| 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 | 31.8 | Very low | 37.4 | Very low | 233 Ų | 233 | 145.6 Ų | 145.6 | 100% | 1.148 | 81% | 0.805 | S | S | * | * | 0 | 140.8 | 0 | -64.3 | -46 | 179.6 | 0 | 0 | 108.4 | |||||
| 2 | P | 45.9 | Very low | 37.1 | Very low | 110 Ų | 110 | 148 Ų | 148 | 71% | 0.714 | 81% | 0.806 | S | S | * | * | -127.6 | 167.7 | -112.7 | 41.2 | -32.1 | 0 | 0 | 0 | 117.6 | |||||
| 3 | S | 33.8 | Very low | 36.9 | Very low | 98 Ų | 98 | 144.4 Ų | 144.4 | 69% | 0.685 | 80% | 0.798 | S | S | * | * | trans | 55.9 | 109.9 | 144.6 | 57.5 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 4 | L | 40.7 | Very low | 36.7 | Very low | 157 Ų | 157 | 144.1 Ų | 144.1 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | 27.4 | 134 | 113 | -63.2 | 168.5 | 0 | 0 | 0 | 119 | |||||
| 5 | I | 38.9 | Very low | 36.6 | Very low | 166 Ų | 166 | 141.3 Ų | 141.3 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | -162.9 | 150.1 | 105.5 | -99.1 | 157.8 | 0 | 0 | 0 | 110.5 | |||||
| 6 | T | 38.9 | Very low | 36.6 | Very low | 112 Ų | 112 | 138.8 Ų | 138.8 | 69% | 0.687 | 81% | 0.806 | S | S | * | * | trans | -93.5 | 156 | -179.9 | 47.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 7 | M | 32.5 | Very low | 36.7 | Very low | 177 Ų | 177 | 136.2 Ų | 136.2 | 87% | 0.872 | 81% | 0.806 | S | S | * | * | trans | -142.2 | 131.5 | 152.2 | -87.7 | -66.7 | 101.6 | 0 | 0 | 109.7 | ||||
| 8 | S | 34.7 | Very low | 37 | Very low | 99 Ų | 99 | 135.6 Ų | 135.6 | 69% | 0.692 | 81% | 0.806 | S | S | * | * | trans | -84.5 | 153.2 | 174.9 | -54.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 9 | V | 40.6 | Very low | 36.9 | Very low | 145 Ų | 145 | 137.3 Ų | 137.3 | 88% | 0.879 | 81% | 0.81 | S | S | * | * | trans | -135.8 | 107.7 | 156.1 | -176.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 10 | D | 37.1 | Very low | 36.7 | Very low | 134 Ų | 134 | 138.3 Ų | 138.3 | 72% | 0.717 | 81% | 0.811 | S | S | * | * | trans | -81.7 | 170.6 | 172.7 | -80.6 | -70.2 | 0 | 0 | 0 | 111.7 | ||||
| 11 | H | 37.1 | Very low | 36.7 | Very low | 171 Ų | 171 | 139.1 Ų | 139.1 | 79% | 0.792 | 81% | 0.811 | S | S | * | * | trans | -56 | 161.8 | 176.3 | -51 | -77.6 | 0 | 0 | 0 | 111.9 | ||||
| 12 | Q | 33.5 | Very low | 36.7 | Very low | 174 Ų | 174 | 133.1 Ų | 133.1 | 81% | 0.813 | 79% | 0.792 | S | S | * | * | -174 | 158.4 | 54 | -143.5 | 158.8 | 38.8 | 0 | 0 | 113.3 | |||||
| 13 | S | 34.8 | Very low | 36.3 | Very low | 101 Ų | 101 | 134.2 Ų | 134.2 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | 22.6 | 124 | 153.1 | 59.5 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 14 | V | 33.5 | Very low | 36.4 | Very low | 141 Ų | 141 | 136.6 Ų | 136.6 | 86% | 0.855 | 81% | 0.808 | S | S | * | * | trans | -132.6 | 127.6 | 146 | 178.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 15 | A | 35.1 | Very low | 36.1 | Very low | 101 Ų | 101 | 134 Ų | 134 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | -99.5 | 144.8 | 165.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 16 | A | 36.4 | Very low | 36 | Very low | 101 Ų | 101 | 138.2 Ų | 138.2 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | trans | -133.3 | 120.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 17 | A | 38 | Very low | 35.6 | Very low | 96 Ų | 96 | 136.3 Ų | 136.3 | 79% | 0.793 | 82% | 0.817 | S | S | * | * | trans | -159.5 | 166.7 | 168 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 18 | P | 42.3 | Very low | 35.8 | Very low | 125 Ų | 125 | 139.6 Ų | 139.6 | 81% | 0.812 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | -98.1 | 165.4 | -70.2 | 36.4 | -30.2 | 0 | 0 | 0 | 111.1 | |||
| 19 | L | 34.9 | Very low | 35.7 | Very low | 168 Ų | 168 | 140.2 Ų | 140.2 | 88% | 0.88 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -91.4 | 122 | 173.5 | -76.1 | 171.5 | 0 | 0 | 0 | 111.3 | ||
| 20 | D | 32.6 | Very low | 35.4 | Very low | 156 Ų | 156 | 140.7 Ų | 140.7 | 83% | 0.834 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -103 | 142.3 | 165.3 | -166.8 | 2.4 | 0 | 0 | 0 | 108.6 | ||
| 21 | L | 37.2 | Very low | 35.2 | Very low | 156 Ų | 156 | 139 Ų | 139 | 82% | 0.817 | 83% | 0.825 | S | S | * | * | trans | -137.5 | 90.2 | -171.6 | -85.4 | 174.9 | 0 | 0 | 0 | 112.6 | ||||
| 22 | S | 31.4 | Very low | 35 | Very low | 107 Ų | 107 | 134.4 Ų | 134.4 | 75% | 0.748 | 82% | 0.824 | S | S | * | * | trans | -73.5 | 138.5 | 172.3 | 60 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 23 | T | 38.8 | Very low | 34.8 | Very low | 134 Ų | 134 | 132.8 Ų | 132.8 | 82% | 0.822 | 82% | 0.822 | S | S | * | * | trans | -34.8 | 136.9 | 169.8 | 53.6 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 24 | T | 36.2 | Very low | 34.8 | Very low | 148 Ų | 148 | 134.8 Ų | 134.8 | 91% | 0.908 | 82% | 0.824 | S | S | * | * | trans | -139.5 | 160.6 | 150.6 | 50.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 25 | A | 34.2 | Very low | 34.7 | Very low | 101 Ų | 101 | 133.3 Ų | 133.3 | 84% | 0.835 | 82% | 0.815 | S | S | * | * | trans | -121.9 | 150.9 | -158.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 26 | R | 36.5 | Very low | 34.3 | Very low | 256 Ų | 256 | 137.8 Ų | 137.8 | 97% | 0.966 | 82% | 0.816 | S | S | * | * | trans | -150.5 | 148.3 | 159.9 | -75.8 | -177.5 | 171.4 | 171.2 | -3.5 | 108.3 | ||||
| 27 | G | 31 | Very low | 34.2 | Very low | 72 Ų | 72 | 137.9 Ų | 137.9 | 74% | 0.742 | 81% | 0.81 | S | S | * | * | cis | 155.8 | 110.4 | -12.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 28 | R | 35.7 | Very low | 34 | Very low | 246 Ų | 246 | 138.2 Ų | 138.2 | 93% | 0.928 | 81% | 0.812 | S | S | * | * | trans | 72 | 117.5 | 161.4 | -61.8 | 178.9 | 170.9 | 174.2 | -3.8 | 121.6 | ||||
| 29 | S | 33.5 | Very low | 33.5 | Very low | 111 Ų | 111 | 136 Ų | 136 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | -169.6 | 114 | 117.4 | 54.2 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 30 | N | 33.4 | Very low | 33.4 | Very low | 156 Ų | 156 | 136.2 Ų | 136.2 | 83% | 0.834 | 81% | 0.814 | S | S | * | * | 56.7 | 131.1 | 90.9 | -76.4 | 25.3 | 0 | 0 | 0 | 114.5 | |||||
| 31 | A | 33.9 | Very low | 33.5 | Very low | 97 Ų | 97 | 133.8 Ų | 133.8 | 80% | 0.802 | 82% | 0.815 | S | S | * | * | cis | -165.1 | 164.4 | -5.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 32 | G | 32.6 | Very low | 33.3 | Very low | 75 Ų | 75 | 138.2 Ų | 138.2 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | trans | 88.5 | 152.5 | 167.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 33 | D | 29.7 | Very low | 33.5 | Very low | 141 Ų | 141 | 137.1 Ų | 137.1 | 75% | 0.754 | 82% | 0.819 | S | S | * | * | cis | -162.6 | 147.2 | -15.6 | -157.3 | 10.5 | 0 | 0 | 0 | 111.6 | ||||
| 34 | L | 33.2 | Very low | 33.3 | Very low | 143 Ų | 143 | 137.6 Ų | 137.6 | 75% | 0.749 | 82% | 0.822 | S | S | * | * | trans | 57.4 | 158.6 | 170.8 | -55.5 | 175.4 | 0 | 0 | 0 | 117.3 | ||||
| 35 | T | 32.8 | Very low | 33 | Very low | 110 Ų | 110 | 134.5 Ų | 134.5 | 68% | 0.675 | 82% | 0.82 | S | S | * | * | cis | -159.2 | 152.8 | 3.8 | -8.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 36 | F | 27.1 | Very low | 32.8 | Very low | 194 Ų | 194 | 133.5 Ų | 133.5 | 85% | 0.851 | 82% | 0.819 | S | S | * | * | trans | 49.1 | 145.5 | 149.1 | -91.5 | -130 | 0 | 0 | 0 | 121.3 | ||||
| 37 | C | 33 | Very low | 33 | Very low | 104 Ų | 104 | 127 Ų | 127 | 70% | 0.703 | 81% | 0.813 | S | S | * | * | cis | -162.2 | 176.8 | -9.9 | -144.7 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 38 | A | 33.6 | Very low | 34.3 | Very low | 102 Ų | 102 | 129.7 Ų | 129.7 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | trans | -32.3 | 159.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 39 | G | 31.8 | Very low | 34.3 | Very low | 79 Ų | 79 | 122.3 Ų | 122.3 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | trans | 173.4 | 41.3 | 167.2 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 40 | D | 34.1 | Very low | 35.7 | Very low | 173 Ų | 173 | 122.7 Ų | 122.7 | 93% | 0.925 | 81% | 0.808 | S | S | * | * | trans | -72.3 | 142.4 | 172.7 | -81.4 | -67.6 | 0 | 0 | 0 | 114 | ||||
| 41 | A | 34.7 | Very low | 36.9 | Very low | 104 Ų | 104 | 120.5 Ų | 120.5 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -168.8 | 146.8 | 143.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 42 | R | 33.5 | Very low | 37 | Very low | 249 Ų | 249 | 120 Ų | 120 | 94% | 0.94 | 80% | 0.799 | S | S | * | * | trans | -153.9 | 117.5 | -178.3 | -178.5 | -174.8 | -176.7 | -174.3 | 2.9 | 111.9 | ||||
| 43 | A | 34.6 | Very low | 37.1 | Very low | 84 Ų | 84 | 121.7 Ų | 121.7 | 69% | 0.694 | 80% | 0.798 | S | S | * | * | trans | -156.6 | 126.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 44 | T | 35.1 | Very low | 37.4 | Very low | 144 Ų | 144 | 122.4 Ų | 122.4 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | 56.3 | 124.9 | 67.9 | 67.3 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 45 | G | 30.3 | Very low | 37.3 | Very low | 84 Ų | 84 | 118.2 Ų | 118.2 | 87% | 0.866 | 80% | 0.8 | S | S | * | * | cis | 165.1 | 176.5 | -1.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 46 | G | 29.6 | Very low | 37.6 | Very low | 79 Ų | 79 | 119.8 Ų | 119.8 | 81% | 0.814 | 81% | 0.809 | S | S | * | * | trans | 132.2 | 159.1 | 168 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 47 | S | 40.6 | Very low | 37.8 | Very low | 121 Ų | 121 | 117.3 Ų | 117.3 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | trans | -149.4 | -178 | 175.6 | -50.4 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 48 | P | 57.6 | Low | 37.8 | Very low | 128 Ų | 128 | 118.4 Ų | 118.4 | 83% | 0.831 | 81% | 0.814 | S | S | * | * | cis | -135.4 | -166.9 | -1 | 41.6 | -21.4 | 0 | 0 | 0 | 115.7 | ||||
| 49 | A | 36.8 | Very low | 37.7 | Very low | 90 Ų | 90 | 119 Ų | 119 | 74% | 0.744 | 81% | 0.811 | S | S | * | * | trans | -47.9 | -173.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 50 | P | 62.9 | Low | 37.7 | Very low | 119 Ų | 119 | 119.9 Ų | 119.9 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | cis | -125.8 | -130.7 | -9.1 | 37.9 | -15.3 | 0 | 0 | 0 | 110.9 | ||||
| 51 | P | 58.6 | Low | 37.6 | Very low | 111 Ų | 111 | 117.4 Ų | 117.4 | 72% | 0.721 | 80% | 0.802 | S | S | * | * | cis | -135.4 | -174.7 | -32.1 | 39.4 | -20.2 | 0 | 0 | 0 | 117 | ||||
| 52 | A | 35.3 | Very low | 37.3 | Very low | 86 Ų | 86 | 123.5 Ų | 123.5 | 71% | 0.711 | 80% | 0.803 | S | S | * | * | trans | 72.1 | 95.9 | 140.6 | 0 | 0 | 0 | 0 | 0 | 125.6 | ||||
| 53 | S | 34.1 | Very low | 37.1 | Very low | 110 Ų | 110 | 122.8 Ų | 122.8 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | 41.6 | 124.1 | 125.4 | 63.9 | 0 | 0 | 0 | 0 | 125.4 | |||||
| 54 | T | 36.2 | Very low | 36.9 | Very low | 157 Ų | 157 | 124 Ų | 124 | 96% | 0.963 | 80% | 0.803 | S | S | * | * | trans | 177.9 | 160.8 | 130.9 | 24.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 55 | G | 31.4 | Very low | 37.5 | Very low | 55 Ų | 55 | 123 Ų | 123 | 57% | 0.567 | 80% | 0.8 | S | S | * | * | cis | 168.3 | 155.4 | -5.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 56 | T | 38.7 | Very low | 37.3 | Very low | 142 Ų | 142 | 126.4 Ų | 126.4 | 87% | 0.871 | 80% | 0.798 | S | S | * | * | trans | 64.4 | 171.7 | 176.4 | 68.7 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 57 | D | 31.6 | Very low | 37.4 | Very low | 143 Ų | 143 | 127 Ų | 127 | 77% | 0.765 | 80% | 0.795 | S | S | * | * | 179.6 | 134.9 | -62.5 | -106.9 | -49.9 | 0 | 0 | 0 | 108.7 | |||||
| 58 | S | 33.9 | Very low | 36.7 | Very low | 127 Ų | 127 | 129 Ų | 129 | 89% | 0.888 | 79% | 0.791 | S | S | * | * | trans | -173.4 | 125.9 | 159.2 | -87.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 59 | S | 31.5 | Very low | 35.2 | Very low | 113 Ų | 113 | 132.6 Ų | 132.6 | 79% | 0.79 | 79% | 0.788 | S | S | * | * | trans | -150.9 | 135.8 | 176.1 | 63.5 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 60 | A | 29.9 | Very low | 34.9 | Very low | 99 Ų | 99 | 134 Ų | 134 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | -160.7 | 102.1 | 166.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 61 | V | 33.9 | Very low | 33.2 | Very low | 120 Ų | 120 | 136.8 Ų | 136.8 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | 77.7 | 95.3 | 56.9 | -177 | 0 | 0 | 0 | 0 | 114 | |||||
| 62 | R | 28.2 | Very low | 31.7 | Very low | 232 Ų | 232 | 140 Ų | 140 | 88% | 0.875 | 80% | 0.8 | S | S | * | * | trans | -175 | 108.7 | 133.2 | -95.3 | 151.6 | -158.9 | -112.3 | 2.9 | 108.2 | ||||
| 63 | R | 29.2 | Very low | 31.3 | Very low | 234 Ų | 234 | 138.8 Ų | 138.8 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | 74 | 115.6 | 95.1 | -78.2 | -166.5 | -179.9 | -167.8 | 0.7 | 114.2 | |||||
| 64 | S | 29.3 | Very low | 31 | Very low | 109 Ų | 109 | 143.6 Ų | 143.6 | 76% | 0.762 | 80% | 0.804 | S | S | * | * | trans | -64.1 | 170.1 | 167.9 | -35.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 65 | P | 47.2 | Very low | 30.5 | Very low | 125 Ų | 125 | 147.9 Ų | 147.9 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | -131.6 | 170 | 98.1 | 39.3 | -32.9 | 0 | 0 | 0 | 114.3 | |||||
| 66 | D | 28 | Very low | 30.3 | Very low | 154 Ų | 154 | 150 Ų | 150 | 82% | 0.824 | 82% | 0.815 | S | S | * | * | trans | -75.1 | 153.1 | 175.9 | -49.1 | -94.1 | 0 | 0 | 0 | 113.3 | ||||
| 67 | A | 29.7 | Very low | 29.9 | Very low | 92 Ų | 92 | 147.6 Ų | 147.6 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | 170.9 | 141.8 | 111.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 68 | E | 27.1 | Very low | 29.7 | Very low | 162 Ų | 162 | 149.2 Ų | 149.2 | 76% | 0.757 | 82% | 0.818 | S | S | * | * | trans | 63.4 | 123.2 | 153.4 | -70.9 | -114.3 | 91.2 | 0 | 0 | 122.6 | ||||
| 69 | R | 26.4 | Very low | 29.6 | Very low | 205 Ų | 205 | 148.4 Ų | 148.4 | 77% | 0.774 | 81% | 0.812 | S | S | * | * | trans | 79.2 | 87.2 | 141.7 | -71 | -176.8 | 170.7 | -127.9 | -6.5 | 122.5 | ||||
| 70 | T | 29.7 | Very low | 29.8 | Very low | 120 Ų | 120 | 148.3 Ų | 148.3 | 74% | 0.736 | 81% | 0.811 | S | S | * | * | 79 | 100.1 | 120.8 | -38.3 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 71 | Q | 27.7 | Very low | 29.9 | Very low | 177 Ų | 177 | 149.3 Ų | 149.3 | 83% | 0.827 | 81% | 0.809 | S | S | * | * | -174.7 | 166.2 | 125.3 | -104 | 174.2 | 59.6 | 0 | 0 | 112.6 | |||||
| 72 | L | 26.5 | Very low | 30.1 | Very low | 177 Ų | 177 | 151.3 Ų | 151.3 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | trans | 61.8 | 142.8 | -172.8 | -63.5 | 98.7 | 0 | 0 | 0 | 115.8 | ||||
| 73 | G | 27.3 | Very low | 30.3 | Very low | 61 Ų | 61 | 149.2 Ų | 149.2 | 63% | 0.629 | 81% | 0.811 | S | S | * | * | cis | 163.6 | 178.2 | -6.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 74 | K | 28.2 | Very low | 30.4 | Very low | 212 Ų | 212 | 143.7 Ų | 143.7 | 92% | 0.922 | 80% | 0.804 | S | S | * | * | trans | 73.2 | 136.3 | -178.3 | -48.4 | 167.5 | -176 | 175.2 | 0 | 113.1 | ||||
| 75 | R | 25.8 | Very low | 30.6 | Very low | 246 Ų | 246 | 143.9 Ų | 143.9 | 93% | 0.928 | 80% | 0.803 | S | S | * | * | cis | -125.1 | 133 | 18.2 | -66 | 170.6 | 170.7 | 161.5 | -4.2 | 111.5 | ||||
| 76 | A | 26.8 | Very low | 29.8 | Very low | 101 Ų | 101 | 141.6 Ų | 141.6 | 84% | 0.835 | 79% | 0.79 | S | S | * | * | trans | -78.2 | 149.9 | 158.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 77 | A | 30.9 | Very low | 30.2 | Very low | 91 Ų | 91 | 143.4 Ų | 143.4 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | trans | -92.3 | 150.6 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | S79 | A77-S79 PolarHBondContact O-N 3.3Å; A77-S79 VanDerWaalsContact O-N 3.13Å | ||
| 78 | D | 26.8 | Very low | 30.8 | Very low | 176 Ų | 176 | 141 Ų | 141 | 94% | 0.941 | 76% | 0.764 | S | S | * | * | trans | -65.2 | 110.8 | 172.5 | -68.8 | -63.2 | 0 | 0 | 0 | 110.6 | ||||
| 79 | S | 31.8 | Very low | 31.1 | Very low | 110 Ų | 110 | 138.4 Ų | 138.4 | 77% | 0.769 | 76% | 0.762 | S | S | * | * | trans | -108.3 | 114.2 | 159.9 | 46.8 | 0 | 0 | 0 | 0 | 108.5 | A77 | A77-S79 PolarHBondContact O-N 3.3Å; A77-S79 VanDerWaalsContact O-N 3.13Å | ||
| 80 | S | 34.8 | Very low | 31.8 | Very low | 111 Ų | 111 | 134.7 Ų | 134.7 | 78% | 0.776 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 139.7 | 173.1 | 43.2 | 0 | 0 | 0 | 0 | 110.1 | I82 | S80-I82 PolarHBondContact O-N 3.29Š|
| 81 | P | 33.7 | Very low | 32.9 | Very low | 120 Ų | 120 | 138 Ų | 138 | 78% | 0.779 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 130.6 | -171.8 | 26.8 | -34.1 | 0 | 0 | 0 | 111.2 | K83 | P81-K83 PolarHBondContact O-N 3.37Å; P81-K83 VanDerWaalsContact O-N 3.17Å |
| 82 | I | 37 | Very low | 33.2 | Very low | 162 Ų | 162 | 138.6 Ų | 138.6 | 83% | 0.831 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 119.4 | 163.1 | -63.7 | 169.2 | 0 | 0 | 0 | 107.1 | S80 T84 | S80-I82 PolarHBondContact O-N 3.29Å; I82-T84 PolarHBondContact O-N 3.28Å; I82-T84 VanDerWaalsContact O-N 3.17Å |
| 83 | K | 33.4 | Very low | 34 | Very low | 188 Ų | 188 | 135.3 Ų | 135.3 | 82% | 0.817 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 120.9 | 174.4 | -74.9 | 178.8 | 180 | 171.2 | 0 | 108.5 | P81 | P81-K83 PolarHBondContact O-N 3.37Å; P81-K83 VanDerWaalsContact O-N 3.17Å |
| 84 | T | 30.7 | Very low | 34.1 | Very low | 118 Ų | 118 | 138.1 Ų | 138.1 | 72% | 0.724 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 148.6 | 167 | 44.6 | 0 | 0 | 0 | 0 | 109.6 | I82 S86 | I82-T84 PolarHBondContact O-N 3.28Å; I82-T84 VanDerWaalsContact O-N 3.17Å; T84-S86 PolarHBondContact O-N 3.12Å; T84-S86 VanDerWaalsContact O-N 3.16Å |
| 85 | P | 32.6 | Very low | 34.4 | Very low | 113 Ų | 113 | 134.8 Ų | 134.8 | 73% | 0.734 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 124 | 175.6 | 24.4 | -33.4 | 0 | 0 | 0 | 108.9 | K87 | P85-K87 VanDerWaalsContact C-N 3.32Å; P85-K87 PolarHBondContact O-N 3.05Å |
| 86 | S | 31.9 | Very low | 34.3 | Very low | 77 Ų | 77 | 131.4 Ų | 131.4 | 54% | 0.538 | 71% | 0.711 | S | S | . | * | trans | -69.1 | 88.9 | -176.1 | 45.5 | 0 | 0 | 0 | 0 | 109.9 | T84 L88 | T84-S86 PolarHBondContact O-N 3.12Å; T84-S86 VanDerWaalsContact O-N 3.16Å; S86-L88 VanDerWaalsContact C-N 3.31Å; S86-L88 PolarHBondContact O-N 2.88Å | ||
| 87 | K | 34.6 | Very low | 34.6 | Very low | 192 Ų | 192 | 132.6 Ų | 132.6 | 84% | 0.835 | 71% | 0.708 | S | S | * | * | trans | -61.9 | 92.5 | 175.8 | -169.2 | 176.1 | -173.4 | 177.2 | 0 | 109 | P85 | P85-K87 VanDerWaalsContact C-N 3.32Å; P85-K87 PolarHBondContact O-N 3.05Å | ||
| 88 | L | 42.1 | Very low | 34.3 | Very low | 41 Ų | 41 | 136.3 Ų | 136.3 | 22% | 0.215 | 71% | 0.709 | C | S | . | * | trans | -50.3 | 141.8 | 177.2 | -73 | 170.1 | 0 | 0 | 0 | 109.5 | S86 F90 I255 | S86-L88 VanDerWaalsContact C-N 3.31Å; S86-L88 PolarHBondContact O-N 2.88Å; L88-F90 VanDerWaalsContact C-N 3.29Å; L88-F90 WeakPolarHBondContact O-CD2 3.16Å; L88-F90 PolarHBondContact O-N 3.36Å; L88-I255 HydrophobicContact CD1-CG2 3.98Å | ||
| 89 | P | 34.2 | Very low | 34.6 | Very low | 109 Ų | 109 | 133.1 Ų | 133.1 | 71% | 0.708 | 70% | 0.698 | S | S | * | * | trans | -71 | 88.5 | -179.2 | 29.7 | -34.3 | 0 | 0 | 0 | 109.4 | R91 | P89-R91 PolarHBondContact O-N 3.48Š| ||
| 90 | F | 42.1 | Very low | 34.5 | Very low | 127 Ų | 127 | 136.4 Ų | 136.4 | 56% | 0.557 | 70% | 0.701 | S | S | * | * | trans | -62 | 77.2 | 170.3 | -79.6 | -82.9 | 0 | 0 | 0 | 110.3 | L88 K92 T256 | L88-F90 VanDerWaalsContact C-N 3.29Å; L88-F90 WeakPolarHBondContact O-CD2 3.16Å; L88-F90 PolarHBondContact O-N 3.36Å; F90-K92 PolarHBondContact O-N 3.31Å; F90-T256 HydrophobicContact CE1-CG2 4.39Å | ||
| 91 | R | 51.2 | Low | 34.1 | Very low | 188 Ų | 188 | 137.5 Ų | 137.5 | 71% | 0.709 | 70% | 0.703 | S | S | * | * | trans | -68 | 96.9 | 170.1 | -77.4 | -179.9 | 167 | 173.2 | -4.6 | 107.6 | P89 R93 | P89-R91 PolarHBondContact O-N 3.48Å; R91-R93 PolarHBondContact O-N 3.25Å | ||
| 92 | K | 35.2 | Very low | 33.9 | Very low | 191 Ų | 191 | 140 Ų | 140 | 83% | 0.83 | 70% | 0.704 | S | S | * | * | trans | -62 | 85.6 | 168.1 | -69.7 | -172.7 | 175.6 | -171.9 | 0 | 109.7 | F90 T94 | F90-K92 PolarHBondContact O-N 3.31Å; K92-T94 PolarHBondContact O-N 3.01Å | ||
| 93 | R | 42.8 | Very low | 33.4 | Very low | 107 Ų | 107 | 141.5 Ų | 141.5 | 40% | 0.404 | 71% | 0.705 | S | S | . | * | trans | -72.2 | 74.6 | 157.3 | -71.6 | -173.8 | -177.5 | 151.6 | 3.4 | 107.7 | R91 F95 D206 D208 Q219 | R91-R93 PolarHBondContact O-N 3.25Å; R93-F95 PolarHBondContact O-N 2.8Å; R93-D206 IonicContact CZ-OD2 2.68Å; R93-D206 IonicContact NH1-OD2 3.94Å; R93-D206 PolarHBondContact NH1-OD2 2.9Å; R93-D206 IonicContact NH2-OD2 3.53Å; R93-D208 IonicContact CZ-OD2 3.89Å; R93-D208 IonicContact NH1-OD2 2.82Å; R93-D208 IonicContact NH2-OD2 3.56Å; R93-D208 PolarHBondContact NH2-OD2 3.42Å; R93-Q219 PolarHBondContact O-NE2 3.22Å | ||
| 94 | T | 28.6 | Very low | 33.5 | Very low | 120 Ų | 120 | 138.1 Ų | 138.1 | 74% | 0.736 | 70% | 0.702 | S | S | * | * | trans | -66.6 | 106.9 | 161.2 | 23.4 | 0 | 0 | 0 | 0 | 107.3 | K92 H96 | K92-T94 PolarHBondContact O-N 3.01Å; T94-H96 PolarHBondContact O-N 3.06Å | ||
| 95 | F | 35.1 | Very low | 33.2 | Very low | 142 Ų | 142 | 137.5 Ų | 137.5 | 62% | 0.623 | 71% | 0.709 | S | S | * | * | trans | -68.5 | 120.6 | 166.6 | -70.5 | -82.4 | 0 | 0 | 0 | 108.2 | R93 V97 I215 Q219 | R93-F95 PolarHBondContact O-N 2.8Å; F95-V97 PolarHBondContact O-N 2.94Å; F95-I215 HydrophobicContact CE2-CG2 4.11Å; F95-Q219 VanDerWaalsContact CD2-NE2 3.31Å | ||
| 96 | H | 24 | Very low | 32.9 | Very low | 176 Ų | 176 | 136.7 Ų | 136.7 | 82% | 0.815 | 71% | 0.712 | S | S | * | * | trans | -70.3 | 109.4 | 164.7 | -117.6 | -75 | 0 | 0 | 0 | 107.4 | T94 E98 | T94-H96 PolarHBondContact O-N 3.06Å; H96-E98 PolarHBondContact O-N 3.2Å | ||
| 97 | V | 32.8 | Very low | 33.4 | Very low | 126 Ų | 126 | 138.4 Ų | 138.4 | 76% | 0.764 | 72% | 0.721 | S | S | * | * | trans | -73.3 | 105.5 | 155.6 | 179.2 | 0 | 0 | 0 | 0 | 105.3 | F95 P99 | F95-V97 PolarHBondContact O-N 2.94Å; V97-P99 WeakPolarHBondContact O-CD 3.33Å | ||
| 98 | E | 25.8 | Very low | 33 | Very low | 168 Ų | 168 | 135.9 Ų | 135.9 | 79% | 0.785 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -69 | 126.6 | 165.2 | -72.8 | -160.6 | 129.8 | 0 | 0 | 108.6 | H96 | H96-E98 PolarHBondContact O-N 3.2Š|
| 99 | P | 31.7 | Very low | 32.3 | Very low | 110 Ų | 110 | 138.4 Ų | 138.4 | 71% | 0.714 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 130.3 | 165.3 | 30.2 | -31.5 | 0 | 0 | 0 | 108.7 | V97 V101 | V97-P99 WeakPolarHBondContact O-CD 3.33Å; P99-V101 PolarHBondContact O-N 3.15Å |
| 100 | E | 29.6 | Very low | 32 | Very low | 178 Ų | 178 | 139.6 Ų | 139.6 | 83% | 0.832 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 126.8 | 178.5 | -78.9 | -167.3 | 115.7 | 0 | 0 | 111.7 | Q102 | E100-Q102 PolarHBondContact O-N 3.23Š|
| 101 | V | 28.1 | Very low | 31.3 | Very low | 135 Ų | 135 | 138.1 Ų | 138.1 | 82% | 0.818 | 76% | 0.759 | S | S | * | * | trans | -83.5 | 106.8 | 176.2 | 178.7 | 0 | 0 | 0 | 0 | 109.4 | P99 | P99-V101 PolarHBondContact O-N 3.15Š| ||
| 102 | Q | 29.3 | Very low | 30.2 | Very low | 172 Ų | 172 | 134.7 Ų | 134.7 | 80% | 0.804 | 76% | 0.764 | S | S | * | * | trans | -112.8 | 140 | 159.9 | -63.7 | -167.2 | 12.6 | 0 | 0 | 110.6 | E100 | E100-Q102 PolarHBondContact O-N 3.23Š| ||
| 103 | K | 25.7 | Very low | 29.9 | Very low | 193 Ų | 193 | 130.8 Ų | 130.8 | 84% | 0.839 | 76% | 0.761 | S | S | * | * | trans | -141.1 | 161.9 | -173.3 | -120.5 | -162.5 | 173.6 | 179.6 | 0 | 109.1 | ||||
| 104 | P | 35.8 | Very low | 29.6 | Very low | 117 Ų | 117 | 131.5 Ų | 131.5 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | -129.9 | 167.6 | -101.3 | 39.2 | -24.7 | 0 | 0 | 0 | 114.8 | |||||
| 105 | A | 23.8 | Very low | 29.3 | Very low | 106 Ų | 106 | 131.7 Ų | 131.7 | 88% | 0.876 | 79% | 0.785 | S | S | * | * | trans | -146.1 | 156.8 | 158.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 106 | A | 25.7 | Very low | 28.9 | Very low | 96 Ų | 96 | 131 Ų | 131 | 79% | 0.793 | 80% | 0.797 | S | S | * | * | trans | -158.3 | -168.1 | -175.8 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 107 | P | 44 | Very low | 29 | Very low | 112 Ų | 112 | 127.9 Ų | 127.9 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | cis | -134 | 174.5 | -12.9 | 41.7 | -26.4 | 0 | 0 | 0 | 114.4 | ||||
| 108 | T | 25.4 | Very low | 29.3 | Very low | 139 Ų | 139 | 127.5 Ų | 127.5 | 85% | 0.853 | 80% | 0.795 | S | S | * | * | trans | 167.5 | 149.8 | 143.6 | 26.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 109 | S | 27.3 | Very low | 29.2 | Very low | 95 Ų | 95 | 124 Ų | 124 | 66% | 0.664 | 80% | 0.795 | S | S | * | * | cis | -165.2 | 163.4 | -25.5 | 44.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 110 | V | 28.9 | Very low | 29 | Very low | 134 Ų | 134 | 128 Ų | 128 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | trans | 49.3 | 113.9 | 169.7 | -72.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 111 | A | 26.7 | Very low | 28.9 | Very low | 95 Ų | 95 | 127.8 Ų | 127.8 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | 70.9 | 137.5 | 76.3 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 112 | S | 28.6 | Very low | 28.9 | Very low | 117 Ų | 117 | 128.1 Ų | 128.1 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | cis | -153.4 | 157.3 | 5.3 | 50.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 113 | S | 27.7 | Very low | 28.7 | Very low | 109 Ų | 109 | 128.3 Ų | 128.3 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | trans | -85.8 | 178.9 | 168.4 | 70.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 114 | P | 36.5 | Very low | 28.7 | Very low | 122 Ų | 122 | 124.7 Ų | 124.7 | 79% | 0.792 | 79% | 0.788 | S | S | * | * | cis | -140.8 | -175.1 | 38.8 | 42.3 | -21.3 | 0 | 0 | 0 | 117.7 | ||||
| 115 | C | 23.8 | Very low | 28.2 | Very low | 124 Ų | 124 | 129.8 Ų | 129.8 | 84% | 0.838 | 79% | 0.792 | S | S | * | * | trans | -69 | 157.9 | -172.3 | -45.5 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 116 | S | 25.6 | Very low | 28.4 | Very low | 126 Ų | 126 | 134.1 Ų | 134.1 | 88% | 0.881 | 79% | 0.791 | S | S | * | * | -161.6 | 150.2 | 128.9 | 41.2 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 117 | S | 26.2 | Very low | 28.4 | Very low | 112 Ų | 112 | 135.1 Ų | 135.1 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | -145.7 | 152.3 | 164.6 | 67.3 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 118 | P | 38.2 | Very low | 27.6 | Very low | 118 Ų | 118 | 134.8 Ų | 134.8 | 77% | 0.766 | 80% | 0.799 | S | S | * | * | -153.2 | -170.3 | 74.4 | 41.5 | -21.5 | 0 | 0 | 0 | 115.7 | |||||
| 119 | A | 25.1 | Very low | 27.6 | Very low | 95 Ų | 95 | 132.3 Ų | 132.3 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | trans | 71.6 | 158.4 | 165.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 120 | E | 27.7 | Very low | 27.6 | Very low | 194 Ų | 194 | 132.8 Ų | 132.8 | 91% | 0.907 | 80% | 0.796 | S | S | * | * | cis | -127.3 | 171.9 | 6.5 | -74.5 | -174.7 | 122.9 | 0 | 0 | 113.5 | ||||
| 121 | E | 27.1 | Very low | 27.6 | Very low | 172 Ų | 172 | 134 Ų | 134 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -94.2 | 148.5 | 166.2 | -60.4 | -175.9 | 127.8 | 0 | 0 | 112.2 | ||||
| 122 | Q | 28.3 | Very low | 27.7 | Very low | 142 Ų | 142 | 136.1 Ų | 136.1 | 66% | 0.664 | 79% | 0.79 | S | S | * | * | 150 | 115.9 | 120.5 | -80.3 | -158.3 | 30.3 | 0 | 0 | 116.7 | |||||
| 123 | K | 25.3 | Very low | 27.7 | Very low | 176 Ų | 176 | 137.3 Ų | 137.3 | 77% | 0.765 | 78% | 0.782 | S | S | * | * | 83 | 156.8 | 120 | -158.6 | -166.9 | -153.5 | 158 | 0 | 120.9 | |||||
| 124 | V | 25.2 | Very low | 27.8 | Very low | 118 Ų | 118 | 140.2 Ų | 140.2 | 72% | 0.715 | 78% | 0.777 | S | S | * | * | trans | 92.2 | 81.6 | 163.4 | -161.4 | 0 | 0 | 0 | 0 | 120 | ||||
| 125 | R | 25.9 | Very low | 27.5 | Very low | 223 Ų | 223 | 141.6 Ų | 141.6 | 84% | 0.842 | 77% | 0.773 | S | S | * | * | 48.7 | 122 | 121.9 | -65.5 | 178.2 | 173.6 | 171.6 | -1.9 | 123.3 | |||||
| 126 | K | 26.8 | Very low | 27.8 | Very low | 198 Ų | 198 | 140 Ų | 140 | 86% | 0.861 | 77% | 0.768 | S | S | * | * | 68.8 | 114.2 | 125.6 | -67.4 | -170.4 | 172 | -167.1 | 0 | 122.5 | |||||
