| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 35.3 | Very low | 30 | Very low | 236 Ų | 236 | 136.8 Ų | 136.8 | 100% | 1.163 | 86% | 0.863 | S | S | * | * | 0 | 111.8 | 0 | -73.8 | 165.4 | 87.1 | 0 | 0 | 107.9 | |||||
| 2 | N | 32.6 | Very low | 30 | Very low | 168 Ų | 168 | 139 Ų | 139 | 90% | 0.898 | 86% | 0.864 | S | S | * | * | trans | 31.8 | 121.3 | 159.3 | -53.1 | -9.2 | 0 | 0 | 0 | 118.5 | ||||
| 3 | G | 28.4 | Very low | 29.9 | Very low | 70 Ų | 70 | 134.9 Ų | 134.9 | 72% | 0.722 | 85% | 0.852 | S | S | * | * | cis | 99.5 | 107.8 | 21.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 4 | R | 32.1 | Very low | 29.6 | Very low | 248 Ų | 248 | 134.9 Ų | 134.9 | 94% | 0.936 | 86% | 0.857 | S | S | * | * | trans | -179.2 | 114.7 | 137 | -102 | 173.9 | -174.7 | -169.2 | 1.3 | 112.9 | ||||
| 5 | S | 30.4 | Very low | 29.7 | Very low | 105 Ų | 105 | 139.1 Ų | 139.1 | 73% | 0.734 | 86% | 0.861 | S | S | * | * | trans | -83.7 | 155.7 | 152.2 | 66.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 6 | L | 30.5 | Very low | 29.6 | Very low | 168 Ų | 168 | 134.1 Ų | 134.1 | 88% | 0.88 | 85% | 0.845 | S | S | * | * | trans | -136.4 | 114.7 | 156.4 | -87.5 | 166.6 | 0 | 0 | 0 | 109.7 | ||||
| 7 | I | 31.4 | Very low | 29.8 | Very low | 167 Ų | 167 | 134.4 Ų | 134.4 | 86% | 0.856 | 85% | 0.848 | S | S | * | * | trans | -109.8 | 143.4 | 160.2 | -68.3 | 174.3 | 0 | 0 | 0 | 106.1 | ||||
| 8 | G | 27.7 | Very low | 29.9 | Very low | 78 Ų | 78 | 134.2 Ų | 134.2 | 80% | 0.804 | 85% | 0.845 | S | S | * | * | trans | 135.2 | 127.8 | 162.8 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 9 | G | 26.9 | Very low | 29.9 | Very low | 81 Ų | 81 | 139.9 Ų | 139.9 | 84% | 0.835 | 85% | 0.849 | S | S | * | * | cis | -168.3 | 176.7 | 11.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 10 | A | 28.5 | Very low | 30 | Very low | 111 Ų | 111 | 143.3 Ų | 143.3 | 92% | 0.917 | 85% | 0.851 | S | S | * | * | trans | -75 | 159.4 | -171 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 11 | G | 26.8 | Very low | 30.2 | Very low | 73 Ų | 73 | 141.6 Ų | 141.6 | 75% | 0.753 | 84% | 0.838 | S | S | * | * | trans | -160 | 136.4 | 166.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 12 | D | 30.1 | Very low | 30.2 | Very low | 163 Ų | 163 | 135.3 Ų | 135.3 | 87% | 0.872 | 82% | 0.815 | S | S | * | * | trans | -74.7 | 147.9 | -152 | -67.3 | -56.8 | 0 | 0 | 0 | 120 | ||||
| 13 | A | 27.5 | Very low | 30.7 | Very low | 86 Ų | 86 | 134.6 Ų | 134.6 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | 34 | 127.3 | 137.6 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 14 | C | 25.9 | Very low | 30.8 | Very low | 135 Ų | 135 | 134.8 Ų | 134.8 | 91% | 0.912 | 81% | 0.806 | S | S | * | * | -155.5 | 124.7 | 124 | -104 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 15 | H | 31.3 | Very low | 31 | Very low | 198 Ų | 198 | 129.3 Ų | 129.3 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | trans | -78 | 136.5 | 172.3 | -83.1 | -80.7 | 0 | 0 | 0 | 111.1 | ||||
| 16 | G | 28.8 | Very low | 31.1 | Very low | 59 Ų | 59 | 134.4 Ų | 134.4 | 61% | 0.608 | 81% | 0.809 | S | S | * | * | trans | -142.9 | 141.1 | 164.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | V18 | G16-V18 PolarHBondContact O-N 3.09Š| ||
| 17 | P | 32.8 | Very low | 31.1 | Very low | 138 Ų | 138 | 131.4 Ų | 131.4 | 90% | 0.896 | 81% | 0.809 | S | S | * | * | trans | -78.3 | 120.7 | -166.4 | 30.8 | -31.8 | 0 | 0 | 0 | 110.9 | ||||
| 18 | V | 32.1 | Very low | 31 | Very low | 132 Ų | 132 | 126.9 Ų | 126.9 | 80% | 0.8 | 80% | 0.804 | S | S | * | * | trans | -102.3 | 93 | 170.2 | 176.3 | 0 | 0 | 0 | 0 | 107.3 | G16 | G16-V18 PolarHBondContact O-N 3.09Š| ||
| 19 | W | 28.8 | Very low | 31.1 | Very low | 243 Ų | 243 | 132.5 Ų | 132.5 | 92% | 0.92 | 81% | 0.809 | S | S | * | * | trans | -159.7 | 108.2 | 155.8 | -96 | 91.3 | 0 | 0 | 0 | 107.9 | ||||
| 20 | K | 32.2 | Very low | 31.1 | Very low | 206 Ų | 206 | 133.3 Ų | 133.3 | 90% | 0.896 | 81% | 0.808 | S | S | * | * | trans | -123.2 | 125.2 | 159.6 | -88.2 | -172.9 | 176.9 | 179.7 | 0 | 107.9 | ||||
| 21 | D | 34.2 | Very low | 31.1 | Very low | 108 Ų | 108 | 133 Ų | 133 | 58% | 0.578 | 81% | 0.805 | S | S | * | * | trans | -41.5 | 129 | 176.6 | -177.8 | 6 | 0 | 0 | 0 | 113.7 | F23 | D21-F23 PolarHBondContact O-N 2.83Å; D21-F23 PolarHBondContact OD1-N 3.34Å | ||
| 22 | P | 35.3 | Very low | 31.2 | Very low | 104 Ų | 104 | 141.1 Ų | 141.1 | 68% | 0.675 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -76.4 | 2.8 | 175.3 | 29.3 | -29.5 | 0 | 0 | 0 | 113.8 | ||
| 23 | F | 42.8 | Very low | 31 | Very low | 154 Ų | 154 | 145.4 Ų | 145.4 | 68% | 0.675 | 82% | 0.817 | S | S | * | * | trans | -126.4 | 52.9 | -178.1 | -61.2 | -75.7 | 0 | 0 | 0 | 113.6 | D21 A105 | D21-F23 PolarHBondContact O-N 2.83Å; D21-F23 PolarHBondContact OD1-N 3.34Å; F23-A105 HydrophobicContact CE1-CB 4.4Å | ||
