 | 89% | 0.89 | 83% | 0.83 | S | S | * | * | trans | 88 | 111.7 | -174.6 | -55 | 165.1 | 0 | 0 | 0 | 113.1 | ||||
| 5 | R | 39.9 | Very low | 33.5 | Very low | 248 Ų | 248 | 142.6 Ų | 142.6 | 94% | 0.936 | 84% | 0.836 | S | S | * | * | cis | 75.8 | 86.1 | 26.5 | -75.4 | -169 | 166.6 | -169.1 | -2.1 | 117.4 | ||||
| 6 | S | 31.3 | Very low | 33.3 | Very low | 129 Ų | 129 | 141.2 Ų | 141.2 | 90% | 0.902 | 83% | 0.834 | S | S | * | * | -170.5 | 156.5 | 128.4 | 57 | 0 | 0 | 0 | 0 | 110 | |||||
| 7 | G | 30.6 | Very low | 32.9 | Very low | 73 Ų | 73 | 145.6 Ų | 145.6 | 75% | 0.753 | 84% | 0.841 | S | S | * | * | cis | 160.9 | 9.7 | -11 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 8 | V | 33.3 | Very low | 33 | Very low | 142 Ų | 142 | 147.3 Ų | 147.3 | 86% | 0.861 | 85% | 0.846 | S | S | * | * | trans | -139.9 | 145.7 | -174.9 | -171.1 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 9 | T | 32.5 | Very low | 32.9 | Very low | 126 Ų | 126 | 150.8 Ų | 150.8 | 77% | 0.773 | 84% | 0.844 | S | S | * | * | trans | -139 | 175.2 | 172.9 | 58.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 10 | P | 45.8 | Very low | 32.8 | Very low | 112 Ų | 112 | 150.7 Ų | 150.7 | 73% | 0.727 | 84% | 0.836 | S | S | * | * | cis | -125 | -156 | -17.8 | 32.4 | -11 | 0 | 0 | 0 | 111.5 | ||||
| 11 | S | 26.6 | Very low | 32.8 | Very low | 109 Ų | 109 | 149.2 Ų | 149.2 | 76% | 0.762 | 83% | 0.831 | S | S | * | * | trans | 102.1 | 134.4 | 150.2 | -56.2 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 12 | C | 27.5 | Very low | 32.4 | Very low | 118 Ų | 118 | 141.7 Ų | 141.7 | 80% | 0.797 | 81% | 0.814 | S | S | * | * | trans | 51.9 | 119.1 | 157.3 | -153.5 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 13 | L | 32.7 | Very low | 32.6 | Very low | 170 Ų | 170 | 147.1 Ų | 147.1 | 89% | 0.89 | 82% | 0.82 | S | S | * | * | -161.1 | 114.4 | 117.9 | -109.3 | 171.1 | 0 | 0 | 0 | 110.9 | |||||
| 14 | A | 29.8 | Very low | 33 | Very low | 74 Ų | 74 | 148.8 Ų | 148.8 | 61% | 0.612 | 82% | 0.823 | S | S | * | * | trans | -90.1 | 156.3 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 15 | R | 30.1 | Very low | 32.6 | Very low | 244 Ų | 244 | 146 Ų | 146 | 92% | 0.921 | 82% | 0.817 | S | S | * | * | trans | 23.4 | 104.8 | 154.8 | -60.7 | 177.2 | -178.6 | 171.5 | 0.3 | 117.4 | ||||
| 16 | C | 29.6 | Very low | 32.3 | Very low | 120 Ų | 120 | 146 Ų | 146 | 81% | 0.811 | 82% | 0.817 | S | S | * | * | trans | -167.9 | 106.5 | 137.2 | -121.4 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 17 | F | 27.5 | Very low | 32.2 | Very low | 216 Ų | 216 | 143 Ų | 143 | 95% | 0.947 | 81% | 0.807 | S | S | * | * | trans | -151.3 | 92.6 | 157.3 | -95.5 | -68.1 | 0 | 0 | 0 | 110.7 | ||||
| 18 | L | 34.2 | Very low | 32.3 | Very low | 176 Ų | 176 | 145.3 Ų | 145.3 | 92% | 0.921 | 81% | 0.811 | S | S | * | * | trans | -141.9 | 89.5 | 169.5 | -111.1 | 176.9 | 0 | 0 | 0 | 109.7 | ||||
| 19 | R | 30.9 | Very low | 33 | Very low | 215 Ų | 215 | 144.1 Ų | 144.1 | 81% | 0.811 | 81% | 0.807 | S | S | * | * | trans | -179.7 | 149.5 | 176.8 | -110.6 | -168.9 | 171.1 | -174.9 | -2.7 | 107.1 | ||||
| 20 | Q | 31.1 | Very low | 32.8 | Very low | 148 Ų | 148 | 144 Ų | 144 | 69% | 0.692 | 81% | 0.805 | S | S | * | * | cis | -146.4 | 165.4 | 7.3 | -63.1 | -158 | 109.9 | 0 | 0 | 109.1 | ||||
| 21 | T | 32.2 | Very low | 32.3 | Very low | 119 Ų | 119 | 146.3 Ų | 146.3 | 73% | 0.73 | 81% | 0.811 | S | S | * | * | cis | -169.9 | 154.1 | -28.8 | 35.9 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 22 | G | 28.8 | Very low | 33 | Very low | 78 Ų | 78 | 146.2 Ų | 146.2 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -132 | 142.6 | 166.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 23 | K | 33.2 | Very low | 33 | Very low | 210 Ų | 210 | 145.5 Ų | 145.5 | 91% | 0.913 | 80% | 0.804 | S | S | * | * | trans | -114.7 | 156.2 | -172.3 | -84.5 | -174.6 | 174.9 | -179.9 | 0 | 113.7 | ||||
| 24 | P | 44 | Very low | 33 | Very low | 128 Ų | 128 | 144.4 Ų | 144.4 | 83% | 0.831 | 80% | 0.798 | S | S | * | * | trans | -109.4 | 171.3 | -176.9 | 41.6 | -35.9 | 0 | 0 | 0 | 115.7 | ||||
| 25 | S | 32.4 | Very low | 32.9 | Very low | 110 Ų | 110 | 148.5 Ų | 148.5 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | -151.9 | 124.9 | 159 | -174.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 26 | R | 33.4 | Very low | 32.9 | Very low | 249 Ų | 249 | 144.2 Ų | 144.2 | 94% | 0.94 | 80% | 0.8 | S | S | * | * | 67 | 116.4 | 73.3 | -129.1 | -176 | -167.5 | -170.6 | 3.1 | 113.1 | |||||
| 27 | G | 29.8 | Very low | 32.9 | Very low | 66 Ų | 66 | 146.7 Ų | 146.7 | 68% | 0.68 | 80% | 0.799 | S | S | * | * | cis | 166.7 | 170.5 | -12.6 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 28 | S | 32.6 | Very low | 33 | Very low | 121 Ų | 121 | 144.4 Ų | 144.4 | 85% | 0.846 | 80% | 0.796 | S | S | * | * | trans | 83.5 | 160.5 | 157.4 | -49.7 | 0 | 0 | 0 | 0 | 120 | ||||
| 29 | P | 48.4 | Very low | 32.8 | Very low | 118 Ų | 118 | 144 Ų | 144 | 77% | 0.766 | 79% | 0.787 | S | S | * | * | -139 | -166.7 | -61.3 | 38.6 | -19.5 | 0 | 0 | 0 | 115.1 | |||||
| 30 | V | 28.9 | Very low | 32.6 | Very low | 122 Ų | 122 | 139.8 Ų | 139.8 | 74% | 0.739 | 78% | 0.78 | S | S | * | * | trans | 113.3 | 97.5 | 157.7 | -175 | 0 | 0 | 0 | 0 | 120 | ||||
| 31 | L | 34.2 | Very low | 32.4 | Very low | 161 Ų | 161 | 140.8 Ų | 140.8 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | 57.2 | 171.1 | 139.5 | -66.5 | 165 | 0 | 0 | 0 | 120.3 | ||||
| 32 | P | 42.5 | Very low | 32.1 | Very low | 107 Ų | 107 | 139.7 Ų | 139.7 | 70% | 0.695 | 78% | 0.782 | S | S | * | * | -138.7 | -177.2 | -82.9 | 41.1 | -21.5 | 0 | 0 | 0 | 117.9 | |||||
| 33 | S | 26.4 | Very low | 32 | Very low | 104 Ų | 104 | 140.9 Ų | 140.9 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | trans | 98.5 | 159 | 151.2 | 82.8 | 0 | 0 | 0 | 0 | 121 | ||||
| 34 | I | 32 | Very low | 31.9 | Very low | 146 Ų | 146 | 136.4 Ų | 136.4 | 75% | 0.749 | 77% | 0.773 | S | S | * | * | trans | 65.1 | 93.7 | 170.9 | -54.9 | 173.4 | 0 | 0 | 0 | 114.7 | ||||
| 35 | Q | 29 | Very low | 31.1 | Very low | 161 Ų | 161 | 138.3 Ų | 138.3 | 75% | 0.752 | 78% | 0.775 | S | S | * | * | 87.9 | 106.8 | 63.1 | 179.6 | -177.6 | -7.3 | 0 | 0 | 114 | |||||
| 36 | N | 29.8 | Very low | 30.9 | Very low | 154 Ų | 154 | 141 Ų | 141 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -177.4 | 131.4 | 130.7 | -96.4 | -28.2 | 0 | 0 | 0 | 113.1 | ||||
| 37 | Q | 29.2 | Very low | 30.6 | Very low | 172 Ų | 172 | 134.7 Ų | 134.7 | 80% | 0.804 | 76% | 0.764 | S | S | * | * | trans | -144.4 | 131.6 | 159.7 | -91.2 | -162.5 | -4.6 | 0 | 0 | 108.6 | ||||
| 38 | L | 29.8 | Very low | 30.6 | Very low | 167 Ų | 167 | 138.4 Ų | 138.4 | 87% | 0.874 | 77% | 0.768 | S | S | * | * | trans | -179.1 | 126.6 | 149.6 | -89.3 | 140.7 | 0 | 0 | 0 | 104.5 | ||||
| 39 | F | 29.2 | Very low | 30.3 | Very low | 167 Ų | 167 | 141.5 Ų | 141.5 | 73% | 0.732 | 77% | 0.767 | S | S | * | * | cis | 93.6 | 116.3 | 44.6 | -95.7 | -52.7 | 0 | 0 | 0 | 115.1 | ||||
| 40 | L | 27.9 | Very low | 29.2 | Very low | 128 Ų | 128 | 139.7 Ų | 139.7 | 67% | 0.67 | 77% | 0.77 | S | S | * | * | trans | 62 | 144.4 | 141.5 | -80.4 | 160.7 | 0 | 0 | 0 | 123.5 | ||||
| 41 | Q | 26.7 | Very low | 29.1 | Very low | 168 Ų | 168 | 139.2 Ų | 139.2 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | trans | 70.6 | 155.7 | 143.6 | -79.8 | 166.7 | -58.5 | 0 | 0 | 119.4 | ||||
| 42 | S | 25.4 | Very low | 28.8 | Very low | 96 Ų | 96 | 137.5 Ų | 137.5 | 67% | 0.671 | 77% | 0.772 | S | S | * | * | cis | -157.3 | 156.3 | -8.4 | 38.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 43 | S | 27 | Very low | 28.3 | Very low | 104 Ų | 104 | 137.6 Ų | 137.6 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | trans | 30.8 | 125.6 | 139.3 | -48.7 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 44 | S | 31.7 | Very low | 29.5 | Very low | 115 Ų | 115 | 137.6 Ų | 137.6 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | 39.3 | 137.5 | 119.3 | -45 | 0 | 0 | 0 | 0 | 122.8 | |||||
| 45 | L | 26.3 | Very low | 29.3 | Very low | 169 Ų | 169 | 139.9 Ų | 139.9 | 89% | 0.885 | 78% | 0.777 | S | S | * | * | trans | -155 | 160.1 | 143.2 | -114.8 | 174.9 | 0 | 0 | 0 | 113.4 | ||||
| 46 | H | 27.8 | Very low | 29.3 | Very low | 167 Ų | 167 | 137.9 Ų | 137.9 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | trans | -85.3 | 175.4 | 168.3 | -70.8 | -123.8 | 0 | 0 | 0 | 109.2 | ||||
| 47 | T | 28.6 | Very low | 29.3 | Very low | 115 Ų | 115 | 141.3 Ų | 141.3 | 71% | 0.706 | 78% | 0.782 | S | S | * | * | -176.8 | 133.9 | 61.9 | 40.1 | 0 | 0 | 0 | 0 | 110 | |||||
| 48 | L | 28.5 | Very low | 29.3 | Very low | 144 Ų | 144 | 139.2 Ų | 139.2 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | 93.7 | 138.8 | 92.9 | -68.4 | 174.2 | 0 | 0 | 0 | 117.7 | |||||
| 49 | F | 27.9 | Very low | 29.3 | Very low | 187 Ų | 187 | 141.6 Ų | 141.6 | 82% | 0.82 | 78% | 0.779 | S | S | * | * | trans | 47 | 126.1 | 154.1 | -81.4 | -77.2 | 0 | 0 | 0 | 124.3 | ||||
| 50 | G | 24.3 | Very low | 29.3 | Very low | 80 Ų | 80 | 141 Ų | 141 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | trans | -150.2 | 137.3 | 143.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 51 | C | 27.9 | Very low | 29.3 | Very low | 111 Ų | 111 | 140.9 Ų | 140.9 | 75% | 0.75 | 79% | 0.792 | S | S | * | * | trans | -137.5 | 128.5 | -167.1 | -170.2 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 52 | S | 27.3 | Very low | 29.4 | Very low | 126 Ų | 126 | 143.1 Ų | 143.1 | 88% | 0.881 | 79% | 0.793 | S | S | * | * | trans | -148.5 | 147.1 | 171.7 | -63.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 53 | S | 30.7 | Very low | 29.6 | Very low | 109 Ų | 109 | 148.7 Ų | 148.7 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | -158.8 | -179.6 | -179.8 | 71.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 54 | P | 51.5 | Low | 29.6 | Very low | 104 Ų | 104 | 150 Ų | 150 | 68% | 0.675 | 79% | 0.794 | S | S | * | * | cis | -142.8 | -167.3 | 7.3 | 40.8 | -19.3 | 0 | 0 | 0 | 116.4 | ||||
| 55 | F | 28.7 | Very low | 29.5 | Very low | 193 Ų | 193 | 155.8 Ų | 155.8 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | trans | 66.2 | 114.9 | 149.5 | -105.8 | -90.2 | 0 | 0 | 0 | 121.7 | ||||
| 56 | S | 29.9 | Very low | 29.7 | Very low | 119 Ų | 119 | 151 Ų | 151 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | -177.9 | 163.1 | 107.7 | 45.3 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 57 | R | 29.3 | Very low | 29.9 | Very low | 226 Ų | 226 | 153 Ų | 153 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | trans | -103.2 | 146.9 | 178 | -64.4 | 173 | 171.2 | 179.9 | -3.8 | 110 | ||||
| 58 | T | 29.9 | Very low | 29.8 | Very low | 129 Ų | 129 | 156.9 Ų | 156.9 | 79% | 0.791 | 80% | 0.804 | S | S | * | * | 173.6 | 148.6 | 110 | 32.5 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 59 | R | 27.8 | Very low | 29.9 | Very low | 217 Ų | 217 | 155.8 Ų | 155.8 | 82% | 0.819 | 80% | 0.803 | S | S | * | * | trans | 56.8 | 118.5 | 142.1 | -71 | -177.2 | 173.5 | -173.2 | -0.9 | 123.8 | ||||
| 60 | I | 29.3 | Very low | 29.7 | Very low | 153 Ų | 153 | 158 Ų | 158 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | 58.5 | 115.6 | 121.3 | -54.6 | 165.5 | 0 | 0 | 0 | 119.4 | |||||
| 61 | S | 28.2 | Very low | 29.9 | Very low | 126 Ų | 126 | 160 Ų | 160 | 88% | 0.881 | 80% | 0.801 | S | S | * | * | trans | -152.4 | 174.9 | 135.6 | -164.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 62 | R | 29 | Very low | 29.8 | Very low | 216 Ų | 216 | 159.5 Ų | 159.5 | 82% | 0.815 | 80% | 0.799 | S | S | * | * | trans | -144.6 | 130.3 | -158.2 | -176.8 | -170.3 | -169.1 | -162.4 | 8.2 | 112.5 | ||||
| 63 | R | 29.2 | Very low | 29.9 | Very low | 213 Ų | 213 | 157.9 Ų | 157.9 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | 65.4 | 164.1 | -179.5 | -72 | 170.7 | 159.2 | -171 | -3.9 | 113.1 | ||||
| 64 | H | 27.6 | Very low | 29.7 | Very low | 131 Ų | 131 | 159.1 Ų | 159.1 | 61% | 0.606 | 80% | 0.796 | S | S | * | * | cis | -150.2 | 158.9 | 6.6 | -141.6 | -62.3 | 0 | 0 | 0 | 111.7 | ||||
| 65 | R | 30.8 | Very low | 28.6 | Very low | 236 Ų | 236 | 158.8 Ų | 158.8 | 89% | 0.891 | 80% | 0.802 | S | S | * | * | trans | 41.2 | 114.3 | 153.7 | -92.2 | 170.1 | -176.7 | -179.8 | 1.8 | 119 | ||||
| 66 | G | 30.1 | Very low | 28.4 | Very low | 70 Ų | 70 | 156 Ų | 156 | 72% | 0.722 | 80% | 0.801 | S | S | * | * | trans | -165.3 | 131.6 | 156.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 67 | K | 30.8 | Very low | 28.2 | Very low | 207 Ų | 207 | 162 Ų | 162 | 90% | 0.9 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -101.6 | 116.6 | 172.5 | -70.2 | 179.9 | -179.2 | 177 | 0 | 108.6 | ||
| 68 | F | 27.3 | Very low | 28.1 | Very low | 198 Ų | 198 | 160.4 Ų | 160.4 | 87% | 0.868 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 118.1 | 168.9 | -78.9 | -84.7 | 0 | 0 | 0 | 110.1 | ||
| 69 | V | 29.3 | Very low | 27.9 | Very low | 120 Ų | 120 | 161.8 Ų | 161.8 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -102.4 | 117.2 | 170 | -179.4 | 0 | 0 | 0 | 0 | 107 | V71 | V69-V71 HydrophobicContact CG1-CG2 4.07Š|
| 70 | W | 25.6 | Very low | 27.7 | Very low | 233 Ų | 233 | 157 Ų | 157 | 88% | 0.883 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 120.5 | 171.6 | -88.9 | 62.6 | 0 | 0 | 0 | 109.7 | ||
| 71 | V | 26.9 | Very low | 27.5 | Very low | 122 Ų | 122 | 154.6 Ų | 154.6 | 74% | 0.739 | 81% | 0.807 | S | S | * | * | trans | -121 | 102.2 | 169.7 | -178.7 | 0 | 0 | 0 | 0 | 107.7 | V69 A73 | V69-V71 HydrophobicContact CG1-CG2 4.07Å; V71-A73 PolarHBondContact O-N 2.99Å; V71-A73 VanDerWaalsContact O-N 3.13Å | ||
| 72 | S | 26.7 | Very low | 27.3 | Very low | 101 Ų | 101 | 156.5 Ų | 156.5 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | trans | -77.8 | 94.7 | 174.7 | -59.5 | 0 | 0 | 0 | 0 | 110 | V74 | S72-V74 PolarHBondContact O-N 2.87Š| ||
| 73 | A | 28.9 | Very low | 27.1 | Very low | 92 Ų | 92 | 153.1 Ų | 153.1 | 76% | 0.76 | 80% | 0.798 | S | S | * | * | trans | -75.3 | 119.4 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | V71 A75 | V71-A73 PolarHBondContact O-N 2.99Å; V71-A73 VanDerWaalsContact O-N 3.13Å; A73-A75 PolarHBondContact O-N 3.37Å | ||
| 74 | V | 26.9 | Very low | 26.8 | Very low | 135 Ų | 135 | 150.9 Ų | 150.9 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -84.3 | 109 | 174.4 | 177 | 0 | 0 | 0 | 0 | 108.9 | S72 | S72-V74 PolarHBondContact O-N 2.87Š| ||
| 75 | A | 28.2 | Very low | 26.9 | Very low | 97 Ų | 97 | 150.6 Ų | 150.6 | 80% | 0.802 | 81% | 0.807 | S | S | * | * | trans | -99.7 | 109.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | A73 | A73-A75 PolarHBondContact O-N 3.37Š| ||
| 76 | V | 25.6 | Very low | 26.6 | Very low | 134 Ų | 134 | 144.4 Ų | 144.4 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | -77.1 | 132.6 | 167.7 | 177 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 77 | R | 25.6 | Very low | 26.3 | Very low | 246 Ų | 246 | 148 Ų | 148 | 93% | 0.928 | 80% | 0.798 | S | S | * | * | trans | -121.9 | 124.6 | 175.1 | -140 | 179.2 | -166.9 | -154.3 | 1.5 | 110.3 | ||||
| 78 | Q | 27.1 | Very low | 26 | Very low | 193 Ų | 193 | 143.7 Ų | 143.7 | 90% | 0.902 | 79% | 0.788 | S | S | * | * | trans | -85.1 | 163.6 | 173.2 | -73 | 178 | -35.3 | 0 | 0 | 110.9 | ||||
| 79 | N | 24.8 | Very low | 25.8 | Very low | 158 Ų | 158 | 139 Ų | 139 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | trans | -100.9 | 143 | -175.9 | -173 | 20.1 | 0 | 0 | 0 | 111 | ||||
| 80 | S | 23.7 | Very low | 25.6 | Very low | 116 Ų | 116 | 139.1 Ų | 139.1 | 81% | 0.811 | 78% | 0.781 | S | S | * | * | trans | -159.3 | 149.8 | 164.5 | -123.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 81 | S | 25.3 | Very low | 25.5 | Very low | 103 Ų | 103 | 133.1 Ų | 133.1 | 72% | 0.72 | 78% | 0.775 | S | S | * | * | trans | -85.1 | 157.6 | -168.9 | 49.2 | 0 | 0 | 0 | 0 | 115 | ||||
| 82 | Q | 23.8 | Very low | 25.5 | Very low | 165 Ų | 165 | 132.1 Ų | 132.1 | 77% | 0.771 | 78% | 0.779 | S | S | * | * | 176.7 | 138.3 | 108.9 | -96.5 | -172.4 | -19.6 | 0 | 0 | 115.5 | |||||
| 83 | I | 25.3 | Very low | 25.4 | Very low | 145 Ų | 145 | 131.4 Ų | 131.4 | 74% | 0.744 | 78% | 0.779 | S | S | * | * | trans | 72 | 138.8 | 137.3 | -64.5 | 169.4 | 0 | 0 | 0 | 121 | ||||
| 84 | Q | 22 | Very low | 25.2 | Very low | 166 Ų | 166 | 132.9 Ų | 132.9 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | trans | -103.5 | 164 | 168.3 | -60.9 | 177.1 | -19.2 | 0 | 0 | 110.6 | ||||
| 85 | P | 31.1 | Very low | 25.2 | Very low | 126 Ų | 126 | 133.3 Ų | 133.3 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | -134 | -175.6 | 93.7 | 6.2 | 17.6 | 0 | 0 | 0 | 112.5 | |||||
| 86 | V | 24.6 | Very low | 25 | Very low | 106 Ų | 106 | 135.9 Ų | 135.9 | 64% | 0.642 | 77% | 0.771 | S | S | * | * | cis | 178.2 | 169.7 | -34.6 | 142.8 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 87 | D | 23 | Very low | 25.1 | Very low | 146 Ų | 146 | 134.5 Ų | 134.5 | 78% | 0.781 | 77% | 0.768 | S | S | * | * | trans | 73.1 | 146.6 | 167.9 | -73.4 | -20.1 | 0 | 0 | 0 | 120.2 | ||||
| 88 | V | 24.3 | Very low | 25.2 | Very low | 116 Ų | 116 | 128.2 Ų | 128.2 | 70% | 0.703 | 76% | 0.761 | S | S | * | * | cis | -162 | 142.7 | -26.8 | 95.3 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 89 | S | 24.1 | Very low | 25.3 | Very low | 99 Ų | 99 | 123.4 Ų | 123.4 | 69% | 0.692 | 76% | 0.755 | S | S | * | * | trans | 55.1 | 168.3 | 156.2 | -51.4 | 0 | 0 | 0 | 0 | 120 | ||||
| 90 | T | 23.3 | Very low | 26.5 | Very low | 123 Ų | 123 | 121.7 Ų | 121.7 | 76% | 0.755 | 75% | 0.752 | S | S | * | * | cis | -155.9 | 161.7 | -0.2 | -14.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 91 | S | 25.1 | Very low | 26.9 | Very low | 106 Ų | 106 | 120.3 Ų | 120.3 | 74% | 0.741 | 74% | 0.742 | S | S | * | * | trans | 68 | 124.2 | 156.7 | -58.3 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 92 | A | 25.1 | Very low | 27.2 | Very low | 101 Ų | 101 | 123.3 Ų | 123.3 | 84% | 0.835 | 75% | 0.75 | S | S | * | * | 72.9 | 140.9 | 67.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 93 | A | 25.3 | Very low | 27.7 | Very low | 86 Ų | 86 | 120.7 Ų | 120.7 | 71% | 0.711 | 75% | 0.749 | S | S | * | * | cis | -157.4 | 149.8 | 18.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 94 | V | 25.3 | Very low | 28.1 | Very low | 124 Ų | 124 | 118.8 Ų | 118.8 | 75% | 0.752 | 76% | 0.755 | S | S | * | * | 97.2 | 120.4 | 91.9 | 155.6 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 95 | L | 25.6 | Very low | 28.5 | Very low | 144 Ų | 144 | 118.1 Ų | 118.1 | 75% | 0.754 | 76% | 0.757 | S | S | * | * | trans | 71.3 | 153.6 | 153.1 | -62.6 | 174.7 | 0 | 0 | 0 | 121.3 | ||||
| 96 | Q | 25.5 | Very low | 29.4 | Very low | 150 Ų | 150 | 117.9 Ų | 117.9 | 70% | 0.701 | 76% | 0.755 | S | S | * | * | cis | -173.8 | 149.8 | -20.6 | -173.2 | 176.4 | 20.4 | 0 | 0 | 113.2 | ||||
| 97 | S | 26.3 | Very low | 29.8 | Very low | 106 Ų | 106 | 117 Ų | 117 | 74% | 0.741 | 76% | 0.76 | S | S | * | * | trans | 65.6 | 164.8 | 156.9 | 63.6 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 98 | S | 27.5 | Very low | 30.9 | Very low | 114 Ų | 114 | 116 Ų | 116 | 80% | 0.797 | 76% | 0.761 | S | S | * | * | cis | -156.1 | 168.8 | 0.3 | 5.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 99 | A | 29.7 | Very low | 31.1 | Very low | 92 Ų | 92 | 115 Ų | 115 | 76% | 0.76 | 77% | 0.765 | S | S | * | * | trans | -127.2 | -160.5 | 168 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 100 | P | 50.5 | Low | 31.2 | Very low | 122 Ų | 122 | 118.4 Ų | 118.4 | 79% | 0.792 | 78% | 0.775 | S | S | * | * | cis | -128.6 | -133.5 | 9.9 | 32.8 | -5 | 0 | 0 | 0 | 112.7 | ||||
| 101 | S | 31.1 | Very low | 31.3 | Very low | 86 Ų | 86 | 118.1 Ų | 118.1 | 60% | 0.601 | 77% | 0.773 | S | S | * | * | cis | -174.4 | 149.5 | 1.9 | 31.6 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 102 | L | 32.1 | Very low | 31.5 | Very low | 167 Ų | 167 | 122.2 Ų | 122.2 | 87% | 0.874 | 78% | 0.78 | S | S | * | * | trans | 65 | 172.1 | 149.7 | -66.7 | 170.4 | 0 | 0 | 0 | 118.4 | ||||
| 103 | S | 34 | Very low | 31.4 | Very low | 109 Ų | 109 | 123.7 Ų | 123.7 | 76% | 0.762 | 78% | 0.779 | S | S | * | * | cis | -171.7 | 167.8 | -8.5 | 33.9 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 104 | A | 33.6 | Very low | 31.4 | Very low | 106 Ų | 106 | 124.5 Ų | 124.5 | 88% | 0.876 | 79% | 0.786 | S | S | * | * | cis | -165.7 | -166.1 | -9.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 105 | D | 30.9 | Very low | 31.4 | Very low | 151 Ų | 151 | 124.2 Ų | 124.2 | 81% | 0.807 | 79% | 0.789 | S | S | * | * | trans | -111.3 | 173.4 | -176.9 | -147.2 | 6.6 | 0 | 0 | 0 | 111.6 | ||||
| 106 | P | 50.5 | Low | 31.3 | Very low | 121 Ų | 121 | 126.7 Ų | 126.7 | 79% | 0.786 | 80% | 0.797 | S | S | * | * | -157 | -163.4 | 56.9 | 43.7 | -19.1 | 0 | 0 | 0 | 118.5 | |||||
| 107 | A | 32.7 | Very low | 31.2 | Very low | 89 Ų | 89 | 127.2 Ų | 127.2 | 74% | 0.736 | 80% | 0.799 | S | S | * | * | trans | -113.5 | 177.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 108 | P | 46.3 | Very low | 31.5 | Very low | 124 Ų | 124 | 129.1 Ų | 129.1 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | -162.7 | 165.3 | 85.6 | 43.3 | -21.9 | 0 | 0 | 0 | 121.6 | |||||
| 109 | A | 27.9 | Very low | 31.7 | Very low | 95 Ų | 95 | 129.6 Ų | 129.6 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | 51 | 132.3 | 141.2 | 0 | 0 | 0 | 0 | 0 | 127 | ||||
| 110 | L | 27.9 | Very low | 31.6 | Very low | 171 Ų | 171 | 129.8 Ų | 129.8 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | -173.4 | -178.5 | 121.9 | -105.7 | 172.4 | 0 | 0 | 0 | 115.1 | |||||
| 111 | T | 25 | Very low | 30.6 | Very low | 117 Ų | 117 | 133.7 Ų | 133.7 | 72% | 0.718 | 81% | 0.809 | S | S | * | * | trans | -118.2 | 150.8 | -154.4 | -30.4 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 112 | Q | 28.9 | Very low | 30.3 | Very low | 191 Ų | 191 | 132.5 Ų | 132.5 | 89% | 0.893 | 81% | 0.811 | S | S | * | * | trans | -171 | 172 | 132.6 | -110.6 | -179.9 | 22.2 | 0 | 0 | 115.5 | ||||
| 113 | T | 22.7 | Very low | 30.1 | Very low | 133 Ų | 133 | 131.3 Ų | 131.3 | 82% | 0.816 | 81% | 0.81 | S | S | * | * | trans | -142.2 | 141.1 | -170.4 | 51.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 114 | A | 24.7 | Very low | 29.7 | Very low | 103 Ų | 103 | 131.6 Ų | 131.6 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | trans | -166.3 | 155.6 | 154.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 115 | S | 25.3 | Very low | 29.5 | Very low | 117 Ų | 117 | 130.6 Ų | 130.6 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -133.4 | 142.8 | 175.1 | -52.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 116 | Q | 24.3 | Very low | 29.4 | Very low | 197 Ų | 197 | 128 Ų | 128 | 92% | 0.921 | 80% | 0.804 | S | S | * | * | trans | -157.6 | 167.9 | 157.2 | -116.3 | 166.3 | 28.1 | 0 | 0 | 112.8 | ||||
| 117 | Q | 24.2 | Very low | 28.4 | Very low | 161 Ų | 161 | 127.2 Ų | 127.2 | 75% | 0.752 | 81% | 0.807 | S | S | * | * | trans | -133 | 156.2 | -148.3 | -79.3 | 167.6 | -104.9 | 0 | 0 | 113.7 | ||||
| 118 | I | 31.1 | Very low | 28.1 | Very low | 145 Ų | 145 | 128.9 Ų | 128.9 | 74% | 0.744 | 81% | 0.814 | S | S | * | * | trans | 71.4 | 156 | 149.7 | -69.6 | 159.6 | 0 | 0 | 0 | 115.4 | ||||
| 119 | P | 33 | Very low | 27.5 | Very low | 124 Ų | 124 | 130.1 Ų | 130.1 | 81% | 0.805 | 82% | 0.819 | S | S | * | * | cis | -116 | -169.9 | -6.8 | 25.6 | -3.6 | 0 | 0 | 0 | 113.8 | ||||
| 120 | A | 27.6 | Very low | 27.6 | Very low | 97 Ų | 97 | 130.3 Ų | 130.3 | 80% | 0.802 | 82% | 0.82 | S | S | * | * | trans | -132 | 141.7 | 165.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 121 | E | 28.2 | Very low | 27.7 | Very low | 203 Ų | 203 | 129.5 Ų | 129.5 | 95% | 0.949 | 82% | 0.817 | S | S | * | * | trans | -165.9 | 155.2 | 166.3 | -106.2 | 173.8 | -164.3 | 0 | 0 | 107 | ||||
| 122 | G | 26.4 | Very low | 27.9 | Very low | 62 Ų | 62 | 129.2 Ų | 129.2 | 64% | 0.639 | 82% | 0.819 | S | S | * | * | cis | 170.8 | 112.8 | -8.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 123 | V | 26.7 | Very low | 28.5 | Very low | 142 Ų | 142 | 126.2 Ų | 126.2 | 86% | 0.861 | 82% | 0.819 | S | S | * | * | trans | 70.2 | 108.5 | 149.3 | -175.8 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 124 | S | 26.3 | Very low | 29.1 | Very low | 115 Ų | 115 | 124.2 Ų | 124.2 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | trans | 68.6 | 159.5 | 134.6 | -157.4 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 125 | A | 28.7 | Very low | 29.9 | Very low | 84 Ų | 84 | 125 Ų | 125 | 69% | 0.694 | 82% | 0.815 | S | S | * | * | cis | -167.5 | 165.5 | -43.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 126 | A | 28.6 | Very low | 30.4 | Very low | 98 Ų | 98 | 126.7 Ų | 126.7 | 81% | 0.81 | 82% | 0.815 | S | S | * | * | trans | 42.7 | 100.6 | 150.5 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 127 | A | 30.9 | Very low | 31.3 | Very low | 104 Ų | 104 | 121.8 Ų | 121.8 | 86% | 0.86 | 80% | 0.8 | S | S | * | * | trans | 11 | 137 | 138.9 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 128 | S | 26.4 | Very low | 32.4 | Very low | 124 Ų | 124 | 117.9 Ų | 117.9 | 87% | 0.867 | 80% | 0.795 | S | S | * | * | trans | -134.9 | 162.2 | 147 | 66.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 129 | V | 33.8 | Very low | 33.3 | Very low | 150 Ų | 150 | 117.7 Ų | 117.7 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | trans | -114.8 | 127.5 | -170.7 | 175.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 130 | A | 28.2 | Very low | 33.8 | Very low | 98 Ų | 98 | 113.7 Ų | 113.7 | 81% | 0.81 | 77% | 0.773 | S | S | * | * | trans | -155.1 | 144.3 | 157.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 131 | D | 30.5 | Very low | 34.7 | Very low | 155 Ų | 155 | 114.8 Ų | 114.8 | 83% | 0.829 | 77% | 0.765 | S | S | * | * | trans | -67.4 | 140.7 | 176.7 | -176.6 | 14.8 | 0 | 0 | 0 | 112.5 | ||||
| 132 | S | 29.5 | Very low | 35.8 | Very low | 111 Ų | 111 | 109.2 Ų | 109.2 | 78% | 0.776 | 75% | 0.746 | S | S | * | * | trans | -170 | 117.3 | 163.1 | -83.1 | 0 | 0 | 0 | 0 | 111.6 | A134 | S132-A134 PolarHBondContact O-N 3.35Š| ||
| 133 | S | 42.5 | Very low | 36.9 | Very low | 127 Ų | 127 | 110.4 Ų | 110.4 | 89% | 0.888 | 74% | 0.741 | S | S | * | * | trans | -72.6 | 110.7 | 172.2 | 56.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 134 | A | 33.6 | Very low | 37.9 | Very low | 91 Ų | 91 | 109.4 Ų | 109.4 | 75% | 0.752 | 73% | 0.73 | S | S | * | * | trans | -130 | 134.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111 | S132 | S132-A134 PolarHBondContact O-N 3.35Š| ||
| 135 | S | 42.1 | Very low | 39.2 | Very low | 119 Ų | 119 | 106.8 Ų | 106.8 | 83% | 0.832 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 125.1 | 178.4 | 51.5 | 0 | 0 | 0 | 0 | 111.4 | ||
| 136 | L | 35.3 | Very low | 40.3 | Very low | 154 Ų | 154 | 108.1 Ų | 108.1 | 81% | 0.806 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 132.4 | 175.3 | -66.1 | 171.9 | 0 | 0 | 0 | 111.3 | ||
| 137 | P | 43.8 | Very low | 41.3 | Very low | 93 Ų | 93 | 109.5 Ų | 109.5 | 60% | 0.604 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 145.6 | 165.9 | 31.1 | -33.4 | 0 | 0 | 0 | 110.5 | D139 | P137-D139 VanDerWaalsContact C-N 3.29Å; P137-D139 PolarHBondContact O-N 2.83Å |
| 138 | A | 48.4 | Very low | 42.2 | Very low | 79 Ų | 79 | 107.6 Ų | 107.6 | 65% | 0.653 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -65.6 | -26.2 | -168.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | A140 | A138-A140 VanDerWaalsContact C-N 3.26Å; A138-A140 PolarHBondContact O-N 3.29Å |
| 139 | D | 49.8 | Very low | 43.5 | Very low | 142 Ų | 142 | 104.1 Ų | 104.1 | 76% | 0.759 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -75.8 | -4.9 | -173.3 | -58.7 | -53.9 | 0 | 0 | 0 | 114.8 | P137 P142 | P137-D139 VanDerWaalsContact C-N 3.29Å; P137-D139 PolarHBondContact O-N 2.83Å; D139-P142 WeakPolarHBondContact O-CD 3.34Å |
| 140 | A | 42.4 | Very low | 44.4 | Very low | 39 Ų | 39 | 101.6 Ų | 101.6 | 32% | 0.322 | 64% | 0.641 | S | S | . | * | G | 310 helix | trans | -78.2 | -19.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | A138 V143 L144 | A138-A140 VanDerWaalsContact C-N 3.26Å; A138-A140 PolarHBondContact O-N 3.29Å; A140-V143 PolarHBondContact O-N 2.88Å; A140-L144 PolarHBondContact O-N 3.45Å |
| 141 | L | 46.4 | Very low | 45.6 | Very low | 121 Ų | 121 | 99.4 Ų | 99.4 | 63% | 0.634 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -61.1 | -46.6 | -174.5 | -65 | 174.5 | 0 | 0 | 0 | 115.3 | V143 L144 A145 | L141-V143 VanDerWaalsContact C-N 3.32Å; L141-V143 PolarHBondContact O-N 3.47Å; L141-L144 PolarHBondContact O-N 3.44Å; L141-A145 WeakPolarHBondContact O-CB 3.28Å; L141-A145 PolarHBondContact O-N 3.31Å |
| 142 | P | 50.8 | Low | 46.7 | Very low | 85 Ų | 85 | 94.8 Ų | 94.8 | 55% | 0.552 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -66.2 | -32 | -179.5 | 25.1 | -34.8 | 0 | 0 | 0 | 113 | D139 A145 Q146 | D139-P142 WeakPolarHBondContact O-CD 3.34Å; P142-A145 PolarHBondContact O-N 3.28Å; P142-Q146 WeakPolarHBondContact O-CB 3.26Å; P142-Q146 PolarHBondContact O-N 3.11Å |
| 143 | V | 49.7 | Very low | 48 | Very low | 88 Ų | 88 | 92.8 Ų | 92.8 | 53% | 0.533 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -69 | -45.9 | 178.3 | -176.9 | 0 | 0 | 0 | 0 | 110.6 | A140 L141 A145 Q146 Q147 | A140-V143 PolarHBondContact O-N 2.88Å; L141-V143 VanDerWaalsContact C-N 3.32Å; L141-V143 PolarHBondContact O-N 3.47Å; V143-A145 VanDerWaalsContact C-N 3.3Å; V143-A145 PolarHBondContact O-N 3.28Å; V143-Q146 PolarHBondContact O-N 3.26Å; V143-Q147 PolarHBondContact O-N 3.48Å; V143-Q147 PolarHBondContact O-OE1 2.78Å |
| 144 | L | 48.6 | Very low | 48.8 | Very low | 120 Ų | 120 | 91.1 Ų | 91.1 | 63% | 0.628 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63 | -35.7 | 175 | -80.3 | 161.7 | 0 | 0 | 0 | 112.6 | A140 L141 A148 | A140-L144 PolarHBondContact O-N 3.45Å; L141-L144 PolarHBondContact O-N 3.44Å; L144-A148 WeakPolarHBondContact O-CB 3.2Å; L144-A148 PolarHBondContact O-N 3.16Å; L144-A148 VanDerWaalsContact O-N 3.07Å |
| 145 | A | 52.3 | Low | 49.7 | Very low | 60 Ų | 60 | 89.5 Ų | 89.5 | 50% | 0.496 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.1 | -41.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L141 P142 V143 A148 A149 | L141-A145 WeakPolarHBondContact O-CB 3.28Å; L141-A145 PolarHBondContact O-N 3.31Å; P142-A145 PolarHBondContact O-N 3.28Å; V143-A145 VanDerWaalsContact C-N 3.3Å; V143-A145 PolarHBondContact O-N 3.28Å; A145-A148 PolarHBondContact O-N 3.01Å; A145-A149 WeakPolarHBondContact O-CB 3.44Å; A145-A149 PolarHBondContact O-N 3Å |
| 146 | Q | 53 | Low | 50.3 | Low | 112 Ų | 112 | 86.3 Ų | 86.3 | 52% | 0.523 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.5 | -46 | 176.7 | -164.8 | 66.7 | 37.3 | 0 | 0 | 111.6 | P142 V143 A148 A149 D150 | P142-Q146 WeakPolarHBondContact O-CB 3.26Å; P142-Q146 PolarHBondContact O-N 3.11Å; V143-Q146 PolarHBondContact O-N 3.26Å; Q146-A148 VanDerWaalsContact C-N 3.25Å; Q146-A148 PolarHBondContact O-N 3.27Å; Q146-A149 WeakPolarHBondContact O-CB 3.49Å; Q146-A149 PolarHBondContact O-N 3.3Å; Q146-D150 PolarHBondContact O-N 3.2Å |
| 147 | Q | 50.2 | Low | 51.3 | Low | 128 Ų | 128 | 84.4 Ų | 84.4 | 60% | 0.598 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -57.3 | -37.9 | 174.2 | -120.4 | 82.2 | 4.5 | 0 | 0 | 112.4 | V143 A151 | V143-Q147 PolarHBondContact O-N 3.48Å; V143-Q147 PolarHBondContact O-OE1 2.78Å; Q147-A151 WeakPolarHBondContact O-CB 3.24Å; Q147-A151 PolarHBondContact O-N 3.3Å; Q147-A151 VanDerWaalsContact O-N 3.08Å |
| 148 | A | 48.4 | Very low | 51.9 | Low | 64 Ų | 64 | 84.1 Ų | 84.1 | 53% | 0.529 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -72.2 | -34.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L144 A145 Q146 A151 A152 | L144-A148 WeakPolarHBondContact O-CB 3.2Å; L144-A148 PolarHBondContact O-N 3.16Å; L144-A148 VanDerWaalsContact O-N 3.07Å; A145-A148 PolarHBondContact O-N 3.01Å; Q146-A148 VanDerWaalsContact C-N 3.25Å; Q146-A148 PolarHBondContact O-N 3.27Å; A148-A151 PolarHBondContact O-N 3.17Å; A148-A152 PolarHBondContact O-N 3.31Å |