| 127 | S | 26.2 | Very low | 28 | Very low | 117 Ų | 117 | 141.3 Ų | 141.3 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | -142.4 | 154.2 | 121.8 | 58.2 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 128 | A | 26.3 | Very low | 28.3 | Very low | 104 Ų | 104 | 143.2 Ų | 143.2 | 86% | 0.86 | 76% | 0.762 | S | S | * | * | cis | 106.4 | 82.7 | 3.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 129 | A | 26.9 | Very low | 27.9 | Very low | 88 Ų | 88 | 142.7 Ų | 142.7 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -166.3 | 121.6 | 155.2 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 130 | S | 27.5 | Very low | 28.1 | Very low | 104 Ų | 104 | 147.6 Ų | 147.6 | 73% | 0.727 | 76% | 0.759 | S | S | * | * | 70.7 | 139.3 | 64.1 | 78.8 | 0 | 0 | 0 | 0 | 113 | |||||
| 131 | H | 27.6 | Very low | 28.1 | Very low | 159 Ų | 159 | 147.1 Ų | 147.1 | 74% | 0.736 | 76% | 0.755 | S | S | * | * | cis | -158.1 | 156.8 | 25.9 | -121.5 | -77.6 | 0 | 0 | 0 | 112.7 | ||||
| 132 | L | 30 | Very low | 28 | Very low | 141 Ų | 141 | 143.1 Ų | 143.1 | 74% | 0.738 | 75% | 0.751 | S | S | * | * | trans | 65.7 | 144 | 158.1 | -59.4 | 159.1 | 0 | 0 | 0 | 117.5 | ||||
| 133 | E | 28 | Very low | 28 | Very low | 141 Ų | 141 | 143.6 Ų | 143.6 | 66% | 0.659 | 76% | 0.763 | S | S | * | * | cis | 74.5 | 139.8 | 31 | -60.5 | -159.3 | 178.3 | 0 | 0 | 114.7 | ||||
| 134 | R | 29.2 | Very low | 28 | Very low | 170 Ų | 170 | 139.3 Ų | 139.3 | 64% | 0.642 | 76% | 0.761 | S | S | * | * | cis | -163.9 | 160.7 | 6.5 | -131.7 | 176.1 | 162.7 | 106 | 3.3 | 112.2 | ||||
| 135 | E | 29.7 | Very low | 29.5 | Very low | 151 Ų | 151 | 139.3 Ų | 139.3 | 71% | 0.706 | 76% | 0.763 | S | S | * | * | trans | 48.1 | 131.4 | 148.7 | -76.3 | 153.5 | -146.8 | 0 | 0 | 121.1 | ||||
| 136 | A | 31.3 | Very low | 29.5 | Very low | 91 Ų | 91 | 135.6 Ų | 135.6 | 75% | 0.752 | 77% | 0.765 | S | S | * | * | 86.8 | 152.7 | 68.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 137 | D | 29.5 | Very low | 29.6 | Very low | 154 Ų | 154 | 132 Ų | 132 | 82% | 0.824 | 76% | 0.76 | S | S | * | * | cis | -160.7 | -176.8 | 1.2 | -149.6 | -22.3 | 0 | 0 | 0 | 112.1 | ||||
| 138 | E | 32.4 | Very low | 29.7 | Very low | 151 Ų | 151 | 135.1 Ų | 135.1 | 71% | 0.706 | 76% | 0.761 | S | S | * | * | trans | 79.3 | 140.6 | 148.8 | -78.2 | -144.8 | 117.9 | 0 | 0 | 125.9 | ||||
| 139 | S | 29.9 | Very low | 29.7 | Very low | 107 Ų | 107 | 140.1 Ų | 140.1 | 75% | 0.748 | 76% | 0.758 | S | S | * | * | trans | 84.1 | 155.9 | 143.9 | 80.1 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 140 | R | 28.7 | Very low | 29.6 | Very low | 198 Ų | 198 | 146.7 Ų | 146.7 | 75% | 0.747 | 76% | 0.764 | S | S | * | * | -167.7 | 165.7 | -50.4 | -130.7 | -177.7 | -169.3 | 171.2 | 6.8 | 110.7 | |||||
| 141 | F | 27.5 | Very low | 29.5 | Very low | 184 Ų | 184 | 146.3 Ų | 146.3 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | trans | 66.3 | 136.5 | 176.6 | -54.8 | -81.3 | 0 | 0 | 0 | 115.9 | ||||
| 142 | A | 26.3 | Very low | 29.5 | Very low | 89 Ų | 89 | 146.4 Ų | 146.4 | 74% | 0.736 | 76% | 0.758 | S | S | * | * | cis | 97 | 122.5 | 15.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 143 | V | 28.6 | Very low | 29.4 | Very low | 151 Ų | 151 | 148.6 Ų | 148.6 | 92% | 0.915 | 77% | 0.765 | S | S | * | * | trans | 178.3 | 156.9 | 147 | 144.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 144 | A | 25.6 | Very low | 29.2 | Very low | 87 Ų | 87 | 146.8 Ų | 146.8 | 72% | 0.719 | 77% | 0.774 | S | S | * | * | trans | -129.8 | -142.8 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 145 | P | 54.9 | Low | 29.1 | Very low | 117 Ų | 117 | 142.9 Ų | 142.9 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | -123 | 169.7 | -101.8 | 38.8 | -24.1 | 0 | 0 | 0 | 115.5 | |||||
| 146 | V | 27.5 | Very low | 29 | Very low | 146 Ų | 146 | 145.1 Ų | 145.1 | 89% | 0.885 | 79% | 0.788 | S | S | * | * | trans | -137.8 | 150 | 168.3 | -174.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 147 | T | 27.9 | Very low | 28.9 | Very low | 121 Ų | 121 | 146 Ų | 146 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | trans | -131.2 | 153.3 | -176.4 | 58.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 148 | H | 28.2 | Very low | 29.4 | Very low | 184 Ų | 184 | 143.9 Ų | 143.9 | 85% | 0.852 | 78% | 0.783 | S | S | * | * | trans | -170.4 | 167.9 | 158.7 | -108.9 | -83.7 | 0 | 0 | 0 | 110.6 | ||||
| 149 | R | 26.2 | Very low | 29.4 | Very low | 208 Ų | 208 | 146 Ų | 146 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | -166.8 | 119.3 | -81.1 | 178.8 | -172.3 | -163.2 | -163.5 | 7.6 | 110.3 | |||||
| 150 | R | 25 | Very low | 29.2 | Very low | 226 Ų | 226 | 145.6 Ų | 145.6 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | trans | 65.4 | 165.5 | 172.1 | -84.5 | -179.5 | 170.8 | -178.1 | -3.6 | 115.6 | ||||
| 151 | T | 26.1 | Very low | 29.4 | Very low | 96 Ų | 96 | 147.6 Ų | 147.6 | 59% | 0.589 | 81% | 0.806 | S | S | * | * | cis | -151.5 | 167.6 | 17.5 | -21 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 152 | E | 27.3 | Very low | 29.3 | Very low | 161 Ų | 161 | 143.9 Ų | 143.9 | 75% | 0.752 | 80% | 0.803 | S | S | * | * | trans | 41.1 | 118.7 | 152.2 | -80.9 | 130 | -136.9 | 0 | 0 | 121.7 | ||||
| 153 | Q | 27.5 | Very low | 29.5 | Very low | 188 Ų | 188 | 145.2 Ų | 145.2 | 88% | 0.879 | 81% | 0.805 | S | S | * | * | 78.1 | 109.9 | 74.8 | -80.2 | -165 | -5.3 | 0 | 0 | 116.6 | |||||
| 154 | A | 24 | Very low | 29.5 | Very low | 103 Ų | 103 | 143.1 Ų | 143.1 | 85% | 0.851 | 80% | 0.796 | S | S | * | * | 173 | 158.9 | 127.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 155 | A | 26.9 | Very low | 29.8 | Very low | 88 Ų | 88 | 146.8 Ų | 146.8 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | trans | 57.9 | 99.7 | 151.8 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 156 | Q | 28.7 | Very low | 28.7 | Very low | 198 Ų | 198 | 149.5 Ų | 149.5 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | 57.7 | 147.5 | 119.7 | -66.9 | 170.9 | -6.3 | 0 | 0 | 122.9 | |||||
| 157 | S | 27.3 | Very low | 28.9 | Very low | 109 Ų | 109 | 148 Ų | 148 | 76% | 0.762 | 80% | 0.796 | S | S | * | * | trans | -88.3 | 178.6 | -171.9 | 57.4 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 158 | P | 40.8 | Very low | 29.2 | Very low | 109 Ų | 109 | 150 Ų | 150 | 71% | 0.708 | 80% | 0.8 | S | S | * | * | cis | -132.3 | -172.9 | -0.2 | 32.5 | -9.7 | 0 | 0 | 0 | 115.2 | ||||
| 159 | E | 32.5 | Very low | 29.3 | Very low | 195 Ų | 195 | 148.6 Ų | 148.6 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | 47.2 | 88.1 | 155.3 | -73.4 | 179.7 | -157.1 | 0 | 0 | 120.1 | ||||
| 160 | A | 26.7 | Very low | 29.6 | Very low | 99 Ų | 99 | 144.8 Ų | 144.8 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -150.7 | 127.3 | 149.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | S162 | A160-S162 PolarHBondContact O-N 3.26Š| ||
| 161 | Y | 32.7 | Very low | 29.9 | Very low | 240 Ų | 240 | 145.2 Ų | 145.2 | 94% | 0.941 | 80% | 0.795 | S | S | * | * | trans | -79.3 | 102.7 | 172.3 | -75.9 | -90.4 | 0 | 0 | 0 | 110.2 | C163 | Y161-C163 PolarHBondContact O-N 3.26Š| ||
| 162 | S | 25.3 | Very low | 30.1 | Very low | 107 Ų | 107 | 143 Ų | 143 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | trans | -86.9 | 98.5 | 176.9 | -173.8 | 0 | 0 | 0 | 0 | 111.6 | A160 C164 | A160-S162 PolarHBondContact O-N 3.26Å; S162-C164 PolarHBondContact O-N 3.38Å | ||
| 163 | C | 29.5 | Very low | 30.3 | Very low | 117 Ų | 117 | 144.6 Ų | 144.6 | 79% | 0.791 | 80% | 0.799 | S | S | * | * | trans | -68.7 | 115.4 | 169.4 | -73.3 | 0 | 0 | 0 | 0 | 110.4 | Y161 I165 | Y161-C163 PolarHBondContact O-N 3.26Å; C163-I165 PolarHBondContact O-N 2.82Å | ||
| 164 | C | 28.9 | Very low | 30.2 | Very low | 106 Ų | 106 | 146.2 Ų | 146.2 | 72% | 0.716 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 119.1 | 177.7 | -67.1 | 0 | 0 | 0 | 0 | 110.9 | S162 | S162-C164 PolarHBondContact O-N 3.38Š|
| 165 | I | 32.2 | Very low | 30.9 | Very low | 164 Ų | 164 | 146.4 Ų | 146.4 | 84% | 0.841 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 121.2 | 172.9 | -59.9 | 172 | 0 | 0 | 0 | 108.5 | C163 | C163-I165 PolarHBondContact O-N 2.82Š|
| 166 | F | 32.4 | Very low | 31 | Very low | 175 Ų | 175 | 149.4 Ų | 149.4 | 77% | 0.768 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 137.7 | 165 | -73.4 | -80.3 | 0 | 0 | 0 | 110 | ||
| 167 | P | 30.4 | Very low | 31 | Very low | 115 Ų | 115 | 145.3 Ų | 145.3 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 130.9 | -179 | 30.9 | -33.8 | 0 | 0 | 0 | 111.6 | ||
| 168 | I | 33.8 | Very low | 31.3 | Very low | 163 Ų | 163 | 148.6 Ų | 148.6 | 84% | 0.836 | 80% | 0.8 | S | S | * | * | trans | -96.7 | 112.4 | 165.5 | -60.9 | 176.7 | 0 | 0 | 0 | 107.7 | ||||
| 169 | I | 32.1 | Very low | 30.7 | Very low | 154 Ų | 154 | 148.6 Ų | 148.6 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | trans | -78 | 135.5 | 170.4 | -63.1 | 175.9 | 0 | 0 | 0 | 108.2 | ||||
| 170 | N | 32 | Very low | 30.7 | Very low | 128 Ų | 128 | 145.5 Ų | 145.5 | 68% | 0.684 | 80% | 0.795 | S | S | * | * | trans | -123.9 | 119.9 | -170.1 | -179.7 | 14.8 | 0 | 0 | 0 | 112.3 | ||||
| 171 | Y | 30.9 | Very low | 30.7 | Very low | 234 Ų | 234 | 149.9 Ų | 149.9 | 92% | 0.918 | 80% | 0.796 | S | S | * | * | trans | -152.7 | 116 | 157.4 | -79.7 | -80.2 | 0 | 0 | 0 | 107.4 | ||||
| 172 | G | 29.8 | Very low | 30.7 | Very low | 51 Ų | 51 | 143.3 Ų | 143.3 | 53% | 0.526 | 78% | 0.783 | S | S | . | * | cis | 155.4 | 136.4 | -13.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 173 | H | 31.1 | Very low | 31.2 | Very low | 193 Ų | 193 | 146.4 Ų | 146.4 | 89% | 0.894 | 79% | 0.785 | S | S | * | * | trans | -173.2 | 163 | 153.8 | -102.9 | -67.7 | 0 | 0 | 0 | 112.1 | ||||
| 174 | Y | 27 | Very low | 31.8 | Very low | 223 Ų | 223 | 146.9 Ų | 146.9 | 88% | 0.875 | 79% | 0.787 | S | S | * | * | trans | -37.8 | 174.4 | 178.1 | -54.2 | -130.8 | 0 | 0 | 0 | 119.1 | ||||
| 175 | P | 38.4 | Very low | 32 | Very low | 107 Ų | 107 | 150 Ų | 150 | 70% | 0.695 | 79% | 0.791 | S | S | * | * | -130.4 | 156.7 | -114.3 | 39.8 | -23.7 | 0 | 0 | 0 | 116.7 | |||||
| 176 | V | 29 | Very low | 32.6 | Very low | 151 Ų | 151 | 147.4 Ų | 147.4 | 92% | 0.915 | 78% | 0.779 | S | S | * | * | trans | -141.6 | 149.1 | 162 | -172.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 177 | C | 27.4 | Very low | 33 | Very low | 112 Ų | 112 | 143 Ų | 143 | 76% | 0.757 | 77% | 0.768 | S | S | * | * | trans | -52 | 148.1 | -172.9 | -70.9 | 0 | 0 | 0 | 0 | 117 | ||||
| 178 | L | 34.2 | Very low | 33.7 | Very low | 177 Ų | 177 | 146.4 Ų | 146.4 | 93% | 0.927 | 77% | 0.766 | S | S | * | * | trans | -64.6 | 124.9 | 150.3 | -78.4 | 160.2 | 0 | 0 | 0 | 110.1 | ||||
| 179 | T | 28.4 | Very low | 34.1 | Very low | 110 Ų | 110 | 142.8 Ų | 142.8 | 68% | 0.675 | 75% | 0.751 | S | S | * | * | trans | -127.7 | 137.7 | 152.6 | 52.4 | 0 | 0 | 0 | 0 | 108.1 | F181 | T179-F181 PolarHBondContact O-N 3.28Å; T179-F181 VanDerWaalsContact O-N 3.12Å | ||
| 180 | P | 31.5 | Very low | 34.8 | Very low | 130 Ų | 130 | 142 Ų | 142 | 84% | 0.844 | 74% | 0.744 | S | S | * | * | trans | -74.4 | 107.9 | -173.9 | 28.8 | -33.4 | 0 | 0 | 0 | 110.3 | ||||
| 181 | F | 26.9 | Very low | 35.7 | Very low | 191 Ų | 191 | 142.5 Ų | 142.5 | 84% | 0.838 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 142.8 | 163.3 | -116.7 | -99.8 | 0 | 0 | 0 | 109.5 | T179 | T179-F181 PolarHBondContact O-N 3.28Å; T179-F181 VanDerWaalsContact O-N 3.12Å |
| 182 | P | 33.5 | Very low | 37 | Very low | 102 Ų | 102 | 135.3 Ų | 135.3 | 66% | 0.662 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -63 | 149.1 | -174.4 | -21.3 | 33 | 0 | 0 | 0 | 112.4 | ||
| 183 | E | 36.2 | Very low | 38.4 | Very low | 171 Ų | 171 | 136.5 Ų | 136.5 | 80% | 0.799 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 139.6 | 168.2 | -60.6 | -174.1 | 142.6 | 0 | 0 | 110.2 | H185 | E183-H185 PolarHBondContact O-N 3.17Š|
| 184 | P | 40.8 | Very low | 40.3 | Very low | 127 Ų | 127 | 133 Ų | 133 | 83% | 0.825 | 71% | 0.705 | S | S | * | * | trans | -67.2 | 98.9 | 172.1 | 27.8 | -32.8 | 0 | 0 | 0 | 109 | N186 | P184-N186 PolarHBondContact O-N 3.42Š| ||
| 185 | H | 33.3 | Very low | 42.6 | Very low | 173 Ų | 173 | 124.9 Ų | 124.9 | 80% | 0.801 | 68% | 0.676 | S | S | * | * | trans | -43.1 | 114 | -178.5 | -74.7 | -65.3 | 0 | 0 | 0 | 111.6 | E183 P187 | E183-H185 PolarHBondContact O-N 3.17Å; H185-P187 WeakPolarHBondContact O-CD 3.16Å | ||
| 186 | N | 45.7 | Very low | 44.3 | Very low | 109 Ų | 109 | 125.9 Ų | 125.9 | 58% | 0.583 | 67% | 0.673 | S | S | * | * | trans | -75.7 | 107.1 | -169.4 | -179.9 | 22 | 0 | 0 | 0 | 111.9 | P184 R188 | P184-N186 PolarHBondContact O-N 3.42Å; N186-R188 VanDerWaalsContact C-N 3.31Å; N186-R188 PolarHBondContact O-N 2.98Å; N186-R188 VanDerWaalsContact OD1-CB 3.23Å; N186-R188 WeakPolarHBondContact OD1-CB 3.23Å; N186-R188 WeakPolarHBondContact OD1-CD 3.5Å; N186-R188 WeakPolarHBondContact OD1-CG 3.48Å; N186-R188 PolarHBondContact OD1-N 3.3Å | ||
| 187 | P | 41.3 | Very low | 46.8 | Very low | 83 Ų | 83 | 122.3 Ų | 122.3 | 54% | 0.539 | 65% | 0.652 | S | S | . | * | trans | -93 | 9.4 | -177.5 | 37.5 | -28.4 | 0 | 0 | 0 | 112.3 | H185 V189 Q191 | H185-P187 WeakPolarHBondContact O-CD 3.16Å; P187-V189 VanDerWaalsContact C-N 3.33Å; P187-V189 PolarHBondContact O-N 2.72Å; P187-Q191 PolarHBondContact O-N 2.89Å | ||
| 188 | R | 43.6 | Very low | 49.2 | Very low | 185 Ų | 185 | 118.1 Ų | 118.1 | 70% | 0.698 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.7 | -26.2 | -163.5 | -74.1 | 176.6 | 169.5 | 153.4 | -2.7 | 114.8 | N186 T192 | N186-R188 VanDerWaalsContact C-N 3.31Å; N186-R188 PolarHBondContact O-N 2.98Å; N186-R188 VanDerWaalsContact OD1-CB 3.23Å; N186-R188 WeakPolarHBondContact OD1-CB 3.23Å; N186-R188 WeakPolarHBondContact OD1-CD 3.5Å; N186-R188 WeakPolarHBondContact OD1-CG 3.48Å; N186-R188 PolarHBondContact OD1-N 3.3Å; R188-T192 WeakPolarHBondContact O-CG2 3.29Å; R188-T192 PolarHBondContact O-N 3.08Å; R188-T192 PolarHBondContact O-OG1 3.24Å |
| 189 | V | 43.7 | Very low | 51.4 | Low | 88 Ų | 88 | 110.3 Ų | 110.3 | 53% | 0.533 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -71.6 | -59.9 | -178.5 | -173.6 | 0 | 0 | 0 | 0 | 110.8 | P187 Q191 T192 D193 | P187-V189 VanDerWaalsContact C-N 3.33Å; P187-V189 PolarHBondContact O-N 2.72Å; V189-Q191 PolarHBondContact O-N 3.02Å; V189-T192 PolarHBondContact O-N 3.39Å; V189-T192 PolarHBondContact O-OG1 3.1Å; V189-D193 VanDerWaalsContact O-CG 3.22Å; V189-D193 PolarHBondContact O-N 2.9Å |
| 190 | H | 45.2 | Very low | 54 | Low | 138 Ų | 138 | 108 Ų | 108 | 64% | 0.639 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.4 | -28.7 | -179.6 | -60 | -41.6 | 0 | 0 | 0 | 113.3 | N194 | H190-N194 VanDerWaalsContact O-CB 3.29Å; H190-N194 WeakPolarHBondContact O-CB 3.4Å; H190-N194 VanDerWaalsContact O-CG 3.24Å; H190-N194 PolarHBondContact O-N 3.19Å; H190-N194 PolarHBondContact O-ND2 3.46Å |
| 191 | Q | 52.6 | Low | 56.6 | Low | 138 Ų | 138 | 106.9 Ų | 106.9 | 65% | 0.645 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -72.3 | -34.3 | 175.5 | -159.4 | 170.5 | 33.4 | 0 | 0 | 112.3 | P187 V189 L195 | P187-Q191 PolarHBondContact O-N 2.89Å; V189-Q191 PolarHBondContact O-N 3.02Å; Q191-L195 VanDerWaalsContact O-CB 3.25Å; Q191-L195 WeakPolarHBondContact O-CB 3.36Å; Q191-L195 PolarHBondContact O-N 3.26Å; Q191-L195 VanDerWaalsContact O-N 3.17Å |
| 192 | T | 56.9 | Low | 59.2 | Low | 82 Ų | 82 | 98 Ų | 98 | 50% | 0.503 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -72.3 | -37.2 | 170.6 | 47.8 | 0 | 0 | 0 | 0 | 112.5 | R188 V189 L195 M196 | R188-T192 WeakPolarHBondContact O-CG2 3.29Å; R188-T192 PolarHBondContact O-N 3.08Å; R188-T192 PolarHBondContact O-OG1 3.24Å; V189-T192 PolarHBondContact O-N 3.39Å; V189-T192 PolarHBondContact O-OG1 3.1Å; T192-L195 PolarHBondContact O-N 3Å; T192-M196 WeakPolarHBondContact O-CB 3.25Å; T192-M196 PolarHBondContact O-N 2.95Å |
| 193 | D | 59.9 | Low | 61.7 | Low | 77 Ų | 77 | 94.7 Ų | 94.7 | 41% | 0.412 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.4 | -45.5 | 179.3 | -60.6 | -26.5 | 0 | 0 | 0 | 111.3 | V189 L195 M196 T197 | V189-D193 VanDerWaalsContact O-CG 3.22Å; V189-D193 PolarHBondContact O-N 2.9Å; D193-L195 VanDerWaalsContact C-N 3.29Å; D193-L195 PolarHBondContact O-N 3.17Å; D193-M196 PolarHBondContact O-N 3.32Å; D193-T197 WeakPolarHBondContact O-CB 3.34Å; D193-T197 WeakPolarHBondContact O-CG2 3.33Å; D193-T197 PolarHBondContact O-N 3.35Å; D193-T197 PolarHBondContact O-OG1 2.89Å |
| 194 | N | 70.4 | Confident | 64.3 | Low | 119 Ų | 119 | 94.3 Ų | 94.3 | 64% | 0.636 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.1 | -33.2 | 174.5 | -73.8 | -20.5 | 0 | 0 | 0 | 112.4 | H190 T197 G198 | H190-N194 VanDerWaalsContact O-CB 3.29Å; H190-N194 WeakPolarHBondContact O-CB 3.4Å; H190-N194 VanDerWaalsContact O-CG 3.24Å; H190-N194 PolarHBondContact O-N 3.19Å; H190-N194 PolarHBondContact O-ND2 3.46Å; N194-T197 WeakPolarHBondContact CA-OG1 3.38Å; N194-T197 PolarHBondContact O-OG1 3.01Å; N194-G198 PolarHBondContact O-N 2.82Å |
| 195 | L | 75.5 | Confident | 66.7 | Low | 52 Ų | 52 | 93 Ų | 93 | 27% | 0.272 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -73.2 | -43.8 | 175.8 | -176.5 | 57.4 | 0 | 0 | 0 | 111.7 | Q191 T192 D193 G198 I199 L231 F234 | Q191-L195 VanDerWaalsContact O-CB 3.25Å; Q191-L195 WeakPolarHBondContact O-CB 3.36Å; Q191-L195 PolarHBondContact O-N 3.26Å; Q191-L195 VanDerWaalsContact O-N 3.17Å; T192-L195 PolarHBondContact O-N 3Å; D193-L195 VanDerWaalsContact C-N 3.29Å; D193-L195 PolarHBondContact O-N 3.17Å; L195-G198 CarbonylContact O-C 3.56Å; L195-G198 PolarHBondContact O-N 2.77Å; L195-I199 HydrophobicContact CD1-CD1 4.2Å; L195-I199 HydrophobicContact CD1-CG1 4.48Å; L195-I199 HydrophobicContact CG-CD1 3.94Å; L195-I199 WeakPolarHBondContact O-CB 3.47Å; L195-I199 WeakPolarHBondContact O-CD1 3.49Å; L195-I199 WeakPolarHBondContact O-CG1 3.22Å; L195-I199 PolarHBondContact O-N 2.87Å; L195-L231 HydrophobicContact CD1-CD2 3.45Å; L195-L231 VanDerWaalsContact CD1-CD2 3.45Å; L195-F234 HydrophobicContact CD2-CD1 3.9Å; L195-F234 HydrophobicContact CD2-CE1 3.49Å; L195-F234 VanDerWaalsContact CD2-CE1 3.49Å; L195-F234 HydrophobicContact CD2-CZ 4.11Å |
| 196 | M | 75.3 | Confident | 69.5 | Low | 128 Ų | 128 | 86.9 Ų | 86.9 | 63% | 0.631 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -70.6 | -37.2 | -179.4 | -167.8 | 61.7 | 174.9 | 0 | 0 | 112.1 | T192 D193 I199 S200 | T192-M196 WeakPolarHBondContact O-CB 3.25Å; T192-M196 PolarHBondContact O-N 2.95Å; D193-M196 PolarHBondContact O-N 3.32Å; M196-I199 PolarHBondContact O-N 3Å; M196-S200 WeakPolarHBondContact O-CB 3.48Å; M196-S200 PolarHBondContact O-N 2.99Å |
| 197 | T | 79.8 | Confident | 71.7 | Confident | 77 Ų | 77 | 90.4 Ų | 90.4 | 47% | 0.472 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -66.4 | -39.8 | 169 | 50.8 | 0 | 0 | 0 | 0 | 111.6 | D193 N194 S200 L201 | D193-T197 WeakPolarHBondContact O-CB 3.34Å; D193-T197 WeakPolarHBondContact O-CG2 3.33Å; D193-T197 PolarHBondContact O-N 3.35Å; D193-T197 PolarHBondContact O-OG1 2.89Å; N194-T197 WeakPolarHBondContact CA-OG1 3.38Å; N194-T197 PolarHBondContact O-OG1 3.01Å; T197-S200 WeakPolarHBondContact O-CB 3.47Å; T197-S200 PolarHBondContact O-N 3.05Å; T197-L201 WeakPolarHBondContact O-CB 3.28Å; T197-L201 WeakPolarHBondContact O-CG 3.43Å; T197-L201 PolarHBondContact O-N 3.27Å |
| 198 | G | 78.7 | Confident | 74 | Confident | 23 Ų | 23 | 89.5 Ų | 89.5 | 24% | 0.237 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -60.3 | -42.5 | 172 | 0 | 0 | 0 | 0 | 0 | 113.6 | N194 L195 L201 A202 | N194-G198 PolarHBondContact O-N 2.82Å; L195-G198 CarbonylContact O-C 3.56Å; L195-G198 PolarHBondContact O-N 2.77Å; G198-L201 PolarHBondContact O-N 2.91Å; G198-A202 WeakPolarHBondContact O-CB 3.48Å; G198-A202 PolarHBondContact O-N 2.85Å |
| 199 | I | 80.4 | Confident | 76.4 | Confident | 13 Ų | 13 | 80.8 Ų | 80.8 | 7% | 0.067 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -64.6 | -43 | 174.1 | -70.2 | 159 | 0 | 0 | 0 | 110.7 | L195 M196 A202 T203 A235 | L195-I199 HydrophobicContact CD1-CD1 4.2Å; L195-I199 HydrophobicContact CD1-CG1 4.48Å; L195-I199 HydrophobicContact CG-CD1 3.94Å; L195-I199 WeakPolarHBondContact O-CB 3.47Å; L195-I199 WeakPolarHBondContact O-CD1 3.49Å; L195-I199 WeakPolarHBondContact O-CG1 3.22Å; L195-I199 PolarHBondContact O-N 2.87Å; M196-I199 PolarHBondContact O-N 3Å; I199-A202 PolarHBondContact O-N 3.22Å; I199-T203 WeakPolarHBondContact O-CB 3.32Å; I199-T203 WeakPolarHBondContact O-CG2 3.4Å; I199-T203 PolarHBondContact O-N 3.13Å; I199-T203 PolarHBondContact O-OG1 3.21Å; I199-A235 HydrophobicContact CB-CB 4.38Å; I199-A235 HydrophobicContact CD1-CB 3.69Å; I199-A235 HydrophobicContact CG1-CB 3.88Å; I199-A235 HydrophobicContact CG2-CB 3.56Å |
| 200 | S | 83.4 | Confident | 78.7 | Confident | 62 Ų | 62 | 78 Ų | 78 | 43% | 0.434 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -59.1 | -48.5 | 174.8 | -176 | 0 | 0 | 0 | 0 | 111 | M196 T197 A202 T203 R204 | M196-S200 WeakPolarHBondContact O-CB 3.48Å; M196-S200 PolarHBondContact O-N 2.99Å; T197-S200 WeakPolarHBondContact O-CB 3.47Å; T197-S200 PolarHBondContact O-N 3.05Å; S200-A202 PolarHBondContact O-N 3.21Å; S200-T203 PolarHBondContact O-N 3.46Å; S200-T203 PolarHBondContact O-OG1 3.49Å; S200-R204 WeakPolarHBondContact O-CB 3.43Å; S200-R204 VanDerWaalsContact O-CG 3.28Å; S200-R204 WeakPolarHBondContact O-CG 3.37Å; S200-R204 PolarHBondContact O-N 3.23Å |
| 201 | L | 85 | Confident | 81.1 | Confident | 106 Ų | 106 | 71.5 Ų | 71.5 | 56% | 0.555 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -63.8 | -36.7 | 176.5 | -70.1 | 169.1 | 0 | 0 | 0 | 113.2 | T197 G198 | T197-L201 WeakPolarHBondContact O-CB 3.28Å; T197-L201 WeakPolarHBondContact O-CG 3.43Å; T197-L201 PolarHBondContact O-N 3.27Å; G198-L201 PolarHBondContact O-N 2.91Å |
| 202 | A | 82.4 | Confident | 83 | Confident | 5 Ų | 5 | 66.5 Ų | 66.5 | 4% | 0.041 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -71.9 | -30.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | G198 I199 S200 L228 | G198-A202 WeakPolarHBondContact O-CB 3.48Å; G198-A202 PolarHBondContact O-N 2.85Å; I199-A202 PolarHBondContact O-N 3.22Å; S200-A202 PolarHBondContact O-N 3.21Å; A202-L228 HydrophobicContact CB-CD2 3.93Å |
| 203 | T | 86.5 | Confident | 84.8 | Confident | 33 Ų | 33 | 62.7 Ų | 62.7 | 20% | 0.202 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -92.3 | -15.9 | 179 | 52.5 | 0 | 0 | 0 | 0 | 114.1 | I199 S200 L232 R237 | I199-T203 WeakPolarHBondContact O-CB 3.32Å; I199-T203 WeakPolarHBondContact O-CG2 3.4Å; I199-T203 PolarHBondContact O-N 3.13Å; I199-T203 PolarHBondContact O-OG1 3.21Å; S200-T203 PolarHBondContact O-N 3.46Å; S200-T203 PolarHBondContact O-OG1 3.49Å; T203-L232 HydrophobicContact CG2-CD2 3.43Å; T203-L232 VanDerWaalsContact CG2-CD2 3.43Å; T203-R237 HydrophobicContact CG2-CG 4.12Å |
| 204 | R | 89.7 | Confident | 86.5 | Confident | 163 Ų | 163 | 59 Ų | 59 | 62% | 0.615 | 31% | 0.311 | S | S | * | . | trans | -60.3 | 139.1 | 170.8 | -86.4 | 173.9 | 66.8 | 177.3 | 2.1 | 110.6 | S200 | S200-R204 WeakPolarHBondContact O-CB 3.43Å; S200-R204 VanDerWaalsContact O-CG 3.28Å; S200-R204 WeakPolarHBondContact O-CG 3.37Å; S200-R204 PolarHBondContact O-N 3.23Å | ||
| 205 | Q | 91.3 | Very high | 87.6 | Confident | 99 Ų | 99 | 55.1 Ų | 55.1 | 46% | 0.463 | 29% | 0.29 | S | S | . | . | B | Isolated β-bridge | trans | -98.1 | 151 | 173 | -61.4 | -179.8 | -89.8 | 0 | 0 | 109.3 | G209 D210 T211 H242 | Q205-G209 PolarHBondContact NE2-O 2.91Å; Q205-D210 WeakPolarHBondContact CA-O 3.33Å; Q205-T211 HydrophobicContact CG-CG2 3.94Å; Q205-H242 PolarHBondContact NE2-O 3.29Å |
| 206 | D | 92.6 | Very high | 88.6 | Confident | 45 Ų | 45 | 52.8 Ų | 52.8 | 24% | 0.241 | 28% | 0.278 | C | S | . | . | trans | -88.9 | -173.4 | 169.3 | 79.4 | -10.7 | 0 | 0 | 0 | 112.1 | R93 D208 G209 D210 | R93-D206 IonicContact CZ-OD2 2.68Å; R93-D206 IonicContact NH1-OD2 3.94Å; R93-D206 PolarHBondContact NH1-OD2 2.9Å; R93-D206 IonicContact NH2-OD2 3.53Å; D206-D208 PolarHBondContact O-N 3.01Å; D206-D208 WeakPolarHBondContact OD1-CA 3.44Å; D206-D208 WeakPolarHBondContact OD1-CB 3.45Å; D206-D208 PolarHBondContact OD1-N 3.31Å; D206-G209 WeakPolarHBondContact O-CA 3.33Å; D206-G209 PolarHBondContact O-N 3.27Å; D206-G209 PolarHBondContact OD1-N 3.32Å; D206-G209 VanDerWaalsContact OD1-N 3.15Å; D206-D210 PolarHBondContact N-O 2.94Å; D206-D210 PolarHBondContact OD1-N 2.89Å | ||
| 207 | E | 92.1 | Very high | 89.6 | Confident | 182 Ų | 182 | 46.7 Ų | 46.7 | 85% | 0.85 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -27 | 179.3 | -48.4 | -58.3 | 136.5 | 0 | 0 | 113.4 | G209 N244 | E207-G209 VanDerWaalsContact C-N 3.27Å; E207-N244 PolarHBondContact O-ND2 2.9Å |
| 208 | D | 89.9 | Confident | 90.3 | Very high | 64 Ų | 64 | 45.8 Ų | 45.8 | 34% | 0.342 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | -1.1 | 175.5 | -63.5 | -69.6 | 0 | 0 | 0 | 111.6 | R93 D206 D210 N244 | R93-D208 IonicContact CZ-OD2 3.89Å; R93-D208 IonicContact NH1-OD2 2.82Å; R93-D208 IonicContact NH2-OD2 3.56Å; R93-D208 PolarHBondContact NH2-OD2 3.42Å; D206-D208 PolarHBondContact O-N 3.01Å; D206-D208 WeakPolarHBondContact OD1-CA 3.44Å; D206-D208 WeakPolarHBondContact OD1-CB 3.45Å; D206-D208 PolarHBondContact OD1-N 3.31Å; D208-D210 VanDerWaalsContact C-N 3.29Å; D208-N244 VanDerWaalsContact O-CB 3.26Å; D208-N244 WeakPolarHBondContact O-CB 3.42Å; D208-N244 VanDerWaalsContact O-CG 3.31Å; D208-N244 PolarHBondContact O-N 2.94Å; D208-N244 PolarHBondContact O-ND2 2.89Å |
| 209 | G | 92.9 | Very high | 91.1 | Very high | 2 Ų | 2 | 48.3 Ų | 48.3 | 2% | 0.021 | 25% | 0.248 | C | C | . | . | trans | 80.5 | 6.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q205 D206 E207 N243 N244 | Q205-G209 PolarHBondContact NE2-O 2.91Å; D206-G209 WeakPolarHBondContact O-CA 3.33Å; D206-G209 PolarHBondContact O-N 3.27Å; D206-G209 PolarHBondContact OD1-N 3.32Å; D206-G209 VanDerWaalsContact OD1-N 3.15Å; E207-G209 VanDerWaalsContact C-N 3.27Å; G209-N243 VanDerWaalsContact O-CA 3.3Å; G209-N243 WeakPolarHBondContact O-CA 3.36Å; G209-N243 WeakPolarHBondContact O-CB 3.45Å; G209-N244 PolarHBondContact N-ND2 3.44Å | ||
| 210 | D | 93.2 | Very high | 91.7 | Very high | 30 Ų | 30 | 49 Ų | 49 | 16% | 0.16 | 26% | 0.259 | C | S | . | . | trans | -81.6 | 134 | -175.6 | -84.5 | -23.9 | 0 | 0 | 0 | 111.9 | Q205 D206 D208 H214 I215 N243 | Q205-D210 WeakPolarHBondContact CA-O 3.33Å; D206-D210 PolarHBondContact N-O 2.94Å; D206-D210 PolarHBondContact OD1-N 2.89Å; D208-D210 VanDerWaalsContact C-N 3.29Å; D210-H214 HydrophobicContact CB-CB 3.89Å; D210-H214 WeakPolarHBondContact OD1-CB 3.28Å; D210-H214 IonicContact OD1-CG 3.48Å; D210-H214 IonicContact OD1-ND1 3.07Å; D210-H214 PolarHBondContact OD1-ND1 3.07Å; D210-H214 VanDerWaalsContact OD1-ND1 3.07Å; D210-I215 HydrophobicContact CB-CG1 4.1Å; D210-N243 WeakPolarHBondContact OD1-CB 3.3Å; D210-N243 PolarHBondContact OD1-ND2 3.12Å | ||
| 211 | T | 93.9 | Very high | 92.2 | Very high | 1 Ų | 1 | 50.6 Ų | 50.6 | 1% | 0.006 | 26% | 0.259 | C | S | . | . | B | Isolated β-bridge | trans | -82.8 | 166.4 | 172 | 60.5 | 0 | 0 | 0 | 0 | 110.5 | Q205 L213 H214 I215 I241 | Q205-T211 HydrophobicContact CG-CG2 3.94Å; T211-L213 PolarHBondContact O-N 3.4Å; T211-L213 VanDerWaalsContact O-N 3.11Å; T211-L213 PolarHBondContact OG1-N 2.91Å; T211-H214 PolarHBondContact N-ND1 2.68Å; T211-H214 WeakPolarHBondContact O-CB 3.48Å; T211-H214 PolarHBondContact O-N 3.26Å; T211-H214 PolarHBondContact OG1-N 3.01Å; T211-H214 VanDerWaalsContact OG1-N 3.13Å; T211-I215 WeakPolarHBondContact O-CG1 3.33Å; T211-I215 PolarHBondContact O-N 3.35Å; T211-I215 VanDerWaalsContact O-N 3.07Å; T211-I241 HydrophobicContact CG2-CB 4.18Å; T211-I241 HydrophobicContact CG2-CD1 4.12Å; T211-I241 HydrophobicContact CG2-CG2 3.67Å |
| 212 | A | 93.2 | Very high | 92.6 | Very high | 34 Ų | 34 | 48.4 Ų | 48.4 | 28% | 0.281 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -52.7 | -33.1 | 169 | 0 | 0 | 0 | 0 | 0 | 112.6 | A216 L228 | A212-A216 WeakPolarHBondContact O-CB 3.34Å; A212-A216 PolarHBondContact O-N 2.69Å; A212-L228 HydrophobicContact CB-CD1 4.06Å; A212-L228 HydrophobicContact CB-CD2 4Å; A212-L228 WeakPolarHBondContact O-CD1 3.31Å |