| 24 | G | 30.7 | Very low | 30.9 | Very low | 73 Ų | 73 | 144.5 Ų | 144.5 | 75% | 0.753 | 82% | 0.816 | S | S | * | * | trans | -99.8 | 99.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 25 | T | 36.5 | Very low | 31 | Very low | 133 Ų | 133 | 146.6 Ų | 146.6 | 82% | 0.816 | 82% | 0.817 | S | S | * | * | trans | -79.4 | 132.6 | 160.5 | 42.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 26 | K | 33 | Very low | 30.8 | Very low | 212 Ų | 212 | 142.4 Ų | 142.4 | 92% | 0.922 | 81% | 0.805 | S | S | * | * | trans | -175.2 | 133.9 | 133.8 | -103.2 | 175.1 | -172.7 | -171.2 | 0 | 112.8 | ||||
| 27 | A | 30.1 | Very low | 30.8 | Very low | 105 Ų | 105 | 150.2 Ų | 150.2 | 87% | 0.868 | 82% | 0.816 | S | S | * | * | trans | -84.9 | 157.8 | 164.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 28 | G | 28.7 | Very low | 30.5 | Very low | 73 Ų | 73 | 150.5 Ų | 150.5 | 75% | 0.753 | 81% | 0.809 | S | S | * | * | trans | 138.6 | 105.1 | 156 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 29 | E | 29.6 | Very low | 30.2 | Very low | 195 Ų | 195 | 150 Ų | 150 | 91% | 0.911 | 80% | 0.802 | S | S | * | * | trans | 74.6 | 112.1 | 144.3 | -74.6 | -179.6 | 147.4 | 0 | 0 | 124.1 | ||||
| 30 | A | 28.1 | Very low | 30.1 | Very low | 98 Ų | 98 | 145.5 Ų | 145.5 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | 49 | 115.7 | 120.7 | 0 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 31 | A | 28.4 | Very low | 29.9 | Very low | 105 Ų | 105 | 139.5 Ų | 139.5 | 87% | 0.868 | 78% | 0.784 | S | S | * | * | trans | -148.9 | 122.4 | 141.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 32 | R | 27.8 | Very low | 29.5 | Very low | 243 Ų | 243 | 142.6 Ų | 142.6 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | trans | -65.4 | 164.5 | 170.5 | -83.5 | 175.7 | 169.4 | 179.7 | -3.5 | 112.7 | ||||
| 33 | R | 27.1 | Very low | 29.2 | Very low | 254 Ų | 254 | 142.1 Ų | 142.1 | 96% | 0.958 | 80% | 0.804 | S | S | * | * | trans | 108.3 | 122.2 | 158.3 | -63.7 | 179.2 | -170.7 | -162.7 | 3.4 | 111.2 | ||||
| 34 | G | 24.5 | Very low | 28.5 | Very low | 67 Ų | 67 | 142.7 Ų | 142.7 | 69% | 0.691 | 82% | 0.815 | S | S | * | * | cis | 164.3 | 147.9 | 5 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 35 | I | 28.4 | Very low | 28.3 | Very low | 179 Ų | 179 | 142.2 Ų | 142.2 | 92% | 0.918 | 81% | 0.809 | S | S | * | * | trans | -153.4 | 142.5 | 149.4 | -93.9 | 146.1 | 0 | 0 | 0 | 106.3 | ||||
| 36 | T | 27.2 | Very low | 27.8 | Very low | 110 Ų | 110 | 141 Ų | 141 | 68% | 0.675 | 81% | 0.806 | S | S | * | * | trans | -114.4 | 137.3 | -151 | -54.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 37 | R | 27.8 | Very low | 27.5 | Very low | 223 Ų | 223 | 140.2 Ų | 140.2 | 84% | 0.842 | 81% | 0.806 | S | S | * | * | trans | 63.7 | 131.2 | 145.3 | -76.3 | 177 | -176.4 | -172.8 | -2.6 | 121.6 | ||||
| 38 | L | 26.5 | Very low | 27.3 | Very low | 144 Ų | 144 | 144.2 Ų | 144.2 | 75% | 0.754 | 81% | 0.807 | S | S | * | * | 159.3 | 136.4 | 113.9 | -109 | 78.6 | 0 | 0 | 0 | 105.4 | |||||
| 39 | N | 26.7 | Very low | 27.2 | Very low | 122 Ų | 122 | 150.1 Ų | 150.1 | 65% | 0.652 | 82% | 0.815 | S | S | * | * | cis | -164.6 | 151 | 17.2 | -109.2 | -20.9 | 0 | 0 | 0 | 110.6 | ||||
| 40 | L | 27.3 | Very low | 27 | Very low | 148 Ų | 148 | 149.4 Ų | 149.4 | 78% | 0.775 | 81% | 0.812 | S | S | * | * | trans | 35.3 | 119.1 | 148.3 | -78.7 | 99.8 | 0 | 0 | 0 | 120.8 | ||||
| 41 | A | 26.4 | Very low | 27.6 | Very low | 79 Ų | 79 | 149.8 Ų | 149.8 | 65% | 0.653 | 81% | 0.805 | S | S | * | * | 87.7 | 118.8 | 64.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 42 | L | 26.8 | Very low | 27.6 | Very low | 173 Ų | 173 | 154.5 Ų | 154.5 | 91% | 0.906 | 81% | 0.81 | S | S | * | * | 169.9 | 154.9 | 115.2 | -90.2 | 165.2 | 0 | 0 | 0 | 112.2 | |||||
| 43 | A | 28.8 | Very low | 27.6 | Very low | 94 Ų | 94 | 152.1 Ų | 152.1 | 78% | 0.777 | 81% | 0.809 | S | S | * | * | trans | 83.2 | 129.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 44 | D | 27.6 | Very low | 27.6 | Very low | 167 Ų | 167 | 149.3 Ų | 149.3 | 89% | 0.893 | 81% | 0.807 | S | S | * | * | cis | -173.8 | 162.6 | -9.4 | -152.1 | -13.3 | 0 | 0 | 0 | 106.2 | ||||
| 45 | G | 26.7 | Very low | 27.7 | Very low | 62 Ų | 62 | 152.5 Ų | 152.5 | 64% | 0.639 | 81% | 0.813 | S | S | * | * | trans | 98.5 | 76.6 | 152.2 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 46 | S | 26.2 | Very low | 27.7 | Very low | 108 Ų | 108 | 148.4 Ų | 148.4 | 76% | 0.755 | 81% | 0.806 | S | S | * | * | trans | -1.9 | 134.6 | 142.1 | 48.8 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 47 | Q | 26.1 | Very low | 27.7 | Very low | 196 Ų | 196 | 151.4 Ų | 151.4 | 92% | 0.916 | 81% | 0.814 | S | S | * | * | 83.9 | 114.2 | 127.6 | -71.5 | -175.5 | -19.6 | 0 | 0 | 122.3 | |||||