| 149 | A | 55 | Low | 52.1 | Low | 51 Ų | 51 | 86.5 Ų | 86.5 | 42% | 0.421 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.7 | -37.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | A145 Q146 P153 | A145-A149 WeakPolarHBondContact O-CB 3.44Å; A145-A149 PolarHBondContact O-N 3Å; Q146-A149 WeakPolarHBondContact O-CB 3.49Å; Q146-A149 PolarHBondContact O-N 3.3Å; A149-P153 WeakPolarHBondContact O-CD 3.1Å |
| 150 | D | 52.8 | Low | 52.3 | Low | 96 Ų | 96 | 86.3 Ų | 86.3 | 51% | 0.513 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -78.2 | -26.1 | 175.3 | -69.2 | -38.2 | 0 | 0 | 0 | 112.8 | Q146 P153 | Q146-D150 PolarHBondContact O-N 3.2Å; D150-P153 WeakPolarHBondContact O-CD 3.37Å; D150-P153 WeakPolarHBondContact O-CG 3.25Å |
| 151 | A | 52 | Low | 52.8 | Low | 53 Ų | 53 | 87.3 Ų | 87.3 | 44% | 0.438 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -71.3 | -27.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q147 A148 V154 A155 | Q147-A151 WeakPolarHBondContact O-CB 3.24Å; Q147-A151 PolarHBondContact O-N 3.3Å; Q147-A151 VanDerWaalsContact O-N 3.08Å; A148-A151 PolarHBondContact O-N 3.17Å; A151-V154 PolarHBondContact O-N 2.85Å; A151-A155 WeakPolarHBondContact O-CB 3.35Å; A151-A155 PolarHBondContact O-N 2.95Å |
| 152 | A | 54.2 | Low | 53.1 | Low | 58 Ų | 58 | 85 Ų | 85 | 48% | 0.479 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63 | -50 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | A148 V154 A155 A156 | A148-A152 PolarHBondContact O-N 3.31Å; A152-V154 VanDerWaalsContact C-N 3.33Å; A152-V154 PolarHBondContact O-N 3.29Å; A152-A155 PolarHBondContact O-N 3.2Å; A152-A156 PolarHBondContact O-N 3.33Å |
| 153 | P | 56.8 | Low | 53.1 | Low | 68 Ų | 68 | 85.1 Ų | 85.1 | 44% | 0.442 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.2 | -34.4 | 175.3 | 26.5 | -34.6 | 0 | 0 | 0 | 111.8 | A149 D150 A155 A156 D157 | A149-P153 WeakPolarHBondContact O-CD 3.1Å; D150-P153 WeakPolarHBondContact O-CD 3.37Å; D150-P153 WeakPolarHBondContact O-CG 3.25Å; P153-A155 PolarHBondContact O-N 3.34Å; P153-A156 CarbonylContact O-C 3.59Å; P153-A156 WeakPolarHBondContact O-CB 3.25Å; P153-A156 PolarHBondContact O-N 3.26Å; P153-D157 WeakPolarHBondContact O-CB 3.44Å; P153-D157 PolarHBondContact O-N 3.41Å |
| 154 | V | 58.6 | Low | 53.5 | Low | 93 Ų | 93 | 84.6 Ų | 84.6 | 56% | 0.564 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.5 | -41.1 | 175 | 177.4 | 0 | 0 | 0 | 0 | 111.3 | A151 A152 A156 D157 V158 | A151-V154 PolarHBondContact O-N 2.85Å; A152-V154 VanDerWaalsContact C-N 3.33Å; A152-V154 PolarHBondContact O-N 3.29Å; V154-A156 VanDerWaalsContact C-N 3.33Å; V154-D157 PolarHBondContact O-N 3.36Å; V154-V158 WeakPolarHBondContact O-CB 3.37Å; V154-V158 VanDerWaalsContact O-CG2 3.26Å; V154-V158 WeakPolarHBondContact O-CG2 3.48Å; V154-V158 PolarHBondContact O-N 3.02Å |
| 155 | A | 52.8 | Low | 54.3 | Low | 56 Ų | 56 | 81.3 Ų | 81.3 | 46% | 0.463 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.3 | -36.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | A151 A152 P153 L159 | A151-A155 WeakPolarHBondContact O-CB 3.35Å; A151-A155 PolarHBondContact O-N 2.95Å; A152-A155 PolarHBondContact O-N 3.2Å; P153-A155 PolarHBondContact O-N 3.34Å; A155-L159 PolarHBondContact O-N 3.49Å |
| 156 | A | 55.4 | Low | 55.2 | Low | 53 Ų | 53 | 81.5 Ų | 81.5 | 44% | 0.438 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.9 | -46 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | A152 P153 V154 V158 L159 Q160 | A152-A156 PolarHBondContact O-N 3.33Å; P153-A156 CarbonylContact O-C 3.59Å; P153-A156 WeakPolarHBondContact O-CB 3.25Å; P153-A156 PolarHBondContact O-N 3.26Å; V154-A156 VanDerWaalsContact C-N 3.33Å; A156-V158 VanDerWaalsContact C-N 3.34Å; A156-V158 PolarHBondContact O-N 2.97Å; A156-L159 CarbonylContact O-C 3.6Å; A156-L159 WeakPolarHBondContact O-CB 3.44Å; A156-L159 PolarHBondContact O-N 3.26Å; A156-Q160 VanDerWaalsContact O-CB 3.32Å; A156-Q160 WeakPolarHBondContact O-CB 3.38Å; A156-Q160 PolarHBondContact O-N 3.21Å |
| 157 | D | 55.3 | Low | 56.6 | Low | 113 Ų | 113 | 84.1 Ų | 84.1 | 60% | 0.604 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.1 | -34.8 | 176.1 | -87.2 | -23.3 | 0 | 0 | 0 | 112 | P153 V154 Q160 A161 | P153-D157 WeakPolarHBondContact O-CB 3.44Å; P153-D157 PolarHBondContact O-N 3.41Å; V154-D157 PolarHBondContact O-N 3.36Å; D157-Q160 PolarHBondContact O-N 3.07Å; D157-A161 WeakPolarHBondContact O-CB 3.49Å; D157-A161 PolarHBondContact O-N 3.39Å |
| 158 | V | 56.8 | Low | 58.2 | Low | 88 Ų | 88 | 78.2 Ų | 78.2 | 53% | 0.533 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.8 | -42.3 | 172.2 | 168.1 | 0 | 0 | 0 | 0 | 111.2 | V154 A156 A161 V162 | V154-V158 WeakPolarHBondContact O-CB 3.37Å; V154-V158 VanDerWaalsContact O-CG2 3.26Å; V154-V158 WeakPolarHBondContact O-CG2 3.48Å; V154-V158 PolarHBondContact O-N 3.02Å; A156-V158 VanDerWaalsContact C-N 3.34Å; A156-V158 PolarHBondContact O-N 2.97Å; V158-A161 PolarHBondContact O-N 3.29Å; V158-V162 WeakPolarHBondContact O-CG2 3.3Å; V158-V162 PolarHBondContact O-N 3.07Å |
| 159 | L | 52.6 | Low | 59.9 | Low | 128 Ų | 128 | 78.3 Ų | 78.3 | 67% | 0.67 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.1 | -40.7 | 172.1 | -86.9 | 160.4 | 0 | 0 | 0 | 112.1 | A155 A156 V162 A163 | A155-L159 PolarHBondContact O-N 3.49Å; A156-L159 CarbonylContact O-C 3.6Å; A156-L159 WeakPolarHBondContact O-CB 3.44Å; A156-L159 PolarHBondContact O-N 3.26Å; L159-V162 PolarHBondContact O-N 3.5Å; L159-A163 WeakPolarHBondContact O-CB 3.45Å; L159-A163 PolarHBondContact O-N 3.32Å |
| 160 | Q | 53.8 | Low | 61.2 | Low | 139 Ų | 139 | 82.2 Ų | 82.2 | 65% | 0.65 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -68.8 | -36.3 | 178.9 | -163 | 108.6 | -27.2 | 0 | 0 | 111.6 | A156 D157 A163 A164 | A156-Q160 VanDerWaalsContact O-CB 3.32Å; A156-Q160 WeakPolarHBondContact O-CB 3.38Å; A156-Q160 PolarHBondContact O-N 3.21Å; D157-Q160 PolarHBondContact O-N 3.07Å; Q160-A163 CarbonylContact O-C 3.53Å; Q160-A163 PolarHBondContact O-N 2.97Å; Q160-A164 VanDerWaalsContact O-CB 3.24Å; Q160-A164 WeakPolarHBondContact O-CB 3.08Å; Q160-A164 PolarHBondContact O-N 2.89Å |
| 161 | A | 53.6 | Low | 62.5 | Low | 60 Ų | 60 | 80 Ų | 80 | 50% | 0.496 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69.6 | -41.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | D157 V158 A163 A164 E165 | D157-A161 WeakPolarHBondContact O-CB 3.49Å; D157-A161 PolarHBondContact O-N 3.39Å; V158-A161 PolarHBondContact O-N 3.29Å; A161-A163 VanDerWaalsContact C-N 3.29Å; A161-A163 PolarHBondContact O-N 3.42Å; A161-A164 CarbonylContact O-C 3.5Å; A161-A164 PolarHBondContact O-N 3.34Å; A161-A164 VanDerWaalsContact O-N 3.08Å; A161-E165 PolarHBondContact O-N 3.31Å |
| 162 | V | 51.9 | Low | 63.9 | Low | 72 Ų | 72 | 80.4 Ų | 80.4 | 44% | 0.436 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.9 | -35.7 | 171.4 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | V158 L159 A164 | V158-V162 WeakPolarHBondContact O-CG2 3.3Å; V158-V162 PolarHBondContact O-N 3.07Å; L159-V162 PolarHBondContact O-N 3.5Å; V162-A164 PolarHBondContact O-N 3.13Å |
| 163 | A | 51.6 | Low | 65.3 | Low | 88 Ų | 88 | 78.4 Ų | 78.4 | 73% | 0.727 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | -10.4 | 173 | 0 | 0 | 0 | 0 | 0 | 114.3 | L159 Q160 A161 | L159-A163 WeakPolarHBondContact O-CB 3.45Å; L159-A163 PolarHBondContact O-N 3.32Å; Q160-A163 CarbonylContact O-C 3.53Å; Q160-A163 PolarHBondContact O-N 2.97Å; A161-A163 VanDerWaalsContact C-N 3.29Å; A161-A163 PolarHBondContact O-N 3.42Å |
| 164 | A | 58.3 | Low | 66.6 | Low | 76 Ų | 76 | 75.9 Ų | 75.9 | 63% | 0.628 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111 | 16.1 | -179 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q160 A161 V162 | Q160-A164 VanDerWaalsContact O-CB 3.24Å; Q160-A164 WeakPolarHBondContact O-CB 3.08Å; Q160-A164 PolarHBondContact O-N 2.89Å; A161-A164 CarbonylContact O-C 3.5Å; A161-A164 PolarHBondContact O-N 3.34Å; A161-A164 VanDerWaalsContact O-N 3.08Å; V162-A164 PolarHBondContact O-N 3.13Å |
| 165 | E | 63.8 | Low | 68 | Low | 51 Ų | 51 | 74.1 Ų | 74.1 | 24% | 0.238 | 46% | 0.461 | C | S | . | . | P | Polyproline II helix | trans | -64.3 | 132.1 | 174.2 | -71.9 | -168.1 | -159.6 | 0 | 0 | 111.6 | A161 R167 H190 M191 S301 | A161-E165 PolarHBondContact O-N 3.31Å; E165-R167 PolarHBondContact O-N 3.29Å; E165-H190 IonicContact OE2-NE2 3.28Å; E165-M191 HydrophobicContact CB-CE 4.15Å; E165-M191 HydrophobicContact CG-CE 4.3Å; E165-S301 VanDerWaalsContact CD-CB 3.41Å; E165-S301 WeakPolarHBondContact OE1-CB 3.44Å; E165-S301 WeakPolarHBondContact OE2-CB 3.49Å; E165-S301 PolarHBondContact OE2-OG 3.06Å |
| 166 | P | 72.1 | Confident | 69.8 | Low | 64 Ų | 64 | 80.6 Ų | 80.6 | 42% | 0.416 | 48% | 0.481 | S | S | . | . | P | Polyproline II helix | trans | -66.7 | 131.1 | 177.3 | 28.1 | -34.1 | 0 | 0 | 0 | 109.8 | E170 L171 | P166-E170 WeakPolarHBondContact CA-OE2 3.31Å; P166-L171 HydrophobicContact CG-CD1 4.48Å |
| 167 | R | 82.6 | Confident | 71.6 | Confident | 168 Ų | 168 | 81.3 Ų | 81.3 | 63% | 0.634 | 48% | 0.48 | S | S | * | . | P | Polyproline II helix | trans | -65 | 151.2 | -175.5 | -76.4 | -171.3 | 173.5 | 125.8 | -1.1 | 111.2 | E165 A169 E170 L171 E187 | E165-R167 PolarHBondContact O-N 3.29Å; R167-A169 PolarHBondContact O-N 3.06Å; R167-A169 VanDerWaalsContact O-N 3.08Å; R167-E170 HydrophobicContact CB-CG 4.38Å; R167-E170 PolarHBondContact N-OE2 3.35Å; R167-E170 WeakPolarHBondContact O-CB 3.39Å; R167-E170 PolarHBondContact O-N 2.86Å; R167-L171 PolarHBondContact O-N 3.42Å; R167-E187 WeakPolarHBondContact CA-OE1 3.18Å; R167-E187 WeakPolarHBondContact CB-OE1 3.42Å |
| 168 | L | 84.2 | Confident | 73.5 | Confident | 4 Ų | 4 | 80 Ų | 80 | 2% | 0.021 | 48% | 0.478 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.4 | -30.3 | 177.9 | -62.7 | -166.6 | 0 | 0 | 0 | 111.7 | E170 L171 G172 L173 A174 Q183 E187 W197 M294 V299 | L168-E170 PolarHBondContact O-N 3.16Å; L168-L171 HydrophobicContact CD2-CD1 4.27Å; L168-L171 PolarHBondContact O-N 3.05Å; L168-G172 PolarHBondContact O-N 3.31Å; L168-L173 HydrophobicContact CB-CB 4.1Å; L168-L173 HydrophobicContact CD2-CD1 4.26Å; L168-L173 CarbonylContact O-C 3.59Å; L168-L173 VanDerWaalsContact O-CA 3.32Å; L168-L173 WeakPolarHBondContact O-CA 3.33Å; L168-L173 VanDerWaalsContact O-CB 3.22Å; L168-L173 WeakPolarHBondContact O-CB 3.35Å; L168-L173 PolarHBondContact O-N 3.5Å; L168-A174 HydrophobicContact CB-CB 4.12Å; L168-Q183 HydrophobicContact CD1-CB 3.93Å; L168-E187 HydrophobicContact CD1-CB 3.86Å; L168-E187 HydrophobicContact CD1-CG 4.4Å; L168-E187 HydrophobicContact CG-CB 4.16Å; L168-E187 HydrophobicContact CG-CG 4.14Å; L168-E187 PolarHBondContact N-OE1 2.95Å; L168-W197 HydrophobicContact CD1-CH2 4.18Å; L168-W197 HydrophobicContact CD2-CH2 4.39Å; L168-M294 HydrophobicContact CD1-CE 4.15Å; L168-M294 HydrophobicContact CD1-SD 4.42Å; L168-V299 HydrophobicContact CD2-CG1 4.05Å; L168-V299 HydrophobicContact CD2-CG2 3.64Å |
| 169 | A | 83.3 | Confident | 75.3 | Confident | 65 Ų | 65 | 76.9 Ų | 76.9 | 54% | 0.537 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -36.9 | 173 | 0 | 0 | 0 | 0 | 0 | 113.6 | R167 G172 A174 | R167-A169 PolarHBondContact O-N 3.06Å; R167-A169 VanDerWaalsContact O-N 3.08Å; A169-G172 PolarHBondContact O-N 2.76Å; A169-G172 VanDerWaalsContact O-N 3.14Å; A169-A174 HydrophobicContact CB-CB 4.4Å |
| 170 | E | 81.9 | Confident | 77.3 | Confident | 134 Ų | 134 | 70.8 Ų | 70.8 | 63% | 0.626 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.9 | -33.1 | 179.6 | -63 | 162.1 | 180 | 0 | 0 | 110.8 | P166 R167 L168 G172 | P166-E170 WeakPolarHBondContact CA-OE2 3.31Å; R167-E170 HydrophobicContact CB-CG 4.38Å; R167-E170 PolarHBondContact N-OE2 3.35Å; R167-E170 WeakPolarHBondContact O-CB 3.39Å; R167-E170 PolarHBondContact O-N 2.86Å; L168-E170 PolarHBondContact O-N 3.16Å; E170-G172 PolarHBondContact O-N 3.01Å |
| 171 | L | 80.9 | Confident | 79.3 | Confident | 49 Ų | 49 | 69.3 Ų | 69.3 | 26% | 0.257 | 42% | 0.423 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.2 | 3.4 | 169.4 | -72 | 153.4 | 0 | 0 | 0 | 113.7 | P166 R167 L168 L173 L297 V299 | P166-L171 HydrophobicContact CG-CD1 4.48Å; R167-L171 PolarHBondContact O-N 3.42Å; L168-L171 HydrophobicContact CD2-CD1 4.27Å; L168-L171 PolarHBondContact O-N 3.05Å; L171-L173 HydrophobicContact CB-CD1 4.4Å; L171-L173 HydrophobicContact CB-CG 4.3Å; L171-L173 PolarHBondContact O-N 3.11Å; L171-L297 HydrophobicContact CB-CD2 3.91Å; L171-L297 HydrophobicContact CD2-CD2 4.02Å; L171-L297 VanDerWaalsContact O-CD2 3.28Å; L171-L297 WeakPolarHBondContact O-CD2 3.24Å; L171-V299 HydrophobicContact CD1-CG2 4.29Å |
| 172 | G | 82 | Confident | 81.3 | Confident | 61 Ų | 61 | 67.5 Ų | 67.5 | 63% | 0.629 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.2 | 16.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | L168 A169 E170 | L168-G172 PolarHBondContact O-N 3.31Å; A169-G172 PolarHBondContact O-N 2.76Å; A169-G172 VanDerWaalsContact O-N 3.14Å; E170-G172 PolarHBondContact O-N 3.01Å |
| 173 | L | 82.3 | Confident | 83.4 | Confident | 16 Ų | 16 | 64.2 Ų | 64.2 | 8% | 0.084 | 39% | 0.385 | C | S | . | . | trans | -92.3 | -164 | 170.9 | -52.6 | 177.5 | 0 | 0 | 0 | 108.8 | L168 L171 A175 K293 M294 L297 V299 | L168-L173 HydrophobicContact CB-CB 4.1Å; L168-L173 HydrophobicContact CD2-CD1 4.26Å; L168-L173 CarbonylContact O-C 3.59Å; L168-L173 VanDerWaalsContact O-CA 3.32Å; L168-L173 WeakPolarHBondContact O-CA 3.33Å; L168-L173 VanDerWaalsContact O-CB 3.22Å; L168-L173 WeakPolarHBondContact O-CB 3.35Å; L168-L173 PolarHBondContact O-N 3.5Å; L171-L173 HydrophobicContact CB-CD1 4.4Å; L171-L173 HydrophobicContact CB-CG 4.3Å; L171-L173 PolarHBondContact O-N 3.11Å; L173-A175 PolarHBondContact O-N 3.43Å; L173-K293 HydrophobicContact CD2-CB 4.03Å; L173-K293 HydrophobicContact CD2-CD 4.32Å; L173-M294 HydrophobicContact CD1-CG 4.01Å; L173-L297 HydrophobicContact CD1-CD2 4.18Å; L173-L297 HydrophobicContact CD2-CD2 4.28Å; L173-L297 HydrophobicContact CG-CD2 4.16Å; L173-V299 HydrophobicContact CD1-CG2 4.08Å | ||
| 174 | A | 85.4 | Confident | 85.5 | Confident | 15 Ų | 15 | 62.1 Ų | 62.1 | 12% | 0.124 | 37% | 0.365 | C | S | . | . | trans | 59.5 | 10.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 118 | L168 A169 | L168-A174 HydrophobicContact CB-CB 4.12Å; A169-A174 HydrophobicContact CB-CB 4.4Å | ||
| 175 | A | 87.7 | Confident | 87.2 | Confident | 57 Ų | 57 | 61.2 Ų | 61.2 | 47% | 0.471 | 35% | 0.349 | S | S | . | . | trans | -58.1 | 157 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | L173 T177 G180 | L173-A175 PolarHBondContact O-N 3.43Å; A175-T177 PolarHBondContact O-N 3.47Å; A175-G180 WeakPolarHBondContact O-CA 3.31Å | ||
| 176 | H | 89.8 | Confident | 88.8 | Confident | 192 Ų | 192 | 58.8 Ų | 58.8 | 89% | 0.889 | 34% | 0.338 | S | S | * | . | S | Bend | trans | -66.4 | 37.3 | -177.7 | -54.4 | -50.2 | 0 | 0 | 0 | 116.7 | ||
| 177 | T | 94.3 | Very high | 89.8 | Confident | 68 Ų | 68 | 57 Ų | 57 | 42% | 0.417 | 32% | 0.324 | S | S | . | . | S | Bend | trans | -104.5 | 161.6 | 172.3 | 62.3 | 0 | 0 | 0 | 0 | 109.5 | A175 V179 G180 L181 | A175-T177 PolarHBondContact O-N 3.47Å; T177-V179 PolarHBondContact O-N 3.39Å; T177-V179 VanDerWaalsContact O-N 3.07Å; T177-G180 PolarHBondContact O-N 3.14Å; T177-G180 PolarHBondContact OG1-N 3.45Å; T177-L181 WeakPolarHBondContact O-CG 3.38Å; T177-L181 PolarHBondContact O-N 3.21Å |
| 178 | P | 93.8 | Very high | 90.4 | Very high | 85 Ų | 85 | 53.8 Ų | 53.8 | 55% | 0.552 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -53.8 | -29.5 | 173.5 | -28.7 | 37 | 0 | 0 | 0 | 114.1 | I182 S286 | P178-I182 WeakPolarHBondContact O-CG1 3.13Å; P178-I182 PolarHBondContact O-N 2.85Å; P178-S286 WeakPolarHBondContact CB-OG 3.42Å |
| 179 | V | 95.3 | Very high | 91 | Very high | 22 Ų | 22 | 53.7 Ų | 53.7 | 13% | 0.133 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -66.2 | -53.9 | 173.4 | 175.5 | 0 | 0 | 0 | 0 | 111 | T177 L181 I182 Q183 I289 A290 K293 | T177-V179 PolarHBondContact O-N 3.39Å; T177-V179 VanDerWaalsContact O-N 3.07Å; V179-L181 PolarHBondContact O-N 3.01Å; V179-I182 PolarHBondContact O-N 3.41Å; V179-Q183 PolarHBondContact O-N 2.8Å; V179-Q183 VanDerWaalsContact O-N 3.16Å; V179-I289 HydrophobicContact CG1-CB 4.32Å; V179-I289 HydrophobicContact CG1-CG2 3.85Å; V179-I289 HydrophobicContact CG2-CB 3.99Å; V179-I289 HydrophobicContact CG2-CG2 3.88Å; V179-A290 HydrophobicContact CG1-CB 4Å; V179-K293 HydrophobicContact CG1-CD 4.41Å |
| 180 | G | 94.6 | Very high | 91.5 | Very high | 1 Ų | 1 | 51.6 Ų | 51.6 | 1% | 0.01 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -71.8 | -28.6 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | A175 T177 I182 Q183 S184 | A175-G180 WeakPolarHBondContact O-CA 3.31Å; T177-G180 PolarHBondContact O-N 3.14Å; T177-G180 PolarHBondContact OG1-N 3.45Å; G180-I182 VanDerWaalsContact C-N 3.26Å; G180-I182 PolarHBondContact O-N 2.97Å; G180-Q183 CarbonylContact O-C 3.59Å; G180-Q183 WeakPolarHBondContact O-CA 3.46Å; G180-Q183 WeakPolarHBondContact O-CB 3.22Å; G180-Q183 PolarHBondContact O-N 3.4Å; G180-S184 PolarHBondContact O-N 3.49Å; G180-S184 PolarHBondContact O-OG 3.46Å |
| 181 | L | 95.4 | Very high | 91.9 | Very high | 107 Ų | 107 | 48.5 Ų | 48.5 | 56% | 0.56 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -60.5 | -34 | 169 | -70.2 | 175.9 | 0 | 0 | 0 | 112.7 | T177 V179 L185 | T177-L181 WeakPolarHBondContact O-CG 3.38Å; T177-L181 PolarHBondContact O-N 3.21Å; V179-L181 PolarHBondContact O-N 3.01Å; L181-L185 WeakPolarHBondContact O-CB 3.44Å; L181-L185 PolarHBondContact O-N 3.21Å; L181-L185 VanDerWaalsContact O-N 3.11Å |
| 182 | I | 96.3 | Very high | 92.4 | Very high | 23 Ų | 23 | 51.6 Ų | 51.6 | 12% | 0.118 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -71.8 | -36.7 | 170.7 | -64.9 | -53.3 | 0 | 0 | 0 | 111 | P178 V179 G180 L185 L186 F287 A290 | P178-I182 WeakPolarHBondContact O-CG1 3.13Å; P178-I182 PolarHBondContact O-N 2.85Å; V179-I182 PolarHBondContact O-N 3.41Å; G180-I182 VanDerWaalsContact C-N 3.26Å; G180-I182 PolarHBondContact O-N 2.97Å; I182-L185 HydrophobicContact CD1-CD2 4.37Å; I182-L185 PolarHBondContact O-N 3Å; I182-L186 HydrophobicContact CG2-CD1 3.89Å; I182-L186 HydrophobicContact CG2-CG 4.24Å; I182-L186 VanDerWaalsContact O-CG 3.25Å; I182-L186 WeakPolarHBondContact O-CG 3.3Å; I182-L186 PolarHBondContact O-N 2.98Å; I182-F287 HydrophobicContact CD1-CD2 3.99Å; I182-F287 HydrophobicContact CD1-CE2 3.42Å; I182-F287 VanDerWaalsContact CD1-CE2 3.42Å; I182-F287 HydrophobicContact CD1-CZ 3.74Å; I182-F287 HydrophobicContact CG1-CD2 4.02Å; I182-F287 HydrophobicContact CG1-CE2 3.97Å; I182-F287 HydrophobicContact CG1-CG 4.48Å; I182-F287 HydrophobicContact CG1-CZ 4.4Å; I182-F287 HydrophobicContact CG2-CD1 3.63Å; I182-F287 HydrophobicContact CG2-CD2 4.22Å; I182-F287 HydrophobicContact CG2-CE1 3.68Å; I182-F287 HydrophobicContact CG2-CE2 4.25Å; I182-F287 HydrophobicContact CG2-CG 3.92Å; I182-F287 HydrophobicContact CG2-CZ 4Å; I182-A290 HydrophobicContact CB-CB 4.2Å; I182-A290 HydrophobicContact CG2-CB 3.99Å |
| 183 | Q | 95.9 | Very high | 92.9 | Very high | 3 Ų | 3 | 53.6 Ų | 53.6 | 1% | 0.014 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.9 | -49.5 | 176.6 | -63.8 | 178.3 | -47.8 | 0 | 0 | 111.2 | L168 V179 G180 L185 L186 E187 A290 M294 | L168-Q183 HydrophobicContact CD1-CB 3.93Å; V179-Q183 PolarHBondContact O-N 2.8Å; V179-Q183 VanDerWaalsContact O-N 3.16Å; G180-Q183 CarbonylContact O-C 3.59Å; G180-Q183 WeakPolarHBondContact O-CA 3.46Å; G180-Q183 WeakPolarHBondContact O-CB 3.22Å; G180-Q183 PolarHBondContact O-N 3.4Å; Q183-L185 VanDerWaalsContact C-N 3.3Å; Q183-L185 PolarHBondContact O-N 3.44Å; Q183-L186 PolarHBondContact O-N 2.82Å; Q183-E187 VanDerWaalsContact O-CB 3.28Å; Q183-E187 WeakPolarHBondContact O-CB 3.34Å; Q183-E187 PolarHBondContact O-N 3.05Å; Q183-A290 HydrophobicContact CG-CB 3.69Å; Q183-A290 PolarHBondContact NE2-O 3.03Å; Q183-A290 VanDerWaalsContact NE2-O 3.13Å; Q183-M294 HydrophobicContact CB-SD 4.49Å; Q183-M294 HydrophobicContact CG-CG 4.41Å; Q183-M294 HydrophobicContact CG-SD 3.93Å |
| 184 | S | 94.8 | Very high | 93.3 | Very high | 44 Ų | 44 | 55.8 Ų | 55.8 | 31% | 0.308 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.9 | -33.6 | 174.2 | -55.2 | 0 | 0 | 0 | 0 | 113.4 | G180 F188 | G180-S184 PolarHBondContact O-N 3.49Å; G180-S184 PolarHBondContact O-OG 3.46Å; S184-F188 VanDerWaalsContact O-CB 3.26Å; S184-F188 WeakPolarHBondContact O-CB 3.18Å; S184-F188 PolarHBondContact O-N 3.28Å |
| 185 | L | 95.8 | Very high | 93.7 | Very high | 56 Ų | 56 | 58.1 Ų | 58.1 | 29% | 0.293 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -67.1 | -42.2 | 174.4 | 177.4 | 62.9 | 0 | 0 | 0 | 111.6 | L181 I182 Q183 I189 | L181-L185 WeakPolarHBondContact O-CB 3.44Å; L181-L185 PolarHBondContact O-N 3.21Å; L181-L185 VanDerWaalsContact O-N 3.11Å; I182-L185 HydrophobicContact CD1-CD2 4.37Å; I182-L185 PolarHBondContact O-N 3Å; Q183-L185 VanDerWaalsContact C-N 3.3Å; Q183-L185 PolarHBondContact O-N 3.44Å; L185-I189 HydrophobicContact CD1-CD1 3.9Å; L185-I189 HydrophobicContact CD1-CG1 4.41Å; L185-I189 HydrophobicContact CG-CD1 3.94Å; L185-I189 VanDerWaalsContact O-CD1 3.3Å; L185-I189 WeakPolarHBondContact O-CD1 3.48Å; L185-I189 WeakPolarHBondContact O-CG1 3.41Å; L185-I189 PolarHBondContact O-N 3.05Å; L185-I189 VanDerWaalsContact O-N 3.09Å |
| 186 | L | 96.4 | Very high | 94 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -71 | -39.4 | 178.3 | -66.7 | 173.3 | 0 | 0 | 0 | 111.6 | I182 Q183 I189 H190 W197 A200 I201 L291 M294 | I182-L186 HydrophobicContact CG2-CD1 3.89Å; I182-L186 HydrophobicContact CG2-CG 4.24Å; I182-L186 VanDerWaalsContact O-CG 3.25Å; I182-L186 WeakPolarHBondContact O-CG 3.3Å; I182-L186 PolarHBondContact O-N 2.98Å; Q183-L186 PolarHBondContact O-N 2.82Å; L186-I189 PolarHBondContact O-N 3.08Å; L186-H190 WeakPolarHBondContact O-CB 3.36Å; L186-H190 PolarHBondContact O-N 2.94Å; L186-W197 HydrophobicContact CB-CZ3 4.04Å; L186-A200 WeakPolarHBondContact CD2-O 3.02Å; L186-I201 HydrophobicContact CD2-CG1 4.41Å; L186-L291 HydrophobicContact CD1-CD2 3.66Å; L186-L291 HydrophobicContact CD1-CG 4.49Å; L186-M294 HydrophobicContact CD1-SD 4.43Å |
| 187 | E | 94.2 | Very high | 94.3 | Very high | 26 Ų | 26 | 48.9 Ų | 48.9 | 12% | 0.121 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58 | -49.9 | 171.6 | -179 | 175.3 | -148.5 | 0 | 0 | 111.4 | R167 L168 Q183 I189 H190 M191 | R167-E187 WeakPolarHBondContact CA-OE1 3.18Å; R167-E187 WeakPolarHBondContact CB-OE1 3.42Å; L168-E187 HydrophobicContact CD1-CB 3.86Å; L168-E187 HydrophobicContact CD1-CG 4.4Å; L168-E187 HydrophobicContact CG-CB 4.16Å; L168-E187 HydrophobicContact CG-CG 4.14Å; L168-E187 PolarHBondContact N-OE1 2.95Å; Q183-E187 VanDerWaalsContact O-CB 3.28Å; Q183-E187 WeakPolarHBondContact O-CB 3.34Å; Q183-E187 PolarHBondContact O-N 3.05Å; E187-I189 VanDerWaalsContact C-N 3.34Å; E187-I189 PolarHBondContact O-N 3.06Å; E187-H190 PolarHBondContact O-N 3.27Å; E187-H190 VanDerWaalsContact O-N 3.09Å; E187-M191 HydrophobicContact CG-CG 4.45Å; E187-M191 WeakPolarHBondContact O-CB 3.36Å; E187-M191 WeakPolarHBondContact O-CG 3.48Å; E187-M191 PolarHBondContact O-N 2.87Å |
| 188 | F | 94.3 | Very high | 94.4 | Very high | 102 Ų | 102 | 50 Ų | 50 | 45% | 0.447 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -59.7 | -40.9 | 175.6 | 175.9 | -95.5 | 0 | 0 | 0 | 112.7 | S184 H190 D192 L193 | S184-F188 VanDerWaalsContact O-CB 3.26Å; S184-F188 WeakPolarHBondContact O-CB 3.18Å; S184-F188 PolarHBondContact O-N 3.28Å; F188-H190 VanDerWaalsContact C-N 3.29Å; F188-H190 PolarHBondContact O-N 3.02Å; F188-D192 WeakPolarHBondContact CA-OD2 3.48Å; F188-D192 HydrophobicContact CD2-CB 3.72Å; F188-D192 VanDerWaalsContact CD2-CG 3.46Å; F188-D192 WeakPolarHBondContact CD2-OD2 3.36Å; F188-D192 HydrophobicContact CE2-CB 3.62Å; F188-D192 HydrophobicContact CG-CB 4.36Å; F188-D192 HydrophobicContact CZ-CB 4.2Å; F188-D192 WeakPolarHBondContact O-CB 3.36Å; F188-D192 PolarHBondContact O-N 2.99Å; F188-L193 HydrophobicContact CE1-CD1 4.35Å; F188-L193 HydrophobicContact CE1-CG 4.42Å; F188-L193 PolarHBondContact O-N 3.34Å |
| 189 | I | 95.9 | Very high | 94.5 | Very high | 1 Ų | 1 | 46.2 Ų | 46.2 | 1% | 0.005 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -71.6 | -27.3 | 177.5 | -61.9 | 161.6 | 0 | 0 | 0 | 111.4 | L185 L186 E187 L193 L195 A200 V203 L207 | L185-I189 HydrophobicContact CD1-CD1 3.9Å; L185-I189 HydrophobicContact CD1-CG1 4.41Å; L185-I189 HydrophobicContact CG-CD1 3.94Å; L185-I189 VanDerWaalsContact O-CD1 3.3Å; L185-I189 WeakPolarHBondContact O-CD1 3.48Å; L185-I189 WeakPolarHBondContact O-CG1 3.41Å; L185-I189 PolarHBondContact O-N 3.05Å; L185-I189 VanDerWaalsContact O-N 3.09Å; L186-I189 PolarHBondContact O-N 3.08Å; E187-I189 VanDerWaalsContact C-N 3.34Å; E187-I189 PolarHBondContact O-N 3.06Å; I189-L193 HydrophobicContact CG1-CD1 4.29Å; I189-L193 HydrophobicContact CG2-CD1 4.32Å; I189-L193 WeakPolarHBondContact O-CB 3.41Å; I189-L195 HydrophobicContact CG2-CB 4.44Å; I189-L195 HydrophobicContact CG2-CD1 3.8Å; I189-L195 PolarHBondContact O-N 3.48Å; I189-A200 HydrophobicContact CB-CB 4.07Å; I189-A200 HydrophobicContact CG2-CB 3.85Å; I189-V203 HydrophobicContact CD1-CG1 4.21Å; I189-V203 HydrophobicContact CG2-CB 4.14Å; I189-V203 HydrophobicContact CG2-CG1 4.16Å; I189-L207 HydrophobicContact CD1-CD1 4.07Å |
| 190 | H | 94.3 | Very high | 94.6 | Very high | 22 Ų | 22 | 45.2 Ų | 45.2 | 10% | 0.102 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -77.9 | -52.3 | 176.2 | -178.3 | 34.9 | 0 | 0 | 0 | 112.3 | E165 L186 E187 F188 G194 L195 W197 A200 | E165-H190 IonicContact OE2-NE2 3.28Å; L186-H190 WeakPolarHBondContact O-CB 3.36Å; L186-H190 PolarHBondContact O-N 2.94Å; E187-H190 PolarHBondContact O-N 3.27Å; E187-H190 VanDerWaalsContact O-N 3.09Å; F188-H190 VanDerWaalsContact C-N 3.29Å; F188-H190 PolarHBondContact O-N 3.02Å; H190-G194 CarbonylContact O-C 3.47Å; H190-G194 VanDerWaalsContact O-CA 3.24Å; H190-G194 WeakPolarHBondContact O-CA 3.27Å; H190-G194 PolarHBondContact O-N 2.82Å; H190-L195 WeakPolarHBondContact CA-O 3.46Å; H190-L195 PolarHBondContact ND1-O 2.9Å; H190-L195 PolarHBondContact O-N 3.33Å; H190-W197 HydrophobicContact CB-CD2 4.35Å; H190-W197 HydrophobicContact CB-CE3 4.15Å; H190-W197 HydrophobicContact CB-CH2 4.28Å; H190-W197 HydrophobicContact CB-CZ2 4.5Å; H190-W197 HydrophobicContact CB-CZ3 4.1Å; H190-W197 AromaticContact CD2-CD1 3.93Å; H190-W197 AromaticContact CD2-CD2 3.71Å; H190-W197 AromaticContact CD2-CE2 3.17Å; H190-W197 AromaticContact CD2-CH2 3.95Å; H190-W197 AromaticContact CD2-CZ2 3.33Å; H190-W197 WeakPolarHBondContact CD2-CZ2 3.37Å; H190-W197 AromaticContact CD2-NE1 3.32Å; H190-W197 PolarHBondContact CD2-NE1 3.49Å; H190-W197 VanDerWaalsContact CD2-NE1 3.32Å; H190-W197 AromaticContact CG-CD2 3.96Å; H190-W197 AromaticContact CG-CE2 3.89Å; H190-W197 AromaticContact NE2-CD1 3.61Å; H190-W197 AromaticContact NE2-CE2 3.61Å; H190-W197 AromaticContact NE2-NE1 3.2Å; H190-W197 PolarHBondContact NE2-NE1 3.28Å; H190-W197 VanDerWaalsContact NE2-NE1 3.2Å; H190-A200 HydrophobicContact CB-CB 4.2Å |
| 191 | M | 90.6 | Very high | 94.8 | Very high | 69 Ų | 69 | 45.1 Ų | 45.1 | 34% | 0.34 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -80.5 | -61 | -173.4 | -66.1 | -80 | 117.5 | 0 | 0 | 112 | E165 E187 L193 G194 | E165-M191 HydrophobicContact CB-CE 4.15Å; E165-M191 HydrophobicContact CG-CE 4.3Å; E187-M191 HydrophobicContact CG-CG 4.45Å; E187-M191 WeakPolarHBondContact O-CB 3.36Å; E187-M191 WeakPolarHBondContact O-CG 3.48Å; E187-M191 PolarHBondContact O-N 2.87Å; M191-L193 PolarHBondContact O-N 2.91Å; M191-G194 PolarHBondContact O-N 2.7Å |
| 192 | D | 91 | Very high | 94.9 | Very high | 114 Ų | 114 | 42.1 Ų | 42.1 | 61% | 0.61 | 23% | 0.233 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -22.9 | -172.6 | -56.7 | -99.8 | 0 | 0 | 0 | 113.6 | F188 | F188-D192 WeakPolarHBondContact CA-OD2 3.48Å; F188-D192 HydrophobicContact CD2-CB 3.72Å; F188-D192 VanDerWaalsContact CD2-CG 3.46Å; F188-D192 WeakPolarHBondContact CD2-OD2 3.36Å; F188-D192 HydrophobicContact CE2-CB 3.62Å; F188-D192 HydrophobicContact CG-CB 4.36Å; F188-D192 HydrophobicContact CZ-CB 4.2Å; F188-D192 WeakPolarHBondContact O-CB 3.36Å; F188-D192 PolarHBondContact O-N 2.99Å |
| 193 | L | 92.6 | Very high | 95 | Very high | 102 Ų | 102 | 43.4 Ų | 43.4 | 53% | 0.534 | 24% | 0.242 | S | C | . | . | S | Bend | trans | -107 | -0 | 175.5 | -59.4 | 177.9 | 0 | 0 | 0 | 113.9 | F188 I189 M191 L195 | F188-L193 HydrophobicContact CE1-CD1 4.35Å; F188-L193 HydrophobicContact CE1-CG 4.42Å; F188-L193 PolarHBondContact O-N 3.34Å; I189-L193 HydrophobicContact CG1-CD1 4.29Å; I189-L193 HydrophobicContact CG2-CD1 4.32Å; I189-L193 WeakPolarHBondContact O-CB 3.41Å; M191-L193 PolarHBondContact O-N 2.91Å; L193-L195 PolarHBondContact O-N 3.45Å |
| 194 | G | 91.3 | Very high | 95.1 | Very high | 63 Ų | 63 | 43.3 Ų | 43.3 | 65% | 0.649 | 24% | 0.242 | S | C | * | . | trans | 62.7 | 19 | 174.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | H190 M191 | H190-G194 CarbonylContact O-C 3.47Å; H190-G194 VanDerWaalsContact O-CA 3.24Å; H190-G194 WeakPolarHBondContact O-CA 3.27Å; H190-G194 PolarHBondContact O-N 2.82Å; M191-G194 PolarHBondContact O-N 2.7Å | ||
| 195 | L | 93.8 | Very high | 95.2 | Very high | 63 Ų | 63 | 41.2 Ų | 41.2 | 33% | 0.33 | 23% | 0.227 | S | C | . | . | trans | -85.1 | 138.9 | 179.9 | -68.8 | 176.2 | 0 | 0 | 0 | 110.9 | I189 H190 L193 V203 | I189-L195 HydrophobicContact CG2-CB 4.44Å; I189-L195 HydrophobicContact CG2-CD1 3.8Å; I189-L195 PolarHBondContact O-N 3.48Å; H190-L195 WeakPolarHBondContact CA-O 3.46Å; H190-L195 PolarHBondContact ND1-O 2.9Å; H190-L195 PolarHBondContact O-N 3.33Å; L193-L195 PolarHBondContact O-N 3.45Å; L195-V203 HydrophobicContact CD1-CG2 3.9Å | ||
| 196 | P | 94.8 | Very high | 95.3 | Very high | 52 Ų | 52 | 41.2 Ų | 41.2 | 34% | 0.338 | 23% | 0.23 | S | C | . | . | trans | -60.6 | 153.7 | 173.2 | 27.5 | -36.3 | 0 | 0 | 0 | 111.2 | W198 G199 A200 | P196-W198 VanDerWaalsContact C-N 3.27Å; P196-W198 HydrophobicContact CG-CZ2 4.36Å; P196-W198 PolarHBondContact O-N 3.3Å; P196-W198 VanDerWaalsContact O-N 3.1Å; P196-G199 CarbonylContact O-C 3.55Å; P196-G199 VanDerWaalsContact O-CA 3.31Å; P196-G199 WeakPolarHBondContact O-CA 3.48Å; P196-G199 PolarHBondContact O-N 3.21Å; P196-A200 PolarHBondContact O-N 3.28Å | ||
| 197 | W | 95.3 | Very high | 95.4 | Very high | 4 Ų | 4 | 45.6 Ų | 45.6 | 2% | 0.015 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -51.1 | -39.7 | -173.7 | -81.3 | 113.4 | 0 | 0 | 0 | 114.4 | L168 L186 H190 G199 A200 I201 M294 V299 S301 L302 G305 L313 | L168-W197 HydrophobicContact CD1-CH2 4.18Å; L168-W197 HydrophobicContact CD2-CH2 4.39Å; L186-W197 HydrophobicContact CB-CZ3 4.04Å; H190-W197 HydrophobicContact CB-CD2 4.35Å; H190-W197 HydrophobicContact CB-CE3 4.15Å; H190-W197 HydrophobicContact CB-CH2 4.28Å; H190-W197 HydrophobicContact CB-CZ2 4.5Å; H190-W197 HydrophobicContact CB-CZ3 4.1Å; H190-W197 AromaticContact CD2-CD1 3.93Å; H190-W197 AromaticContact CD2-CD2 3.71Å; H190-W197 AromaticContact CD2-CE2 3.17Å; H190-W197 AromaticContact CD2-CH2 3.95Å; H190-W197 AromaticContact CD2-CZ2 3.33Å; H190-W197 WeakPolarHBondContact CD2-CZ2 3.37Å; H190-W197 AromaticContact CD2-NE1 3.32Å; H190-W197 PolarHBondContact CD2-NE1 3.49Å; H190-W197 VanDerWaalsContact CD2-NE1 3.32Å; H190-W197 AromaticContact CG-CD2 3.96Å; H190-W197 AromaticContact CG-CE2 3.89Å; H190-W197 AromaticContact NE2-CD1 3.61Å; H190-W197 AromaticContact NE2-CE2 3.61Å; H190-W197 AromaticContact NE2-NE1 3.2Å; H190-W197 PolarHBondContact NE2-NE1 3.28Å; H190-W197 VanDerWaalsContact NE2-NE1 3.2Å; W197-G199 VanDerWaalsContact C-N 3.29Å; W197-G199 PolarHBondContact O-N 2.72Å; W197-A200 PolarHBondContact O-N 2.71Å; W197-I201 VanDerWaalsContact O-CG1 3.23Å; W197-I201 WeakPolarHBondContact O-CG1 3.3Å; W197-I201 PolarHBondContact O-N 2.66Å; W197-M294 HydrophobicContact CE3-CE 3.9Å; W197-M294 HydrophobicContact CH2-CE 3.67Å; W197-M294 HydrophobicContact CZ2-CE 4.43Å; W197-M294 HydrophobicContact CZ3-CE 3.35Å; W197-V299 HydrophobicContact CZ2-CG1 4.04Å; W197-S301 VanDerWaalsContact CD1-C 3.49Å; W197-S301 VanDerWaalsContact CD1-O 3.26Å; W197-S301 PolarHBondContact NE1-OG 2.93Å; W197-L302 HydrophobicContact CB-CD1 4.36Å; W197-L302 HydrophobicContact CD2-CD1 3.76Å; W197-L302 HydrophobicContact CE3-CD1 4.18Å; W197-L302 HydrophobicContact CG-CD1 3.87Å; W197-G305 PolarHBondContact N-O 3.37Å; W197-L313 HydrophobicContact CB-CD1 3.55Å |