| 213 | L | 94.9 | Very high | 93.2 | Very high | 2 Ų | 2 | 52.6 Ų | 52.6 | 1% | 0.01 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -73.3 | -39.1 | 177.6 | -176.5 | 59.6 | 0 | 0 | 0 | 112.5 | T211 V217 V225 L228 I229 L232 L239 P249 L265 | T211-L213 PolarHBondContact O-N 3.4Å; T211-L213 VanDerWaalsContact O-N 3.11Å; T211-L213 PolarHBondContact OG1-N 2.91Å; L213-V217 HydrophobicContact CD1-CG2 4.25Å; L213-V217 WeakPolarHBondContact O-CB 3.41Å; L213-V217 VanDerWaalsContact O-CG2 3.26Å; L213-V217 WeakPolarHBondContact O-CG2 3.41Å; L213-V217 PolarHBondContact O-N 3.14Å; L213-V225 HydrophobicContact CD1-CG1 4.03Å; L213-V225 HydrophobicContact CD1-CG2 4.5Å; L213-L228 HydrophobicContact CB-CD1 4.43Å; L213-L228 HydrophobicContact CD1-CB 4.18Å; L213-L228 HydrophobicContact CD1-CD1 4.5Å; L213-I229 HydrophobicContact CD1-CG1 4.25Å; L213-L232 HydrophobicContact CB-CD1 4.46Å; L213-L232 HydrophobicContact CD2-CD1 3.73Å; L213-L239 HydrophobicContact CD2-CD2 4.16Å; L213-P249 HydrophobicContact CD2-CB 4.07Å; L213-P249 HydrophobicContact CD2-CG 3.64Å; L213-P249 HydrophobicContact CG-CB 3.95Å; L213-P249 HydrophobicContact CG-CG 3.81Å; L213-L265 HydrophobicContact CD2-CD2 4.49Å |
| 214 | H | 95.6 | Very high | 93.5 | Very high | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58.6 | -48.6 | 171.4 | -67.9 | 161.7 | 0 | 0 | 0 | 111.4 | D210 T211 A216 V217 V218 I241 Q247 P249 L252 | D210-H214 HydrophobicContact CB-CB 3.89Å; D210-H214 WeakPolarHBondContact OD1-CB 3.28Å; D210-H214 IonicContact OD1-CG 3.48Å; D210-H214 IonicContact OD1-ND1 3.07Å; D210-H214 PolarHBondContact OD1-ND1 3.07Å; D210-H214 VanDerWaalsContact OD1-ND1 3.07Å; T211-H214 PolarHBondContact N-ND1 2.68Å; T211-H214 WeakPolarHBondContact O-CB 3.48Å; T211-H214 PolarHBondContact O-N 3.26Å; T211-H214 PolarHBondContact OG1-N 3.01Å; T211-H214 VanDerWaalsContact OG1-N 3.13Å; H214-A216 PolarHBondContact O-N 2.99Å; H214-V217 PolarHBondContact O-N 3.27Å; H214-V218 WeakPolarHBondContact O-CG2 3.34Å; H214-V218 PolarHBondContact O-N 3.45Å; H214-I241 PolarHBondContact CE1-O 2.97Å; H214-I241 PolarHBondContact NE2-O 2.99Å; H214-I241 VanDerWaalsContact NE2-O 3.14Å; H214-Q247 PolarHBondContact CE1-O 3.25Å; H214-P249 VanDerWaalsContact NE2-CD 3.27Å; H214-P249 WeakPolarHBondContact NE2-CD 3.29Å; H214-L252 HydrophobicContact CB-CD1 3.62Å |
| 215 | I | 94.3 | Very high | 93.8 | Very high | 37 Ų | 37 | 47.1 Ų | 47.1 | 19% | 0.19 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.6 | -46.1 | -178.5 | -62.5 | 170.4 | 0 | 0 | 0 | 110.9 | F95 D210 T211 V217 V218 Q219 | F95-I215 HydrophobicContact CE2-CG2 4.11Å; D210-I215 HydrophobicContact CB-CG1 4.1Å; T211-I215 WeakPolarHBondContact O-CG1 3.33Å; T211-I215 PolarHBondContact O-N 3.35Å; T211-I215 VanDerWaalsContact O-N 3.07Å; I215-V217 VanDerWaalsContact C-N 3.34Å; I215-V217 PolarHBondContact O-N 3.01Å; I215-V218 PolarHBondContact O-N 3.48Å; I215-Q219 WeakPolarHBondContact O-CG 3.33Å; I215-Q219 PolarHBondContact O-N 2.9Å |
| 216 | A | 95.4 | Very high | 93.9 | Very high | 3 Ų | 3 | 46.7 Ų | 46.7 | 3% | 0.025 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.1 | -37.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A212 H214 Q219 G220 E221 I224 V225 L228 | A212-A216 WeakPolarHBondContact O-CB 3.34Å; A212-A216 PolarHBondContact O-N 2.69Å; H214-A216 PolarHBondContact O-N 2.99Å; A216-Q219 PolarHBondContact O-N 3.42Å; A216-G220 PolarHBondContact O-N 2.88Å; A216-E221 PolarHBondContact O-N 3.39Å; A216-E221 VanDerWaalsContact O-N 3.13Å; A216-I224 HydrophobicContact CB-CB 4.37Å; A216-I224 HydrophobicContact CB-CG2 3.92Å; A216-V225 HydrophobicContact CB-CG2 3.77Å; A216-L228 HydrophobicContact CB-CD1 3.87Å |
| 217 | V | 96.2 | Very high | 93.9 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -69.4 | -39 | 174.3 | 169.6 | 0 | 0 | 0 | 0 | 112.1 | L213 H214 I215 Q219 G220 V225 P249 L252 A253 Q258 L261 L265 | L213-V217 HydrophobicContact CD1-CG2 4.25Å; L213-V217 WeakPolarHBondContact O-CB 3.41Å; L213-V217 VanDerWaalsContact O-CG2 3.26Å; L213-V217 WeakPolarHBondContact O-CG2 3.41Å; L213-V217 PolarHBondContact O-N 3.14Å; H214-V217 PolarHBondContact O-N 3.27Å; I215-V217 VanDerWaalsContact C-N 3.34Å; I215-V217 PolarHBondContact O-N 3.01Å; V217-Q219 VanDerWaalsContact C-N 3.27Å; V217-Q219 PolarHBondContact O-N 3.48Å; V217-G220 PolarHBondContact O-N 3.41Å; V217-V225 HydrophobicContact CG2-CG1 4.42Å; V217-V225 HydrophobicContact CG2-CG2 3.93Å; V217-P249 HydrophobicContact CG2-CB 4.2Å; V217-L252 HydrophobicContact CG1-CB 4.02Å; V217-A253 HydrophobicContact CG1-CB 3.7Å; V217-Q258 PolarHBondContact O-OE1 3.44Å; V217-L261 HydrophobicContact CB-CD1 4.19Å; V217-L261 HydrophobicContact CG1-CD1 4.08Å; V217-L261 HydrophobicContact CG2-CD1 4.09Å; V217-L265 HydrophobicContact CG2-CD1 4.23Å |
| 218 | V | 95.8 | Very high | 93.9 | Very high | 58 Ų | 58 | 44 Ų | 44 | 35% | 0.352 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -64.9 | -34.1 | 175.5 | 171 | 0 | 0 | 0 | 0 | 111.5 | H214 I215 L252 | H214-V218 WeakPolarHBondContact O-CG2 3.34Å; H214-V218 PolarHBondContact O-N 3.45Å; I215-V218 PolarHBondContact O-N 3.48Å; V218-L252 HydrophobicContact CG2-CB 4.29Å; V218-L252 HydrophobicContact CG2-CD1 3.97Å; V218-L252 HydrophobicContact CG2-CD2 4.32Å; V218-L252 HydrophobicContact CG2-CG 4.43Å |
| 219 | Q | 94.1 | Very high | 94.1 | Very high | 76 Ų | 76 | 41.4 Ų | 41.4 | 36% | 0.355 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -77.6 | -28.2 | 176.2 | -71 | 169.5 | -20 | 0 | 0 | 113.3 | R93 F95 I215 A216 V217 E221 | R93-Q219 PolarHBondContact O-NE2 3.22Å; F95-Q219 VanDerWaalsContact CD2-NE2 3.31Å; I215-Q219 WeakPolarHBondContact O-CG 3.33Å; I215-Q219 PolarHBondContact O-N 2.9Å; A216-Q219 PolarHBondContact O-N 3.42Å; V217-Q219 VanDerWaalsContact C-N 3.27Å; V217-Q219 PolarHBondContact O-N 3.48Å; Q219-E221 HydrophobicContact CB-CG 4.12Å |
| 220 | G | 93.6 | Very high | 93.9 | Very high | 28 Ų | 28 | 47.7 Ų | 47.7 | 29% | 0.289 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85.8 | 16.1 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | A216 V217 L222 | A216-G220 PolarHBondContact O-N 2.88Å; V217-G220 PolarHBondContact O-N 3.41Å; G220-L222 VanDerWaalsContact C-N 3.3Å; G220-L222 PolarHBondContact O-N 2.91Å |
| 221 | E | 93.7 | Very high | 93.8 | Very high | 94 Ų | 94 | 48.2 Ų | 48.2 | 44% | 0.439 | 25% | 0.254 | S | S | . | . | trans | -79.5 | 74.8 | -174.3 | -72.2 | -62.3 | 161.2 | 0 | 0 | 112 | A216 Q219 P223 I224 V225 | A216-E221 PolarHBondContact O-N 3.39Å; A216-E221 VanDerWaalsContact O-N 3.13Å; Q219-E221 HydrophobicContact CB-CG 4.12Å; E221-P223 VanDerWaalsContact C-N 3.33Å; E221-I224 HydrophobicContact CB-CB 4.02Å; E221-I224 HydrophobicContact CB-CD1 3.8Å; E221-I224 HydrophobicContact CB-CG1 3.96Å; E221-I224 HydrophobicContact CG-CD1 4.14Å; E221-I224 WeakPolarHBondContact O-CA 3.3Å; E221-I224 WeakPolarHBondContact O-CB 3.31Å; E221-I224 PolarHBondContact O-N 3.32Å; E221-V225 PolarHBondContact O-N 3.42Å | ||
| 222 | L | 93.9 | Very high | 93.5 | Very high | 60 Ų | 60 | 48.3 Ų | 48.3 | 31% | 0.314 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -47.8 | -40.7 | -177.2 | -174.2 | 147.8 | 0 | 0 | 0 | 114.6 | G220 I224 V225 H226 N260 L261 | G220-L222 VanDerWaalsContact C-N 3.3Å; G220-L222 PolarHBondContact O-N 2.91Å; L222-I224 PolarHBondContact O-N 3.39Å; L222-V225 PolarHBondContact O-N 3.17Å; L222-H226 PolarHBondContact O-CD2 2.88Å; L222-H226 VanDerWaalsContact O-CD2 3.27Å; L222-H226 PolarHBondContact O-N 2.87Å; L222-N260 HydrophobicContact CD1-CB 4.16Å; L222-L261 HydrophobicContact CB-CD2 3.87Å; L222-L261 HydrophobicContact CD1-CD2 3.97Å; L222-L261 HydrophobicContact CG-CD2 3.95Å |
| 223 | P | 94 | Very high | 93.3 | Very high | 93 Ų | 93 | 50.8 Ų | 50.8 | 60% | 0.604 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -65.1 | -36.2 | 174.9 | -21.3 | 34.2 | 0 | 0 | 0 | 113.5 | E221 K227 | E221-P223 VanDerWaalsContact C-N 3.33Å; P223-K227 PolarHBondContact O-N 2.93Å |
| 224 | I | 93.1 | Very high | 93 | Very high | 81 Ų | 81 | 57.2 Ų | 57.2 | 42% | 0.415 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -71.7 | -42.7 | 177.3 | -57 | -177.6 | 0 | 0 | 0 | 109.6 | A216 E221 L222 H226 K227 L228 | A216-I224 HydrophobicContact CB-CB 4.37Å; A216-I224 HydrophobicContact CB-CG2 3.92Å; E221-I224 HydrophobicContact CB-CB 4.02Å; E221-I224 HydrophobicContact CB-CD1 3.8Å; E221-I224 HydrophobicContact CB-CG1 3.96Å; E221-I224 HydrophobicContact CG-CD1 4.14Å; E221-I224 WeakPolarHBondContact O-CA 3.3Å; E221-I224 WeakPolarHBondContact O-CB 3.31Å; E221-I224 PolarHBondContact O-N 3.32Å; L222-I224 PolarHBondContact O-N 3.39Å; I224-H226 PolarHBondContact O-N 3.27Å; I224-K227 PolarHBondContact O-N 3.11Å; I224-L228 HydrophobicContact CG2-CD1 3.86Å; I224-L228 HydrophobicContact CG2-CG 4.27Å; I224-L228 WeakPolarHBondContact O-CG 3.47Å; I224-L228 PolarHBondContact O-N 3.04Å |
| 225 | V | 95.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -57.2 | -48.5 | 175.5 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | L213 A216 V217 E221 L222 K227 L228 I229 L261 V264 | L213-V225 HydrophobicContact CD1-CG1 4.03Å; L213-V225 HydrophobicContact CD1-CG2 4.5Å; A216-V225 HydrophobicContact CB-CG2 3.77Å; V217-V225 HydrophobicContact CG2-CG1 4.42Å; V217-V225 HydrophobicContact CG2-CG2 3.93Å; E221-V225 PolarHBondContact O-N 3.42Å; L222-V225 PolarHBondContact O-N 3.17Å; V225-K227 VanDerWaalsContact C-N 3.34Å; V225-K227 PolarHBondContact O-N 3.4Å; V225-L228 PolarHBondContact O-N 3.27Å; V225-I229 HydrophobicContact CG1-CD1 3.65Å; V225-I229 HydrophobicContact CG1-CG1 4.38Å; V225-I229 WeakPolarHBondContact O-CB 3.24Å; V225-I229 VanDerWaalsContact O-CG1 3.28Å; V225-I229 WeakPolarHBondContact O-CG1 3.28Å; V225-I229 PolarHBondContact O-N 3.41Å; V225-L261 HydrophobicContact CB-CD2 4.33Å; V225-L261 HydrophobicContact CG1-CD2 4.24Å; V225-L261 HydrophobicContact CG2-CD1 4.12Å; V225-L261 HydrophobicContact CG2-CD2 4.32Å; V225-V264 HydrophobicContact CG1-CG1 4.43Å |
| 226 | H | 94.3 | Very high | 92.1 | Very high | 90 Ų | 90 | 68.1 Ų | 68.1 | 42% | 0.417 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -58.3 | -43.1 | 174.8 | -84.5 | -69.2 | 0 | 0 | 0 | 113 | L222 I224 H230 V264 | L222-H226 PolarHBondContact O-CD2 2.88Å; L222-H226 VanDerWaalsContact O-CD2 3.27Å; L222-H226 PolarHBondContact O-N 2.87Å; I224-H226 PolarHBondContact O-N 3.27Å; H226-H230 WeakPolarHBondContact O-CB 3.37Å; H226-H230 PolarHBondContact O-N 3.42Å; H226-V264 VanDerWaalsContact CE1-CG1 3.47Å; H226-V264 WeakPolarHBondContact CE1-CG1 3.25Å |
| 227 | K | 92.2 | Very high | 91.7 | Very high | 150 Ų | 150 | 74.6 Ų | 74.6 | 65% | 0.652 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -65.3 | -41.5 | 179.3 | -171 | 175.2 | -179.2 | 179.7 | 0 | 111.9 | P223 I224 V225 H230 L231 | P223-K227 PolarHBondContact O-N 2.93Å; I224-K227 PolarHBondContact O-N 3.11Å; V225-K227 VanDerWaalsContact C-N 3.34Å; V225-K227 PolarHBondContact O-N 3.4Å; K227-H230 PolarHBondContact O-N 3.36Å; K227-L231 HydrophobicContact CG-CD1 4.46Å; K227-L231 VanDerWaalsContact O-CG 3.3Å; K227-L231 WeakPolarHBondContact O-CG 3.42Å; K227-L231 PolarHBondContact O-N 2.91Å; K227-L231 VanDerWaalsContact O-N 3.1Å |
| 228 | L | 92.6 | Very high | 91.2 | Very high | 21 Ų | 21 | 77.2 Ų | 77.2 | 11% | 0.11 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -67.6 | -43.7 | 177.1 | -71 | 171.5 | 0 | 0 | 0 | 112 | A202 A212 L213 A216 I224 V225 H230 L231 L232 | A202-L228 HydrophobicContact CB-CD2 3.93Å; A212-L228 HydrophobicContact CB-CD1 4.06Å; A212-L228 HydrophobicContact CB-CD2 4Å; A212-L228 WeakPolarHBondContact O-CD1 3.31Å; L213-L228 HydrophobicContact CB-CD1 4.43Å; L213-L228 HydrophobicContact CD1-CB 4.18Å; L213-L228 HydrophobicContact CD1-CD1 4.5Å; A216-L228 HydrophobicContact CB-CD1 3.87Å; I224-L228 HydrophobicContact CG2-CD1 3.86Å; I224-L228 HydrophobicContact CG2-CG 4.27Å; I224-L228 WeakPolarHBondContact O-CG 3.47Å; I224-L228 PolarHBondContact O-N 3.04Å; V225-L228 PolarHBondContact O-N 3.27Å; L228-H230 PolarHBondContact O-N 3.46Å; L228-L231 PolarHBondContact O-N 2.79Å; L228-L232 WeakPolarHBondContact O-CG 3.37Å; L228-L232 PolarHBondContact O-N 3.14Å |
| 229 | I | 93 | Very high | 91 | Very high | 10 Ų | 10 | 74.6 Ų | 74.6 | 5% | 0.051 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -56.6 | -48.8 | 173.6 | -73.8 | 169 | 0 | 0 | 0 | 110.6 | L213 V225 L231 L232 L233 L239 V264 L265 A268 | L213-I229 HydrophobicContact CD1-CG1 4.25Å; V225-I229 HydrophobicContact CG1-CD1 3.65Å; V225-I229 HydrophobicContact CG1-CG1 4.38Å; V225-I229 WeakPolarHBondContact O-CB 3.24Å; V225-I229 VanDerWaalsContact O-CG1 3.28Å; V225-I229 WeakPolarHBondContact O-CG1 3.28Å; V225-I229 PolarHBondContact O-N 3.41Å; I229-L231 VanDerWaalsContact C-N 3.3Å; I229-L231 PolarHBondContact O-N 2.99Å; I229-L232 PolarHBondContact O-N 2.86Å; I229-L233 HydrophobicContact CG2-CD1 3.74Å; I229-L233 HydrophobicContact CG2-CG 4.26Å; I229-L233 WeakPolarHBondContact O-CB 3.45Å; I229-L233 WeakPolarHBondContact O-CG 3.32Å; I229-L233 PolarHBondContact O-N 3.47Å; I229-L239 HydrophobicContact CG1-CD2 4.22Å; I229-V264 HydrophobicContact CD1-CG1 3.74Å; I229-L265 HydrophobicContact CD1-CD2 3.88Å; I229-L265 HydrophobicContact CG1-CD2 4.42Å; I229-A268 HydrophobicContact CD1-CB 4.2Å; I229-A268 HydrophobicContact CG2-CB 3.48Å; I229-A268 VanDerWaalsContact CG2-CB 3.48Å |
| 230 | H | 90.5 | Very high | 90.9 | Very high | 133 Ų | 133 | 72.8 Ų | 72.8 | 62% | 0.616 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -62.3 | -36.5 | -180 | -169.3 | -66.2 | 0 | 0 | 0 | 112.4 | H226 K227 L228 F234 | H226-H230 WeakPolarHBondContact O-CB 3.37Å; H226-H230 PolarHBondContact O-N 3.42Å; K227-H230 PolarHBondContact O-N 3.36Å; L228-H230 PolarHBondContact O-N 3.46Å; H230-F234 VanDerWaalsContact O-CB 3.28Å; H230-F234 WeakPolarHBondContact O-CB 3.42Å; H230-F234 PolarHBondContact O-N 2.94Å; H230-F234 VanDerWaalsContact O-N 3.08Å |
| 231 | L | 89.6 | Confident | 90.8 | Very high | 41 Ų | 41 | 73.4 Ų | 73.4 | 22% | 0.215 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -67.4 | -43.5 | 174.5 | -72.6 | 167.7 | 0 | 0 | 0 | 112.2 | L195 K227 L228 I229 A235 | L195-L231 HydrophobicContact CD1-CD2 3.45Å; L195-L231 VanDerWaalsContact CD1-CD2 3.45Å; K227-L231 HydrophobicContact CG-CD1 4.46Å; K227-L231 VanDerWaalsContact O-CG 3.3Å; K227-L231 WeakPolarHBondContact O-CG 3.42Å; K227-L231 PolarHBondContact O-N 2.91Å; K227-L231 VanDerWaalsContact O-N 3.1Å; L228-L231 PolarHBondContact O-N 2.79Å; I229-L231 VanDerWaalsContact C-N 3.3Å; I229-L231 PolarHBondContact O-N 2.99Å; L231-A235 WeakPolarHBondContact O-CB 3.27Å; L231-A235 PolarHBondContact O-N 3.25Å |
| 232 | L | 89.3 | Confident | 90.8 | Very high | 3 Ų | 3 | 72.1 Ų | 72.1 | 2% | 0.016 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -67 | -43.9 | 179.5 | -70.1 | 168.1 | 0 | 0 | 0 | 112.1 | T203 L213 L228 I229 A235 R236 R237 L239 | T203-L232 HydrophobicContact CG2-CD2 3.43Å; T203-L232 VanDerWaalsContact CG2-CD2 3.43Å; L213-L232 HydrophobicContact CB-CD1 4.46Å; L213-L232 HydrophobicContact CD2-CD1 3.73Å; L228-L232 WeakPolarHBondContact O-CG 3.37Å; L228-L232 PolarHBondContact O-N 3.14Å; I229-L232 PolarHBondContact O-N 2.86Å; L232-A235 CarbonylContact O-C 3.6Å; L232-A235 WeakPolarHBondContact O-CA 3.28Å; L232-A235 WeakPolarHBondContact O-CB 3.43Å; L232-A235 PolarHBondContact O-N 3.14Å; L232-R236 PolarHBondContact O-N 3.07Å; L232-R236 VanDerWaalsContact O-N 3.15Å; L232-R237 HydrophobicContact CB-CB 4.36Å; L232-R237 HydrophobicContact CD2-CB 3.97Å; L232-R237 HydrophobicContact CD2-CG 4.45Å; L232-R237 PolarHBondContact O-N 3.34Å; L232-L239 HydrophobicContact CB-CD2 4.07Å; L232-L239 HydrophobicContact CD1-CD2 3.92Å |
| 233 | L | 89.1 | Confident | 90.9 | Very high | 86 Ų | 86 | 69.9 Ų | 69.9 | 45% | 0.45 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65.6 | -41.1 | 176.8 | -67.9 | 177.8 | 0 | 0 | 0 | 111.9 | I229 A235 R236 A268 | I229-L233 HydrophobicContact CG2-CD1 3.74Å; I229-L233 HydrophobicContact CG2-CG 4.26Å; I229-L233 WeakPolarHBondContact O-CB 3.45Å; I229-L233 WeakPolarHBondContact O-CG 3.32Å; I229-L233 PolarHBondContact O-N 3.47Å; L233-A235 VanDerWaalsContact C-N 3.27Å; L233-A235 PolarHBondContact O-N 2.69Å; L233-R236 PolarHBondContact O-N 3Å; L233-A268 HydrophobicContact CD1-CB 4.38Å |
| 234 | F | 87.6 | Confident | 90.9 | Very high | 137 Ų | 137 | 70.9 Ų | 70.9 | 60% | 0.601 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -60 | -39.3 | 172.3 | -172.5 | -83.2 | 0 | 0 | 0 | 111.7 | L195 H230 R236 | L195-F234 HydrophobicContact CD2-CD1 3.9Å; L195-F234 HydrophobicContact CD2-CE1 3.49Å; L195-F234 VanDerWaalsContact CD2-CE1 3.49Å; L195-F234 HydrophobicContact CD2-CZ 4.11Å; H230-F234 VanDerWaalsContact O-CB 3.28Å; H230-F234 WeakPolarHBondContact O-CB 3.42Å; H230-F234 PolarHBondContact O-N 2.94Å; H230-F234 VanDerWaalsContact O-N 3.08Å; F234-R236 PolarHBondContact O-N 2.93Å |
| 235 | A | 85.8 | Confident | 90.9 | Very high | 28 Ų | 28 | 70.1 Ų | 70.1 | 23% | 0.231 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.3 | -0.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | I199 L231 L232 L233 R237 | I199-A235 HydrophobicContact CB-CB 4.38Å; I199-A235 HydrophobicContact CD1-CB 3.69Å; I199-A235 HydrophobicContact CG1-CB 3.88Å; I199-A235 HydrophobicContact CG2-CB 3.56Å; L231-A235 WeakPolarHBondContact O-CB 3.27Å; L231-A235 PolarHBondContact O-N 3.25Å; L232-A235 CarbonylContact O-C 3.6Å; L232-A235 WeakPolarHBondContact O-CA 3.28Å; L232-A235 WeakPolarHBondContact O-CB 3.43Å; L232-A235 PolarHBondContact O-N 3.14Å; L233-A235 VanDerWaalsContact C-N 3.27Å; L233-A235 PolarHBondContact O-N 2.69Å; A235-R237 HydrophobicContact CB-CG 3.86Å; A235-R237 PolarHBondContact O-N 3.29Å |
| 236 | R | 85.3 | Confident | 90.9 | Very high | 238 Ų | 238 | 75.1 Ų | 75.1 | 90% | 0.898 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52 | 35.1 | -170.5 | -56.7 | -173.5 | 178.5 | -158.2 | -0.4 | 113.3 | L232 L233 F234 | L232-R236 PolarHBondContact O-N 3.07Å; L232-R236 VanDerWaalsContact O-N 3.15Å; L233-R236 PolarHBondContact O-N 3Å; F234-R236 PolarHBondContact O-N 2.93Å |
| 237 | R | 86.3 | Confident | 90.9 | Very high | 139 Ų | 139 | 71.2 Ų | 71.2 | 53% | 0.525 | 34% | 0.34 | S | S | . | . | trans | -92.7 | 136.9 | 172.3 | -63.7 | -67.1 | -172.3 | 166.7 | 2.6 | 109.4 | T203 L232 A235 | T203-R237 HydrophobicContact CG2-CG 4.12Å; L232-R237 HydrophobicContact CB-CB 4.36Å; L232-R237 HydrophobicContact CD2-CB 3.97Å; L232-R237 HydrophobicContact CD2-CG 4.45Å; L232-R237 PolarHBondContact O-N 3.34Å; A235-R237 HydrophobicContact CB-CG 3.86Å; A235-R237 PolarHBondContact O-N 3.29Å | ||
| 238 | G | 86.7 | Confident | 91.1 | Very high | 55 Ų | 55 | 64.1 Ų | 64.1 | 57% | 0.567 | 31% | 0.309 | S | S | * | . | trans | -67.6 | 154.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 239 | L | 90.4 | Very high | 91.3 | Very high | 4 Ų | 4 | 63.2 Ų | 63.2 | 2% | 0.021 | 30% | 0.304 | C | S | . | . | S | Bend | trans | -83.4 | -24.7 | 180 | -59.5 | 178.2 | 0 | 0 | 0 | 112.5 | L213 I229 L232 I241 P249 A268 A270 | L213-L239 HydrophobicContact CD2-CD2 4.16Å; I229-L239 HydrophobicContact CG1-CD2 4.22Å; L232-L239 HydrophobicContact CB-CD2 4.07Å; L232-L239 HydrophobicContact CD1-CD2 3.92Å; L239-I241 PolarHBondContact O-N 3.01Å; L239-P249 VanDerWaalsContact O-CD 3.28Å; L239-P249 WeakPolarHBondContact O-CD 3.35Å; L239-P249 WeakPolarHBondContact O-CG 3.35Å; L239-A268 HydrophobicContact CD1-CB 3.52Å; L239-A268 WeakPolarHBondContact CD1-O 3.16Å; L239-A270 HydrophobicContact CB-CB 4.22Å; L239-A270 HydrophobicContact CD1-CB 4.29Å |
| 240 | D | 92.2 | Very high | 91.4 | Very high | 38 Ų | 38 | 62.8 Ų | 62.8 | 20% | 0.203 | 30% | 0.302 | C | S | . | . | trans | -80.7 | 47.3 | -174.9 | -55.3 | -65.4 | 0 | 0 | 0 | 113.3 | H242 T248 D271 V274 | D240-H242 PolarHBondContact O-CE1 3.49Å; D240-H242 VanDerWaalsContact O-CE1 3.27Å; D240-H242 PolarHBondContact O-ND1 2.98Å; D240-T248 HydrophobicContact CB-CG2 4.11Å; D240-D271 PolarHBondContact OD1-N 2.97Å; D240-D271 PolarHBondContact OD2-N 3.37Å; D240-V274 HydrophobicContact CB-CG2 4.11Å | ||
| 241 | I | 92 | Very high | 91.7 | Very high | 41 Ų | 41 | 56.5 Ų | 56.5 | 21% | 0.21 | 27% | 0.273 | C | S | . | . | trans | -68.8 | 141.1 | 168.3 | -53.1 | 174 | 0 | 0 | 0 | 107.8 | T211 H214 L239 T248 | T211-I241 HydrophobicContact CG2-CB 4.18Å; T211-I241 HydrophobicContact CG2-CD1 4.12Å; T211-I241 HydrophobicContact CG2-CG2 3.67Å; H214-I241 PolarHBondContact CE1-O 2.97Å; H214-I241 PolarHBondContact NE2-O 2.99Å; H214-I241 VanDerWaalsContact NE2-O 3.14Å; L239-I241 PolarHBondContact O-N 3.01Å; I241-T248 WeakPolarHBondContact O-CA 3.37Å | ||
| 242 | H | 94.7 | Very high | 92 | Very high | 67 Ų | 67 | 55.2 Ų | 55.2 | 31% | 0.31 | 27% | 0.266 | S | S | . | . | trans | -109.1 | 134.6 | -174.9 | -66.9 | 63.5 | 0 | 0 | 0 | 111.2 | Q205 D240 R246 Q247 V274 | Q205-H242 PolarHBondContact NE2-O 3.29Å; D240-H242 PolarHBondContact O-CE1 3.49Å; D240-H242 VanDerWaalsContact O-CE1 3.27Å; D240-H242 PolarHBondContact O-ND1 2.98Å; H242-R246 PolarHBondContact CD2-O 3.15Å; H242-Q247 WeakPolarHBondContact CA-O 3.46Å; H242-V274 VanDerWaalsContact NE2-CG1 3.33Å; H242-V274 WeakPolarHBondContact NE2-CG1 3.33Å | ||
| 243 | N | 94.6 | Very high | 92.4 | Very high | 12 Ų | 12 | 55 Ų | 55 | 6% | 0.064 | 27% | 0.265 | C | S | . | . | trans | -84 | -176.3 | 171.4 | 71 | 8.1 | 0 | 0 | 0 | 112.9 | G209 D210 L245 R246 Q247 | G209-N243 VanDerWaalsContact O-CA 3.3Å; G209-N243 WeakPolarHBondContact O-CA 3.36Å; G209-N243 WeakPolarHBondContact O-CB 3.45Å; D210-N243 WeakPolarHBondContact OD1-CB 3.3Å; D210-N243 PolarHBondContact OD1-ND2 3.12Å; N243-L245 PolarHBondContact O-N 2.84Å; N243-L245 VanDerWaalsContact O-N 3.12Å; N243-L245 WeakPolarHBondContact OD1-CA 3.33Å; N243-L245 WeakPolarHBondContact OD1-CB 3.45Å; N243-L245 PolarHBondContact OD1-N 3.04Å; N243-R246 WeakPolarHBondContact O-CA 3.37Å; N243-R246 PolarHBondContact O-N 3.43Å; N243-R246 PolarHBondContact OD1-N 3.13Å; N243-Q247 PolarHBondContact N-O 3.35Å; N243-Q247 PolarHBondContact OD1-N 2.95Å; N243-Q247 PolarHBondContact OD1-O 2.99Å | ||
| 244 | N | 93.7 | Very high | 92.7 | Very high | 115 Ų | 115 | 51 Ų | 51 | 62% | 0.615 | 24% | 0.244 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -15.5 | 179.9 | -66.5 | -14 | 0 | 0 | 0 | 113.4 | E207 D208 G209 R246 | E207-N244 PolarHBondContact O-ND2 2.9Å; D208-N244 VanDerWaalsContact O-CB 3.26Å; D208-N244 WeakPolarHBondContact O-CB 3.42Å; D208-N244 VanDerWaalsContact O-CG 3.31Å; D208-N244 PolarHBondContact O-N 2.94Å; D208-N244 PolarHBondContact O-ND2 2.89Å; G209-N244 PolarHBondContact N-ND2 3.44Å; N244-R246 VanDerWaalsContact C-N 3.32Å |
| 245 | L | 93.2 | Very high | 93.1 | Very high | 65 Ų | 65 | 45.2 Ų | 45.2 | 34% | 0.34 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | 8.3 | 171 | -52 | -172.3 | 0 | 0 | 0 | 112.8 | N243 Q247 R277 | N243-L245 PolarHBondContact O-N 2.84Å; N243-L245 VanDerWaalsContact O-N 3.12Å; N243-L245 WeakPolarHBondContact OD1-CA 3.33Å; N243-L245 WeakPolarHBondContact OD1-CB 3.45Å; N243-L245 PolarHBondContact OD1-N 3.04Å; L245-Q247 HydrophobicContact CB-CG 4.17Å; L245-Q247 PolarHBondContact O-N 3.45Å; L245-R277 VanDerWaalsContact O-CB 3.3Å; L245-R277 WeakPolarHBondContact O-CB 3.43Å; L245-R277 WeakPolarHBondContact O-CD 3.04Å; L245-R277 VanDerWaalsContact O-CG 3.26Å; L245-R277 WeakPolarHBondContact O-CG 3.49Å |
| 246 | R | 95.4 | Very high | 93.5 | Very high | 104 Ų | 104 | 45.1 Ų | 45.1 | 39% | 0.392 | 22% | 0.216 | S | C | . | . | S | Bend | trans | 58.3 | 24.6 | -173.3 | -162.3 | 175.2 | -177.7 | -111.7 | -5.6 | 112.9 | H242 N243 N244 L275 D276 R277 | H242-R246 PolarHBondContact CD2-O 3.15Å; N243-R246 WeakPolarHBondContact O-CA 3.37Å; N243-R246 PolarHBondContact O-N 3.43Å; N243-R246 PolarHBondContact OD1-N 3.13Å; N244-R246 VanDerWaalsContact C-N 3.32Å; R246-L275 VanDerWaalsContact CZ-O 3.27Å; R246-L275 PolarHBondContact NH1-O 3.15Å; R246-D276 PolarHBondContact NH1-O 3.22Å; R246-D276 WeakPolarHBondContact O-CA 3.3Å; R246-R277 HydrophobicContact CB-CB 4.03Å |
| 247 | Q | 95.8 | Very high | 94 | Very high | 9 Ų | 9 | 39.7 Ų | 39.7 | 4% | 0.042 | 20% | 0.198 | C | C | . | . | trans | -93 | 145.9 | 178.1 | -67.1 | 172.6 | -24.9 | 0 | 0 | 110.5 | H214 H242 N243 L245 H251 L252 D276 | H214-Q247 PolarHBondContact CE1-O 3.25Å; H242-Q247 WeakPolarHBondContact CA-O 3.46Å; N243-Q247 PolarHBondContact N-O 3.35Å; N243-Q247 PolarHBondContact OD1-N 2.95Å; N243-Q247 PolarHBondContact OD1-O 2.99Å; L245-Q247 HydrophobicContact CB-CG 4.17Å; L245-Q247 PolarHBondContact O-N 3.45Å; Q247-H251 HydrophobicContact CB-CB 4.2Å; Q247-H251 HydrophobicContact CG-CB 4.46Å; Q247-L252 HydrophobicContact CB-CD2 4.31Å; Q247-L252 HydrophobicContact CB-CG 4.41Å; Q247-D276 HydrophobicContact CG-CB 4.44Å | ||
| 248 | T | 96.1 | Very high | 94.4 | Very high | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.006 | 19% | 0.185 | C | C | . | . | trans | -102.7 | 171 | 175.2 | 63 | 0 | 0 | 0 | 0 | 110.2 | D240 I241 L250 H251 L252 V274 | D240-T248 HydrophobicContact CB-CG2 4.11Å; I241-T248 WeakPolarHBondContact O-CA 3.37Å; T248-L250 PolarHBondContact O-N 3.33Å; T248-H251 PolarHBondContact O-N 3.39Å; T248-H251 VanDerWaalsContact O-N 3.16Å; T248-H251 PolarHBondContact OG1-N 3.49Å; T248-H251 PolarHBondContact OG1-ND1 3.37Å; T248-L252 PolarHBondContact O-N 3.17Å; T248-V274 HydrophobicContact CG2-CB 4.46Å; T248-V274 HydrophobicContact CG2-CG1 3.7Å | ||
| 249 | P | 95.9 | Very high | 94.8 | Very high | 1 Ų | 1 | 33.8 Ų | 33.8 | 1% | 0.006 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.9 | -34.7 | 174.5 | -19.4 | 30.7 | 0 | 0 | 0 | 112.2 | L213 H214 V217 L239 L252 A253 L265 | L213-P249 HydrophobicContact CD2-CB 4.07Å; L213-P249 HydrophobicContact CD2-CG 3.64Å; L213-P249 HydrophobicContact CG-CB 3.95Å; L213-P249 HydrophobicContact CG-CG 3.81Å; H214-P249 VanDerWaalsContact NE2-CD 3.27Å; H214-P249 WeakPolarHBondContact NE2-CD 3.29Å; V217-P249 HydrophobicContact CG2-CB 4.2Å; L239-P249 VanDerWaalsContact O-CD 3.28Å; L239-P249 WeakPolarHBondContact O-CD 3.35Å; L239-P249 WeakPolarHBondContact O-CG 3.35Å; P249-L252 PolarHBondContact O-N 2.84Å; P249-A253 WeakPolarHBondContact O-CB 3.41Å; P249-A253 PolarHBondContact O-N 3.44Å; P249-L265 HydrophobicContact CB-CD1 4.13Å; P249-L265 HydrophobicContact CB-CD2 4.08Å |
| 250 | L | 95.9 | Very high | 95 | Very high | 1 Ų | 1 | 39.2 Ų | 39.2 | 1% | 0.005 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66.8 | -42 | 177.2 | -174.6 | 61.5 | 0 | 0 | 0 | 112 | T248 L252 A253 V254 V262 L265 L266 A270 P272 A282 | T248-L250 PolarHBondContact O-N 3.33Å; L250-L252 VanDerWaalsContact C-N 3.35Å; L250-L252 PolarHBondContact O-N 3.29Å; L250-A253 PolarHBondContact O-N 3.16Å; L250-V254 WeakPolarHBondContact O-CG2 3.41Å; L250-V254 PolarHBondContact O-N 3.34Å; L250-V254 VanDerWaalsContact O-N 3.16Å; L250-V262 HydrophobicContact CD1-CG1 4.08Å; L250-L265 HydrophobicContact CD1-CB 4.25Å; L250-L266 HydrophobicContact CD1-CD2 4.25Å; L250-L266 HydrophobicContact CD1-CG 4.16Å; L250-L266 HydrophobicContact CD2-CD2 3.93Å; L250-A270 HydrophobicContact CB-CB 4.43Å; L250-A270 HydrophobicContact CD2-CB 4.38Å; L250-P272 HydrophobicContact CD2-CB 4.22Å; L250-A282 HydrophobicContact CD2-CB 4.25Å; L250-A282 HydrophobicContact CG-CB 4.19Å |
| 251 | H | 96.5 | Very high | 95.1 | Very high | 2 Ų | 2 | 37.5 Ų | 37.5 | 1% | 0.009 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.9 | -43.3 | 172.7 | -69.7 | 146 | 0 | 0 | 0 | 111.9 | Q247 T248 V254 I255 V274 Q280 A282 L285 | Q247-H251 HydrophobicContact CB-CB 4.2Å; Q247-H251 HydrophobicContact CG-CB 4.46Å; T248-H251 PolarHBondContact O-N 3.39Å; T248-H251 VanDerWaalsContact O-N 3.16Å; T248-H251 PolarHBondContact OG1-N 3.49Å; T248-H251 PolarHBondContact OG1-ND1 3.37Å; H251-V254 PolarHBondContact O-N 3.03Å; H251-I255 WeakPolarHBondContact O-CD1 3.32Å; H251-I255 VanDerWaalsContact O-CG1 3.26Å; H251-I255 WeakPolarHBondContact O-CG1 3.2Å; H251-I255 PolarHBondContact O-N 3.42Å; H251-V274 PolarHBondContact CE1-O 2.76Å; H251-V274 VanDerWaalsContact CE1-O 3.25Å; H251-V274 PolarHBondContact NE2-O 2.64Å; H251-Q280 PolarHBondContact NE2-O 3.36Å; H251-A282 PolarHBondContact NE2-N 3.39Å; H251-L285 HydrophobicContact CB-CD1 3.99Å |