| 48 | E | 26.8 | Very low | 27.7 | Very low | 188 Ų | 188 | 149.2 Ų | 149.2 | 88% | 0.879 | 81% | 0.813 | S | S | * | * | trans | -77.6 | 144.4 | 155.7 | -69.5 | 170.4 | 146 | 0 | 0 | 111.4 | ||||
| 49 | Q | 25.9 | Very low | 27.7 | Very low | 198 Ų | 198 | 150.1 Ų | 150.1 | 93% | 0.925 | 82% | 0.819 | S | S | * | * | trans | -170.1 | 115.2 | 139.9 | -106.7 | 168.1 | 6.5 | 0 | 0 | 111 | ||||
| 50 | E | 25.8 | Very low | 27.8 | Very low | 180 Ų | 180 | 149.6 Ų | 149.6 | 84% | 0.841 | 83% | 0.825 | S | S | * | * | trans | -83.7 | -179 | 156.8 | -94.8 | -176.6 | 180 | 0 | 0 | 109.8 | ||||
| 51 | P | 41.8 | Very low | 28.2 | Very low | 105 Ų | 105 | 148 Ų | 148 | 68% | 0.682 | 82% | 0.824 | S | S | * | * | cis | -132.8 | 178.4 | -27.4 | 30.8 | -10.9 | 0 | 0 | 0 | 111.7 | ||||
| 52 | E | 28.3 | Very low | 28.2 | Very low | 205 Ų | 205 | 149.7 Ų | 149.7 | 96% | 0.958 | 83% | 0.826 | S | S | * | * | trans | -171.8 | 143 | 140.8 | -107.6 | 169.7 | -165 | 0 | 0 | 112.7 | ||||
| 53 | E | 27.2 | Very low | 28.2 | Very low | 193 Ų | 193 | 149.6 Ų | 149.6 | 90% | 0.902 | 82% | 0.823 | S | S | * | * | trans | -73.6 | 146.5 | -177.6 | -68.4 | 171.6 | 128.4 | 0 | 0 | 113.2 | ||||
| 54 | E | 27.7 | Very low | 28.1 | Very low | 195 Ų | 195 | 151.3 Ų | 151.3 | 91% | 0.911 | 82% | 0.823 | S | S | * | * | trans | -154.5 | 134.4 | 143.3 | -132.4 | 175 | -172 | 0 | 0 | 112.7 | ||||
| 55 | T | 24.9 | Very low | 28.1 | Very low | 133 Ų | 133 | 154.8 Ų | 154.8 | 82% | 0.816 | 82% | 0.824 | S | S | * | * | trans | -80.3 | 143.1 | -178.4 | 43.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 56 | A | 28.8 | Very low | 28.2 | Very low | 93 Ų | 93 | 157.6 Ų | 157.6 | 77% | 0.769 | 83% | 0.829 | S | S | * | * | trans | 176.5 | 130 | 133.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 57 | M | 28.5 | Very low | 28.1 | Very low | 173 Ų | 173 | 160.1 Ų | 160.1 | 85% | 0.852 | 83% | 0.833 | S | S | * | * | trans | 44.9 | 111.4 | 141 | -70.5 | -174.5 | -174.5 | 0 | 0 | 120.7 | ||||
| 58 | E | 26.9 | Very low | 28.2 | Very low | 177 Ų | 177 | 159.3 Ų | 159.3 | 83% | 0.827 | 83% | 0.832 | S | S | * | * | 74 | 107.1 | 98.9 | -87.4 | -169.1 | 162.9 | 0 | 0 | 114.9 | |||||
| 59 | D | 26.9 | Very low | 28.2 | Very low | 164 Ų | 164 | 153.7 Ų | 153.7 | 88% | 0.877 | 83% | 0.825 | S | S | * | * | -169.3 | 130 | 123 | -110.7 | -19.1 | 0 | 0 | 0 | 111.2 | |||||
| 60 | S | 27.8 | Very low | 28.3 | Very low | 110 Ų | 110 | 151.8 Ų | 151.8 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | trans | -107.3 | 145.5 | 162.8 | -84.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 61 | P | 36.2 | Very low | 28.4 | Very low | 116 Ų | 116 | 150.7 Ų | 150.7 | 75% | 0.753 | 82% | 0.816 | S | S | * | * | -143.7 | 129.1 | 105.4 | 29.5 | -10.9 | 0 | 0 | 0 | 115.3 | |||||
| 62 | T | 26.7 | Very low | 27.7 | Very low | 113 Ų | 113 | 153 Ų | 153 | 69% | 0.693 | 82% | 0.817 | S | S | * | * | 44.9 | 119.1 | 126.6 | -16.6 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 63 | M | 26.9 | Very low | 27.8 | Very low | 172 Ų | 172 | 149.4 Ų | 149.4 | 85% | 0.847 | 81% | 0.809 | S | S | * | * | trans | 74.6 | 104.1 | 141.5 | -85.5 | 179.5 | -157.1 | 0 | 0 | 120.7 | ||||
| 64 | V | 26.6 | Very low | 27.7 | Very low | 130 Ų | 130 | 144.7 Ų | 144.7 | 79% | 0.788 | 80% | 0.798 | S | S | * | * | -140.3 | 110.9 | 120.2 | -179.3 | 0 | 0 | 0 | 0 | 108.1 | V66 | V64-V66 HydrophobicContact CG1-CG2 4.07Å; V64-V66 PolarHBondContact O-N 2.93Å | |||
| 65 | R | 26.7 | Very low | 28.1 | Very low | 239 Ų | 239 | 140.9 Ų | 140.9 | 90% | 0.902 | 79% | 0.79 | S | S | * | * | trans | -72.2 | 111.7 | 165.7 | -97.5 | -177.6 | 169.3 | 168.1 | -3.6 | 107.7 | ||||
| 66 | V | 29.3 | Very low | 28.2 | Very low | 122 Ų | 122 | 140.8 Ų | 140.8 | 74% | 0.739 | 79% | 0.793 | S | S | * | * | trans | -95.3 | 111.3 | 165.6 | 179.8 | 0 | 0 | 0 | 0 | 106.8 | V64 M68 | V64-V66 HydrophobicContact CG1-CG2 4.07Å; V64-V66 PolarHBondContact O-N 2.93Å; V66-M68 PolarHBondContact O-N 3.17Å; V66-M68 VanDerWaalsContact O-N 3.09Å | ||
| 67 | D | 25 | Very low | 28.6 | Very low | 160 Ų | 160 | 145 Ų | 145 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | trans | -59.9 | 107.5 | 172 | -86.2 | -32.4 | 0 | 0 | 0 | 109.7 | G69 | D67-G69 PolarHBondContact O-N 2.85Å; D67-G69 VanDerWaalsContact O-N 3.17Å | ||
| 68 | M | 28.7 | Very low | 28.9 | Very low | 179 Ų | 179 | 140.3 Ų | 140.3 | 88% | 0.882 | 79% | 0.79 | S | S | * | * | trans | -74.8 | 94.9 | 161.3 | -93.9 | -78.8 | -161.4 | 0 | 0 | 107.6 | V66 E70 | V66-M68 PolarHBondContact O-N 3.17Å; V66-M68 VanDerWaalsContact O-N 3.09Å; M68-E70 VanDerWaalsContact C-N 3.35Å; M68-E70 PolarHBondContact O-N 3Å | ||