| 198 | W | 96.3 | Very high | 95.5 | Very high | 90 Ų | 90 | 45.2 Ų | 45.2 | 34% | 0.341 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -60 | -40.8 | 174.9 | 73.8 | -93.9 | 0 | 0 | 0 | 111.9 | P196 I201 V202 G305 G306 V307 L313 | P196-W198 VanDerWaalsContact C-N 3.27Å; P196-W198 HydrophobicContact CG-CZ2 4.36Å; P196-W198 PolarHBondContact O-N 3.3Å; P196-W198 VanDerWaalsContact O-N 3.1Å; W198-I201 PolarHBondContact O-N 2.94Å; W198-V202 HydrophobicContact CE3-CG2 4.19Å; W198-V202 HydrophobicContact CZ3-CG2 4.47Å; W198-V202 VanDerWaalsContact O-CG2 3.28Å; W198-V202 WeakPolarHBondContact O-CG2 3.43Å; W198-V202 PolarHBondContact O-N 2.84Å; W198-G305 PolarHBondContact N-O 3.06Å; W198-G306 VanDerWaalsContact CD1-O 3.24Å; W198-V307 HydrophobicContact CB-CG1 4.43Å; W198-V307 HydrophobicContact CD2-CB 4.15Å; W198-V307 HydrophobicContact CD2-CG1 3.84Å; W198-V307 HydrophobicContact CE3-CG1 4.35Å; W198-V307 HydrophobicContact CG-CB 3.99Å; W198-V307 HydrophobicContact CG-CG1 3.86Å; W198-V307 HydrophobicContact CZ2-CG2 4.35Å; W198-L313 HydrophobicContact CB-CD1 4.2Å |
| 199 | G | 96.8 | Very high | 95.6 | Very high | 7 Ų | 7 | 41.2 Ų | 41.2 | 7% | 0.072 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -70.1 | -40.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | P196 W197 I201 V202 V203 | P196-G199 CarbonylContact O-C 3.55Å; P196-G199 VanDerWaalsContact O-CA 3.31Å; P196-G199 WeakPolarHBondContact O-CA 3.48Å; P196-G199 PolarHBondContact O-N 3.21Å; W197-G199 VanDerWaalsContact C-N 3.29Å; W197-G199 PolarHBondContact O-N 2.72Å; G199-I201 PolarHBondContact O-N 2.7Å; G199-V202 PolarHBondContact O-N 2.82Å; G199-V203 WeakPolarHBondContact O-CG2 3.46Å; G199-V203 PolarHBondContact O-N 3.04Å |
| 200 | A | 97.2 | Very high | 95.6 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.8 | -43.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | L186 I189 H190 P196 W197 V203 G204 | L186-A200 WeakPolarHBondContact CD2-O 3.02Å; I189-A200 HydrophobicContact CB-CB 4.07Å; I189-A200 HydrophobicContact CG2-CB 3.85Å; H190-A200 HydrophobicContact CB-CB 4.2Å; P196-A200 PolarHBondContact O-N 3.28Å; W197-A200 PolarHBondContact O-N 2.71Å; A200-V203 PolarHBondContact O-N 3.33Å; A200-G204 PolarHBondContact O-N 3.46Å |
| 201 | I | 97.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 172.9 | -67.6 | 166 | 0 | 0 | 0 | 110.8 | L186 W197 W198 G199 T205 L291 L313 A371 T374 | L186-I201 HydrophobicContact CD2-CG1 4.41Å; W197-I201 VanDerWaalsContact O-CG1 3.23Å; W197-I201 WeakPolarHBondContact O-CG1 3.3Å; W197-I201 PolarHBondContact O-N 2.66Å; W198-I201 PolarHBondContact O-N 2.94Å; G199-I201 PolarHBondContact O-N 2.7Å; I201-T205 VanDerWaalsContact O-CB 3.29Å; I201-T205 WeakPolarHBondContact O-CB 3.45Å; I201-T205 PolarHBondContact O-N 2.96Å; I201-T205 PolarHBondContact O-OG1 3.15Å; I201-L291 HydrophobicContact CD1-CD2 3.88Å; I201-L291 HydrophobicContact CG1-CD2 3.83Å; I201-L291 HydrophobicContact CG2-CD1 4.5Å; I201-L313 HydrophobicContact CD1-CD1 4.35Å; I201-A371 HydrophobicContact CD1-CB 3.96Å; I201-T374 HydrophobicContact CB-CG2 4.43Å; I201-T374 HydrophobicContact CG2-CG2 4.02Å |
| 202 | V | 98.1 | Very high | 95.9 | Very high | 43 Ų | 43 | 45.2 Ų | 45.2 | 26% | 0.261 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -60.1 | -53.8 | 178 | 167.8 | 0 | 0 | 0 | 0 | 111.2 | W198 G199 T205 V206 T378 | W198-V202 HydrophobicContact CE3-CG2 4.19Å; W198-V202 HydrophobicContact CZ3-CG2 4.47Å; W198-V202 VanDerWaalsContact O-CG2 3.28Å; W198-V202 WeakPolarHBondContact O-CG2 3.43Å; W198-V202 PolarHBondContact O-N 2.84Å; G199-V202 PolarHBondContact O-N 2.82Å; V202-T205 WeakPolarHBondContact O-CB 3.29Å; V202-T205 PolarHBondContact O-N 2.93Å; V202-V206 WeakPolarHBondContact O-CG2 3.4Å; V202-V206 PolarHBondContact O-N 2.94Å; V202-T378 HydrophobicContact CB-CG2 4.38Å; V202-T378 HydrophobicContact CG1-CG2 4.07Å; V202-T378 HydrophobicContact CG2-CG2 4.4Å |
| 203 | V | 98.1 | Very high | 96 | Very high | 51 Ų | 51 | 41.7 Ų | 41.7 | 31% | 0.309 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -65.8 | -45.5 | -176.5 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | I189 L195 G199 A200 T205 V206 L207 | I189-V203 HydrophobicContact CD1-CG1 4.21Å; I189-V203 HydrophobicContact CG2-CB 4.14Å; I189-V203 HydrophobicContact CG2-CG1 4.16Å; L195-V203 HydrophobicContact CD1-CG2 3.9Å; G199-V203 WeakPolarHBondContact O-CG2 3.46Å; G199-V203 PolarHBondContact O-N 3.04Å; A200-V203 PolarHBondContact O-N 3.33Å; V203-T205 VanDerWaalsContact C-N 3.28Å; V203-T205 PolarHBondContact O-N 3.09Å; V203-V206 PolarHBondContact O-N 3.35Å; V203-V206 VanDerWaalsContact O-N 3.14Å; V203-L207 HydrophobicContact CG1-CD1 3.92Å; V203-L207 HydrophobicContact CG1-CG 4.29Å; V203-L207 WeakPolarHBondContact O-CG 3.35Å; V203-L207 PolarHBondContact O-N 3.43Å |
| 204 | G | 97.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.8 | -39.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A200 A208 | A200-G204 PolarHBondContact O-N 3.46Å; G204-A208 WeakPolarHBondContact O-CB 3.49Å; G204-A208 PolarHBondContact O-N 2.82Å |
| 205 | T | 97.9 | Very high | 96.1 | Very high | 1 Ų | 1 | 38.8 Ų | 38.8 | 1% | 0.006 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63 | -47.7 | 173.6 | -56.8 | 0 | 0 | 0 | 0 | 111.6 | I201 V202 V203 A208 R209 Y375 T378 | I201-T205 VanDerWaalsContact O-CB 3.29Å; I201-T205 WeakPolarHBondContact O-CB 3.45Å; I201-T205 PolarHBondContact O-N 2.96Å; I201-T205 PolarHBondContact O-OG1 3.15Å; V202-T205 WeakPolarHBondContact O-CB 3.29Å; V202-T205 PolarHBondContact O-N 2.93Å; V203-T205 VanDerWaalsContact C-N 3.28Å; V203-T205 PolarHBondContact O-N 3.09Å; T205-A208 PolarHBondContact O-N 2.9Å; T205-R209 HydrophobicContact CG2-CG 4.43Å; T205-R209 WeakPolarHBondContact O-CB 3.44Å; T205-R209 VanDerWaalsContact O-CG 3.3Å; T205-R209 WeakPolarHBondContact O-CG 3.35Å; T205-R209 PolarHBondContact O-N 3.47Å; T205-Y375 HydrophobicContact CG2-CD2 4.02Å; T205-Y375 HydrophobicContact CG2-CE2 3.97Å; T205-Y375 VanDerWaalsContact OG1-CD2 3.27Å; T205-Y375 WeakPolarHBondContact OG1-CD2 3.47Å; T205-T378 HydrophobicContact CG2-CG2 3.93Å |
| 206 | V | 98.1 | Very high | 96 | Very high | 56 Ų | 56 | 36 Ų | 36 | 34% | 0.339 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -63.3 | -44.8 | 180 | 171.6 | 0 | 0 | 0 | 0 | 111.1 | V202 V203 A208 R209 V210 T378 F382 | V202-V206 WeakPolarHBondContact O-CG2 3.4Å; V202-V206 PolarHBondContact O-N 2.94Å; V203-V206 PolarHBondContact O-N 3.35Å; V203-V206 VanDerWaalsContact O-N 3.14Å; V206-A208 PolarHBondContact O-N 2.92Å; V206-R209 PolarHBondContact O-N 2.94Å; V206-V210 HydrophobicContact CG1-CG2 4.34Å; V206-V210 WeakPolarHBondContact O-CG2 3.25Å; V206-V210 PolarHBondContact O-N 3.33Å; V206-T378 HydrophobicContact CG2-CG2 4.2Å; V206-F382 HydrophobicContact CG1-CD2 4.49Å; V206-F382 HydrophobicContact CG1-CE2 4.33Å; V206-F382 HydrophobicContact CG2-CD2 4.47Å |
| 207 | L | 97.7 | Very high | 95.9 | Very high | 92 Ų | 92 | 34.1 Ų | 34.1 | 48% | 0.482 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -58.6 | -48.8 | 176.3 | -71.3 | 171.3 | 0 | 0 | 0 | 111.7 | I189 V203 R209 V210 A211 | I189-L207 HydrophobicContact CD1-CD1 4.07Å; V203-L207 HydrophobicContact CG1-CD1 3.92Å; V203-L207 HydrophobicContact CG1-CG 4.29Å; V203-L207 WeakPolarHBondContact O-CG 3.35Å; V203-L207 PolarHBondContact O-N 3.43Å; L207-R209 VanDerWaalsContact C-N 3.32Å; L207-R209 PolarHBondContact O-N 3.34Å; L207-V210 PolarHBondContact O-N 3.49Å; L207-A211 PolarHBondContact O-N 3.04Å |
| 208 | A | 96.3 | Very high | 95.7 | Very high | 18 Ų | 18 | 40.2 Ų | 40.2 | 15% | 0.149 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -62.1 | -38.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G204 T205 V206 A211 V212 V283 F287 | G204-A208 WeakPolarHBondContact O-CB 3.49Å; G204-A208 PolarHBondContact O-N 2.82Å; T205-A208 PolarHBondContact O-N 2.9Å; V206-A208 PolarHBondContact O-N 2.92Å; A208-A211 PolarHBondContact O-N 2.93Å; A208-V212 WeakPolarHBondContact O-CG2 3.36Å; A208-V212 PolarHBondContact O-N 3.23Å; A208-V212 VanDerWaalsContact O-N 3.16Å; A208-V283 HydrophobicContact CB-CG1 4.44Å; A208-F287 HydrophobicContact CB-CE2 3.58Å; A208-F287 HydrophobicContact CB-CZ 3.77Å |
| 209 | R | 95.8 | Very high | 95.3 | Very high | 17 Ų | 17 | 36.2 Ų | 36.2 | 6% | 0.064 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -68.2 | -39.9 | 175.6 | -73.9 | -55.6 | -159.6 | 101.5 | -1.7 | 112.9 | T205 V206 L207 V212 F213 S379 F382 S383 | T205-R209 HydrophobicContact CG2-CG 4.43Å; T205-R209 WeakPolarHBondContact O-CB 3.44Å; T205-R209 VanDerWaalsContact O-CG 3.3Å; T205-R209 WeakPolarHBondContact O-CG 3.35Å; T205-R209 PolarHBondContact O-N 3.47Å; V206-R209 PolarHBondContact O-N 2.94Å; L207-R209 VanDerWaalsContact C-N 3.32Å; L207-R209 PolarHBondContact O-N 3.34Å; R209-V212 PolarHBondContact O-N 3.26Å; R209-F213 PolarHBondContact O-N 2.75Å; R209-S379 PolarHBondContact NE-OG 3.05Å; R209-S379 VanDerWaalsContact NE-OG 3.12Å; R209-S379 PolarHBondContact NH1-O 3.03Å; R209-S379 VanDerWaalsContact NH2-C 3.33Å; R209-S379 PolarHBondContact NH2-O 2.85Å; R209-S379 PolarHBondContact NH2-OG 3.21Å; R209-F382 HydrophobicContact CB-CD1 3.6Å; R209-F382 HydrophobicContact CB-CD2 3.81Å; R209-F382 HydrophobicContact CB-CE1 3.62Å; R209-F382 HydrophobicContact CB-CE2 3.81Å; R209-F382 HydrophobicContact CB-CG 3.71Å; R209-F382 HydrophobicContact CB-CZ 3.72Å; R209-F382 HydrophobicContact CG-CB 4.25Å; R209-F382 HydrophobicContact CG-CD1 3.94Å; R209-F382 HydrophobicContact CG-CD2 4.39Å; R209-F382 HydrophobicContact CG-CE1 4.43Å; R209-F382 HydrophobicContact CG-CG 3.92Å; R209-S383 PolarHBondContact NH1-OG 3.04Å; R209-S383 PolarHBondContact NH2-OG 3.42Å |
| 210 | V | 96.9 | Very high | 94.9 | Very high | 83 Ų | 83 | 39.2 Ų | 39.2 | 50% | 0.503 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.9 | -40.4 | 174.1 | 170 | 0 | 0 | 0 | 0 | 111.1 | V206 L207 V212 F213 P214 F382 | V206-V210 HydrophobicContact CG1-CG2 4.34Å; V206-V210 WeakPolarHBondContact O-CG2 3.25Å; V206-V210 PolarHBondContact O-N 3.33Å; L207-V210 PolarHBondContact O-N 3.49Å; V210-V212 VanDerWaalsContact C-N 3.32Å; V210-V212 PolarHBondContact O-N 3.34Å; V210-F213 WeakPolarHBondContact O-CB 3.44Å; V210-F213 PolarHBondContact O-N 2.64Å; V210-P214 WeakPolarHBondContact O-CD 3.12Å; V210-F382 HydrophobicContact CG2-CE2 3.96Å; V210-F382 HydrophobicContact CG2-CZ 4.07Å |
| 211 | A | 96 | Very high | 94.5 | Very high | 77 Ų | 77 | 43.6 Ų | 43.6 | 64% | 0.636 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -63 | -35.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | L207 A208 P214 | L207-A211 PolarHBondContact O-N 3.04Å; A208-A211 PolarHBondContact O-N 2.93Å; A211-P214 WeakPolarHBondContact O-CD 3.46Å |
| 212 | V | 94.7 | Very high | 94.1 | Very high | 17 Ų | 17 | 45 Ų | 45 | 10% | 0.103 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -84.3 | -22.2 | 179 | 177.7 | 0 | 0 | 0 | 0 | 112.9 | A208 R209 V210 P214 V215 I216 V279 V283 | A208-V212 WeakPolarHBondContact O-CG2 3.36Å; A208-V212 PolarHBondContact O-N 3.23Å; A208-V212 VanDerWaalsContact O-N 3.16Å; R209-V212 PolarHBondContact O-N 3.26Å; V210-V212 VanDerWaalsContact C-N 3.32Å; V210-V212 PolarHBondContact O-N 3.34Å; V212-P214 VanDerWaalsContact C-CD 3.46Å; V212-V215 WeakPolarHBondContact O-CA 3.07Å; V212-V215 WeakPolarHBondContact O-CB 3.32Å; V212-V215 PolarHBondContact O-N 2.84Å; V212-I216 HydrophobicContact CG1-CD1 4Å; V212-I216 HydrophobicContact CG1-CG1 4.07Å; V212-I216 PolarHBondContact O-N 2.7Å; V212-V279 HydrophobicContact CG1-CG1 4Å; V212-V279 HydrophobicContact CG2-CG1 4.19Å; V212-V283 HydrophobicContact CG2-CG2 4.21Å |
| 213 | F | 94.1 | Very high | 93.6 | Very high | 39 Ų | 39 | 44.6 Ų | 44.6 | 17% | 0.171 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -49.1 | -42.4 | -177.7 | 176 | -99.3 | 0 | 0 | 0 | 115.2 | R209 V210 V215 I216 V217 Q386 L389 L390 F399 | R209-F213 PolarHBondContact O-N 2.75Å; V210-F213 WeakPolarHBondContact O-CB 3.44Å; V210-F213 PolarHBondContact O-N 2.64Å; F213-V215 PolarHBondContact O-N 2.86Å; F213-I216 WeakPolarHBondContact O-CB 3.45Å; F213-I216 PolarHBondContact O-N 2.91Å; F213-V217 HydrophobicContact CD1-CG2 4.13Å; F213-V217 HydrophobicContact CD2-CG2 4.41Å; F213-V217 HydrophobicContact CE1-CG2 3.66Å; F213-V217 HydrophobicContact CE2-CG2 3.98Å; F213-V217 HydrophobicContact CG-CG2 4.49Å; F213-V217 HydrophobicContact CZ-CG2 3.58Å; F213-V217 WeakPolarHBondContact O-CG2 3.45Å; F213-V217 PolarHBondContact O-N 2.96Å; F213-Q386 HydrophobicContact CD2-CG 3.95Å; F213-Q386 HydrophobicContact CE2-CG 3.95Å; F213-L389 HydrophobicContact CZ-CD2 4.42Å; F213-L390 HydrophobicContact CE2-CD1 4.15Å; F213-L390 HydrophobicContact CE2-CD2 4.03Å; F213-L390 HydrophobicContact CE2-CG 4.2Å; F213-L390 HydrophobicContact CZ-CD2 3.96Å; F213-F399 HydrophobicContact CE1-CE1 4.49Å; F213-F399 HydrophobicContact CE1-CE2 4.34Å; F213-F399 AromaticContact CE1-CZ 3.93Å; F213-F399 HydrophobicContact CE1-CZ 3.93Å; F213-F399 HydrophobicContact CZ-CE2 4.23Å; F213-F399 HydrophobicContact CZ-CZ 4.29Å |
| 214 | P | 93.1 | Very high | 93.1 | Very high | 71 Ų | 71 | 42.6 Ų | 42.6 | 46% | 0.461 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.5 | -27.4 | 176.3 | -23.8 | 35.2 | 0 | 0 | 0 | 114.3 | V210 A211 V212 K218 | V210-P214 WeakPolarHBondContact O-CD 3.12Å; A211-P214 WeakPolarHBondContact O-CD 3.46Å; V212-P214 VanDerWaalsContact C-CD 3.46Å; P214-K218 WeakPolarHBondContact O-CG 3.3Å; P214-K218 PolarHBondContact O-N 3.31Å |
| 215 | V | 93.1 | Very high | 92.7 | Very high | 34 Ų | 34 | 44.7 Ų | 44.7 | 21% | 0.206 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -73.6 | -40.1 | 172.8 | -175.1 | 0 | 0 | 0 | 0 | 110.1 | V212 F213 K218 G219 L275 V279 | V212-V215 WeakPolarHBondContact O-CA 3.07Å; V212-V215 WeakPolarHBondContact O-CB 3.32Å; V212-V215 PolarHBondContact O-N 2.84Å; F213-V215 PolarHBondContact O-N 2.86Å; V215-K218 WeakPolarHBondContact O-CB 3.08Å; V215-K218 PolarHBondContact O-N 3.02Å; V215-G219 PolarHBondContact O-N 3.04Å; V215-L275 HydrophobicContact CG1-CD2 4.08Å; V215-L275 HydrophobicContact CG1-CG 3.91Å; V215-V279 HydrophobicContact CG1-CB 4.47Å; V215-V279 HydrophobicContact CG1-CG2 4.21Å |
| 216 | I | 90.8 | Very high | 92.2 | Very high | 5 Ų | 5 | 46 Ų | 46 | 3% | 0.026 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.6 | -43.9 | 177.7 | -59.4 | 171.4 | 0 | 0 | 0 | 110.9 | V212 F213 K218 G219 Q220 V276 L390 | V212-I216 HydrophobicContact CG1-CD1 4Å; V212-I216 HydrophobicContact CG1-CG1 4.07Å; V212-I216 PolarHBondContact O-N 2.7Å; F213-I216 WeakPolarHBondContact O-CB 3.45Å; F213-I216 PolarHBondContact O-N 2.91Å; I216-K218 VanDerWaalsContact C-N 3.31Å; I216-K218 PolarHBondContact O-N 2.66Å; I216-G219 PolarHBondContact O-N 2.93Å; I216-Q220 HydrophobicContact CG2-CG 4.36Å; I216-Q220 WeakPolarHBondContact O-CG 3.33Å; I216-Q220 PolarHBondContact O-N 2.82Å; I216-V276 HydrophobicContact CG1-CG1 4.02Å; I216-V276 HydrophobicContact CG1-CG2 4.49Å; I216-L390 HydrophobicContact CG2-CD1 4.42Å |
| 217 | V | 91.9 | Very high | 91.6 | Very high | 11 Ų | 11 | 43.4 Ų | 43.4 | 7% | 0.067 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -58.7 | -41 | 174.2 | 171.8 | 0 | 0 | 0 | 0 | 111.9 | F213 R221 L390 F399 I401 | F213-V217 HydrophobicContact CD1-CG2 4.13Å; F213-V217 HydrophobicContact CD2-CG2 4.41Å; F213-V217 HydrophobicContact CE1-CG2 3.66Å; F213-V217 HydrophobicContact CE2-CG2 3.98Å; F213-V217 HydrophobicContact CG-CG2 4.49Å; F213-V217 HydrophobicContact CZ-CG2 3.58Å; F213-V217 WeakPolarHBondContact O-CG2 3.45Å; F213-V217 PolarHBondContact O-N 2.96Å; V217-R221 PolarHBondContact O-N 2.74Å; V217-R221 VanDerWaalsContact O-N 3.12Å; V217-L390 HydrophobicContact CG2-CD1 4.48Å; V217-L390 HydrophobicContact CG2-CD2 4.01Å; V217-F399 HydrophobicContact CG1-CB 3.79Å; V217-F399 HydrophobicContact CG1-CD1 3.86Å; V217-F399 HydrophobicContact CG1-CG 3.91Å; V217-I401 HydrophobicContact CG1-CD1 4.47Å |
| 218 | K | 90.7 | Very high | 91.1 | Very high | 133 Ų | 133 | 41.2 Ų | 41.2 | 58% | 0.578 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -64.7 | -46.4 | 174.3 | -72 | 169.9 | -177.7 | 176.1 | 0 | 111.6 | P214 V215 I216 Q220 R221 E222 | P214-K218 WeakPolarHBondContact O-CG 3.3Å; P214-K218 PolarHBondContact O-N 3.31Å; V215-K218 WeakPolarHBondContact O-CB 3.08Å; V215-K218 PolarHBondContact O-N 3.02Å; I216-K218 VanDerWaalsContact C-N 3.31Å; I216-K218 PolarHBondContact O-N 2.66Å; K218-Q220 PolarHBondContact O-N 3.17Å; K218-R221 WeakPolarHBondContact O-CB 3.48Å; K218-R221 PolarHBondContact O-N 2.75Å; K218-E222 WeakPolarHBondContact O-CG 3.34Å; K218-E222 PolarHBondContact O-N 2.93Å; K218-E222 VanDerWaalsContact O-N 3.08Å |
| 219 | G | 89.5 | Confident | 90.8 | Very high | 5 Ų | 5 | 41.3 Ų | 41.3 | 5% | 0.052 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.5 | -43 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | V215 I216 R221 E222 A223 | V215-G219 PolarHBondContact O-N 3.04Å; I216-G219 PolarHBondContact O-N 2.93Å; G219-R221 PolarHBondContact O-N 2.71Å; G219-E222 PolarHBondContact O-N 3.49Å; G219-A223 VanDerWaalsContact O-CB 3.3Å; G219-A223 WeakPolarHBondContact O-CB 3.35Å; G219-A223 PolarHBondContact O-N 2.89Å |
| 220 | Q | 87.4 | Confident | 90.4 | Very high | 71 Ų | 71 | 41.1 Ų | 41.1 | 33% | 0.332 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.8 | -38.8 | 175.9 | -72.2 | -66.6 | -22.9 | 0 | 0 | 112.5 | I216 K218 A224 L390 | I216-Q220 HydrophobicContact CG2-CG 4.36Å; I216-Q220 WeakPolarHBondContact O-CG 3.33Å; I216-Q220 PolarHBondContact O-N 2.82Å; K218-Q220 PolarHBondContact O-N 3.17Å; Q220-A224 WeakPolarHBondContact O-CB 3.21Å; Q220-A224 PolarHBondContact O-N 3.28Å; Q220-L390 HydrophobicContact CG-CD1 4.34Å |
| 221 | R | 89.6 | Confident | 89.8 | Confident | 91 Ų | 91 | 37.9 Ų | 37.9 | 34% | 0.343 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -60.6 | -50.2 | 172.7 | 178.9 | -170.3 | -66.5 | -134.2 | 8.5 | 111.9 | V217 K218 G219 A224 K225 F399 N400 | V217-R221 PolarHBondContact O-N 2.74Å; V217-R221 VanDerWaalsContact O-N 3.12Å; K218-R221 WeakPolarHBondContact O-CB 3.48Å; K218-R221 PolarHBondContact O-N 2.75Å; G219-R221 PolarHBondContact O-N 2.71Å; R221-A224 PolarHBondContact O-N 3.3Å; R221-K225 PolarHBondContact O-N 2.88Å; R221-F399 PolarHBondContact NH2-O 3.47Å; R221-N400 PolarHBondContact NE-O 3.4Å; R221-N400 PolarHBondContact NH2-O 3.34Å |
| 222 | E | 89.4 | Confident | 89.5 | Confident | 29 Ų | 29 | 38.9 Ų | 38.9 | 14% | 0.136 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -70.7 | -32.9 | -176.9 | -59.9 | -59.8 | 107.9 | 0 | 0 | 111.9 | K218 G219 K225 L226 R272 | K218-E222 WeakPolarHBondContact O-CG 3.34Å; K218-E222 PolarHBondContact O-N 2.93Å; K218-E222 VanDerWaalsContact O-N 3.08Å; G219-E222 PolarHBondContact O-N 3.49Å; E222-K225 VanDerWaalsContact CD-NZ 3.27Å; E222-K225 PolarHBondContact O-N 3.3Å; E222-K225 WeakPolarHBondContact OE1-CD 3.26Å; E222-K225 WeakPolarHBondContact OE1-CE 3.4Å; E222-K225 IonicContact OE1-NZ 3.02Å; E222-K225 PolarHBondContact OE1-NZ 2.98Å; E222-K225 IonicContact OE2-NZ 3.88Å; E222-K225 PolarHBondContact OE2-NZ 2.87Å; E222-L226 WeakPolarHBondContact O-CB 3.21Å; E222-L226 PolarHBondContact O-N 3.31Å; E222-R272 HydrophobicContact CB-CB 3.99Å; E222-R272 HydrophobicContact CG-CB 4Å; E222-R272 WeakPolarHBondContact OE2-CD 3.26Å; E222-R272 IonicContact OE2-CZ 3.24Å; E222-R272 IonicContact OE2-NE 2.72Å; E222-R272 IonicContact OE2-NH1 2.64Å; E222-R272 PolarHBondContact OE2-NH1 2.85Å |
| 223 | A | 86.8 | Confident | 89.2 | Confident | 36 Ų | 36 | 38.9 Ų | 38.9 | 30% | 0.298 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -64 | -41 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | G219 L226 N227 | G219-A223 VanDerWaalsContact O-CB 3.3Å; G219-A223 WeakPolarHBondContact O-CB 3.35Å; G219-A223 PolarHBondContact O-N 2.89Å; A223-L226 PolarHBondContact O-N 3.47Å; A223-N227 WeakPolarHBondContact O-CB 3.26Å; A223-N227 PolarHBondContact O-N 3.4Å |
| 224 | A | 87.4 | Confident | 88.8 | Confident | 9 Ų | 9 | 38.1 Ų | 38.1 | 7% | 0.074 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.1 | -44.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q220 R221 L226 N227 N228 I401 P402 | Q220-A224 WeakPolarHBondContact O-CB 3.21Å; Q220-A224 PolarHBondContact O-N 3.28Å; R221-A224 PolarHBondContact O-N 3.3Å; A224-L226 PolarHBondContact O-N 3.49Å; A224-N227 PolarHBondContact O-N 2.91Å; A224-N228 VanDerWaalsContact O-CG 3.25Å; A224-N228 PolarHBondContact O-N 3.43Å; A224-N228 VanDerWaalsContact O-N 3.11Å; A224-N228 PolarHBondContact O-OD1 2.94Å; A224-I401 HydrophobicContact CB-CG2 4.36Å; A224-P402 HydrophobicContact CB-CB 4.18Å; A224-P402 HydrophobicContact CB-CG 4.48Å |
| 225 | K | 88.8 | Confident | 88.6 | Confident | 44 Ų | 44 | 40.5 Ų | 40.5 | 19% | 0.191 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -55.1 | -50.7 | 171.7 | -71.6 | 179.3 | 174.3 | 172.5 | 0 | 111.7 | R221 E222 N227 N228 V229 D267 V268 P402 | R221-K225 PolarHBondContact O-N 2.88Å; E222-K225 VanDerWaalsContact CD-NZ 3.27Å; E222-K225 PolarHBondContact O-N 3.3Å; E222-K225 WeakPolarHBondContact OE1-CD 3.26Å; E222-K225 WeakPolarHBondContact OE1-CE 3.4Å; E222-K225 IonicContact OE1-NZ 3.02Å; E222-K225 PolarHBondContact OE1-NZ 2.98Å; E222-K225 IonicContact OE2-NZ 3.88Å; E222-K225 PolarHBondContact OE2-NZ 2.87Å; K225-N227 VanDerWaalsContact C-N 3.34Å; K225-N227 PolarHBondContact O-N 3.01Å; K225-N228 PolarHBondContact O-N 3.27Å; K225-V229 PolarHBondContact O-N 3.39Å; K225-D267 PolarHBondContact NZ-O 3.2Å; K225-D267 IonicContact NZ-OD2 2.96Å; K225-D267 PolarHBondContact NZ-OD2 3.16Å; K225-V268 HydrophobicContact CB-CG1 3.94Å; K225-P402 HydrophobicContact CG-CG 4.26Å |
| 226 | L | 87.4 | Confident | 88.5 | Confident | 27 Ų | 27 | 40.7 Ų | 40.7 | 14% | 0.141 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.1 | -40.4 | -176.1 | -179.6 | 64.2 | 0 | 0 | 0 | 111.7 | E222 A223 A224 V229 L230 P270 I342 | E222-L226 WeakPolarHBondContact O-CB 3.21Å; E222-L226 PolarHBondContact O-N 3.31Å; A223-L226 PolarHBondContact O-N 3.47Å; A224-L226 PolarHBondContact O-N 3.49Å; L226-V229 PolarHBondContact O-N 2.98Å; L226-L230 PolarHBondContact O-N 3.39Å; L226-P270 HydrophobicContact CD2-CB 4.36Å; L226-I342 HydrophobicContact CD2-CD1 4.17Å; L226-I342 HydrophobicContact CG-CD1 4.36Å |
| 227 | N | 85.7 | Confident | 88.4 | Confident | 2 Ų | 2 | 42.7 Ų | 42.7 | 1% | 0.011 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60.9 | -46 | 174.8 | -166.7 | -25 | 0 | 0 | 0 | 110.7 | A223 A224 K225 V229 L230 G341 I342 R404 H407 | A223-N227 WeakPolarHBondContact O-CB 3.26Å; A223-N227 PolarHBondContact O-N 3.4Å; A224-N227 PolarHBondContact O-N 2.91Å; K225-N227 VanDerWaalsContact C-N 3.34Å; K225-N227 PolarHBondContact O-N 3.01Å; N227-V229 PolarHBondContact O-N 3.44Å; N227-V229 VanDerWaalsContact O-N 3.14Å; N227-L230 WeakPolarHBondContact O-CB 3.41Å; N227-L230 PolarHBondContact O-N 2.98Å; N227-L230 VanDerWaalsContact O-N 3.08Å; N227-G341 PolarHBondContact ND2-O 2.98Å; N227-I342 HydrophobicContact CB-CG1 4.06Å; N227-R404 HydrophobicContact CB-CG 4.43Å; N227-R404 WeakPolarHBondContact ND2-CD 3.25Å; N227-R404 PolarHBondContact ND2-NE 2.95Å; N227-H407 PolarHBondContact O-CD2 3.35Å; N227-H407 PolarHBondContact O-NE2 3.5Å |
| 228 | N | 88.1 | Confident | 88.1 | Confident | 46 Ų | 46 | 46 Ų | 46 | 25% | 0.246 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.4 | -29 | -177.7 | -68.7 | -1.5 | 0 | 0 | 0 | 114.3 | A224 K225 E403 R404 V405 H407 | A224-N228 VanDerWaalsContact O-CG 3.25Å; A224-N228 PolarHBondContact O-N 3.43Å; A224-N228 VanDerWaalsContact O-N 3.11Å; A224-N228 PolarHBondContact O-OD1 2.94Å; K225-N228 PolarHBondContact O-N 3.27Å; N228-E403 PolarHBondContact ND2-O 2.85Å; N228-E403 PolarHBondContact OD1-O 3.18Å; N228-R404 WeakPolarHBondContact OD1-CA 3.43Å; N228-V405 HydrophobicContact CB-CG2 4.26Å; N228-V405 PolarHBondContact OD1-N 3.38Å; N228-H407 PolarHBondContact O-CE1 2.92Å; N228-H407 VanDerWaalsContact O-CE1 3.31Å; N228-H407 PolarHBondContact O-NE2 2.68Å |
| 229 | V | 89.6 | Confident | 88 | Confident | 20 Ų | 20 | 46 Ų | 46 | 12% | 0.121 | 23% | 0.229 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -105.9 | 6.2 | 177.3 | -55.8 | 0 | 0 | 0 | 0 | 114.2 | K225 L226 N227 E232 M233 F262 H266 V268 | K225-V229 PolarHBondContact O-N 3.39Å; L226-V229 PolarHBondContact O-N 2.98Å; N227-V229 PolarHBondContact O-N 3.44Å; N227-V229 VanDerWaalsContact O-N 3.14Å; V229-E232 PolarHBondContact O-N 2.9Å; V229-M233 HydrophobicContact CG2-CG 3.99Å; V229-M233 PolarHBondContact O-N 2.96Å; V229-F262 HydrophobicContact CB-CE1 4.01Å; V229-F262 HydrophobicContact CB-CZ 4.14Å; V229-F262 HydrophobicContact CG2-CE1 4.2Å; V229-H266 HydrophobicContact CG1-CB 4.3Å; V229-V268 HydrophobicContact CG2-CB 4.36Å; V229-V268 HydrophobicContact CG2-CG1 3.79Å; V229-V268 HydrophobicContact CG2-CG2 3.94Å |
| 230 | L | 86.6 | Confident | 88 | Confident | 14 Ų | 14 | 47.2 Ų | 47.2 | 7% | 0.073 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -51.6 | -50.7 | -175.8 | -178.2 | 77 | 0 | 0 | 0 | 115.2 | L226 N227 E232 M233 T234 I342 L412 | L226-L230 PolarHBondContact O-N 3.39Å; N227-L230 WeakPolarHBondContact O-CB 3.41Å; N227-L230 PolarHBondContact O-N 2.98Å; N227-L230 VanDerWaalsContact O-N 3.08Å; L230-E232 PolarHBondContact O-N 3.09Å; L230-M233 WeakPolarHBondContact O-CB 3.32Å; L230-M233 PolarHBondContact O-N 2.72Å; L230-T234 PolarHBondContact O-N 3.3Å; L230-T234 PolarHBondContact O-OG1 3.15Å; L230-I342 HydrophobicContact CD1-CD1 4.18Å; L230-I342 HydrophobicContact CD1-CG1 4.47Å; L230-I342 HydrophobicContact CD1-CG2 4.11Å; L230-I342 HydrophobicContact CD2-CB 4.44Å; L230-I342 HydrophobicContact CD2-CG1 4.38Å; L230-I342 HydrophobicContact CD2-CG2 3.42Å; L230-I342 VanDerWaalsContact CD2-CG2 3.42Å; L230-I342 HydrophobicContact CG-CG2 4.42Å; L230-L412 HydrophobicContact CD2-CD2 3.93Å |
| 231 | P | 85.6 | Confident | 87.9 | Confident | 14 Ų | 14 | 46 Ų | 46 | 9% | 0.091 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -67.3 | -26.3 | -174.8 | 27.7 | -36.8 | 0 | 0 | 0 | 112.8 | K235 H407 A411 | P231-K235 WeakPolarHBondContact O-CD 3.29Å; P231-K235 VanDerWaalsContact O-CG 3.25Å; P231-K235 WeakPolarHBondContact O-CG 3.22Å; P231-K235 PolarHBondContact O-N 2.88Å; P231-H407 WeakPolarHBondContact CD-NE2 3.19Å; P231-A411 VanDerWaalsContact CB-O 3.25Å; P231-A411 WeakPolarHBondContact CB-O 3.32Å |
| 232 | E | 88.6 | Confident | 87.8 | Confident | 99 Ų | 99 | 48.1 Ų | 48.1 | 46% | 0.463 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -77.9 | -46.2 | 174 | -66.2 | 179.6 | -172.4 | 0 | 0 | 110.7 | V229 L230 T234 K235 L236 F262 | V229-E232 PolarHBondContact O-N 2.9Å; L230-E232 PolarHBondContact O-N 3.09Å; E232-T234 PolarHBondContact O-N 3.06Å; E232-K235 PolarHBondContact O-N 3.05Å; E232-K235 VanDerWaalsContact O-N 3.11Å; E232-L236 WeakPolarHBondContact O-CD1 3.09Å; E232-L236 PolarHBondContact O-N 2.66Å; E232-F262 HydrophobicContact CB-CE1 4.37Å; E232-F262 HydrophobicContact CB-CE2 3.96Å; E232-F262 HydrophobicContact CB-CZ 3.61Å; E232-F262 WeakPolarHBondContact OE2-CE2 3.49Å; E232-F262 VanDerWaalsContact OE2-CZ 3.26Å; E232-F262 WeakPolarHBondContact OE2-CZ 3.31Å |
| 233 | M | 88.5 | Confident | 87.8 | Confident | 16 Ų | 16 | 47.1 Ų | 47.1 | 8% | 0.079 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -51.3 | -43.4 | 170.9 | -80.9 | -71.7 | -62.1 | 0 | 0 | 112.4 | V229 L230 T237 L259 F262 Q263 V268 | V229-M233 HydrophobicContact CG2-CG 3.99Å; V229-M233 PolarHBondContact O-N 2.96Å; L230-M233 WeakPolarHBondContact O-CB 3.32Å; L230-M233 PolarHBondContact O-N 2.72Å; M233-T237 WeakPolarHBondContact O-CB 3.46Å; M233-T237 PolarHBondContact O-N 2.95Å; M233-T237 PolarHBondContact O-OG1 2.83Å; M233-L259 HydrophobicContact CE-CD1 4.09Å; M233-L259 HydrophobicContact SD-CD1 3.98Å; M233-F262 HydrophobicContact CG-CD1 4.17Å; M233-F262 HydrophobicContact CG-CE1 3.85Å; M233-F262 HydrophobicContact SD-CD1 3.72Å; M233-F262 HydrophobicContact SD-CE1 4.02Å; M233-Q263 HydrophobicContact CE-CG 3.79Å; M233-Q263 HydrophobicContact SD-CG 3.6Å; M233-Q263 VanDerWaalsContact SD-CG 3.6Å; M233-V268 HydrophobicContact SD-CG2 4.28Å |
| 234 | T | 86 | Confident | 87.6 | Confident | 23 Ų | 23 | 48.3 Ų | 48.3 | 14% | 0.141 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.4 | -54.3 | 174.1 | -71.1 | 0 | 0 | 0 | 0 | 111.4 | L230 E232 L236 T237 D238 P413 | L230-T234 PolarHBondContact O-N 3.3Å; L230-T234 PolarHBondContact O-OG1 3.15Å; E232-T234 PolarHBondContact O-N 3.06Å; T234-L236 PolarHBondContact O-N 3.09Å; T234-L236 VanDerWaalsContact O-N 3.16Å; T234-T237 CarbonylContact O-C 3.58Å; T234-T237 WeakPolarHBondContact O-CA 3.33Å; T234-T237 WeakPolarHBondContact O-CB 3.31Å; T234-T237 PolarHBondContact O-N 3.13Å; T234-D238 WeakPolarHBondContact CG2-OD2 3.26Å; T234-D238 PolarHBondContact O-N 3.18Å; T234-P413 HydrophobicContact CG2-CB 3.76Å; T234-P413 HydrophobicContact CG2-CG 3.77Å |
| 235 | K | 89.1 | Confident | 87.4 | Confident | 121 Ų | 121 | 53.5 Ų | 53.5 | 53% | 0.526 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -56 | -35.6 | -179.8 | -72.7 | 166.7 | -174.7 | 177.8 | 0 | 113.4 | P231 E232 K239 | P231-K235 WeakPolarHBondContact O-CD 3.29Å; P231-K235 VanDerWaalsContact O-CG 3.25Å; P231-K235 WeakPolarHBondContact O-CG 3.22Å; P231-K235 PolarHBondContact O-N 2.88Å; E232-K235 PolarHBondContact O-N 3.05Å; E232-K235 VanDerWaalsContact O-N 3.11Å; K235-K239 WeakPolarHBondContact O-CG 3.44Å; K235-K239 PolarHBondContact O-N 3.25Å |
| 236 | L | 90.3 | Very high | 87.2 | Confident | 39 Ų | 39 | 54.9 Ų | 54.9 | 20% | 0.204 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -75.3 | -35.4 | 174.8 | -80.8 | 81.1 | 0 | 0 | 0 | 112.3 | E232 T234 M240 D258 L259 F262 | E232-L236 WeakPolarHBondContact O-CD1 3.09Å; E232-L236 PolarHBondContact O-N 2.66Å; T234-L236 PolarHBondContact O-N 3.09Å; T234-L236 VanDerWaalsContact O-N 3.16Å; L236-M240 WeakPolarHBondContact O-CB 3.4Å; L236-M240 PolarHBondContact O-N 2.96Å; L236-M240 VanDerWaalsContact O-N 3.09Å; L236-D258 HydrophobicContact CD2-CB 4.22Å; L236-L259 HydrophobicContact CB-CB 4.25Å; L236-L259 HydrophobicContact CB-CD1 3.85Å; L236-L259 HydrophobicContact CD2-CB 4.46Å; L236-F262 HydrophobicContact CD2-CB 3.8Å; L236-F262 HydrophobicContact CD2-CD2 4.38Å; L236-F262 HydrophobicContact CD2-CG 4.18Å |
| 237 | T | 88.5 | Confident | 86.9 | Confident | 46 Ų | 46 | 55.8 Ų | 55.8 | 28% | 0.282 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -65.2 | -39.9 | 173.9 | -58.1 | 0 | 0 | 0 | 0 | 111.7 | M233 T234 M240 N241 | M233-T237 WeakPolarHBondContact O-CB 3.46Å; M233-T237 PolarHBondContact O-N 2.95Å; M233-T237 PolarHBondContact O-OG1 2.83Å; T234-T237 CarbonylContact O-C 3.58Å; T234-T237 WeakPolarHBondContact O-CA 3.33Å; T234-T237 WeakPolarHBondContact O-CB 3.31Å; T234-T237 PolarHBondContact O-N 3.13Å; T237-M240 HydrophobicContact CG2-CE 4.28Å; T237-M240 WeakPolarHBondContact O-CB 3.49Å; T237-M240 PolarHBondContact O-N 2.98Å; T237-N241 VanDerWaalsContact O-CG 3.3Å; T237-N241 PolarHBondContact O-N 3.31Å; T237-N241 PolarHBondContact O-ND2 3.29Å; T237-N241 VanDerWaalsContact O-ND2 3.15Å |
| 238 | D | 87.3 | Confident | 87 | Confident | 80 Ų | 80 | 58.5 Ų | 58.5 | 43% | 0.428 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -68.6 | -44.9 | 179.8 | -64.1 | -27.8 | 0 | 0 | 0 | 111.3 | T234 M240 N241 E242 | T234-D238 WeakPolarHBondContact CG2-OD2 3.26Å; T234-D238 PolarHBondContact O-N 3.18Å; D238-M240 VanDerWaalsContact C-N 3.29Å; D238-M240 PolarHBondContact O-N 3.44Å; D238-N241 CarbonylContact O-C 3.53Å; D238-N241 WeakPolarHBondContact O-CA 3.48Å; D238-N241 WeakPolarHBondContact O-CB 3.39Å; D238-N241 PolarHBondContact O-N 3.42Å; D238-E242 WeakPolarHBondContact O-CB 3.48Å; D238-E242 PolarHBondContact O-N 2.85Å |