| 252 | L | 96.1 | Very high | 95.3 | Very high | 13 Ų | 13 | 35.6 Ų | 35.6 | 7% | 0.068 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65.9 | -40.2 | 177.7 | -65.4 | 175.6 | 0 | 0 | 0 | 112.4 | H214 V217 V218 Q247 T248 P249 L250 V254 I255 T256 | H214-L252 HydrophobicContact CB-CD1 3.62Å; V217-L252 HydrophobicContact CG1-CB 4.02Å; V218-L252 HydrophobicContact CG2-CB 4.29Å; V218-L252 HydrophobicContact CG2-CD1 3.97Å; V218-L252 HydrophobicContact CG2-CD2 4.32Å; V218-L252 HydrophobicContact CG2-CG 4.43Å; Q247-L252 HydrophobicContact CB-CD2 4.31Å; Q247-L252 HydrophobicContact CB-CG 4.41Å; T248-L252 PolarHBondContact O-N 3.17Å; P249-L252 PolarHBondContact O-N 2.84Å; L250-L252 VanDerWaalsContact C-N 3.35Å; L250-L252 PolarHBondContact O-N 3.29Å; L252-V254 VanDerWaalsContact C-N 3.29Å; L252-V254 PolarHBondContact O-N 3.3Å; L252-I255 PolarHBondContact O-N 3.48Å; L252-I255 VanDerWaalsContact O-N 3.17Å; L252-T256 WeakPolarHBondContact O-CG2 3.46Å; L252-T256 PolarHBondContact O-N 3.25Å; L252-T256 PolarHBondContact O-OG1 3.07Å; L252-T256 VanDerWaalsContact O-OG1 3.1Å |
| 253 | A | 96.5 | Very high | 95.3 | Very high | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -62 | -35.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | V217 P249 L250 T256 K257 Q258 L261 V262 L265 | V217-A253 HydrophobicContact CG1-CB 3.7Å; P249-A253 WeakPolarHBondContact O-CB 3.41Å; P249-A253 PolarHBondContact O-N 3.44Å; L250-A253 PolarHBondContact O-N 3.16Å; A253-T256 PolarHBondContact O-OG1 2.9Å; A253-K257 PolarHBondContact O-N 3.34Å; A253-Q258 PolarHBondContact O-N 3.13Å; A253-L261 HydrophobicContact CB-CB 4.05Å; A253-V262 HydrophobicContact CB-CG2 3.8Å; A253-L265 HydrophobicContact CB-CD1 3.88Å |
| 254 | V | 96.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -69.9 | -47 | 171.9 | 175.3 | 0 | 0 | 0 | 0 | 110.8 | L250 H251 L252 T256 K257 V262 A282 L285 C286 L291 L298 | L250-V254 WeakPolarHBondContact O-CG2 3.41Å; L250-V254 PolarHBondContact O-N 3.34Å; L250-V254 VanDerWaalsContact O-N 3.16Å; H251-V254 PolarHBondContact O-N 3.03Å; L252-V254 VanDerWaalsContact C-N 3.29Å; L252-V254 PolarHBondContact O-N 3.3Å; V254-T256 VanDerWaalsContact C-N 3.32Å; V254-T256 PolarHBondContact O-N 3.05Å; V254-K257 WeakPolarHBondContact O-CA 3.45Å; V254-K257 PolarHBondContact O-N 2.92Å; V254-V262 HydrophobicContact CG2-CG2 3.9Å; V254-A282 HydrophobicContact CG2-CB 4.18Å; V254-L285 HydrophobicContact CG1-CB 3.7Å; V254-C286 WeakPolarHBondContact CG1-SG 3.39Å; V254-L291 HydrophobicContact CG1-CD1 3.73Å; V254-L291 WeakPolarHBondContact O-CD1 3.48Å; V254-L298 HydrophobicContact CG2-CD1 4.25Å |
| 255 | I | 95.1 | Very high | 95.4 | Very high | 17 Ų | 17 | 28.5 Ų | 28.5 | 9% | 0.087 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.3 | -37.6 | 179.7 | -69.7 | 162.2 | 0 | 0 | 0 | 112.1 | L88 H251 L252 K257 L285 Y289 | L88-I255 HydrophobicContact CD1-CG2 3.98Å; H251-I255 WeakPolarHBondContact O-CD1 3.32Å; H251-I255 VanDerWaalsContact O-CG1 3.26Å; H251-I255 WeakPolarHBondContact O-CG1 3.2Å; H251-I255 PolarHBondContact O-N 3.42Å; L252-I255 PolarHBondContact O-N 3.48Å; L252-I255 VanDerWaalsContact O-N 3.17Å; I255-K257 PolarHBondContact O-N 3.06Å; I255-L285 HydrophobicContact CD1-CD1 4.23Å; I255-L285 HydrophobicContact CG1-CD1 4.24Å; I255-Y289 HydrophobicContact CG1-CE2 3.91Å |
| 256 | T | 95.1 | Very high | 95.3 | Very high | 26 Ų | 26 | 26.2 Ų | 26.2 | 16% | 0.16 | 13% | 0.128 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78 | -3.4 | 174 | 59.6 | 0 | 0 | 0 | 0 | 114.1 | F90 L252 A253 V254 Q258 | F90-T256 HydrophobicContact CE1-CG2 4.39Å; L252-T256 WeakPolarHBondContact O-CG2 3.46Å; L252-T256 PolarHBondContact O-N 3.25Å; L252-T256 PolarHBondContact O-OG1 3.07Å; L252-T256 VanDerWaalsContact O-OG1 3.1Å; A253-T256 PolarHBondContact O-OG1 2.9Å; V254-T256 VanDerWaalsContact C-N 3.32Å; V254-T256 PolarHBondContact O-N 3.05Å; T256-Q258 VanDerWaalsContact OG1-CD 3.31Å; T256-Q258 WeakPolarHBondContact OG1-CG 3.5Å; T256-Q258 PolarHBondContact OG1-NE2 2.92Å |
| 257 | K | 95.4 | Very high | 95.2 | Very high | 123 Ų | 123 | 29.4 Ų | 29.4 | 54% | 0.535 | 14% | 0.14 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 67 | 29.3 | 178.4 | -44.9 | -168.1 | 171.9 | -138.3 | 0 | 114.3 | A253 V254 I255 A259 Y289 L291 | A253-K257 PolarHBondContact O-N 3.34Å; V254-K257 WeakPolarHBondContact O-CA 3.45Å; V254-K257 PolarHBondContact O-N 2.92Å; I255-K257 PolarHBondContact O-N 3.06Å; K257-A259 PolarHBondContact O-N 3.24Å; K257-Y289 PolarHBondContact NZ-O 3.42Å; K257-Y289 VanDerWaalsContact NZ-O 3.13Å; K257-L291 HydrophobicContact CB-CD2 4.01Å; K257-L291 HydrophobicContact CD-CD2 3.47Å; K257-L291 VanDerWaalsContact CD-CD2 3.47Å; K257-L291 HydrophobicContact CG-CD1 4.16Å; K257-L291 HydrophobicContact CG-CD2 3.58Å |
| 258 | Q | 94.5 | Very high | 95 | Very high | 50 Ų | 50 | 29.9 Ų | 29.9 | 23% | 0.234 | 15% | 0.146 | C | C | . | . | trans | -101.3 | 79.1 | -170.7 | -64.5 | 178.3 | 15.5 | 0 | 0 | 112.3 | V217 A253 T256 N260 L261 V262 | V217-Q258 PolarHBondContact O-OE1 3.44Å; A253-Q258 PolarHBondContact O-N 3.13Å; T256-Q258 VanDerWaalsContact OG1-CD 3.31Å; T256-Q258 WeakPolarHBondContact OG1-CG 3.5Å; T256-Q258 PolarHBondContact OG1-NE2 2.92Å; Q258-N260 PolarHBondContact O-N 3.5Å; Q258-N260 VanDerWaalsContact O-N 3.09Å; Q258-L261 HydrophobicContact CB-CB 4.32Å; Q258-L261 HydrophobicContact CB-CG 4.33Å; Q258-L261 PolarHBondContact O-N 2.97Å; Q258-V262 PolarHBondContact O-N 3.49Å; Q258-V262 VanDerWaalsContact O-N 3.15Å | ||
| 259 | A | 94.8 | Very high | 94.7 | Very high | 20 Ų | 20 | 32.7 Ų | 32.7 | 17% | 0.165 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -52.6 | -33.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | K257 L261 V262 D263 E293 V297 | K257-A259 PolarHBondContact O-N 3.24Å; A259-L261 PolarHBondContact O-N 3.25Å; A259-V262 WeakPolarHBondContact O-CB 3.46Å; A259-V262 PolarHBondContact O-N 3.07Å; A259-D263 PolarHBondContact O-N 2.8Å; A259-E293 HydrophobicContact CB-CB 4.2Å; A259-V297 HydrophobicContact CB-CG2 4.28Å |
| 260 | N | 95.3 | Very high | 94.6 | Very high | 118 Ų | 118 | 32.9 Ų | 32.9 | 63% | 0.631 | 18% | 0.177 | S | C | * | . | H | α-helix | trans | -65.3 | -36.2 | 176.4 | -63.2 | -2.7 | 0 | 0 | 0 | 112.9 | L222 Q258 V264 | L222-N260 HydrophobicContact CD1-CB 4.16Å; Q258-N260 PolarHBondContact O-N 3.5Å; Q258-N260 VanDerWaalsContact O-N 3.09Å; N260-V264 VanDerWaalsContact O-CG2 3.31Å; N260-V264 WeakPolarHBondContact O-CG2 3.42Å; N260-V264 PolarHBondContact O-N 3.32Å; N260-V264 VanDerWaalsContact O-N 3.14Å |
| 261 | L | 95.4 | Very high | 94.4 | Very high | 3 Ų | 3 | 36.2 Ų | 36.2 | 2% | 0.016 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -76.8 | -31.8 | 175 | -66 | -163.1 | 0 | 0 | 0 | 111.8 | V217 L222 V225 A253 Q258 A259 V264 L265 | V217-L261 HydrophobicContact CB-CD1 4.19Å; V217-L261 HydrophobicContact CG1-CD1 4.08Å; V217-L261 HydrophobicContact CG2-CD1 4.09Å; L222-L261 HydrophobicContact CB-CD2 3.87Å; L222-L261 HydrophobicContact CD1-CD2 3.97Å; L222-L261 HydrophobicContact CG-CD2 3.95Å; V225-L261 HydrophobicContact CB-CD2 4.33Å; V225-L261 HydrophobicContact CG1-CD2 4.24Å; V225-L261 HydrophobicContact CG2-CD1 4.12Å; V225-L261 HydrophobicContact CG2-CD2 4.32Å; A253-L261 HydrophobicContact CB-CB 4.05Å; Q258-L261 HydrophobicContact CB-CB 4.32Å; Q258-L261 HydrophobicContact CB-CG 4.33Å; Q258-L261 PolarHBondContact O-N 2.97Å; A259-L261 PolarHBondContact O-N 3.25Å; L261-V264 PolarHBondContact O-N 3.22Å; L261-L265 VanDerWaalsContact O-CB 3.31Å; L261-L265 WeakPolarHBondContact O-CB 3.45Å; L261-L265 WeakPolarHBondContact O-CD1 3.35Å; L261-L265 VanDerWaalsContact O-CG 3.24Å; L261-L265 WeakPolarHBondContact O-CG 3.35Å; L261-L265 PolarHBondContact O-N 2.97Å |
| 262 | V | 95.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.5 | -47.4 | 171.2 | 176.1 | 0 | 0 | 0 | 0 | 110.1 | L250 A253 V254 Q258 A259 L265 L266 V297 L298 | L250-V262 HydrophobicContact CD1-CG1 4.08Å; A253-V262 HydrophobicContact CB-CG2 3.8Å; V254-V262 HydrophobicContact CG2-CG2 3.9Å; Q258-V262 PolarHBondContact O-N 3.49Å; Q258-V262 VanDerWaalsContact O-N 3.15Å; A259-V262 WeakPolarHBondContact O-CB 3.46Å; A259-V262 PolarHBondContact O-N 3.07Å; V262-L265 PolarHBondContact O-N 3.27Å; V262-L266 HydrophobicContact CG1-CD1 3.68Å; V262-L266 HydrophobicContact CG1-CG 4.44Å; V262-L266 WeakPolarHBondContact O-CB 3.41Å; V262-L266 WeakPolarHBondContact O-CD1 3.37Å; V262-L266 WeakPolarHBondContact O-CG 3.45Å; V262-L266 PolarHBondContact O-N 2.79Å; V262-V297 HydrophobicContact CB-CG1 4.38Å; V262-V297 HydrophobicContact CG1-CB 4.33Å; V262-V297 HydrophobicContact CG1-CG1 3.9Å; V262-L298 HydrophobicContact CG1-CD2 4.27Å; V262-L298 HydrophobicContact CG1-CG 3.92Å |
| 263 | D | 94.4 | Very high | 93.9 | Very high | 30 Ų | 30 | 37.6 Ų | 37.6 | 16% | 0.16 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58.7 | -47.5 | 175 | 175.8 | 72.6 | 0 | 0 | 0 | 112.4 | A259 R267 V297 F301 | A259-D263 PolarHBondContact O-N 2.8Å; D263-R267 VanDerWaalsContact CG-NH2 3.28Å; D263-R267 WeakPolarHBondContact O-CB 3.37Å; D263-R267 WeakPolarHBondContact O-CG 3.5Å; D263-R267 PolarHBondContact O-N 3.29Å; D263-R267 IonicContact OD1-CZ 3.05Å; D263-R267 IonicContact OD1-NE 3.4Å; D263-R267 PolarHBondContact OD1-NE 3.12Å; D263-R267 IonicContact OD1-NH1 3.67Å; D263-R267 IonicContact OD1-NH2 2.68Å; D263-R267 PolarHBondContact OD1-NH2 3.33Å; D263-R267 IonicContact OD2-CZ 2.95Å; D263-R267 IonicContact OD2-NE 3.67Å; D263-R267 IonicContact OD2-NH1 2.69Å; D263-R267 PolarHBondContact OD2-NH1 2.95Å; D263-R267 IonicContact OD2-NH2 3.12Å; D263-R267 PolarHBondContact OD2-NH2 3.33Å; D263-R267 VanDerWaalsContact OD2-NH2 3.12Å; D263-V297 HydrophobicContact CB-CG1 3.78Å; D263-F301 VanDerWaalsContact OD1-CE2 3.29Å; D263-F301 WeakPolarHBondContact OD1-CE2 3.26Å; D263-F301 WeakPolarHBondContact OD1-CZ 3.45Å |
| 264 | V | 95.3 | Very high | 93.8 | Very high | 15 Ų | 15 | 38.6 Ų | 38.6 | 9% | 0.091 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -65 | -40.8 | 179.3 | 167.9 | 0 | 0 | 0 | 0 | 112.5 | V225 H226 I229 N260 L261 A268 | V225-V264 HydrophobicContact CG1-CG1 4.43Å; H226-V264 VanDerWaalsContact CE1-CG1 3.47Å; H226-V264 WeakPolarHBondContact CE1-CG1 3.25Å; I229-V264 HydrophobicContact CD1-CG1 3.74Å; N260-V264 VanDerWaalsContact O-CG2 3.31Å; N260-V264 WeakPolarHBondContact O-CG2 3.42Å; N260-V264 PolarHBondContact O-N 3.32Å; N260-V264 VanDerWaalsContact O-N 3.14Å; L261-V264 PolarHBondContact O-N 3.22Å; V264-A268 VanDerWaalsContact O-CB 3.3Å; V264-A268 WeakPolarHBondContact O-CB 3.43Å; V264-A268 PolarHBondContact O-N 2.87Å; V264-A268 VanDerWaalsContact O-N 3.13Å |
| 265 | L | 94.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -70.1 | -40.8 | 179 | -73.9 | 165.5 | 0 | 0 | 0 | 112.1 | L213 V217 I229 P249 L250 A253 L261 V262 A268 G269 A270 | L213-L265 HydrophobicContact CD2-CD2 4.49Å; V217-L265 HydrophobicContact CG2-CD1 4.23Å; I229-L265 HydrophobicContact CD1-CD2 3.88Å; I229-L265 HydrophobicContact CG1-CD2 4.42Å; P249-L265 HydrophobicContact CB-CD1 4.13Å; P249-L265 HydrophobicContact CB-CD2 4.08Å; L250-L265 HydrophobicContact CD1-CB 4.25Å; A253-L265 HydrophobicContact CB-CD1 3.88Å; L261-L265 VanDerWaalsContact O-CB 3.31Å; L261-L265 WeakPolarHBondContact O-CB 3.45Å; L261-L265 WeakPolarHBondContact O-CD1 3.35Å; L261-L265 VanDerWaalsContact O-CG 3.24Å; L261-L265 WeakPolarHBondContact O-CG 3.35Å; L261-L265 PolarHBondContact O-N 2.97Å; V262-L265 PolarHBondContact O-N 3.27Å; L265-A268 CarbonylContact O-C 3.53Å; L265-A268 PolarHBondContact O-N 3.15Å; L265-G269 PolarHBondContact O-N 2.91Å; L265-A270 HydrophobicContact CB-CB 4.18Å; L265-A270 WeakPolarHBondContact O-CB 3.49Å; L265-A270 PolarHBondContact O-N 3.38Å |
| 266 | L | 93 | Very high | 93.7 | Very high | 17 Ų | 17 | 40.2 Ų | 40.2 | 9% | 0.089 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -66.6 | -43.8 | 176.6 | -68.2 | 166.2 | 0 | 0 | 0 | 111.5 | L250 V262 A268 G269 P272 V297 L298 F301 | L250-L266 HydrophobicContact CD1-CD2 4.25Å; L250-L266 HydrophobicContact CD1-CG 4.16Å; L250-L266 HydrophobicContact CD2-CD2 3.93Å; V262-L266 HydrophobicContact CG1-CD1 3.68Å; V262-L266 HydrophobicContact CG1-CG 4.44Å; V262-L266 WeakPolarHBondContact O-CB 3.41Å; V262-L266 WeakPolarHBondContact O-CD1 3.37Å; V262-L266 WeakPolarHBondContact O-CG 3.45Å; V262-L266 PolarHBondContact O-N 2.79Å; L266-A268 PolarHBondContact O-N 2.93Å; L266-G269 PolarHBondContact O-N 2.83Å; L266-P272 HydrophobicContact CD2-CB 4.18Å; L266-P272 HydrophobicContact CD2-CG 4.27Å; L266-V297 HydrophobicContact CD1-CG1 4.13Å; L266-L298 HydrophobicContact CD1-CD2 3.83Å; L266-L298 HydrophobicContact CD1-CG 4.25Å; L266-L298 HydrophobicContact CD2-CD2 4.08Å; L266-L298 HydrophobicContact CG-CD2 4.48Å; L266-F301 HydrophobicContact CB-CB 4.28Å; L266-F301 HydrophobicContact CB-CD1 4.37Å; L266-F301 HydrophobicContact CB-CD2 3.84Å; L266-F301 HydrophobicContact CB-CE2 4.31Å; L266-F301 HydrophobicContact CB-CG 3.89Å; L266-F301 HydrophobicContact CD1-CB 4.2Å; L266-F301 HydrophobicContact CD1-CD2 3.66Å; L266-F301 HydrophobicContact CD1-CE2 4.45Å; L266-F301 HydrophobicContact CD1-CG 4.18Å; L266-F301 HydrophobicContact CG-CD2 4.4Å |
| 267 | R | 91.9 | Very high | 93.7 | Very high | 171 Ų | 171 | 43.7 Ų | 43.7 | 65% | 0.645 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -60.3 | -26.7 | 172.2 | -75.3 | -176.8 | -176.7 | 142.7 | 17.5 | 113.5 | D263 G269 F301 | D263-R267 VanDerWaalsContact CG-NH2 3.28Å; D263-R267 WeakPolarHBondContact O-CB 3.37Å; D263-R267 WeakPolarHBondContact O-CG 3.5Å; D263-R267 PolarHBondContact O-N 3.29Å; D263-R267 IonicContact OD1-CZ 3.05Å; D263-R267 IonicContact OD1-NE 3.4Å; D263-R267 PolarHBondContact OD1-NE 3.12Å; D263-R267 IonicContact OD1-NH1 3.67Å; D263-R267 IonicContact OD1-NH2 2.68Å; D263-R267 PolarHBondContact OD1-NH2 3.33Å; D263-R267 IonicContact OD2-CZ 2.95Å; D263-R267 IonicContact OD2-NE 3.67Å; D263-R267 IonicContact OD2-NH1 2.69Å; D263-R267 PolarHBondContact OD2-NH1 2.95Å; D263-R267 IonicContact OD2-NH2 3.12Å; D263-R267 PolarHBondContact OD2-NH2 3.33Å; D263-R267 VanDerWaalsContact OD2-NH2 3.12Å; R267-G269 VanDerWaalsContact C-N 3.34Å; R267-F301 HydrophobicContact CG-CE1 3.59Å; R267-F301 HydrophobicContact CG-CZ 3.5Å |
| 268 | A | 91.9 | Very high | 93.6 | Very high | 19 Ų | 19 | 41.8 Ų | 41.8 | 16% | 0.157 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | -2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | I229 L233 L239 V264 L265 L266 | I229-A268 HydrophobicContact CD1-CB 4.2Å; I229-A268 HydrophobicContact CG2-CB 3.48Å; I229-A268 VanDerWaalsContact CG2-CB 3.48Å; L233-A268 HydrophobicContact CD1-CB 4.38Å; L239-A268 HydrophobicContact CD1-CB 3.52Å; L239-A268 WeakPolarHBondContact CD1-O 3.16Å; V264-A268 VanDerWaalsContact O-CB 3.3Å; V264-A268 WeakPolarHBondContact O-CB 3.43Å; V264-A268 PolarHBondContact O-N 2.87Å; V264-A268 VanDerWaalsContact O-N 3.13Å; L265-A268 CarbonylContact O-C 3.53Å; L265-A268 PolarHBondContact O-N 3.15Å; L266-A268 PolarHBondContact O-N 2.93Å |
| 269 | G | 90.4 | Very high | 93.6 | Very high | 60 Ų | 60 | 39.4 Ų | 39.4 | 62% | 0.619 | 21% | 0.214 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 90.2 | 25.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | L265 L266 R267 | L265-G269 PolarHBondContact O-N 2.91Å; L266-G269 PolarHBondContact O-N 2.83Å; R267-G269 VanDerWaalsContact C-N 3.34Å |
| 270 | A | 92.9 | Very high | 93.6 | Very high | 6 Ų | 6 | 39 Ų | 39 | 5% | 0.05 | 21% | 0.209 | C | C | . | . | trans | -70.8 | 135.4 | 167.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | L239 L250 L265 P272 | L239-A270 HydrophobicContact CB-CB 4.22Å; L239-A270 HydrophobicContact CD1-CB 4.29Å; L250-A270 HydrophobicContact CB-CB 4.43Å; L250-A270 HydrophobicContact CD2-CB 4.38Å; L265-A270 HydrophobicContact CB-CB 4.18Å; L265-A270 WeakPolarHBondContact O-CB 3.49Å; L265-A270 PolarHBondContact O-N 3.38Å; A270-P272 WeakPolarHBondContact O-CD 3.37Å | ||
| 271 | D | 91.4 | Very high | 93.6 | Very high | 70 Ų | 70 | 33.4 Ų | 33.4 | 37% | 0.374 | 18% | 0.179 | S | C | . | . | trans | -84.7 | 117.1 | -174.2 | 173.9 | 23.1 | 0 | 0 | 0 | 113 | D240 A273 V274 | D240-D271 PolarHBondContact OD1-N 2.97Å; D240-D271 PolarHBondContact OD2-N 3.37Å; D271-A273 PolarHBondContact O-N 2.68Å; D271-A273 VanDerWaalsContact OD1-CB 3.32Å; D271-A273 WeakPolarHBondContact OD1-CB 3.41Å; D271-A273 PolarHBondContact OD1-N 3.06Å; D271-V274 HydrophobicContact CB-CG2 3.81Å; D271-V274 WeakPolarHBondContact O-CG2 3.33Å; D271-V274 PolarHBondContact O-N 3.26Å | ||
| 272 | P | 91.7 | Very high | 93.5 | Very high | 15 Ų | 15 | 33.3 Ų | 33.3 | 10% | 0.097 | 18% | 0.178 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -9.3 | 177.3 | 31.4 | -36.7 | 0 | 0 | 0 | 114.5 | L250 L266 A270 T281 L298 | L250-P272 HydrophobicContact CD2-CB 4.22Å; L266-P272 HydrophobicContact CD2-CB 4.18Å; L266-P272 HydrophobicContact CD2-CG 4.27Å; A270-P272 WeakPolarHBondContact O-CD 3.37Å; P272-T281 WeakPolarHBondContact O-CB 3.37Å; P272-L298 HydrophobicContact CB-CD2 3.87Å |
| 273 | A | 91.6 | Very high | 93.4 | Very high | 29 Ų | 29 | 33.3 Ų | 33.3 | 24% | 0.24 | 18% | 0.178 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.7 | -6.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | D271 L275 C307 I310 | D271-A273 PolarHBondContact O-N 2.68Å; D271-A273 VanDerWaalsContact OD1-CB 3.32Å; D271-A273 WeakPolarHBondContact OD1-CB 3.41Å; D271-A273 PolarHBondContact OD1-N 3.06Å; A273-L275 WeakPolarHBondContact O-CD2 3.37Å; A273-C307 HydrophobicContact CB-CB 4.43Å; A273-I310 HydrophobicContact CB-CD1 3.7Å |
| 274 | V | 93.3 | Very high | 93.5 | Very high | 22 Ų | 22 | 31.9 Ų | 31.9 | 13% | 0.133 | 17% | 0.17 | C | C | . | . | trans | -61 | 146.1 | 176.7 | -178.9 | 0 | 0 | 0 | 0 | 110.7 | D240 H242 T248 H251 D271 | D240-V274 HydrophobicContact CB-CG2 4.11Å; H242-V274 VanDerWaalsContact NE2-CG1 3.33Å; H242-V274 WeakPolarHBondContact NE2-CG1 3.33Å; T248-V274 HydrophobicContact CG2-CB 4.46Å; T248-V274 HydrophobicContact CG2-CG1 3.7Å; H251-V274 PolarHBondContact CE1-O 2.76Å; H251-V274 VanDerWaalsContact CE1-O 3.25Å; H251-V274 PolarHBondContact NE2-O 2.64Å; D271-V274 HydrophobicContact CB-CG2 3.81Å; D271-V274 WeakPolarHBondContact O-CG2 3.33Å; D271-V274 PolarHBondContact O-N 3.26Å | ||
| 275 | L | 94.3 | Very high | 93.5 | Very high | 50 Ų | 50 | 31.2 Ų | 31.2 | 26% | 0.262 | 17% | 0.167 | S | C | . | . | trans | -111.5 | 131.5 | -172.7 | -53.4 | -177 | 0 | 0 | 0 | 111.7 | R246 A273 T281 I310 | R246-L275 VanDerWaalsContact CZ-O 3.27Å; R246-L275 PolarHBondContact NH1-O 3.15Å; A273-L275 WeakPolarHBondContact O-CD2 3.37Å; L275-T281 HydrophobicContact CD2-CG2 3.57Å; L275-I310 HydrophobicContact CD2-CG2 3.75Å | ||
| 276 | D | 95.1 | Very high | 93.5 | Very high | 1 Ų | 1 | 31.2 Ų | 31.2 | 1% | 0.005 | 17% | 0.167 | C | C | . | . | trans | -75.1 | -168.4 | 173.7 | 97.9 | -42.8 | 0 | 0 | 0 | 113.1 | R246 Q247 H278 G279 Q280 | R246-D276 PolarHBondContact NH1-O 3.22Å; R246-D276 WeakPolarHBondContact O-CA 3.3Å; Q247-D276 HydrophobicContact CG-CB 4.44Å; D276-H278 PolarHBondContact O-N 3.27Å; D276-H278 VanDerWaalsContact OD1-CA 3.32Å; D276-H278 WeakPolarHBondContact OD1-CA 3.26Å; D276-H278 WeakPolarHBondContact OD1-CB 3.42Å; D276-H278 PolarHBondContact OD1-N 3.1Å; D276-H278 IonicContact OD2-CD2 3.67Å; D276-H278 IonicContact OD2-CG 2.69Å; D276-H278 PolarHBondContact OD2-N 2.98Å; D276-G279 PolarHBondContact O-N 2.79Å; D276-G279 PolarHBondContact OD1-N 3.05Å; D276-G279 VanDerWaalsContact OD1-N 3.15Å; D276-Q280 PolarHBondContact N-O 2.91Å; D276-Q280 WeakPolarHBondContact OD1-CB 3.22Å; D276-Q280 PolarHBondContact OD1-N 3.22Å | ||
| 277 | R | 94.9 | Very high | 93.6 | Very high | 98 Ų | 98 | 30.4 Ų | 30.4 | 37% | 0.37 | 16% | 0.162 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.5 | -15.6 | 175.7 | 61.6 | 175.1 | -168.1 | -173.6 | -1.1 | 115.1 | L245 R246 F313 | L245-R277 VanDerWaalsContact O-CB 3.3Å; L245-R277 WeakPolarHBondContact O-CB 3.43Å; L245-R277 WeakPolarHBondContact O-CD 3.04Å; L245-R277 VanDerWaalsContact O-CG 3.26Å; L245-R277 WeakPolarHBondContact O-CG 3.49Å; R246-R277 HydrophobicContact CB-CB 4.03Å; R277-F313 WeakPolarHBondContact O-CE2 3.3Å |
| 278 | H | 93.9 | Very high | 93.7 | Very high | 83 Ų | 83 | 25.1 Ų | 25.1 | 38% | 0.384 | 15% | 0.145 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -103.7 | 3.5 | 176.4 | -57.6 | -48.8 | 0 | 0 | 0 | 112.1 | D276 Q280 F313 | D276-H278 PolarHBondContact O-N 3.27Å; D276-H278 VanDerWaalsContact OD1-CA 3.32Å; D276-H278 WeakPolarHBondContact OD1-CA 3.26Å; D276-H278 WeakPolarHBondContact OD1-CB 3.42Å; D276-H278 PolarHBondContact OD1-N 3.1Å; D276-H278 IonicContact OD2-CD2 3.67Å; D276-H278 IonicContact OD2-CG 2.69Å; D276-H278 PolarHBondContact OD2-N 2.98Å; H278-Q280 VanDerWaalsContact C-N 3.26Å; H278-Q280 HydrophobicContact CB-CG 4.01Å; H278-Q280 PolarHBondContact CD2-OE1 3.46Å; H278-F313 WeakPolarHBondContact O-CB 3.29Å; H278-F313 WeakPolarHBondContact O-CG 3.34Å; H278-F313 PolarHBondContact O-N 3.15Å |
| 279 | G | 94.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 15% | 0.147 | C | C | . | . | S | Bend | trans | 76 | 13.1 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | D276 N312 | D276-G279 PolarHBondContact O-N 2.79Å; D276-G279 PolarHBondContact OD1-N 3.05Å; D276-G279 VanDerWaalsContact OD1-N 3.15Å; G279-N312 WeakPolarHBondContact O-CA 3.4Å |
| 280 | Q | 95.1 | Very high | 93.9 | Very high | 13 Ų | 13 | 29.8 Ų | 29.8 | 6% | 0.061 | 15% | 0.145 | C | C | . | . | trans | -83.7 | 136 | -178.1 | -65.4 | 176.8 | -83.6 | 0 | 0 | 110.3 | H251 D276 H278 H284 L285 E288 N312 | H251-Q280 PolarHBondContact NE2-O 3.36Å; D276-Q280 PolarHBondContact N-O 2.91Å; D276-Q280 WeakPolarHBondContact OD1-CB 3.22Å; D276-Q280 PolarHBondContact OD1-N 3.22Å; H278-Q280 VanDerWaalsContact C-N 3.26Å; H278-Q280 HydrophobicContact CB-CG 4.01Å; H278-Q280 PolarHBondContact CD2-OE1 3.46Å; Q280-H284 HydrophobicContact CB-CB 3.77Å; Q280-H284 HydrophobicContact CG-CB 4.02Å; Q280-L285 HydrophobicContact CB-CD2 4.06Å; Q280-L285 HydrophobicContact CB-CG 4.3Å; Q280-E288 PolarHBondContact NE2-OE2 3.1Å; Q280-N312 HydrophobicContact CG-CB 4.1Å | ||
| 281 | T | 94.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 15% | 0.147 | C | C | . | . | trans | -86.4 | 170.1 | 165.2 | 62.9 | 0 | 0 | 0 | 0 | 111 | P272 L275 L283 H284 L285 I310 | P272-T281 WeakPolarHBondContact O-CB 3.37Å; L275-T281 HydrophobicContact CD2-CG2 3.57Å; T281-L283 PolarHBondContact O-N 3.34Å; T281-L283 VanDerWaalsContact O-N 3.14Å; T281-L283 PolarHBondContact OG1-N 3.44Å; T281-H284 PolarHBondContact N-ND1 3.18Å; T281-H284 WeakPolarHBondContact O-CB 3.39Å; T281-H284 PolarHBondContact O-N 3.45Å; T281-H284 PolarHBondContact OG1-ND1 3Å; T281-L285 PolarHBondContact O-N 3.2Å; T281-L285 VanDerWaalsContact O-N 3.15Å; T281-I310 HydrophobicContact CG2-CB 4.23Å; T281-I310 HydrophobicContact CG2-CD1 3.92Å; T281-I310 HydrophobicContact CG2-CG2 3.75Å | ||
| 282 | A | 93.8 | Very high | 94 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -48.6 | -38.7 | 169.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | L250 H251 V254 L285 C286 L298 | L250-A282 HydrophobicContact CD2-CB 4.25Å; L250-A282 HydrophobicContact CG-CB 4.19Å; H251-A282 PolarHBondContact NE2-N 3.39Å; V254-A282 HydrophobicContact CG2-CB 4.18Å; A282-L285 PolarHBondContact O-N 3.16Å; A282-C286 PolarHBondContact O-N 2.91Å; A282-C286 PolarHBondContact O-SG 3.16Å; A282-C286 VanDerWaalsContact O-SG 3.36Å; A282-L298 HydrophobicContact CB-CD1 3.85Å; A282-L298 HydrophobicContact CB-CD2 3.79Å |
| 283 | L | 94.2 | Very high | 94.1 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.2 | -42 | 175.6 | -70.8 | 177.6 | 0 | 0 | 0 | 113.2 | T281 L285 C286 C287 L295 L298 L299 C307 L308 P318 | T281-L283 PolarHBondContact O-N 3.34Å; T281-L283 VanDerWaalsContact O-N 3.14Å; T281-L283 PolarHBondContact OG1-N 3.44Å; L283-L285 VanDerWaalsContact C-N 3.31Å; L283-L285 PolarHBondContact O-N 3.36Å; L283-C286 WeakPolarHBondContact O-CB 3.27Å; L283-C286 PolarHBondContact O-N 3.09Å; L283-C287 PolarHBondContact O-N 3.37Å; L283-C287 PolarHBondContact O-SG 3.3Å; L283-L295 HydrophobicContact CD2-CD1 3.7Å; L283-L298 HydrophobicContact CD2-CB 3.77Å; L283-L298 HydrophobicContact CD2-CD1 4.08Å; L283-L298 HydrophobicContact CD2-CG 4.49Å; L283-L299 HydrophobicContact CD1-CD2 4.42Å; L283-L299 HydrophobicContact CD2-CD2 3.95Å; L283-L299 HydrophobicContact CD2-CG 4.25Å; L283-C307 HydrophobicContact CD1-CB 4.28Å; L283-C307 WeakPolarHBondContact CD1-SG 3.26Å; L283-L308 HydrophobicContact CD1-CD2 4.03Å; L283-P318 HydrophobicContact CB-CB 4.26Å; L283-P318 HydrophobicContact CB-CG 3.92Å |
| 284 | H | 95.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60 | -43.5 | 176.5 | -70.4 | 83.5 | 0 | 0 | 0 | 111 | Q280 T281 C286 C287 E288 I310 N312 L316 L321 | Q280-H284 HydrophobicContact CB-CB 3.77Å; Q280-H284 HydrophobicContact CG-CB 4.02Å; T281-H284 PolarHBondContact N-ND1 3.18Å; T281-H284 WeakPolarHBondContact O-CB 3.39Å; T281-H284 PolarHBondContact O-N 3.45Å; T281-H284 PolarHBondContact OG1-ND1 3Å; H284-C286 VanDerWaalsContact C-N 3.34Å; H284-C286 PolarHBondContact O-N 2.86Å; H284-C287 PolarHBondContact O-N 3.34Å; H284-C287 VanDerWaalsContact O-N 3.16Å; H284-E288 PolarHBondContact O-N 3.47Å; H284-I310 PolarHBondContact CE1-O 2.96Å; H284-I310 PolarHBondContact NE2-O 3.43Å; H284-N312 PolarHBondContact NE2-N 2.84Å; H284-L316 PolarHBondContact NE2-O 2.69Å; H284-L316 VanDerWaalsContact NE2-O 3.11Å; H284-L321 HydrophobicContact CB-CD1 3.88Å |
| 285 | L | 94.9 | Very high | 94.3 | Very high | 2 Ų | 2 | 32.3 Ų | 32.3 | 1% | 0.01 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -65.3 | -35.3 | 177.5 | -60.2 | 175.7 | 0 | 0 | 0 | 112 | H251 V254 I255 Q280 T281 A282 L283 C287 Y289 | H251-L285 HydrophobicContact CB-CD1 3.99Å; V254-L285 HydrophobicContact CG1-CB 3.7Å; I255-L285 HydrophobicContact CD1-CD1 4.23Å; I255-L285 HydrophobicContact CG1-CD1 4.24Å; Q280-L285 HydrophobicContact CB-CD2 4.06Å; Q280-L285 HydrophobicContact CB-CG 4.3Å; T281-L285 PolarHBondContact O-N 3.2Å; T281-L285 VanDerWaalsContact O-N 3.15Å; A282-L285 PolarHBondContact O-N 3.16Å; L283-L285 VanDerWaalsContact C-N 3.31Å; L283-L285 PolarHBondContact O-N 3.36Å; L285-C287 VanDerWaalsContact C-N 3.33Å; L285-Y289 HydrophobicContact CB-CD2 4.39Å; L285-Y289 HydrophobicContact CB-CE2 4.43Å; L285-Y289 HydrophobicContact CD2-CE2 4.17Å; L285-Y289 VanDerWaalsContact O-CD2 3.3Å; L285-Y289 WeakPolarHBondContact O-CD2 3.23Å; L285-Y289 PolarHBondContact O-N 3.1Å |
| 286 | C | 94.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.9 | -36.9 | 171.4 | -71.5 | 0 | 0 | 0 | 0 | 113 | V254 A282 L283 H284 Q290 L291 C294 L295 L298 | V254-C286 WeakPolarHBondContact CG1-SG 3.39Å; A282-C286 PolarHBondContact O-N 2.91Å; A282-C286 PolarHBondContact O-SG 3.16Å; A282-C286 VanDerWaalsContact O-SG 3.36Å; L283-C286 WeakPolarHBondContact O-CB 3.27Å; L283-C286 PolarHBondContact O-N 3.09Å; H284-C286 VanDerWaalsContact C-N 3.34Å; H284-C286 PolarHBondContact O-N 2.86Å; C286-Q290 PolarHBondContact O-N 2.94Å; C286-L291 HydrophobicContact CB-CB 4.29Å; C286-L291 PolarHBondContact O-N 3.36Å; C286-C294 VanDerWaalsContact SG-CB 3.52Å; C286-L295 HydrophobicContact CB-CB 4.06Å; C286-L295 HydrophobicContact CB-CD1 3.77Å; C286-L298 VanDerWaalsContact SG-CD1 3.51Å |
| 287 | C | 94.7 | Very high | 94.1 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -71.6 | -39.9 | 177.5 | -63 | 0 | 0 | 0 | 0 | 112.6 | L283 H284 L285 P318 L321 A322 H327 | L283-C287 PolarHBondContact O-N 3.37Å; L283-C287 PolarHBondContact O-SG 3.3Å; H284-C287 PolarHBondContact O-N 3.34Å; H284-C287 VanDerWaalsContact O-N 3.16Å; L285-C287 VanDerWaalsContact C-N 3.33Å; C287-P318 PolarHBondContact SG-O 3.39Å; C287-P318 VanDerWaalsContact SG-O 3.4Å; C287-L321 HydrophobicContact CB-CB 3.94Å; C287-A322 HydrophobicContact CB-CB 4.4Å; C287-H327 PolarHBondContact O-ND1 3.16Å |
| 288 | E | 93.8 | Very high | 94 | Very high | 60 Ų | 60 | 27.7 Ų | 27.7 | 28% | 0.28 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -64.6 | -51.5 | 175.2 | -174.6 | -175.2 | 146.7 | 0 | 0 | 112.1 | Q280 H284 Q290 | Q280-E288 PolarHBondContact NE2-OE2 3.1Å; H284-E288 PolarHBondContact O-N 3.47Å; E288-Q290 VanDerWaalsContact C-N 3.29Å; E288-Q290 PolarHBondContact O-N 3.29Å |