| 69 | G | 26.4 | Very low | 29.5 | Very low | 71 Ų | 71 | 142.2 Ų | 142.2 | 73% | 0.732 | 79% | 0.79 | S | S | * | * | trans | -63.1 | 93.8 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | D67 N71 | D67-G69 PolarHBondContact O-N 2.85Å; D67-G69 VanDerWaalsContact O-N 3.17Å; G69-N71 PolarHBondContact O-N 3.15Å | ||
| 70 | E | 27.5 | Very low | 30.4 | Very low | 157 Ų | 157 | 144.8 Ų | 144.8 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | trans | -62.3 | 104.2 | 161.6 | -75.4 | -170.7 | 155.2 | 0 | 0 | 108.7 | M68 Q72 | M68-E70 VanDerWaalsContact C-N 3.35Å; M68-E70 PolarHBondContact O-N 3Å; E70-Q72 PolarHBondContact O-N 3.06Å | ||
| 71 | N | 27.6 | Very low | 31.2 | Very low | 158 Ų | 158 | 145.7 Ų | 145.7 | 85% | 0.845 | 79% | 0.792 | S | S | * | * | trans | -66.9 | 78.3 | 162.2 | -100.3 | -21.7 | 0 | 0 | 0 | 109 | G69 V73 | G69-N71 PolarHBondContact O-N 3.15Å; N71-V73 VanDerWaalsContact C-N 3.28Å; N71-V73 PolarHBondContact O-N 2.91Å | ||
| 72 | Q | 26.9 | Very low | 32.1 | Very low | 153 Ų | 153 | 146.8 Ų | 146.8 | 72% | 0.715 | 79% | 0.785 | S | S | * | * | trans | -71.2 | 90.2 | 161.1 | -75 | -168.4 | 15.1 | 0 | 0 | 108.5 | E70 S74 | E70-Q72 PolarHBondContact O-N 3.06Å; Q72-S74 VanDerWaalsContact C-N 3.32Å; Q72-S74 PolarHBondContact O-N 2.78Å | ||
| 73 | V | 30.6 | Very low | 34.2 | Very low | 130 Ų | 130 | 145.4 Ų | 145.4 | 79% | 0.788 | 78% | 0.779 | S | S | * | * | trans | -64.1 | 98.2 | 164.4 | 179.4 | 0 | 0 | 0 | 0 | 107.5 | N71 | N71-V73 VanDerWaalsContact C-N 3.28Å; N71-V73 PolarHBondContact O-N 2.91Å | ||
| 74 | S | 25.6 | Very low | 36.4 | Very low | 94 Ų | 94 | 146 Ų | 146 | 66% | 0.657 | 78% | 0.776 | S | S | * | * | trans | -59.5 | 125.5 | 171.3 | -65 | 0 | 0 | 0 | 0 | 109.3 | Q72 C76 | Q72-S74 VanDerWaalsContact C-N 3.32Å; Q72-S74 PolarHBondContact O-N 2.78Å; S74-C76 PolarHBondContact O-N 3.15Å; S74-C76 VanDerWaalsContact O-N 3.15Å | ||
| 75 | P | 34.9 | Very low | 38.9 | Very low | 114 Ų | 114 | 143.3 Ų | 143.3 | 74% | 0.74 | 77% | 0.768 | S | S | * | * | trans | -72.1 | 115.1 | 172.4 | 26.9 | -28.3 | 0 | 0 | 0 | 108 | K77 | P75-K77 PolarHBondContact O-N 2.94Š| ||
| 76 | C | 28 | Very low | 41.5 | Very low | 132 Ų | 132 | 135 Ų | 135 | 89% | 0.892 | 74% | 0.741 | S | S | * | * | trans | -47.5 | 103.1 | 170.4 | -74.5 | 0 | 0 | 0 | 0 | 110.1 | S74 G78 | S74-C76 PolarHBondContact O-N 3.15Å; S74-C76 VanDerWaalsContact O-N 3.15Å; C76-G78 VanDerWaalsContact C-N 3.28Å; C76-G78 PolarHBondContact O-N 3.37Å | ||
| 77 | K | 36.6 | Very low | 44 | Very low | 181 Ų | 181 | 131.7 Ų | 131.7 | 79% | 0.787 | 73% | 0.731 | S | S | * | * | trans | -72.1 | 81.5 | 174.1 | -84.6 | 176.5 | 176.5 | 168.8 | 0 | 109.6 | P75 R79 | P75-K77 PolarHBondContact O-N 2.94Å; K77-R79 PolarHBondContact O-N 2.92Å | ||
| 78 | G | 35.1 | Very low | 47 | Very low | 75 Ų | 75 | 130.7 Ų | 130.7 | 77% | 0.773 | 72% | 0.716 | S | S | * | * | trans | -86.5 | 57.5 | 153.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | C76 R80 | C76-G78 VanDerWaalsContact C-N 3.28Å; C76-G78 PolarHBondContact O-N 3.37Å; G78-R80 VanDerWaalsContact C-N 3.34Å; G78-R80 PolarHBondContact O-N 3.35Å | ||
| 79 | R | 39.3 | Very low | 50.1 | Low | 217 Ų | 217 | 124.2 Ų | 124.2 | 82% | 0.819 | 69% | 0.687 | S | S | * | * | trans | -72 | 90.8 | 176.1 | -99.1 | -173.3 | -179 | -176.5 | 1.2 | 108.7 | K77 C81 | K77-R79 PolarHBondContact O-N 2.92Å; R79-C81 PolarHBondContact O-N 2.84Å; R79-C81 VanDerWaalsContact O-N 3.15Å | ||
| 80 | R | 45.6 | Very low | 53.4 | Low | 217 Ų | 217 | 123.3 Ų | 123.3 | 82% | 0.819 | 67% | 0.667 | S | S | * | * | trans | -58.3 | 116 | 151 | -87.1 | -179.4 | 175 | 175.7 | -2 | 106.1 | G78 F82 | G78-R80 VanDerWaalsContact C-N 3.34Å; G78-R80 PolarHBondContact O-N 3.35Å; R80-F82 HydrophobicContact CB-CD2 4.27Å; R80-F82 PolarHBondContact O-N 2.99Å | ||
| 81 | C | 44.9 | Very low | 56.6 | Low | 130 Ų | 130 | 116 Ų | 116 | 88% | 0.878 | 63% | 0.633 | S | S | * | * | trans | -71.3 | 72.3 | 178.8 | -149 | 0 | 0 | 0 | 0 | 108.4 | R79 | R79-C81 PolarHBondContact O-N 2.84Å; R79-C81 VanDerWaalsContact O-N 3.15Å | ||
| 82 | F | 54.8 | Low | 59.9 | Low | 138 Ų | 138 | 109 Ų | 109 | 61% | 0.605 | 60% | 0.596 | S | S | * | * | trans | -64.5 | 125.5 | 165.5 | -98.7 | -85.7 | 0 | 0 | 0 | 106.7 | R80 K84 L86 | R80-F82 HydrophobicContact CB-CD2 4.27Å; R80-F82 PolarHBondContact O-N 2.99Å; F82-K84 PolarHBondContact O-N 3.22Å; F82-K84 VanDerWaalsContact O-N 3.15Å; F82-L86 HydrophobicContact CD1-CD2 3.69Å; F82-L86 HydrophobicContact CE1-CD2 3.71Å | ||