| 239 | K | 88.8 | Confident | 86.8 | Confident | 134 Ų | 134 | 62.8 Ų | 62.8 | 58% | 0.583 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -56.9 | -40.4 | 170.9 | -75.2 | 178.1 | 175.3 | -172.1 | 0 | 112.9 | K235 E242 A243 | K235-K239 WeakPolarHBondContact O-CG 3.44Å; K235-K239 PolarHBondContact O-N 3.25Å; K239-E242 PolarHBondContact O-N 3.16Å; K239-A243 WeakPolarHBondContact O-CB 3.34Å; K239-A243 PolarHBondContact O-N 3.46Å |
| 240 | M | 89.3 | Confident | 86.9 | Confident | 30 Ų | 30 | 70.1 Ų | 70.1 | 15% | 0.148 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -65.4 | -38.5 | 174.8 | -179.8 | -158.2 | 68 | 0 | 0 | 111.6 | L236 T237 D238 K244 F252 A255 Y256 L259 | L236-M240 WeakPolarHBondContact O-CB 3.4Å; L236-M240 PolarHBondContact O-N 2.96Å; L236-M240 VanDerWaalsContact O-N 3.09Å; T237-M240 HydrophobicContact CG2-CE 4.28Å; T237-M240 WeakPolarHBondContact O-CB 3.49Å; T237-M240 PolarHBondContact O-N 2.98Å; D238-M240 VanDerWaalsContact C-N 3.29Å; D238-M240 PolarHBondContact O-N 3.44Å; M240-K244 WeakPolarHBondContact O-CB 3.49Å; M240-K244 PolarHBondContact O-N 3.43Å; M240-F252 HydrophobicContact CG-CD2 4.03Å; M240-F252 HydrophobicContact CG-CE2 3.66Å; M240-F252 HydrophobicContact SD-CE2 4.36Å; M240-A255 HydrophobicContact CB-CB 4.05Å; M240-Y256 HydrophobicContact SD-CD2 4.03Å; M240-L259 HydrophobicContact CE-CD2 4.49Å; M240-L259 HydrophobicContact SD-CD2 3.89Å |
| 241 | N | 85.2 | Confident | 87.1 | Confident | 45 Ų | 45 | 73.9 Ų | 73.9 | 24% | 0.241 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -70.9 | -34.8 | 176.2 | -72.2 | -37.1 | 0 | 0 | 0 | 112.9 | T237 D238 Q245 | T237-N241 VanDerWaalsContact O-CG 3.3Å; T237-N241 PolarHBondContact O-N 3.31Å; T237-N241 PolarHBondContact O-ND2 3.29Å; T237-N241 VanDerWaalsContact O-ND2 3.15Å; D238-N241 CarbonylContact O-C 3.53Å; D238-N241 WeakPolarHBondContact O-CA 3.48Å; D238-N241 WeakPolarHBondContact O-CB 3.39Å; D238-N241 PolarHBondContact O-N 3.42Å; N241-Q245 WeakPolarHBondContact O-CG 3.35Å; N241-Q245 PolarHBondContact O-N 3.23Å; N241-Q245 VanDerWaalsContact O-N 3.13Å; N241-Q245 PolarHBondContact O-NE2 3.48Å; N241-Q245 VanDerWaalsContact O-NE2 3.09Å |
| 242 | E | 87.5 | Confident | 87.4 | Confident | 136 Ų | 136 | 76.5 Ų | 76.5 | 64% | 0.636 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -66.9 | -51.7 | 174.9 | -177.6 | 176.6 | -156.7 | 0 | 0 | 110.9 | D238 K239 K244 Q245 S246 | D238-E242 WeakPolarHBondContact O-CB 3.48Å; D238-E242 PolarHBondContact O-N 2.85Å; K239-E242 PolarHBondContact O-N 3.16Å; E242-K244 PolarHBondContact O-N 2.8Å; E242-Q245 CarbonylContact O-C 3.56Å; E242-Q245 WeakPolarHBondContact O-CA 3.48Å; E242-Q245 WeakPolarHBondContact O-CB 3.24Å; E242-Q245 PolarHBondContact O-N 3.12Å; E242-S246 PolarHBondContact O-N 3.17Å |
| 243 | A | 88 | Confident | 87.6 | Confident | 8 Ų | 8 | 74.5 Ų | 74.5 | 7% | 0.066 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.4 | -28.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | K239 S246 G247 N248 E251 F252 | K239-A243 WeakPolarHBondContact O-CB 3.34Å; K239-A243 PolarHBondContact O-N 3.46Å; A243-S246 PolarHBondContact O-OG 2.78Å; A243-S246 VanDerWaalsContact O-OG 3.04Å; A243-G247 PolarHBondContact O-N 3.13Å; A243-N248 PolarHBondContact O-N 2.88Å; A243-E251 HydrophobicContact CB-CB 3.72Å; A243-F252 HydrophobicContact CB-CB 4.3Å |
| 244 | K | 83.1 | Confident | 87.8 | Confident | 61 Ų | 61 | 79.2 Ų | 79.2 | 27% | 0.265 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -70 | -35.4 | 171.1 | -169.3 | -177.6 | -177.9 | -175.4 | 0 | 112.3 | M240 E242 F252 | M240-K244 WeakPolarHBondContact O-CB 3.49Å; M240-K244 PolarHBondContact O-N 3.43Å; E242-K244 PolarHBondContact O-N 2.8Å; K244-F252 HydrophobicContact CB-CD2 3.76Å; K244-F252 HydrophobicContact CB-CE2 4Å; K244-F252 HydrophobicContact CD-CE2 4.24Å; K244-F252 HydrophobicContact CG-CD2 4.27Å; K244-F252 HydrophobicContact CG-CE2 4.2Å |
| 245 | Q | 83.6 | Confident | 88.2 | Confident | 118 Ų | 118 | 78.7 Ų | 78.7 | 55% | 0.551 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -77.3 | -33.7 | 178.1 | -74.7 | 169.8 | 68.2 | 0 | 0 | 112.5 | N241 E242 G247 L431 | N241-Q245 WeakPolarHBondContact O-CG 3.35Å; N241-Q245 PolarHBondContact O-N 3.23Å; N241-Q245 VanDerWaalsContact O-N 3.13Å; N241-Q245 PolarHBondContact O-NE2 3.48Å; N241-Q245 VanDerWaalsContact O-NE2 3.09Å; E242-Q245 CarbonylContact O-C 3.56Å; E242-Q245 WeakPolarHBondContact O-CA 3.48Å; E242-Q245 WeakPolarHBondContact O-CB 3.24Å; E242-Q245 PolarHBondContact O-N 3.12Å; Q245-G247 PolarHBondContact O-N 3.46Å; Q245-L431 HydrophobicContact CG-CD2 4.4Å |
| 246 | S | 85.3 | Confident | 88.4 | Confident | 74 Ų | 74 | 79 Ų | 79 | 52% | 0.517 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | -18.2 | 172.3 | 74.3 | 0 | 0 | 0 | 0 | 113 | E242 A243 N248 | E242-S246 PolarHBondContact O-N 3.17Å; A243-S246 PolarHBondContact O-OG 2.78Å; A243-S246 VanDerWaalsContact O-OG 3.04Å; S246-N248 PolarHBondContact O-N 3.23Å; S246-N248 WeakPolarHBondContact OG-CB 3.3Å; S246-N248 PolarHBondContact OG-N 3.34Å |
| 247 | G | 81 | Confident | 88.6 | Confident | 45 Ų | 45 | 80.4 Ų | 80.4 | 46% | 0.464 | 41% | 0.408 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.2 | 1.9 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | A243 Q245 K249 | A243-G247 PolarHBondContact O-N 3.13Å; Q245-G247 PolarHBondContact O-N 3.46Å; G247-K249 PolarHBondContact O-N 3.39Å |
| 248 | N | 86.3 | Confident | 88.9 | Confident | 59 Ų | 59 | 81.9 Ų | 81.9 | 32% | 0.316 | 41% | 0.414 | S | S | . | . | trans | -74.7 | 98.8 | -179.6 | -173 | -17.1 | 0 | 0 | 0 | 110.9 | A243 S246 Y250 E251 F252 | A243-N248 PolarHBondContact O-N 2.88Å; S246-N248 PolarHBondContact O-N 3.23Å; S246-N248 WeakPolarHBondContact OG-CB 3.3Å; S246-N248 PolarHBondContact OG-N 3.34Å; N248-Y250 PolarHBondContact O-N 3.12Å; N248-Y250 WeakPolarHBondContact OD1-CB 3.33Å; N248-Y250 PolarHBondContact OD1-N 2.93Å; N248-E251 HydrophobicContact CB-CB 4.08Å; N248-E251 HydrophobicContact CB-CG 4.32Å; N248-E251 WeakPolarHBondContact CB-OE2 3.29Å; N248-E251 WeakPolarHBondContact ND2-CG 3.44Å; N248-E251 PolarHBondContact ND2-OE1 3.46Å; N248-E251 PolarHBondContact ND2-OE2 2.85Å; N248-E251 PolarHBondContact O-N 3.08Å; N248-E251 PolarHBondContact OD1-N 3.25Å; N248-F252 WeakPolarHBondContact O-CB 3.36Å; N248-F252 PolarHBondContact O-N 3.39Å | ||
| 249 | K | 85.8 | Confident | 89.2 | Confident | 137 Ų | 137 | 78.6 Ų | 78.6 | 60% | 0.596 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -58.3 | -31.8 | -179.5 | -60.3 | -168.1 | -177.1 | -168.4 | 0 | 113.6 | G247 A253 E439 | G247-K249 PolarHBondContact O-N 3.39Å; K249-A253 VanDerWaalsContact O-CB 3.26Å; K249-A253 WeakPolarHBondContact O-CB 3.48Å; K249-A253 PolarHBondContact O-N 3.4Å; K249-E439 WeakPolarHBondContact CE-OE1 3.36Å; K249-E439 IonicContact NZ-OE1 2.77Å; K249-E439 PolarHBondContact NZ-OE1 2.94Å |
| 250 | Y | 90.8 | Very high | 89.5 | Confident | 173 Ų | 173 | 74.5 Ų | 74.5 | 68% | 0.678 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -72.2 | -47.4 | 179.5 | 176.8 | -94.5 | 0 | 0 | 0 | 111.2 | N248 F252 A253 K254 | N248-Y250 PolarHBondContact O-N 3.12Å; N248-Y250 WeakPolarHBondContact OD1-CB 3.33Å; N248-Y250 PolarHBondContact OD1-N 2.93Å; Y250-F252 VanDerWaalsContact C-N 3.34Å; Y250-F252 PolarHBondContact O-N 2.9Å; Y250-A253 PolarHBondContact O-N 3.2Å; Y250-K254 WeakPolarHBondContact O-CB 3.29Å; Y250-K254 PolarHBondContact O-N 2.89Å |
| 251 | E | 91.1 | Very high | 89.7 | Confident | 93 Ų | 93 | 78.3 Ų | 78.3 | 44% | 0.435 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.1 | -40.5 | 174.5 | -75.7 | 165.2 | -172.5 | 0 | 0 | 111.8 | A243 N248 K254 A255 | A243-E251 HydrophobicContact CB-CB 3.72Å; N248-E251 HydrophobicContact CB-CB 4.08Å; N248-E251 HydrophobicContact CB-CG 4.32Å; N248-E251 WeakPolarHBondContact CB-OE2 3.29Å; N248-E251 WeakPolarHBondContact ND2-CG 3.44Å; N248-E251 PolarHBondContact ND2-OE1 3.46Å; N248-E251 PolarHBondContact ND2-OE2 2.85Å; N248-E251 PolarHBondContact O-N 3.08Å; N248-E251 PolarHBondContact OD1-N 3.25Å; E251-K254 PolarHBondContact O-N 3.34Å; E251-A255 WeakPolarHBondContact O-CB 3.26Å; E251-A255 PolarHBondContact O-N 3.46Å |
| 252 | F | 91.3 | Very high | 90.2 | Very high | 70 Ų | 70 | 77.2 Ų | 77.2 | 31% | 0.307 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 176.2 | 177.6 | -101.2 | 0 | 0 | 0 | 111.6 | M240 A243 K244 N248 Y250 K254 A255 Y256 | M240-F252 HydrophobicContact CG-CD2 4.03Å; M240-F252 HydrophobicContact CG-CE2 3.66Å; M240-F252 HydrophobicContact SD-CE2 4.36Å; A243-F252 HydrophobicContact CB-CB 4.3Å; K244-F252 HydrophobicContact CB-CD2 3.76Å; K244-F252 HydrophobicContact CB-CE2 4Å; K244-F252 HydrophobicContact CD-CE2 4.24Å; K244-F252 HydrophobicContact CG-CD2 4.27Å; K244-F252 HydrophobicContact CG-CE2 4.2Å; N248-F252 WeakPolarHBondContact O-CB 3.36Å; N248-F252 PolarHBondContact O-N 3.39Å; Y250-F252 VanDerWaalsContact C-N 3.34Å; Y250-F252 PolarHBondContact O-N 2.9Å; F252-K254 VanDerWaalsContact C-N 3.33Å; F252-K254 PolarHBondContact O-N 3.21Å; F252-A255 PolarHBondContact O-N 3.08Å; F252-Y256 WeakPolarHBondContact O-CB 3.5Å; F252-Y256 PolarHBondContact O-N 3.32Å |
| 253 | A | 92 | Very high | 90.5 | Very high | 57 Ų | 57 | 73 Ų | 73 | 47% | 0.471 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.1 | -39.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | K249 Y250 S257 | K249-A253 VanDerWaalsContact O-CB 3.26Å; K249-A253 WeakPolarHBondContact O-CB 3.48Å; K249-A253 PolarHBondContact O-N 3.4Å; Y250-A253 PolarHBondContact O-N 3.2Å; A253-S257 VanDerWaalsContact O-CB 3.31Å; A253-S257 WeakPolarHBondContact O-CB 3.42Å; A253-S257 PolarHBondContact O-N 2.91Å |
| 254 | K | 94.4 | Very high | 90.8 | Very high | 115 Ų | 115 | 79.7 Ų | 79.7 | 50% | 0.5 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -64.1 | -54.4 | 175.3 | -176.1 | 179.2 | 177.4 | -179.1 | 0 | 111.7 | Y250 E251 F252 Y256 S257 D258 | Y250-K254 WeakPolarHBondContact O-CB 3.29Å; Y250-K254 PolarHBondContact O-N 2.89Å; E251-K254 PolarHBondContact O-N 3.34Å; F252-K254 VanDerWaalsContact C-N 3.33Å; F252-K254 PolarHBondContact O-N 3.21Å; K254-Y256 VanDerWaalsContact C-N 3.3Å; K254-Y256 PolarHBondContact O-N 3.19Å; K254-S257 CarbonylContact O-C 3.52Å; K254-S257 WeakPolarHBondContact O-CA 3.18Å; K254-S257 WeakPolarHBondContact O-CB 3.35Å; K254-S257 PolarHBondContact O-N 2.96Å; K254-D258 VanDerWaalsContact O-CG 3.3Å; K254-D258 PolarHBondContact O-N 3.16Å |
| 255 | A | 93.7 | Very high | 91.3 | Very high | 12 Ų | 12 | 84.5 Ų | 84.5 | 10% | 0.099 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -62 | -36.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | M240 E251 F252 L259 | M240-A255 HydrophobicContact CB-CB 4.05Å; E251-A255 WeakPolarHBondContact O-CB 3.26Å; E251-A255 PolarHBondContact O-N 3.46Å; F252-A255 PolarHBondContact O-N 3.08Å; A255-L259 VanDerWaalsContact O-CB 3.3Å; A255-L259 WeakPolarHBondContact O-CB 3.37Å; A255-L259 PolarHBondContact O-N 2.92Å |
| 256 | Y | 92.8 | Very high | 91.7 | Very high | 127 Ų | 127 | 82.2 Ų | 82.2 | 50% | 0.498 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.8 | -41.5 | 171.9 | -179.4 | -97 | 0 | 0 | 0 | 112.3 | M240 F252 K254 N260 | M240-Y256 HydrophobicContact SD-CD2 4.03Å; F252-Y256 WeakPolarHBondContact O-CB 3.5Å; F252-Y256 PolarHBondContact O-N 3.32Å; K254-Y256 VanDerWaalsContact C-N 3.3Å; K254-Y256 PolarHBondContact O-N 3.19Å; Y256-N260 VanDerWaalsContact O-CB 3.26Å; Y256-N260 WeakPolarHBondContact O-CB 3.5Å; Y256-N260 PolarHBondContact O-N 2.93Å |
| 257 | S | 95 | Very high | 92 | Very high | 69 Ų | 69 | 82.3 Ų | 82.3 | 48% | 0.483 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.7 | -47.2 | 174.3 | -169.4 | 0 | 0 | 0 | 0 | 111.5 | A253 K254 L259 N260 L261 | A253-S257 VanDerWaalsContact O-CB 3.31Å; A253-S257 WeakPolarHBondContact O-CB 3.42Å; A253-S257 PolarHBondContact O-N 2.91Å; K254-S257 CarbonylContact O-C 3.52Å; K254-S257 WeakPolarHBondContact O-CA 3.18Å; K254-S257 WeakPolarHBondContact O-CB 3.35Å; K254-S257 PolarHBondContact O-N 2.96Å; S257-L259 PolarHBondContact O-N 2.99Å; S257-N260 PolarHBondContact O-N 3.38Å; S257-L261 VanDerWaalsContact O-CB 3.3Å; S257-L261 WeakPolarHBondContact O-CB 3.33Å; S257-L261 PolarHBondContact O-N 3.49Å |
| 258 | D | 94.9 | Very high | 92.4 | Very high | 76 Ų | 76 | 80.6 Ų | 80.6 | 41% | 0.406 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -58.7 | -45.7 | 177.4 | -67.6 | -21.5 | 0 | 0 | 0 | 111 | L236 K254 N260 L261 F262 | L236-D258 HydrophobicContact CD2-CB 4.22Å; K254-D258 VanDerWaalsContact O-CG 3.3Å; K254-D258 PolarHBondContact O-N 3.16Å; D258-N260 PolarHBondContact O-N 3.45Å; D258-L261 PolarHBondContact O-N 2.81Å; D258-F262 VanDerWaalsContact O-CB 3.31Å; D258-F262 WeakPolarHBondContact O-CB 3.38Å; D258-F262 PolarHBondContact O-N 3.03Å |
| 259 | L | 93.9 | Very high | 92.5 | Very high | 12 Ų | 12 | 80.6 Ų | 80.6 | 6% | 0.063 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -63 | -40.3 | 176.8 | 177.4 | 60.6 | 0 | 0 | 0 | 112.4 | M233 L236 M240 A255 S257 Q263 | M233-L259 HydrophobicContact CE-CD1 4.09Å; M233-L259 HydrophobicContact SD-CD1 3.98Å; L236-L259 HydrophobicContact CB-CB 4.25Å; L236-L259 HydrophobicContact CB-CD1 3.85Å; L236-L259 HydrophobicContact CD2-CB 4.46Å; M240-L259 HydrophobicContact CE-CD2 4.49Å; M240-L259 HydrophobicContact SD-CD2 3.89Å; A255-L259 VanDerWaalsContact O-CB 3.3Å; A255-L259 WeakPolarHBondContact O-CB 3.37Å; A255-L259 PolarHBondContact O-N 2.92Å; S257-L259 PolarHBondContact O-N 2.99Å; L259-Q263 WeakPolarHBondContact O-CG 3.28Å; L259-Q263 PolarHBondContact O-N 3.2Å |
| 260 | N | 94 | Very high | 92.3 | Very high | 48 Ų | 48 | 77.1 Ų | 77.1 | 26% | 0.257 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -72.5 | -38.2 | 178.9 | -167.3 | -20.5 | 0 | 0 | 0 | 111.6 | Y256 S257 D258 Q263 K264 | Y256-N260 VanDerWaalsContact O-CB 3.26Å; Y256-N260 WeakPolarHBondContact O-CB 3.5Å; Y256-N260 PolarHBondContact O-N 2.93Å; S257-N260 PolarHBondContact O-N 3.38Å; D258-N260 PolarHBondContact O-N 3.45Å; N260-Q263 PolarHBondContact O-N 3.34Å; N260-K264 WeakPolarHBondContact O-CB 3.4Å; N260-K264 WeakPolarHBondContact O-CD 3.47Å; N260-K264 VanDerWaalsContact O-CG 3.32Å; N260-K264 WeakPolarHBondContact O-CG 3.3Å; N260-K264 PolarHBondContact O-N 2.97Å; N260-K264 WeakPolarHBondContact OD1-CE 3.26Å; N260-K264 PolarHBondContact OD1-NZ 3.47Å |
| 261 | L | 94.9 | Very high | 92.1 | Very high | 110 Ų | 110 | 75.1 Ų | 75.1 | 58% | 0.576 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -65.7 | -40.4 | 172.9 | -177.4 | 142.4 | 0 | 0 | 0 | 111.3 | S257 D258 K264 K265 | S257-L261 VanDerWaalsContact O-CB 3.3Å; S257-L261 WeakPolarHBondContact O-CB 3.33Å; S257-L261 PolarHBondContact O-N 3.49Å; D258-L261 PolarHBondContact O-N 2.81Å; L261-K264 PolarHBondContact O-N 2.97Å; L261-K265 VanDerWaalsContact O-CB 3.28Å; L261-K265 WeakPolarHBondContact O-CB 3.41Å; L261-K265 PolarHBondContact O-N 2.94Å |
| 262 | F | 94.9 | Very high | 91.8 | Very high | 22 Ų | 22 | 75 Ų | 75 | 10% | 0.096 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.1 | -50.5 | 173.3 | -173.4 | -84.4 | 0 | 0 | 0 | 111.8 | V229 E232 M233 L236 D258 K264 K265 H266 | V229-F262 HydrophobicContact CB-CE1 4.01Å; V229-F262 HydrophobicContact CB-CZ 4.14Å; V229-F262 HydrophobicContact CG2-CE1 4.2Å; E232-F262 HydrophobicContact CB-CE1 4.37Å; E232-F262 HydrophobicContact CB-CE2 3.96Å; E232-F262 HydrophobicContact CB-CZ 3.61Å; E232-F262 WeakPolarHBondContact OE2-CE2 3.49Å; E232-F262 VanDerWaalsContact OE2-CZ 3.26Å; E232-F262 WeakPolarHBondContact OE2-CZ 3.31Å; M233-F262 HydrophobicContact CG-CD1 4.17Å; M233-F262 HydrophobicContact CG-CE1 3.85Å; M233-F262 HydrophobicContact SD-CD1 3.72Å; M233-F262 HydrophobicContact SD-CE1 4.02Å; L236-F262 HydrophobicContact CD2-CB 3.8Å; L236-F262 HydrophobicContact CD2-CD2 4.38Å; L236-F262 HydrophobicContact CD2-CG 4.18Å; D258-F262 VanDerWaalsContact O-CB 3.31Å; D258-F262 WeakPolarHBondContact O-CB 3.38Å; D258-F262 PolarHBondContact O-N 3.03Å; F262-K264 VanDerWaalsContact C-N 3.29Å; F262-K264 PolarHBondContact O-N 3.24Å; F262-K265 PolarHBondContact O-N 3.21Å; F262-K265 VanDerWaalsContact O-N 3.16Å; F262-H266 AromaticContact CE1-CD2 3.97Å; F262-H266 AromaticContact CE2-CD2 3.78Å; F262-H266 AromaticContact CE2-NE2 3.61Å; F262-H266 AromaticContact CZ-CD2 3.75Å; F262-H266 AromaticContact CZ-NE2 3.84Å; F262-H266 PolarHBondContact O-CD2 3.27Å; F262-H266 PolarHBondContact O-N 3.17Å |
| 263 | Q | 93.4 | Very high | 91.2 | Very high | 47 Ų | 47 | 73 Ų | 73 | 22% | 0.22 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -55.5 | -43.5 | 176.7 | -76.7 | 175.8 | 43.7 | 0 | 0 | 112.4 | M233 L259 N260 D267 V268 | M233-Q263 HydrophobicContact CE-CG 3.79Å; M233-Q263 HydrophobicContact SD-CG 3.6Å; M233-Q263 VanDerWaalsContact SD-CG 3.6Å; L259-Q263 WeakPolarHBondContact O-CG 3.28Å; L259-Q263 PolarHBondContact O-N 3.2Å; N260-Q263 PolarHBondContact O-N 3.34Å; Q263-D267 PolarHBondContact O-N 2.83Å; Q263-D267 VanDerWaalsContact O-N 3.13Å; Q263-V268 HydrophobicContact CB-CG2 4.45Å; Q263-V268 WeakPolarHBondContact CB-O 3.4Å; Q263-V268 HydrophobicContact CG-CG2 4.33Å; Q263-V268 PolarHBondContact O-N 2.63Å |
| 264 | K | 93.8 | Very high | 90.9 | Very high | 148 Ų | 148 | 76.3 Ų | 76.3 | 64% | 0.643 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -65.5 | -45.2 | 175.4 | -74.2 | 164 | 177.3 | 156.4 | 0 | 112.7 | N260 L261 F262 H266 D267 | N260-K264 WeakPolarHBondContact O-CB 3.4Å; N260-K264 WeakPolarHBondContact O-CD 3.47Å; N260-K264 VanDerWaalsContact O-CG 3.32Å; N260-K264 WeakPolarHBondContact O-CG 3.3Å; N260-K264 PolarHBondContact O-N 2.97Å; N260-K264 WeakPolarHBondContact OD1-CE 3.26Å; N260-K264 PolarHBondContact OD1-NZ 3.47Å; L261-K264 PolarHBondContact O-N 2.97Å; F262-K264 VanDerWaalsContact C-N 3.29Å; F262-K264 PolarHBondContact O-N 3.24Å; K264-H266 VanDerWaalsContact C-N 3.28Å; K264-H266 PolarHBondContact O-N 2.95Å; K264-D267 PolarHBondContact O-N 3.44Å |
| 265 | K | 94.5 | Very high | 90.5 | Very high | 163 Ų | 163 | 74.4 Ų | 74.4 | 71% | 0.709 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -60.9 | -35.6 | -179.3 | -177.5 | -175.1 | 179.1 | -169 | 0 | 112.4 | L261 F262 | L261-K265 VanDerWaalsContact O-CB 3.28Å; L261-K265 WeakPolarHBondContact O-CB 3.41Å; L261-K265 PolarHBondContact O-N 2.94Å; F262-K265 PolarHBondContact O-N 3.21Å; F262-K265 VanDerWaalsContact O-N 3.16Å |
| 266 | H | 91.5 | Very high | 90.3 | Very high | 69 Ų | 69 | 74.9 Ų | 74.9 | 32% | 0.319 | 38% | 0.375 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.6 | 3.3 | -178.1 | -67.9 | -97.7 | 0 | 0 | 0 | 114.1 | V229 F262 K264 V268 | V229-H266 HydrophobicContact CG1-CB 4.3Å; F262-H266 AromaticContact CE1-CD2 3.97Å; F262-H266 AromaticContact CE2-CD2 3.78Å; F262-H266 AromaticContact CE2-NE2 3.61Å; F262-H266 AromaticContact CZ-CD2 3.75Å; F262-H266 AromaticContact CZ-NE2 3.84Å; F262-H266 PolarHBondContact O-CD2 3.27Å; F262-H266 PolarHBondContact O-N 3.17Å; K264-H266 VanDerWaalsContact C-N 3.28Å; K264-H266 PolarHBondContact O-N 2.95Å; H266-V268 VanDerWaalsContact C-N 3.26Å; H266-V268 HydrophobicContact CB-CG1 4.45Å; H266-V268 HydrophobicContact CB-CG2 4.22Å; H266-V268 PolarHBondContact O-N 3.37Å |
| 267 | D | 91.5 | Very high | 90.1 | Very high | 77 Ų | 77 | 71.9 Ų | 71.9 | 41% | 0.412 | 37% | 0.371 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 44.3 | 48.8 | -172.3 | -175 | 48.8 | 0 | 0 | 0 | 113.2 | K225 Q263 K264 R272 | K225-D267 PolarHBondContact NZ-O 3.2Å; K225-D267 IonicContact NZ-OD2 2.96Å; K225-D267 PolarHBondContact NZ-OD2 3.16Å; Q263-D267 PolarHBondContact O-N 2.83Å; Q263-D267 VanDerWaalsContact O-N 3.13Å; K264-D267 PolarHBondContact O-N 3.44Å; D267-R272 PolarHBondContact O-NH1 3.25Å; D267-R272 IonicContact OD1-CZ 2.95Å; D267-R272 VanDerWaalsContact OD1-CZ 3.28Å; D267-R272 IonicContact OD1-NH1 2.7Å; D267-R272 PolarHBondContact OD1-NH1 2.87Å; D267-R272 IonicContact OD1-NH2 2.63Å; D267-R272 PolarHBondContact OD1-NH2 3.07Å; D267-R272 IonicContact OD2-NH1 2.66Å; D267-R272 PolarHBondContact OD2-NH1 3.5Å |
| 268 | V | 89.6 | Confident | 89.9 | Confident | 8 Ų | 8 | 73.4 Ų | 73.4 | 5% | 0.048 | 37% | 0.373 | C | S | . | . | trans | -112.7 | 137.1 | 174.4 | -66.6 | 0 | 0 | 0 | 0 | 110.9 | K225 V229 M233 Q263 H266 | K225-V268 HydrophobicContact CB-CG1 3.94Å; V229-V268 HydrophobicContact CG2-CB 4.36Å; V229-V268 HydrophobicContact CG2-CG1 3.79Å; V229-V268 HydrophobicContact CG2-CG2 3.94Å; M233-V268 HydrophobicContact SD-CG2 4.28Å; Q263-V268 HydrophobicContact CB-CG2 4.45Å; Q263-V268 WeakPolarHBondContact CB-O 3.4Å; Q263-V268 HydrophobicContact CG-CG2 4.33Å; Q263-V268 PolarHBondContact O-N 2.63Å; H266-V268 VanDerWaalsContact C-N 3.26Å; H266-V268 HydrophobicContact CB-CG1 4.45Å; H266-V268 HydrophobicContact CB-CG2 4.22Å; H266-V268 PolarHBondContact O-N 3.37Å | ||
| 269 | N | 88.1 | Confident | 89.8 | Confident | 60 Ų | 60 | 72 Ų | 72 | 32% | 0.321 | 37% | 0.367 | S | S | . | . | trans | -144.4 | 120.1 | 172.6 | 173 | -16.3 | 0 | 0 | 0 | 107.8 | L271 R272 | N269-L271 PolarHBondContact O-N 3.41Å; N269-L271 VanDerWaalsContact OD1-CB 3.29Å; N269-L271 WeakPolarHBondContact OD1-CB 3.42Å; N269-L271 PolarHBondContact OD1-N 3.26Å; N269-R272 HydrophobicContact CB-CG 4.03Å; N269-R272 WeakPolarHBondContact O-CB 3.47Å; N269-R272 PolarHBondContact O-N 2.94Å; N269-R272 VanDerWaalsContact O-N 3.08Å | ||
| 270 | P | 82.5 | Confident | 89.7 | Confident | 63 Ų | 63 | 74.8 Ų | 74.8 | 41% | 0.409 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -60.4 | -29.2 | -176 | 24.7 | -34.2 | 0 | 0 | 0 | 113.2 | L226 R272 G273 | L226-P270 HydrophobicContact CD2-CB 4.36Å; P270-R272 VanDerWaalsContact C-N 3.26Å; P270-R272 PolarHBondContact O-N 3Å; P270-G273 PolarHBondContact O-N 3.26Å |
| 271 | L | 87.3 | Confident | 89.6 | Confident | 131 Ų | 131 | 75.2 Ų | 75.2 | 69% | 0.686 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -66.8 | -25.4 | 179 | -55.4 | 178.4 | 0 | 0 | 0 | 112.7 | N269 G273 F274 | N269-L271 PolarHBondContact O-N 3.41Å; N269-L271 VanDerWaalsContact OD1-CB 3.29Å; N269-L271 WeakPolarHBondContact OD1-CB 3.42Å; N269-L271 PolarHBondContact OD1-N 3.26Å; L271-G273 PolarHBondContact O-N 2.87Å; L271-F274 WeakPolarHBondContact O-CB 3.48Å; L271-F274 PolarHBondContact O-N 3.37Å; L271-F274 VanDerWaalsContact O-N 3.12Å |
| 272 | R | 84.8 | Confident | 89.6 | Confident | 90 Ų | 90 | 73.3 Ų | 73.3 | 34% | 0.34 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -64.4 | -29.7 | 176.1 | -66.1 | 179.6 | -174.5 | 169.7 | 4.3 | 112.2 | E222 D267 N269 P270 F274 L275 | E222-R272 HydrophobicContact CB-CB 3.99Å; E222-R272 HydrophobicContact CG-CB 4Å; E222-R272 WeakPolarHBondContact OE2-CD 3.26Å; E222-R272 IonicContact OE2-CZ 3.24Å; E222-R272 IonicContact OE2-NE 2.72Å; E222-R272 IonicContact OE2-NH1 2.64Å; E222-R272 PolarHBondContact OE2-NH1 2.85Å; D267-R272 PolarHBondContact O-NH1 3.25Å; D267-R272 IonicContact OD1-CZ 2.95Å; D267-R272 VanDerWaalsContact OD1-CZ 3.28Å; D267-R272 IonicContact OD1-NH1 2.7Å; D267-R272 PolarHBondContact OD1-NH1 2.87Å; D267-R272 IonicContact OD1-NH2 2.63Å; D267-R272 PolarHBondContact OD1-NH2 3.07Å; D267-R272 IonicContact OD2-NH1 2.66Å; D267-R272 PolarHBondContact OD2-NH1 3.5Å; N269-R272 HydrophobicContact CB-CG 4.03Å; N269-R272 WeakPolarHBondContact O-CB 3.47Å; N269-R272 PolarHBondContact O-N 2.94Å; N269-R272 VanDerWaalsContact O-N 3.08Å; P270-R272 VanDerWaalsContact C-N 3.26Å; P270-R272 PolarHBondContact O-N 3Å; R272-F274 VanDerWaalsContact C-N 3.33Å; R272-L275 WeakPolarHBondContact O-CB 3.34Å; R272-L275 PolarHBondContact O-N 3.5Å |
| 273 | G | 78.9 | Confident | 89.7 | Confident | 30 Ų | 30 | 74.2 Ų | 74.2 | 31% | 0.309 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -68.9 | -30.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | P270 L271 L275 | P270-G273 PolarHBondContact O-N 3.26Å; L271-G273 PolarHBondContact O-N 2.87Å; G273-L275 VanDerWaalsContact C-N 3.25Å; G273-L275 PolarHBondContact O-N 3.37Å |
| 274 | F | 84.3 | Confident | 89.8 | Confident | 126 Ų | 126 | 75 Ų | 75 | 55% | 0.553 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -74.9 | -12.4 | 179.3 | -166.9 | -106.1 | 0 | 0 | 0 | 113.7 | L271 R272 V276 P277 L278 | L271-F274 WeakPolarHBondContact O-CB 3.48Å; L271-F274 PolarHBondContact O-N 3.37Å; L271-F274 VanDerWaalsContact O-N 3.12Å; R272-F274 VanDerWaalsContact C-N 3.33Å; F274-V276 PolarHBondContact O-N 3.35Å; F274-P277 HydrophobicContact CD2-CB 4.36Å; F274-P277 HydrophobicContact CD2-CG 4.43Å; F274-P277 HydrophobicContact CE2-CB 4.2Å; F274-P277 WeakPolarHBondContact O-CD 3.47Å; F274-L278 HydrophobicContact CD1-CB 4.2Å; F274-L278 HydrophobicContact CE1-CB 4.24Å; F274-L278 HydrophobicContact CE1-CD1 4.32Å; F274-L278 WeakPolarHBondContact O-CB 3.49Å; F274-L278 PolarHBondContact O-N 3.4Å |
| 275 | L | 86.9 | Confident | 89.9 | Confident | 74 Ų | 74 | 71.7 Ų | 71.7 | 39% | 0.387 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -57.1 | -32.2 | 179 | -176.3 | 62.6 | 0 | 0 | 0 | 113.2 | V215 R272 G273 V279 | V215-L275 HydrophobicContact CG1-CD2 4.08Å; V215-L275 HydrophobicContact CG1-CG 3.91Å; R272-L275 WeakPolarHBondContact O-CB 3.34Å; R272-L275 PolarHBondContact O-N 3.5Å; G273-L275 VanDerWaalsContact C-N 3.25Å; G273-L275 PolarHBondContact O-N 3.37Å; L275-V279 HydrophobicContact CD1-CG2 4.35Å; L275-V279 WeakPolarHBondContact O-CG2 3.49Å; L275-V279 PolarHBondContact O-N 2.85Å; L275-V279 VanDerWaalsContact O-N 3.14Å |
| 276 | V | 88.6 | Confident | 90 | Very high | 22 Ų | 22 | 64.6 Ų | 64.6 | 13% | 0.133 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -71.5 | -55.5 | -179.3 | 171.8 | 0 | 0 | 0 | 0 | 111.8 | I216 F274 L278 V279 Q280 | I216-V276 HydrophobicContact CG1-CG1 4.02Å; I216-V276 HydrophobicContact CG1-CG2 4.49Å; F274-V276 PolarHBondContact O-N 3.35Å; V276-L278 PolarHBondContact O-N 3.06Å; V276-V279 PolarHBondContact O-N 3.47Å; V276-Q280 WeakPolarHBondContact O-CB 3.48Å; V276-Q280 PolarHBondContact O-N 3.05Å |
| 277 | P | 89.2 | Confident | 90.3 | Very high | 64 Ų | 64 | 61.3 Ų | 61.3 | 42% | 0.416 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -50.7 | -41.9 | 168.5 | -29.7 | 34.5 | 0 | 0 | 0 | 113.7 | F274 V279 Q280 A281 | F274-P277 HydrophobicContact CD2-CB 4.36Å; F274-P277 HydrophobicContact CD2-CG 4.43Å; F274-P277 HydrophobicContact CE2-CB 4.2Å; F274-P277 WeakPolarHBondContact O-CD 3.47Å; P277-V279 VanDerWaalsContact C-N 3.31Å; P277-V279 PolarHBondContact O-N 2.93Å; P277-Q280 PolarHBondContact O-N 2.83Å; P277-A281 WeakPolarHBondContact O-CB 3.11Å; P277-A281 PolarHBondContact O-N 2.94Å |
| 278 | L | 90.9 | Very high | 90.5 | Very high | 102 Ų | 102 | 59.4 Ų | 59.4 | 53% | 0.534 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -64.2 | -30.5 | -177.4 | -174.1 | 63.5 | 0 | 0 | 0 | 113.6 | F274 V276 P282 | F274-L278 HydrophobicContact CD1-CB 4.2Å; F274-L278 HydrophobicContact CE1-CB 4.24Å; F274-L278 HydrophobicContact CE1-CD1 4.32Å; F274-L278 WeakPolarHBondContact O-CB 3.49Å; F274-L278 PolarHBondContact O-N 3.4Å; V276-L278 PolarHBondContact O-N 3.06Å; L278-P282 WeakPolarHBondContact O-CD 3.44Å; L278-P282 VanDerWaalsContact O-CG 3.24Å; L278-P282 WeakPolarHBondContact O-CG 3.49Å |
| 279 | V | 92.3 | Very high | 90.8 | Very high | 47 Ų | 47 | 62 Ų | 62 | 29% | 0.285 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -90.9 | -37.2 | 174 | 174 | 0 | 0 | 0 | 0 | 111.7 | V212 V215 L275 V276 P277 P282 V283 | V212-V279 HydrophobicContact CG1-CG1 4Å; V212-V279 HydrophobicContact CG2-CG1 4.19Å; V215-V279 HydrophobicContact CG1-CB 4.47Å; V215-V279 HydrophobicContact CG1-CG2 4.21Å; L275-V279 HydrophobicContact CD1-CG2 4.35Å; L275-V279 WeakPolarHBondContact O-CG2 3.49Å; L275-V279 PolarHBondContact O-N 2.85Å; L275-V279 VanDerWaalsContact O-N 3.14Å; V276-V279 PolarHBondContact O-N 3.47Å; P277-V279 VanDerWaalsContact C-N 3.31Å; P277-V279 PolarHBondContact O-N 2.93Å; V279-P282 WeakPolarHBondContact O-CD 3.49Å; V279-V283 WeakPolarHBondContact O-CG2 3.31Å |
| 280 | Q | 91.4 | Very high | 91.2 | Very high | 69 Ų | 69 | 59.2 Ų | 59.2 | 32% | 0.322 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -72.4 | -36.5 | -175.2 | -172.5 | 174.5 | -6.5 | 0 | 0 | 112.9 | V276 P277 V283 F284 | V276-Q280 WeakPolarHBondContact O-CB 3.48Å; V276-Q280 PolarHBondContact O-N 3.05Å; P277-Q280 PolarHBondContact O-N 2.83Å; Q280-V283 PolarHBondContact O-N 3.23Å; Q280-F284 WeakPolarHBondContact O-CB 3.33Å; Q280-F284 PolarHBondContact O-N 3.21Å |
| 281 | A | 93.2 | Very high | 91.9 | Very high | 58 Ų | 58 | 56.2 Ų | 56.2 | 48% | 0.479 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -67.3 | -45 | -180 | 0 | 0 | 0 | 0 | 0 | 113.3 | P277 V283 F284 I285 | P277-A281 WeakPolarHBondContact O-CB 3.11Å; P277-A281 PolarHBondContact O-N 2.94Å; A281-V283 VanDerWaalsContact C-N 3.31Å; A281-V283 PolarHBondContact O-N 3.22Å; A281-F284 PolarHBondContact O-N 3.36Å; A281-I285 WeakPolarHBondContact O-CG2 3.29Å; A281-I285 PolarHBondContact O-N 2.93Å |
| 282 | P | 95.1 | Very high | 92.3 | Very high | 69 Ų | 69 | 53.6 Ų | 53.6 | 45% | 0.448 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -56.8 | -38.4 | 170.6 | -29.7 | 37.6 | 0 | 0 | 0 | 114.2 | L278 V279 I285 S286 | L278-P282 WeakPolarHBondContact O-CD 3.44Å; L278-P282 VanDerWaalsContact O-CG 3.24Å; L278-P282 WeakPolarHBondContact O-CG 3.49Å; V279-P282 WeakPolarHBondContact O-CD 3.49Å; P282-I285 WeakPolarHBondContact O-CG2 3.35Å; P282-S286 WeakPolarHBondContact O-CB 3.35Å; P282-S286 PolarHBondContact O-N 3.24Å; P282-S286 VanDerWaalsContact O-N 3.12Å; P282-S286 PolarHBondContact O-OG 3.38Å |
| 283 | V | 95.6 | Very high | 92.7 | Very high | 41 Ų | 41 | 54.2 Ų | 54.2 | 25% | 0.248 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -68.2 | -47 | 175.8 | 174.3 | 0 | 0 | 0 | 0 | 110.7 | A208 V212 V279 Q280 A281 I285 S286 F287 | A208-V283 HydrophobicContact CB-CG1 4.44Å; V212-V283 HydrophobicContact CG2-CG2 4.21Å; V279-V283 WeakPolarHBondContact O-CG2 3.31Å; Q280-V283 PolarHBondContact O-N 3.23Å; A281-V283 VanDerWaalsContact C-N 3.31Å; A281-V283 PolarHBondContact O-N 3.22Å; V283-I285 PolarHBondContact O-N 3.04Å; V283-S286 PolarHBondContact O-N 2.94Å; V283-F287 HydrophobicContact CG1-CD2 4.02Å; V283-F287 HydrophobicContact CG1-CE2 4.09Å; V283-F287 WeakPolarHBondContact O-CD2 3.39Å; V283-F287 PolarHBondContact O-N 3.22Å; V283-F287 VanDerWaalsContact O-N 3.11Å |
| 284 | F | 95.3 | Very high | 93.4 | Very high | 64 Ų | 64 | 52.8 Ų | 52.8 | 28% | 0.281 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -59.6 | -48.4 | 178.4 | 179 | -90.6 | 0 | 0 | 0 | 112.5 | Q280 A281 S286 F287 F288 Y375 W376 | Q280-F284 WeakPolarHBondContact O-CB 3.33Å; Q280-F284 PolarHBondContact O-N 3.21Å; A281-F284 PolarHBondContact O-N 3.36Å; F284-S286 VanDerWaalsContact C-N 3.28Å; F284-S286 PolarHBondContact O-N 3.25Å; F284-F287 PolarHBondContact O-N 3.44Å; F284-F288 HydrophobicContact CE1-CB 4.44Å; F284-F288 VanDerWaalsContact O-CB 3.28Å; F284-F288 WeakPolarHBondContact O-CB 3.45Å; F284-F288 PolarHBondContact O-N 3.37Å; F284-Y375 AromaticContact CD2-CE1 3.73Å; F284-Y375 HydrophobicContact CD2-CE1 3.73Å; F284-Y375 AromaticContact CE2-CE1 3.83Å; F284-Y375 HydrophobicContact CE2-CE1 3.83Å; F284-W376 HydrophobicContact CE2-CD2 4.1Å; F284-W376 AromaticContact CE2-CE2 3.92Å; F284-W376 HydrophobicContact CE2-CG 4.24Å; F284-W376 HydrophobicContact CE2-CZ2 4.41Å; F284-W376 AromaticContact CE2-NE1 3.94Å; F284-W376 HydrophobicContact CZ-CD2 4.11Å; F284-W376 AromaticContact CZ-CE2 3.9Å; F284-W376 HydrophobicContact CZ-CE3 4.37Å; F284-W376 HydrophobicContact CZ-CH2 4.25Å; F284-W376 AromaticContact CZ-CZ2 3.97Å; F284-W376 HydrophobicContact CZ-CZ2 3.97Å; F284-W376 HydrophobicContact CZ-CZ3 4.44Å |