| 289 | Y | 92.8 | Very high | 93.8 | Very high | 52 Ų | 52 | 25.1 Ų | 25.1 | 20% | 0.204 | 12% | 0.123 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.6 | 9.3 | -174.9 | -61.2 | -49.6 | 0 | 0 | 0 | 115.1 | I255 K257 L285 L291 | I255-Y289 HydrophobicContact CG1-CE2 3.91Å; K257-Y289 PolarHBondContact NZ-O 3.42Å; K257-Y289 VanDerWaalsContact NZ-O 3.13Å; L285-Y289 HydrophobicContact CB-CD2 4.39Å; L285-Y289 HydrophobicContact CB-CE2 4.43Å; L285-Y289 HydrophobicContact CD2-CE2 4.17Å; L285-Y289 VanDerWaalsContact O-CD2 3.3Å; L285-Y289 WeakPolarHBondContact O-CD2 3.23Å; L285-Y289 PolarHBondContact O-N 3.1Å; Y289-L291 VanDerWaalsContact O-CD2 3.22Å; Y289-L291 WeakPolarHBondContact O-CD2 3.49Å; Y289-L291 WeakPolarHBondContact O-CG 3.31Å |
| 290 | Q | 93.9 | Very high | 93.5 | Very high | 124 Ų | 124 | 28.8 Ų | 28.8 | 58% | 0.579 | 15% | 0.149 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 60.4 | 40.1 | 177.9 | -154.8 | -177.4 | 29.5 | 0 | 0 | 114.8 | C286 E288 L292 H327 L330 | C286-Q290 PolarHBondContact O-N 2.94Å; E288-Q290 VanDerWaalsContact C-N 3.29Å; E288-Q290 PolarHBondContact O-N 3.29Å; Q290-L292 PolarHBondContact O-N 3.21Å; Q290-H327 PolarHBondContact NE2-CD2 3.28Å; Q290-H327 VanDerWaalsContact NE2-CD2 3.28Å; Q290-H327 PolarHBondContact NE2-NE2 3.07Å; Q290-L330 HydrophobicContact CG-CD1 4.22Å |
| 291 | L | 93.8 | Very high | 92.8 | Very high | 16 Ų | 16 | 31.8 Ų | 31.8 | 8% | 0.084 | 16% | 0.162 | C | C | . | . | trans | -96.8 | 75 | -166.3 | -53.6 | 178.6 | 0 | 0 | 0 | 112.9 | V254 K257 C286 Y289 E293 C294 L295 | V254-L291 HydrophobicContact CG1-CD1 3.73Å; V254-L291 WeakPolarHBondContact O-CD1 3.48Å; K257-L291 HydrophobicContact CB-CD2 4.01Å; K257-L291 HydrophobicContact CD-CD2 3.47Å; K257-L291 VanDerWaalsContact CD-CD2 3.47Å; K257-L291 HydrophobicContact CG-CD1 4.16Å; K257-L291 HydrophobicContact CG-CD2 3.58Å; C286-L291 HydrophobicContact CB-CB 4.29Å; C286-L291 PolarHBondContact O-N 3.36Å; Y289-L291 VanDerWaalsContact O-CD2 3.22Å; Y289-L291 WeakPolarHBondContact O-CD2 3.49Å; Y289-L291 WeakPolarHBondContact O-CG 3.31Å; L291-E293 VanDerWaalsContact C-N 3.28Å; L291-E293 PolarHBondContact O-N 2.97Å; L291-C294 HydrophobicContact CB-CB 3.96Å; L291-C294 PolarHBondContact O-N 3.19Å; L291-L295 VanDerWaalsContact O-CB 3.31Å; L291-L295 WeakPolarHBondContact O-CB 3.44Å; L291-L295 PolarHBondContact O-N 3.23Å | ||
| 292 | L | 93.8 | Very high | 91.5 | Very high | 52 Ų | 52 | 32.7 Ų | 32.7 | 27% | 0.272 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -55.8 | -39.4 | -178.9 | -172.7 | 66.3 | 0 | 0 | 0 | 113.1 | Q290 S296 N329 L330 K333 | Q290-L292 PolarHBondContact O-N 3.21Å; L292-S296 WeakPolarHBondContact O-CB 3.48Å; L292-S296 PolarHBondContact O-N 3.43Å; L292-S296 PolarHBondContact O-OG 2.99Å; L292-N329 HydrophobicContact CD1-CB 4.48Å; L292-L330 HydrophobicContact CB-CD2 4.01Å; L292-L330 HydrophobicContact CD1-CD2 3.82Å; L292-K333 HydrophobicContact CD1-CD 3.84Å; L292-K333 HydrophobicContact CD1-CG 3.99Å |
| 293 | E | 94.3 | Very high | 89.8 | Confident | 123 Ų | 123 | 38.1 Ų | 38.1 | 58% | 0.575 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -70.5 | -48.1 | -179.7 | -55.9 | -45.2 | 115.8 | 0 | 0 | 112 | A259 L291 L295 S296 V297 | A259-E293 HydrophobicContact CB-CB 4.2Å; L291-E293 VanDerWaalsContact C-N 3.28Å; L291-E293 PolarHBondContact O-N 2.97Å; E293-L295 VanDerWaalsContact C-N 3.3Å; E293-L295 PolarHBondContact O-N 2.88Å; E293-S296 WeakPolarHBondContact O-CB 3.48Å; E293-S296 PolarHBondContact O-N 3.15Å; E293-S296 VanDerWaalsContact O-N 3.1Å; E293-V297 WeakPolarHBondContact O-CG2 3.48Å; E293-V297 PolarHBondContact O-N 3.21Å |
| 294 | C | 93.3 | Very high | 87.7 | Confident | 4 Ų | 4 | 43.8 Ų | 43.8 | 3% | 0.027 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.2 | -38.7 | 175.9 | -59.3 | 0 | 0 | 0 | 0 | 111.7 | C286 L291 S296 V297 L298 | C286-C294 VanDerWaalsContact SG-CB 3.52Å; L291-C294 HydrophobicContact CB-CB 3.96Å; L291-C294 PolarHBondContact O-N 3.19Å; C294-S296 VanDerWaalsContact C-N 3.35Å; C294-V297 PolarHBondContact O-N 3.14Å; C294-L298 WeakPolarHBondContact O-CB 3.44Å; C294-L298 WeakPolarHBondContact O-CD1 3.33Å; C294-L298 WeakPolarHBondContact O-CG 3.5Å; C294-L298 PolarHBondContact O-N 3.06Å |
| 295 | L | 94 | Very high | 85.8 | Confident | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 172.6 | -167.9 | 84.5 | 0 | 0 | 0 | 111 | L283 C286 L291 E293 V297 L298 L299 L330 K333 L334 | L283-L295 HydrophobicContact CD2-CD1 3.7Å; C286-L295 HydrophobicContact CB-CB 4.06Å; C286-L295 HydrophobicContact CB-CD1 3.77Å; L291-L295 VanDerWaalsContact O-CB 3.31Å; L291-L295 WeakPolarHBondContact O-CB 3.44Å; L291-L295 PolarHBondContact O-N 3.23Å; E293-L295 VanDerWaalsContact C-N 3.3Å; E293-L295 PolarHBondContact O-N 2.88Å; L295-V297 VanDerWaalsContact C-N 3.34Å; L295-V297 PolarHBondContact O-N 3.47Å; L295-L298 PolarHBondContact O-N 2.99Å; L295-L299 HydrophobicContact CD2-CD1 4.05Å; L295-L299 HydrophobicContact CG-CD1 3.82Å; L295-L299 HydrophobicContact CG-CG 4.32Å; L295-L299 WeakPolarHBondContact O-CB 3.4Å; L295-L299 VanDerWaalsContact O-CG 3.23Å; L295-L299 WeakPolarHBondContact O-CG 3.48Å; L295-L299 PolarHBondContact O-N 2.86Å; L295-L330 HydrophobicContact CD2-CB 4.29Å; L295-L330 HydrophobicContact CD2-CD2 3.91Å; L295-K333 HydrophobicContact CD2-CB 3.77Å; L295-L334 HydrophobicContact CD1-CD2 4.22Å |
| 296 | S | 92.9 | Very high | 84.3 | Confident | 25 Ų | 25 | 51.1 Ų | 51.1 | 18% | 0.175 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62 | -41.8 | 180 | -58.9 | 0 | 0 | 0 | 0 | 112.2 | L292 E293 C294 S300 K333 | L292-S296 WeakPolarHBondContact O-CB 3.48Å; L292-S296 PolarHBondContact O-N 3.43Å; L292-S296 PolarHBondContact O-OG 2.99Å; E293-S296 WeakPolarHBondContact O-CB 3.48Å; E293-S296 PolarHBondContact O-N 3.15Å; E293-S296 VanDerWaalsContact O-N 3.1Å; C294-S296 VanDerWaalsContact C-N 3.35Å; S296-S300 WeakPolarHBondContact O-CB 3.42Å; S296-S300 PolarHBondContact O-N 3.45Å; S296-S300 VanDerWaalsContact O-N 3.14Å; S296-S300 PolarHBondContact O-OG 3.3Å; S296-K333 PolarHBondContact OG-NZ 3.48Å |
| 297 | V | 93 | Very high | 83.5 | Confident | 27 Ų | 27 | 51.2 Ų | 51.2 | 16% | 0.164 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -64.2 | -53.5 | 174.6 | 175.7 | 0 | 0 | 0 | 0 | 110.4 | A259 V262 D263 L266 E293 C294 L295 L299 S300 F301 | A259-V297 HydrophobicContact CB-CG2 4.28Å; V262-V297 HydrophobicContact CB-CG1 4.38Å; V262-V297 HydrophobicContact CG1-CB 4.33Å; V262-V297 HydrophobicContact CG1-CG1 3.9Å; D263-V297 HydrophobicContact CB-CG1 3.78Å; L266-V297 HydrophobicContact CD1-CG1 4.13Å; E293-V297 WeakPolarHBondContact O-CG2 3.48Å; E293-V297 PolarHBondContact O-N 3.21Å; C294-V297 PolarHBondContact O-N 3.14Å; L295-V297 VanDerWaalsContact C-N 3.34Å; L295-V297 PolarHBondContact O-N 3.47Å; V297-L299 PolarHBondContact O-N 2.99Å; V297-S300 PolarHBondContact O-N 3.23Å; V297-S300 VanDerWaalsContact O-N 3.07Å; V297-S300 PolarHBondContact O-OG 3.21Å; V297-F301 HydrophobicContact CG1-CD2 4.14Å; V297-F301 HydrophobicContact CG1-CE2 4Å; V297-F301 WeakPolarHBondContact O-CD2 3.4Å; V297-F301 PolarHBondContact O-N 3.19Å |
| 298 | L | 92.1 | Very high | 83.2 | Confident | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -52.2 | -51.6 | 178.4 | -79.1 | 158.5 | 0 | 0 | 0 | 112.1 | V254 V262 L266 P272 A282 L283 C286 C294 L295 S300 F301 S302 | V254-L298 HydrophobicContact CG2-CD1 4.25Å; V262-L298 HydrophobicContact CG1-CD2 4.27Å; V262-L298 HydrophobicContact CG1-CG 3.92Å; L266-L298 HydrophobicContact CD1-CD2 3.83Å; L266-L298 HydrophobicContact CD1-CG 4.25Å; L266-L298 HydrophobicContact CD2-CD2 4.08Å; L266-L298 HydrophobicContact CG-CD2 4.48Å; P272-L298 HydrophobicContact CB-CD2 3.87Å; A282-L298 HydrophobicContact CB-CD1 3.85Å; A282-L298 HydrophobicContact CB-CD2 3.79Å; L283-L298 HydrophobicContact CD2-CB 3.77Å; L283-L298 HydrophobicContact CD2-CD1 4.08Å; L283-L298 HydrophobicContact CD2-CG 4.49Å; C286-L298 VanDerWaalsContact SG-CD1 3.51Å; C294-L298 WeakPolarHBondContact O-CB 3.44Å; C294-L298 WeakPolarHBondContact O-CD1 3.33Å; C294-L298 WeakPolarHBondContact O-CG 3.5Å; C294-L298 PolarHBondContact O-N 3.06Å; L295-L298 PolarHBondContact O-N 2.99Å; L298-S300 VanDerWaalsContact C-N 3.26Å; L298-S300 PolarHBondContact O-N 3.25Å; L298-F301 PolarHBondContact O-N 3.28Å; L298-F301 VanDerWaalsContact O-N 3.07Å; L298-S302 PolarHBondContact O-N 2.96Å; L298-S302 PolarHBondContact O-OG 3.17Å |
| 299 | L | 90.3 | Very high | 83 | Confident | 29 Ų | 29 | 51.9 Ų | 51.9 | 15% | 0.152 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.3 | -29.1 | -179 | -65.3 | 174.9 | 0 | 0 | 0 | 113 | L283 L295 V297 F301 L308 K333 A337 | L283-L299 HydrophobicContact CD1-CD2 4.42Å; L283-L299 HydrophobicContact CD2-CD2 3.95Å; L283-L299 HydrophobicContact CD2-CG 4.25Å; L295-L299 HydrophobicContact CD2-CD1 4.05Å; L295-L299 HydrophobicContact CG-CD1 3.82Å; L295-L299 HydrophobicContact CG-CG 4.32Å; L295-L299 WeakPolarHBondContact O-CB 3.4Å; L295-L299 VanDerWaalsContact O-CG 3.23Å; L295-L299 WeakPolarHBondContact O-CG 3.48Å; L295-L299 PolarHBondContact O-N 2.86Å; V297-L299 PolarHBondContact O-N 2.99Å; L299-F301 VanDerWaalsContact C-N 3.29Å; L299-F301 PolarHBondContact O-N 3.33Å; L299-L308 HydrophobicContact CD2-CD2 3.66Å; L299-K333 HydrophobicContact CD1-CB 4.17Å; L299-K333 WeakPolarHBondContact CD1-O 3.35Å; L299-A337 HydrophobicContact CD1-CB 4.1Å; L299-A337 HydrophobicContact CD2-CB 3.92Å; L299-A337 HydrophobicContact CG-CB 4.42Å |
| 300 | S | 88.7 | Confident | 83 | Confident | 78 Ų | 78 | 51.5 Ų | 51.5 | 55% | 0.545 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -71.2 | -20.5 | 175 | 72.4 | 0 | 0 | 0 | 0 | 114.3 | S296 V297 L298 | S296-S300 WeakPolarHBondContact O-CB 3.42Å; S296-S300 PolarHBondContact O-N 3.45Å; S296-S300 VanDerWaalsContact O-N 3.14Å; S296-S300 PolarHBondContact O-OG 3.3Å; V297-S300 PolarHBondContact O-N 3.23Å; V297-S300 VanDerWaalsContact O-N 3.07Å; V297-S300 PolarHBondContact O-OG 3.21Å; L298-S300 VanDerWaalsContact C-N 3.26Å; L298-S300 PolarHBondContact O-N 3.25Å |
| 301 | F | 80.8 | Confident | 83 | Confident | 76 Ų | 76 | 49.4 Ų | 49.4 | 33% | 0.333 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -97.6 | -23.8 | 173.3 | -73.5 | -76.7 | 0 | 0 | 0 | 113.7 | D263 L266 R267 V297 L298 L299 S303 | D263-F301 VanDerWaalsContact OD1-CE2 3.29Å; D263-F301 WeakPolarHBondContact OD1-CE2 3.26Å; D263-F301 WeakPolarHBondContact OD1-CZ 3.45Å; L266-F301 HydrophobicContact CB-CB 4.28Å; L266-F301 HydrophobicContact CB-CD1 4.37Å; L266-F301 HydrophobicContact CB-CD2 3.84Å; L266-F301 HydrophobicContact CB-CE2 4.31Å; L266-F301 HydrophobicContact CB-CG 3.89Å; L266-F301 HydrophobicContact CD1-CB 4.2Å; L266-F301 HydrophobicContact CD1-CD2 3.66Å; L266-F301 HydrophobicContact CD1-CE2 4.45Å; L266-F301 HydrophobicContact CD1-CG 4.18Å; L266-F301 HydrophobicContact CG-CD2 4.4Å; R267-F301 HydrophobicContact CG-CE1 3.59Å; R267-F301 HydrophobicContact CG-CZ 3.5Å; V297-F301 HydrophobicContact CG1-CD2 4.14Å; V297-F301 HydrophobicContact CG1-CE2 4Å; V297-F301 WeakPolarHBondContact O-CD2 3.4Å; V297-F301 PolarHBondContact O-N 3.19Å; L298-F301 PolarHBondContact O-N 3.28Å; L298-F301 VanDerWaalsContact O-N 3.07Å; L299-F301 VanDerWaalsContact C-N 3.29Å; L299-F301 PolarHBondContact O-N 3.33Å; F301-S303 PolarHBondContact O-N 2.86Å |
| 302 | S | 67.1 | Low | 83 | Confident | 19 Ų | 19 | 49.1 Ų | 49.1 | 13% | 0.133 | 29% | 0.285 | C | S | . | . | trans | -70.1 | 15.9 | -176.1 | -63.6 | 0 | 0 | 0 | 0 | 115.8 | L298 S304 S305 C307 | L298-S302 PolarHBondContact O-N 2.96Å; L298-S302 PolarHBondContact O-OG 3.17Å; S302-S304 PolarHBondContact O-N 2.87Å; S302-S305 PolarHBondContact O-N 3.31Å; S302-C307 PolarHBondContact OG-SG 3.28Å | ||
| 303 | S | 57.8 | Low | 83 | Confident | 113 Ų | 113 | 53.1 Ų | 53.1 | 79% | 0.79 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -0 | -178.6 | -47.8 | 0 | 0 | 0 | 0 | 115.4 | F301 | F301-S303 PolarHBondContact O-N 2.86Š|
| 304 | S | 50.3 | Low | 83 | Confident | 120 Ų | 120 | 51.9 Ų | 51.9 | 84% | 0.839 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -129.1 | 3.9 | -179.4 | -168.5 | 0 | 0 | 0 | 0 | 114.8 | S302 | S302-S304 PolarHBondContact O-N 2.87Š|
| 305 | S | 55.3 | Low | 83 | Confident | 48 Ų | 48 | 51.8 Ų | 51.8 | 34% | 0.336 | 30% | 0.295 | S | S | . | . | trans | -152 | 132.6 | 177.1 | 58.2 | 0 | 0 | 0 | 0 | 113.8 | S302 C307 | S302-S305 PolarHBondContact O-N 3.31Å; S305-C307 PolarHBondContact O-N 3.08Å | ||
| 306 | P | 62.8 | Low | 83.1 | Confident | 107 Ų | 107 | 52.4 Ų | 52.4 | 70% | 0.695 | 30% | 0.298 | S | S | * | . | trans | -82.3 | 58.4 | -176.7 | 35.3 | -37.3 | 0 | 0 | 0 | 112.2 | L308 E309 | P306-L308 PolarHBondContact O-N 2.92Å; P306-E309 PolarHBondContact O-N 2.99Å | ||
| 307 | C | 78.6 | Confident | 83.2 | Confident | 2 Ų | 2 | 51.2 Ų | 51.2 | 1% | 0.014 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -2.7 | 176.5 | 56.8 | 0 | 0 | 0 | 0 | 114.1 | A273 L283 S302 S305 I310 | A273-C307 HydrophobicContact CB-CB 4.43Å; L283-C307 HydrophobicContact CD1-CB 4.28Å; L283-C307 WeakPolarHBondContact CD1-SG 3.26Å; S302-C307 PolarHBondContact OG-SG 3.28Å; S305-C307 PolarHBondContact O-N 3.08Å; C307-I310 HydrophobicContact CB-CD1 3.89Å |
| 308 | L | 87.8 | Confident | 83.3 | Confident | 20 Ų | 20 | 50 Ų | 50 | 11% | 0.105 | 28% | 0.282 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | -35 | 171.9 | -59.3 | 170.8 | 0 | 0 | 0 | 113.2 | L283 L299 P306 P318 L334 A337 A339 | L283-L308 HydrophobicContact CD1-CD2 4.03Å; L299-L308 HydrophobicContact CD2-CD2 3.66Å; P306-L308 PolarHBondContact O-N 2.92Å; L308-P318 VanDerWaalsContact O-CD 3.25Å; L308-P318 WeakPolarHBondContact O-CD 3.41Å; L308-L334 HydrophobicContact CD2-CD2 3.7Å; L308-A337 HydrophobicContact CD1-CB 4.41Å; L308-A337 WeakPolarHBondContact CD1-O 3.22Å; L308-A339 HydrophobicContact CB-CB 4.12Å; L308-A339 HydrophobicContact CD1-CB 4.22Å; L308-A339 HydrophobicContact CD2-CB 4.39Å; L308-A339 HydrophobicContact CG-CB 4.48Å |
| 309 | E | 90.5 | Very high | 83.5 | Confident | 54 Ų | 54 | 50 Ų | 50 | 25% | 0.252 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -100.8 | 2.5 | -173.5 | -60.6 | -48.2 | 132.5 | 0 | 0 | 114.4 | P306 R311 A339 D340 A343 | P306-E309 PolarHBondContact O-N 2.99Å; E309-R311 PolarHBondContact O-NH1 3.11Å; E309-A339 WeakPolarHBondContact OE1-CA 3.47Å; E309-D340 PolarHBondContact OE1-N 3.15Å; E309-A343 WeakPolarHBondContact OE2-CB 3.34Å |
| 310 | I | 92.3 | Very high | 83.7 | Confident | 45 Ų | 45 | 48.7 Ų | 48.7 | 23% | 0.231 | 28% | 0.275 | C | S | . | . | trans | -62.2 | 139.1 | 167.1 | -62.6 | 174.6 | 0 | 0 | 0 | 108 | A273 L275 T281 H284 C307 | A273-I310 HydrophobicContact CB-CD1 3.7Å; L275-I310 HydrophobicContact CD2-CG2 3.75Å; T281-I310 HydrophobicContact CG2-CB 4.23Å; T281-I310 HydrophobicContact CG2-CD1 3.92Å; T281-I310 HydrophobicContact CG2-CG2 3.75Å; H284-I310 PolarHBondContact CE1-O 2.96Å; H284-I310 PolarHBondContact NE2-O 3.43Å; C307-I310 HydrophobicContact CB-CD1 3.89Å | ||
| 311 | R | 93.4 | Very high | 84.1 | Confident | 79 Ų | 79 | 45.7 Ų | 45.7 | 30% | 0.298 | 25% | 0.253 | S | S | . | . | trans | -119 | 139.1 | 180 | -64.4 | 173.4 | 174.6 | 69.9 | -11 | 110.2 | E309 L316 M344 I346 | E309-R311 PolarHBondContact O-NH1 3.11Å; R311-L316 CarbonylContact C-O 3.46Å; R311-L316 VanDerWaalsContact CA-O 3.29Å; R311-L316 WeakPolarHBondContact CA-O 3.39Å; R311-M344 VanDerWaalsContact CZ-O 3.31Å; R311-M344 PolarHBondContact NE-O 2.9Å; R311-M344 PolarHBondContact NH2-O 3.01Å; R311-I346 HydrophobicContact CB-CD1 4.01Å; R311-I346 HydrophobicContact CB-CG1 4.47Å | ||
| 312 | N | 94.7 | Very high | 84.8 | Confident | 10 Ų | 10 | 42 Ų | 42 | 5% | 0.053 | 24% | 0.237 | C | C | . | . | trans | -73 | 178.2 | 178.1 | 72.6 | -1.1 | 0 | 0 | 0 | 112.6 | G279 Q280 H284 E314 G315 L316 | G279-N312 WeakPolarHBondContact O-CA 3.4Å; Q280-N312 HydrophobicContact CG-CB 4.1Å; H284-N312 PolarHBondContact NE2-N 2.84Å; N312-E314 PolarHBondContact O-N 3.42Å; N312-E314 VanDerWaalsContact O-N 3.09Å; N312-E314 VanDerWaalsContact OD1-CA 3.3Å; N312-E314 WeakPolarHBondContact OD1-CA 3.42Å; N312-E314 WeakPolarHBondContact OD1-CB 3.34Å; N312-E314 PolarHBondContact OD1-N 3.49Å; N312-G315 PolarHBondContact O-N 2.88Å; N312-G315 PolarHBondContact OD1-N 2.78Å; N312-G315 VanDerWaalsContact OD1-N 3.15Å; N312-L316 PolarHBondContact N-O 3.2Å; N312-L316 PolarHBondContact OD1-N 3.02Å; N312-L316 PolarHBondContact OD1-O 3.04Å | ||
| 313 | F | 94.3 | Very high | 86.1 | Confident | 136 Ų | 136 | 41.1 Ų | 41.1 | 60% | 0.596 | 23% | 0.231 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -8.1 | 175.9 | -60.4 | -20.2 | 0 | 0 | 0 | 113.6 | R277 H278 G315 | R277-F313 WeakPolarHBondContact O-CE2 3.3Å; H278-F313 WeakPolarHBondContact O-CB 3.29Å; H278-F313 WeakPolarHBondContact O-CG 3.34Å; H278-F313 PolarHBondContact O-N 3.15Å; F313-G315 VanDerWaalsContact C-N 3.35Å |
| 314 | E | 92.5 | Very high | 87.9 | Confident | 97 Ų | 97 | 39 Ų | 39 | 45% | 0.453 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | -2.9 | 168.4 | -61.8 | -154.7 | 127.3 | 0 | 0 | 113.8 | N312 L316 K347 | N312-E314 PolarHBondContact O-N 3.42Å; N312-E314 VanDerWaalsContact O-N 3.09Å; N312-E314 VanDerWaalsContact OD1-CA 3.3Å; N312-E314 WeakPolarHBondContact OD1-CA 3.42Å; N312-E314 WeakPolarHBondContact OD1-CB 3.34Å; N312-E314 PolarHBondContact OD1-N 3.49Å; E314-L316 HydrophobicContact CB-CD1 4.22Å; E314-L316 HydrophobicContact CB-CG 4.22Å; E314-K347 VanDerWaalsContact CA-NZ 3.28Å; E314-K347 VanDerWaalsContact CB-NZ 3.34Å; E314-K347 WeakPolarHBondContact O-CD 3.2Å; E314-K347 WeakPolarHBondContact O-CE 3.48Å; E314-K347 PolarHBondContact O-NZ 3.01Å |
| 315 | G | 94.1 | Very high | 89.9 | Confident | 3 Ų | 3 | 38.6 Ų | 38.6 | 3% | 0.031 | 20% | 0.195 | C | C | . | . | S | Bend | trans | 84.9 | 5.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | N312 F313 D345 I346 | N312-G315 PolarHBondContact O-N 2.88Å; N312-G315 PolarHBondContact OD1-N 2.78Å; N312-G315 VanDerWaalsContact OD1-N 3.15Å; F313-G315 VanDerWaalsContact C-N 3.35Å; G315-D345 WeakPolarHBondContact O-CA 3.36Å; G315-I346 PolarHBondContact O-N 3.09Å; G315-I346 VanDerWaalsContact O-N 3.08Å |
| 316 | L | 95.6 | Very high | 91.6 | Very high | 13 Ų | 13 | 37.3 Ų | 37.3 | 7% | 0.068 | 19% | 0.19 | C | C | . | . | trans | -99.6 | 139.6 | -172.1 | -56.3 | 177.4 | 0 | 0 | 0 | 110.7 | H284 R311 N312 E314 H320 L321 D345 | H284-L316 PolarHBondContact NE2-O 2.69Å; H284-L316 VanDerWaalsContact NE2-O 3.11Å; R311-L316 CarbonylContact C-O 3.46Å; R311-L316 VanDerWaalsContact CA-O 3.29Å; R311-L316 WeakPolarHBondContact CA-O 3.39Å; N312-L316 PolarHBondContact N-O 3.2Å; N312-L316 PolarHBondContact OD1-N 3.02Å; N312-L316 PolarHBondContact OD1-O 3.04Å; E314-L316 HydrophobicContact CB-CD1 4.22Å; E314-L316 HydrophobicContact CB-CG 4.22Å; L316-H320 HydrophobicContact CB-CB 3.88Å; L316-H320 HydrophobicContact CD2-CB 4.02Å; L316-H320 HydrophobicContact CG-CB 4.47Å; L316-L321 HydrophobicContact CB-CD2 4.39Å; L316-L321 HydrophobicContact CD1-CD2 3.8Å; L316-D345 HydrophobicContact CD2-CB 4.18Å | ||
| 317 | S | 95.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 16% | 0.164 | C | C | . | . | trans | -86 | 170.2 | 167.5 | 80.7 | 0 | 0 | 0 | 0 | 111.6 | L319 H320 L321 | S317-L319 PolarHBondContact O-N 3.24Å; S317-L319 PolarHBondContact OG-N 3.31Å; S317-H320 PolarHBondContact N-ND1 3.24Å; S317-H320 WeakPolarHBondContact O-CB 3.32Å; S317-H320 PolarHBondContact O-N 3.12Å; S317-H320 PolarHBondContact OG-ND1 2.76Å; S317-L321 PolarHBondContact O-N 3.35Å; S317-L321 VanDerWaalsContact O-N 3.15Å | ||
| 318 | P | 95.1 | Very high | 93.9 | Very high | 1 Ų | 1 | 40.1 Ų | 40.1 | 1% | 0.006 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -54.3 | -35.2 | 174.1 | -24.7 | 34.9 | 0 | 0 | 0 | 113.3 | L283 C287 L308 L321 A322 L334 | L283-P318 HydrophobicContact CB-CB 4.26Å; L283-P318 HydrophobicContact CB-CG 3.92Å; C287-P318 PolarHBondContact SG-O 3.39Å; C287-P318 VanDerWaalsContact SG-O 3.4Å; L308-P318 VanDerWaalsContact O-CD 3.25Å; L308-P318 WeakPolarHBondContact O-CD 3.41Å; P318-L321 PolarHBondContact O-N 2.85Å; P318-A322 WeakPolarHBondContact O-CB 3.36Å; P318-A322 PolarHBondContact O-N 3.47Å; P318-L334 HydrophobicContact CB-CD1 4.1Å; P318-L334 HydrophobicContact CB-CD2 4.24Å |
| 319 | L | 95.9 | Very high | 94.3 | Very high | 1 Ų | 1 | 44.1 Ų | 44.1 | 1% | 0.005 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67 | -39.6 | 177 | -177.2 | 62 | 0 | 0 | 0 | 111.8 | S317 L321 A322 V323 A331 L334 L335 D340 P352 | S317-L319 PolarHBondContact O-N 3.24Å; S317-L319 PolarHBondContact OG-N 3.31Å; L319-L321 VanDerWaalsContact C-N 3.35Å; L319-L321 PolarHBondContact O-N 3.15Å; L319-A322 PolarHBondContact O-N 3.31Å; L319-V323 HydrophobicContact CD1-CG2 4.16Å; L319-V323 HydrophobicContact CG-CG2 4.48Å; L319-V323 WeakPolarHBondContact O-CB 3.37Å; L319-V323 WeakPolarHBondContact O-CG2 3.3Å; L319-V323 PolarHBondContact O-N 3.48Å; L319-A331 HydrophobicContact CD1-CB 3.98Å; L319-L334 HydrophobicContact CB-CD1 4.16Å; L319-L334 HydrophobicContact CD1-CB 4.33Å; L319-L334 HydrophobicContact CD1-CD1 4.27Å; L319-L335 HydrophobicContact CD1-CD2 4.46Å; L319-L335 HydrophobicContact CD1-CG 4.33Å; L319-L335 HydrophobicContact CD2-CD2 3.86Å; L319-D340 WeakPolarHBondContact CD2-O 3.04Å; L319-P352 HydrophobicContact CD2-CG 4.01Å; L319-P352 HydrophobicContact CG-CB 4.46Å; L319-P352 HydrophobicContact CG-CG 4.24Å |
| 320 | H | 95.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.1 | -45.7 | 173.9 | -67.3 | 67.7 | 0 | 0 | 0 | 110.9 | L316 S317 V323 L324 A343 D345 H355 | L316-H320 HydrophobicContact CB-CB 3.88Å; L316-H320 HydrophobicContact CD2-CB 4.02Å; L316-H320 HydrophobicContact CG-CB 4.47Å; S317-H320 PolarHBondContact N-ND1 3.24Å; S317-H320 WeakPolarHBondContact O-CB 3.32Å; S317-H320 PolarHBondContact O-N 3.12Å; S317-H320 PolarHBondContact OG-ND1 2.76Å; H320-V323 PolarHBondContact O-N 2.89Å; H320-L324 WeakPolarHBondContact O-CB 3.42Å; H320-L324 PolarHBondContact O-N 3.14Å; H320-A343 PolarHBondContact CE1-O 2.79Å; H320-A343 PolarHBondContact NE2-O 3Å; H320-D345 PolarHBondContact NE2-N 2.91Å; H320-H355 AromaticContact CD2-CD2 3.6Å; H320-H355 AromaticContact CD2-NE2 3.7Å |
| 321 | L | 95.2 | Very high | 94.6 | Very high | 15 Ų | 15 | 39.6 Ų | 39.6 | 8% | 0.079 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.7 | -44.6 | 177.2 | -66.9 | -179.8 | 0 | 0 | 0 | 111.9 | H284 C287 L316 S317 P318 L319 V323 L324 Q325 | H284-L321 HydrophobicContact CB-CD1 3.88Å; C287-L321 HydrophobicContact CB-CB 3.94Å; L316-L321 HydrophobicContact CB-CD2 4.39Å; L316-L321 HydrophobicContact CD1-CD2 3.8Å; S317-L321 PolarHBondContact O-N 3.35Å; S317-L321 VanDerWaalsContact O-N 3.15Å; P318-L321 PolarHBondContact O-N 2.85Å; L319-L321 VanDerWaalsContact C-N 3.35Å; L319-L321 PolarHBondContact O-N 3.15Å; L321-V323 VanDerWaalsContact C-N 3.34Å; L321-V323 PolarHBondContact O-N 3.27Å; L321-L324 PolarHBondContact O-N 2.88Å; L321-Q325 WeakPolarHBondContact O-CG 3.28Å; L321-Q325 PolarHBondContact O-N 3.48Å; L321-Q325 VanDerWaalsContact O-N 3.15Å |
| 322 | A | 95.7 | Very high | 94.7 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.3 | -41.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | C287 P318 L319 G326 H327 L330 A331 L334 | C287-A322 HydrophobicContact CB-CB 4.4Å; P318-A322 WeakPolarHBondContact O-CB 3.36Å; P318-A322 PolarHBondContact O-N 3.47Å; L319-A322 PolarHBondContact O-N 3.31Å; A322-G326 PolarHBondContact O-N 3.03Å; A322-H327 WeakPolarHBondContact O-CB 3.42Å; A322-H327 PolarHBondContact O-N 3.31Å; A322-L330 HydrophobicContact CB-CB 4.07Å; A322-A331 HydrophobicContact CB-CB 4.21Å; A322-L334 HydrophobicContact CB-CD1 4.09Å |
| 323 | V | 96.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -74.2 | -41.7 | 179.1 | 171.4 | 0 | 0 | 0 | 0 | 112.2 | L319 H320 L321 Q325 G326 A331 P352 A356 L368 | L319-V323 HydrophobicContact CD1-CG2 4.16Å; L319-V323 HydrophobicContact CG-CG2 4.48Å; L319-V323 WeakPolarHBondContact O-CB 3.37Å; L319-V323 WeakPolarHBondContact O-CG2 3.3Å; L319-V323 PolarHBondContact O-N 3.48Å; H320-V323 PolarHBondContact O-N 2.89Å; L321-V323 VanDerWaalsContact C-N 3.34Å; L321-V323 PolarHBondContact O-N 3.27Å; V323-Q325 VanDerWaalsContact C-N 3.27Å; V323-Q325 PolarHBondContact O-N 3.28Å; V323-G326 PolarHBondContact O-N 3.47Å; V323-A331 HydrophobicContact CG2-CB 4.17Å; V323-P352 HydrophobicContact CB-CB 4.48Å; V323-P352 WeakPolarHBondContact CG1-O 3.26Å; V323-P352 HydrophobicContact CG2-CB 4.17Å; V323-A356 HydrophobicContact CG1-CB 3.74Å; V323-L368 HydrophobicContact CG1-CD1 3.95Å; V323-L368 HydrophobicContact CG2-CD1 4.14Å; V323-L368 HydrophobicContact CG2-CD2 4.27Å |
| 324 | L | 94 | Very high | 94.7 | Very high | 67 Ų | 67 | 37.4 Ų | 37.4 | 35% | 0.351 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -61.6 | -35.6 | 179 | -175.5 | 65.3 | 0 | 0 | 0 | 112.2 | H320 L321 G326 | H320-L324 WeakPolarHBondContact O-CB 3.42Å; H320-L324 PolarHBondContact O-N 3.14Å; L321-L324 PolarHBondContact O-N 2.88Å; L324-G326 VanDerWaalsContact C-N 3.33Å |
| 325 | Q | 91.9 | Very high | 94.7 | Very high | 112 Ų | 112 | 34.1 Ų | 34.1 | 52% | 0.523 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85 | -1.4 | 173.8 | -58.2 | -64.4 | -12.8 | 0 | 0 | 113.6 | L321 V323 H327 | L321-Q325 WeakPolarHBondContact O-CG 3.28Å; L321-Q325 PolarHBondContact O-N 3.48Å; L321-Q325 VanDerWaalsContact O-N 3.15Å; V323-Q325 VanDerWaalsContact C-N 3.27Å; V323-Q325 PolarHBondContact O-N 3.28Å; Q325-H327 VanDerWaalsContact C-N 3.3Å; Q325-H327 PolarHBondContact O-CD2 3.4Å; Q325-H327 VanDerWaalsContact O-CD2 3.32Å; Q325-H327 PolarHBondContact O-N 2.83Å |
| 326 | G | 92.6 | Very high | 94.6 | Very high | 22 Ų | 22 | 39 Ų | 39 | 23% | 0.227 | 19% | 0.19 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 71.6 | 17.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | A322 V323 L324 R328 N361 | A322-G326 PolarHBondContact O-N 3.03Å; V323-G326 PolarHBondContact O-N 3.47Å; L324-G326 VanDerWaalsContact C-N 3.33Å; G326-R328 VanDerWaalsContact C-N 3.31Å; G326-R328 PolarHBondContact O-N 3.23Å; G326-N361 WeakPolarHBondContact CA-ND2 3.26Å |
| 327 | H | 94.7 | Very high | 94.4 | Very high | 32 Ų | 32 | 40.5 Ų | 40.5 | 15% | 0.148 | 20% | 0.204 | C | C | . | . | trans | -80.1 | 67.4 | -173.4 | -64.5 | 165.1 | 0 | 0 | 0 | 112.7 | C287 Q290 A322 Q325 N329 L330 A331 | C287-H327 PolarHBondContact O-ND1 3.16Å; Q290-H327 PolarHBondContact NE2-CD2 3.28Å; Q290-H327 VanDerWaalsContact NE2-CD2 3.28Å; Q290-H327 PolarHBondContact NE2-NE2 3.07Å; A322-H327 WeakPolarHBondContact O-CB 3.42Å; A322-H327 PolarHBondContact O-N 3.31Å; Q325-H327 VanDerWaalsContact C-N 3.3Å; Q325-H327 PolarHBondContact O-CD2 3.4Å; Q325-H327 VanDerWaalsContact O-CD2 3.32Å; Q325-H327 PolarHBondContact O-N 2.83Å; H327-N329 PolarHBondContact O-N 2.87Å; H327-L330 HydrophobicContact CB-CB 4.14Å; H327-L330 HydrophobicContact CB-CD1 3.55Å; H327-L330 HydrophobicContact CB-CG 3.95Å; H327-L330 PolarHBondContact O-N 2.94Å; H327-A331 PolarHBondContact O-N 3.37Å | ||
| 328 | R | 94.6 | Very high | 94.1 | Very high | 136 Ų | 136 | 43.4 Ų | 43.4 | 51% | 0.513 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -45.9 | -40.4 | -176.8 | -169.7 | -179.5 | 77.4 | 174.4 | 3.5 | 114.6 | G326 L330 A331 K332 M364 F367 | G326-R328 VanDerWaalsContact C-N 3.31Å; G326-R328 PolarHBondContact O-N 3.23Å; R328-L330 PolarHBondContact O-N 3.4Å; R328-A331 PolarHBondContact O-N 2.92Å; R328-K332 WeakPolarHBondContact O-CB 3.31Å; R328-K332 PolarHBondContact O-N 2.65Å; R328-M364 HydrophobicContact CB-CE 3.85Å; R328-M364 HydrophobicContact CB-SD 4.11Å; R328-M364 HydrophobicContact CG-CE 3.84Å; R328-F367 HydrophobicContact CG-CB 4.31Å; R328-F367 HydrophobicContact CG-CD1 4.27Å; R328-F367 HydrophobicContact CG-CD2 3.64Å; R328-F367 HydrophobicContact CG-CE2 3.98Å; R328-F367 HydrophobicContact CG-CG 3.79Å; R328-F367 HydrophobicContact CG-CZ 4.45Å |
| 329 | N | 95.4 | Very high | 94 | Very high | 104 Ų | 104 | 43.8 Ų | 43.8 | 56% | 0.556 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -69.8 | -30.5 | -178.7 | -63.7 | -5.8 | 0 | 0 | 0 | 113.1 | L292 H327 K333 | L292-N329 HydrophobicContact CD1-CB 4.48Å; H327-N329 PolarHBondContact O-N 2.87Å; N329-K333 PolarHBondContact O-N 3.06Å |