| 83 | P | 71.3 | Confident | 63.2 | Low | 85 Ų | 85 | 102.5 Ų | 102.5 | 55% | 0.552 | 57% | 0.566 | S | S | * | * | trans | -56.6 | 126.3 | 178.6 | 19.3 | -27.6 | 0 | 0 | 0 | 108 | A85 L86 | P83-A85 PolarHBondContact O-N 3.18Å; P83-L86 HydrophobicContact CG-CB 4.19Å; P83-L86 WeakPolarHBondContact O-CB 2.85Å; P83-L86 PolarHBondContact O-N 3.31Å | ||
| 84 | K | 73.5 | Confident | 66.2 | Low | 184 Ų | 184 | 100.5 Ų | 100.5 | 80% | 0.8 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -48.1 | -37.7 | -173 | -72.5 | -179.4 | 178.8 | 177.6 | 0 | 112.6 | F82 L86 G87 Y88 | F82-K84 PolarHBondContact O-N 3.22Å; F82-K84 VanDerWaalsContact O-N 3.15Å; K84-L86 VanDerWaalsContact C-N 3.3Å; K84-L86 PolarHBondContact O-N 3.28Å; K84-G87 PolarHBondContact O-N 3.15Å; K84-Y88 WeakPolarHBondContact O-CD2 3.17Å |
| 85 | A | 79.7 | Confident | 69.5 | Low | 74 Ų | 74 | 101.8 Ų | 101.8 | 61% | 0.612 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -58 | -36.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | P83 G87 Y88 | P83-A85 PolarHBondContact O-N 3.18Å; A85-G87 VanDerWaalsContact C-N 3.32Å; A85-G87 PolarHBondContact O-N 3.47Å; A85-Y88 PolarHBondContact O-N 3.32Å |
| 86 | L | 80.3 | Confident | 72.3 | Confident | 65 Ų | 65 | 98.7 Ų | 98.7 | 34% | 0.34 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.1 | -35 | -179.8 | -162.1 | 69.9 | 0 | 0 | 0 | 111.4 | F82 P83 K84 Y88 V89 T90 L302 | F82-L86 HydrophobicContact CD1-CD2 3.69Å; F82-L86 HydrophobicContact CE1-CD2 3.71Å; P83-L86 HydrophobicContact CG-CB 4.19Å; P83-L86 WeakPolarHBondContact O-CB 2.85Å; P83-L86 PolarHBondContact O-N 3.31Å; K84-L86 VanDerWaalsContact C-N 3.3Å; K84-L86 PolarHBondContact O-N 3.28Å; L86-Y88 PolarHBondContact O-N 3.01Å; L86-V89 HydrophobicContact CD1-CG2 4.04Å; L86-V89 VanDerWaalsContact O-CG2 3.28Å; L86-V89 WeakPolarHBondContact O-CG2 3.41Å; L86-V89 PolarHBondContact O-N 3.18Å; L86-T90 HydrophobicContact CG-CG2 4.08Å; L86-T90 WeakPolarHBondContact O-CG2 3.13Å; L86-T90 PolarHBondContact O-N 3.32Å; L86-T90 VanDerWaalsContact O-N 3.16Å; L86-T90 PolarHBondContact O-OG1 2.92Å; L86-L302 HydrophobicContact CD1-CD1 4.48Å |
| 87 | G | 81.5 | Confident | 75.4 | Confident | 51 Ų | 51 | 93.9 Ų | 93.9 | 53% | 0.526 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.7 | -28.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114 | K84 A85 T90 | K84-G87 PolarHBondContact O-N 3.15Å; A85-G87 VanDerWaalsContact C-N 3.32Å; A85-G87 PolarHBondContact O-N 3.47Å; G87-T90 PolarHBondContact O-OG1 3.29Å |
| 88 | Y | 88.9 | Confident | 78.2 | Confident | 140 Ų | 140 | 89.6 Ų | 89.6 | 55% | 0.549 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -76.9 | -22.4 | 177.9 | -73.8 | -81.8 | 0 | 0 | 0 | 113.6 | K84 A85 L86 M93 E95 | K84-Y88 WeakPolarHBondContact O-CD2 3.17Å; A85-Y88 PolarHBondContact O-N 3.32Å; L86-Y88 PolarHBondContact O-N 3.01Å; Y88-M93 WeakPolarHBondContact O-CE 3.41Å; Y88-E95 WeakPolarHBondContact CD1-OE2 3.31Å; Y88-E95 WeakPolarHBondContact CE1-OE2 3.46Å |
| 89 | V | 92.8 | Very high | 81 | Confident | 42 Ų | 42 | 93 Ų | 93 | 26% | 0.255 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -106.3 | -8.7 | -175.2 | -60.8 | 0 | 0 | 0 | 0 | 113.6 | L86 M93 N125 L302 | L86-V89 HydrophobicContact CD1-CG2 4.04Å; L86-V89 VanDerWaalsContact O-CG2 3.28Å; L86-V89 WeakPolarHBondContact O-CG2 3.41Å; L86-V89 PolarHBondContact O-N 3.18Å; V89-M93 HydrophobicContact CG1-CE 4.29Å; V89-N125 PolarHBondContact O-ND2 3.28Å; V89-L302 HydrophobicContact CB-CD1 4.47Å; V89-L302 HydrophobicContact CG2-CD1 3.9Å |
| 90 | T | 95.7 | Very high | 83.7 | Confident | 53 Ų | 53 | 83.3 Ų | 83.3 | 33% | 0.325 | 43% | 0.429 | S | S | . | . | S | Bend | trans | -84.9 | 162.6 | 176.9 | 54.1 | 0 | 0 | 0 | 0 | 113.1 | L86 G87 L302 | L86-T90 HydrophobicContact CG-CG2 4.08Å; L86-T90 WeakPolarHBondContact O-CG2 3.13Å; L86-T90 PolarHBondContact O-N 3.32Å; L86-T90 VanDerWaalsContact O-N 3.16Å; L86-T90 PolarHBondContact O-OG1 2.92Å; G87-T90 PolarHBondContact O-OG1 3.29Å; T90-L302 WeakPolarHBondContact CA-O 3.35Å; T90-L302 WeakPolarHBondContact CG2-O 3.28Å |
| 91 | G | 95.7 | Very high | 86 | Confident | 2 Ų | 2 | 79.1 Ų | 79.1 | 2% | 0.021 | 42% | 0.416 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 58.5 | -143.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | M93 N125 S303 | G91-M93 VanDerWaalsContact C-N 3.27Å; G91-M93 PolarHBondContact O-N 3.2Å; G91-N125 PolarHBondContact O-ND2 3.16Å; G91-S303 WeakPolarHBondContact CA-O 3.46Å; G91-S303 PolarHBondContact N-O 2.63Å; G91-S303 PolarHBondContact O-OG 3.39Å |
| 92 | D | 95.6 | Very high | 88.3 | Confident | 12 Ų | 12 | 79.7 Ų | 79.7 | 6% | 0.064 | 41% | 0.41 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | -0.6 | -175.1 | -62.2 | -19.2 | 0 | 0 | 0 | 114.7 | K94 R115 N124 T419 | D92-K94 VanDerWaalsContact C-N 3.31Å; D92-K94 HydrophobicContact CB-CG 4.07Å; D92-K94 PolarHBondContact O-N 2.83Å; D92-R115 PolarHBondContact O-NH1 3.15Å; D92-R115 PolarHBondContact O-NH2 3.48Å; D92-N124 CarbonylContact C-O 3.31Å; D92-N124 VanDerWaalsContact C-O 3.31Å; D92-N124 WeakPolarHBondContact CA-O 3.38Å; D92-N124 HydrophobicContact CB-CB 4.36Å; D92-T419 VanDerWaalsContact OD2-CB 3.28Å; D92-T419 WeakPolarHBondContact OD2-CB 3.17Å |