| 285 | I | 96.1 | Very high | 93.9 | Very high | 79 Ų | 79 | 47.2 Ų | 47.2 | 41% | 0.405 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -67.1 | -31.1 | -179.7 | -163.6 | 61.7 | 0 | 0 | 0 | 112 | A281 P282 V283 F288 I289 | A281-I285 WeakPolarHBondContact O-CG2 3.29Å; A281-I285 PolarHBondContact O-N 2.93Å; P282-I285 WeakPolarHBondContact O-CG2 3.35Å; V283-I285 PolarHBondContact O-N 3.04Å; I285-F288 HydrophobicContact CD1-CD1 4.09Å; I285-I289 HydrophobicContact CD1-CD1 4.12Å; I285-I289 HydrophobicContact CD1-CG1 4.2Å; I285-I289 HydrophobicContact CG1-CD1 3.79Å; I285-I289 HydrophobicContact CG1-CG1 4.26Å; I285-I289 WeakPolarHBondContact O-CB 3.24Å; I285-I289 VanDerWaalsContact O-CG1 3.27Å; I285-I289 WeakPolarHBondContact O-CG1 3.38Å; I285-I289 PolarHBondContact O-N 3.12Å |
| 286 | S | 96.9 | Very high | 94.1 | Very high | 13 Ų | 13 | 49.6 Ų | 49.6 | 9% | 0.091 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65.9 | -49.6 | 175.8 | -59.8 | 0 | 0 | 0 | 0 | 111.7 | P178 P282 V283 F284 A290 | P178-S286 WeakPolarHBondContact CB-OG 3.42Å; P282-S286 WeakPolarHBondContact O-CB 3.35Å; P282-S286 PolarHBondContact O-N 3.24Å; P282-S286 VanDerWaalsContact O-N 3.12Å; P282-S286 PolarHBondContact O-OG 3.38Å; V283-S286 PolarHBondContact O-N 2.94Å; F284-S286 VanDerWaalsContact C-N 3.28Å; F284-S286 PolarHBondContact O-N 3.25Å; S286-A290 WeakPolarHBondContact O-CB 3.49Å; S286-A290 PolarHBondContact O-N 2.91Å |
| 287 | F | 97.6 | Very high | 94 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61 | -46.6 | 173.7 | -89.7 | -91.8 | 0 | 0 | 0 | 112.2 | I182 A208 V283 F284 I289 A290 L291 Y375 | I182-F287 HydrophobicContact CD1-CD2 3.99Å; I182-F287 HydrophobicContact CD1-CE2 3.42Å; I182-F287 VanDerWaalsContact CD1-CE2 3.42Å; I182-F287 HydrophobicContact CD1-CZ 3.74Å; I182-F287 HydrophobicContact CG1-CD2 4.02Å; I182-F287 HydrophobicContact CG1-CE2 3.97Å; I182-F287 HydrophobicContact CG1-CG 4.48Å; I182-F287 HydrophobicContact CG1-CZ 4.4Å; I182-F287 HydrophobicContact CG2-CD1 3.63Å; I182-F287 HydrophobicContact CG2-CD2 4.22Å; I182-F287 HydrophobicContact CG2-CE1 3.68Å; I182-F287 HydrophobicContact CG2-CE2 4.25Å; I182-F287 HydrophobicContact CG2-CG 3.92Å; I182-F287 HydrophobicContact CG2-CZ 4Å; A208-F287 HydrophobicContact CB-CE2 3.58Å; A208-F287 HydrophobicContact CB-CZ 3.77Å; V283-F287 HydrophobicContact CG1-CD2 4.02Å; V283-F287 HydrophobicContact CG1-CE2 4.09Å; V283-F287 WeakPolarHBondContact O-CD2 3.39Å; V283-F287 PolarHBondContact O-N 3.22Å; V283-F287 VanDerWaalsContact O-N 3.11Å; F284-F287 PolarHBondContact O-N 3.44Å; F287-I289 PolarHBondContact O-N 3.28Å; F287-A290 PolarHBondContact O-N 3.18Å; F287-L291 HydrophobicContact CD1-CD1 4.46Å; F287-L291 WeakPolarHBondContact O-CB 3.48Å; F287-L291 VanDerWaalsContact O-CG 3.32Å; F287-L291 WeakPolarHBondContact O-CG 3.27Å; F287-L291 PolarHBondContact O-N 3.14Å; F287-Y375 HydrophobicContact CB-CD1 4.29Å; F287-Y375 HydrophobicContact CB-CD2 3.77Å; F287-Y375 HydrophobicContact CB-CE1 3.96Å; F287-Y375 HydrophobicContact CB-CE2 3.4Å; F287-Y375 HydrophobicContact CB-CG 4.23Å; F287-Y375 AromaticContact CD1-CD2 3.31Å; F287-Y375 HydrophobicContact CD1-CD2 3.31Å; F287-Y375 AromaticContact CD1-CE2 3.4Å; F287-Y375 HydrophobicContact CD1-CE2 3.4Å; F287-Y375 HydrophobicContact CD1-CG 4.26Å; F287-Y375 AromaticContact CD2-CE2 3.82Å; F287-Y375 HydrophobicContact CD2-CE2 3.82Å; F287-Y375 AromaticContact CE1-CD2 4Å; F287-Y375 HydrophobicContact CE1-CD2 4Å; F287-Y375 HydrophobicContact CE1-CE2 4.06Å; F287-Y375 HydrophobicContact CE2-CE2 4.42Å; F287-Y375 AromaticContact CG-CD2 3.66Å; F287-Y375 HydrophobicContact CG-CD2 3.66Å; F287-Y375 AromaticContact CG-CE2 3.25Å; F287-Y375 HydrophobicContact CG-CE2 3.25Å; F287-Y375 AromaticContact CG-CZ 3.87Å |
| 288 | F | 96.3 | Very high | 93.2 | Very high | 38 Ų | 38 | 52.5 Ų | 52.5 | 17% | 0.167 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.2 | -44.5 | -179.7 | 177.1 | -93.1 | 0 | 0 | 0 | 112.3 | F284 I285 R292 F368 V372 | F284-F288 HydrophobicContact CE1-CB 4.44Å; F284-F288 VanDerWaalsContact O-CB 3.28Å; F284-F288 WeakPolarHBondContact O-CB 3.45Å; F284-F288 PolarHBondContact O-N 3.37Å; I285-F288 HydrophobicContact CD1-CD1 4.09Å; F288-R292 VanDerWaalsContact CE1-CD 3.45Å; F288-R292 HydrophobicContact CE1-CG 4.46Å; F288-R292 HydrophobicContact CZ-CG 4.43Å; F288-R292 WeakPolarHBondContact O-CB 3.49Å; F288-R292 WeakPolarHBondContact O-CG 3.42Å; F288-R292 PolarHBondContact O-N 2.9Å; F288-R292 VanDerWaalsContact O-N 3.11Å; F288-F368 AromaticContact CE2-CD2 3.92Å; F288-F368 HydrophobicContact CE2-CD2 3.92Å; F288-F368 AromaticContact CE2-CE2 3.77Å; F288-F368 HydrophobicContact CE2-CE2 3.77Å; F288-F368 HydrophobicContact CZ-CD2 4.13Å; F288-F368 AromaticContact CZ-CE2 3.6Å; F288-F368 HydrophobicContact CZ-CE2 3.6Å; F288-F368 HydrophobicContact CZ-CZ 4.41Å; F288-V372 HydrophobicContact CD2-CG1 3.53Å; F288-V372 HydrophobicContact CE2-CG1 3.76Å |
| 289 | I | 96.3 | Very high | 93 | Very high | 63 Ų | 63 | 47.9 Ų | 47.9 | 32% | 0.323 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -71.9 | -39.2 | 177 | -64.8 | 174 | 0 | 0 | 0 | 111.1 | V179 I285 F287 K293 | V179-I289 HydrophobicContact CG1-CB 4.32Å; V179-I289 HydrophobicContact CG1-CG2 3.85Å; V179-I289 HydrophobicContact CG2-CB 3.99Å; V179-I289 HydrophobicContact CG2-CG2 3.88Å; I285-I289 HydrophobicContact CD1-CD1 4.12Å; I285-I289 HydrophobicContact CD1-CG1 4.2Å; I285-I289 HydrophobicContact CG1-CD1 3.79Å; I285-I289 HydrophobicContact CG1-CG1 4.26Å; I285-I289 WeakPolarHBondContact O-CB 3.24Å; I285-I289 VanDerWaalsContact O-CG1 3.27Å; I285-I289 WeakPolarHBondContact O-CG1 3.38Å; I285-I289 PolarHBondContact O-N 3.12Å; F287-I289 PolarHBondContact O-N 3.28Å; I289-K293 HydrophobicContact CG2-CD 4.42Å; I289-K293 HydrophobicContact CG2-CG 4.34Å; I289-K293 WeakPolarHBondContact O-CB 3.21Å; I289-K293 WeakPolarHBondContact O-CG 3.33Å; I289-K293 PolarHBondContact O-N 2.91Å |
| 290 | A | 96.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.8 | -51 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V179 I182 Q183 S286 F287 K293 M294 | V179-A290 HydrophobicContact CG1-CB 4Å; I182-A290 HydrophobicContact CB-CB 4.2Å; I182-A290 HydrophobicContact CG2-CB 3.99Å; Q183-A290 HydrophobicContact CG-CB 3.69Å; Q183-A290 PolarHBondContact NE2-O 3.03Å; Q183-A290 VanDerWaalsContact NE2-O 3.13Å; S286-A290 WeakPolarHBondContact O-CB 3.49Å; S286-A290 PolarHBondContact O-N 2.91Å; F287-A290 PolarHBondContact O-N 3.18Å; A290-K293 PolarHBondContact O-N 3.03Å; A290-M294 WeakPolarHBondContact O-CG 3.22Å; A290-M294 PolarHBondContact O-N 3.39Å |
| 291 | L | 96.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -70.9 | -39.5 | -178.1 | -63.5 | 168.3 | 0 | 0 | 0 | 111.9 | L186 I201 F287 K293 M294 A295 A371 V372 Y375 | L186-L291 HydrophobicContact CD1-CD2 3.66Å; L186-L291 HydrophobicContact CD1-CG 4.49Å; I201-L291 HydrophobicContact CD1-CD2 3.88Å; I201-L291 HydrophobicContact CG1-CD2 3.83Å; I201-L291 HydrophobicContact CG2-CD1 4.5Å; F287-L291 HydrophobicContact CD1-CD1 4.46Å; F287-L291 WeakPolarHBondContact O-CB 3.48Å; F287-L291 VanDerWaalsContact O-CG 3.32Å; F287-L291 WeakPolarHBondContact O-CG 3.27Å; F287-L291 PolarHBondContact O-N 3.14Å; L291-K293 VanDerWaalsContact C-N 3.32Å; L291-K293 PolarHBondContact O-N 2.91Å; L291-M294 HydrophobicContact CD2-SD 4.42Å; L291-M294 PolarHBondContact O-N 3.15Å; L291-A295 WeakPolarHBondContact O-CB 3.44Å; L291-A295 PolarHBondContact O-N 3Å; L291-A371 HydrophobicContact CB-CB 4.38Å; L291-A371 HydrophobicContact CD2-CB 4.43Å; L291-V372 HydrophobicContact CB-CG2 4.1Å; L291-Y375 HydrophobicContact CD1-CD1 4.45Å; L291-Y375 HydrophobicContact CD1-CD2 4.34Å; L291-Y375 HydrophobicContact CD1-CG 3.79Å |
| 292 | R | 95.3 | Very high | 92.4 | Very high | 77 Ų | 77 | 44 Ų | 44 | 29% | 0.291 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -57.2 | -45.7 | 169 | -84.5 | -172.6 | 55.7 | 97.3 | 6.7 | 111.3 | F288 A295 Y296 V372 | F288-R292 VanDerWaalsContact CE1-CD 3.45Å; F288-R292 HydrophobicContact CE1-CG 4.46Å; F288-R292 HydrophobicContact CZ-CG 4.43Å; F288-R292 WeakPolarHBondContact O-CB 3.49Å; F288-R292 WeakPolarHBondContact O-CG 3.42Å; F288-R292 PolarHBondContact O-N 2.9Å; F288-R292 VanDerWaalsContact O-N 3.11Å; R292-A295 PolarHBondContact O-N 3.05Å; R292-Y296 HydrophobicContact CB-CD2 4.08Å; R292-Y296 HydrophobicContact CB-CE2 4.12Å; R292-Y296 HydrophobicContact CG-CD2 4.46Å; R292-Y296 HydrophobicContact CG-CE2 3.98Å; R292-Y296 PolarHBondContact NH1-OH 3.46Å; R292-Y296 WeakPolarHBondContact O-CD2 3.22Å; R292-Y296 PolarHBondContact O-N 3.32Å; R292-V372 HydrophobicContact CG-CG2 3.93Å |
| 293 | K | 94.6 | Very high | 92.2 | Very high | 103 Ų | 103 | 45.1 Ų | 45.1 | 45% | 0.448 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -62 | -44.4 | -180 | -81.2 | -168.7 | 173.6 | -162.4 | 0 | 112.2 | L173 V179 I289 A290 L291 A295 Y296 L297 | L173-K293 HydrophobicContact CD2-CB 4.03Å; L173-K293 HydrophobicContact CD2-CD 4.32Å; V179-K293 HydrophobicContact CG1-CD 4.41Å; I289-K293 HydrophobicContact CG2-CD 4.42Å; I289-K293 HydrophobicContact CG2-CG 4.34Å; I289-K293 WeakPolarHBondContact O-CB 3.21Å; I289-K293 WeakPolarHBondContact O-CG 3.33Å; I289-K293 PolarHBondContact O-N 2.91Å; A290-K293 PolarHBondContact O-N 3.03Å; L291-K293 VanDerWaalsContact C-N 3.32Å; L291-K293 PolarHBondContact O-N 2.91Å; K293-A295 VanDerWaalsContact C-N 3.26Å; K293-A295 PolarHBondContact O-N 2.78Å; K293-Y296 PolarHBondContact O-N 3.29Å; K293-L297 WeakPolarHBondContact O-CB 3.38Å; K293-L297 PolarHBondContact O-N 2.83Å |
| 294 | M | 93.6 | Very high | 91.9 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.8 | -29.3 | 178.1 | -67.1 | 158.1 | 70.2 | 0 | 0 | 113 | L168 L173 Q183 L186 W197 A290 L291 L297 V299 L302 | L168-M294 HydrophobicContact CD1-CE 4.15Å; L168-M294 HydrophobicContact CD1-SD 4.42Å; L173-M294 HydrophobicContact CD1-CG 4.01Å; Q183-M294 HydrophobicContact CB-SD 4.49Å; Q183-M294 HydrophobicContact CG-CG 4.41Å; Q183-M294 HydrophobicContact CG-SD 3.93Å; L186-M294 HydrophobicContact CD1-SD 4.43Å; W197-M294 HydrophobicContact CE3-CE 3.9Å; W197-M294 HydrophobicContact CH2-CE 3.67Å; W197-M294 HydrophobicContact CZ2-CE 4.43Å; W197-M294 HydrophobicContact CZ3-CE 3.35Å; A290-M294 WeakPolarHBondContact O-CG 3.22Å; A290-M294 PolarHBondContact O-N 3.39Å; L291-M294 HydrophobicContact CD2-SD 4.42Å; L291-M294 PolarHBondContact O-N 3.15Å; M294-L297 VanDerWaalsContact O-O 3.09Å; M294-V299 HydrophobicContact CB-CG2 4.11Å; M294-V299 HydrophobicContact CG-CG2 4.36Å; M294-V299 PolarHBondContact O-N 3.38Å; M294-L302 HydrophobicContact CB-CD1 4.45Å; M294-L302 HydrophobicContact CB-CD2 4.37Å; M294-L302 HydrophobicContact CE-CD1 3.99Å |
| 295 | A | 93.7 | Very high | 91.6 | Very high | 8 Ų | 8 | 45.9 Ų | 45.9 | 7% | 0.066 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -81.2 | -42.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | L291 R292 K293 L302 P369 | L291-A295 WeakPolarHBondContact O-CB 3.44Å; L291-A295 PolarHBondContact O-N 3Å; R292-A295 PolarHBondContact O-N 3.05Å; K293-A295 VanDerWaalsContact C-N 3.26Å; K293-A295 PolarHBondContact O-N 2.78Å; A295-L302 HydrophobicContact CB-CD2 4.28Å; A295-P369 HydrophobicContact CB-CB 3.55Å; A295-P369 HydrophobicContact CB-CG 3.42Å; A295-P369 VanDerWaalsContact CB-CG 3.42Å |
| 296 | Y | 91.5 | Very high | 91.4 | Very high | 124 Ų | 124 | 42.7 Ų | 42.7 | 49% | 0.486 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -85.4 | -17.6 | -178 | -68 | -63.5 | 0 | 0 | 0 | 114.5 | R292 K293 P298 P369 | R292-Y296 HydrophobicContact CB-CD2 4.08Å; R292-Y296 HydrophobicContact CB-CE2 4.12Å; R292-Y296 HydrophobicContact CG-CD2 4.46Å; R292-Y296 HydrophobicContact CG-CE2 3.98Å; R292-Y296 PolarHBondContact NH1-OH 3.46Å; R292-Y296 WeakPolarHBondContact O-CD2 3.22Å; R292-Y296 PolarHBondContact O-N 3.32Å; K293-Y296 PolarHBondContact O-N 3.29Å; Y296-P298 WeakPolarHBondContact O-CD 3.11Å; Y296-P369 HydrophobicContact CE2-CG 4.12Å |
| 297 | L | 86.4 | Confident | 91.2 | Very high | 80 Ų | 80 | 44.1 Ų | 44.1 | 42% | 0.419 | 23% | 0.232 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -110.4 | 80.6 | 161.7 | -171 | 127.7 | 0 | 0 | 0 | 105.3 | L171 L173 K293 M294 V299 | L171-L297 HydrophobicContact CB-CD2 3.91Å; L171-L297 HydrophobicContact CD2-CD2 4.02Å; L171-L297 VanDerWaalsContact O-CD2 3.28Å; L171-L297 WeakPolarHBondContact O-CD2 3.24Å; L173-L297 HydrophobicContact CD1-CD2 4.18Å; L173-L297 HydrophobicContact CD2-CD2 4.28Å; L173-L297 HydrophobicContact CG-CD2 4.16Å; K293-L297 WeakPolarHBondContact O-CB 3.38Å; K293-L297 PolarHBondContact O-N 2.83Å; M294-L297 VanDerWaalsContact O-O 3.09Å; L297-V299 PolarHBondContact O-N 3.44Å |
| 298 | P | 72.4 | Confident | 91 | Very high | 68 Ų | 68 | 50.6 Ų | 50.6 | 44% | 0.442 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | 108.7 | -154.7 | 23.3 | -34.5 | 0 | 0 | 0 | 111.6 | Y296 P300 | Y296-P298 WeakPolarHBondContact O-CD 3.11Å; P298-P300 WeakPolarHBondContact O-CD 3.46Å |
| 299 | V | 85.9 | Confident | 90.8 | Very high | 4 Ų | 4 | 52.7 Ų | 52.7 | 2% | 0.024 | 27% | 0.273 | C | S | . | . | trans | -66 | 120.2 | 168.7 | 178.6 | 0 | 0 | 0 | 0 | 107.1 | L168 L171 L173 W197 M294 L297 S301 L302 | L168-V299 HydrophobicContact CD2-CG1 4.05Å; L168-V299 HydrophobicContact CD2-CG2 3.64Å; L171-V299 HydrophobicContact CD1-CG2 4.29Å; L173-V299 HydrophobicContact CD1-CG2 4.08Å; W197-V299 HydrophobicContact CZ2-CG1 4.04Å; M294-V299 HydrophobicContact CB-CG2 4.11Å; M294-V299 HydrophobicContact CG-CG2 4.36Å; M294-V299 PolarHBondContact O-N 3.38Å; L297-V299 PolarHBondContact O-N 3.44Å; V299-S301 PolarHBondContact O-N 2.84Å; V299-L302 HydrophobicContact CB-CB 4.12Å; V299-L302 WeakPolarHBondContact O-CB 3.36Å; V299-L302 PolarHBondContact O-N 3.18Å | ||
| 300 | P | 85.5 | Confident | 90.6 | Very high | 79 Ų | 79 | 50.5 Ų | 50.5 | 51% | 0.513 | 26% | 0.261 | S | S | . | . | G | 310 helix | trans | -57.6 | -43.8 | -168.6 | -29.3 | 36.4 | 0 | 0 | 0 | 114.2 | P298 L302 Q303 | P298-P300 WeakPolarHBondContact O-CD 3.46Å; P300-L302 PolarHBondContact O-N 3.32Å; P300-Q303 WeakPolarHBondContact O-CB 3.4Å; P300-Q303 PolarHBondContact O-N 3.35Å |
| 301 | S | 88.4 | Confident | 90.5 | Very high | 12 Ų | 12 | 54.8 Ų | 54.8 | 8% | 0.084 | 29% | 0.287 | C | S | . | . | G | 310 helix | trans | -66.8 | -15.7 | 177.3 | 51.7 | 0 | 0 | 0 | 0 | 114.1 | E165 W197 V299 Q303 T304 G305 | E165-S301 VanDerWaalsContact CD-CB 3.41Å; E165-S301 WeakPolarHBondContact OE1-CB 3.44Å; E165-S301 WeakPolarHBondContact OE2-CB 3.49Å; E165-S301 PolarHBondContact OE2-OG 3.06Å; W197-S301 VanDerWaalsContact CD1-C 3.49Å; W197-S301 VanDerWaalsContact CD1-O 3.26Å; W197-S301 PolarHBondContact NE1-OG 2.93Å; V299-S301 PolarHBondContact O-N 2.84Å; S301-Q303 PolarHBondContact O-N 3.42Å; S301-T304 PolarHBondContact O-N 2.78Å; S301-T304 PolarHBondContact O-OG1 3.42Å; S301-G305 WeakPolarHBondContact O-CA 3.34Å; S301-G305 PolarHBondContact O-N 3.42Å |
| 302 | L | 91.5 | Very high | 90.3 | Very high | 1 Ų | 1 | 57 Ų | 57 | 1% | 0.005 | 30% | 0.299 | C | S | . | . | G | 310 helix | trans | -67.7 | -23 | 170.9 | -142.6 | 91.3 | 0 | 0 | 0 | 111.7 | W197 M294 A295 V299 P300 T304 L313 | W197-L302 HydrophobicContact CB-CD1 4.36Å; W197-L302 HydrophobicContact CD2-CD1 3.76Å; W197-L302 HydrophobicContact CE3-CD1 4.18Å; W197-L302 HydrophobicContact CG-CD1 3.87Å; M294-L302 HydrophobicContact CB-CD1 4.45Å; M294-L302 HydrophobicContact CB-CD2 4.37Å; M294-L302 HydrophobicContact CE-CD1 3.99Å; A295-L302 HydrophobicContact CB-CD2 4.28Å; V299-L302 HydrophobicContact CB-CB 4.12Å; V299-L302 WeakPolarHBondContact O-CB 3.36Å; V299-L302 PolarHBondContact O-N 3.18Å; P300-L302 PolarHBondContact O-N 3.32Å; L302-T304 VanDerWaalsContact C-N 3.31Å; L302-L313 HydrophobicContact CD2-CB 4.18Å; L302-L313 HydrophobicContact CG-CB 3.87Å; L302-L313 VanDerWaalsContact O-CB 3.31Å; L302-L313 WeakPolarHBondContact O-CB 3.24Å; L302-L313 PolarHBondContact O-N 3.48Å |
| 303 | Q | 90.7 | Very high | 90.3 | Very high | 93 Ų | 93 | 53.3 Ų | 53.3 | 44% | 0.435 | 29% | 0.285 | S | S | . | . | G | 310 helix | trans | -78.2 | -15.4 | -180 | -60.3 | -177.3 | -27.3 | 0 | 0 | 113.3 | P300 S301 D312 | P300-Q303 WeakPolarHBondContact O-CB 3.4Å; P300-Q303 PolarHBondContact O-N 3.35Å; S301-Q303 PolarHBondContact O-N 3.42Å; Q303-D312 WeakPolarHBondContact O-CA 3.3Å |
| 304 | T | 90.1 | Very high | 90.3 | Very high | 111 Ų | 111 | 49.4 Ų | 49.4 | 68% | 0.681 | 27% | 0.271 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -122 | -19.6 | 179.3 | 53.4 | 0 | 0 | 0 | 0 | 113.3 | S301 L302 G306 T311 | S301-T304 PolarHBondContact O-N 2.78Å; S301-T304 PolarHBondContact O-OG1 3.42Å; L302-T304 VanDerWaalsContact C-N 3.31Å; T304-G306 PolarHBondContact O-N 3.02Å; T304-G306 VanDerWaalsContact O-N 3.1Å; T304-T311 CarbonylContact C-O 3.5Å |
| 305 | G | 88.9 | Confident | 90.3 | Very high | 10 Ų | 10 | 51.3 Ų | 51.3 | 10% | 0.103 | 29% | 0.286 | C | S | . | . | S | Bend | trans | -76.1 | 14.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | W197 W198 S301 L313 | W197-G305 PolarHBondContact N-O 3.37Å; W198-G305 PolarHBondContact N-O 3.06Å; S301-G305 WeakPolarHBondContact O-CA 3.34Å; S301-G305 PolarHBondContact O-N 3.42Å; G305-L313 WeakPolarHBondContact O-CD1 3.25Å |
| 306 | G | 91.1 | Very high | 90.4 | Very high | 12 Ų | 12 | 52.6 Ų | 52.6 | 12% | 0.124 | 30% | 0.297 | C | S | . | . | trans | -82.8 | -161.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | W198 T304 F310 T311 | W198-G306 VanDerWaalsContact CD1-O 3.24Å; T304-G306 PolarHBondContact O-N 3.02Å; T304-G306 VanDerWaalsContact O-N 3.1Å; G306-F310 CarbonylContact C-O 3.54Å; G306-F310 VanDerWaalsContact CA-O 3.23Å; G306-F310 WeakPolarHBondContact CA-O 3.37Å; G306-T311 VanDerWaalsContact CA-O 3.25Å; G306-T311 WeakPolarHBondContact CA-O 3.43Å; G306-T311 PolarHBondContact N-O 2.93Å | ||
| 307 | V | 92.8 | Very high | 90.6 | Very high | 43 Ų | 43 | 46.8 Ų | 46.8 | 26% | 0.261 | 27% | 0.274 | S | S | . | . | B | Isolated β-bridge | trans | -160 | 161.5 | -176.8 | 75 | 0 | 0 | 0 | 0 | 112.7 | W198 W309 F310 | W198-V307 HydrophobicContact CB-CG1 4.43Å; W198-V307 HydrophobicContact CD2-CB 4.15Å; W198-V307 HydrophobicContact CD2-CG1 3.84Å; W198-V307 HydrophobicContact CE3-CG1 4.35Å; W198-V307 HydrophobicContact CG-CB 3.99Å; W198-V307 HydrophobicContact CG-CG1 3.86Å; W198-V307 HydrophobicContact CZ2-CG2 4.35Å; V307-W309 PolarHBondContact O-N 2.89Å; V307-W309 VanDerWaalsContact O-N 3.16Å; V307-F310 HydrophobicContact CG1-CE1 4.09Å; V307-F310 HydrophobicContact CG1-CE2 4.04Å; V307-F310 HydrophobicContact CG1-CZ 3.6Å; V307-F310 PolarHBondContact N-O 3.37Å; V307-F310 CarbonylContact O-C 3.57Å; V307-F310 WeakPolarHBondContact O-CD1 3.34Å; V307-F310 WeakPolarHBondContact O-CE1 3.4Å; V307-F310 WeakPolarHBondContact O-CG 3.35Å; V307-F310 PolarHBondContact O-N 2.86Å |
| 308 | L | 92.5 | Very high | 90.9 | Very high | 136 Ų | 136 | 47.1 Ų | 47.1 | 71% | 0.712 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.8 | -114.4 | 179 | -55.3 | 178.8 | 0 | 0 | 0 | 112 | ||
| 309 | W | 93.1 | Very high | 92 | Very high | 83 Ų | 83 | 50.3 Ų | 50.3 | 31% | 0.314 | 29% | 0.289 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.8 | -3.5 | -179.5 | 68.2 | 85.4 | 0 | 0 | 0 | 114 | V307 D317 F319 I321 L322 | V307-W309 PolarHBondContact O-N 2.89Å; V307-W309 VanDerWaalsContact O-N 3.16Å; W309-D317 PolarHBondContact NE1-OD1 2.94Å; W309-D317 PolarHBondContact NE1-OD2 2.9Å; W309-F319 HydrophobicContact CB-CD2 3.86Å; W309-F319 HydrophobicContact CB-CE2 3.98Å; W309-F319 AromaticContact CD1-CD2 3.87Å; W309-F319 HydrophobicContact CG-CD2 4.13Å; W309-I321 HydrophobicContact CD2-CD1 3.95Å; W309-I321 HydrophobicContact CE3-CD1 4.49Å; W309-I321 HydrophobicContact CG-CD1 4.18Å; W309-I321 HydrophobicContact CH2-CG2 3.96Å; W309-I321 HydrophobicContact CZ2-CB 3.8Å; W309-I321 HydrophobicContact CZ2-CD1 4.33Å; W309-I321 HydrophobicContact CZ2-CG2 3.46Å; W309-I321 VanDerWaalsContact CZ2-CG2 3.46Å; W309-L322 HydrophobicContact CZ2-CD2 3.97Å; W309-L322 HydrophobicContact CZ2-CG 4.04Å |
| 310 | F | 92.2 | Very high | 92.4 | Very high | 16 Ų | 16 | 54.7 Ų | 54.7 | 7% | 0.07 | 31% | 0.306 | C | S | . | . | B | Isolated β-bridge | trans | -125.6 | 75.2 | -177.3 | 60.3 | -80.2 | 0 | 0 | 0 | 109.9 | G306 V307 L313 L322 T370 T374 | G306-F310 CarbonylContact C-O 3.54Å; G306-F310 VanDerWaalsContact CA-O 3.23Å; G306-F310 WeakPolarHBondContact CA-O 3.37Å; V307-F310 HydrophobicContact CG1-CE1 4.09Å; V307-F310 HydrophobicContact CG1-CE2 4.04Å; V307-F310 HydrophobicContact CG1-CZ 3.6Å; V307-F310 PolarHBondContact N-O 3.37Å; V307-F310 CarbonylContact O-C 3.57Å; V307-F310 WeakPolarHBondContact O-CD1 3.34Å; V307-F310 WeakPolarHBondContact O-CE1 3.4Å; V307-F310 WeakPolarHBondContact O-CG 3.35Å; V307-F310 PolarHBondContact O-N 2.86Å; F310-L313 HydrophobicContact CD2-CD2 3.88Å; F310-L313 HydrophobicContact CE2-CD2 4.08Å; F310-L322 HydrophobicContact CB-CD1 4.45Å; F310-L322 HydrophobicContact CD1-CD1 3.97Å; F310-L322 HydrophobicContact CD2-CD1 3.97Å; F310-L322 HydrophobicContact CE1-CD1 4.18Å; F310-L322 HydrophobicContact CE1-CD2 4.37Å; F310-L322 HydrophobicContact CE2-CD1 4.18Å; F310-L322 HydrophobicContact CG-CD1 3.88Å; F310-L322 HydrophobicContact CZ-CD1 4.28Å; F310-T370 HydrophobicContact CB-CG2 4.17Å; F310-T374 WeakPolarHBondContact CE2-OG1 3.5Å |
| 311 | T | 92.8 | Very high | 92.9 | Very high | 90 Ų | 90 | 54.5 Ų | 54.5 | 55% | 0.552 | 30% | 0.299 | S | S | * | . | trans | -69.7 | -40.3 | 176.3 | 47 | 0 | 0 | 0 | 0 | 112.4 | T304 G306 | T304-T311 CarbonylContact C-O 3.5Å; G306-T311 VanDerWaalsContact CA-O 3.25Å; G306-T311 WeakPolarHBondContact CA-O 3.43Å; G306-T311 PolarHBondContact N-O 2.93Å | ||
| 312 | D | 93.9 | Very high | 93.2 | Very high | 47 Ų | 47 | 54.1 Ų | 54.1 | 25% | 0.251 | 30% | 0.297 | S | S | . | . | trans | -86.1 | 118.3 | 173.6 | -173.8 | -9.1 | 0 | 0 | 0 | 110.3 | Q303 S314 A315 T370 | Q303-D312 WeakPolarHBondContact O-CA 3.3Å; D312-S314 WeakPolarHBondContact OD1-CA 3.21Å; D312-S314 VanDerWaalsContact OD1-CB 3.29Å; D312-S314 WeakPolarHBondContact OD1-CB 3.33Å; D312-S314 PolarHBondContact OD1-N 3.5Å; D312-S314 PolarHBondContact OD1-OG 2.83Å; D312-S314 PolarHBondContact OD2-OG 3.28Å; D312-A315 HydrophobicContact CB-CB 4.16Å; D312-A315 PolarHBondContact OD1-N 3.22Å; D312-A315 VanDerWaalsContact OD1-N 3.13Å; D312-A315 VanDerWaalsContact OD2-CB 3.26Å; D312-A315 WeakPolarHBondContact OD2-CB 3.33Å; D312-T370 PolarHBondContact O-OG1 2.91Å | ||
| 313 | L | 94.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 54.1 Ų | 54.1 | 0% | 0 | 30% | 0.296 | C | S | . | . | S | Bend | trans | -87.4 | -12 | 176.2 | -74 | 168.9 | 0 | 0 | 0 | 113.7 | W197 W198 I201 L302 G305 F310 T370 A371 | W197-L313 HydrophobicContact CB-CD1 3.55Å; W198-L313 HydrophobicContact CB-CD1 4.2Å; I201-L313 HydrophobicContact CD1-CD1 4.35Å; L302-L313 HydrophobicContact CD2-CB 4.18Å; L302-L313 HydrophobicContact CG-CB 3.87Å; L302-L313 VanDerWaalsContact O-CB 3.31Å; L302-L313 WeakPolarHBondContact O-CB 3.24Å; L302-L313 PolarHBondContact O-N 3.48Å; G305-L313 WeakPolarHBondContact O-CD1 3.25Å; F310-L313 HydrophobicContact CD2-CD2 3.88Å; F310-L313 HydrophobicContact CE2-CD2 4.08Å; L313-T370 WeakPolarHBondContact CA-OG1 3.32Å; L313-T370 PolarHBondContact O-OG1 3.42Å; L313-A371 HydrophobicContact CB-CB 4.18Å; L313-A371 WeakPolarHBondContact O-CB 3.08Å; L313-A371 PolarHBondContact O-N 3.19Å |
| 314 | S | 95 | Very high | 93.7 | Very high | 20 Ų | 20 | 55.5 Ų | 55.5 | 14% | 0.14 | 30% | 0.301 | C | S | . | . | S | Bend | trans | -88.8 | -34.5 | 178.5 | 77.3 | 0 | 0 | 0 | 0 | 113.3 | D312 P369 | D312-S314 WeakPolarHBondContact OD1-CA 3.21Å; D312-S314 VanDerWaalsContact OD1-CB 3.29Å; D312-S314 WeakPolarHBondContact OD1-CB 3.33Å; D312-S314 PolarHBondContact OD1-N 3.5Å; D312-S314 PolarHBondContact OD1-OG 2.83Å; D312-S314 PolarHBondContact OD2-OG 3.28Å; S314-P369 VanDerWaalsContact O-CB 3.3Å; S314-P369 WeakPolarHBondContact O-CB 3.16Å; S314-P369 WeakPolarHBondContact O-CG 3.48Å |
| 315 | A | 94.4 | Very high | 94 | Very high | 40 Ų | 40 | 51.9 Ų | 51.9 | 33% | 0.331 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -75 | 167.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | D312 P369 T370 | D312-A315 HydrophobicContact CB-CB 4.16Å; D312-A315 PolarHBondContact OD1-N 3.22Å; D312-A315 VanDerWaalsContact OD1-N 3.13Å; D312-A315 VanDerWaalsContact OD2-CB 3.26Å; D312-A315 WeakPolarHBondContact OD2-CB 3.33Å; A315-P369 CarbonylContact O-C 3.59Å; A315-P369 VanDerWaalsContact O-CA 3.28Å; A315-P369 WeakPolarHBondContact O-CA 3.24Å; A315-T370 PolarHBondContact O-N 3.28Å; A315-T370 PolarHBondContact O-OG1 2.78Å |
| 316 | A | 95.3 | Very high | 94.3 | Very high | 36 Ų | 36 | 51.7 Ų | 51.7 | 30% | 0.298 | 28% | 0.279 | S | S | . | . | P | Polyproline II helix | trans | -74.5 | 159.1 | 169 | 0 | 0 | 0 | 0 | 0 | 111.4 | P318 | A316-P318 VanDerWaalsContact O-CD 3.29Å; A316-P318 WeakPolarHBondContact O-CD 3.46Å |
| 317 | D | 94.8 | Very high | 94.5 | Very high | 1 Ų | 1 | 51.9 Ų | 51.9 | 1% | 0.005 | 28% | 0.278 | C | S | . | . | P | Polyproline II helix | trans | -64.9 | 117 | -178 | -172.8 | -30.9 | 0 | 0 | 0 | 110.8 | W309 F319 Y320 I321 L322 P323 T370 | W309-D317 PolarHBondContact NE1-OD1 2.94Å; W309-D317 PolarHBondContact NE1-OD2 2.9Å; D317-F319 PolarHBondContact O-N 3.07Å; D317-F319 VanDerWaalsContact O-N 3.07Å; D317-F319 PolarHBondContact OD1-N 2.94Å; D317-Y320 PolarHBondContact O-N 3.33Å; D317-Y320 VanDerWaalsContact O-N 3.14Å; D317-Y320 PolarHBondContact OD1-N 2.99Å; D317-Y320 VanDerWaalsContact OD1-N 3.09Å; D317-I321 PolarHBondContact OD2-N 3.31Å; D317-I321 VanDerWaalsContact OD2-N 3.09Å; D317-L322 VanDerWaalsContact OD2-CB 3.29Å; D317-L322 WeakPolarHBondContact OD2-CB 3.31Å; D317-L322 WeakPolarHBondContact OD2-CG 3.42Å; D317-L322 PolarHBondContact OD2-N 3.44Å; D317-P323 HydrophobicContact CB-CG 4.44Å; D317-T370 VanDerWaalsContact CA-CG2 3.4Å; D317-T370 HydrophobicContact CB-CG2 3.72Å; D317-T370 VanDerWaalsContact N-CG2 3.29Å |
| 318 | P | 93.2 | Very high | 94.6 | Very high | 88 Ų | 88 | 51.3 Ų | 51.3 | 57% | 0.571 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -23.1 | -178.5 | -24.3 | 34.7 | 0 | 0 | 0 | 114.4 | A316 | A316-P318 VanDerWaalsContact O-CD 3.29Å; A316-P318 WeakPolarHBondContact O-CD 3.46Å |
| 319 | F | 95.1 | Very high | 94.7 | Very high | 134 Ų | 134 | 45.8 Ų | 45.8 | 59% | 0.588 | 25% | 0.253 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.3 | 2.1 | -177.9 | -56.8 | -77.7 | 0 | 0 | 0 | 112.9 | W309 D317 I321 | W309-F319 HydrophobicContact CB-CD2 3.86Å; W309-F319 HydrophobicContact CB-CE2 3.98Å; W309-F319 AromaticContact CD1-CD2 3.87Å; W309-F319 HydrophobicContact CG-CD2 4.13Å; D317-F319 PolarHBondContact O-N 3.07Å; D317-F319 VanDerWaalsContact O-N 3.07Å; D317-F319 PolarHBondContact OD1-N 2.94Å; F319-I321 HydrophobicContact CB-CD1 3.74Å; F319-I321 HydrophobicContact CB-CG1 3.8Å; F319-I321 HydrophobicContact CG-CD1 4.49Å; F319-I321 PolarHBondContact O-N 3.31Å |
| 320 | Y | 94.9 | Very high | 94.6 | Very high | 97 Ų | 97 | 44.1 Ų | 44.1 | 38% | 0.38 | 25% | 0.249 | S | C | . | . | trans | 55.2 | 14.2 | -176.8 | -52.7 | -69.7 | 0 | 0 | 0 | 116.2 | D317 L322 P323 F324 I366 | D317-Y320 PolarHBondContact O-N 3.33Å; D317-Y320 VanDerWaalsContact O-N 3.14Å; D317-Y320 PolarHBondContact OD1-N 2.99Å; D317-Y320 VanDerWaalsContact OD1-N 3.09Å; Y320-L322 PolarHBondContact O-N 3.01Å; Y320-P323 VanDerWaalsContact O-CD 3.28Å; Y320-P323 WeakPolarHBondContact O-CD 3.39Å; Y320-F324 VanDerWaalsContact O-CD2 3.24Å; Y320-F324 WeakPolarHBondContact O-CD2 3.4Å; Y320-F324 PolarHBondContact O-N 3.26Å; Y320-I366 HydrophobicContact CD1-CD1 3.76Å; Y320-I366 HydrophobicContact CD1-CG1 3.36Å; Y320-I366 HydrophobicContact CE1-CD1 4.19Å; Y320-I366 HydrophobicContact CE1-CG1 3.75Å; Y320-I366 HydrophobicContact CG-CD1 4.06Å; Y320-I366 HydrophobicContact CG-CG1 4.13Å | ||
| 321 | I | 96.1 | Very high | 94.5 | Very high | 74 Ų | 74 | 47.2 Ų | 47.2 | 38% | 0.379 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.2 | -44.8 | -175.6 | -63.1 | 168.6 | 0 | 0 | 0 | 110.8 | W309 D317 F319 F324 A325 | W309-I321 HydrophobicContact CD2-CD1 3.95Å; W309-I321 HydrophobicContact CE3-CD1 4.49Å; W309-I321 HydrophobicContact CG-CD1 4.18Å; W309-I321 HydrophobicContact CH2-CG2 3.96Å; W309-I321 HydrophobicContact CZ2-CB 3.8Å; W309-I321 HydrophobicContact CZ2-CD1 4.33Å; W309-I321 HydrophobicContact CZ2-CG2 3.46Å; W309-I321 VanDerWaalsContact CZ2-CG2 3.46Å; D317-I321 PolarHBondContact OD2-N 3.31Å; D317-I321 VanDerWaalsContact OD2-N 3.09Å; F319-I321 HydrophobicContact CB-CD1 3.74Å; F319-I321 HydrophobicContact CB-CG1 3.8Å; F319-I321 HydrophobicContact CG-CD1 4.49Å; F319-I321 PolarHBondContact O-N 3.31Å; I321-F324 PolarHBondContact O-N 3.28Å; I321-A325 VanDerWaalsContact O-CB 3.29Å; I321-A325 WeakPolarHBondContact O-CB 3.29Å; I321-A325 PolarHBondContact O-N 2.85Å |
| 322 | L | 95.4 | Very high | 94.4 | Very high | 5 Ų | 5 | 48.9 Ų | 48.9 | 3% | 0.026 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64.1 | -48.5 | 179 | -65.7 | 173.9 | 0 | 0 | 0 | 112.6 | W309 F310 D317 Y320 F324 A325 V326 T370 F373 L377 | W309-L322 HydrophobicContact CZ2-CD2 3.97Å; W309-L322 HydrophobicContact CZ2-CG 4.04Å; F310-L322 HydrophobicContact CB-CD1 4.45Å; F310-L322 HydrophobicContact CD1-CD1 3.97Å; F310-L322 HydrophobicContact CD2-CD1 3.97Å; F310-L322 HydrophobicContact CE1-CD1 4.18Å; F310-L322 HydrophobicContact CE1-CD2 4.37Å; F310-L322 HydrophobicContact CE2-CD1 4.18Å; F310-L322 HydrophobicContact CG-CD1 3.88Å; F310-L322 HydrophobicContact CZ-CD1 4.28Å; D317-L322 VanDerWaalsContact OD2-CB 3.29Å; D317-L322 WeakPolarHBondContact OD2-CB 3.31Å; D317-L322 WeakPolarHBondContact OD2-CG 3.42Å; D317-L322 PolarHBondContact OD2-N 3.44Å; Y320-L322 PolarHBondContact O-N 3.01Å; L322-F324 VanDerWaalsContact C-N 3.35Å; L322-F324 PolarHBondContact O-N 3.39Å; L322-A325 PolarHBondContact O-N 3.28Å; L322-V326 WeakPolarHBondContact O-CB 3.42Å; L322-V326 WeakPolarHBondContact O-CG2 3.32Å; L322-V326 PolarHBondContact O-N 3.49Å; L322-T370 HydrophobicContact CD1-CG2 4.13Å; L322-F373 HydrophobicContact CB-CB 3.79Å; L322-F373 HydrophobicContact CB-CG 4.43Å; L322-L377 HydrophobicContact CD2-CD2 3.78Å |
| 323 | P | 95.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -49.6 | -46.6 | 168.7 | -28.5 | 28.4 | 0 | 0 | 0 | 115 | D317 Y320 T327 L362 I366 F373 | D317-P323 HydrophobicContact CB-CG 4.44Å; Y320-P323 VanDerWaalsContact O-CD 3.28Å; Y320-P323 WeakPolarHBondContact O-CD 3.39Å; P323-T327 WeakPolarHBondContact O-CB 3.3Å; P323-T327 PolarHBondContact O-N 2.85Å; P323-T327 PolarHBondContact O-OG1 3.32Å; P323-L362 HydrophobicContact CB-CD1 3.73Å; P323-I366 HydrophobicContact CB-CG1 4.27Å; P323-I366 HydrophobicContact CG-CG1 4.31Å; P323-F373 HydrophobicContact CB-CE1 4.08Å; P323-F373 HydrophobicContact CB-CE2 4.47Å; P323-F373 HydrophobicContact CB-CZ 3.98Å; P323-F373 HydrophobicContact CG-CD2 4.16Å; P323-F373 HydrophobicContact CG-CE1 4.19Å; P323-F373 HydrophobicContact CG-CE2 3.77Å; P323-F373 HydrophobicContact CG-CZ 3.78Å |
| 324 | F | 96.3 | Very high | 93.7 | Very high | 123 Ų | 123 | 50 Ų | 50 | 54% | 0.539 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -69.7 | -41.9 | 178.3 | -77.4 | -67.7 | 0 | 0 | 0 | 112.4 | Y320 I321 L322 V326 T327 G328 L362 | Y320-F324 VanDerWaalsContact O-CD2 3.24Å; Y320-F324 WeakPolarHBondContact O-CD2 3.4Å; Y320-F324 PolarHBondContact O-N 3.26Å; I321-F324 PolarHBondContact O-N 3.28Å; L322-F324 VanDerWaalsContact C-N 3.35Å; L322-F324 PolarHBondContact O-N 3.39Å; F324-V326 PolarHBondContact O-N 3.21Å; F324-T327 PolarHBondContact O-N 3.41Å; F324-G328 PolarHBondContact O-N 3.16Å; F324-L362 HydrophobicContact CD1-CD2 3.95Å; F324-L362 HydrophobicContact CE1-CD2 3.66Å; F324-L362 HydrophobicContact CZ-CD2 4.37Å |
| 325 | A | 96.1 | Very high | 93.2 | Very high | 35 Ų | 35 | 51.5 Ų | 51.5 | 29% | 0.289 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.3 | -39.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | I321 L322 T329 L377 | I321-A325 VanDerWaalsContact O-CB 3.29Å; I321-A325 WeakPolarHBondContact O-CB 3.29Å; I321-A325 PolarHBondContact O-N 2.85Å; L322-A325 PolarHBondContact O-N 3.28Å; A325-T329 WeakPolarHBondContact O-CB 3.33Å; A325-T329 WeakPolarHBondContact O-CG2 3.24Å; A325-T329 PolarHBondContact O-N 3.47Å; A325-T329 PolarHBondContact O-OG1 3.28Å; A325-L377 HydrophobicContact CB-CD1 3.95Å; A325-L377 HydrophobicContact CB-CD2 4.26Å |