| 330 | L | 95 | Very high | 93.9 | Very high | 3 Ų | 3 | 47.2 Ų | 47.2 | 2% | 0.016 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -77.9 | -45 | 174 | -54.9 | 173.3 | 0 | 0 | 0 | 110.2 | Q290 L292 L295 A322 H327 R328 K332 K333 L334 | Q290-L330 HydrophobicContact CG-CD1 4.22Å; L292-L330 HydrophobicContact CB-CD2 4.01Å; L292-L330 HydrophobicContact CD1-CD2 3.82Å; L295-L330 HydrophobicContact CD2-CB 4.29Å; L295-L330 HydrophobicContact CD2-CD2 3.91Å; A322-L330 HydrophobicContact CB-CB 4.07Å; H327-L330 HydrophobicContact CB-CB 4.14Å; H327-L330 HydrophobicContact CB-CD1 3.55Å; H327-L330 HydrophobicContact CB-CG 3.95Å; H327-L330 PolarHBondContact O-N 2.94Å; R328-L330 PolarHBondContact O-N 3.4Å; L330-K332 VanDerWaalsContact C-N 3.26Å; L330-K332 PolarHBondContact O-N 3.37Å; L330-K333 PolarHBondContact O-N 3.34Å; L330-K333 VanDerWaalsContact O-N 3.12Å; L330-L334 WeakPolarHBondContact O-CG 3.4Å; L330-L334 PolarHBondContact O-N 2.93Å |
| 331 | A | 95.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -55.7 | -43.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | L319 A322 V323 H327 R328 L334 L335 M364 F367 | L319-A331 HydrophobicContact CD1-CB 3.98Å; A322-A331 HydrophobicContact CB-CB 4.21Å; V323-A331 HydrophobicContact CG2-CB 4.17Å; H327-A331 PolarHBondContact O-N 3.37Å; R328-A331 PolarHBondContact O-N 2.92Å; A331-L334 PolarHBondContact O-N 3.34Å; A331-L335 WeakPolarHBondContact O-CG 3.49Å; A331-L335 PolarHBondContact O-N 3.2Å; A331-M364 HydrophobicContact CB-CE 4.29Å; A331-F367 HydrophobicContact CB-CE1 4.07Å |
| 332 | K | 95.3 | Very high | 93.9 | Very high | 101 Ų | 101 | 49.9 Ų | 49.9 | 44% | 0.439 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.8 | -51.2 | 172.7 | -169.1 | -179.5 | 173.3 | 179 | 0 | 112.3 | R328 L330 L334 L335 D336 F367 | R328-K332 WeakPolarHBondContact O-CB 3.31Å; R328-K332 PolarHBondContact O-N 2.65Å; L330-K332 VanDerWaalsContact C-N 3.26Å; L330-K332 PolarHBondContact O-N 3.37Å; K332-L334 PolarHBondContact O-N 3.15Å; K332-L335 PolarHBondContact O-N 2.97Å; K332-L335 VanDerWaalsContact O-N 3.1Å; K332-D336 WeakPolarHBondContact CE-OD1 3.3Å; K332-D336 WeakPolarHBondContact CE-OD2 3.46Å; K332-D336 WeakPolarHBondContact O-CB 3.49Å; K332-D336 VanDerWaalsContact O-CG 3.25Å; K332-D336 PolarHBondContact O-N 3.48Å; K332-F367 HydrophobicContact CB-CE2 4.02Å; K332-F367 HydrophobicContact CB-CZ 3.66Å; K332-F367 HydrophobicContact CG-CE2 4.3Å; K332-F367 HydrophobicContact CG-CZ 4.15Å |
| 333 | K | 93.8 | Very high | 93.8 | Very high | 77 Ų | 77 | 50 Ų | 50 | 34% | 0.335 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.7 | -28.8 | -179.7 | -76.3 | -141.6 | 175.3 | -165.9 | 0 | 113.9 | L292 L295 S296 L299 N329 L330 A337 | L292-K333 HydrophobicContact CD1-CD 3.84Å; L292-K333 HydrophobicContact CD1-CG 3.99Å; L295-K333 HydrophobicContact CD2-CB 3.77Å; S296-K333 PolarHBondContact OG-NZ 3.48Å; L299-K333 HydrophobicContact CD1-CB 4.17Å; L299-K333 WeakPolarHBondContact CD1-O 3.35Å; N329-K333 PolarHBondContact O-N 3.06Å; L330-K333 PolarHBondContact O-N 3.34Å; L330-K333 VanDerWaalsContact O-N 3.12Å; K333-A337 WeakPolarHBondContact O-CB 3.47Å; K333-A337 PolarHBondContact O-N 2.98Å |
| 334 | L | 93.8 | Very high | 93.7 | Very high | 1 Ų | 1 | 54.1 Ų | 54.1 | 1% | 0.005 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -71.3 | -43.2 | 172.6 | -68.7 | 169.2 | 0 | 0 | 0 | 112.1 | L295 L308 P318 L319 A322 L330 A331 K332 A337 G338 A339 | L295-L334 HydrophobicContact CD1-CD2 4.22Å; L308-L334 HydrophobicContact CD2-CD2 3.7Å; P318-L334 HydrophobicContact CB-CD1 4.1Å; P318-L334 HydrophobicContact CB-CD2 4.24Å; L319-L334 HydrophobicContact CB-CD1 4.16Å; L319-L334 HydrophobicContact CD1-CB 4.33Å; L319-L334 HydrophobicContact CD1-CD1 4.27Å; A322-L334 HydrophobicContact CB-CD1 4.09Å; L330-L334 WeakPolarHBondContact O-CG 3.4Å; L330-L334 PolarHBondContact O-N 2.93Å; A331-L334 PolarHBondContact O-N 3.34Å; K332-L334 PolarHBondContact O-N 3.15Å; L334-A337 CarbonylContact O-C 3.58Å; L334-A337 PolarHBondContact O-N 2.95Å; L334-G338 PolarHBondContact O-N 2.81Å; L334-A339 HydrophobicContact CB-CB 4.07Å; L334-A339 VanDerWaalsContact O-CB 3.27Å; L334-A339 WeakPolarHBondContact O-CB 3.41Å; L334-A339 PolarHBondContact O-N 3.34Å |
| 335 | L | 93.6 | Very high | 93.7 | Very high | 28 Ų | 28 | 51 Ų | 51 | 15% | 0.147 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -68 | -42.6 | 176.2 | -66.6 | 175.3 | 0 | 0 | 0 | 112.1 | L319 A331 K332 A337 G338 I341 F367 L368 N371 | L319-L335 HydrophobicContact CD1-CD2 4.46Å; L319-L335 HydrophobicContact CD1-CG 4.33Å; L319-L335 HydrophobicContact CD2-CD2 3.86Å; A331-L335 WeakPolarHBondContact O-CG 3.49Å; A331-L335 PolarHBondContact O-N 3.2Å; K332-L335 PolarHBondContact O-N 2.97Å; K332-L335 VanDerWaalsContact O-N 3.1Å; L335-A337 PolarHBondContact O-N 3.07Å; L335-A337 VanDerWaalsContact O-N 3.15Å; L335-G338 PolarHBondContact O-N 3.02Å; L335-I341 HydrophobicContact CD1-CD1 3.96Å; L335-I341 HydrophobicContact CD1-CG1 4.31Å; L335-I341 HydrophobicContact CD2-CB 3.67Å; L335-I341 HydrophobicContact CD2-CD1 4.17Å; L335-I341 HydrophobicContact CD2-CG1 3.85Å; L335-F367 HydrophobicContact CD1-CE1 3.78Å; L335-F367 HydrophobicContact CD1-CZ 4.07Å; L335-L368 HydrophobicContact CD1-CD2 4.5Å; L335-N371 HydrophobicContact CD1-CB 4.08Å |
| 336 | D | 92.2 | Very high | 93.9 | Very high | 105 Ų | 105 | 50.8 Ų | 50.8 | 56% | 0.561 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -58 | -24.8 | 172.2 | -68.6 | -18.3 | 0 | 0 | 0 | 111.7 | K332 | K332-D336 WeakPolarHBondContact CE-OD1 3.3Å; K332-D336 WeakPolarHBondContact CE-OD2 3.46Å; K332-D336 WeakPolarHBondContact O-CB 3.49Å; K332-D336 VanDerWaalsContact O-CG 3.25Å; K332-D336 PolarHBondContact O-N 3.48Å |
| 337 | A | 90.2 | Very high | 93.9 | Very high | 46 Ų | 46 | 56.1 Ų | 56.1 | 38% | 0.38 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.8 | 2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | L299 L308 K333 L334 L335 | L299-A337 HydrophobicContact CD1-CB 4.1Å; L299-A337 HydrophobicContact CD2-CB 3.92Å; L299-A337 HydrophobicContact CG-CB 4.42Å; L308-A337 HydrophobicContact CD1-CB 4.41Å; L308-A337 WeakPolarHBondContact CD1-O 3.22Å; K333-A337 WeakPolarHBondContact O-CB 3.47Å; K333-A337 PolarHBondContact O-N 2.98Å; L334-A337 CarbonylContact O-C 3.58Å; L334-A337 PolarHBondContact O-N 2.95Å; L335-A337 PolarHBondContact O-N 3.07Å; L335-A337 VanDerWaalsContact O-N 3.15Å |
| 338 | G | 90.4 | Very high | 93.8 | Very high | 61 Ų | 61 | 56.7 Ų | 56.7 | 63% | 0.629 | 30% | 0.3 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 90.2 | 23.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | L334 L335 | L334-G338 PolarHBondContact O-N 2.81Å; L335-G338 PolarHBondContact O-N 3.02Å |
| 339 | A | 92.8 | Very high | 93.8 | Very high | 9 Ų | 9 | 50.2 Ų | 50.2 | 7% | 0.074 | 28% | 0.276 | C | S | . | . | trans | -67.2 | 144.3 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | L308 E309 L334 I341 | L308-A339 HydrophobicContact CB-CB 4.12Å; L308-A339 HydrophobicContact CD1-CB 4.22Å; L308-A339 HydrophobicContact CD2-CB 4.39Å; L308-A339 HydrophobicContact CG-CB 4.48Å; E309-A339 WeakPolarHBondContact OE1-CA 3.47Å; L334-A339 HydrophobicContact CB-CB 4.07Å; L334-A339 VanDerWaalsContact O-CB 3.27Å; L334-A339 WeakPolarHBondContact O-CB 3.41Å; L334-A339 PolarHBondContact O-N 3.34Å; A339-I341 PolarHBondContact O-N 3.36Å | ||
| 340 | D | 93.6 | Very high | 93.8 | Very high | 73 Ų | 73 | 46.4 Ų | 46.4 | 39% | 0.39 | 26% | 0.255 | S | S | . | . | trans | -72.8 | 111.8 | -179.8 | 174.9 | 18.7 | 0 | 0 | 0 | 111 | E309 L319 N342 A343 | E309-D340 PolarHBondContact OE1-N 3.15Å; L319-D340 WeakPolarHBondContact CD2-O 3.04Å; D340-N342 PolarHBondContact O-N 2.75Å; D340-N342 PolarHBondContact OD1-N 3.46Å; D340-A343 HydrophobicContact CB-CB 4.03Å; D340-A343 WeakPolarHBondContact O-CB 3.48Å; D340-A343 PolarHBondContact O-N 2.84Å; D340-A343 VanDerWaalsContact O-N 3.16Å; D340-A343 WeakPolarHBondContact OD2-CA 2.86Å; D340-A343 PolarHBondContact OD2-N 2.71Å | ||
| 341 | I | 95.3 | Very high | 93.9 | Very high | 21 Ų | 21 | 46.3 Ų | 46.3 | 11% | 0.108 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -19.2 | 178.8 | -160.7 | 169.7 | 0 | 0 | 0 | 113.3 | L335 A339 P352 L368 N371 C373 | L335-I341 HydrophobicContact CD1-CD1 3.96Å; L335-I341 HydrophobicContact CD1-CG1 4.31Å; L335-I341 HydrophobicContact CD2-CB 3.67Å; L335-I341 HydrophobicContact CD2-CD1 4.17Å; L335-I341 HydrophobicContact CD2-CG1 3.85Å; A339-I341 PolarHBondContact O-N 3.36Å; I341-P352 VanDerWaalsContact O-CD 3.3Å; I341-P352 WeakPolarHBondContact O-CD 3.39Å; I341-P352 WeakPolarHBondContact O-CG 3.41Å; I341-L368 HydrophobicContact CD1-CD2 4.15Å; I341-L368 HydrophobicContact CG1-CD2 3.97Å; I341-N371 HydrophobicContact CD1-CB 3.55Å; I341-C373 HydrophobicContact CD1-CB 3.83Å; I341-C373 HydrophobicContact CG1-CB 3.84Å; I341-C373 HydrophobicContact CG2-CB 4.37Å |
| 342 | N | 94.9 | Very high | 93.9 | Very high | 50 Ų | 50 | 46.3 Ų | 46.3 | 27% | 0.267 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.9 | 6.7 | -179.6 | -57.2 | -46.9 | 0 | 0 | 0 | 112.8 | D340 M344 D374 | D340-N342 PolarHBondContact O-N 2.75Å; D340-N342 PolarHBondContact OD1-N 3.46Å; N342-M344 PolarHBondContact O-N 2.81Å; N342-D374 PolarHBondContact OD1-N 2.95Å |
| 343 | A | 93.8 | Very high | 94 | Very high | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.008 | 23% | 0.234 | C | C | . | . | P | Polyproline II helix | trans | -54.8 | 125.1 | -176 | 0 | 0 | 0 | 0 | 0 | 111 | E309 H320 D340 P352 | E309-A343 WeakPolarHBondContact OE2-CB 3.34Å; H320-A343 PolarHBondContact CE1-O 2.79Å; H320-A343 PolarHBondContact NE2-O 3Å; D340-A343 HydrophobicContact CB-CB 4.03Å; D340-A343 WeakPolarHBondContact O-CB 3.48Å; D340-A343 PolarHBondContact O-N 2.84Å; D340-A343 VanDerWaalsContact O-N 3.16Å; D340-A343 WeakPolarHBondContact OD2-CA 2.86Å; D340-A343 PolarHBondContact OD2-N 2.71Å; A343-P352 WeakPolarHBondContact O-CD 3.22Å |
| 344 | M | 94.9 | Very high | 94.1 | Very high | 88 Ų | 88 | 38 Ų | 38 | 43% | 0.433 | 22% | 0.219 | S | C | . | . | P | Polyproline II helix | trans | -86 | 147.2 | -179.6 | -68 | -177.5 | -71.5 | 0 | 0 | 112.9 | R311 N342 Q350 | R311-M344 VanDerWaalsContact CZ-O 3.31Å; R311-M344 PolarHBondContact NE-O 2.9Å; R311-M344 PolarHBondContact NH2-O 3.01Å; N342-M344 PolarHBondContact O-N 2.81Å; M344-Q350 WeakPolarHBondContact CA-O 3.44Å |
| 345 | D | 94.5 | Very high | 94.2 | Very high | 2 Ų | 2 | 38.5 Ų | 38.5 | 1% | 0.011 | 22% | 0.221 | C | C | . | . | P | Polyproline II helix | trans | -76.2 | 148.9 | 172.7 | 105.9 | -92.5 | 0 | 0 | 0 | 113.1 | G315 L316 H320 K347 S348 G349 Q350 Y380 | G315-D345 WeakPolarHBondContact O-CA 3.36Å; L316-D345 HydrophobicContact CD2-CB 4.18Å; H320-D345 PolarHBondContact NE2-N 2.91Å; D345-K347 WeakPolarHBondContact OD2-CA 3.3Å; D345-K347 WeakPolarHBondContact OD2-CB 3.4Å; D345-K347 PolarHBondContact OD2-N 3.09Å; D345-S348 VanDerWaalsContact OD1-C 3.23Å; D345-S348 VanDerWaalsContact OD1-CA 3.3Å; D345-S348 WeakPolarHBondContact OD1-CA 3.41Å; D345-S348 WeakPolarHBondContact OD1-CB 3.38Å; D345-S348 PolarHBondContact OD1-N 3.02Å; D345-S348 VanDerWaalsContact OD1-N 3.09Å; D345-S348 PolarHBondContact OD1-OG 3Å; D345-S348 PolarHBondContact OD2-N 2.73Å; D345-S348 PolarHBondContact OD2-OG 3.08Å; D345-G349 VanDerWaalsContact O-CA 3.28Å; D345-G349 WeakPolarHBondContact O-CA 3.37Å; D345-G349 PolarHBondContact O-N 3.39Å; D345-G349 PolarHBondContact OD1-N 3.22Å; D345-Q350 PolarHBondContact N-O 2.62Å; D345-Q350 WeakPolarHBondContact OD1-CB 3.3Å; D345-Q350 PolarHBondContact OD1-N 3.49Å; D345-Y380 PolarHBondContact O-OH 3.19Å |
| 346 | I | 94.3 | Very high | 94.3 | Very high | 106 Ų | 106 | 37.2 Ų | 37.2 | 54% | 0.544 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -29.9 | -176.4 | -50.7 | -177.1 | 0 | 0 | 0 | 113.5 | R311 G315 | R311-I346 HydrophobicContact CB-CD1 4.01Å; R311-I346 HydrophobicContact CB-CG1 4.47Å; G315-I346 PolarHBondContact O-N 3.09Å; G315-I346 VanDerWaalsContact O-N 3.08Å |
| 347 | K | 92.8 | Very high | 94.5 | Very high | 134 Ų | 134 | 32.2 Ų | 32.2 | 58% | 0.583 | 19% | 0.187 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -80.6 | -38.1 | -175.2 | -66.9 | 174.4 | 177.8 | 154.8 | 0 | 112.5 | E314 D345 | E314-K347 VanDerWaalsContact CA-NZ 3.28Å; E314-K347 VanDerWaalsContact CB-NZ 3.34Å; E314-K347 WeakPolarHBondContact O-CD 3.2Å; E314-K347 WeakPolarHBondContact O-CE 3.48Å; E314-K347 PolarHBondContact O-NZ 3.01Å; D345-K347 WeakPolarHBondContact OD2-CA 3.3Å; D345-K347 WeakPolarHBondContact OD2-CB 3.4Å; D345-K347 PolarHBondContact OD2-N 3.09Å |
| 348 | S | 92.6 | Very high | 94.7 | Very high | 44 Ų | 44 | 33.5 Ų | 33.5 | 31% | 0.308 | 19% | 0.186 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -134 | -4.6 | -169.3 | 39 | 0 | 0 | 0 | 0 | 115.4 | D345 Q350 S379 Y380 | D345-S348 VanDerWaalsContact OD1-C 3.23Å; D345-S348 VanDerWaalsContact OD1-CA 3.3Å; D345-S348 WeakPolarHBondContact OD1-CA 3.41Å; D345-S348 WeakPolarHBondContact OD1-CB 3.38Å; D345-S348 PolarHBondContact OD1-N 3.02Å; D345-S348 VanDerWaalsContact OD1-N 3.09Å; D345-S348 PolarHBondContact OD1-OG 3Å; D345-S348 PolarHBondContact OD2-N 2.73Å; D345-S348 PolarHBondContact OD2-OG 3.08Å; S348-Q350 PolarHBondContact O-N 3.36Å; S348-Q350 WeakPolarHBondContact OG-CG 3.37Å; S348-S379 WeakPolarHBondContact O-CB 3.45Å; S348-Y380 PolarHBondContact O-N 3.05Å |
| 349 | G | 95.1 | Very high | 94.9 | Very high | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.01 | 17% | 0.172 | C | C | . | . | trans | 68.6 | 17 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | D345 S379 Y380 | D345-G349 VanDerWaalsContact O-CA 3.28Å; D345-G349 WeakPolarHBondContact O-CA 3.37Å; D345-G349 PolarHBondContact O-N 3.39Å; D345-G349 PolarHBondContact OD1-N 3.22Å; G349-S379 WeakPolarHBondContact O-CA 3.5Å; G349-Y380 VanDerWaalsContact N-CD2 3.27Å; G349-Y380 VanDerWaalsContact N-CE2 3.26Å | ||
| 350 | Q | 95.8 | Very high | 94.9 | Very high | 23 Ų | 23 | 37.2 Ų | 37.2 | 11% | 0.107 | 19% | 0.194 | C | C | . | . | trans | -72.3 | 140.8 | -178.8 | -55.5 | -67.2 | -33.9 | 0 | 0 | 109.5 | M344 D345 S348 M354 S379 I388 | M344-Q350 WeakPolarHBondContact CA-O 3.44Å; D345-Q350 PolarHBondContact N-O 2.62Å; D345-Q350 WeakPolarHBondContact OD1-CB 3.3Å; D345-Q350 PolarHBondContact OD1-N 3.49Å; S348-Q350 PolarHBondContact O-N 3.36Å; S348-Q350 WeakPolarHBondContact OG-CG 3.37Å; Q350-M354 VanDerWaalsContact CA-SD 3.58Å; Q350-M354 HydrophobicContact CB-CB 4.06Å; Q350-M354 HydrophobicContact CB-SD 4.12Å; Q350-M354 VanDerWaalsContact OE1-CB 3.3Å; Q350-M354 PolarHBondContact OE1-SD 3.39Å; Q350-S379 PolarHBondContact NE2-OG 3.01Å; Q350-I388 VanDerWaalsContact OE1-CD1 3.32Å | ||
| 351 | S | 96.1 | Very high | 94.9 | Very high | 2 Ų | 2 | 35.8 Ų | 35.8 | 1% | 0.014 | 19% | 0.186 | C | C | . | . | trans | -86.1 | 167.2 | 169.5 | 72.6 | 0 | 0 | 0 | 0 | 111 | L353 M354 H355 | S351-L353 PolarHBondContact O-N 2.91Å; S351-M354 PolarHBondContact N-SD 3.36Å; S351-M354 WeakPolarHBondContact O-CB 2.99Å; S351-M354 PolarHBondContact O-N 3.15Å; S351-H355 PolarHBondContact O-N 3.45Å | ||
| 352 | P | 96.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.4 | -34.7 | 177.5 | -23.5 | 35.2 | 0 | 0 | 0 | 112.2 | L319 V323 I341 A343 M354 H355 A356 L368 | L319-P352 HydrophobicContact CD2-CG 4.01Å; L319-P352 HydrophobicContact CG-CB 4.46Å; L319-P352 HydrophobicContact CG-CG 4.24Å; V323-P352 HydrophobicContact CB-CB 4.48Å; V323-P352 WeakPolarHBondContact CG1-O 3.26Å; V323-P352 HydrophobicContact CG2-CB 4.17Å; I341-P352 VanDerWaalsContact O-CD 3.3Å; I341-P352 WeakPolarHBondContact O-CD 3.39Å; I341-P352 WeakPolarHBondContact O-CG 3.41Å; A343-P352 WeakPolarHBondContact O-CD 3.22Å; P352-M354 VanDerWaalsContact C-N 3.3Å; P352-M354 PolarHBondContact O-N 3.3Å; P352-H355 PolarHBondContact O-N 2.97Å; P352-A356 PolarHBondContact O-N 3.03Å; P352-L368 HydrophobicContact CB-CD1 4.25Å |
| 353 | L | 97.1 | Very high | 94.8 | Very high | 1 Ų | 1 | 40.7 Ų | 40.7 | 1% | 0.005 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.2 | -42.5 | 173.9 | -178.9 | 68.1 | 0 | 0 | 0 | 111.8 | S351 A356 V357 V365 L368 I369 V375 A385 L401 | S351-L353 PolarHBondContact O-N 2.91Å; L353-A356 WeakPolarHBondContact O-CB 3.41Å; L353-A356 PolarHBondContact O-N 2.93Å; L353-V357 WeakPolarHBondContact O-CG2 3.19Å; L353-V357 PolarHBondContact O-N 3.24Å; L353-V365 HydrophobicContact CD1-CG1 3.99Å; L353-L368 HydrophobicContact CB-CD1 4.46Å; L353-L368 HydrophobicContact CD1-CB 4.24Å; L353-I369 HydrophobicContact CD1-CD1 4.49Å; L353-I369 HydrophobicContact CD1-CG1 4.16Å; L353-V375 HydrophobicContact CD2-CB 4.49Å; L353-V375 HydrophobicContact CD2-CG1 4.48Å; L353-A385 HydrophobicContact CD2-CB 3.78Å; L353-A385 HydrophobicContact CG-CB 4.01Å; L353-L401 HydrophobicContact CD2-CD2 4.25Å |
| 354 | M | 96.6 | Very high | 94.9 | Very high | 1 Ų | 1 | 40.8 Ų | 40.8 | 1% | 0.005 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.9 | -38.6 | 178.7 | -64.5 | 168.2 | 177.6 | 0 | 0 | 111.6 | Q350 S351 P352 V357 E358 S377 A385 I388 | Q350-M354 VanDerWaalsContact CA-SD 3.58Å; Q350-M354 HydrophobicContact CB-CB 4.06Å; Q350-M354 HydrophobicContact CB-SD 4.12Å; Q350-M354 VanDerWaalsContact OE1-CB 3.3Å; Q350-M354 PolarHBondContact OE1-SD 3.39Å; S351-M354 PolarHBondContact N-SD 3.36Å; S351-M354 WeakPolarHBondContact O-CB 2.99Å; S351-M354 PolarHBondContact O-N 3.15Å; P352-M354 VanDerWaalsContact C-N 3.3Å; P352-M354 PolarHBondContact O-N 3.3Å; M354-V357 PolarHBondContact O-N 2.8Å; M354-E358 VanDerWaalsContact O-CB 3.31Å; M354-E358 WeakPolarHBondContact O-CB 3.34Å; M354-E358 PolarHBondContact O-N 3.3Å; M354-S377 VanDerWaalsContact CE-C 3.46Å; M354-S377 WeakPolarHBondContact CE-O 3.49Å; M354-A385 HydrophobicContact CG-CB 4.21Å; M354-I388 HydrophobicContact CB-CD1 3.77Å; M354-I388 HydrophobicContact CG-CD1 3.93Å |
| 355 | H | 95.8 | Very high | 94.9 | Very high | 13 Ų | 13 | 36.6 Ų | 36.6 | 6% | 0.06 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -68 | -32.2 | 172.9 | -71.9 | -60.3 | 0 | 0 | 0 | 113.5 | H320 S351 P352 E358 S359 | H320-H355 AromaticContact CD2-CD2 3.6Å; H320-H355 AromaticContact CD2-NE2 3.7Å; S351-H355 PolarHBondContact O-N 3.45Å; P352-H355 PolarHBondContact O-N 2.97Å; H355-E358 PolarHBondContact O-N 3.29Å; H355-S359 WeakPolarHBondContact O-CB 3.4Å; H355-S359 PolarHBondContact O-N 3.28Å; H355-S359 PolarHBondContact O-OG 3.32Å |
| 356 | A | 96.4 | Very high | 95 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -66.9 | -40.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V323 P352 L353 S359 N360 N361 M364 V365 L368 | V323-A356 HydrophobicContact CG1-CB 3.74Å; P352-A356 PolarHBondContact O-N 3.03Å; L353-A356 WeakPolarHBondContact O-CB 3.41Å; L353-A356 PolarHBondContact O-N 2.93Å; A356-S359 PolarHBondContact O-OG 2.95Å; A356-S359 VanDerWaalsContact O-OG 3.13Å; A356-N360 PolarHBondContact O-N 3.03Å; A356-N361 PolarHBondContact O-N 3.31Å; A356-M364 HydrophobicContact CB-CB 4.03Å; A356-V365 HydrophobicContact CB-CG2 3.66Å; A356-L368 HydrophobicContact CB-CD1 3.98Å |
| 357 | V | 96.3 | Very high | 95.1 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66.1 | -43.7 | 171.8 | 174.9 | 0 | 0 | 0 | 0 | 110.7 | L353 M354 S359 N360 V365 A385 I388 A389 Q394 T397 L401 | L353-V357 WeakPolarHBondContact O-CG2 3.19Å; L353-V357 PolarHBondContact O-N 3.24Å; M354-V357 PolarHBondContact O-N 2.8Å; V357-S359 PolarHBondContact O-N 3.4Å; V357-N360 PolarHBondContact O-N 3.45Å; V357-V365 HydrophobicContact CG2-CG1 4.46Å; V357-V365 HydrophobicContact CG2-CG2 3.73Å; V357-A385 HydrophobicContact CG2-CB 4.24Å; V357-I388 HydrophobicContact CG1-CB 4.02Å; V357-I388 HydrophobicContact CG1-CG2 3.85Å; V357-A389 HydrophobicContact CG1-CB 3.75Å; V357-Q394 PolarHBondContact O-NE2 3.38Å; V357-Q394 PolarHBondContact O-OE1 2.94Å; V357-T397 HydrophobicContact CG1-CG2 4.35Å; V357-T397 HydrophobicContact CG2-CG2 3.91Å; V357-L401 HydrophobicContact CG2-CD1 4.31Å |
| 358 | E | 94.2 | Very high | 95.3 | Very high | 74 Ų | 74 | 29.8 Ų | 29.8 | 35% | 0.346 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -59.2 | -47.6 | 178.6 | 172.7 | 135.8 | -92.6 | 0 | 0 | 112.4 | M354 H355 N360 R392 | M354-E358 VanDerWaalsContact O-CB 3.31Å; M354-E358 WeakPolarHBondContact O-CB 3.34Å; M354-E358 PolarHBondContact O-N 3.3Å; H355-E358 PolarHBondContact O-N 3.29Å; E358-N360 PolarHBondContact O-N 3.36Å; E358-R392 PolarHBondContact O-NH1 3.13Å; E358-R392 IonicContact OE1-CZ 2.64Å; E358-R392 IonicContact OE1-NE 3.91Å; E358-R392 IonicContact OE1-NH2 2.9Å; E358-R392 PolarHBondContact OE1-NH2 3.24Å |
| 359 | S | 92.8 | Very high | 95.4 | Very high | 48 Ų | 48 | 29.3 Ų | 29.3 | 34% | 0.336 | 16% | 0.16 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -70.2 | -3.2 | 175.2 | 60.6 | 0 | 0 | 0 | 0 | 114.2 | H355 A356 V357 N361 | H355-S359 WeakPolarHBondContact O-CB 3.4Å; H355-S359 PolarHBondContact O-N 3.28Å; H355-S359 PolarHBondContact O-OG 3.32Å; A356-S359 PolarHBondContact O-OG 2.95Å; A356-S359 VanDerWaalsContact O-OG 3.13Å; V357-S359 PolarHBondContact O-N 3.4Å; S359-N361 PolarHBondContact O-N 3.13Å |
| 360 | N | 93.1 | Very high | 95.4 | Very high | 100 Ų | 100 | 35.5 Ų | 35.5 | 54% | 0.535 | 19% | 0.189 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 58.7 | 29.7 | -176.4 | -167.7 | 89.2 | 0 | 0 | 0 | 112.5 | A356 V357 E358 A362 Q394 | A356-N360 PolarHBondContact O-N 3.03Å; V357-N360 PolarHBondContact O-N 3.45Å; E358-N360 PolarHBondContact O-N 3.36Å; N360-A362 PolarHBondContact O-N 2.95Å; N360-Q394 VanDerWaalsContact OD1-CG 3.24Å; N360-Q394 WeakPolarHBondContact OD1-CG 3.1Å; N360-Q394 PolarHBondContact OD1-NE2 2.95Å; N360-Q394 VanDerWaalsContact OD1-NE2 3.08Å |
| 361 | N | 94 | Very high | 95.4 | Very high | 43 Ų | 43 | 37.6 Ų | 37.6 | 23% | 0.23 | 20% | 0.201 | C | C | . | . | trans | -92.4 | 85.3 | -177.9 | -168.6 | -34.2 | 0 | 0 | 0 | 110.5 | G326 A356 S359 D363 M364 V365 | G326-N361 WeakPolarHBondContact CA-ND2 3.26Å; A356-N361 PolarHBondContact O-N 3.31Å; S359-N361 PolarHBondContact O-N 3.13Å; N361-D363 VanDerWaalsContact C-N 3.26Å; N361-D363 PolarHBondContact O-N 2.8Å; N361-D363 PolarHBondContact OD1-N 3.24Å; N361-M364 HydrophobicContact CB-CB 4.1Å; N361-M364 HydrophobicContact CB-CG 4.34Å; N361-M364 VanDerWaalsContact CG-CG 3.48Å; N361-M364 PolarHBondContact O-N 2.95Å; N361-M364 VanDerWaalsContact O-N 3.1Å; N361-M364 WeakPolarHBondContact OD1-CG 3.32Å; N361-M364 PolarHBondContact OD1-N 3.22Å; N361-V365 WeakPolarHBondContact O-CG2 3.38Å; N361-V365 PolarHBondContact O-N 3.22Å | ||
| 362 | A | 93.1 | Very high | 95.1 | Very high | 50 Ų | 50 | 40.2 Ų | 40.2 | 41% | 0.413 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -58.1 | -35.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | N360 M364 V365 H366 | N360-A362 PolarHBondContact O-N 2.95Å; A362-M364 VanDerWaalsContact C-N 3.33Å; A362-M364 PolarHBondContact O-N 2.83Å; A362-V365 PolarHBondContact O-N 2.78Å; A362-H366 WeakPolarHBondContact O-CB 3.31Å; A362-H366 PolarHBondContact O-N 3.39Å |
| 363 | D | 94.7 | Very high | 95 | Very high | 124 Ų | 124 | 40.6 Ų | 40.6 | 66% | 0.663 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -66.5 | -35.4 | 177.6 | -63.5 | -22.1 | 0 | 0 | 0 | 111.8 | N361 F367 | N361-D363 VanDerWaalsContact C-N 3.26Å; N361-D363 PolarHBondContact O-N 2.8Å; N361-D363 PolarHBondContact OD1-N 3.24Å; D363-F367 VanDerWaalsContact O-CB 3.32Å; D363-F367 WeakPolarHBondContact O-CB 3.35Å; D363-F367 PolarHBondContact O-N 2.98Å |
| 364 | M | 96.1 | Very high | 94.9 | Very high | 2 Ų | 2 | 43.8 Ų | 43.8 | 1% | 0.01 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -76.8 | -34.4 | 174.9 | -71.2 | -95.7 | 51.8 | 0 | 0 | 112.7 | R328 A331 A356 N361 A362 H366 F367 L368 | R328-M364 HydrophobicContact CB-CE 3.85Å; R328-M364 HydrophobicContact CB-SD 4.11Å; R328-M364 HydrophobicContact CG-CE 3.84Å; A331-M364 HydrophobicContact CB-CE 4.29Å; A356-M364 HydrophobicContact CB-CB 4.03Å; N361-M364 HydrophobicContact CB-CB 4.1Å; N361-M364 HydrophobicContact CB-CG 4.34Å; N361-M364 VanDerWaalsContact CG-CG 3.48Å; N361-M364 PolarHBondContact O-N 2.95Å; N361-M364 VanDerWaalsContact O-N 3.1Å; N361-M364 WeakPolarHBondContact OD1-CG 3.32Å; N361-M364 PolarHBondContact OD1-N 3.22Å; A362-M364 VanDerWaalsContact C-N 3.33Å; A362-M364 PolarHBondContact O-N 2.83Å; M364-H366 VanDerWaalsContact C-N 3.35Å; M364-F367 HydrophobicContact CE-CB 3.86Å; M364-F367 HydrophobicContact CE-CD1 3.26Å; M364-F367 HydrophobicContact CE-CE1 4.02Å; M364-F367 HydrophobicContact CE-CG 3.75Å; M364-F367 PolarHBondContact O-N 2.98Å; M364-L368 VanDerWaalsContact O-CG 3.31Å; M364-L368 WeakPolarHBondContact O-CG 3.33Å; M364-L368 PolarHBondContact O-N 3.21Å |
| 365 | V | 96.4 | Very high | 94.9 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 170.3 | 175.2 | 0 | 0 | 0 | 0 | 110.1 | L353 A356 V357 N361 A362 L368 I369 T397 L400 L401 | L353-V365 HydrophobicContact CD1-CG1 3.99Å; A356-V365 HydrophobicContact CB-CG2 3.66Å; V357-V365 HydrophobicContact CG2-CG1 4.46Å; V357-V365 HydrophobicContact CG2-CG2 3.73Å; N361-V365 WeakPolarHBondContact O-CG2 3.38Å; N361-V365 PolarHBondContact O-N 3.22Å; A362-V365 PolarHBondContact O-N 2.78Å; V365-L368 PolarHBondContact O-N 3.34Å; V365-I369 HydrophobicContact CG1-CD1 3.76Å; V365-I369 WeakPolarHBondContact O-CD1 3.48Å; V365-I369 VanDerWaalsContact O-CG1 3.26Å; V365-I369 WeakPolarHBondContact O-CG1 3.46Å; V365-I369 PolarHBondContact O-N 2.85Å; V365-I369 VanDerWaalsContact O-N 3.15Å; V365-T397 HydrophobicContact CG1-CG2 4.12Å; V365-T397 HydrophobicContact CG2-CG2 4.22Å; V365-L400 HydrophobicContact CB-CD2 4.43Å; V365-L400 HydrophobicContact CG1-CD2 3.88Å; V365-L401 HydrophobicContact CG1-CD2 4.4Å |
| 366 | H | 95.8 | Very high | 94.9 | Very high | 84 Ų | 84 | 46.1 Ų | 46.1 | 39% | 0.389 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -60.2 | -49.9 | 176.5 | -161.7 | -77.9 | 0 | 0 | 0 | 111.5 | A362 M364 L368 I369 E370 L400 | A362-H366 WeakPolarHBondContact O-CB 3.31Å; A362-H366 PolarHBondContact O-N 3.39Å; M364-H366 VanDerWaalsContact C-N 3.35Å; H366-L368 PolarHBondContact O-N 3.15Å; H366-I369 PolarHBondContact O-N 2.88Å; H366-E370 IonicContact CE1-OE1 3.34Å; H366-E370 PolarHBondContact CE1-OE1 2.85Å; H366-E370 VanDerWaalsContact CE1-OE1 3.29Å; H366-E370 IonicContact CE1-OE2 3.96Å; H366-E370 IonicContact CG-OE2 3.42Å; H366-E370 IonicContact ND1-OE1 3.58Å; H366-E370 PolarHBondContact ND1-OE1 3.22Å; H366-E370 IonicContact ND1-OE2 3.29Å; H366-E370 PolarHBondContact ND1-OE2 3.15Å; H366-E370 WeakPolarHBondContact O-CG 3.29Å; H366-E370 PolarHBondContact O-N 3.48Å; H366-L400 HydrophobicContact CB-CD2 4.05Å |
| 367 | F | 96.6 | Very high | 94.8 | Very high | 16 Ų | 16 | 47.1 Ų | 47.1 | 7% | 0.07 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -57.9 | -43.8 | 178.4 | 172.2 | -94.5 | 0 | 0 | 0 | 113.2 | R328 A331 K332 L335 D363 M364 E370 N371 | R328-F367 HydrophobicContact CG-CB 4.31Å; R328-F367 HydrophobicContact CG-CD1 4.27Å; R328-F367 HydrophobicContact CG-CD2 3.64Å; R328-F367 HydrophobicContact CG-CE2 3.98Å; R328-F367 HydrophobicContact CG-CG 3.79Å; R328-F367 HydrophobicContact CG-CZ 4.45Å; A331-F367 HydrophobicContact CB-CE1 4.07Å; K332-F367 HydrophobicContact CB-CE2 4.02Å; K332-F367 HydrophobicContact CB-CZ 3.66Å; K332-F367 HydrophobicContact CG-CE2 4.3Å; K332-F367 HydrophobicContact CG-CZ 4.15Å; L335-F367 HydrophobicContact CD1-CE1 3.78Å; L335-F367 HydrophobicContact CD1-CZ 4.07Å; D363-F367 VanDerWaalsContact O-CB 3.32Å; D363-F367 WeakPolarHBondContact O-CB 3.35Å; D363-F367 PolarHBondContact O-N 2.98Å; M364-F367 HydrophobicContact CE-CB 3.86Å; M364-F367 HydrophobicContact CE-CD1 3.26Å; M364-F367 HydrophobicContact CE-CE1 4.02Å; M364-F367 HydrophobicContact CE-CG 3.75Å; M364-F367 PolarHBondContact O-N 2.98Å; F367-E370 PolarHBondContact O-N 3.49Å; F367-N371 VanDerWaalsContact CE2-ND2 3.31Å; F367-N371 WeakPolarHBondContact CE2-ND2 3.49Å; F367-N371 WeakPolarHBondContact CZ-ND2 3.41Å; F367-N371 PolarHBondContact O-N 2.82Å; F367-N371 VanDerWaalsContact O-N 3.15Å; F367-N371 PolarHBondContact O-ND2 2.8Å |
| 368 | L | 96.4 | Very high | 94.8 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -67.8 | -37.9 | -179.9 | -70.4 | 169.2 | 0 | 0 | 0 | 111.9 | V323 L335 I341 P352 L353 A356 M364 V365 H366 N371 G372 C373 | V323-L368 HydrophobicContact CG1-CD1 3.95Å; V323-L368 HydrophobicContact CG2-CD1 4.14Å; V323-L368 HydrophobicContact CG2-CD2 4.27Å; L335-L368 HydrophobicContact CD1-CD2 4.5Å; I341-L368 HydrophobicContact CD1-CD2 4.15Å; I341-L368 HydrophobicContact CG1-CD2 3.97Å; P352-L368 HydrophobicContact CB-CD1 4.25Å; L353-L368 HydrophobicContact CB-CD1 4.46Å; L353-L368 HydrophobicContact CD1-CB 4.24Å; A356-L368 HydrophobicContact CB-CD1 3.98Å; M364-L368 VanDerWaalsContact O-CG 3.31Å; M364-L368 WeakPolarHBondContact O-CG 3.33Å; M364-L368 PolarHBondContact O-N 3.21Å; V365-L368 PolarHBondContact O-N 3.34Å; H366-L368 PolarHBondContact O-N 3.15Å; L368-N371 CarbonylContact O-C 3.56Å; L368-N371 PolarHBondContact O-N 2.78Å; L368-G372 PolarHBondContact O-N 2.96Å; L368-C373 HydrophobicContact CB-CB 4.41Å; L368-C373 PolarHBondContact O-N 3.18Å; L368-C373 PolarHBondContact O-SG 3.5Å |