| 93 | M | 96.5 | Very high | 90.2 | Very high | 16 Ų | 16 | 76.1 Ų | 76.1 | 8% | 0.079 | 40% | 0.395 | C | S | . | . | trans | 48.2 | 48.3 | -174.4 | -61 | -177.8 | 70.3 | 0 | 0 | 113.4 | Y88 V89 G91 E95 L96 A97 R115 N125 P126 I127 | Y88-M93 WeakPolarHBondContact O-CE 3.41Å; V89-M93 HydrophobicContact CG1-CE 4.29Å; G91-M93 VanDerWaalsContact C-N 3.27Å; G91-M93 PolarHBondContact O-N 3.2Å; M93-E95 PolarHBondContact O-N 3.12Å; M93-L96 HydrophobicContact CB-CB 4.23Å; M93-L96 HydrophobicContact CE-CB 4.17Å; M93-L96 HydrophobicContact CE-CD2 3.48Å; M93-L96 VanDerWaalsContact CE-CD2 3.48Å; M93-L96 HydrophobicContact CE-CG 4.44Å; M93-L96 PolarHBondContact O-N 3.41Å; M93-L96 VanDerWaalsContact O-N 3.17Å; M93-L96 HydrophobicContact SD-CD2 4.45Å; M93-A97 PolarHBondContact O-N 3.41Å; M93-A97 VanDerWaalsContact O-N 3.12Å; M93-R115 PolarHBondContact O-NH2 3.37Å; M93-N125 WeakPolarHBondContact CG-ND2 3.29Å; M93-N125 VanDerWaalsContact SD-CG 3.57Å; M93-N125 PolarHBondContact SD-OD1 2.92Å; M93-P126 HydrophobicContact CE-CG 4.48Å; M93-P126 HydrophobicContact SD-CG 3.9Å; M93-I127 HydrophobicContact CE-CG1 3.8Å; M93-I127 HydrophobicContact SD-CB 4.34Å; M93-I127 HydrophobicContact SD-CG1 3.67Å | ||
| 94 | K | 93.9 | Very high | 91.5 | Very high | 88 Ų | 88 | 76.1 Ų | 76.1 | 38% | 0.383 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.2 | -32.4 | -177 | -61.7 | 178.3 | -171.7 | 166 | 0 | 112.7 | D92 A97 N98 E423 | D92-K94 VanDerWaalsContact C-N 3.31Å; D92-K94 HydrophobicContact CB-CG 4.07Å; D92-K94 PolarHBondContact O-N 2.83Å; K94-A97 PolarHBondContact O-N 3.28Å; K94-N98 WeakPolarHBondContact O-CB 3.38Å; K94-N98 VanDerWaalsContact O-CG 3.31Å; K94-N98 PolarHBondContact O-N 2.78Å; K94-N98 PolarHBondContact O-ND2 3.23Å; K94-E423 IonicContact NZ-OE1 2.86Å; K94-E423 PolarHBondContact NZ-OE1 2.93Å; K94-E423 IonicContact NZ-OE2 3.88Å; K94-E423 PolarHBondContact NZ-OE2 3.34Å |
| 95 | E | 94.1 | Very high | 92.5 | Very high | 121 Ų | 121 | 70 Ų | 70 | 57% | 0.565 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -66.6 | -42.6 | 177.6 | -64.1 | -175.9 | -177.9 | 0 | 0 | 112.2 | Y88 M93 N98 W99 | Y88-E95 WeakPolarHBondContact CD1-OE2 3.31Å; Y88-E95 WeakPolarHBondContact CE1-OE2 3.46Å; M93-E95 PolarHBondContact O-N 3.12Å; E95-N98 PolarHBondContact O-N 2.88Å; E95-W99 WeakPolarHBondContact O-CB 3.4Å; E95-W99 PolarHBondContact O-N 3.27Å |
| 96 | L | 93.9 | Very high | 93.4 | Very high | 50 Ų | 50 | 71.4 Ų | 71.4 | 26% | 0.262 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 173.3 | 177.5 | 64.4 | 0 | 0 | 0 | 110.8 | M93 N98 W99 L100 P126 | M93-L96 HydrophobicContact CB-CB 4.23Å; M93-L96 HydrophobicContact CE-CB 4.17Å; M93-L96 HydrophobicContact CE-CD2 3.48Å; M93-L96 VanDerWaalsContact CE-CD2 3.48Å; M93-L96 HydrophobicContact CE-CG 4.44Å; M93-L96 PolarHBondContact O-N 3.41Å; M93-L96 VanDerWaalsContact O-N 3.17Å; M93-L96 HydrophobicContact SD-CD2 4.45Å; L96-N98 VanDerWaalsContact C-N 3.29Å; L96-N98 PolarHBondContact O-N 3.17Å; L96-W99 HydrophobicContact CD1-CE3 3.97Å; L96-W99 HydrophobicContact CD1-CZ3 4.39Å; L96-W99 PolarHBondContact O-N 3.24Å; L96-L100 HydrophobicContact CD1-CD1 4.15Å; L96-L100 HydrophobicContact CD1-CG 4.18Å; L96-L100 HydrophobicContact CG-CD1 3.94Å; L96-L100 HydrophobicContact CG-CG 4.41Å; L96-L100 WeakPolarHBondContact O-CB 3.43Å; L96-L100 WeakPolarHBondContact O-CG 3.47Å; L96-L100 PolarHBondContact O-N 3.33Å; L96-P126 HydrophobicContact CD2-CG 3.74Å |
| 97 | A | 93.8 | Very high | 94.2 | Very high | 31 Ų | 31 | 72.2 Ų | 72.2 | 26% | 0.256 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -59.2 | -40.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | M93 K94 | M93-A97 PolarHBondContact O-N 3.41Å; M93-A97 VanDerWaalsContact O-N 3.12Å; K94-A97 PolarHBondContact O-N 3.28Å |
| 98 | N | 94.6 | Very high | 95 | Very high | 90 Ų | 90 | 71.8 Ų | 71.8 | 48% | 0.481 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -67.4 | -43.3 | 175.5 | -74.9 | -30 | 0 | 0 | 0 | 112.1 | K94 E95 L96 L100 K101 | K94-N98 WeakPolarHBondContact O-CB 3.38Å; K94-N98 VanDerWaalsContact O-CG 3.31Å; K94-N98 PolarHBondContact O-N 2.78Å; K94-N98 PolarHBondContact O-ND2 3.23Å; E95-N98 PolarHBondContact O-N 2.88Å; L96-N98 VanDerWaalsContact C-N 3.29Å; L96-N98 PolarHBondContact O-N 3.17Å; N98-L100 VanDerWaalsContact C-N 3.28Å; N98-L100 PolarHBondContact O-N 2.97Å; N98-K101 WeakPolarHBondContact O-CB 3.4Å; N98-K101 PolarHBondContact O-N 3.35Å; N98-K101 PolarHBondContact OD1-NZ 3.16Å |