| 326 | V | 95.6 | Very high | 92.5 | Very high | 5 Ų | 5 | 52.7 Ų | 52.7 | 3% | 0.03 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -66.3 | -41.5 | 174.3 | 168.9 | 0 | 0 | 0 | 0 | 111.3 | L322 F324 T329 M330 F373 W376 L377 N380 | L322-V326 WeakPolarHBondContact O-CB 3.42Å; L322-V326 WeakPolarHBondContact O-CG2 3.32Å; L322-V326 PolarHBondContact O-N 3.49Å; F324-V326 PolarHBondContact O-N 3.21Å; V326-T329 WeakPolarHBondContact CA-OG1 3.41Å; V326-T329 PolarHBondContact O-OG1 2.94Å; V326-M330 WeakPolarHBondContact O-CB 3.37Å; V326-M330 PolarHBondContact O-N 3.36Å; V326-F373 HydrophobicContact CB-CD1 4.03Å; V326-F373 HydrophobicContact CG1-CD1 4.26Å; V326-F373 HydrophobicContact CG2-CB 4.38Å; V326-F373 HydrophobicContact CG2-CD1 3.93Å; V326-W376 HydrophobicContact CG1-CB 4Å; V326-W376 HydrophobicContact CG1-CD2 3.59Å; V326-W376 HydrophobicContact CG1-CE3 4.09Å; V326-W376 HydrophobicContact CG1-CG 3.53Å; V326-W376 HydrophobicContact CG2-CB 4.1Å; V326-L377 HydrophobicContact CG2-CB 3.69Å; V326-L377 HydrophobicContact CG2-CD1 4.25Å; V326-N380 PolarHBondContact O-ND2 2.98Å |
| 327 | T | 95.1 | Very high | 91.3 | Very high | 17 Ų | 17 | 52.3 Ų | 52.3 | 10% | 0.104 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.3 | -46.6 | 176.2 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | P323 F324 M330 F331 P358 L359 L362 | P323-T327 WeakPolarHBondContact O-CB 3.3Å; P323-T327 PolarHBondContact O-N 2.85Å; P323-T327 PolarHBondContact O-OG1 3.32Å; F324-T327 PolarHBondContact O-N 3.41Å; T327-M330 PolarHBondContact O-N 2.86Å; T327-F331 PolarHBondContact O-N 3.35Å; T327-P358 HydrophobicContact CG2-CB 3.91Å; T327-L359 HydrophobicContact CG2-CD2 3.95Å; T327-L362 HydrophobicContact CG2-CD2 4.44Å |
| 328 | G | 95 | Very high | 89.4 | Confident | 30 Ų | 30 | 53.8 Ų | 53.8 | 31% | 0.309 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65 | -46.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F324 M330 F331 F332 | F324-G328 PolarHBondContact O-N 3.16Å; G328-M330 VanDerWaalsContact C-N 3.32Å; G328-M330 PolarHBondContact O-N 3.22Å; G328-F331 WeakPolarHBondContact O-CB 3.25Å; G328-F331 PolarHBondContact O-N 3.27Å; G328-F332 WeakPolarHBondContact O-CD2 3.42Å; G328-F332 PolarHBondContact O-N 3.12Å |
| 329 | T | 94.6 | Very high | 87.3 | Confident | 21 Ų | 21 | 54.7 Ų | 54.7 | 13% | 0.129 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -64.7 | -35.3 | 176.1 | 52.5 | 0 | 0 | 0 | 0 | 112.3 | A325 V326 F332 I333 L377 N380 L384 | A325-T329 WeakPolarHBondContact O-CB 3.33Å; A325-T329 WeakPolarHBondContact O-CG2 3.24Å; A325-T329 PolarHBondContact O-N 3.47Å; A325-T329 PolarHBondContact O-OG1 3.28Å; V326-T329 WeakPolarHBondContact CA-OG1 3.41Å; V326-T329 PolarHBondContact O-OG1 2.94Å; T329-F332 PolarHBondContact O-N 2.95Å; T329-I333 WeakPolarHBondContact O-CD1 3.42Å; T329-I333 VanDerWaalsContact O-CG1 3.24Å; T329-I333 WeakPolarHBondContact O-CG1 3.35Å; T329-I333 PolarHBondContact O-N 2.82Å; T329-L377 HydrophobicContact CG2-CD1 3.94Å; T329-N380 WeakPolarHBondContact OG1-CB 3.44Å; T329-N380 PolarHBondContact OG1-ND2 3.25Å; T329-L384 HydrophobicContact CG2-CD1 4.11Å |
| 330 | M | 91 | Very high | 85 | Confident | 48 Ų | 48 | 50.1 Ų | 50.1 | 24% | 0.236 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.5 | -40.6 | 172.5 | -169.6 | 67 | 174 | 0 | 0 | 111.9 | V326 T327 G328 I333 L334 P358 | V326-M330 WeakPolarHBondContact O-CB 3.37Å; V326-M330 PolarHBondContact O-N 3.36Å; T327-M330 PolarHBondContact O-N 2.86Å; G328-M330 VanDerWaalsContact C-N 3.32Å; G328-M330 PolarHBondContact O-N 3.22Å; M330-I333 PolarHBondContact O-N 3.39Å; M330-L334 WeakPolarHBondContact O-CG 3.27Å; M330-L334 PolarHBondContact O-N 3.14Å; M330-P358 HydrophobicContact CB-CB 4.45Å; M330-P358 HydrophobicContact CB-CG 4.26Å; M330-P358 HydrophobicContact CG-CB 4.33Å; M330-P358 HydrophobicContact CG-CG 3.78Å |
| 331 | F | 90.9 | Very high | 82.9 | Confident | 80 Ų | 80 | 46.8 Ų | 46.8 | 35% | 0.351 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 172.5 | 179 | -80.3 | 0 | 0 | 0 | 111.8 | T327 G328 I333 L334 E335 R355 | T327-F331 PolarHBondContact O-N 3.35Å; G328-F331 WeakPolarHBondContact O-CB 3.25Å; G328-F331 PolarHBondContact O-N 3.27Å; F331-I333 PolarHBondContact O-N 2.82Å; F331-L334 PolarHBondContact O-N 2.76Å; F331-E335 PolarHBondContact O-N 3.37Å; F331-R355 HydrophobicContact CD2-CG 3.77Å; F331-R355 HydrophobicContact CE2-CG 3.35Å; F331-R355 HydrophobicContact CZ-CG 4.15Å |
| 332 | F | 90.8 | Very high | 80.8 | Confident | 125 Ų | 125 | 45.5 Ų | 45.5 | 55% | 0.548 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.1 | -38.3 | 176.3 | -76.7 | -65.9 | 0 | 0 | 0 | 113 | G328 T329 L334 E335 L336 L384 | G328-F332 WeakPolarHBondContact O-CD2 3.42Å; G328-F332 PolarHBondContact O-N 3.12Å; T329-F332 PolarHBondContact O-N 2.95Å; F332-L334 VanDerWaalsContact C-N 3.33Å; F332-L334 PolarHBondContact O-N 3.29Å; F332-E335 PolarHBondContact O-N 3.35Å; F332-L336 WeakPolarHBondContact O-CB 3.5Å; F332-L336 WeakPolarHBondContact O-CG 3.42Å; F332-L336 PolarHBondContact O-N 2.93Å; F332-L384 HydrophobicContact CB-CD2 3.89Å |
| 333 | I | 88.6 | Confident | 78.7 | Confident | 28 Ų | 28 | 47.8 Ų | 47.8 | 14% | 0.144 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61.5 | -42.4 | 173.9 | -70.3 | 161.6 | 0 | 0 | 0 | 110.8 | T329 M330 F331 G337 N380 L384 | T329-I333 WeakPolarHBondContact O-CD1 3.42Å; T329-I333 VanDerWaalsContact O-CG1 3.24Å; T329-I333 WeakPolarHBondContact O-CG1 3.35Å; T329-I333 PolarHBondContact O-N 2.82Å; M330-I333 PolarHBondContact O-N 3.39Å; F331-I333 PolarHBondContact O-N 2.82Å; I333-G337 VanDerWaalsContact O-CA 3.26Å; I333-G337 WeakPolarHBondContact O-CA 3.28Å; I333-G337 PolarHBondContact O-N 3.31Å; I333-N380 HydrophobicContact CD1-CB 3.57Å; I333-L384 HydrophobicContact CB-CD2 4.49Å; I333-L384 HydrophobicContact CD1-CG 4.42Å; I333-L384 HydrophobicContact CG1-CD2 3.64Å; I333-L384 HydrophobicContact CG1-CG 3.72Å |
| 334 | L | 84.6 | Confident | 76.8 | Confident | 42 Ų | 42 | 49.1 Ų | 49.1 | 22% | 0.22 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.5 | -37.5 | 178.4 | -72.2 | 168.3 | 0 | 0 | 0 | 112 | M330 F331 F332 A338 F354 P358 | M330-L334 WeakPolarHBondContact O-CG 3.27Å; M330-L334 PolarHBondContact O-N 3.14Å; F331-L334 PolarHBondContact O-N 2.76Å; F332-L334 VanDerWaalsContact C-N 3.33Å; F332-L334 PolarHBondContact O-N 3.29Å; L334-A338 WeakPolarHBondContact O-CB 3.45Å; L334-A338 PolarHBondContact O-N 3.44Å; L334-F354 WeakPolarHBondContact CD1-O 3.29Å; L334-F354 HydrophobicContact CD2-CB 4.21Å; L334-P358 HydrophobicContact CD1-CG 3.89Å |
| 335 | E | 83.7 | Confident | 74.7 | Confident | 53 Ų | 53 | 44.2 Ų | 44.2 | 25% | 0.248 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -71.9 | -51.6 | 179.7 | -156.4 | 59 | -138.9 | 0 | 0 | 111.8 | F331 F332 G337 A338 E339 K351 R355 | F331-E335 PolarHBondContact O-N 3.37Å; F332-E335 PolarHBondContact O-N 3.35Å; E335-G337 VanDerWaalsContact C-N 3.32Å; E335-G337 PolarHBondContact O-N 2.83Å; E335-A338 PolarHBondContact O-N 3.4Å; E335-E339 PolarHBondContact O-N 3Å; E335-K351 VanDerWaalsContact OE1-CE 3.26Å; E335-K351 WeakPolarHBondContact OE1-CE 3.41Å; E335-K351 IonicContact OE1-NZ 2.93Å; E335-K351 PolarHBondContact OE1-NZ 3.27Å; E335-K351 WeakPolarHBondContact OE2-CE 3.49Å; E335-K351 IonicContact OE2-NZ 2.75Å; E335-R355 IonicContact OE1-NH2 3.81Å; E335-R355 PolarHBondContact OE1-NH2 3.43Å; E335-R355 IonicContact OE2-CZ 3.41Å; E335-R355 VanDerWaalsContact OE2-CZ 3.24Å; E335-R355 IonicContact OE2-NE 2.78Å; E335-R355 PolarHBondContact OE2-NE 2.79Å; E335-R355 IonicContact OE2-NH2 3.81Å; E335-R355 PolarHBondContact OE2-NH2 3.12Å |
| 336 | L | 80.4 | Confident | 72.8 | Confident | 65 Ų | 65 | 44.8 Ų | 44.8 | 34% | 0.34 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -68.9 | -28.5 | 177.6 | -64.9 | 171.4 | 0 | 0 | 0 | 113.1 | F332 L384 V387 R391 | F332-L336 WeakPolarHBondContact O-CB 3.5Å; F332-L336 WeakPolarHBondContact O-CG 3.42Å; F332-L336 PolarHBondContact O-N 2.93Å; L336-L384 HydrophobicContact CD1-CD2 3.86Å; L336-V387 HydrophobicContact CB-CG1 3.99Å; L336-R391 PolarHBondContact O-NH1 3.31Å |
| 337 | G | 69.6 | Low | 71.1 | Confident | 27 Ų | 27 | 47.7 Ų | 47.7 | 28% | 0.278 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -78.1 | -35.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | I333 E335 E339 S340 G341 | I333-G337 VanDerWaalsContact O-CA 3.26Å; I333-G337 WeakPolarHBondContact O-CA 3.28Å; I333-G337 PolarHBondContact O-N 3.31Å; E335-G337 VanDerWaalsContact C-N 3.32Å; E335-G337 PolarHBondContact O-N 2.83Å; G337-E339 VanDerWaalsContact C-N 3.27Å; G337-E339 PolarHBondContact O-N 3.26Å; G337-S340 WeakPolarHBondContact O-CA 3.38Å; G337-S340 VanDerWaalsContact O-CB 3.26Å; G337-S340 WeakPolarHBondContact O-CB 3.45Å; G337-S340 PolarHBondContact O-N 2.77Å; G337-G341 PolarHBondContact O-N 3.02Å |
| 338 | A | 56 | Low | 69.8 | Low | 33 Ų | 33 | 54.3 Ų | 54.3 | 27% | 0.273 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.5 | -34.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L334 E335 S340 G341 K351 | L334-A338 WeakPolarHBondContact O-CB 3.45Å; L334-A338 PolarHBondContact O-N 3.44Å; E335-A338 PolarHBondContact O-N 3.4Å; A338-S340 PolarHBondContact O-N 3.36Å; A338-S340 VanDerWaalsContact O-N 3.15Å; A338-G341 PolarHBondContact O-N 3.09Å; A338-K351 HydrophobicContact CB-CD 3.64Å; A338-K351 HydrophobicContact CB-CG 4.21Å |
| 339 | E | 48 | Very low | 68.5 | Low | 106 Ų | 106 | 55.9 Ų | 55.9 | 50% | 0.495 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.9 | -9.2 | 169.7 | -69.1 | -166.9 | 113.4 | 0 | 0 | 114 | E335 G337 R391 R404 | E335-E339 PolarHBondContact O-N 3Å; G337-E339 VanDerWaalsContact C-N 3.27Å; G337-E339 PolarHBondContact O-N 3.26Å; E339-R391 IonicContact OE1-NH2 3.86Å; E339-R391 IonicContact OE2-CZ 2.66Å; E339-R391 IonicContact OE2-NH1 2.71Å; E339-R391 PolarHBondContact OE2-NH1 3.15Å; E339-R391 IonicContact OE2-NH2 2.72Å; E339-R391 PolarHBondContact OE2-NH2 2.93Å; E339-R404 PolarHBondContact O-NH1 3.37Å |
| 340 | S | 46.2 | Very low | 67.3 | Low | 38 Ų | 38 | 59 Ų | 59 | 27% | 0.266 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.4 | -16.8 | 169.4 | -50.8 | 0 | 0 | 0 | 0 | 112.8 | G337 A338 R404 | G337-S340 WeakPolarHBondContact O-CA 3.38Å; G337-S340 VanDerWaalsContact O-CB 3.26Å; G337-S340 WeakPolarHBondContact O-CB 3.45Å; G337-S340 PolarHBondContact O-N 2.77Å; A338-S340 PolarHBondContact O-N 3.36Å; A338-S340 VanDerWaalsContact O-N 3.15Å; S340-R404 PolarHBondContact O-NH1 2.99Å |
| 341 | G | 51.3 | Low | 66.4 | Low | 28 Ų | 28 | 59.6 Ų | 59.6 | 29% | 0.289 | 31% | 0.31 | S | S | . | . | S | Bend | trans | -69 | -177.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | N227 G337 A338 R404 | N227-G341 PolarHBondContact ND2-O 2.98Å; G337-G341 PolarHBondContact O-N 3.02Å; A338-G341 PolarHBondContact O-N 3.09Å; G341-R404 VanDerWaalsContact O-CZ 3.29Å; G341-R404 PolarHBondContact O-NH1 3.32Å |
| 342 | I | 52 | Low | 65.7 | Low | 46 Ų | 46 | 59.3 Ų | 59.3 | 24% | 0.236 | 32% | 0.315 | C | S | . | . | trans | -75 | 123.3 | 169.6 | -86.6 | 158.6 | 0 | 0 | 0 | 108.8 | L226 N227 L230 N344 L347 | L226-I342 HydrophobicContact CD2-CD1 4.17Å; L226-I342 HydrophobicContact CG-CD1 4.36Å; N227-I342 HydrophobicContact CB-CG1 4.06Å; L230-I342 HydrophobicContact CD1-CD1 4.18Å; L230-I342 HydrophobicContact CD1-CG1 4.47Å; L230-I342 HydrophobicContact CD1-CG2 4.11Å; L230-I342 HydrophobicContact CD2-CB 4.44Å; L230-I342 HydrophobicContact CD2-CG1 4.38Å; L230-I342 HydrophobicContact CD2-CG2 3.42Å; L230-I342 VanDerWaalsContact CD2-CG2 3.42Å; L230-I342 HydrophobicContact CG-CG2 4.42Å; I342-N344 HydrophobicContact CG2-CB 3.91Å; I342-N344 WeakPolarHBondContact CG2-ND2 3.34Å; I342-N344 PolarHBondContact O-N 2.99Å; I342-N344 VanDerWaalsContact O-N 3.09Å; I342-L347 HydrophobicContact CB-CD2 4.2Å; I342-L347 HydrophobicContact CG2-CD2 4.33Å; I342-L347 VanDerWaalsContact O-CD2 3.22Å; I342-L347 WeakPolarHBondContact O-CD2 3.33Å | ||
| 343 | D | 51.6 | Low | 65.2 | Low | 54 Ų | 54 | 57.4 Ų | 57.4 | 29% | 0.289 | 31% | 0.313 | S | S | . | . | trans | -71.2 | 104.7 | 170 | -62.7 | -45.7 | 0 | 0 | 0 | 107.4 | R404 L412 | D343-R404 IonicContact OD1-CZ 3.42Å; D343-R404 IonicContact OD1-NH2 2.66Å; D343-R404 PolarHBondContact OD1-NH2 3.11Å; D343-R404 IonicContact OD2-CZ 2.71Å; D343-R404 IonicContact OD2-NE 3.6Å; D343-R404 IonicContact OD2-NH2 3.89Å; D343-R404 PolarHBondContact OD2-NH2 2.85Å; D343-L412 HydrophobicContact CB-CD1 4.26Å; D343-L412 WeakPolarHBondContact O-CD1 3.38Å; D343-L412 VanDerWaalsContact O-CD2 3.24Å; D343-L412 WeakPolarHBondContact O-CD2 3.18Å | ||
| 344 | N | 55 | Low | 64.9 | Low | 27 Ų | 27 | 60 Ų | 60 | 14% | 0.144 | 32% | 0.324 | C | S | . | . | trans | -142.8 | 139.7 | 174 | -111.3 | -34.1 | 0 | 0 | 0 | 108.6 | I342 N346 L347 R348 P413 | I342-N344 HydrophobicContact CG2-CB 3.91Å; I342-N344 WeakPolarHBondContact CG2-ND2 3.34Å; I342-N344 PolarHBondContact O-N 2.99Å; I342-N344 VanDerWaalsContact O-N 3.09Å; N344-N346 VanDerWaalsContact C-N 3.34Å; N344-N346 PolarHBondContact O-N 3.19Å; N344-L347 HydrophobicContact CB-CB 3.98Å; N344-L347 WeakPolarHBondContact O-CA 3.07Å; N344-L347 VanDerWaalsContact O-CB 3.27Å; N344-L347 WeakPolarHBondContact O-CB 3.46Å; N344-L347 PolarHBondContact O-N 3.49Å; N344-R348 PolarHBondContact O-N 2.87Å; N344-P413 VanDerWaalsContact OD1-CD 3.3Å; N344-P413 WeakPolarHBondContact OD1-CD 3.36Å; N344-P413 VanDerWaalsContact OD1-CG 3.29Å; N344-P413 WeakPolarHBondContact OD1-CG 3.4Å | ||
| 345 | P | 52.6 | Low | 64.9 | Low | 20 Ų | 20 | 62.3 Ų | 62.3 | 13% | 0.13 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -68.8 | -33 | -177.8 | 27.8 | -32.8 | 0 | 0 | 0 | 112.2 | L347 R348 P413 S415 | P345-L347 PolarHBondContact O-N 2.85Å; P345-R348 VanDerWaalsContact O-CB 3.31Å; P345-R348 WeakPolarHBondContact O-CB 3.29Å; P345-R348 PolarHBondContact O-N 3.27Å; P345-P413 WeakPolarHBondContact CD-O 3.44Å; P345-P413 WeakPolarHBondContact CG-O 3.31Å; P345-S415 WeakPolarHBondContact CB-OG 3.41Å |
| 346 | N | 55.4 | Low | 65.1 | Low | 47 Ų | 47 | 63.9 Ų | 63.9 | 25% | 0.251 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -56.4 | -34.3 | 166.4 | -88.1 | -64.4 | 0 | 0 | 0 | 112.5 | N344 R348 M350 D416 S421 | N344-N346 VanDerWaalsContact C-N 3.34Å; N344-N346 PolarHBondContact O-N 3.19Å; N346-R348 VanDerWaalsContact C-N 3.29Å; N346-R348 PolarHBondContact O-N 3.41Å; N346-M350 PolarHBondContact O-N 3.48Å; N346-D416 PolarHBondContact OD1-O 3.46Å; N346-S421 PolarHBondContact OD1-OG 3.29Å |
| 347 | L | 61.8 | Low | 65.4 | Low | 66 Ų | 66 | 63.7 Ų | 63.7 | 35% | 0.346 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -75 | -13.7 | 177.4 | -116.1 | 70.7 | 0 | 0 | 0 | 113.3 | I342 N344 P345 M350 K351 | I342-L347 HydrophobicContact CB-CD2 4.2Å; I342-L347 HydrophobicContact CG2-CD2 4.33Å; I342-L347 VanDerWaalsContact O-CD2 3.22Å; I342-L347 WeakPolarHBondContact O-CD2 3.33Å; N344-L347 HydrophobicContact CB-CB 3.98Å; N344-L347 WeakPolarHBondContact O-CA 3.07Å; N344-L347 VanDerWaalsContact O-CB 3.27Å; N344-L347 WeakPolarHBondContact O-CB 3.46Å; N344-L347 PolarHBondContact O-N 3.49Å; P345-L347 PolarHBondContact O-N 2.85Å; L347-M350 HydrophobicContact CD1-SD 3.66Å; L347-M350 HydrophobicContact CG-SD 3.97Å; L347-K351 VanDerWaalsContact O-CB 3.29Å; L347-K351 WeakPolarHBondContact O-CB 3.28Å; L347-K351 PolarHBondContact O-N 3.04Å |
| 348 | R | 65.9 | Low | 66.3 | Low | 157 Ų | 157 | 62.9 Ų | 62.9 | 59% | 0.592 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -69 | -48.6 | 173.6 | -62.2 | 177.3 | -171.7 | -107.5 | 2.5 | 110.7 | N344 P345 N346 M350 K351 T352 | N344-R348 PolarHBondContact O-N 2.87Å; P345-R348 VanDerWaalsContact O-CB 3.31Å; P345-R348 WeakPolarHBondContact O-CB 3.29Å; P345-R348 PolarHBondContact O-N 3.27Å; N346-R348 VanDerWaalsContact C-N 3.29Å; N346-R348 PolarHBondContact O-N 3.41Å; R348-M350 VanDerWaalsContact C-N 3.32Å; R348-M350 PolarHBondContact O-N 2.92Å; R348-K351 WeakPolarHBondContact O-CB 3.37Å; R348-K351 PolarHBondContact O-N 2.88Å; R348-K351 VanDerWaalsContact O-N 3.16Å; R348-T352 PolarHBondContact O-N 3.46Å; R348-T352 PolarHBondContact O-OG1 3.13Å |
| 349 | T | 68.4 | Low | 68 | Low | 63 Ų | 63 | 66.4 Ų | 66.4 | 39% | 0.387 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -63.1 | -41.1 | 176 | -46.9 | 0 | 0 | 0 | 0 | 111.1 | T352 V353 L418 | T349-T352 PolarHBondContact O-N 3.03Å; T349-V353 WeakPolarHBondContact O-CG2 3.37Å; T349-V353 PolarHBondContact O-N 3.48Å; T349-L418 HydrophobicContact CG2-CB 3.74Å; T349-L418 HydrophobicContact CG2-CD1 3.95Å; T349-L418 HydrophobicContact CG2-CG 4.49Å |
| 350 | M | 70.1 | Confident | 70.1 | Confident | 86 Ų | 86 | 67 Ų | 67 | 42% | 0.424 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -57.9 | -47.1 | 171.6 | -170.6 | -179.8 | 177.8 | 0 | 0 | 111.5 | N346 L347 R348 T352 V353 F354 | N346-M350 PolarHBondContact O-N 3.48Å; L347-M350 HydrophobicContact CD1-SD 3.66Å; L347-M350 HydrophobicContact CG-SD 3.97Å; R348-M350 VanDerWaalsContact C-N 3.32Å; R348-M350 PolarHBondContact O-N 2.92Å; M350-T352 VanDerWaalsContact C-N 3.34Å; M350-T352 PolarHBondContact O-N 3.33Å; M350-V353 PolarHBondContact O-N 3.43Å; M350-F354 HydrophobicContact CE-CD2 4.39Å; M350-F354 HydrophobicContact CE-CE2 3.58Å; M350-F354 HydrophobicContact CE-CZ 4.36Å; M350-F354 HydrophobicContact CG-CD2 3.8Å; M350-F354 HydrophobicContact CG-CE2 3.68Å; M350-F354 VanDerWaalsContact O-CD2 3.27Å; M350-F354 WeakPolarHBondContact O-CD2 3.37Å; M350-F354 PolarHBondContact O-N 3.19Å; M350-F354 HydrophobicContact SD-CE2 4.48Å |
| 351 | K | 70.6 | Confident | 72.2 | Confident | 61 Ų | 61 | 67.8 Ų | 67.8 | 27% | 0.265 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -58.6 | -41.9 | 175.6 | -177.2 | -178.9 | 179.8 | 174 | 0 | 111.9 | E335 A338 L347 R348 F354 R355 | E335-K351 VanDerWaalsContact OE1-CE 3.26Å; E335-K351 WeakPolarHBondContact OE1-CE 3.41Å; E335-K351 IonicContact OE1-NZ 2.93Å; E335-K351 PolarHBondContact OE1-NZ 3.27Å; E335-K351 WeakPolarHBondContact OE2-CE 3.49Å; E335-K351 IonicContact OE2-NZ 2.75Å; A338-K351 HydrophobicContact CB-CD 3.64Å; A338-K351 HydrophobicContact CB-CG 4.21Å; L347-K351 VanDerWaalsContact O-CB 3.29Å; L347-K351 WeakPolarHBondContact O-CB 3.28Å; L347-K351 PolarHBondContact O-N 3.04Å; R348-K351 WeakPolarHBondContact O-CB 3.37Å; R348-K351 PolarHBondContact O-N 2.88Å; R348-K351 VanDerWaalsContact O-N 3.16Å; K351-F354 PolarHBondContact O-N 2.76Å; K351-R355 WeakPolarHBondContact O-CB 3.48Å; K351-R355 PolarHBondContact O-N 3.05Å |
| 352 | T | 77.6 | Confident | 74.3 | Confident | 73 Ų | 73 | 67.3 Ų | 67.3 | 45% | 0.448 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.1 | -46.6 | 175.4 | -54.1 | 0 | 0 | 0 | 0 | 111.3 | R348 T349 M350 F354 R355 I356 | R348-T352 PolarHBondContact O-N 3.46Å; R348-T352 PolarHBondContact O-OG1 3.13Å; T349-T352 PolarHBondContact O-N 3.03Å; M350-T352 VanDerWaalsContact C-N 3.34Å; M350-T352 PolarHBondContact O-N 3.33Å; T352-F354 PolarHBondContact O-N 2.94Å; T352-R355 PolarHBondContact O-N 2.88Å; T352-I356 HydrophobicContact CG2-CD1 4.08Å; T352-I356 WeakPolarHBondContact O-CG1 3.18Å; T352-I356 PolarHBondContact O-N 3.2Å; T352-I356 VanDerWaalsContact O-N 3.16Å |
| 353 | V | 80 | Confident | 76.3 | Confident | 85 Ų | 85 | 69.4 Ų | 69.4 | 52% | 0.515 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60.1 | -47.5 | 176.5 | 173.6 | 0 | 0 | 0 | 0 | 111 | T349 M350 R355 I356 M357 | T349-V353 WeakPolarHBondContact O-CG2 3.37Å; T349-V353 PolarHBondContact O-N 3.48Å; M350-V353 PolarHBondContact O-N 3.43Å; V353-R355 PolarHBondContact O-N 3.14Å; V353-I356 PolarHBondContact O-N 3.34Å; V353-M357 PolarHBondContact O-N 2.98Å |
| 354 | F | 82 | Confident | 78.3 | Confident | 84 Ų | 84 | 73 Ų | 73 | 37% | 0.368 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.4 | -36 | 177 | -81.7 | -71.8 | 0 | 0 | 0 | 113.2 | L334 M350 K351 T352 I356 M357 P358 | L334-F354 WeakPolarHBondContact CD1-O 3.29Å; L334-F354 HydrophobicContact CD2-CB 4.21Å; M350-F354 HydrophobicContact CE-CD2 4.39Å; M350-F354 HydrophobicContact CE-CE2 3.58Å; M350-F354 HydrophobicContact CE-CZ 4.36Å; M350-F354 HydrophobicContact CG-CD2 3.8Å; M350-F354 HydrophobicContact CG-CE2 3.68Å; M350-F354 VanDerWaalsContact O-CD2 3.27Å; M350-F354 WeakPolarHBondContact O-CD2 3.37Å; M350-F354 PolarHBondContact O-N 3.19Å; M350-F354 HydrophobicContact SD-CE2 4.48Å; K351-F354 PolarHBondContact O-N 2.76Å; T352-F354 PolarHBondContact O-N 2.94Å; F354-I356 VanDerWaalsContact C-N 3.28Å; F354-I356 PolarHBondContact O-N 3.4Å; F354-M357 HydrophobicContact CD1-CE 3.85Å; F354-M357 HydrophobicContact CD1-SD 3.92Å; F354-M357 HydrophobicContact CE1-CE 4.13Å; F354-M357 HydrophobicContact CE1-SD 3.93Å; F354-M357 WeakPolarHBondContact O-CB 3.47Å; F354-M357 PolarHBondContact O-N 3.28Å; F354-P358 WeakPolarHBondContact O-CD 3.16Å |
| 355 | R | 84.8 | Confident | 80 | Confident | 90 Ų | 90 | 72.2 Ų | 72.2 | 34% | 0.34 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.8 | -32.8 | 176.7 | -170.7 | -171.6 | -78.5 | 162.6 | -8 | 112.2 | F331 E335 K351 T352 V353 | F331-R355 HydrophobicContact CD2-CG 3.77Å; F331-R355 HydrophobicContact CE2-CG 3.35Å; F331-R355 HydrophobicContact CZ-CG 4.15Å; E335-R355 IonicContact OE1-NH2 3.81Å; E335-R355 PolarHBondContact OE1-NH2 3.43Å; E335-R355 IonicContact OE2-CZ 3.41Å; E335-R355 VanDerWaalsContact OE2-CZ 3.24Å; E335-R355 IonicContact OE2-NE 2.78Å; E335-R355 PolarHBondContact OE2-NE 2.79Å; E335-R355 IonicContact OE2-NH2 3.81Å; E335-R355 PolarHBondContact OE2-NH2 3.12Å; K351-R355 WeakPolarHBondContact O-CB 3.48Å; K351-R355 PolarHBondContact O-N 3.05Å; T352-R355 PolarHBondContact O-N 2.88Å; V353-R355 PolarHBondContact O-N 3.14Å |
| 356 | I | 87.2 | Confident | 82 | Confident | 85 Ų | 85 | 73.1 Ų | 73.1 | 44% | 0.436 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -82.7 | -28.5 | 177.6 | -61.7 | 166 | 0 | 0 | 0 | 111.5 | T352 V353 F354 L359 I360 | T352-I356 HydrophobicContact CG2-CD1 4.08Å; T352-I356 WeakPolarHBondContact O-CG1 3.18Å; T352-I356 PolarHBondContact O-N 3.2Å; T352-I356 VanDerWaalsContact O-N 3.16Å; V353-I356 PolarHBondContact O-N 3.34Å; F354-I356 VanDerWaalsContact C-N 3.28Å; F354-I356 PolarHBondContact O-N 3.4Å; I356-L359 WeakPolarHBondContact O-CB 3.49Å; I356-L359 PolarHBondContact O-N 3.49Å; I356-I360 HydrophobicContact CG2-CD1 3.86Å; I356-I360 HydrophobicContact CG2-CG1 4.09Å; I356-I360 PolarHBondContact O-N 2.86Å |
| 357 | M | 88.2 | Confident | 83.8 | Confident | 62 Ų | 62 | 76 Ų | 76 | 31% | 0.305 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -52.2 | -43 | -174.6 | -172.6 | -173.6 | 76.3 | 0 | 0 | 115.2 | V353 F354 L359 I360 I361 | V353-M357 PolarHBondContact O-N 2.98Å; F354-M357 HydrophobicContact CD1-CE 3.85Å; F354-M357 HydrophobicContact CD1-SD 3.92Å; F354-M357 HydrophobicContact CE1-CE 4.13Å; F354-M357 HydrophobicContact CE1-SD 3.93Å; F354-M357 WeakPolarHBondContact O-CB 3.47Å; F354-M357 PolarHBondContact O-N 3.28Å; M357-L359 VanDerWaalsContact C-N 3.29Å; M357-L359 PolarHBondContact O-N 2.63Å; M357-I360 PolarHBondContact O-N 3.21Å; M357-I361 HydrophobicContact CE-CD1 4.29Å; M357-I361 HydrophobicContact CG-CD1 3.78Å; M357-I361 HydrophobicContact CG-CG1 4.41Å; M357-I361 WeakPolarHBondContact O-CG1 3.31Å; M357-I361 PolarHBondContact O-N 3Å; M357-I361 HydrophobicContact SD-CD1 4.38Å |
| 358 | P | 88.3 | Confident | 85.4 | Confident | 9 Ų | 9 | 74.6 Ų | 74.6 | 6% | 0.058 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -57.7 | -37.7 | 174.6 | -26.7 | 35 | 0 | 0 | 0 | 113.9 | T327 M330 L334 F354 I360 I361 L362 | T327-P358 HydrophobicContact CG2-CB 3.91Å; M330-P358 HydrophobicContact CB-CB 4.45Å; M330-P358 HydrophobicContact CB-CG 4.26Å; M330-P358 HydrophobicContact CG-CB 4.33Å; M330-P358 HydrophobicContact CG-CG 3.78Å; L334-P358 HydrophobicContact CD1-CG 3.89Å; F354-P358 WeakPolarHBondContact O-CD 3.16Å; P358-I360 VanDerWaalsContact C-N 3.33Å; P358-I361 PolarHBondContact O-N 2.86Å; P358-L362 PolarHBondContact O-N 3Å |
| 359 | L | 92.2 | Very high | 86.8 | Confident | 108 Ų | 108 | 67.2 Ų | 67.2 | 57% | 0.565 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -70.3 | -31 | 179.7 | -59.2 | 172.7 | 0 | 0 | 0 | 112.1 | T327 I356 M357 P363 | T327-L359 HydrophobicContact CG2-CD2 3.95Å; I356-L359 WeakPolarHBondContact O-CB 3.49Å; I356-L359 PolarHBondContact O-N 3.49Å; M357-L359 VanDerWaalsContact C-N 3.29Å; M357-L359 PolarHBondContact O-N 2.63Å; L359-P363 VanDerWaalsContact O-CD 3.25Å; L359-P363 WeakPolarHBondContact O-CD 3.3Å |
| 360 | I | 92.2 | Very high | 88.1 | Confident | 118 Ų | 118 | 64.2 Ų | 64.2 | 61% | 0.605 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -73.4 | -35.2 | 173.5 | -62.7 | 172.2 | 0 | 0 | 0 | 110.9 | I356 M357 P358 P363 | I356-I360 HydrophobicContact CG2-CD1 3.86Å; I356-I360 HydrophobicContact CG2-CG1 4.09Å; I356-I360 PolarHBondContact O-N 2.86Å; M357-I360 PolarHBondContact O-N 3.21Å; P358-I360 VanDerWaalsContact C-N 3.33Å; I360-P363 WeakPolarHBondContact O-CD 3.25Å |
| 361 | I | 90.1 | Very high | 89.4 | Confident | 54 Ų | 54 | 60.1 Ų | 60.1 | 28% | 0.277 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -75.3 | -35.4 | -179.9 | -69.4 | 171.5 | 0 | 0 | 0 | 111.7 | M357 P358 L364 T365 W376 | M357-I361 HydrophobicContact CE-CD1 4.29Å; M357-I361 HydrophobicContact CG-CD1 3.78Å; M357-I361 HydrophobicContact CG-CG1 4.41Å; M357-I361 WeakPolarHBondContact O-CG1 3.31Å; M357-I361 PolarHBondContact O-N 3Å; M357-I361 HydrophobicContact SD-CD1 4.38Å; P358-I361 PolarHBondContact O-N 2.86Å; I361-L364 WeakPolarHBondContact O-CA 3.34Å; I361-L364 WeakPolarHBondContact O-CB 3.48Å; I361-L364 PolarHBondContact O-N 3.38Å; I361-T365 HydrophobicContact CG2-CG2 3.57Å; I361-T365 PolarHBondContact O-N 3.39Å; I361-T365 PolarHBondContact O-OG1 2.91Å; I361-W376 HydrophobicContact CG2-CH2 4.4Å |
| 362 | L | 94.3 | Very high | 90.6 | Very high | 19 Ų | 19 | 57.3 Ų | 57.3 | 10% | 0.099 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -45.2 | -57.5 | -178.5 | 174.8 | 57.7 | 0 | 0 | 0 | 114.3 | P323 F324 T327 P358 L364 T365 I366 | P323-L362 HydrophobicContact CB-CD1 3.73Å; F324-L362 HydrophobicContact CD1-CD2 3.95Å; F324-L362 HydrophobicContact CE1-CD2 3.66Å; F324-L362 HydrophobicContact CZ-CD2 4.37Å; T327-L362 HydrophobicContact CG2-CD2 4.44Å; P358-L362 PolarHBondContact O-N 3Å; L362-L364 PolarHBondContact O-N 2.77Å; L362-T365 PolarHBondContact O-N 3.4Å; L362-T365 PolarHBondContact O-OG1 3.07Å; L362-I366 HydrophobicContact CD1-CB 4.45Å; L362-I366 HydrophobicContact CD1-CD1 4.47Å; L362-I366 WeakPolarHBondContact O-CB 3.21Å; L362-I366 PolarHBondContact O-N 3.5Å |
| 363 | P | 94.3 | Very high | 91.6 | Very high | 89 Ų | 89 | 53.9 Ų | 53.9 | 58% | 0.578 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -65.8 | -20.6 | -179.2 | 26.9 | -36.3 | 0 | 0 | 0 | 114.2 | L359 I360 | L359-P363 VanDerWaalsContact O-CD 3.25Å; L359-P363 WeakPolarHBondContact O-CD 3.3Å; I360-P363 WeakPolarHBondContact O-CD 3.25Å |
| 364 | L | 92.8 | Very high | 92.4 | Very high | 131 Ų | 131 | 50.2 Ų | 50.2 | 69% | 0.686 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -78.4 | -31.3 | 172.8 | 177.5 | 63.2 | 0 | 0 | 0 | 112 | I361 L362 | I361-L364 WeakPolarHBondContact O-CA 3.34Å; I361-L364 WeakPolarHBondContact O-CB 3.48Å; I361-L364 PolarHBondContact O-N 3.38Å; L362-L364 PolarHBondContact O-N 2.77Å |
| 365 | T | 91.6 | Very high | 93.1 | Very high | 10 Ų | 10 | 46.6 Ų | 46.6 | 6% | 0.061 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -100.3 | -16.2 | -175.7 | 57 | 0 | 0 | 0 | 0 | 114.6 | I361 L362 N367 F368 F373 W376 | I361-T365 HydrophobicContact CG2-CG2 3.57Å; I361-T365 PolarHBondContact O-N 3.39Å; I361-T365 PolarHBondContact O-OG1 2.91Å; L362-T365 PolarHBondContact O-N 3.4Å; L362-T365 PolarHBondContact O-OG1 3.07Å; T365-N367 PolarHBondContact O-N 3.27Å; T365-F368 HydrophobicContact CG2-CD2 4.05Å; T365-F368 HydrophobicContact CG2-CE2 3.72Å; T365-F368 HydrophobicContact CG2-CZ 4.32Å; T365-F368 VanDerWaalsContact O-CB 3.23Å; T365-F368 WeakPolarHBondContact O-CB 3.47Å; T365-F368 WeakPolarHBondContact O-CG 3.36Å; T365-F368 PolarHBondContact O-N 2.93Å; T365-F373 WeakPolarHBondContact O-CE2 3.32Å; T365-F373 WeakPolarHBondContact O-CZ 3.47Å; T365-W376 HydrophobicContact CG2-CZ3 4.36Å |
| 366 | I | 94.1 | Very high | 93.6 | Very high | 38 Ų | 38 | 44 Ų | 44 | 20% | 0.195 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.1 | -29.3 | -168.7 | -166.3 | 164.3 | 0 | 0 | 0 | 114.4 | Y320 P323 L362 | Y320-I366 HydrophobicContact CD1-CD1 3.76Å; Y320-I366 HydrophobicContact CD1-CG1 3.36Å; Y320-I366 HydrophobicContact CE1-CD1 4.19Å; Y320-I366 HydrophobicContact CE1-CG1 3.75Å; Y320-I366 HydrophobicContact CG-CD1 4.06Å; Y320-I366 HydrophobicContact CG-CG1 4.13Å; P323-I366 HydrophobicContact CB-CG1 4.27Å; P323-I366 HydrophobicContact CG-CG1 4.31Å; L362-I366 HydrophobicContact CD1-CB 4.45Å; L362-I366 HydrophobicContact CD1-CD1 4.47Å; L362-I366 WeakPolarHBondContact O-CB 3.21Å; L362-I366 PolarHBondContact O-N 3.5Å |
| 367 | N | 93.6 | Very high | 94.1 | Very high | 107 Ų | 107 | 41.8 Ų | 41.8 | 57% | 0.572 | 22% | 0.22 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -93.7 | 19.1 | 177.5 | -60.1 | -45.7 | 0 | 0 | 0 | 113.8 | T365 | T365-N367 PolarHBondContact O-N 3.27Š|
| 368 | F | 95.1 | Very high | 94.5 | Very high | 37 Ų | 37 | 39.9 Ų | 39.9 | 16% | 0.162 | 21% | 0.212 | C | C | . | . | S | Bend | trans | -86.3 | 153.5 | 175.4 | -71.6 | 1.1 | 0 | 0 | 0 | 111.9 | F288 T365 F373 | F288-F368 AromaticContact CE2-CD2 3.92Å; F288-F368 HydrophobicContact CE2-CD2 3.92Å; F288-F368 AromaticContact CE2-CE2 3.77Å; F288-F368 HydrophobicContact CE2-CE2 3.77Å; F288-F368 HydrophobicContact CZ-CD2 4.13Å; F288-F368 AromaticContact CZ-CE2 3.6Å; F288-F368 HydrophobicContact CZ-CE2 3.6Å; F288-F368 HydrophobicContact CZ-CZ 4.41Å; T365-F368 HydrophobicContact CG2-CD2 4.05Å; T365-F368 HydrophobicContact CG2-CE2 3.72Å; T365-F368 HydrophobicContact CG2-CZ 4.32Å; T365-F368 VanDerWaalsContact O-CB 3.23Å; T365-F368 WeakPolarHBondContact O-CB 3.47Å; T365-F368 WeakPolarHBondContact O-CG 3.36Å; T365-F368 PolarHBondContact O-N 2.93Å; F368-F373 HydrophobicContact CB-CE2 3.91Å; F368-F373 HydrophobicContact CB-CZ 4.49Å |
| 369 | P | 96.6 | Very high | 94.9 | Very high | 3 Ų | 3 | 39.6 Ų | 39.6 | 2% | 0.019 | 21% | 0.21 | C | C | . | . | trans | -52.5 | 138 | 178.6 | -28.8 | 35.4 | 0 | 0 | 0 | 113.8 | A295 Y296 S314 A315 A371 V372 | A295-P369 HydrophobicContact CB-CB 3.55Å; A295-P369 HydrophobicContact CB-CG 3.42Å; A295-P369 VanDerWaalsContact CB-CG 3.42Å; Y296-P369 HydrophobicContact CE2-CG 4.12Å; S314-P369 VanDerWaalsContact O-CB 3.3Å; S314-P369 WeakPolarHBondContact O-CB 3.16Å; S314-P369 WeakPolarHBondContact O-CG 3.48Å; A315-P369 CarbonylContact O-C 3.59Å; A315-P369 VanDerWaalsContact O-CA 3.28Å; A315-P369 WeakPolarHBondContact O-CA 3.24Å; P369-A371 PolarHBondContact O-N 2.98Å; P369-V372 HydrophobicContact CB-CG2 4.3Å; P369-V372 WeakPolarHBondContact O-CB 3.23Å; P369-V372 PolarHBondContact O-N 2.77Å | ||
| 370 | T | 95.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -59.7 | -27 | 178.2 | 53.3 | 0 | 0 | 0 | 0 | 112.7 | F310 D312 L313 A315 D317 L322 V372 F373 T374 | F310-T370 HydrophobicContact CB-CG2 4.17Å; D312-T370 PolarHBondContact O-OG1 2.91Å; L313-T370 WeakPolarHBondContact CA-OG1 3.32Å; L313-T370 PolarHBondContact O-OG1 3.42Å; A315-T370 PolarHBondContact O-N 3.28Å; A315-T370 PolarHBondContact O-OG1 2.78Å; D317-T370 VanDerWaalsContact CA-CG2 3.4Å; D317-T370 HydrophobicContact CB-CG2 3.72Å; D317-T370 VanDerWaalsContact N-CG2 3.29Å; L322-T370 HydrophobicContact CD1-CG2 4.13Å; T370-V372 VanDerWaalsContact C-N 3.26Å; T370-V372 PolarHBondContact O-N 3.11Å; T370-F373 PolarHBondContact O-N 2.78Å; T370-T374 WeakPolarHBondContact O-CB 3.2Å; T370-T374 PolarHBondContact O-N 2.7Å; T370-T374 PolarHBondContact O-OG1 3.32Å |
| 371 | A | 96.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -51.4 | -44.2 | 168.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | I201 L291 L313 P369 T374 Y375 | I201-A371 HydrophobicContact CD1-CB 3.96Å; L291-A371 HydrophobicContact CB-CB 4.38Å; L291-A371 HydrophobicContact CD2-CB 4.43Å; L313-A371 HydrophobicContact CB-CB 4.18Å; L313-A371 WeakPolarHBondContact O-CB 3.08Å; L313-A371 PolarHBondContact O-N 3.19Å; P369-A371 PolarHBondContact O-N 2.98Å; A371-T374 PolarHBondContact O-N 3.08Å; A371-Y375 PolarHBondContact O-N 2.89Å; A371-Y375 VanDerWaalsContact O-N 3.07Å |