| 369 | I | 95.6 | Very high | 94.9 | Very high | 33 Ų | 33 | 47.4 Ų | 47.4 | 17% | 0.169 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.7 | -41.4 | 174.4 | -68.2 | 165.8 | 0 | 0 | 0 | 110.9 | L353 V365 H366 N371 G372 V375 L400 L401 | L353-I369 HydrophobicContact CD1-CD1 4.49Å; L353-I369 HydrophobicContact CD1-CG1 4.16Å; V365-I369 HydrophobicContact CG1-CD1 3.76Å; V365-I369 WeakPolarHBondContact O-CD1 3.48Å; V365-I369 VanDerWaalsContact O-CG1 3.26Å; V365-I369 WeakPolarHBondContact O-CG1 3.46Å; V365-I369 PolarHBondContact O-N 2.85Å; V365-I369 VanDerWaalsContact O-N 3.15Å; H366-I369 PolarHBondContact O-N 2.88Å; I369-N371 PolarHBondContact O-N 3.16Å; I369-G372 PolarHBondContact O-N 2.94Å; I369-V375 HydrophobicContact CG1-CG2 4.39Å; I369-L400 HydrophobicContact CD1-CD2 4.26Å; I369-L400 HydrophobicContact CD1-CG 3.91Å; I369-L401 HydrophobicContact CD1-CD2 4.17Å |
| 370 | E | 95.3 | Very high | 95.1 | Very high | 131 Ų | 131 | 51.3 Ų | 51.3 | 61% | 0.612 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -62.9 | -26.7 | 175.2 | -74.6 | 173.8 | 125 | 0 | 0 | 113.4 | H366 F367 | H366-E370 IonicContact CE1-OE1 3.34Å; H366-E370 PolarHBondContact CE1-OE1 2.85Å; H366-E370 VanDerWaalsContact CE1-OE1 3.29Å; H366-E370 IonicContact CE1-OE2 3.96Å; H366-E370 IonicContact CG-OE2 3.42Å; H366-E370 IonicContact ND1-OE1 3.58Å; H366-E370 PolarHBondContact ND1-OE1 3.22Å; H366-E370 IonicContact ND1-OE2 3.29Å; H366-E370 PolarHBondContact ND1-OE2 3.15Å; H366-E370 WeakPolarHBondContact O-CG 3.29Å; H366-E370 PolarHBondContact O-N 3.48Å; F367-E370 PolarHBondContact O-N 3.49Å |
| 371 | N | 94.1 | Very high | 95.2 | Very high | 68 Ų | 68 | 48.3 Ų | 48.3 | 36% | 0.364 | 27% | 0.265 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.1 | 10.9 | 174.5 | -69.2 | -91.4 | 0 | 0 | 0 | 113.1 | L335 I341 F367 L368 I369 | L335-N371 HydrophobicContact CD1-CB 4.08Å; I341-N371 HydrophobicContact CD1-CB 3.55Å; F367-N371 VanDerWaalsContact CE2-ND2 3.31Å; F367-N371 WeakPolarHBondContact CE2-ND2 3.49Å; F367-N371 WeakPolarHBondContact CZ-ND2 3.41Å; F367-N371 PolarHBondContact O-N 2.82Å; F367-N371 VanDerWaalsContact O-N 3.15Å; F367-N371 PolarHBondContact O-ND2 2.8Å; L368-N371 CarbonylContact O-C 3.56Å; L368-N371 PolarHBondContact O-N 2.78Å; I369-N371 PolarHBondContact O-N 3.16Å |
| 372 | G | 91.5 | Very high | 95.2 | Very high | 56 Ų | 56 | 46.2 Ų | 46.2 | 58% | 0.577 | 25% | 0.254 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.8 | 31.3 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | L368 I369 | L368-G372 PolarHBondContact O-N 2.96Å; I369-G372 PolarHBondContact O-N 2.94Å |
| 373 | C | 93.8 | Very high | 95.4 | Very high | 9 Ų | 9 | 45.4 Ų | 45.4 | 6% | 0.061 | 24% | 0.242 | C | C | . | . | trans | -62.8 | 151.1 | 172.3 | 70.4 | 0 | 0 | 0 | 0 | 112.6 | I341 L368 V375 | I341-C373 HydrophobicContact CD1-CB 3.83Å; I341-C373 HydrophobicContact CG1-CB 3.84Å; I341-C373 HydrophobicContact CG2-CB 4.37Å; L368-C373 HydrophobicContact CB-CB 4.41Å; L368-C373 PolarHBondContact O-N 3.18Å; L368-C373 PolarHBondContact O-SG 3.5Å; C373-V375 PolarHBondContact O-N 3.02Å; C373-V375 VanDerWaalsContact O-N 3.14Å | ||
| 374 | D | 94.9 | Very high | 95.5 | Very high | 67 Ų | 67 | 39.5 Ų | 39.5 | 36% | 0.358 | 21% | 0.211 | S | C | . | . | trans | -73.9 | 105.8 | 172.3 | 173 | 28.5 | 0 | 0 | 0 | 110.6 | N342 N376 S377 | N342-D374 PolarHBondContact OD1-N 2.95Å; D374-N376 PolarHBondContact O-N 2.84Å; D374-N376 WeakPolarHBondContact OD1-CA 3.19Å; D374-N376 PolarHBondContact OD1-N 3.4Å; D374-S377 WeakPolarHBondContact CB-OG 3.39Å; D374-S377 PolarHBondContact O-OG 3.29Å; D374-S377 PolarHBondContact OD1-N 2.93Å; D374-S377 VanDerWaalsContact OD2-CA 3.22Å; D374-S377 WeakPolarHBondContact OD2-CA 3.36Å; D374-S377 WeakPolarHBondContact OD2-CB 3.33Å; D374-S377 PolarHBondContact OD2-N 3.05Å; D374-S377 PolarHBondContact OD2-OG 3.45Å | ||
| 375 | V | 95.8 | Very high | 95.5 | Very high | 12 Ų | 12 | 39.4 Ų | 39.4 | 7% | 0.073 | 21% | 0.211 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66 | -23 | 179 | -170.2 | 0 | 0 | 0 | 0 | 112.3 | L353 I369 C373 L401 A406 | L353-V375 HydrophobicContact CD2-CB 4.49Å; L353-V375 HydrophobicContact CD2-CG1 4.48Å; I369-V375 HydrophobicContact CG1-CG2 4.39Å; C373-V375 PolarHBondContact O-N 3.02Å; C373-V375 VanDerWaalsContact O-N 3.14Å; V375-L401 HydrophobicContact CG1-CB 4.46Å; V375-L401 HydrophobicContact CG1-CD2 3.71Å; V375-A406 HydrophobicContact CG1-CB 3.64Å |
| 376 | N | 95.6 | Very high | 95.6 | Very high | 51 Ų | 51 | 39.4 Ų | 39.4 | 27% | 0.273 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -102.9 | 2.3 | -173.3 | -69.2 | -51 | 0 | 0 | 0 | 114.3 | D374 G405 A406 D407 L410 | D374-N376 PolarHBondContact O-N 2.84Å; D374-N376 WeakPolarHBondContact OD1-CA 3.19Å; D374-N376 PolarHBondContact OD1-N 3.4Å; N376-G405 PolarHBondContact ND2-O 3.21Å; N376-A406 WeakPolarHBondContact OD1-CA 3.37Å; N376-D407 PolarHBondContact OD1-N 3.43Å; N376-L410 HydrophobicContact CB-CD1 4.07Å |
| 377 | S | 95.7 | Very high | 95.6 | Very high | 22 Ų | 22 | 35.6 Ų | 35.6 | 15% | 0.154 | 19% | 0.193 | C | C | . | . | trans | -48.4 | 144.8 | 173.1 | -78.9 | 0 | 0 | 0 | 0 | 111.6 | M354 D374 T384 | M354-S377 VanDerWaalsContact CE-C 3.46Å; M354-S377 WeakPolarHBondContact CE-O 3.49Å; D374-S377 WeakPolarHBondContact CB-OG 3.39Å; D374-S377 PolarHBondContact O-OG 3.29Å; D374-S377 PolarHBondContact OD1-N 2.93Å; D374-S377 VanDerWaalsContact OD2-CA 3.22Å; D374-S377 WeakPolarHBondContact OD2-CA 3.36Å; D374-S377 WeakPolarHBondContact OD2-CB 3.33Å; D374-S377 PolarHBondContact OD2-N 3.05Å; D374-S377 PolarHBondContact OD2-OG 3.45Å; S377-T384 WeakPolarHBondContact O-CA 3.37Å | ||
| 378 | Q | 95.8 | Very high | 95.6 | Very high | 78 Ų | 78 | 36 Ų | 36 | 36% | 0.364 | 20% | 0.195 | S | C | . | . | trans | -117.9 | 129.7 | -179.7 | -68.1 | -170.7 | -81.2 | 0 | 0 | 111.3 | G382 T384 K411 | Q378-G382 PolarHBondContact NE2-O 2.82Å; Q378-T384 HydrophobicContact CG-CG2 3.77Å; Q378-K411 PolarHBondContact NE2-O 3.29Å | ||
| 379 | S | 96.6 | Very high | 95.6 | Very high | 2 Ų | 2 | 36 Ų | 36 | 1% | 0.014 | 20% | 0.195 | C | C | . | . | trans | -69.4 | 173.1 | 171.4 | 59.7 | 0 | 0 | 0 | 0 | 112.5 | S348 G349 Q350 S381 G382 N383 | S348-S379 WeakPolarHBondContact O-CB 3.45Å; G349-S379 WeakPolarHBondContact O-CA 3.5Å; Q350-S379 PolarHBondContact NE2-OG 3.01Å; S379-S381 PolarHBondContact O-N 3.27Å; S379-S381 PolarHBondContact OG-OG 3.11Å; S379-G382 WeakPolarHBondContact O-CA 3.22Å; S379-G382 PolarHBondContact O-N 3.1Å; S379-N383 PolarHBondContact N-O 3.42Å; S379-N383 PolarHBondContact OG-N 3.43Å; S379-N383 PolarHBondContact OG-O 3.47Å | ||
| 380 | Y | 95.9 | Very high | 95.6 | Very high | 129 Ų | 129 | 34.4 Ų | 34.4 | 51% | 0.506 | 19% | 0.187 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.6 | -2.8 | 176.5 | -57.4 | -26.3 | 0 | 0 | 0 | 114.6 | D345 S348 G349 Y413 | D345-Y380 PolarHBondContact O-OH 3.19Å; S348-Y380 PolarHBondContact O-N 3.05Å; G349-Y380 VanDerWaalsContact N-CD2 3.27Å; G349-Y380 VanDerWaalsContact N-CE2 3.26Å; Y380-Y413 WeakPolarHBondContact O-CD2 3.24Å; Y380-Y413 WeakPolarHBondContact O-CE2 3.41Å |
| 381 | S | 94.8 | Very high | 95.6 | Very high | 37 Ų | 37 | 29.8 Ų | 29.8 | 26% | 0.259 | 18% | 0.175 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | 1.1 | 171.1 | 64 | 0 | 0 | 0 | 0 | 113.5 | S379 N383 N412 Y413 | S379-S381 PolarHBondContact O-N 3.27Å; S379-S381 PolarHBondContact OG-OG 3.11Å; S381-N383 PolarHBondContact O-N 3.41Å; S381-N383 PolarHBondContact OG-ND2 2.99Å; S381-N412 WeakPolarHBondContact O-CB 3.48Å; S381-Y413 PolarHBondContact O-N 3.04Å |
| 382 | G | 95.5 | Very high | 95.6 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 18% | 0.178 | C | C | . | . | S | Bend | trans | 73.5 | -4 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q378 S379 T384 N412 | Q378-G382 PolarHBondContact NE2-O 2.82Å; S379-G382 WeakPolarHBondContact O-CA 3.22Å; S379-G382 PolarHBondContact O-N 3.1Å; G382-T384 PolarHBondContact O-N 2.9Å; G382-N412 WeakPolarHBondContact O-CA 3.49Å |
| 383 | N | 96.6 | Very high | 95.7 | Very high | 32 Ų | 32 | 30.1 Ų | 30.1 | 17% | 0.171 | 16% | 0.159 | C | C | . | . | trans | -71.6 | 131.3 | 178.7 | -71.8 | -67.2 | 0 | 0 | 0 | 110.9 | S379 S381 H387 N412 | S379-N383 PolarHBondContact N-O 3.42Å; S379-N383 PolarHBondContact OG-N 3.43Å; S379-N383 PolarHBondContact OG-O 3.47Å; S381-N383 PolarHBondContact O-N 3.41Å; S381-N383 PolarHBondContact OG-ND2 2.99Å; N383-H387 HydrophobicContact CB-CB 3.97Å; N383-H387 WeakPolarHBondContact OD1-CB 3.48Å; N383-H387 PolarHBondContact OD1-CD2 3.15Å; N383-N412 WeakPolarHBondContact OD1-CB 3.43Å; N383-N412 PolarHBondContact OD1-ND2 3Å | ||
| 384 | T | 96.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 16% | 0.159 | C | C | . | . | trans | -89.1 | 168.7 | 170.2 | 65.9 | 0 | 0 | 0 | 0 | 111.6 | S377 Q378 G382 L386 H387 I388 L410 | S377-T384 WeakPolarHBondContact O-CA 3.37Å; Q378-T384 HydrophobicContact CG-CG2 3.77Å; G382-T384 PolarHBondContact O-N 2.9Å; T384-L386 PolarHBondContact O-N 3.02Å; T384-L386 VanDerWaalsContact O-N 3.15Å; T384-L386 PolarHBondContact OG1-N 2.93Å; T384-H387 PolarHBondContact N-ND1 3.35Å; T384-H387 WeakPolarHBondContact O-CB 3.47Å; T384-H387 PolarHBondContact O-N 3.46Å; T384-H387 PolarHBondContact OG1-N 3.49Å; T384-H387 PolarHBondContact OG1-ND1 3.04Å; T384-I388 PolarHBondContact O-N 3.38Å; T384-L410 HydrophobicContact CG2-CB 4.42Å; T384-L410 HydrophobicContact CG2-CD1 3.82Å | ||
| 385 | A | 96.8 | Very high | 95.6 | Very high | 1 Ų | 1 | 28.3 Ų | 28.3 | 1% | 0.008 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -52.3 | -35.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | L353 M354 V357 I388 A389 L401 | L353-A385 HydrophobicContact CD2-CB 3.78Å; L353-A385 HydrophobicContact CG-CB 4.01Å; M354-A385 HydrophobicContact CG-CB 4.21Å; V357-A385 HydrophobicContact CG2-CB 4.24Å; A385-I388 PolarHBondContact O-N 3.1Å; A385-A389 PolarHBondContact O-N 3.46Å; A385-L401 HydrophobicContact CB-CD1 4.4Å; A385-L401 HydrophobicContact CB-CD2 4.19Å |
| 386 | L | 96.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -67.5 | -38.6 | 176.7 | -171.4 | 64.5 | 0 | 0 | 0 | 112.7 | T384 I388 A389 C390 V398 L401 L402 A406 P418 L431 | T384-L386 PolarHBondContact O-N 3.02Å; T384-L386 VanDerWaalsContact O-N 3.15Å; T384-L386 PolarHBondContact OG1-N 2.93Å; L386-I388 VanDerWaalsContact C-N 3.33Å; L386-I388 PolarHBondContact O-N 2.98Å; L386-A389 PolarHBondContact O-N 2.94Å; L386-C390 WeakPolarHBondContact O-CB 3.38Å; L386-C390 PolarHBondContact O-N 3.19Å; L386-C390 PolarHBondContact O-SG 3.04Å; L386-V398 HydrophobicContact CD1-CB 4.43Å; L386-V398 HydrophobicContact CD1-CG1 4.08Å; L386-V398 HydrophobicContact CD1-CG2 4.29Å; L386-L401 HydrophobicContact CB-CD1 4.47Å; L386-L401 HydrophobicContact CD1-CB 4Å; L386-L401 HydrophobicContact CD1-CD1 4.22Å; L386-L402 HydrophobicContact CD1-CD2 4.42Å; L386-L402 HydrophobicContact CD1-CG 4.25Å; L386-L402 HydrophobicContact CD2-CD2 3.97Å; L386-A406 HydrophobicContact CB-CB 4.22Å; L386-A406 HydrophobicContact CD1-CB 4.46Å; L386-A406 HydrophobicContact CD2-CB 3.91Å; L386-A406 HydrophobicContact CG-CB 4.42Å; L386-P418 HydrophobicContact CB-CG 4.34Å; L386-P418 HydrophobicContact CD2-CB 4Å; L386-P418 HydrophobicContact CD2-CG 3.92Å; L386-P418 HydrophobicContact CG-CB 3.87Å; L386-P418 HydrophobicContact CG-CG 4.04Å; L386-L431 HydrophobicContact CD1-CD2 4.39Å; L386-L431 HydrophobicContact CD2-CD2 4.18Å; L386-L431 HydrophobicContact CG-CD2 4.5Å |
| 387 | H | 96.9 | Very high | 95.5 | Very high | 3 Ų | 3 | 31 Ų | 31 | 1% | 0.014 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -58.7 | -46.1 | 173.3 | -71.9 | 79.9 | 0 | 0 | 0 | 111.1 | N383 T384 C390 G391 L410 D416 V421 | N383-H387 HydrophobicContact CB-CB 3.97Å; N383-H387 WeakPolarHBondContact OD1-CB 3.48Å; N383-H387 PolarHBondContact OD1-CD2 3.15Å; T384-H387 PolarHBondContact N-ND1 3.35Å; T384-H387 WeakPolarHBondContact O-CB 3.47Å; T384-H387 PolarHBondContact O-N 3.46Å; T384-H387 PolarHBondContact OG1-N 3.49Å; T384-H387 PolarHBondContact OG1-ND1 3.04Å; H387-C390 PolarHBondContact O-N 3.46Å; H387-G391 PolarHBondContact O-N 3.43Å; H387-L410 PolarHBondContact CE1-O 3.08Å; H387-D416 PolarHBondContact NE2-O 3.05Å; H387-V421 HydrophobicContact CB-CG2 4.3Å |
| 388 | I | 96.1 | Very high | 95.5 | Very high | 25 Ų | 25 | 30 Ų | 30 | 13% | 0.128 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65.2 | -44.4 | -177.8 | -56.7 | 168.5 | 0 | 0 | 0 | 110.6 | Q350 M354 V357 T384 A385 L386 C390 G391 R392 | Q350-I388 VanDerWaalsContact OE1-CD1 3.32Å; M354-I388 HydrophobicContact CB-CD1 3.77Å; M354-I388 HydrophobicContact CG-CD1 3.93Å; V357-I388 HydrophobicContact CG1-CB 4.02Å; V357-I388 HydrophobicContact CG1-CG2 3.85Å; T384-I388 PolarHBondContact O-N 3.38Å; A385-I388 PolarHBondContact O-N 3.1Å; L386-I388 VanDerWaalsContact C-N 3.33Å; L386-I388 PolarHBondContact O-N 2.98Å; I388-C390 VanDerWaalsContact C-N 3.35Å; I388-C390 PolarHBondContact O-N 3.44Å; I388-G391 PolarHBondContact O-N 3.48Å; I388-R392 HydrophobicContact CG2-CG 4.36Å; I388-R392 WeakPolarHBondContact O-CB 3.42Å; I388-R392 WeakPolarHBondContact O-CG 3.49Å; I388-R392 PolarHBondContact O-N 2.99Å |
| 389 | A | 96.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.3 | -42.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | V357 A385 L386 G393 Q394 T397 V398 L401 | V357-A389 HydrophobicContact CG1-CB 3.75Å; A385-A389 PolarHBondContact O-N 3.46Å; L386-A389 PolarHBondContact O-N 2.94Å; A389-G393 PolarHBondContact O-N 2.8Å; A389-Q394 HydrophobicContact CB-CB 4.46Å; A389-Q394 PolarHBondContact O-N 2.91Å; A389-T397 HydrophobicContact CB-CG2 4.16Å; A389-V398 HydrophobicContact CB-CG2 3.65Å; A389-L401 HydrophobicContact CB-CD1 3.86Å |
| 390 | C | 95.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.7 | -44.6 | 176.8 | -72 | 0 | 0 | 0 | 0 | 113.1 | L386 H387 I388 G393 P418 V421 K423 I427 | L386-C390 WeakPolarHBondContact O-CB 3.38Å; L386-C390 PolarHBondContact O-N 3.19Å; L386-C390 PolarHBondContact O-SG 3.04Å; H387-C390 PolarHBondContact O-N 3.46Å; I388-C390 VanDerWaalsContact C-N 3.35Å; I388-C390 PolarHBondContact O-N 3.44Å; C390-G393 PolarHBondContact O-N 3.38Å; C390-P418 WeakPolarHBondContact CB-O 3.3Å; C390-P418 PolarHBondContact SG-O 3.02Å; C390-V421 CarbonylContact C-O 3.54Å; C390-V421 HydrophobicContact CB-CG2 4.15Å; C390-K423 PolarHBondContact O-N 2.76Å; C390-I427 HydrophobicContact CB-CG2 4.12Å; C390-I427 VanDerWaalsContact SG-CG2 3.54Å |
| 391 | G | 94.9 | Very high | 95.2 | Very high | 34 Ų | 34 | 26.4 Ų | 26.4 | 35% | 0.351 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -69.8 | -36.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | H387 I388 V421 K423 | H387-G391 PolarHBondContact O-N 3.43Å; I388-G391 PolarHBondContact O-N 3.48Å; G391-V421 VanDerWaalsContact CA-O 3.3Å; G391-V421 WeakPolarHBondContact CA-O 3.4Å; G391-V421 PolarHBondContact N-O 3.35Å; G391-K423 WeakPolarHBondContact O-CB 3.17Å; G391-K423 WeakPolarHBondContact O-CD 3.44Å |
| 392 | R | 94.5 | Very high | 95.2 | Very high | 114 Ų | 114 | 27.1 Ų | 27.1 | 43% | 0.43 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -72.8 | -30.3 | 175.6 | -72.6 | -176.7 | 170.2 | -98.4 | -18.7 | 112.3 | E358 I388 Q394 K423 | E358-R392 PolarHBondContact O-NH1 3.13Å; E358-R392 IonicContact OE1-CZ 2.64Å; E358-R392 IonicContact OE1-NE 3.91Å; E358-R392 IonicContact OE1-NH2 2.9Å; E358-R392 PolarHBondContact OE1-NH2 3.24Å; I388-R392 HydrophobicContact CG2-CG 4.36Å; I388-R392 WeakPolarHBondContact O-CB 3.42Å; I388-R392 WeakPolarHBondContact O-CG 3.49Å; I388-R392 PolarHBondContact O-N 2.99Å; R392-Q394 HydrophobicContact CB-CG 3.98Å; R392-K423 PolarHBondContact O-NZ 3.31Å |
| 393 | G | 93.4 | Very high | 95.1 | Very high | 17 Ų | 17 | 35.6 Ų | 35.6 | 18% | 0.175 | 18% | 0.178 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 104.3 | 20.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | A389 C390 V395 I427 | A389-G393 PolarHBondContact O-N 2.8Å; C390-G393 PolarHBondContact O-N 3.38Å; G393-V395 PolarHBondContact O-N 3.29Å; G393-V395 VanDerWaalsContact O-N 3.16Å; G393-I427 VanDerWaalsContact C-CD1 3.44Å |
| 394 | Q | 94.1 | Very high | 94.9 | Very high | 14 Ų | 14 | 35.9 Ų | 35.9 | 7% | 0.065 | 18% | 0.182 | C | C | . | . | trans | -86.9 | 83.8 | -167.8 | -56.2 | -179.4 | -0.4 | 0 | 0 | 112.2 | V357 N360 A389 R392 D396 T397 V398 | V357-Q394 PolarHBondContact O-NE2 3.38Å; V357-Q394 PolarHBondContact O-OE1 2.94Å; N360-Q394 VanDerWaalsContact OD1-CG 3.24Å; N360-Q394 WeakPolarHBondContact OD1-CG 3.1Å; N360-Q394 PolarHBondContact OD1-NE2 2.95Å; N360-Q394 VanDerWaalsContact OD1-NE2 3.08Å; A389-Q394 HydrophobicContact CB-CB 4.46Å; A389-Q394 PolarHBondContact O-N 2.91Å; R392-Q394 HydrophobicContact CB-CG 3.98Å; Q394-D396 VanDerWaalsContact C-N 3.3Å; Q394-D396 PolarHBondContact O-N 3.38Å; Q394-T397 WeakPolarHBondContact CB-OG1 3.49Å; Q394-T397 PolarHBondContact O-N 3.24Å; Q394-T397 PolarHBondContact OE1-OG1 3.39Å; Q394-V398 WeakPolarHBondContact O-CG2 3.29Å; Q394-V398 PolarHBondContact O-N 2.92Å | ||
| 395 | V | 93.1 | Very high | 94.7 | Very high | 24 Ų | 24 | 38.2 Ų | 38.2 | 15% | 0.145 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -53.7 | -43.8 | -173.6 | 177.7 | 0 | 0 | 0 | 0 | 112.8 | G393 V398 R399 K426 I427 | G393-V395 PolarHBondContact O-N 3.29Å; G393-V395 VanDerWaalsContact O-N 3.16Å; V395-V398 PolarHBondContact O-N 3.34Å; V395-R399 VanDerWaalsContact CG1-NH2 3.32Å; V395-R399 WeakPolarHBondContact O-CG 3.48Å; V395-R399 PolarHBondContact O-N 3.27Å; V395-R399 VanDerWaalsContact O-N 3.12Å; V395-K426 HydrophobicContact CG2-CB 4.37Å; V395-I427 HydrophobicContact CG2-CD1 4.37Å; V395-I427 HydrophobicContact CG2-CG1 3.88Å |
| 396 | D | 93.2 | Very high | 94.6 | Very high | 109 Ų | 109 | 38.6 Ų | 38.6 | 58% | 0.583 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -86.3 | -30.2 | -171.3 | -54.3 | -56.6 | 0 | 0 | 0 | 112.6 | Q394 V398 R399 L400 | Q394-D396 VanDerWaalsContact C-N 3.3Å; Q394-D396 PolarHBondContact O-N 3.38Å; D396-V398 VanDerWaalsContact C-N 3.32Å; D396-V398 PolarHBondContact O-N 3.01Å; D396-R399 WeakPolarHBondContact O-CB 3.47Å; D396-R399 PolarHBondContact O-N 2.64Å; D396-R399 WeakPolarHBondContact OD1-CD 3.41Å; D396-R399 IonicContact OD1-CZ 3.62Å; D396-R399 IonicContact OD1-NE 3.68Å; D396-R399 PolarHBondContact OD1-NE 3.07Å; D396-L400 PolarHBondContact O-N 3.45Å |
| 397 | T | 95.3 | Very high | 94.4 | Very high | 10 Ų | 10 | 41.4 Ų | 41.4 | 6% | 0.061 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.7 | -43.6 | 163.8 | -42.8 | 0 | 0 | 0 | 0 | 111.1 | V357 V365 A389 Q394 R399 L400 L401 | V357-T397 HydrophobicContact CG1-CG2 4.35Å; V357-T397 HydrophobicContact CG2-CG2 3.91Å; V365-T397 HydrophobicContact CG1-CG2 4.12Å; V365-T397 HydrophobicContact CG2-CG2 4.22Å; A389-T397 HydrophobicContact CB-CG2 4.16Å; Q394-T397 WeakPolarHBondContact CB-OG1 3.49Å; Q394-T397 PolarHBondContact O-N 3.24Å; Q394-T397 PolarHBondContact OE1-OG1 3.39Å; T397-R399 PolarHBondContact O-N 3.31Å; T397-L400 PolarHBondContact O-N 3.32Å; T397-L401 HydrophobicContact CG2-CD1 4.07Å; T397-L401 HydrophobicContact CG2-CG 4.47Å; T397-L401 WeakPolarHBondContact O-CB 3.36Å; T397-L401 VanDerWaalsContact O-CG 3.29Å; T397-L401 WeakPolarHBondContact O-CG 3.37Å; T397-L401 PolarHBondContact O-N 3.17Å |
| 398 | V | 95.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.3 | -42.4 | 174.3 | 167.3 | 0 | 0 | 0 | 0 | 111.4 | L386 A389 Q394 V395 D396 L400 L402 I427 V430 L431 | L386-V398 HydrophobicContact CD1-CB 4.43Å; L386-V398 HydrophobicContact CD1-CG1 4.08Å; L386-V398 HydrophobicContact CD1-CG2 4.29Å; A389-V398 HydrophobicContact CB-CG2 3.65Å; Q394-V398 WeakPolarHBondContact O-CG2 3.29Å; Q394-V398 PolarHBondContact O-N 2.92Å; V395-V398 PolarHBondContact O-N 3.34Å; D396-V398 VanDerWaalsContact C-N 3.32Å; D396-V398 PolarHBondContact O-N 3.01Å; V398-L400 VanDerWaalsContact C-N 3.33Å; V398-L400 PolarHBondContact O-N 2.91Å; V398-L402 HydrophobicContact CG1-CD1 3.75Å; V398-L402 HydrophobicContact CG1-CG 4.38Å; V398-L402 WeakPolarHBondContact O-CB 3.31Å; V398-L402 WeakPolarHBondContact O-CD1 3.33Å; V398-L402 VanDerWaalsContact O-CG 3.22Å; V398-L402 WeakPolarHBondContact O-CG 3.43Å; V398-L402 PolarHBondContact O-N 3.17Å; V398-I427 HydrophobicContact CG1-CG2 4.33Å; V398-I427 HydrophobicContact CG2-CG2 4.2Å; V398-V430 HydrophobicContact CG1-CG1 4.05Å; V398-L431 HydrophobicContact CG1-CD2 4.23Å; V398-L431 HydrophobicContact CG1-CG 4.42Å |
| 399 | R | 93.8 | Very high | 94 | Very high | 100 Ų | 100 | 45.8 Ų | 45.8 | 38% | 0.377 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.8 | -39.1 | 175.1 | -65.6 | 174.9 | -156.1 | -74.4 | 1.4 | 112.5 | V395 D396 T397 K403 V430 | V395-R399 VanDerWaalsContact CG1-NH2 3.32Å; V395-R399 WeakPolarHBondContact O-CG 3.48Å; V395-R399 PolarHBondContact O-N 3.27Å; V395-R399 VanDerWaalsContact O-N 3.12Å; D396-R399 WeakPolarHBondContact O-CB 3.47Å; D396-R399 PolarHBondContact O-N 2.64Å; D396-R399 WeakPolarHBondContact OD1-CD 3.41Å; D396-R399 IonicContact OD1-CZ 3.62Å; D396-R399 IonicContact OD1-NE 3.68Å; D396-R399 PolarHBondContact OD1-NE 3.07Å; T397-R399 PolarHBondContact O-N 3.31Å; R399-K403 WeakPolarHBondContact O-CB 3.45Å; R399-K403 VanDerWaalsContact O-CG 3.26Å; R399-K403 WeakPolarHBondContact O-CG 3.39Å; R399-K403 PolarHBondContact O-N 3.07Å; R399-K403 VanDerWaalsContact O-N 3.1Å; R399-V430 HydrophobicContact CG-CG1 4.22Å |
| 400 | L | 94.4 | Very high | 93.9 | Very high | 35 Ų | 35 | 48 Ų | 48 | 18% | 0.183 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -66.6 | -50.9 | -180 | -179.9 | 57.5 | 0 | 0 | 0 | 110.7 | V365 H366 I369 D396 T397 V398 L402 K403 S404 | V365-L400 HydrophobicContact CB-CD2 4.43Å; V365-L400 HydrophobicContact CG1-CD2 3.88Å; H366-L400 HydrophobicContact CB-CD2 4.05Å; I369-L400 HydrophobicContact CD1-CD2 4.26Å; I369-L400 HydrophobicContact CD1-CG 3.91Å; D396-L400 PolarHBondContact O-N 3.45Å; T397-L400 PolarHBondContact O-N 3.32Å; V398-L400 VanDerWaalsContact C-N 3.33Å; V398-L400 PolarHBondContact O-N 2.91Å; L400-L402 PolarHBondContact O-N 2.92Å; L400-K403 WeakPolarHBondContact O-CB 3.43Å; L400-K403 PolarHBondContact O-N 2.9Å; L400-K403 VanDerWaalsContact O-N 3.11Å; L400-S404 PolarHBondContact O-N 3.29Å; L400-S404 PolarHBondContact O-OG 3.19Å |
| 401 | L | 94.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -58.1 | -44.5 | 177 | -67.8 | 168 | 0 | 0 | 0 | 112.1 | L353 V357 V365 I369 V375 A385 L386 A389 T397 K403 S404 G405 A406 | L353-L401 HydrophobicContact CD2-CD2 4.25Å; V357-L401 HydrophobicContact CG2-CD1 4.31Å; V365-L401 HydrophobicContact CG1-CD2 4.4Å; I369-L401 HydrophobicContact CD1-CD2 4.17Å; V375-L401 HydrophobicContact CG1-CB 4.46Å; V375-L401 HydrophobicContact CG1-CD2 3.71Å; A385-L401 HydrophobicContact CB-CD1 4.4Å; A385-L401 HydrophobicContact CB-CD2 4.19Å; L386-L401 HydrophobicContact CB-CD1 4.47Å; L386-L401 HydrophobicContact CD1-CB 4Å; L386-L401 HydrophobicContact CD1-CD1 4.22Å; A389-L401 HydrophobicContact CB-CD1 3.86Å; T397-L401 HydrophobicContact CG2-CD1 4.07Å; T397-L401 HydrophobicContact CG2-CG 4.47Å; T397-L401 WeakPolarHBondContact O-CB 3.36Å; T397-L401 VanDerWaalsContact O-CG 3.29Å; T397-L401 WeakPolarHBondContact O-CG 3.37Å; T397-L401 PolarHBondContact O-N 3.17Å; L401-K403 VanDerWaalsContact C-N 3.33Å; L401-K403 PolarHBondContact O-N 3.46Å; L401-S404 WeakPolarHBondContact CA-OG 3.35Å; L401-S404 CarbonylContact O-C 3.5Å; L401-S404 PolarHBondContact O-N 3.47Å; L401-S404 PolarHBondContact O-OG 2.95Å; L401-G405 PolarHBondContact O-N 3.12Å; L401-A406 VanDerWaalsContact C-CB 3.48Å; L401-A406 HydrophobicContact CB-CB 3.89Å; L401-A406 WeakPolarHBondContact O-CB 3.26Å; L401-A406 PolarHBondContact O-N 2.98Å |
| 402 | L | 93.9 | Very high | 93.9 | Very high | 51 Ų | 51 | 52 Ų | 52 | 27% | 0.267 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -65.3 | -33.4 | 176.5 | -70.7 | 169.1 | 0 | 0 | 0 | 113 | L386 V398 L400 S404 G405 V430 L431 | L386-L402 HydrophobicContact CD1-CD2 4.42Å; L386-L402 HydrophobicContact CD1-CG 4.25Å; L386-L402 HydrophobicContact CD2-CD2 3.97Å; V398-L402 HydrophobicContact CG1-CD1 3.75Å; V398-L402 HydrophobicContact CG1-CG 4.38Å; V398-L402 WeakPolarHBondContact O-CB 3.31Å; V398-L402 WeakPolarHBondContact O-CD1 3.33Å; V398-L402 VanDerWaalsContact O-CG 3.22Å; V398-L402 WeakPolarHBondContact O-CG 3.43Å; V398-L402 PolarHBondContact O-N 3.17Å; L400-L402 PolarHBondContact O-N 2.92Å; L402-S404 VanDerWaalsContact C-N 3.32Å; L402-G405 PolarHBondContact O-N 3.45Å; L402-V430 HydrophobicContact CD1-CG1 3.84Å; L402-L431 HydrophobicContact CD1-CD2 4.03Å; L402-L431 HydrophobicContact CD2-CD2 4.13Å; L402-L431 HydrophobicContact CG-CD2 4.49Å |
| 403 | K | 93.5 | Very high | 93.9 | Very high | 179 Ų | 179 | 54.3 Ų | 54.3 | 78% | 0.778 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -69.1 | -30.8 | 173.7 | -78.2 | 172.8 | 174 | -172.8 | 0 | 112.5 | R399 L400 L401 G405 | R399-K403 WeakPolarHBondContact O-CB 3.45Å; R399-K403 VanDerWaalsContact O-CG 3.26Å; R399-K403 WeakPolarHBondContact O-CG 3.39Å; R399-K403 PolarHBondContact O-N 3.07Å; R399-K403 VanDerWaalsContact O-N 3.1Å; L400-K403 WeakPolarHBondContact O-CB 3.43Å; L400-K403 PolarHBondContact O-N 2.9Å; L400-K403 VanDerWaalsContact O-N 3.11Å; L401-K403 VanDerWaalsContact C-N 3.33Å; L401-K403 PolarHBondContact O-N 3.46Å; K403-G405 VanDerWaalsContact C-N 3.32Å |
| 404 | S | 93.1 | Very high | 94 | Very high | 37 Ų | 37 | 60.1 Ų | 60.1 | 26% | 0.259 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | 20.7 | 177.7 | 63.7 | 0 | 0 | 0 | 0 | 113.7 | L400 L401 L402 | L400-S404 PolarHBondContact O-N 3.29Å; L400-S404 PolarHBondContact O-OG 3.19Å; L401-S404 WeakPolarHBondContact CA-OG 3.35Å; L401-S404 CarbonylContact O-C 3.5Å; L401-S404 PolarHBondContact O-N 3.47Å; L401-S404 PolarHBondContact O-OG 2.95Å; L402-S404 VanDerWaalsContact C-N 3.32Å |
| 405 | G | 91.9 | Very high | 94 | Very high | 50 Ų | 50 | 64.7 Ų | 64.7 | 52% | 0.515 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81.8 | 22.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 116 | N376 L401 L402 K403 D407 | N376-G405 PolarHBondContact ND2-O 3.21Å; L401-G405 PolarHBondContact O-N 3.12Å; L402-G405 PolarHBondContact O-N 3.45Å; K403-G405 VanDerWaalsContact C-N 3.32Å; G405-D407 PolarHBondContact O-N 3.5Å |
| 406 | A | 94.4 | Very high | 94.1 | Very high | 8 Ų | 8 | 66.2 Ų | 66.2 | 7% | 0.066 | 34% | 0.342 | C | S | . | . | trans | -62.8 | 122.8 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | V375 N376 L386 L401 S408 | V375-A406 HydrophobicContact CG1-CB 3.64Å; N376-A406 WeakPolarHBondContact OD1-CA 3.37Å; L386-A406 HydrophobicContact CB-CB 4.22Å; L386-A406 HydrophobicContact CD1-CB 4.46Å; L386-A406 HydrophobicContact CD2-CB 3.91Å; L386-A406 HydrophobicContact CG-CB 4.42Å; L401-A406 VanDerWaalsContact C-CB 3.48Å; L401-A406 HydrophobicContact CB-CB 3.89Å; L401-A406 WeakPolarHBondContact O-CB 3.26Å; L401-A406 PolarHBondContact O-N 2.98Å; A406-S408 PolarHBondContact O-N 3.47Å | ||
| 407 | D | 93.2 | Very high | 94.2 | Very high | 60 Ų | 60 | 61.9 Ų | 61.9 | 32% | 0.321 | 32% | 0.319 | S | S | . | . | trans | -76.2 | 123 | 176.4 | -175.4 | 3.9 | 0 | 0 | 0 | 110.5 | N376 G405 S409 L410 | N376-D407 PolarHBondContact OD1-N 3.43Å; G405-D407 PolarHBondContact O-N 3.5Å; D407-S409 VanDerWaalsContact CG-OG 3.27Å; D407-S409 WeakPolarHBondContact OD1-CA 3.49Å; D407-S409 VanDerWaalsContact OD1-CB 3.29Å; D407-S409 WeakPolarHBondContact OD1-CB 3.22Å; D407-S409 PolarHBondContact OD1-N 2.99Å; D407-S409 PolarHBondContact OD1-OG 3.28Å; D407-S409 PolarHBondContact OD2-OG 3.43Å; D407-L410 HydrophobicContact CB-CD1 3.95Å; D407-L410 HydrophobicContact CB-CG 3.92Å | ||
| 408 | S | 92.9 | Very high | 94.2 | Very high | 42 Ų | 42 | 61.4 Ų | 61.4 | 29% | 0.294 | 32% | 0.316 | S | S | . | . | S | Bend | trans | -90.3 | 0.2 | 178.5 | 61.2 | 0 | 0 | 0 | 0 | 113.8 | A406 | A406-S408 PolarHBondContact O-N 3.47Š|