| 99 | W | 95.1 | Very high | 95.4 | Very high | 147 Ų | 147 | 67.3 Ų | 67.3 | 56% | 0.557 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -63.9 | -32.6 | 178.1 | 177.3 | 86.5 | 0 | 0 | 0 | 113.1 | E95 L96 K101 K103 | E95-W99 WeakPolarHBondContact O-CB 3.4Å; E95-W99 PolarHBondContact O-N 3.27Å; L96-W99 HydrophobicContact CD1-CE3 3.97Å; L96-W99 HydrophobicContact CD1-CZ3 4.39Å; L96-W99 PolarHBondContact O-N 3.24Å; W99-K101 VanDerWaalsContact C-N 3.35Å; W99-K103 HydrophobicContact CD2-CG 4.43Å; W99-K103 HydrophobicContact CE3-CG 4.18Å; W99-K103 HydrophobicContact CH2-CD 4.06Å; W99-K103 HydrophobicContact CH2-CG 4.25Å; W99-K103 HydrophobicContact CZ2-CD 4.03Å; W99-K103 HydrophobicContact CZ2-CG 4.5Å; W99-K103 HydrophobicContact CZ3-CD 4.41Å; W99-K103 HydrophobicContact CZ3-CG 4.09Å; W99-K103 VanDerWaalsContact O-CG 3.31Å; W99-K103 WeakPolarHBondContact O-CG 3.46Å |
| 100 | L | 95.1 | Very high | 95.7 | Very high | 14 Ų | 14 | 69.2 Ų | 69.2 | 7% | 0.073 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -72.8 | -19.7 | 179.1 | -81.1 | 171.5 | 0 | 0 | 0 | 114.3 | L96 N98 D102 K103 L107 Q108 D111 | L96-L100 HydrophobicContact CD1-CD1 4.15Å; L96-L100 HydrophobicContact CD1-CG 4.18Å; L96-L100 HydrophobicContact CG-CD1 3.94Å; L96-L100 HydrophobicContact CG-CG 4.41Å; L96-L100 WeakPolarHBondContact O-CB 3.43Å; L96-L100 WeakPolarHBondContact O-CG 3.47Å; L96-L100 PolarHBondContact O-N 3.33Å; N98-L100 VanDerWaalsContact C-N 3.28Å; N98-L100 PolarHBondContact O-N 2.97Å; L100-D102 PolarHBondContact O-N 2.92Å; L100-K103 HydrophobicContact CD2-CB 4.24Å; L100-K103 HydrophobicContact CD2-CG 4.39Å; L100-K103 WeakPolarHBondContact O-CB 3.41Å; L100-K103 PolarHBondContact O-N 3.05Å; L100-L107 HydrophobicContact CD2-CB 4.14Å; L100-Q108 VanDerWaalsContact O-CG 3.25Å; L100-Q108 WeakPolarHBondContact O-CG 3.42Å; L100-Q108 PolarHBondContact O-NE2 3.44Å; L100-D111 HydrophobicContact CD1-CB 3.56Å; L100-D111 VanDerWaalsContact CD1-CG 3.49Å |
| 101 | K | 93.3 | Very high | 95.8 | Very high | 128 Ų | 128 | 67.2 Ų | 67.2 | 56% | 0.557 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -35.9 | -177.1 | -74 | 172.5 | 178.4 | 168.7 | 0 | 113.1 | N98 W99 Q108 | N98-K101 WeakPolarHBondContact O-CB 3.4Å; N98-K101 PolarHBondContact O-N 3.35Å; N98-K101 PolarHBondContact OD1-NZ 3.16Å; W99-K101 VanDerWaalsContact C-N 3.35Å; K101-Q108 PolarHBondContact O-NE2 3.17Å; K101-Q108 VanDerWaalsContact O-NE2 3.07Å |
| 102 | D | 94 | Very high | 96 | Very high | 142 Ų | 142 | 68.6 Ų | 68.6 | 76% | 0.759 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.3 | 19.5 | -178.9 | -51.9 | -44 | 0 | 0 | 0 | 112.8 | L100 | L100-D102 PolarHBondContact O-N 2.92Š|
| 103 | K | 95.8 | Very high | 96.1 | Very high | 64 Ų | 64 | 68.3 Ų | 68.3 | 28% | 0.278 | 35% | 0.349 | S | S | . | . | S | Bend | trans | -108.9 | 164 | -178.5 | -60.1 | -68.8 | 171.8 | -78.8 | 0 | 110.8 | W99 L100 A105 Q108 | W99-K103 HydrophobicContact CD2-CG 4.43Å; W99-K103 HydrophobicContact CE3-CG 4.18Å; W99-K103 HydrophobicContact CH2-CD 4.06Å; W99-K103 HydrophobicContact CH2-CG 4.25Å; W99-K103 HydrophobicContact CZ2-CD 4.03Å; W99-K103 HydrophobicContact CZ2-CG 4.5Å; W99-K103 HydrophobicContact CZ3-CD 4.41Å; W99-K103 HydrophobicContact CZ3-CG 4.09Å; W99-K103 VanDerWaalsContact O-CG 3.31Å; W99-K103 WeakPolarHBondContact O-CG 3.46Å; L100-K103 HydrophobicContact CD2-CB 4.24Å; L100-K103 HydrophobicContact CD2-CG 4.39Å; L100-K103 WeakPolarHBondContact O-CB 3.41Å; L100-K103 PolarHBondContact O-N 3.05Å; K103-A105 PolarHBondContact O-N 3.36Å; K103-Q108 PolarHBondContact O-NE2 3.37Å |
| 104 | P | 97.1 | Very high | 96.2 | Very high | 85 Ų | 85 | 68.7 Ų | 68.7 | 55% | 0.552 | 35% | 0.352 | S | S | * | . | trans | -49.2 | 138.5 | -179.7 | -30.1 | 35.2 | 0 | 0 | 0 | 113.3 | V106 L107 Q108 | P104-V106 PolarHBondContact O-N 3.07Å; P104-V106 VanDerWaalsContact O-N 3.09Å; P104-L107 WeakPolarHBondContact O-CB 3.39Å; P104-L107 PolarHBondContact O-N 3.22Å; P104-Q108 PolarHBondContact O-N 3.12Å | ||
| 105 | A | 96.1 | Very high | 96.4 | Very high | 56 Ų | 56 | 64.7 Ų | 64.7 | 46% | 0.463 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -56.4 | -31.1 | -176 | 0 | 0 | 0 | 0 | 0 | 113.2 | F23 K103 L107 Q108 F109 | F23-A105 HydrophobicContact CE1-CB 4.4Å; K103-A105 PolarHBondContact O-N 3.36Å; A105-L107 PolarHBondContact O-N 3.25Å; A105-Q108 PolarHBondContact O-N 3.49Å; A105-F109 WeakPolarHBondContact O-CB 3.15Å; A105-F109 PolarHBondContact O-N 3.31Å |
| 106 | V | 97.4 | Very high | 96.7 | Very high | 102 Ų | 102 | 59 Ų | 59 | 62% | 0.618 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -62.4 | -40.6 | 175.7 | 179.4 | 0 | 0 | 0 | 0 | 111.7 | P104 F109 I110 | P104-V106 PolarHBondContact O-N 3.07Å; P104-V106 VanDerWaalsContact O-N 3.09Å; V106-F109 PolarHBondContact O-N 3.39Å; V106-I110 HydrophobicContact CG1-CD1 4.08Å; V106-I110 VanDerWaalsContact O-CG1 3.31Å; V106-I110 WeakPolarHBondContact O-CG1 3.35Å; V106-I110 PolarHBondContact O-N 3.09Å |