| 372 | V | 96.7 | Very high | 95.6 | Very high | 1 Ų | 1 | 32.1 Ų | 32.1 | 1% | 0.006 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -67.4 | -40.2 | -179.1 | -177.8 | 0 | 0 | 0 | 0 | 110.5 | F288 L291 R292 P369 T370 W376 | F288-V372 HydrophobicContact CD2-CG1 3.53Å; F288-V372 HydrophobicContact CE2-CG1 3.76Å; L291-V372 HydrophobicContact CB-CG2 4.1Å; R292-V372 HydrophobicContact CG-CG2 3.93Å; P369-V372 HydrophobicContact CB-CG2 4.3Å; P369-V372 WeakPolarHBondContact O-CB 3.23Å; P369-V372 PolarHBondContact O-N 2.77Å; T370-V372 VanDerWaalsContact C-N 3.26Å; T370-V372 PolarHBondContact O-N 3.11Å; V372-W376 WeakPolarHBondContact O-CB 3.41Å; V372-W376 PolarHBondContact O-N 3.09Å |
| 373 | F | 96.6 | Very high | 95.5 | Very high | 2 Ų | 2 | 31.7 Ų | 31.7 | 1% | 0.009 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -74.1 | -33.1 | 176.6 | -71.3 | -72.9 | 0 | 0 | 0 | 113.2 | L322 P323 V326 T365 F368 T370 W376 L377 | L322-F373 HydrophobicContact CB-CB 3.79Å; L322-F373 HydrophobicContact CB-CG 4.43Å; P323-F373 HydrophobicContact CB-CE1 4.08Å; P323-F373 HydrophobicContact CB-CE2 4.47Å; P323-F373 HydrophobicContact CB-CZ 3.98Å; P323-F373 HydrophobicContact CG-CD2 4.16Å; P323-F373 HydrophobicContact CG-CE1 4.19Å; P323-F373 HydrophobicContact CG-CE2 3.77Å; P323-F373 HydrophobicContact CG-CZ 3.78Å; V326-F373 HydrophobicContact CB-CD1 4.03Å; V326-F373 HydrophobicContact CG1-CD1 4.26Å; V326-F373 HydrophobicContact CG2-CB 4.38Å; V326-F373 HydrophobicContact CG2-CD1 3.93Å; T365-F373 WeakPolarHBondContact O-CE2 3.32Å; T365-F373 WeakPolarHBondContact O-CZ 3.47Å; F368-F373 HydrophobicContact CB-CE2 3.91Å; F368-F373 HydrophobicContact CB-CZ 4.49Å; T370-F373 PolarHBondContact O-N 2.78Å; F373-W376 PolarHBondContact O-N 2.79Å; F373-L377 VanDerWaalsContact O-CB 3.24Å; F373-L377 WeakPolarHBondContact O-CB 3.27Å; F373-L377 PolarHBondContact O-N 3.41Å |
| 374 | T | 96.9 | Very high | 95.5 | Very high | 8 Ų | 8 | 29.3 Ų | 29.3 | 5% | 0.049 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -61.3 | -45.3 | 173.5 | -60.4 | 0 | 0 | 0 | 0 | 110.7 | I201 F310 T370 A371 T378 | I201-T374 HydrophobicContact CB-CG2 4.43Å; I201-T374 HydrophobicContact CG2-CG2 4.02Å; F310-T374 WeakPolarHBondContact CE2-OG1 3.5Å; T370-T374 WeakPolarHBondContact O-CB 3.2Å; T370-T374 PolarHBondContact O-N 2.7Å; T370-T374 PolarHBondContact O-OG1 3.32Å; A371-T374 PolarHBondContact O-N 3.08Å; T374-T378 WeakPolarHBondContact O-CB 3.28Å; T374-T378 PolarHBondContact O-N 3.38Å; T374-T378 VanDerWaalsContact O-N 3.12Å; T374-T378 PolarHBondContact O-OG1 3.36Å |
| 375 | Y | 97.4 | Very high | 95.5 | Very high | 7 Ų | 7 | 25.2 Ų | 25.2 | 3% | 0.027 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -57 | -54.1 | 168.3 | 161.5 | -98.3 | 0 | 0 | 0 | 111.6 | T205 F284 F287 L291 A371 L377 T378 S379 | T205-Y375 HydrophobicContact CG2-CD2 4.02Å; T205-Y375 HydrophobicContact CG2-CE2 3.97Å; T205-Y375 VanDerWaalsContact OG1-CD2 3.27Å; T205-Y375 WeakPolarHBondContact OG1-CD2 3.47Å; F284-Y375 AromaticContact CD2-CE1 3.73Å; F284-Y375 HydrophobicContact CD2-CE1 3.73Å; F284-Y375 AromaticContact CE2-CE1 3.83Å; F284-Y375 HydrophobicContact CE2-CE1 3.83Å; F287-Y375 HydrophobicContact CB-CD1 4.29Å; F287-Y375 HydrophobicContact CB-CD2 3.77Å; F287-Y375 HydrophobicContact CB-CE1 3.96Å; F287-Y375 HydrophobicContact CB-CE2 3.4Å; F287-Y375 HydrophobicContact CB-CG 4.23Å; F287-Y375 AromaticContact CD1-CD2 3.31Å; F287-Y375 HydrophobicContact CD1-CD2 3.31Å; F287-Y375 AromaticContact CD1-CE2 3.4Å; F287-Y375 HydrophobicContact CD1-CE2 3.4Å; F287-Y375 HydrophobicContact CD1-CG 4.26Å; F287-Y375 AromaticContact CD2-CE2 3.82Å; F287-Y375 HydrophobicContact CD2-CE2 3.82Å; F287-Y375 AromaticContact CE1-CD2 4Å; F287-Y375 HydrophobicContact CE1-CD2 4Å; F287-Y375 HydrophobicContact CE1-CE2 4.06Å; F287-Y375 HydrophobicContact CE2-CE2 4.42Å; F287-Y375 AromaticContact CG-CD2 3.66Å; F287-Y375 HydrophobicContact CG-CD2 3.66Å; F287-Y375 AromaticContact CG-CE2 3.25Å; F287-Y375 HydrophobicContact CG-CE2 3.25Å; F287-Y375 AromaticContact CG-CZ 3.87Å; L291-Y375 HydrophobicContact CD1-CD1 4.45Å; L291-Y375 HydrophobicContact CD1-CD2 4.34Å; L291-Y375 HydrophobicContact CD1-CG 3.79Å; A371-Y375 PolarHBondContact O-N 2.89Å; A371-Y375 VanDerWaalsContact O-N 3.07Å; Y375-L377 PolarHBondContact O-N 3.21Å; Y375-T378 PolarHBondContact O-N 3.41Å; Y375-S379 WeakPolarHBondContact O-CB 3.43Å; Y375-S379 PolarHBondContact O-N 3.26Å |
| 376 | W | 95.8 | Very high | 95.6 | Very high | 35 Ų | 35 | 25.7 Ų | 25.7 | 13% | 0.133 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65.2 | -39.3 | -171.9 | -156.9 | -19.3 | 0 | 0 | 0 | 111.7 | F284 V326 I361 T365 V372 F373 S379 N380 | F284-W376 HydrophobicContact CE2-CD2 4.1Å; F284-W376 AromaticContact CE2-CE2 3.92Å; F284-W376 HydrophobicContact CE2-CG 4.24Å; F284-W376 HydrophobicContact CE2-CZ2 4.41Å; F284-W376 AromaticContact CE2-NE1 3.94Å; F284-W376 HydrophobicContact CZ-CD2 4.11Å; F284-W376 AromaticContact CZ-CE2 3.9Å; F284-W376 HydrophobicContact CZ-CE3 4.37Å; F284-W376 HydrophobicContact CZ-CH2 4.25Å; F284-W376 AromaticContact CZ-CZ2 3.97Å; F284-W376 HydrophobicContact CZ-CZ2 3.97Å; F284-W376 HydrophobicContact CZ-CZ3 4.44Å; V326-W376 HydrophobicContact CG1-CB 4Å; V326-W376 HydrophobicContact CG1-CD2 3.59Å; V326-W376 HydrophobicContact CG1-CE3 4.09Å; V326-W376 HydrophobicContact CG1-CG 3.53Å; V326-W376 HydrophobicContact CG2-CB 4.1Å; I361-W376 HydrophobicContact CG2-CH2 4.4Å; T365-W376 HydrophobicContact CG2-CZ3 4.36Å; V372-W376 WeakPolarHBondContact O-CB 3.41Å; V372-W376 PolarHBondContact O-N 3.09Å; F373-W376 PolarHBondContact O-N 2.79Å; W376-S379 WeakPolarHBondContact O-CB 3.18Å; W376-S379 PolarHBondContact O-N 3.06Å; W376-N380 VanDerWaalsContact O-CB 3.31Å; W376-N380 WeakPolarHBondContact O-CB 3.49Å; W376-N380 VanDerWaalsContact O-CG 3.22Å; W376-N380 PolarHBondContact O-N 3.23Å; W376-N380 PolarHBondContact O-OD1 3.44Å |
| 377 | L | 96.9 | Very high | 95.4 | Very high | 39 Ų | 39 | 24.9 Ų | 24.9 | 20% | 0.204 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.2 | -47.9 | 175.7 | -173.1 | 59.1 | 0 | 0 | 0 | 111 | L322 A325 V326 T329 F373 Y375 S379 N380 C381 | L322-L377 HydrophobicContact CD2-CD2 3.78Å; A325-L377 HydrophobicContact CB-CD1 3.95Å; A325-L377 HydrophobicContact CB-CD2 4.26Å; V326-L377 HydrophobicContact CG2-CB 3.69Å; V326-L377 HydrophobicContact CG2-CD1 4.25Å; T329-L377 HydrophobicContact CG2-CD1 3.94Å; F373-L377 VanDerWaalsContact O-CB 3.24Å; F373-L377 WeakPolarHBondContact O-CB 3.27Å; F373-L377 PolarHBondContact O-N 3.41Å; Y375-L377 PolarHBondContact O-N 3.21Å; L377-S379 VanDerWaalsContact C-N 3.33Å; L377-S379 PolarHBondContact O-N 3.36Å; L377-N380 PolarHBondContact O-N 3.22Å; L377-N380 VanDerWaalsContact O-N 3.14Å; L377-C381 WeakPolarHBondContact O-CB 3.34Å; L377-C381 PolarHBondContact O-N 2.8Å; L377-C381 PolarHBondContact O-SG 2.91Å |
| 378 | T | 97.7 | Very high | 95.2 | Very high | 23 Ų | 23 | 23 Ų | 23 | 14% | 0.141 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.6 | -45.4 | 175.5 | -54.1 | 0 | 0 | 0 | 0 | 111.5 | V202 T205 V206 T374 Y375 N380 C381 F382 | V202-T378 HydrophobicContact CB-CG2 4.38Å; V202-T378 HydrophobicContact CG1-CG2 4.07Å; V202-T378 HydrophobicContact CG2-CG2 4.4Å; T205-T378 HydrophobicContact CG2-CG2 3.93Å; V206-T378 HydrophobicContact CG2-CG2 4.2Å; T374-T378 WeakPolarHBondContact O-CB 3.28Å; T374-T378 PolarHBondContact O-N 3.38Å; T374-T378 VanDerWaalsContact O-N 3.12Å; T374-T378 PolarHBondContact O-OG1 3.36Å; Y375-T378 PolarHBondContact O-N 3.41Å; T378-N380 VanDerWaalsContact C-N 3.28Å; T378-N380 PolarHBondContact O-N 3.05Å; T378-C381 PolarHBondContact O-N 3.4Å; T378-F382 WeakPolarHBondContact O-CB 3.38Å; T378-F382 PolarHBondContact O-N 3.49Å |
| 379 | S | 96.5 | Very high | 95.1 | Very high | 3 Ų | 3 | 25.3 Ų | 25.3 | 2% | 0.021 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59.6 | -40.2 | 176.7 | -158 | 0 | 0 | 0 | 0 | 110.5 | R209 Y375 W376 L377 S383 | R209-S379 PolarHBondContact NE-OG 3.05Å; R209-S379 VanDerWaalsContact NE-OG 3.12Å; R209-S379 PolarHBondContact NH1-O 3.03Å; R209-S379 VanDerWaalsContact NH2-C 3.33Å; R209-S379 PolarHBondContact NH2-O 2.85Å; R209-S379 PolarHBondContact NH2-OG 3.21Å; Y375-S379 WeakPolarHBondContact O-CB 3.43Å; Y375-S379 PolarHBondContact O-N 3.26Å; W376-S379 WeakPolarHBondContact O-CB 3.18Å; W376-S379 PolarHBondContact O-N 3.06Å; L377-S379 VanDerWaalsContact C-N 3.33Å; L377-S379 PolarHBondContact O-N 3.36Å; S379-S383 PolarHBondContact O-N 2.66Å; S379-S383 PolarHBondContact O-OG 2.96Å |
| 380 | N | 95.8 | Very high | 94.7 | Very high | 6 Ų | 6 | 26 Ų | 26 | 3% | 0.032 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -71 | -45.6 | 176.5 | -77.6 | -0.4 | 0 | 0 | 0 | 112.8 | V326 T329 I333 W376 L377 T378 F382 S383 L384 | V326-N380 PolarHBondContact O-ND2 2.98Å; T329-N380 WeakPolarHBondContact OG1-CB 3.44Å; T329-N380 PolarHBondContact OG1-ND2 3.25Å; I333-N380 HydrophobicContact CD1-CB 3.57Å; W376-N380 VanDerWaalsContact O-CB 3.31Å; W376-N380 WeakPolarHBondContact O-CB 3.49Å; W376-N380 VanDerWaalsContact O-CG 3.22Å; W376-N380 PolarHBondContact O-N 3.23Å; W376-N380 PolarHBondContact O-OD1 3.44Å; L377-N380 PolarHBondContact O-N 3.22Å; L377-N380 VanDerWaalsContact O-N 3.14Å; T378-N380 VanDerWaalsContact C-N 3.28Å; T378-N380 PolarHBondContact O-N 3.05Å; N380-F382 VanDerWaalsContact C-N 3.3Å; N380-F382 PolarHBondContact O-N 3.48Å; N380-S383 WeakPolarHBondContact O-CA 3.23Å; N380-S383 VanDerWaalsContact O-CB 3.29Å; N380-S383 WeakPolarHBondContact O-CB 3.23Å; N380-S383 PolarHBondContact O-N 3.31Å; N380-L384 WeakPolarHBondContact O-CG 3.4Å; N380-L384 PolarHBondContact O-N 2.91Å |
| 381 | C | 96.6 | Very high | 94.3 | Very high | 69 Ų | 69 | 30.5 Ų | 30.5 | 47% | 0.466 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -59.5 | -40.7 | 175.6 | -69.1 | 0 | 0 | 0 | 0 | 111.5 | L377 T378 L384 G385 | L377-C381 WeakPolarHBondContact O-CB 3.34Å; L377-C381 PolarHBondContact O-N 2.8Å; L377-C381 PolarHBondContact O-SG 2.91Å; T378-C381 PolarHBondContact O-N 3.4Å; C381-L384 PolarHBondContact O-N 3.1Å; C381-G385 PolarHBondContact O-N 2.98Å |
| 382 | F | 95.7 | Very high | 94 | Very high | 48 Ų | 48 | 35.5 Ų | 35.5 | 21% | 0.211 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.5 | -44.5 | 170.7 | -167.4 | -73.5 | 0 | 0 | 0 | 111.6 | V206 R209 V210 T378 N380 L384 G385 Q386 | V206-F382 HydrophobicContact CG1-CD2 4.49Å; V206-F382 HydrophobicContact CG1-CE2 4.33Å; V206-F382 HydrophobicContact CG2-CD2 4.47Å; R209-F382 HydrophobicContact CB-CD1 3.6Å; R209-F382 HydrophobicContact CB-CD2 3.81Å; R209-F382 HydrophobicContact CB-CE1 3.62Å; R209-F382 HydrophobicContact CB-CE2 3.81Å; R209-F382 HydrophobicContact CB-CG 3.71Å; R209-F382 HydrophobicContact CB-CZ 3.72Å; R209-F382 HydrophobicContact CG-CB 4.25Å; R209-F382 HydrophobicContact CG-CD1 3.94Å; R209-F382 HydrophobicContact CG-CD2 4.39Å; R209-F382 HydrophobicContact CG-CE1 4.43Å; R209-F382 HydrophobicContact CG-CG 3.92Å; V210-F382 HydrophobicContact CG2-CE2 3.96Å; V210-F382 HydrophobicContact CG2-CZ 4.07Å; T378-F382 WeakPolarHBondContact O-CB 3.38Å; T378-F382 PolarHBondContact O-N 3.49Å; N380-F382 VanDerWaalsContact C-N 3.3Å; N380-F382 PolarHBondContact O-N 3.48Å; F382-L384 VanDerWaalsContact C-N 3.3Å; F382-L384 PolarHBondContact O-N 2.9Å; F382-G385 PolarHBondContact O-N 3.3Å; F382-Q386 HydrophobicContact CD1-CB 4.22Å; F382-Q386 HydrophobicContact CE1-CB 4.18Å; F382-Q386 HydrophobicContact CE1-CG 4.47Å; F382-Q386 WeakPolarHBondContact O-CB 3.29Å; F382-Q386 PolarHBondContact O-N 3.42Å |
| 383 | S | 93.3 | Very high | 93.6 | Very high | 10 Ų | 10 | 38.7 Ų | 38.7 | 7% | 0.07 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -57 | -42.3 | 175 | -67.1 | 0 | 0 | 0 | 0 | 112.4 | R209 S379 N380 V387 | R209-S383 PolarHBondContact NH1-OG 3.04Å; R209-S383 PolarHBondContact NH2-OG 3.42Å; S379-S383 PolarHBondContact O-N 2.66Å; S379-S383 PolarHBondContact O-OG 2.96Å; N380-S383 WeakPolarHBondContact O-CA 3.23Å; N380-S383 VanDerWaalsContact O-CB 3.29Å; N380-S383 WeakPolarHBondContact O-CB 3.23Å; N380-S383 PolarHBondContact O-N 3.31Å; S383-V387 WeakPolarHBondContact O-CB 3.19Å; S383-V387 VanDerWaalsContact O-CG2 3.29Å; S383-V387 WeakPolarHBondContact O-CG2 3.34Å; S383-V387 PolarHBondContact O-N 3.39Å |
| 384 | L | 93.3 | Very high | 93.4 | Very high | 39 Ų | 39 | 41.3 Ų | 41.3 | 20% | 0.204 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -65.6 | -50.8 | 179.2 | -70.5 | 168.8 | 0 | 0 | 0 | 111.6 | T329 F332 I333 L336 N380 C381 F382 Q386 V387 A388 | T329-L384 HydrophobicContact CG2-CD1 4.11Å; F332-L384 HydrophobicContact CB-CD2 3.89Å; I333-L384 HydrophobicContact CB-CD2 4.49Å; I333-L384 HydrophobicContact CD1-CG 4.42Å; I333-L384 HydrophobicContact CG1-CD2 3.64Å; I333-L384 HydrophobicContact CG1-CG 3.72Å; L336-L384 HydrophobicContact CD1-CD2 3.86Å; N380-L384 WeakPolarHBondContact O-CG 3.4Å; N380-L384 PolarHBondContact O-N 2.91Å; C381-L384 PolarHBondContact O-N 3.1Å; F382-L384 VanDerWaalsContact C-N 3.3Å; F382-L384 PolarHBondContact O-N 2.9Å; L384-Q386 VanDerWaalsContact C-N 3.31Å; L384-Q386 PolarHBondContact O-N 2.92Å; L384-V387 PolarHBondContact O-N 3.12Å; L384-V387 VanDerWaalsContact O-N 3.16Å; L384-A388 PolarHBondContact O-N 3.16Å |
| 385 | G | 93.9 | Very high | 93.2 | Very high | 45 Ų | 45 | 42 Ų | 42 | 46% | 0.464 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.7 | -40.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | C381 F382 A388 L389 | C381-G385 PolarHBondContact O-N 2.98Å; F382-G385 PolarHBondContact O-N 3.3Å; G385-A388 PolarHBondContact O-N 3.25Å; G385-L389 VanDerWaalsContact O-CB 3.24Å; G385-L389 WeakPolarHBondContact O-CB 3.24Å; G385-L389 PolarHBondContact O-N 2.93Å |
| 386 | Q | 92.3 | Very high | 92.9 | Very high | 19 Ų | 19 | 44.7 Ų | 44.7 | 9% | 0.089 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.6 | -40.6 | 174.7 | -177 | -166.4 | -103.1 | 0 | 0 | 112.5 | F213 F382 L384 L390 | F213-Q386 HydrophobicContact CD2-CG 3.95Å; F213-Q386 HydrophobicContact CE2-CG 3.95Å; F382-Q386 HydrophobicContact CD1-CB 4.22Å; F382-Q386 HydrophobicContact CE1-CB 4.18Å; F382-Q386 HydrophobicContact CE1-CG 4.47Å; F382-Q386 WeakPolarHBondContact O-CB 3.29Å; F382-Q386 PolarHBondContact O-N 3.42Å; L384-Q386 VanDerWaalsContact C-N 3.31Å; L384-Q386 PolarHBondContact O-N 2.92Å; Q386-L390 HydrophobicContact CG-CD1 3.98Å; Q386-L390 HydrophobicContact CG-CG 4.44Å; Q386-L390 WeakPolarHBondContact O-CB 3.36Å; Q386-L390 VanDerWaalsContact O-CG 3.3Å; Q386-L390 WeakPolarHBondContact O-CG 3.37Å; Q386-L390 PolarHBondContact O-N 2.99Å |
| 387 | V | 89.8 | Confident | 92.6 | Very high | 22 Ų | 22 | 51.4 Ų | 51.4 | 13% | 0.133 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -67.2 | -42.9 | 176.3 | 166.9 | 0 | 0 | 0 | 0 | 110.8 | L336 S383 L384 R391 | L336-V387 HydrophobicContact CB-CG1 3.99Å; S383-V387 WeakPolarHBondContact O-CB 3.19Å; S383-V387 VanDerWaalsContact O-CG2 3.29Å; S383-V387 WeakPolarHBondContact O-CG2 3.34Å; S383-V387 PolarHBondContact O-N 3.39Å; L384-V387 PolarHBondContact O-N 3.12Å; L384-V387 VanDerWaalsContact O-N 3.16Å; V387-R391 HydrophobicContact CG1-CG 4.42Å; V387-R391 WeakPolarHBondContact O-CB 3.49Å; V387-R391 WeakPolarHBondContact O-CG 3.26Å; V387-R391 PolarHBondContact O-N 3.18Å |
| 388 | A | 90.4 | Very high | 92.5 | Very high | 66 Ų | 66 | 59.5 Ų | 59.5 | 55% | 0.545 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -59.6 | -48.9 | 174 | 0 | 0 | 0 | 0 | 0 | 111.5 | L384 G385 L390 R391 H392 | L384-A388 PolarHBondContact O-N 3.16Å; G385-A388 PolarHBondContact O-N 3.25Å; A388-L390 PolarHBondContact O-N 3.19Å; A388-R391 PolarHBondContact O-N 2.99Å; A388-H392 PolarHBondContact O-N 2.87Å |
| 389 | L | 92 | Very high | 92.2 | Very high | 86 Ų | 86 | 62 Ų | 62 | 45% | 0.45 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -58.4 | -49.3 | 178.1 | -176.3 | 69.2 | 0 | 0 | 0 | 112.1 | F213 G385 R391 H392 V395 | F213-L389 HydrophobicContact CZ-CD2 4.42Å; G385-L389 VanDerWaalsContact O-CB 3.24Å; G385-L389 WeakPolarHBondContact O-CB 3.24Å; G385-L389 PolarHBondContact O-N 2.93Å; L389-R391 VanDerWaalsContact C-N 3.31Å; L389-R391 PolarHBondContact O-N 2.85Å; L389-H392 WeakPolarHBondContact O-CB 3.38Å; L389-H392 PolarHBondContact O-N 3.47Å; L389-V395 HydrophobicContact CD1-CG2 3.9Å; L389-V395 HydrophobicContact CG-CG1 4.26Å; L389-V395 HydrophobicContact CG-CG2 4.4Å; L389-V395 VanDerWaalsContact O-CB 3.25Å; L389-V395 WeakPolarHBondContact O-CB 3.44Å; L389-V395 WeakPolarHBondContact O-CG1 3.44Å; L389-V395 WeakPolarHBondContact O-CG2 3.33Å |
| 390 | L | 89.6 | Confident | 92 | Very high | 17 Ų | 17 | 67.1 Ų | 67.1 | 9% | 0.089 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -75.8 | -15 | -178.1 | -66.4 | -179.8 | 0 | 0 | 0 | 114 | F213 I216 V217 Q220 Q386 A388 V395 R396 F399 I401 | F213-L390 HydrophobicContact CE2-CD1 4.15Å; F213-L390 HydrophobicContact CE2-CD2 4.03Å; F213-L390 HydrophobicContact CE2-CG 4.2Å; F213-L390 HydrophobicContact CZ-CD2 3.96Å; I216-L390 HydrophobicContact CG2-CD1 4.42Å; V217-L390 HydrophobicContact CG2-CD1 4.48Å; V217-L390 HydrophobicContact CG2-CD2 4.01Å; Q220-L390 HydrophobicContact CG-CD1 4.34Å; Q386-L390 HydrophobicContact CG-CD1 3.98Å; Q386-L390 HydrophobicContact CG-CG 4.44Å; Q386-L390 WeakPolarHBondContact O-CB 3.36Å; Q386-L390 VanDerWaalsContact O-CG 3.3Å; Q386-L390 WeakPolarHBondContact O-CG 3.37Å; Q386-L390 PolarHBondContact O-N 2.99Å; A388-L390 PolarHBondContact O-N 3.19Å; L390-V395 HydrophobicContact CD2-CG1 4.08Å; L390-R396 WeakPolarHBondContact O-CD 3.37Å; L390-R396 WeakPolarHBondContact O-CG 3.43Å; L390-F399 HydrophobicContact CD2-CD2 4.46Å; L390-I401 HydrophobicContact CD2-CD1 4.25Å |
| 391 | R | 87.1 | Confident | 91.6 | Very high | 96 Ų | 96 | 67.5 Ų | 67.5 | 36% | 0.362 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -80.3 | -24.4 | 170.1 | -74.7 | 173.3 | 70.6 | 156.8 | -3.2 | 112.5 | L336 E339 V387 A388 L389 | L336-R391 PolarHBondContact O-NH1 3.31Å; E339-R391 IonicContact OE1-NH2 3.86Å; E339-R391 IonicContact OE2-CZ 2.66Å; E339-R391 IonicContact OE2-NH1 2.71Å; E339-R391 PolarHBondContact OE2-NH1 3.15Å; E339-R391 IonicContact OE2-NH2 2.72Å; E339-R391 PolarHBondContact OE2-NH2 2.93Å; V387-R391 HydrophobicContact CG1-CG 4.42Å; V387-R391 WeakPolarHBondContact O-CB 3.49Å; V387-R391 WeakPolarHBondContact O-CG 3.26Å; V387-R391 PolarHBondContact O-N 3.18Å; A388-R391 PolarHBondContact O-N 2.99Å; L389-R391 VanDerWaalsContact C-N 3.31Å; L389-R391 PolarHBondContact O-N 2.85Å |
| 392 | H | 90.4 | Very high | 91.1 | Very high | 104 Ų | 104 | 66.3 Ų | 66.3 | 48% | 0.481 | 34% | 0.339 | S | S | . | . | S | Bend | trans | -64 | 128.1 | -179.3 | -170.3 | -109.6 | 0 | 0 | 0 | 112.4 | A388 L389 A394 V395 R396 | A388-H392 PolarHBondContact O-N 2.87Å; L389-H392 WeakPolarHBondContact O-CB 3.38Å; L389-H392 PolarHBondContact O-N 3.47Å; H392-A394 PolarHBondContact O-N 3.14Å; H392-V395 HydrophobicContact CB-CB 4.4Å; H392-V395 HydrophobicContact CB-CG2 4.11Å; H392-V395 WeakPolarHBondContact O-CB 3.37Å; H392-V395 PolarHBondContact O-N 3.07Å; H392-V395 VanDerWaalsContact O-N 3.07Å; H392-R396 PolarHBondContact O-N 3.09Å; H392-R396 VanDerWaalsContact O-N 3.07Å |
| 393 | P | 87.9 | Confident | 90.6 | Very high | 69 Ų | 69 | 70.5 Ų | 70.5 | 45% | 0.448 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.6 | -36.2 | -169.2 | 22.4 | -33.8 | 0 | 0 | 0 | 113.9 | V395 R396 R397 | P393-V395 VanDerWaalsContact C-N 3.28Å; P393-V395 PolarHBondContact O-N 2.87Å; P393-R396 PolarHBondContact O-N 3.02Å; P393-R397 WeakPolarHBondContact O-CG 3.39Å; P393-R397 PolarHBondContact O-N 3.37Å |
| 394 | A | 92.3 | Very high | 89.9 | Confident | 56 Ų | 56 | 72.6 Ų | 72.6 | 46% | 0.463 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.9 | -35.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | H392 R398 | H392-A394 PolarHBondContact O-N 3.14Å; A394-R398 WeakPolarHBondContact O-CB 3.41Å; A394-R398 PolarHBondContact O-N 2.88Å |
| 395 | V | 92 | Very high | 89.3 | Confident | 24 Ų | 24 | 74.2 Ų | 74.2 | 15% | 0.145 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -71.4 | -43.4 | 177.3 | 177.5 | 0 | 0 | 0 | 0 | 110.5 | L389 L390 H392 P393 R397 R398 F399 | L389-V395 HydrophobicContact CD1-CG2 3.9Å; L389-V395 HydrophobicContact CG-CG1 4.26Å; L389-V395 HydrophobicContact CG-CG2 4.4Å; L389-V395 VanDerWaalsContact O-CB 3.25Å; L389-V395 WeakPolarHBondContact O-CB 3.44Å; L389-V395 WeakPolarHBondContact O-CG1 3.44Å; L389-V395 WeakPolarHBondContact O-CG2 3.33Å; L390-V395 HydrophobicContact CD2-CG1 4.08Å; H392-V395 HydrophobicContact CB-CB 4.4Å; H392-V395 HydrophobicContact CB-CG2 4.11Å; H392-V395 WeakPolarHBondContact O-CB 3.37Å; H392-V395 PolarHBondContact O-N 3.07Å; H392-V395 VanDerWaalsContact O-N 3.07Å; P393-V395 VanDerWaalsContact C-N 3.28Å; P393-V395 PolarHBondContact O-N 2.87Å; V395-R397 VanDerWaalsContact C-N 3.32Å; V395-R397 PolarHBondContact O-N 3.02Å; V395-R398 PolarHBondContact O-N 3.18Å; V395-F399 HydrophobicContact CG1-CD2 3.62Å; V395-F399 HydrophobicContact CG1-CE2 3.83Å; V395-F399 WeakPolarHBondContact O-CD2 3.42Å; V395-F399 PolarHBondContact O-N 2.81Å |
| 396 | R | 90.9 | Very high | 88.5 | Confident | 62 Ų | 62 | 80.4 Ų | 80.4 | 23% | 0.234 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -58.6 | -43.1 | 174.1 | -67.3 | 179.8 | 69.2 | 162.9 | 7.9 | 112 | L390 H392 P393 F399 N400 I401 P402 | L390-R396 WeakPolarHBondContact O-CD 3.37Å; L390-R396 WeakPolarHBondContact O-CG 3.43Å; H392-R396 PolarHBondContact O-N 3.09Å; H392-R396 VanDerWaalsContact O-N 3.07Å; P393-R396 PolarHBondContact O-N 3.02Å; R396-F399 CarbonylContact O-C 3.48Å; R396-N400 WeakPolarHBondContact O-CA 3.33Å; R396-N400 PolarHBondContact O-N 2.91Å; R396-I401 HydrophobicContact CB-CB 4.3Å; R396-I401 HydrophobicContact CG-CB 4.49Å; R396-I401 PolarHBondContact O-N 3.48Å; R396-P402 PolarHBondContact NH2-O 2.93Å |
| 397 | R | 91.1 | Very high | 87.6 | Confident | 177 Ų | 177 | 80.8 Ų | 80.8 | 67% | 0.668 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -60.5 | -50.9 | 172.9 | -70.4 | 172.4 | -174.4 | 177.7 | 1.9 | 111.3 | P393 V395 F399 N400 | P393-R397 WeakPolarHBondContact O-CG 3.39Å; P393-R397 PolarHBondContact O-N 3.37Å; V395-R397 VanDerWaalsContact C-N 3.32Å; V395-R397 PolarHBondContact O-N 3.02Å; R397-F399 PolarHBondContact O-N 3.17Å; R397-N400 PolarHBondContact O-N 3.41Å; R397-N400 PolarHBondContact O-ND2 3.44Å |
| 398 | R | 94.3 | Very high | 86.6 | Confident | 208 Ų | 208 | 83.9 Ų | 83.9 | 79% | 0.785 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -58.4 | -42.8 | 179.6 | -176.8 | 58.2 | 175.1 | 179.7 | -0.7 | 112.9 | A394 V395 N400 | A394-R398 WeakPolarHBondContact O-CB 3.41Å; A394-R398 PolarHBondContact O-N 2.88Å; V395-R398 PolarHBondContact O-N 3.18Å; R398-N400 VanDerWaalsContact C-N 3.31Å; R398-N400 PolarHBondContact O-ND2 3.09Å |
| 399 | F | 91.7 | Very high | 85.3 | Confident | 77 Ų | 77 | 85.3 Ų | 85.3 | 34% | 0.338 | 42% | 0.415 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.8 | 5.4 | 177 | -70.6 | -66.3 | 0 | 0 | 0 | 114.4 | F213 V217 R221 L390 V395 R396 R397 I401 | F213-F399 HydrophobicContact CE1-CE1 4.49Å; F213-F399 HydrophobicContact CE1-CE2 4.34Å; F213-F399 AromaticContact CE1-CZ 3.93Å; F213-F399 HydrophobicContact CE1-CZ 3.93Å; F213-F399 HydrophobicContact CZ-CE2 4.23Å; F213-F399 HydrophobicContact CZ-CZ 4.29Å; V217-F399 HydrophobicContact CG1-CB 3.79Å; V217-F399 HydrophobicContact CG1-CD1 3.86Å; V217-F399 HydrophobicContact CG1-CG 3.91Å; R221-F399 PolarHBondContact NH2-O 3.47Å; L390-F399 HydrophobicContact CD2-CD2 4.46Å; V395-F399 HydrophobicContact CG1-CD2 3.62Å; V395-F399 HydrophobicContact CG1-CE2 3.83Å; V395-F399 WeakPolarHBondContact O-CD2 3.42Å; V395-F399 PolarHBondContact O-N 2.81Å; R396-F399 CarbonylContact O-C 3.48Å; R397-F399 PolarHBondContact O-N 3.17Å; F399-I401 VanDerWaalsContact C-N 3.27Å; F399-I401 HydrophobicContact CB-CD1 4.11Å; F399-I401 HydrophobicContact CB-CG1 4.01Å; F399-I401 PolarHBondContact O-N 3.09Å |
| 400 | N | 91.2 | Very high | 84 | Confident | 110 Ų | 110 | 86.2 Ų | 86.2 | 59% | 0.588 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.4 | 47.3 | -179 | -63.7 | -105.2 | 0 | 0 | 0 | 112.4 | R221 R396 R397 R398 | R221-N400 PolarHBondContact NE-O 3.4Å; R221-N400 PolarHBondContact NH2-O 3.34Å; R396-N400 WeakPolarHBondContact O-CA 3.33Å; R396-N400 PolarHBondContact O-N 2.91Å; R397-N400 PolarHBondContact O-N 3.41Å; R397-N400 PolarHBondContact O-ND2 3.44Å; R398-N400 VanDerWaalsContact C-N 3.31Å; R398-N400 PolarHBondContact O-ND2 3.09Å |
| 401 | I | 88.5 | Confident | 82.7 | Confident | 14 Ų | 14 | 87 Ų | 87 | 7% | 0.072 | 45% | 0.445 | C | S | . | . | P | Polyproline II helix | trans | -87.1 | 118.4 | 173.9 | -58.6 | 174.5 | 0 | 0 | 0 | 107.2 | V217 A224 L390 R396 F399 | V217-I401 HydrophobicContact CG1-CD1 4.47Å; A224-I401 HydrophobicContact CB-CG2 4.36Å; L390-I401 HydrophobicContact CD2-CD1 4.25Å; R396-I401 HydrophobicContact CB-CB 4.3Å; R396-I401 HydrophobicContact CG-CB 4.49Å; R396-I401 PolarHBondContact O-N 3.48Å; F399-I401 VanDerWaalsContact C-N 3.27Å; F399-I401 HydrophobicContact CB-CD1 4.11Å; F399-I401 HydrophobicContact CB-CG1 4.01Å; F399-I401 PolarHBondContact O-N 3.09Å |
| 402 | P | 86.1 | Confident | 81.6 | Confident | 43 Ų | 43 | 83.1 Ų | 83.1 | 28% | 0.279 | 43% | 0.431 | S | S | . | . | P | Polyproline II helix | trans | -51.7 | 146.8 | 178.4 | -28.1 | 34 | 0 | 0 | 0 | 112.8 | A224 K225 R396 | A224-P402 HydrophobicContact CB-CB 4.18Å; A224-P402 HydrophobicContact CB-CG 4.48Å; K225-P402 HydrophobicContact CG-CG 4.26Å; R396-P402 PolarHBondContact NH2-O 2.93Å |
| 403 | E | 84.7 | Confident | 80.2 | Confident | 137 Ų | 137 | 79.7 Ų | 79.7 | 64% | 0.64 | 42% | 0.418 | S | S | * | . | P | Polyproline II helix | trans | -66.9 | 145.7 | 166.5 | -64.6 | -168.5 | 179.2 | 0 | 0 | 109.6 | N228 | N228-E403 PolarHBondContact ND2-O 2.85Å; N228-E403 PolarHBondContact OD1-O 3.18Å |
| 404 | R | 78.8 | Confident | 78.8 | Confident | 54 Ų | 54 | 85.3 Ų | 85.3 | 20% | 0.204 | 44% | 0.438 | C | S | . | . | P | Polyproline II helix | trans | -94.8 | 116.3 | -174.5 | 179.1 | -176.2 | 131.1 | -167.3 | -16.8 | 108.9 | N227 N228 E339 S340 G341 D343 K406 | N227-R404 HydrophobicContact CB-CG 4.43Å; N227-R404 WeakPolarHBondContact ND2-CD 3.25Å; N227-R404 PolarHBondContact ND2-NE 2.95Å; N228-R404 WeakPolarHBondContact OD1-CA 3.43Å; E339-R404 PolarHBondContact O-NH1 3.37Å; S340-R404 PolarHBondContact O-NH1 2.99Å; G341-R404 VanDerWaalsContact O-CZ 3.29Å; G341-R404 PolarHBondContact O-NH1 3.32Å; D343-R404 IonicContact OD1-CZ 3.42Å; D343-R404 IonicContact OD1-NH2 2.66Å; D343-R404 PolarHBondContact OD1-NH2 3.11Å; D343-R404 IonicContact OD2-CZ 2.71Å; D343-R404 IonicContact OD2-NE 3.6Å; D343-R404 IonicContact OD2-NH2 3.89Å; D343-R404 PolarHBondContact OD2-NH2 2.85Å; R404-K406 PolarHBondContact O-N 3Å |
| 405 | V | 80 | Confident | 77.1 | Confident | 72 Ų | 72 | 85.1 Ų | 85.1 | 44% | 0.436 | 43% | 0.433 | S | S | . | . | P | Polyproline II helix | trans | -64.9 | 129.5 | 172 | 179.2 | 0 | 0 | 0 | 0 | 108.8 | N228 H407 | N228-V405 HydrophobicContact CB-CG2 4.26Å; N228-V405 PolarHBondContact OD1-N 3.38Å; V405-H407 PolarHBondContact O-N 3.29Å |
| 406 | K | 77 | Confident | 75.6 | Confident | 175 Ų | 175 | 86.6 Ų | 86.6 | 76% | 0.761 | 44% | 0.44 | S | S | * | . | trans | -86.4 | 99.7 | 169.1 | -70 | -176.5 | 178.6 | -178.9 | 0 | 108 | R404 | R404-K406 PolarHBondContact O-N 3Š| ||
| 407 | H | 73.4 | Confident | 74.5 | Confident | 28 Ų | 28 | 85.6 Ų | 85.6 | 13% | 0.13 | 45% | 0.45 | C | S | . | . | trans | -70.6 | 136.4 | 177.2 | -63.3 | -63.1 | 0 | 0 | 0 | 110.6 | N227 N228 P231 V405 L412 | N227-H407 PolarHBondContact O-CD2 3.35Å; N227-H407 PolarHBondContact O-NE2 3.5Å; N228-H407 PolarHBondContact O-CE1 2.92Å; N228-H407 VanDerWaalsContact O-CE1 3.31Å; N228-H407 PolarHBondContact O-NE2 2.68Å; P231-H407 WeakPolarHBondContact CD-NE2 3.19Å; V405-H407 PolarHBondContact O-N 3.29Å; H407-L412 HydrophobicContact CB-CD2 4Å; H407-L412 HydrophobicContact CB-CG 4.3Å | ||
| 408 | P | 68.4 | Low | 73.4 | Confident | 87 Ų | 87 | 79.9 Ų | 79.9 | 57% | 0.565 | 43% | 0.432 | S | S | * | . | trans | -66.6 | 143.9 | 176 | 28.1 | -33.6 | 0 | 0 | 0 | 110 | A410 A411 | P408-A410 PolarHBondContact O-N 3.35Å; P408-A411 HydrophobicContact CG-CB 3.9Å; P408-A411 PolarHBondContact O-N 2.75Å | ||
| 409 | T | 64.9 | Low | 72.6 | Confident | 95 Ų | 95 | 76.7 Ų | 76.7 | 58% | 0.583 | 43% | 0.429 | S | S | * | . | G | 310 helix | trans | -55.3 | -28.3 | -173.1 | -47.5 | 0 | 0 | 0 | 0 | 114 | ||
| 410 | A | 63 | Low | 71.9 | Confident | 105 Ų | 105 | 77.6 Ų | 77.6 | 87% | 0.868 | 43% | 0.434 | S | S | * | . | G | 310 helix | trans | -77.4 | -15.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | P408 | P408-A410 PolarHBondContact O-N 3.35Š|
| 411 | A | 63.1 | Low | 71.1 | Confident | 35 Ų | 35 | 74.2 Ų | 74.2 | 29% | 0.289 | 42% | 0.419 | S | S | . | . | G | 310 helix | trans | -90.9 | -9.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | P231 P408 | P231-A411 VanDerWaalsContact CB-O 3.25Å; P231-A411 WeakPolarHBondContact CB-O 3.32Å; P408-A411 HydrophobicContact CG-CB 3.9Å; P408-A411 PolarHBondContact O-N 2.75Å |
| 412 | L | 63.7 | Low | 70.7 | Confident | 14 Ų | 14 | 79.8 Ų | 79.8 | 7% | 0.073 | 45% | 0.447 | C | S | . | . | S | Bend | trans | -87.8 | 153.7 | 175.5 | -63.8 | 172.4 | 0 | 0 | 0 | 110.2 | L230 D343 H407 Q414 | L230-L412 HydrophobicContact CD2-CD2 3.93Å; D343-L412 HydrophobicContact CB-CD1 4.26Å; D343-L412 WeakPolarHBondContact O-CD1 3.38Å; D343-L412 VanDerWaalsContact O-CD2 3.24Å; D343-L412 WeakPolarHBondContact O-CD2 3.18Å; H407-L412 HydrophobicContact CB-CD2 4Å; H407-L412 HydrophobicContact CB-CG 4.3Å; L412-Q414 PolarHBondContact O-N 3.16Å |
| 413 | P | 60.8 | Low | 70.7 | Confident | 31 Ų | 31 | 84.3 Ų | 84.3 | 20% | 0.201 | 46% | 0.462 | C | S | . | . | P | Polyproline II helix | trans | -58.4 | 129.4 | 174.4 | 22.7 | -31.2 | 0 | 0 | 0 | 110.4 | T234 N344 P345 S415 | T234-P413 HydrophobicContact CG2-CB 3.76Å; T234-P413 HydrophobicContact CG2-CG 3.77Å; N344-P413 VanDerWaalsContact OD1-CD 3.3Å; N344-P413 WeakPolarHBondContact OD1-CD 3.36Å; N344-P413 VanDerWaalsContact OD1-CG 3.29Å; N344-P413 WeakPolarHBondContact OD1-CG 3.4Å; P345-P413 WeakPolarHBondContact CD-O 3.44Å; P345-P413 WeakPolarHBondContact CG-O 3.31Å; P413-S415 PolarHBondContact O-N 3.17Å |
| 414 | Q | 59.1 | Low | 70.6 | Confident | 188 Ų | 188 | 81.8 Ų | 81.8 | 88% | 0.879 | 45% | 0.449 | S | S | * | . | P | Polyproline II helix | trans | -60.9 | 129.8 | 168.8 | -65.2 | -171.3 | 4.2 | 0 | 0 | 108.7 | L412 | L412-Q414 PolarHBondContact O-N 3.16Š|
| 415 | S | 55.7 | Low | 70.8 | Confident | 51 Ų | 51 | 81 Ų | 81 | 36% | 0.357 | 46% | 0.457 | S | S | . | . | P | Polyproline II helix | trans | -88 | 118.6 | 179.9 | 57.5 | 0 | 0 | 0 | 0 | 111 | P345 P413 | P345-S415 WeakPolarHBondContact CB-OG 3.41Å; P413-S415 PolarHBondContact O-N 3.17Å |
| 416 | D | 60.8 | Low | 71 | Confident | 55 Ų | 55 | 86.9 Ų | 86.9 | 29% | 0.294 | 47% | 0.472 | S | S | . | . | P | Polyproline II helix | trans | -53.3 | 157.1 | 145.5 | -49.4 | -62.3 | 0 | 0 | 0 | 110 | N346 E420 K424 | N346-D416 PolarHBondContact OD1-O 3.46Å; D416-E420 HydrophobicContact CB-CB 3.96Å; D416-E420 HydrophobicContact CB-CG 3.83Å; D416-K424 IonicContact OD1-NZ 3.75Å; D416-K424 PolarHBondContact OD1-NZ 3.25Å; D416-K424 WeakPolarHBondContact OD2-CD 3.34Å; D416-K424 WeakPolarHBondContact OD2-CE 3.28Å; D416-K424 IonicContact OD2-NZ 3.19Å; D416-K424 PolarHBondContact OD2-NZ 3.04Å |
| 417 | G | 67.9 | Low | 71.5 | Confident | 42 Ų | 42 | 84.8 Ų | 84.8 | 43% | 0.433 | 46% | 0.463 | S | S | . | . | P | Polyproline II helix | trans | -59 | 153.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | I419 E420 S421 | G417-I419 PolarHBondContact O-N 3.07Å; G417-I419 VanDerWaalsContact O-N 3.12Å; G417-E420 CarbonylContact O-C 3.48Å; G417-E420 WeakPolarHBondContact O-CA 3.4Å; G417-E420 WeakPolarHBondContact O-CB 3.3Å; G417-E420 PolarHBondContact O-N 3.1Å; G417-S421 PolarHBondContact O-N 3.04Å; G417-S421 PolarHBondContact O-OG 2.89Å |