| 409 | S | 92.9 | Very high | 94.1 | Very high | 78 Ų | 78 | 63.1 Ų | 63.1 | 55% | 0.545 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -98.2 | -20.5 | 177 | 82.5 | 0 | 0 | 0 | 0 | 114.1 | D407 | D407-S409 VanDerWaalsContact CG-OG 3.27Å; D407-S409 WeakPolarHBondContact OD1-CA 3.49Å; D407-S409 VanDerWaalsContact OD1-CB 3.29Å; D407-S409 WeakPolarHBondContact OD1-CB 3.22Å; D407-S409 PolarHBondContact OD1-N 2.99Å; D407-S409 PolarHBondContact OD1-OG 3.28Å; D407-S409 PolarHBondContact OD2-OG 3.43Å |
| 410 | L | 93.8 | Very high | 94.1 | Very high | 47 Ų | 47 | 64.1 Ų | 64.1 | 25% | 0.246 | 34% | 0.337 | C | S | . | . | trans | -53 | 143.1 | 173.7 | -73.4 | 174.2 | 0 | 0 | 0 | 111.2 | N376 T384 H387 D407 P418 | N376-L410 HydrophobicContact CB-CD1 4.07Å; T384-L410 HydrophobicContact CG2-CB 4.42Å; T384-L410 HydrophobicContact CG2-CD1 3.82Å; H387-L410 PolarHBondContact CE1-O 3.08Å; D407-L410 HydrophobicContact CB-CD1 3.95Å; D407-L410 HydrophobicContact CB-CG 3.92Å; L410-P418 WeakPolarHBondContact O-CD 3.39Å | ||
| 411 | K | 95.1 | Very high | 94.1 | Very high | 111 Ų | 111 | 64.3 Ų | 64.3 | 48% | 0.483 | 34% | 0.34 | S | S | . | . | trans | -114.1 | 143.4 | -179.9 | -68.9 | 179.5 | 179.2 | -179.3 | 0 | 112.1 | Q378 N415 D416 T417 | Q378-K411 PolarHBondContact NE2-O 3.29Å; K411-N415 HydrophobicContact CD-CB 4.46Å; K411-D416 CarbonylContact C-O 3.58Å; K411-D416 VanDerWaalsContact CA-O 3.22Å; K411-D416 WeakPolarHBondContact CA-O 3.4Å; K411-T417 HydrophobicContact CG-CG2 3.8Å | ||
| 412 | N | 95.3 | Very high | 94 | Very high | 7 Ų | 7 | 65.1 Ų | 65.1 | 4% | 0.037 | 35% | 0.347 | C | S | . | . | trans | -79.2 | 177 | 165.5 | 75.4 | 13.5 | 0 | 0 | 0 | 111.5 | S381 G382 N383 H414 N415 D416 | S381-N412 WeakPolarHBondContact O-CB 3.48Å; G382-N412 WeakPolarHBondContact O-CA 3.49Å; N383-N412 WeakPolarHBondContact OD1-CB 3.43Å; N383-N412 PolarHBondContact OD1-ND2 3Å; N412-H414 PolarHBondContact O-N 3.18Å; N412-H414 WeakPolarHBondContact OD1-CA 3.38Å; N412-H414 WeakPolarHBondContact OD1-CB 3.34Å; N412-H414 PolarHBondContact OD1-N 3.25Å; N412-N415 WeakPolarHBondContact O-CA 3.46Å; N412-N415 PolarHBondContact O-N 2.87Å; N412-N415 PolarHBondContact OD1-N 3.26Å; N412-D416 PolarHBondContact N-O 3.31Å; N412-D416 PolarHBondContact OD1-N 3.48Å; N412-D416 VanDerWaalsContact OD1-N 3.07Å | ||
| 413 | Y | 95.4 | Very high | 94 | Very high | 162 Ų | 162 | 69.4 Ų | 69.4 | 64% | 0.635 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72 | -5.4 | -178.8 | -62.7 | -18.2 | 0 | 0 | 0 | 114.5 | Y380 S381 N415 | Y380-Y413 WeakPolarHBondContact O-CD2 3.24Å; Y380-Y413 WeakPolarHBondContact O-CE2 3.41Å; S381-Y413 PolarHBondContact O-N 3.04Å; Y413-N415 VanDerWaalsContact C-N 3.31Å |
| 414 | H | 94.1 | Very high | 93.9 | Very high | 138 Ų | 138 | 64.4 Ų | 64.4 | 64% | 0.639 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.2 | 0.7 | 167.2 | -54.3 | -63 | 0 | 0 | 0 | 112.6 | N412 D416 | N412-H414 PolarHBondContact O-N 3.18Å; N412-H414 WeakPolarHBondContact OD1-CA 3.38Å; N412-H414 WeakPolarHBondContact OD1-CB 3.34Å; N412-H414 PolarHBondContact OD1-N 3.25Å; H414-D416 PolarHBondContact O-N 2.88Å |
| 415 | N | 95.1 | Very high | 93.7 | Very high | 110 Ų | 110 | 70.2 Ų | 70.2 | 59% | 0.588 | 37% | 0.365 | S | S | * | . | S | Bend | trans | 69 | 6.7 | -170.2 | -61.7 | -89.8 | 0 | 0 | 0 | 115.2 | K411 N412 Y413 | K411-N415 HydrophobicContact CD-CB 4.46Å; N412-N415 WeakPolarHBondContact O-CA 3.46Å; N412-N415 PolarHBondContact O-N 2.87Å; N412-N415 PolarHBondContact OD1-N 3.26Å; Y413-N415 VanDerWaalsContact C-N 3.31Å |
| 416 | D | 95.8 | Very high | 93.6 | Very high | 57 Ų | 57 | 75.3 Ų | 75.3 | 31% | 0.305 | 37% | 0.373 | S | S | . | . | trans | -70.7 | 145.8 | 173.4 | -65.6 | -56.6 | 0 | 0 | 0 | 110.9 | H387 K411 N412 H414 M420 V421 | H387-D416 PolarHBondContact NE2-O 3.05Å; K411-D416 CarbonylContact C-O 3.58Å; K411-D416 VanDerWaalsContact CA-O 3.22Å; K411-D416 WeakPolarHBondContact CA-O 3.4Å; N412-D416 PolarHBondContact N-O 3.31Å; N412-D416 PolarHBondContact OD1-N 3.48Å; N412-D416 VanDerWaalsContact OD1-N 3.07Å; H414-D416 PolarHBondContact O-N 2.88Å; D416-M420 HydrophobicContact CB-CB 4.13Å; D416-V421 HydrophobicContact CB-CG1 3.87Å | ||
| 417 | T | 95.1 | Very high | 93.5 | Very high | 17 Ų | 17 | 74.9 Ų | 74.9 | 10% | 0.104 | 37% | 0.37 | C | S | . | . | trans | -99.6 | 165.9 | 165.9 | 56.9 | 0 | 0 | 0 | 0 | 110.1 | K411 V419 M420 V421 | K411-T417 HydrophobicContact CG-CG2 3.8Å; T417-V419 PolarHBondContact O-N 3.03Å; T417-M420 HydrophobicContact CG2-SD 4.24Å; T417-M420 PolarHBondContact N-SD 3.39Å; T417-M420 WeakPolarHBondContact O-CB 3.33Å; T417-M420 PolarHBondContact O-N 2.78Å; T417-M420 WeakPolarHBondContact OG1-CG 3.46Å; T417-M420 PolarHBondContact OG1-SD 3.45Å; T417-V421 PolarHBondContact O-N 3.44Å | ||
| 418 | P | 93.6 | Very high | 93.4 | Very high | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 36% | 0.361 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.6 | -23.3 | 172.9 | -27.6 | 35.6 | 0 | 0 | 0 | 114.7 | L386 C390 L410 L431 | L386-P418 HydrophobicContact CB-CG 4.34Å; L386-P418 HydrophobicContact CD2-CB 4Å; L386-P418 HydrophobicContact CD2-CG 3.92Å; L386-P418 HydrophobicContact CG-CB 3.87Å; L386-P418 HydrophobicContact CG-CG 4.04Å; C390-P418 WeakPolarHBondContact CB-O 3.3Å; C390-P418 PolarHBondContact SG-O 3.02Å; L410-P418 WeakPolarHBondContact O-CD 3.39Å; P418-L431 HydrophobicContact CB-CD2 4.44Å; P418-L431 WeakPolarHBondContact O-CD1 3.28Å |
| 419 | V | 93.5 | Very high | 93.3 | Very high | 36 Ų | 36 | 73.4 Ų | 73.4 | 22% | 0.218 | 36% | 0.359 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.2 | -31.4 | 175.4 | -173.2 | 0 | 0 | 0 | 0 | 112.1 | T417 A422 T428 L431 | T417-V419 PolarHBondContact O-N 3.03Å; V419-A422 WeakPolarHBondContact O-CB 3.35Å; V419-T428 HydrophobicContact CG1-CG2 4.01Å; V419-L431 HydrophobicContact CB-CD1 4.33Å; V419-L431 HydrophobicContact CG2-CB 4.01Å; V419-L431 HydrophobicContact CG2-CD1 3.95Å; V419-L431 HydrophobicContact CG2-CG 4.49Å |
| 420 | M | 93.4 | Very high | 93.2 | Very high | 122 Ų | 122 | 70.3 Ų | 70.3 | 60% | 0.601 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.5 | -41.1 | -178.3 | -67.5 | 156.9 | 174 | 0 | 0 | 111.3 | D416 T417 A422 | D416-M420 HydrophobicContact CB-CB 4.13Å; T417-M420 HydrophobicContact CG2-SD 4.24Å; T417-M420 PolarHBondContact N-SD 3.39Å; T417-M420 WeakPolarHBondContact O-CB 3.33Å; T417-M420 PolarHBondContact O-N 2.78Å; T417-M420 WeakPolarHBondContact OG1-CG 3.46Å; T417-M420 PolarHBondContact OG1-SD 3.45Å; M420-A422 PolarHBondContact O-N 3.4Å |
| 421 | V | 94.4 | Very high | 92.9 | Very high | 39 Ų | 39 | 69 Ų | 69 | 24% | 0.236 | 33% | 0.331 | C | S | . | . | S | Bend | trans | -77.8 | 6.2 | 173.7 | -61.4 | 0 | 0 | 0 | 0 | 114.2 | H387 C390 G391 D416 T417 K423 | H387-V421 HydrophobicContact CB-CG2 4.3Å; C390-V421 CarbonylContact C-O 3.54Å; C390-V421 HydrophobicContact CB-CG2 4.15Å; G391-V421 VanDerWaalsContact CA-O 3.3Å; G391-V421 WeakPolarHBondContact CA-O 3.4Å; G391-V421 PolarHBondContact N-O 3.35Å; D416-V421 HydrophobicContact CB-CG1 3.87Å; T417-V421 PolarHBondContact O-N 3.44Å; V421-K423 PolarHBondContact O-N 2.93Å |
| 422 | A | 94.4 | Very high | 92.5 | Very high | 17 Ų | 17 | 71.1 Ų | 71.1 | 14% | 0.14 | 34% | 0.336 | C | S | . | . | trans | -70.6 | 102.4 | -175 | 0 | 0 | 0 | 0 | 0 | 112.8 | V419 M420 N424 I427 L431 | V419-A422 WeakPolarHBondContact O-CB 3.35Å; M420-A422 PolarHBondContact O-N 3.4Å; A422-N424 PolarHBondContact O-N 2.94Å; A422-N424 VanDerWaalsContact O-N 3.09Å; A422-I427 HydrophobicContact CB-CB 4.28Å; A422-I427 HydrophobicContact CB-CG2 3.87Å; A422-L431 HydrophobicContact CB-CD1 4.39Å | ||
| 423 | K | 93.1 | Very high | 91.4 | Very high | 141 Ų | 141 | 72.7 Ų | 72.7 | 61% | 0.613 | 35% | 0.353 | S | S | * | . | S | Bend | trans | -57.6 | -26.1 | -176.8 | 179 | 170.4 | 173.3 | -177.1 | 0 | 115.4 | C390 G391 R392 V421 | C390-K423 PolarHBondContact O-N 2.76Å; G391-K423 WeakPolarHBondContact O-CB 3.17Å; G391-K423 WeakPolarHBondContact O-CD 3.44Å; R392-K423 PolarHBondContact O-NZ 3.31Å; V421-K423 PolarHBondContact O-N 2.93Å |
| 424 | N | 91.1 | Very high | 89.7 | Confident | 73 Ų | 73 | 74.9 Ų | 74.9 | 39% | 0.39 | 36% | 0.36 | S | S | . | . | S | Bend | trans | -131.1 | 135 | -174.4 | -74.8 | -42.8 | 0 | 0 | 0 | 110.7 | A422 K426 I427 T428 | A422-N424 PolarHBondContact O-N 2.94Å; A422-N424 VanDerWaalsContact O-N 3.09Å; N424-K426 PolarHBondContact O-N 3.3Å; N424-I427 HydrophobicContact CB-CD1 4.35Å; N424-I427 HydrophobicContact CB-CG1 4.38Å; N424-I427 WeakPolarHBondContact O-CB 3.29Å; N424-I427 PolarHBondContact O-N 3.01Å; N424-T428 PolarHBondContact O-N 3.01Å |
| 425 | K | 88.8 | Confident | 87.6 | Confident | 159 Ų | 159 | 70.8 Ų | 70.8 | 69% | 0.691 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -50.9 | -35.9 | 174.7 | -176.2 | -176.2 | 171.4 | -175.8 | 0 | 113.2 | I427 T428 D429 | K425-I427 PolarHBondContact O-N 2.99Å; K425-T428 WeakPolarHBondContact O-CB 3.46Å; K425-T428 PolarHBondContact O-N 3.14Å; K425-T428 VanDerWaalsContact O-N 3.09Å; K425-D429 WeakPolarHBondContact CE-OD2 3.43Å; K425-D429 PolarHBondContact O-N 3.23Å |
| 426 | K | 90.5 | Very high | 85.4 | Confident | 157 Ų | 157 | 69.3 Ų | 69.3 | 68% | 0.683 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -53.9 | -34.2 | 174.6 | -69.6 | -176.3 | 177.5 | 179.9 | 0 | 113.2 | V395 N424 V430 | V395-K426 HydrophobicContact CG2-CB 4.37Å; N424-K426 PolarHBondContact O-N 3.3Å; K426-V430 VanDerWaalsContact O-CG2 3.29Å; K426-V430 WeakPolarHBondContact O-CG2 3.47Å; K426-V430 PolarHBondContact O-N 3.38Å |
| 427 | I | 92.5 | Very high | 82.8 | Confident | 0 Ų | 0 | 76.1 Ų | 76.1 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -77 | -44.4 | 177.5 | -65.9 | 176.1 | 0 | 0 | 0 | 110 | C390 G393 V395 V398 A422 N424 K425 D429 V430 L431 | C390-I427 HydrophobicContact CB-CG2 4.12Å; C390-I427 VanDerWaalsContact SG-CG2 3.54Å; G393-I427 VanDerWaalsContact C-CD1 3.44Å; V395-I427 HydrophobicContact CG2-CD1 4.37Å; V395-I427 HydrophobicContact CG2-CG1 3.88Å; V398-I427 HydrophobicContact CG1-CG2 4.33Å; V398-I427 HydrophobicContact CG2-CG2 4.2Å; A422-I427 HydrophobicContact CB-CB 4.28Å; A422-I427 HydrophobicContact CB-CG2 3.87Å; N424-I427 HydrophobicContact CB-CD1 4.35Å; N424-I427 HydrophobicContact CB-CG1 4.38Å; N424-I427 WeakPolarHBondContact O-CB 3.29Å; N424-I427 PolarHBondContact O-N 3.01Å; K425-I427 PolarHBondContact O-N 2.99Å; I427-D429 VanDerWaalsContact C-N 3.26Å; I427-D429 PolarHBondContact O-N 3.01Å; I427-V430 PolarHBondContact O-N 2.9Å; I427-V430 VanDerWaalsContact O-N 3.08Å; I427-L431 HydrophobicContact CG2-CD1 3.76Å; I427-L431 HydrophobicContact CG2-CG 4.29Å; I427-L431 WeakPolarHBondContact O-CG 3.19Å; I427-L431 PolarHBondContact O-N 3.06Å |
| 428 | T | 91.1 | Very high | 80.2 | Confident | 22 Ų | 22 | 84.3 Ų | 84.3 | 14% | 0.135 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -55.5 | -41 | 173.2 | -36.7 | 0 | 0 | 0 | 0 | 111.9 | V419 N424 K425 R432 | V419-T428 HydrophobicContact CG1-CG2 4.01Å; N424-T428 PolarHBondContact O-N 3.01Å; K425-T428 WeakPolarHBondContact O-CB 3.46Å; K425-T428 PolarHBondContact O-N 3.14Å; K425-T428 VanDerWaalsContact O-N 3.09Å; T428-R432 VanDerWaalsContact O-CB 3.28Å; T428-R432 WeakPolarHBondContact O-CB 3.35Å; T428-R432 WeakPolarHBondContact O-CD 3.36Å; T428-R432 WeakPolarHBondContact O-CG 3.47Å; T428-R432 PolarHBondContact O-N 2.86Å |
| 429 | D | 90.3 | Very high | 77.8 | Confident | 48 Ų | 48 | 91.9 Ų | 91.9 | 26% | 0.257 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -72.6 | -28.9 | 177.7 | -70.2 | -32.9 | 0 | 0 | 0 | 112.9 | K425 I427 R434 G435 | K425-D429 WeakPolarHBondContact CE-OD2 3.43Å; K425-D429 PolarHBondContact O-N 3.23Å; I427-D429 VanDerWaalsContact C-N 3.26Å; I427-D429 PolarHBondContact O-N 3.01Å; D429-R434 PolarHBondContact O-N 2.86Å; D429-G435 PolarHBondContact O-N 3.35Å |
| 430 | V | 90.9 | Very high | 74.9 | Confident | 14 Ų | 14 | 101.1 Ų | 101.1 | 9% | 0.085 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -72.8 | -49.7 | 172.4 | 164.3 | 0 | 0 | 0 | 0 | 111.3 | V398 R399 L402 K426 I427 R432 G433 | V398-V430 HydrophobicContact CG1-CG1 4.05Å; R399-V430 HydrophobicContact CG-CG1 4.22Å; L402-V430 HydrophobicContact CD1-CG1 3.84Å; K426-V430 VanDerWaalsContact O-CG2 3.29Å; K426-V430 WeakPolarHBondContact O-CG2 3.47Å; K426-V430 PolarHBondContact O-N 3.38Å; I427-V430 PolarHBondContact O-N 2.9Å; I427-V430 VanDerWaalsContact O-N 3.08Å; V430-R432 VanDerWaalsContact C-N 3.27Å; V430-R432 PolarHBondContact O-N 3.23Å; V430-G433 PolarHBondContact O-N 3.08Å |
| 431 | L | 88.3 | Confident | 72.1 | Confident | 20 Ų | 20 | 101.1 Ų | 101.1 | 11% | 0.105 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -59.8 | -37.6 | 177.5 | -68.3 | 161.8 | 0 | 0 | 0 | 112 | L386 V398 L402 P418 V419 A422 I427 G433 | L386-L431 HydrophobicContact CD1-CD2 4.39Å; L386-L431 HydrophobicContact CD2-CD2 4.18Å; L386-L431 HydrophobicContact CG-CD2 4.5Å; V398-L431 HydrophobicContact CG1-CD2 4.23Å; V398-L431 HydrophobicContact CG1-CG 4.42Å; L402-L431 HydrophobicContact CD1-CD2 4.03Å; L402-L431 HydrophobicContact CD2-CD2 4.13Å; L402-L431 HydrophobicContact CG-CD2 4.49Å; P418-L431 HydrophobicContact CB-CD2 4.44Å; P418-L431 WeakPolarHBondContact O-CD1 3.28Å; V419-L431 HydrophobicContact CB-CD1 4.33Å; V419-L431 HydrophobicContact CG2-CB 4.01Å; V419-L431 HydrophobicContact CG2-CD1 3.95Å; V419-L431 HydrophobicContact CG2-CG 4.49Å; A422-L431 HydrophobicContact CB-CD1 4.39Å; I427-L431 HydrophobicContact CG2-CD1 3.76Å; I427-L431 HydrophobicContact CG2-CG 4.29Å; I427-L431 WeakPolarHBondContact O-CG 3.19Å; I427-L431 PolarHBondContact O-N 3.06Å; L431-G433 PolarHBondContact O-N 3.21Å |
| 432 | R | 85.1 | Confident | 69.1 | Low | 155 Ų | 155 | 107.6 Ų | 107.6 | 59% | 0.585 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.5 | 10.9 | 176 | -68.3 | 173.4 | 176.9 | 173.5 | -1 | 113.9 | T428 V430 R434 | T428-R432 VanDerWaalsContact O-CB 3.28Å; T428-R432 WeakPolarHBondContact O-CB 3.35Å; T428-R432 WeakPolarHBondContact O-CD 3.36Å; T428-R432 WeakPolarHBondContact O-CG 3.47Å; T428-R432 PolarHBondContact O-N 2.86Å; V430-R432 VanDerWaalsContact C-N 3.27Å; V430-R432 PolarHBondContact O-N 3.23Å; R432-R434 HydrophobicContact CB-CG 4.45Å; R432-R434 PolarHBondContact O-N 3.09Å |
| 433 | G | 73.5 | Confident | 66.1 | Low | 40 Ų | 40 | 115.3 Ų | 115.3 | 41% | 0.412 | 56% | 0.555 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 67.7 | -3.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | V430 L431 G435 S436 | V430-G433 PolarHBondContact O-N 3.08Å; L431-G433 PolarHBondContact O-N 3.21Å; G433-G435 PolarHBondContact O-N 3.32Å; G433-G435 VanDerWaalsContact O-N 3.14Å; G433-S436 PolarHBondContact O-N 3.39Å |
| 434 | R | 59.2 | Low | 63 | Low | 207 Ų | 207 | 116.8 Ų | 116.8 | 78% | 0.781 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -16 | -173.5 | -68.8 | -173.5 | 171.5 | -161.7 | -5.1 | 113.9 | D429 R432 | D429-R434 PolarHBondContact O-N 2.86Å; R432-R434 HydrophobicContact CB-CG 4.45Å; R432-R434 PolarHBondContact O-N 3.09Å |
| 435 | G | 49.8 | Very low | 60.2 | Low | 53 Ų | 53 | 118.8 Ų | 118.8 | 55% | 0.546 | 58% | 0.581 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.8 | -5.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | D429 G433 | D429-G435 PolarHBondContact O-N 3.35Å; G433-G435 PolarHBondContact O-N 3.32Å; G433-G435 VanDerWaalsContact O-N 3.14Å |
| 436 | S | 48.1 | Very low | 57.3 | Low | 78 Ų | 78 | 117.4 Ų | 117.4 | 55% | 0.545 | 59% | 0.59 | S | S | . | * | trans | -118.7 | 94.5 | -168.6 | -61.5 | 0 | 0 | 0 | 0 | 111.6 | G433 Q438 | G433-S436 PolarHBondContact O-N 3.39Å; S436-Q438 PolarHBondContact O-N 2.84Å | ||
| 437 | K | 42.5 | Very low | 54.4 | Low | 201 Ų | 201 | 116.3 Ų | 116.3 | 87% | 0.874 | 60% | 0.596 | S | S | * | * | trans | -57.8 | 128.1 | 157.9 | -73.7 | -177 | 177.6 | -179.8 | 0 | 107.3 | I439 | K437-I439 PolarHBondContact O-N 3.19Š| ||
| 438 | Q | 39.7 | Very low | 51.5 | Low | 189 Ų | 189 | 121.8 Ų | 121.8 | 88% | 0.883 | 64% | 0.635 | S | S | * | * | trans | -59.4 | 107.3 | 176.7 | -72.9 | 168.6 | -45.2 | 0 | 0 | 109.2 | S436 R440 | S436-Q438 PolarHBondContact O-N 2.84Å; Q438-R440 PolarHBondContact O-N 3.16Å | ||
| 439 | I | 43.7 | Very low | 48.6 | Very low | 158 Ų | 158 | 127.3 Ų | 127.3 | 81% | 0.81 | 67% | 0.668 | S | S | * | * | trans | -69.7 | 92.5 | 158 | -61.9 | 177.5 | 0 | 0 | 0 | 104.4 | K437 V441 | K437-I439 PolarHBondContact O-N 3.19Å; I439-V441 VanDerWaalsContact C-N 3.29Å; I439-V441 PolarHBondContact O-N 2.93Å | ||
| 440 | R | 31.8 | Very low | 45.8 | Very low | 230 Ų | 230 | 130.3 Ų | 130.3 | 87% | 0.868 | 69% | 0.693 | S | S | * | * | trans | -68.4 | 92.3 | 178.2 | -159 | 178.5 | -166.7 | 175.5 | 3.4 | 106.6 | Q438 Q442 | Q438-R440 PolarHBondContact O-N 3.16Å; R440-Q442 PolarHBondContact O-N 3.09Å | ||
| 441 | V | 35.6 | Very low | 43.6 | Very low | 122 Ų | 122 | 135 Ų | 135 | 74% | 0.739 | 72% | 0.724 | S | S | * | * | trans | -55 | 117.4 | 167.4 | 177.1 | 0 | 0 | 0 | 0 | 105.7 | I439 E443 | I439-V441 VanDerWaalsContact C-N 3.29Å; I439-V441 PolarHBondContact O-N 2.93Å; V441-E443 PolarHBondContact O-N 3.06Å | ||
| 442 | Q | 31.6 | Very low | 40.9 | Very low | 176 Ų | 176 | 142.9 Ų | 142.9 | 82% | 0.822 | 76% | 0.759 | S | S | * | * | trans | -80.5 | 93.7 | -174.4 | -170.7 | 171.3 | 11.9 | 0 | 0 | 107.5 | R440 Q444 | R440-Q442 PolarHBondContact O-N 3.09Å; Q442-Q444 PolarHBondContact O-N 3.22Å | ||
| 443 | E | 30.6 | Very low | 38.2 | Very low | 179 Ų | 179 | 143.6 Ų | 143.6 | 84% | 0.836 | 77% | 0.77 | S | S | * | * | trans | -53.4 | 112 | 173.2 | -66.6 | -179.2 | 145.1 | 0 | 0 | 109.1 | V441 P445 | V441-E443 PolarHBondContact O-N 3.06Å; E443-P445 WeakPolarHBondContact O-CD 3.35Å | ||
| 444 | Q | 29.4 | Very low | 36.2 | Very low | 172 Ų | 172 | 147.4 Ų | 147.4 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | -76.4 | 120.2 | 166.7 | -70.4 | -174.4 | -12.8 | 0 | 0 | 107.2 | Q442 C446 | Q442-Q444 PolarHBondContact O-N 3.22Å; Q444-C446 PolarHBondContact O-N 3.13Å | ||
| 445 | P | 31.2 | Very low | 34.7 | Very low | 115 Ų | 115 | 142.6 Ų | 142.6 | 75% | 0.747 | 79% | 0.787 | S | S | * | * | trans | -67.4 | 120.8 | 179.4 | 27 | -33.1 | 0 | 0 | 0 | 109.5 | E443 V447 | E443-P445 WeakPolarHBondContact O-CD 3.35Å; P445-V447 PolarHBondContact O-N 3.06Å; P445-V447 VanDerWaalsContact O-N 3.08Å | ||
| 446 | C | 27.1 | Very low | 33.8 | Very low | 130 Ų | 130 | 151.1 Ų | 151.1 | 88% | 0.878 | 80% | 0.804 | S | S | * | * | trans | -68.2 | 104.9 | 175.7 | -66.9 | 0 | 0 | 0 | 0 | 109.9 | Q444 | Q444-C446 PolarHBondContact O-N 3.13Š| ||
| 447 | V | 30.3 | Very low | 33 | Very low | 133 Ų | 133 | 155.6 Ų | 155.6 | 81% | 0.806 | 82% | 0.818 | S | S | * | * | trans | -92.4 | 114.8 | 171.6 | -179 | 0 | 0 | 0 | 0 | 108.9 | P445 | P445-V447 PolarHBondContact O-N 3.06Å; P445-V447 VanDerWaalsContact O-N 3.08Å | ||
| 448 | S | 31.4 | Very low | 32.4 | Very low | 116 Ų | 116 | 153.7 Ų | 153.7 | 81% | 0.811 | 81% | 0.813 | S | S | * | * | trans | -106.9 | 104.4 | -178.1 | 42.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 449 | V | 30.4 | Very low | 31.9 | Very low | 138 Ų | 138 | 151.6 Ų | 151.6 | 84% | 0.836 | 81% | 0.808 | S | S | * | * | trans | -138.7 | 141.4 | 161.1 | -172.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 450 | S | 32.4 | Very low | 31.2 | Very low | 110 Ų | 110 | 148 Ų | 148 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -77.4 | 167.1 | -174.1 | -55.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 451 | P | 44.8 | Very low | 31.3 | Very low | 114 Ų | 114 | 142.7 Ų | 142.7 | 74% | 0.74 | 81% | 0.807 | S | S | * | * | trans | -95.2 | 156.3 | -161.3 | 36.9 | -35.2 | 0 | 0 | 0 | 114.6 | ||||
| 452 | H | 30.3 | Very low | 32.4 | Very low | 184 Ų | 184 | 142.3 Ų | 142.3 | 85% | 0.852 | 81% | 0.807 | S | S | * | * | trans | -146.3 | 158.2 | 152.6 | -99.6 | -73.4 | 0 | 0 | 0 | 112.7 | ||||
| 453 | Q | 28.6 | Very low | 32.5 | Very low | 171 Ų | 171 | 139.2 Ų | 139.2 | 80% | 0.799 | 81% | 0.805 | S | S | * | * | trans | -67.6 | 157.5 | -166.9 | -66.6 | 150.5 | -67.2 | 0 | 0 | 115.8 | ||||
| 454 | S | 30.8 | Very low | 32.6 | Very low | 119 Ų | 119 | 135 Ų | 135 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | 139.2 | 142.3 | 118.8 | 64.7 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 455 | C | 28.8 | Very low | 32.8 | Very low | 107 Ų | 107 | 132.6 Ų | 132.6 | 72% | 0.723 | 79% | 0.788 | S | S | * | * | trans | -75 | 160.1 | -175.7 | -48.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 456 | Y | 30.5 | Very low | 32.9 | Very low | 231 Ų | 231 | 135.2 Ų | 135.2 | 91% | 0.906 | 79% | 0.79 | S | S | * | * | -167 | -173.7 | 108.3 | -100.6 | -67.7 | 0 | 0 | 0 | 110.2 | |||||
| 457 | M | 30.4 | Very low | 33.4 | Very low | 172 Ų | 172 | 134.7 Ų | 134.7 | 85% | 0.847 | 79% | 0.788 | S | S | * | * | trans | -109.6 | 171.9 | -156.5 | -62.6 | -173.8 | 75.7 | 0 | 0 | 115.7 | ||||
| 458 | E | 30.3 | Very low | 33.6 | Very low | 161 Ų | 161 | 140.1 Ų | 140.1 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | 111 | 118.7 | 146.5 | -68.8 | -154.7 | 74.9 | 0 | 0 | 120.8 | ||||
| 459 | N | 29.5 | Very low | 33.7 | Very low | 146 Ų | 146 | 138.1 Ų | 138.1 | 78% | 0.781 | 79% | 0.791 | S | S | * | * | 45.3 | 123 | 126.9 | -60.9 | -30.8 | 0 | 0 | 0 | 121 | |||||
| 460 | G | 29.8 | Very low | 33.8 | Very low | 81 Ų | 81 | 136.6 Ų | 136.6 | 84% | 0.835 | 79% | 0.787 | S | S | * | * | trans | 159 | 90.1 | 158.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 461 | S | 33.8 | Very low | 34 | Very low | 119 Ų | 119 | 137 Ų | 137 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | trans | -126.3 | 160.7 | 168.7 | -66.6 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 462 | P | 58.4 | Low | 34.7 | Very low | 114 Ų | 114 | 137 Ų | 137 | 74% | 0.74 | 79% | 0.79 | S | S | * | * | cis | -132 | -152.3 | -44.5 | 39.9 | -23.6 | 0 | 0 | 0 | 110.1 | ||||
| 463 | S | 33.7 | Very low | 36 | Very low | 111 Ų | 111 | 133.2 Ų | 133.2 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | trans | 90.7 | 150.3 | 168.4 | -44.2 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 464 | S | 32.7 | Very low | 36.3 | Very low | 91 Ų | 91 | 130.8 Ų | 130.8 | 64% | 0.636 | 78% | 0.778 | S | S | * | * | cis | -167.9 | -167.6 | -20.3 | 56.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 465 | N | 32.5 | Very low | 36.7 | Very low | 121 Ų | 121 | 131.3 Ų | 131.3 | 65% | 0.647 | 78% | 0.776 | S | S | * | * | trans | 82.5 | 121.8 | 167.8 | -51.4 | -9.7 | 0 | 0 | 0 | 114.3 | ||||
| 466 | H | 34 | Very low | 37.8 | Very low | 171 Ų | 171 | 130.9 Ų | 130.9 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | 65.6 | 132.2 | 83.2 | -47.4 | -42.4 | 0 | 0 | 0 | 112.3 | |||||
| 467 | S | 38.5 | Very low | 38 | Very low | 118 Ų | 118 | 128.7 Ų | 128.7 | 83% | 0.825 | 77% | 0.77 | S | S | * | * | cis | -150.8 | 165.3 | 31.8 | -67.3 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 468 | R | 34.3 | Very low | 38.3 | Very low | 248 Ų | 248 | 125 Ų | 125 | 94% | 0.936 | 76% | 0.762 | S | S | * | * | trans | -44.7 | 156.6 | 166.5 | -58.9 | 161.1 | 168.4 | 177.3 | -6 | 116.4 | ||||
| 469 | G | 32.3 | Very low | 38.2 | Very low | 73 Ų | 73 | 127.4 Ų | 127.4 | 75% | 0.753 | 77% | 0.77 | S | S | * | * | trans | 160.4 | 82.8 | 164.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 470 | S | 34.1 | Very low | 38.5 | Very low | 107 Ų | 107 | 128.2 Ų | 128.2 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | 92 | 56.2 | 67.2 | -62.2 | 0 | 0 | 0 | 0 | 116.6 | |||||
| 471 | S | 36.1 | Very low | 39.6 | Very low | 117 Ų | 117 | 129.6 Ų | 129.6 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | 67.4 | -169.2 | 137.1 | -34.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 472 | P | 59.1 | Low | 39.4 | Very low | 116 Ų | 116 | 130 Ų | 130 | 75% | 0.753 | 77% | 0.77 | S | S | * | * | trans | -133.9 | -133.2 | -130.7 | 39.2 | -12.8 | 0 | 0 | 0 | 112.5 | ||||
| 473 | P | 58.6 | Low | 38.2 | Very low | 104 Ų | 104 | 128.9 Ų | 128.9 | 68% | 0.675 | 77% | 0.771 | S | S | * | * | -107.3 | -176.1 | -68.1 | 36.8 | -22.9 | 0 | 0 | 0 | 112 | |||||
| 474 | T | 33.4 | Very low | 38.2 | Very low | 120 Ų | 120 | 129 Ų | 129 | 74% | 0.736 | 77% | 0.771 | S | S | * | * | 172.4 | 115.3 | 127.6 | 30.8 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 475 | T | 41 | Very low | 38.5 | Very low | 129 Ų | 129 | 133 Ų | 133 | 79% | 0.791 | 78% | 0.78 | S | S | * | * | 86.6 | -179.9 | 112.3 | 71.6 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 476 | P | 51.4 | Low | 39.5 | Very low | 99 Ų | 99 | 132.3 Ų | 132.3 | 64% | 0.643 | 78% | 0.782 | S | S | * | * | -129.4 | -171.6 | -114.7 | 32.8 | -8.3 | 0 | 0 | 0 | 114 | |||||
| 477 | H | 35.1 | Very low | 39.5 | Very low | 184 Ų | 184 | 130.3 Ų | 130.3 | 85% | 0.852 | 78% | 0.777 | S | S | * | * | -173.4 | 160.9 | 124.9 | -98.9 | -66.2 | 0 | 0 | 0 | 111.3 | |||||
| 478 | S | 34.8 | Very low | 39.4 | Very low | 96 Ų | 96 | 133.2 Ų | 133.2 | 67% | 0.671 | 77% | 0.774 | S | S | * | * | trans | -127.1 | 136.8 | -168.4 | 54.9 | 0 | 0 | 0 | 0 | 112 | ||||
| 479 | F | 29.8 | Very low | 39.6 | Very low | 211 Ų | 211 | 127.6 Ų | 127.6 | 93% | 0.925 | 77% | 0.768 | S | S | * | * | trans | -147.8 | 147.6 | 158.1 | -88.2 | -69.1 | 0 | 0 | 0 | 113.5 | ||||
| 480 | L | 35.8 | Very low | 40 | Very low | 163 Ų | 163 | 129.7 Ų | 129.7 | 85% | 0.853 | 77% | 0.771 | S | S | * | * | trans | -144.8 | 175.3 | 173 | -90.6 | 172.5 | 0 | 0 | 0 | 105.3 | ||||
| 481 | P | 52.6 | Low | 40.5 | Very low | 110 Ų | 110 | 129.7 Ų | 129.7 | 71% | 0.714 | 77% | 0.771 | S | S | * | * | cis | -128.9 | -173.7 | -9.4 | 39.8 | -23.7 | 0 | 0 | 0 | 112.9 | ||||
| 482 | S | 28.5 | Very low | 41 | Very low | 127 Ų | 127 | 128.3 Ų | 128.3 | 89% | 0.888 | 77% | 0.767 | S | S | * | * | 175.3 | 172.2 | 127.3 | 46.6 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 483 | A | 34.7 | Very low | 40.4 | Very low | 91 Ų | 91 | 130 Ų | 130 | 75% | 0.752 | 77% | 0.769 | S | S | * | * | trans | -128.5 | 158.3 | -169 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 484 | S | 33.4 | Very low | 40 | Very low | 112 Ų | 112 | 138.6 Ų | 138.6 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | 169.7 | 116.9 | 129.1 | 43.1 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 485 | Q | 39.4 | Very low | 40.3 | Very low | 175 Ų | 175 | 139.5 Ų | 139.5 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | 54.7 | 180 | 138.9 | -72.8 | -146.7 | 13 | 0 | 0 | 119.5 | ||||
| 486 | P | 52.3 | Low | 40.3 | Very low | 107 Ų | 107 | 140.1 Ų | 140.1 | 70% | 0.695 | 80% | 0.799 | S | S | * | * | cis | -135.7 | 161.6 | 4.2 | 43.4 | -26 | 0 | 0 | 0 | 119.6 | ||||
| 487 | L | 34.5 | Very low | 39.7 | Very low | 129 Ų | 129 | 142.3 Ų | 142.3 | 68% | 0.675 | 81% | 0.808 | S | S | * | * | trans | 47.4 | 131.4 | 135.9 | -64 | 170.2 | 0 | 0 | 0 | 125.2 | ||||
| 488 | K | 36 | Very low | 39.9 | Very low | 179 Ų | 179 | 139.9 Ų | 139.9 | 78% | 0.778 | 81% | 0.805 | S | S | * | * | trans | 71 | 157.8 | 140.2 | -69.1 | 172.6 | 176.9 | 176.1 | 0 | 117.4 | ||||
| 489 | T | 38.3 | Very low | 40.3 | Very low | 131 Ų | 131 | 142.6 Ų | 142.6 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | cis | -141 | 169.6 | 14.9 | -31.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 490 | S | 41.9 | Very low | 41 | Very low | 116 Ų | 116 | 138.1 Ų | 138.1 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | -135.2 | 126.6 | 171.4 | 179.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 491 | S | 42.9 | Very low | 41.3 | Very low | 107 Ų | 107 | 136.3 Ų | 136.3 | 75% | 0.748 | 80% | 0.803 | S | S | * | * | trans | 160.4 | 156.4 | 169.6 | 52.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 492 | A | 47.1 | Very low | 40.4 | Very low | 89 Ų | 89 | 138.3 Ų | 138.3 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | cis | -167.4 | 160.1 | -27.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 493 | L | 46.5 | Very low | 41.4 | Very low | 152 Ų | 152 | 139.3 Ų | 139.3 | 80% | 0.796 | 80% | 0.803 | S | S | * | * | trans | 19.9 | 128.8 | 151.9 | -64.9 | 165.3 | 0 | 0 | 0 | 120.4 | ||||
| 494 | F | 50.3 | Low | 42.1 | Very low | 283 Ų | 283 | 143.6 Ų | 143.6 | 100% | 1.241 | 81% | 0.808 | S | S | * | * | -132.6 | 0 | 107.6 | -101.3 | -77.8 | 0 | 0 | 0 | 109.5 |
Retrieved 494 of 494 residues in 530.8 ms
(Link to these results)