| 418 | L | 68.9 | Low | 72 | Confident | 57 Ų | 57 | 85.6 Ų | 85.6 | 30% | 0.298 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -54.5 | -38.1 | -176.9 | -179.3 | 151.4 | 0 | 0 | 0 | 113 | T349 E420 S421 M422 | T349-L418 HydrophobicContact CG2-CB 3.74Å; T349-L418 HydrophobicContact CG2-CD1 3.95Å; T349-L418 HydrophobicContact CG2-CG 4.49Å; L418-E420 VanDerWaalsContact C-N 3.3Å; L418-E420 PolarHBondContact O-N 2.84Å; L418-S421 PolarHBondContact O-OG 2.85Å; L418-M422 HydrophobicContact CD2-CG 4.41Å; L418-M422 HydrophobicContact CD2-SD 3.72Å; L418-M422 WeakPolarHBondContact O-CB 3.37Å; L418-M422 VanDerWaalsContact O-CG 3.31Å; L418-M422 WeakPolarHBondContact O-CG 3.42Å; L418-M422 PolarHBondContact O-N 3.48Å |
| 419 | I | 76 | Confident | 72.8 | Confident | 141 Ų | 141 | 84.4 Ų | 84.4 | 72% | 0.723 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -64.5 | -36.7 | 175.2 | -60.1 | 173 | 0 | 0 | 0 | 111 | G417 K423 | G417-I419 PolarHBondContact O-N 3.07Å; G417-I419 VanDerWaalsContact O-N 3.12Å; I419-K423 VanDerWaalsContact O-CB 3.26Å; I419-K423 WeakPolarHBondContact O-CB 3.26Å; I419-K423 PolarHBondContact O-N 2.95Å |
| 420 | E | 78.4 | Confident | 74 | Confident | 95 Ų | 95 | 84.4 Ų | 84.4 | 44% | 0.444 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -78.6 | -39.3 | -179.3 | -176.5 | 168.6 | -158.6 | 0 | 0 | 112.5 | D416 G417 L418 M422 K423 K424 | D416-E420 HydrophobicContact CB-CB 3.96Å; D416-E420 HydrophobicContact CB-CG 3.83Å; G417-E420 CarbonylContact O-C 3.48Å; G417-E420 WeakPolarHBondContact O-CA 3.4Å; G417-E420 WeakPolarHBondContact O-CB 3.3Å; G417-E420 PolarHBondContact O-N 3.1Å; L418-E420 VanDerWaalsContact C-N 3.3Å; L418-E420 PolarHBondContact O-N 2.84Å; E420-M422 VanDerWaalsContact C-N 3.33Å; E420-M422 PolarHBondContact O-N 3.49Å; E420-K423 CarbonylContact O-C 3.59Å; E420-K423 WeakPolarHBondContact O-CB 3.45Å; E420-K423 PolarHBondContact O-N 3.13Å; E420-K423 VanDerWaalsContact O-N 3.13Å; E420-K424 WeakPolarHBondContact O-CB 3.2Å; E420-K424 WeakPolarHBondContact O-CG 3.36Å; E420-K424 PolarHBondContact O-N 3.24Å |
| 421 | S | 74.6 | Confident | 75 | Confident | 39 Ų | 39 | 82 Ų | 82 | 27% | 0.273 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.9 | -35.7 | 171.7 | 60.1 | 0 | 0 | 0 | 0 | 111.7 | N346 G417 L418 G425 | N346-S421 PolarHBondContact OD1-OG 3.29Å; G417-S421 PolarHBondContact O-N 3.04Å; G417-S421 PolarHBondContact O-OG 2.89Å; L418-S421 PolarHBondContact O-OG 2.85Å; S421-G425 PolarHBondContact O-N 2.73Å |
| 422 | M | 79.2 | Confident | 76 | Confident | 132 Ų | 132 | 81.7 Ų | 81.7 | 65% | 0.65 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -61.7 | -44.3 | 166.4 | -76.2 | -177.9 | 68.1 | 0 | 0 | 112.5 | L418 E420 G425 W426 | L418-M422 HydrophobicContact CD2-CG 4.41Å; L418-M422 HydrophobicContact CD2-SD 3.72Å; L418-M422 WeakPolarHBondContact O-CB 3.37Å; L418-M422 VanDerWaalsContact O-CG 3.31Å; L418-M422 WeakPolarHBondContact O-CG 3.42Å; L418-M422 PolarHBondContact O-N 3.48Å; E420-M422 VanDerWaalsContact C-N 3.33Å; E420-M422 PolarHBondContact O-N 3.49Å; M422-G425 PolarHBondContact O-N 2.9Å; M422-W426 PolarHBondContact O-N 3.07Å |
| 423 | K | 85.8 | Confident | 77.2 | Confident | 137 Ų | 137 | 86.2 Ų | 86.2 | 60% | 0.596 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -65.6 | -39.8 | 179.3 | -171.5 | 177 | -176.3 | 178.8 | 0 | 112.4 | I419 E420 K427 | I419-K423 VanDerWaalsContact O-CB 3.26Å; I419-K423 WeakPolarHBondContact O-CB 3.26Å; I419-K423 PolarHBondContact O-N 2.95Å; E420-K423 CarbonylContact O-C 3.59Å; E420-K423 WeakPolarHBondContact O-CB 3.45Å; E420-K423 PolarHBondContact O-N 3.13Å; E420-K423 VanDerWaalsContact O-N 3.13Å; K423-K427 WeakPolarHBondContact O-CG 3.28Å; K423-K427 PolarHBondContact O-N 3.44Å |
| 424 | K | 82.3 | Confident | 78.5 | Confident | 85 Ų | 85 | 88.9 Ų | 88.9 | 37% | 0.37 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -65.8 | -42.3 | 171.1 | -70.8 | -178.1 | -174.7 | -177.5 | 0 | 110.8 | D416 E420 K427 N428 | D416-K424 IonicContact OD1-NZ 3.75Å; D416-K424 PolarHBondContact OD1-NZ 3.25Å; D416-K424 WeakPolarHBondContact OD2-CD 3.34Å; D416-K424 WeakPolarHBondContact OD2-CE 3.28Å; D416-K424 IonicContact OD2-NZ 3.19Å; D416-K424 PolarHBondContact OD2-NZ 3.04Å; E420-K424 WeakPolarHBondContact O-CB 3.2Å; E420-K424 WeakPolarHBondContact O-CG 3.36Å; E420-K424 PolarHBondContact O-N 3.24Å; K424-K427 PolarHBondContact O-N 3.11Å; K424-N428 WeakPolarHBondContact O-CB 3.33Å; K424-N428 PolarHBondContact O-N 2.77Å |
| 425 | G | 83 | Confident | 79.7 | Confident | 37 Ų | 37 | 83 Ų | 83 | 38% | 0.381 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -57.2 | -49.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | S421 M422 N428 A429 | S421-G425 PolarHBondContact O-N 2.73Å; M422-G425 PolarHBondContact O-N 2.9Å; G425-N428 PolarHBondContact O-N 3.23Å; G425-A429 WeakPolarHBondContact O-CB 3.32Å; G425-A429 PolarHBondContact O-N 2.88Å |
| 426 | W | 85.9 | Confident | 81.2 | Confident | 195 Ų | 195 | 87.2 Ų | 87.2 | 74% | 0.739 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -59.9 | -48 | 175.9 | -169.4 | -60.5 | 0 | 0 | 0 | 111.5 | M422 N428 A429 Q430 | M422-W426 PolarHBondContact O-N 3.07Å; W426-N428 VanDerWaalsContact C-N 3.33Å; W426-N428 PolarHBondContact O-N 3.2Å; W426-A429 PolarHBondContact O-N 3.32Å; W426-Q430 WeakPolarHBondContact O-CB 3.11Å; W426-Q430 PolarHBondContact O-N 3.39Å |
| 427 | K | 87.1 | Confident | 82.6 | Confident | 132 Ų | 132 | 88.4 Ų | 88.4 | 57% | 0.574 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -57.7 | -43.7 | 175.4 | -78.1 | -176.7 | 171.6 | -167.4 | 0 | 112.2 | K423 K424 A429 Q430 L431 | K423-K427 WeakPolarHBondContact O-CG 3.28Å; K423-K427 PolarHBondContact O-N 3.44Å; K424-K427 PolarHBondContact O-N 3.11Å; K427-A429 VanDerWaalsContact C-N 3.33Å; K427-A429 PolarHBondContact O-N 2.91Å; K427-Q430 PolarHBondContact O-N 3.29Å; K427-L431 VanDerWaalsContact O-CB 3.3Å; K427-L431 WeakPolarHBondContact O-CB 3.15Å; K427-L431 PolarHBondContact O-N 3.5Å |
| 428 | N | 84.3 | Confident | 83.5 | Confident | 44 Ų | 44 | 94.4 Ų | 94.4 | 24% | 0.235 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -69.9 | -28.8 | -179.8 | -71.7 | -9.8 | 0 | 0 | 0 | 113 | K424 G425 W426 A432 | K424-N428 WeakPolarHBondContact O-CB 3.33Å; K424-N428 PolarHBondContact O-N 2.77Å; G425-N428 PolarHBondContact O-N 3.23Å; W426-N428 VanDerWaalsContact C-N 3.33Å; W426-N428 PolarHBondContact O-N 3.2Å; N428-A432 WeakPolarHBondContact O-CB 3.22Å; N428-A432 PolarHBondContact O-N 2.54Å |
| 429 | A | 85.1 | Confident | 84.4 | Confident | 62 Ų | 62 | 95 Ų | 95 | 51% | 0.512 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -75.1 | -43.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | G425 W426 K427 L431 A432 H433 | G425-A429 WeakPolarHBondContact O-CB 3.32Å; G425-A429 PolarHBondContact O-N 2.88Å; W426-A429 PolarHBondContact O-N 3.32Å; K427-A429 VanDerWaalsContact C-N 3.33Å; K427-A429 PolarHBondContact O-N 2.91Å; A429-L431 PolarHBondContact O-N 3.46Å; A429-A432 WeakPolarHBondContact O-CB 3.41Å; A429-A432 PolarHBondContact O-N 3.2Å; A429-A432 VanDerWaalsContact O-N 3.17Å; A429-H433 PolarHBondContact O-N 2.62Å |
| 430 | Q | 89.1 | Confident | 85.1 | Confident | 96 Ų | 96 | 96.9 Ų | 96.9 | 45% | 0.449 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.6 | -42 | 176 | -173.3 | 175.1 | 6.5 | 0 | 0 | 111.9 | W426 K427 A432 H433 Q434 | W426-Q430 WeakPolarHBondContact O-CB 3.11Å; W426-Q430 PolarHBondContact O-N 3.39Å; K427-Q430 PolarHBondContact O-N 3.29Å; Q430-A432 VanDerWaalsContact C-N 3.35Å; Q430-H433 PolarHBondContact O-N 3.42Å; Q430-Q434 WeakPolarHBondContact O-CG 3.35Å; Q430-Q434 PolarHBondContact O-N 2.91Å |
| 431 | L | 85.1 | Confident | 85.7 | Confident | 55 Ų | 55 | 100.1 Ų | 100.1 | 29% | 0.288 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.4 | -40.7 | 172.7 | -178.4 | 64.1 | 0 | 0 | 0 | 111.5 | Q245 K427 A429 Q434 L435 | Q245-L431 HydrophobicContact CG-CD2 4.4Å; K427-L431 VanDerWaalsContact O-CB 3.3Å; K427-L431 WeakPolarHBondContact O-CB 3.15Å; K427-L431 PolarHBondContact O-N 3.5Å; A429-L431 PolarHBondContact O-N 3.46Å; L431-Q434 PolarHBondContact O-N 3.37Å; L431-L435 HydrophobicContact CG-CD1 4.19Å; L431-L435 WeakPolarHBondContact O-CB 3.09Å; L431-L435 VanDerWaalsContact O-CG 3.28Å; L431-L435 WeakPolarHBondContact O-CG 3.29Å; L431-L435 PolarHBondContact O-N 3.02Å |
| 432 | A | 83 | Confident | 86.5 | Confident | 28 Ų | 28 | 103.9 Ų | 103.9 | 23% | 0.231 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -61.4 | -46.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | N428 A429 Q430 Q434 L435 E436 | N428-A432 WeakPolarHBondContact O-CB 3.22Å; N428-A432 PolarHBondContact O-N 2.54Å; A429-A432 WeakPolarHBondContact O-CB 3.41Å; A429-A432 PolarHBondContact O-N 3.2Å; A429-A432 VanDerWaalsContact O-N 3.17Å; Q430-A432 VanDerWaalsContact C-N 3.35Å; A432-Q434 PolarHBondContact O-N 2.94Å; A432-L435 PolarHBondContact O-N 3.29Å; A432-E436 WeakPolarHBondContact O-CB 3.42Å; A432-E436 PolarHBondContact O-N 3.39Å |
| 433 | H | 88.3 | Confident | 87 | Confident | 109 Ų | 109 | 104.6 Ų | 104.6 | 51% | 0.505 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.5 | -43.8 | 176.5 | -170.4 | -81.9 | 0 | 0 | 0 | 111.6 | A429 Q430 L435 E436 E437 | A429-H433 PolarHBondContact O-N 2.62Å; Q430-H433 PolarHBondContact O-N 3.42Å; H433-L435 VanDerWaalsContact C-N 3.34Å; H433-L435 PolarHBondContact O-N 2.91Å; H433-E436 PolarHBondContact O-N 3.25Å; H433-E437 IonicContact CE1-OE1 2.82Å; H433-E437 PolarHBondContact CE1-OE1 3.13Å; H433-E437 IonicContact ND1-OE1 3.79Å; H433-E437 IonicContact ND1-OE2 3.66Å; H433-E437 WeakPolarHBondContact O-CB 3.07Å; H433-E437 WeakPolarHBondContact O-CG 3.43Å; H433-E437 PolarHBondContact O-N 3.45Å |
| 434 | Q | 88.5 | Confident | 87.4 | Confident | 86 Ų | 86 | 101.3 Ų | 101.3 | 40% | 0.402 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.1 | -35.6 | 176.1 | -74.4 | 176.2 | -14.3 | 0 | 0 | 113.1 | Q430 L431 A432 R438 | Q430-Q434 WeakPolarHBondContact O-CG 3.35Å; Q430-Q434 PolarHBondContact O-N 2.91Å; L431-Q434 PolarHBondContact O-N 3.37Å; A432-Q434 PolarHBondContact O-N 2.94Å; Q434-R438 WeakPolarHBondContact O-CB 3.47Å; Q434-R438 VanDerWaalsContact O-CG 3.22Å; Q434-R438 WeakPolarHBondContact O-CG 3.39Å; Q434-R438 PolarHBondContact O-N 3.48Å; Q434-R438 VanDerWaalsContact O-N 3.07Å |
| 435 | L | 85 | Confident | 88 | Confident | 64 Ų | 64 | 102.4 Ų | 102.4 | 34% | 0.335 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -68.8 | -42.7 | 173.7 | -71.6 | 168.3 | 0 | 0 | 0 | 111.3 | L431 A432 H433 R438 E439 | L431-L435 HydrophobicContact CG-CD1 4.19Å; L431-L435 WeakPolarHBondContact O-CB 3.09Å; L431-L435 VanDerWaalsContact O-CG 3.28Å; L431-L435 WeakPolarHBondContact O-CG 3.29Å; L431-L435 PolarHBondContact O-N 3.02Å; A432-L435 PolarHBondContact O-N 3.29Å; H433-L435 VanDerWaalsContact C-N 3.34Å; H433-L435 PolarHBondContact O-N 2.91Å; L435-R438 PolarHBondContact O-N 3.38Å; L435-E439 PolarHBondContact O-N 3.29Å |
| 436 | E | 87.1 | Confident | 88.5 | Confident | 141 Ų | 141 | 106.6 Ų | 106.6 | 66% | 0.659 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.3 | -42.6 | 176.7 | -172.8 | 174.5 | 177.7 | 0 | 0 | 112.2 | A432 H433 R438 E439 R440 | A432-E436 WeakPolarHBondContact O-CB 3.42Å; A432-E436 PolarHBondContact O-N 3.39Å; H433-E436 PolarHBondContact O-N 3.25Å; E436-R438 VanDerWaalsContact C-N 3.35Å; E436-R438 PolarHBondContact O-N 3.03Å; E436-E439 PolarHBondContact O-N 3.43Å; E436-R440 WeakPolarHBondContact O-CB 3.43Å; E436-R440 PolarHBondContact O-N 3.41Å |
| 437 | E | 90.1 | Very high | 88.8 | Confident | 80 Ų | 80 | 100.7 Ų | 100.7 | 37% | 0.374 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.6 | -43 | 171.9 | -77.6 | -172.8 | 139.8 | 0 | 0 | 112.2 | H433 R440 R441 | H433-E437 IonicContact CE1-OE1 2.82Å; H433-E437 PolarHBondContact CE1-OE1 3.13Å; H433-E437 IonicContact ND1-OE1 3.79Å; H433-E437 IonicContact ND1-OE2 3.66Å; H433-E437 WeakPolarHBondContact O-CB 3.07Å; H433-E437 WeakPolarHBondContact O-CG 3.43Å; H433-E437 PolarHBondContact O-N 3.45Å; E437-R440 PolarHBondContact O-N 3.21Å; E437-R441 VanDerWaalsContact O-CG 3.3Å; E437-R441 WeakPolarHBondContact O-CG 3.26Å; E437-R441 PolarHBondContact O-N 3.49Å |
| 438 | R | 87.6 | Confident | 88.9 | Confident | 168 Ų | 168 | 98.9 Ų | 98.9 | 63% | 0.634 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62.3 | -47.1 | 175.2 | -77.4 | 171.9 | 178.1 | -163.6 | 0.1 | 110.9 | Q434 L435 E436 R440 R441 I442 | Q434-R438 WeakPolarHBondContact O-CB 3.47Å; Q434-R438 VanDerWaalsContact O-CG 3.22Å; Q434-R438 WeakPolarHBondContact O-CG 3.39Å; Q434-R438 PolarHBondContact O-N 3.48Å; Q434-R438 VanDerWaalsContact O-N 3.07Å; L435-R438 PolarHBondContact O-N 3.38Å; E436-R438 VanDerWaalsContact C-N 3.35Å; E436-R438 PolarHBondContact O-N 3.03Å; R438-R440 VanDerWaalsContact C-N 3.34Å; R438-R440 PolarHBondContact O-N 3.38Å; R438-R441 PolarHBondContact O-N 3.4Å; R438-I442 WeakPolarHBondContact O-CB 3.43Å; R438-I442 WeakPolarHBondContact O-CD1 3.38Å; R438-I442 VanDerWaalsContact O-CG1 3.24Å; R438-I442 WeakPolarHBondContact O-CG1 3.44Å; R438-I442 PolarHBondContact O-N 3.34Å |
| 439 | E | 87.6 | Confident | 89.2 | Confident | 68 Ų | 68 | 100.1 Ų | 100.1 | 32% | 0.318 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.6 | -41.3 | 175.3 | -75.7 | -152.1 | 177.7 | 0 | 0 | 112.9 | K249 L435 E436 I442 K443 | K249-E439 WeakPolarHBondContact CE-OE1 3.36Å; K249-E439 IonicContact NZ-OE1 2.77Å; K249-E439 PolarHBondContact NZ-OE1 2.94Å; L435-E439 PolarHBondContact O-N 3.29Å; E436-E439 PolarHBondContact O-N 3.43Å; E439-I442 PolarHBondContact O-N 2.93Å; E439-K443 WeakPolarHBondContact O-CB 3.32Å; E439-K443 VanDerWaalsContact O-CG 3.31Å; E439-K443 WeakPolarHBondContact O-CG 3.45Å; E439-K443 PolarHBondContact O-N 3.05Å; E439-K443 IonicContact OE2-NZ 2.93Å; E439-K443 PolarHBondContact OE2-NZ 3.47Å |
| 440 | R | 90.8 | Very high | 89.6 | Confident | 181 Ų | 181 | 101.3 Ų | 101.3 | 68% | 0.683 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.4 | -42 | 177.6 | -174 | 177.3 | 177.1 | -172.2 | -0.6 | 111.6 | E436 E437 R438 N444 | E436-R440 WeakPolarHBondContact O-CB 3.43Å; E436-R440 PolarHBondContact O-N 3.41Å; E437-R440 PolarHBondContact O-N 3.21Å; R438-R440 VanDerWaalsContact C-N 3.34Å; R438-R440 PolarHBondContact O-N 3.38Å; R440-N444 VanDerWaalsContact O-CB 3.32Å; R440-N444 WeakPolarHBondContact O-CB 3.33Å; R440-N444 PolarHBondContact O-N 3.2Å; R440-N444 PolarHBondContact O-OD1 3.48Å |
| 441 | R | 90.9 | Very high | 89.8 | Confident | 163 Ų | 163 | 103.9 Ų | 103.9 | 62% | 0.615 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.7 | -39.2 | 173.9 | -70.2 | 176.5 | -162.6 | -142.1 | 6.9 | 112.1 | E437 R438 N444 H445 I448 | E437-R441 VanDerWaalsContact O-CG 3.3Å; E437-R441 WeakPolarHBondContact O-CG 3.26Å; E437-R441 PolarHBondContact O-N 3.49Å; R438-R441 PolarHBondContact O-N 3.4Å; R441-N444 CarbonylContact O-C 3.53Å; R441-N444 PolarHBondContact O-N 2.79Å; R441-H445 WeakPolarHBondContact O-CA 3.47Å; R441-H445 PolarHBondContact O-N 3.35Å; R441-I448 HydrophobicContact CB-CD1 4.4Å |
| 442 | I | 90.3 | Very high | 90.1 | Very high | 119 Ų | 119 | 102.9 Ų | 102.9 | 61% | 0.61 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -68.2 | -44.8 | 177.2 | -68.7 | 164.1 | 0 | 0 | 0 | 111.1 | R438 E439 N444 H445 | R438-I442 WeakPolarHBondContact O-CB 3.43Å; R438-I442 WeakPolarHBondContact O-CD1 3.38Å; R438-I442 VanDerWaalsContact O-CG1 3.24Å; R438-I442 WeakPolarHBondContact O-CG1 3.44Å; R438-I442 PolarHBondContact O-N 3.34Å; E439-I442 PolarHBondContact O-N 2.93Å; I442-N444 VanDerWaalsContact C-N 3.31Å; I442-N444 PolarHBondContact O-N 2.98Å; I442-H445 PolarHBondContact O-N 3.21Å; I442-H445 PolarHBondContact O-ND1 3.06Å |
| 443 | K | 91.4 | Very high | 90.5 | Very high | 146 Ų | 146 | 106.3 Ų | 106.3 | 64% | 0.635 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.3 | -39.8 | 175.6 | -73.2 | 165.7 | -171.7 | 161.6 | 0 | 111.5 | E439 | E439-K443 WeakPolarHBondContact O-CB 3.32Å; E439-K443 VanDerWaalsContact O-CG 3.31Å; E439-K443 WeakPolarHBondContact O-CG 3.45Å; E439-K443 PolarHBondContact O-N 3.05Å; E439-K443 IonicContact OE2-NZ 2.93Å; E439-K443 PolarHBondContact OE2-NZ 3.47Å |
| 444 | N | 93.1 | Very high | 90.6 | Very high | 69 Ų | 69 | 109.9 Ų | 109.9 | 37% | 0.369 | 55% | 0.55 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -93.2 | 12.5 | -178.1 | -64.8 | 28 | 0 | 0 | 0 | 113.9 | R440 R441 I442 L446 D447 I448 | R440-N444 VanDerWaalsContact O-CB 3.32Å; R440-N444 WeakPolarHBondContact O-CB 3.33Å; R440-N444 PolarHBondContact O-N 3.2Å; R440-N444 PolarHBondContact O-OD1 3.48Å; R441-N444 CarbonylContact O-C 3.53Å; R441-N444 PolarHBondContact O-N 2.79Å; I442-N444 VanDerWaalsContact C-N 3.31Å; I442-N444 PolarHBondContact O-N 2.98Å; N444-L446 VanDerWaalsContact C-N 3.27Å; N444-L446 PolarHBondContact O-N 3.19Å; N444-D447 PolarHBondContact O-N 2.78Å; N444-D447 VanDerWaalsContact O-N 3.09Å; N444-I448 HydrophobicContact CB-CD1 4.26Å; N444-I448 WeakPolarHBondContact O-CG1 3.28Å; N444-I448 PolarHBondContact O-N 3.45Å |
| 445 | H | 94.2 | Very high | 90.6 | Very high | 107 Ų | 107 | 115.6 Ų | 115.6 | 50% | 0.495 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -61.2 | -32.9 | -170 | 76.7 | -82.8 | 0 | 0 | 0 | 113.6 | R441 I442 I448 A449 | R441-H445 WeakPolarHBondContact O-CA 3.47Å; R441-H445 PolarHBondContact O-N 3.35Å; I442-H445 PolarHBondContact O-N 3.21Å; I442-H445 PolarHBondContact O-ND1 3.06Å; H445-I448 PolarHBondContact O-N 3.5Å; H445-A449 WeakPolarHBondContact O-CB 3.44Å; H445-A449 PolarHBondContact O-N 2.96Å |
| 446 | L | 93.4 | Very high | 90.8 | Very high | 126 Ų | 126 | 121.8 Ų | 121.8 | 66% | 0.66 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -65.9 | -43.1 | 175.7 | -62.2 | 176.6 | 0 | 0 | 0 | 112.1 | N444 A449 A450 | N444-L446 VanDerWaalsContact C-N 3.27Å; N444-L446 PolarHBondContact O-N 3.19Å; L446-A449 PolarHBondContact O-N 3.36Å; L446-A450 WeakPolarHBondContact O-CB 2.94Å; L446-A450 PolarHBondContact O-N 3.4Å |
| 447 | D | 92.3 | Very high | 90.8 | Very high | 71 Ų | 71 | 121.2 Ų | 121.2 | 38% | 0.38 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -66.5 | -38.7 | 176.3 | 178.9 | 57.5 | 0 | 0 | 0 | 111.4 | N444 K451 | N444-D447 PolarHBondContact O-N 2.78Å; N444-D447 VanDerWaalsContact O-N 3.09Å; D447-K451 WeakPolarHBondContact O-CB 3.34Å; D447-K451 WeakPolarHBondContact O-CD 3.49Å; D447-K451 WeakPolarHBondContact O-CG 3.4Å; D447-K451 PolarHBondContact O-N 3.08Å; D447-K451 VanDerWaalsContact O-N 3.08Å; D447-K451 WeakPolarHBondContact OD1-CE 3.5Å; D447-K451 IonicContact OD1-NZ 3.87Å; D447-K451 PolarHBondContact OD1-NZ 3.02Å; D447-K451 IonicContact OD2-NZ 2.7Å; D447-K451 PolarHBondContact OD2-NZ 3.48Å |
| 448 | I | 90.6 | Very high | 90.7 | Very high | 93 Ų | 93 | 125.2 Ų | 125.2 | 48% | 0.477 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -65.8 | -40 | 174.3 | -65.4 | 166.3 | 0 | 0 | 0 | 111 | R441 N444 H445 G452 | R441-I448 HydrophobicContact CB-CD1 4.4Å; N444-I448 HydrophobicContact CB-CD1 4.26Å; N444-I448 WeakPolarHBondContact O-CG1 3.28Å; N444-I448 PolarHBondContact O-N 3.45Å; H445-I448 PolarHBondContact O-N 3.5Å; I448-G452 PolarHBondContact O-N 3.42Å |
| 449 | A | 90.8 | Very high | 90.7 | Very high | 71 Ų | 71 | 123.9 Ų | 123.9 | 59% | 0.587 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -68 | -44.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | H445 L446 K451 G452 | H445-A449 WeakPolarHBondContact O-CB 3.44Å; H445-A449 PolarHBondContact O-N 2.96Å; L446-A449 PolarHBondContact O-N 3.36Å; A449-K451 VanDerWaalsContact C-N 3.27Å; A449-K451 PolarHBondContact O-N 3.36Å; A449-G452 PolarHBondContact O-N 2.91Å |
| 450 | A | 91.9 | Very high | 90.6 | Very high | 86 Ų | 86 | 127.6 Ų | 127.6 | 71% | 0.711 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -65.2 | -28 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L446 | L446-A450 WeakPolarHBondContact O-CB 2.94Å; L446-A450 PolarHBondContact O-N 3.4Å |
| 451 | K | 93.3 | Very high | 90.3 | Very high | 150 Ų | 150 | 122.5 Ų | 122.5 | 65% | 0.652 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -3.7 | 173.6 | -71.3 | 166.6 | 178.6 | 161 | 0 | 113.7 | D447 A449 | D447-K451 WeakPolarHBondContact O-CB 3.34Å; D447-K451 WeakPolarHBondContact O-CD 3.49Å; D447-K451 WeakPolarHBondContact O-CG 3.4Å; D447-K451 PolarHBondContact O-N 3.08Å; D447-K451 VanDerWaalsContact O-N 3.08Å; D447-K451 WeakPolarHBondContact OD1-CE 3.5Å; D447-K451 IonicContact OD1-NZ 3.87Å; D447-K451 PolarHBondContact OD1-NZ 3.02Å; D447-K451 IonicContact OD2-NZ 2.7Å; D447-K451 PolarHBondContact OD2-NZ 3.48Å; A449-K451 VanDerWaalsContact C-N 3.27Å; A449-K451 PolarHBondContact O-N 3.36Å |
| 452 | G | 91.7 | Very high | 89.8 | Confident | 34 Ų | 34 | 117.7 Ų | 117.7 | 35% | 0.351 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -76 | 152 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | I448 A449 L454 | I448-G452 PolarHBondContact O-N 3.42Å; A449-G452 PolarHBondContact O-N 2.91Å; G452-L454 PolarHBondContact O-N 3.29Å |
| 453 | P | 91.8 | Very high | 89.3 | Confident | 101 Ų | 101 | 119.9 Ų | 119.9 | 66% | 0.656 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 134.2 | 171.3 | 28.3 | -34 | 0 | 0 | 0 | 110.3 | R455 | P453-R455 PolarHBondContact O-N 3.46Š|
| 454 | L | 90.5 | Very high | 88.3 | Confident | 183 Ų | 183 | 120 Ų | 120 | 96% | 0.958 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 124.1 | 174.8 | -77.6 | 159.9 | 0 | 0 | 0 | 110.4 | G452 | G452-L454 PolarHBondContact O-N 3.29Š|
| 455 | R | 88.3 | Confident | 87.2 | Confident | 206 Ų | 206 | 123.6 Ų | 123.6 | 78% | 0.777 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -96.8 | 135.1 | 174.7 | -62.5 | -63.2 | -177.2 | 147.6 | -0.7 | 108.9 | P453 | P453-R455 PolarHBondContact O-N 3.46Š|
| 456 | Q | 88.4 | Confident | 85.6 | Confident | 195 Ų | 195 | 124.2 Ų | 124.2 | 91% | 0.911 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 135.2 | 169.7 | -69 | 175.8 | -16.6 | 0 | 0 | 109.6 | ||
| 457 | T | 87.4 | Confident | 84.1 | Confident | 128 Ų | 128 | 124 Ų | 124 | 79% | 0.785 | 67% | 0.669 | S | S | * | * | trans | -127.5 | 139.4 | 178.2 | 51.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 458 | F | 87.9 | Confident | 82.3 | Confident | 165 Ų | 165 | 129.5 Ų | 129.5 | 72% | 0.724 | 69% | 0.693 | S | S | * | * | trans | -85.9 | 141.4 | 177.9 | -61.2 | -81.2 | 0 | 0 | 0 | 110.7 | H460 P462 | F458-H460 WeakPolarHBondContact CB-O 3.24Å; F458-H460 PolarHBondContact O-N 3.31Å; F458-P462 HydrophobicContact CD2-CG 3.99Å; F458-P462 HydrophobicContact CE2-CG 4.45Å | ||
| 459 | T | 88.3 | Confident | 80.6 | Confident | 139 Ų | 139 | 129.1 Ų | 129.1 | 85% | 0.853 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -62.5 | -27.5 | 178.3 | -41.3 | 0 | 0 | 0 | 0 | 113.2 | ||
| 460 | H | 84.3 | Confident | 78.6 | Confident | 147 Ų | 147 | 130.4 Ų | 130.4 | 68% | 0.681 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -126.6 | 151.7 | 175.9 | -59.1 | -67 | 0 | 0 | 0 | 109.8 | F458 P462 | F458-H460 WeakPolarHBondContact CB-O 3.24Å; F458-H460 PolarHBondContact O-N 3.31Å; H460-P462 VanDerWaalsContact O-CD 3.25Å; H460-P462 WeakPolarHBondContact O-CD 3.45Å |
| 461 | N | 85.1 | Confident | 76.8 | Confident | 73 Ų | 73 | 135.8 Ų | 135.8 | 39% | 0.39 | 72% | 0.721 | S | S | . | * | trans | -65.7 | 112.2 | 179.7 | -178.2 | -1.4 | 0 | 0 | 0 | 110.8 | L463 Q464 | N461-L463 PolarHBondContact O-N 2.91Å; N461-L463 PolarHBondContact OD1-N 3.28Å; N461-Q464 HydrophobicContact CB-CB 4.23Å; N461-Q464 WeakPolarHBondContact ND2-CG 3.32Å; N461-Q464 PolarHBondContact ND2-OE1 3.07Å; N461-Q464 PolarHBondContact O-N 3.08Å | ||
| 462 | P | 79.9 | Confident | 74.8 | Confident | 63 Ų | 63 | 137.6 Ų | 137.6 | 41% | 0.409 | 73% | 0.732 | S | S | . | * | G | 310 helix | trans | -68.3 | -20 | -176.8 | 29.5 | -35.5 | 0 | 0 | 0 | 112.6 | F458 H460 | F458-P462 HydrophobicContact CD2-CG 3.99Å; F458-P462 HydrophobicContact CE2-CG 4.45Å; H460-P462 VanDerWaalsContact O-CD 3.25Å; H460-P462 WeakPolarHBondContact O-CD 3.45Å |
| 463 | L | 80.6 | Confident | 73.1 | Confident | 165 Ų | 165 | 144.4 Ų | 144.4 | 86% | 0.864 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -85.6 | -7.6 | -179.9 | -55.4 | 177.6 | 0 | 0 | 0 | 113.5 | N461 | N461-L463 PolarHBondContact O-N 2.91Å; N461-L463 PolarHBondContact OD1-N 3.28Å |
| 464 | Q | 71.3 | Confident | 71.4 | Confident | 147 Ų | 147 | 148.4 Ų | 148.4 | 69% | 0.687 | 77% | 0.765 | S | S | * | * | G | 310 helix | trans | -106.2 | 9.1 | 177.2 | -80.6 | 175.1 | -37.5 | 0 | 0 | 113 | N461 T466 | N461-Q464 HydrophobicContact CB-CB 4.23Å; N461-Q464 WeakPolarHBondContact ND2-CG 3.32Å; N461-Q464 PolarHBondContact ND2-OE1 3.07Å; N461-Q464 PolarHBondContact O-N 3.08Å; Q464-T466 VanDerWaalsContact C-N 3.3Å; Q464-T466 PolarHBondContact O-N 2.94Å |
| 465 | Q | 68.7 | Low | 70.1 | Confident | 145 Ų | 145 | 147.1 Ų | 147.1 | 68% | 0.678 | 76% | 0.757 | S | S | * | * | trans | -74.8 | 82.8 | 172.2 | -65.3 | -172.4 | 0.9 | 0 | 0 | 110.4 | ||||
| 466 | T | 61.2 | Low | 69 | Low | 120 Ų | 120 | 143.3 Ų | 143.3 | 74% | 0.736 | 75% | 0.746 | S | S | * | * | trans | -56.7 | 124.1 | 161 | -52.3 | 0 | 0 | 0 | 0 | 107.8 | Q464 Q468 | Q464-T466 VanDerWaalsContact C-N 3.3Å; Q464-T466 PolarHBondContact O-N 2.94Å; T466-Q468 PolarHBondContact O-N 3.47Å | ||
| 467 | P | 61.2 | Low | 67.8 | Low | 121 Ų | 121 | 138.5 Ų | 138.5 | 79% | 0.786 | 74% | 0.74 | S | S | * | * | trans | -65.6 | 105.1 | -174.5 | 24.8 | -33.6 | 0 | 0 | 0 | 110.5 | A469 | P467-A469 PolarHBondContact O-N 2.95Š| ||
| 468 | Q | 54.4 | Low | 66.9 | Low | 188 Ų | 188 | 138.3 Ų | 138.3 | 88% | 0.879 | 73% | 0.728 | S | S | * | * | trans | -70.3 | 115.4 | 178.3 | -80.6 | -171.3 | -32 | 0 | 0 | 110.6 | T466 | T466-Q468 PolarHBondContact O-N 3.47Š| ||
| 469 | A | 54.7 | Low | 65.7 | Low | 85 Ų | 85 | 134.2 Ų | 134.2 | 70% | 0.702 | 72% | 0.718 | S | S | * | * | trans | 50.8 | 72.5 | 159.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | P467 K471 | P467-A469 PolarHBondContact O-N 2.95Å; A469-K471 PolarHBondContact O-N 3.27Å | ||
| 470 | A | 49.5 | Very low | 64.5 | Low | 97 Ų | 97 | 134.5 Ų | 134.5 | 80% | 0.802 | 70% | 0.704 | S | S | * | * | trans | -54.7 | 119 | 130.2 | 0 | 0 | 0 | 0 | 0 | 106.8 | Q472 | A470-Q472 PolarHBondContact O-N 3.03Š| ||
| 471 | K | 53.3 | Low | 63.5 | Low | 200 Ų | 200 | 134.6 Ų | 134.6 | 87% | 0.87 | 70% | 0.702 | S | S | * | * | trans | -60.2 | 102.6 | -178 | -75.4 | -178.3 | 176.2 | 179.6 | 0 | 109.4 | A469 Q473 | A469-K471 PolarHBondContact O-N 3.27Å; K471-Q473 PolarHBondContact O-N 3.39Å; K471-Q473 VanDerWaalsContact O-N 3.17Å | ||
| 472 | Q | 51.4 | Low | 62.5 | Low | 188 Ų | 188 | 136.2 Ų | 136.2 | 88% | 0.879 | 71% | 0.711 | S | S | * | * | trans | -59 | 118.9 | 156.9 | -74.7 | -179.6 | -32.8 | 0 | 0 | 106.4 | A470 E474 | A470-Q472 PolarHBondContact O-N 3.03Å; Q472-E474 PolarHBondContact O-N 2.87Å | ||
| 473 | Q | 57.6 | Low | 61.7 | Low | 177 Ų | 177 | 139 Ų | 139 | 83% | 0.827 | 73% | 0.726 | S | S | * | * | trans | -60.5 | 135.3 | 171.4 | -68.8 | 170.9 | -43 | 0 | 0 | 107.7 | K471 I475 | K471-Q473 PolarHBondContact O-N 3.39Å; K471-Q473 VanDerWaalsContact O-N 3.17Å; Q473-I475 VanDerWaalsContact C-N 3.34Å; Q473-I475 PolarHBondContact O-N 3.08Å | ||
| 474 | E | 56.3 | Low | 60.7 | Low | 185 Ų | 185 | 137.2 Ų | 137.2 | 86% | 0.864 | 72% | 0.717 | S | S | * | * | trans | -64.1 | 97.2 | 172.9 | -80.8 | -169.8 | 119.3 | 0 | 0 | 109.5 | Q472 K476 | Q472-E474 PolarHBondContact O-N 2.87Å; E474-K476 PolarHBondContact O-N 3.35Å | ||
| 475 | I | 63.2 | Low | 59.9 | Low | 156 Ų | 156 | 137.2 Ų | 137.2 | 80% | 0.8 | 76% | 0.756 | S | S | * | * | trans | -69.8 | 86.1 | 162.1 | -56.7 | 178.9 | 0 | 0 | 0 | 105.9 | Q473 A477 | Q473-I475 VanDerWaalsContact C-N 3.34Å; Q473-I475 PolarHBondContact O-N 3.08Å; I475-A477 PolarHBondContact O-N 2.86Å | ||
| 476 | K | 63.6 | Low | 59.4 | Low | 125 Ų | 125 | 136.9 Ų | 136.9 | 54% | 0.543 | 76% | 0.76 | S | S | . | * | trans | -46.8 | 131.1 | 176.5 | -64.8 | -177.5 | -171.8 | 172.4 | 0 | 109 | E474 K478 P479 D482 | E474-K476 PolarHBondContact O-N 3.35Å; K476-K478 PolarHBondContact O-N 3.42Å; K476-P479 WeakPolarHBondContact O-CD 3.2Å; K476-D482 IonicContact NZ-OD1 2.75Å; K476-D482 IonicContact NZ-OD2 2.94Å; K476-D482 PolarHBondContact NZ-OD2 3.14Å | ||
| 477 | A | 64.4 | Low | 59.3 | Low | 94 Ų | 94 | 137.7 Ų | 137.7 | 78% | 0.777 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -64.1 | -3.3 | -169.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | I475 | I475-A477 PolarHBondContact O-N 2.86Š|
| 478 | K | 67.4 | Low | 59.2 | Low | 124 Ų | 124 | 138.7 Ų | 138.7 | 54% | 0.539 | 76% | 0.76 | S | S | . | * | trans | -144.9 | 70.2 | 176.9 | -62.1 | -166.2 | 175.9 | -175.2 | 0 | 111.6 | K476 W480 K481 | K476-K478 PolarHBondContact O-N 3.42Å; K478-W480 HydrophobicContact CB-CD2 4.35Å; K478-W480 HydrophobicContact CB-CH2 4.03Å; K478-W480 HydrophobicContact CB-CZ2 3.77Å; K478-W480 HydrophobicContact CB-CZ3 4.42Å; K478-W480 HydrophobicContact CD-CH2 4.45Å; K478-W480 HydrophobicContact CD-CZ2 3.82Å; K478-W480 HydrophobicContact CG-CH2 3.78Å; K478-W480 HydrophobicContact CG-CZ2 3.57Å; K478-W480 PolarHBondContact O-N 3.5Å; K478-K481 HydrophobicContact CB-CG 4.47Å; K478-K481 PolarHBondContact O-N 3.5Å | ||
| 479 | P | 63.7 | Low | 59.5 | Low | 79 Ų | 79 | 135.8 Ų | 135.8 | 51% | 0.513 | 75% | 0.753 | S | S | . | * | G | 310 helix | trans | -65.8 | -21 | -172.8 | 27.7 | -35.9 | 0 | 0 | 0 | 114.1 | K476 K481 D482 | K476-P479 WeakPolarHBondContact O-CD 3.2Å; P479-K481 PolarHBondContact O-N 2.78Å; P479-D482 PolarHBondContact O-N 3.22Å |
| 480 | W | 63.5 | Low | 59.8 | Low | 146 Ų | 146 | 138.9 Ų | 138.9 | 55% | 0.553 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -67.9 | -18.6 | 178.5 | 57.5 | 90 | 0 | 0 | 0 | 114.3 | K478 D482 T483 I484 | K478-W480 HydrophobicContact CB-CD2 4.35Å; K478-W480 HydrophobicContact CB-CH2 4.03Å; K478-W480 HydrophobicContact CB-CZ2 3.77Å; K478-W480 HydrophobicContact CB-CZ3 4.42Å; K478-W480 HydrophobicContact CD-CH2 4.45Å; K478-W480 HydrophobicContact CD-CZ2 3.82Å; K478-W480 HydrophobicContact CG-CH2 3.78Å; K478-W480 HydrophobicContact CG-CZ2 3.57Å; K478-W480 PolarHBondContact O-N 3.5Å; W480-D482 PolarHBondContact O-N 3.5Å; W480-T483 PolarHBondContact O-N 3.01Å; W480-T483 PolarHBondContact O-OG1 2.95Å; W480-I484 PolarHBondContact O-N 3.18Å |
| 481 | K | 63.1 | Low | 60.5 | Low | 148 Ų | 148 | 141.7 Ų | 141.7 | 64% | 0.643 | 75% | 0.753 | S | S | * | * | G | 310 helix | trans | -66.6 | -22 | 175.5 | -81.2 | -159.8 | 162.6 | -147.1 | 0 | 114 | K478 P479 T483 | K478-K481 HydrophobicContact CB-CG 4.47Å; K478-K481 PolarHBondContact O-N 3.5Å; P479-K481 PolarHBondContact O-N 2.78Å; K481-T483 VanDerWaalsContact C-N 3.33Å |
| 482 | D | 62.7 | Low | 61 | Low | 108 Ų | 108 | 137.6 Ų | 137.6 | 58% | 0.578 | 75% | 0.745 | S | S | * | * | G | 310 helix | trans | -90.3 | 0 | -179.3 | -63.4 | -9.1 | 0 | 0 | 0 | 111.4 | K476 P479 W480 | K476-D482 IonicContact NZ-OD1 2.75Å; K476-D482 IonicContact NZ-OD2 2.94Å; K476-D482 PolarHBondContact NZ-OD2 3.14Å; P479-D482 PolarHBondContact O-N 3.22Å; W480-D482 PolarHBondContact O-N 3.5Å |
| 483 | T | 63.7 | Low | 61.7 | Low | 120 Ų | 120 | 133.7 Ų | 133.7 | 74% | 0.736 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.8 | -21.3 | 179.8 | 53.8 | 0 | 0 | 0 | 0 | 115.9 | W480 K481 | W480-T483 PolarHBondContact O-N 3.01Å; W480-T483 PolarHBondContact O-OG1 2.95Å; K481-T483 VanDerWaalsContact C-N 3.33Å |
| 484 | I | 59.1 | Low | 62.1 | Low | 129 Ų | 129 | 130.1 Ų | 130.1 | 66% | 0.662 | 73% | 0.727 | S | S | * | * | trans | -131.9 | 119 | 172.9 | -51.4 | 178.4 | 0 | 0 | 0 | 108.1 | W480 | W480-I484 PolarHBondContact O-N 3.18Š| ||
| 485 | G | 54.6 | Low | 62.6 | Low | 147 Ų | 147 | 125.1 Ų | 125.1 | 100% | 1.515 | 72% | 0.715 | S | S | * | * | trans | -82.1 | 0 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.2 |
Retrieved 485 of 485 residues in 397.1 ms
(Link to these results)