| 107 | L | 97.4 | Very high | 96.9 | Very high | 82 Ų | 82 | 56.6 Ų | 56.6 | 43% | 0.429 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -69.3 | -39.3 | 177.6 | -66 | -179.6 | 0 | 0 | 0 | 111.6 | L100 P104 A105 F109 I110 D111 | L100-L107 HydrophobicContact CD2-CB 4.14Å; P104-L107 WeakPolarHBondContact O-CB 3.39Å; P104-L107 PolarHBondContact O-N 3.22Å; A105-L107 PolarHBondContact O-N 3.25Å; L107-F109 VanDerWaalsContact C-N 3.32Å; L107-I110 PolarHBondContact O-N 3.43Å; L107-D111 PolarHBondContact O-N 3.03Å |
| 108 | Q | 97.5 | Very high | 97.1 | Very high | 43 Ų | 43 | 55.1 Ų | 55.1 | 20% | 0.201 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.2 | -44.7 | 173.2 | -59.7 | -172.8 | 41.8 | 0 | 0 | 110.6 | L100 K101 K103 P104 A105 I110 D111 W112 | L100-Q108 VanDerWaalsContact O-CG 3.25Å; L100-Q108 WeakPolarHBondContact O-CG 3.42Å; L100-Q108 PolarHBondContact O-NE2 3.44Å; K101-Q108 PolarHBondContact O-NE2 3.17Å; K101-Q108 VanDerWaalsContact O-NE2 3.07Å; K103-Q108 PolarHBondContact O-NE2 3.37Å; P104-Q108 PolarHBondContact O-N 3.12Å; A105-Q108 PolarHBondContact O-N 3.49Å; Q108-I110 PolarHBondContact O-N 3.31Å; Q108-D111 WeakPolarHBondContact O-CB 3.42Å; Q108-D111 PolarHBondContact O-N 3.07Å; Q108-W112 HydrophobicContact CB-CZ2 4.04Å; Q108-W112 PolarHBondContact O-N 3.3Å; Q108-W112 PolarHBondContact O-NE1 3.11Å |
| 109 | F | 98.3 | Very high | 97.3 | Very high | 45 Ų | 45 | 51.8 Ų | 51.8 | 20% | 0.197 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.4 | -44.9 | 178.3 | -172.1 | -103.7 | 0 | 0 | 0 | 111.9 | A105 V106 L107 D111 W112 I113 V152 T155 L156 L159 | A105-F109 WeakPolarHBondContact O-CB 3.15Å; A105-F109 PolarHBondContact O-N 3.31Å; V106-F109 PolarHBondContact O-N 3.39Å; L107-F109 VanDerWaalsContact C-N 3.32Å; F109-D111 VanDerWaalsContact C-N 3.34Å; F109-D111 PolarHBondContact O-N 2.98Å; F109-W112 HydrophobicContact CD2-CE3 4.13Å; F109-W112 WeakPolarHBondContact O-CB 3.45Å; F109-W112 PolarHBondContact O-N 2.93Å; F109-W112 VanDerWaalsContact O-N 3.15Å; F109-I113 HydrophobicContact CD1-CG1 4.22Å; F109-I113 HydrophobicContact CE1-CD1 4.05Å; F109-I113 HydrophobicContact CE1-CG1 3.9Å; F109-I113 HydrophobicContact CE2-CD1 4.37Å; F109-I113 HydrophobicContact CZ-CD1 3.85Å; F109-I113 HydrophobicContact CZ-CG1 4.21Å; F109-I113 WeakPolarHBondContact O-CG1 3.26Å; F109-I113 PolarHBondContact O-N 2.87Å; F109-V152 HydrophobicContact CE1-CG1 4.23Å; F109-V152 HydrophobicContact CZ-CG1 4.22Å; F109-T155 HydrophobicContact CD2-CG2 4.21Å; F109-T155 HydrophobicContact CE2-CG2 3.6Å; F109-T155 HydrophobicContact CZ-CG2 4.32Å; F109-L156 HydrophobicContact CE2-CD2 3.77Å; F109-L156 HydrophobicContact CE2-CG 4.1Å; F109-L156 HydrophobicContact CZ-CD2 3.74Å; F109-L156 HydrophobicContact CZ-CG 3.75Å; F109-L159 HydrophobicContact CD2-CD1 4.43Å; F109-L159 HydrophobicContact CE2-CD1 4.39Å |
| 110 | I | 98.4 | Very high | 97.5 | Very high | 82 Ų | 82 | 44.8 Ų | 44.8 | 42% | 0.421 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.6 | -43.4 | 175.5 | -68.4 | 165.2 | 0 | 0 | 0 | 111.3 | V106 L107 Q108 W112 I113 L114 | V106-I110 HydrophobicContact CG1-CD1 4.08Å; V106-I110 VanDerWaalsContact O-CG1 3.31Å; V106-I110 WeakPolarHBondContact O-CG1 3.35Å; V106-I110 PolarHBondContact O-N 3.09Å; L107-I110 PolarHBondContact O-N 3.43Å; Q108-I110 PolarHBondContact O-N 3.31Å; I110-W112 VanDerWaalsContact C-N 3.32Å; I110-W112 PolarHBondContact O-N 3.45Å; I110-I113 PolarHBondContact O-N 3.34Å; I110-L114 HydrophobicContact CG2-CD1 3.96Å; I110-L114 HydrophobicContact CG2-CG 4.39Å; I110-L114 WeakPolarHBondContact O-CG 3.35Å; I110-L114 PolarHBondContact O-N 3.36Å |
| 111 | D | 98.5 | Very high | 97.7 | Very high | 11 Ų | 11 | 44.2 Ų | 44.2 | 6% | 0.059 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.4 | -43.1 | 174.6 | 173.5 | 77.2 | 0 | 0 | 0 | 111.7 | L100 L107 Q108 F109 I113 L114 R115 P126 | L100-D111 HydrophobicContact CD1-CB 3.56Å; L100-D111 VanDerWaalsContact CD1-CG 3.49Å; L107-D111 PolarHBondContact O-N 3.03Å; Q108-D111 WeakPolarHBondContact O-CB 3.42Å; Q108-D111 PolarHBondContact O-N 3.07Å; F109-D111 VanDerWaalsContact C-N 3.34Å; F109-D111 PolarHBondContact O-N 2.98Å; D111-I113 PolarHBondContact O-N 3.41Å; D111-L114 PolarHBondContact O-N 3.07Å; D111-R115 WeakPolarHBondContact O-CB 3.49Å; D111-R115 VanDerWaalsContact O-CG 3.28Å; D111-R115 WeakPolarHBondContact O-CG 3.45Å; D111-R115 PolarHBondContact O-N 2.88Å; D111-R115 IonicContact OD1-CZ 2.72Å; D111-R115 IonicContact OD1-NE 3.71Å; D111-R115 PolarHBondContact OD1-NE 3.5Å; D111-R115 IonicContact OD1-NH2 3.74Å; D111-R115 WeakPolarHBondContact OD2-CD 3.37Å; D111-R115 IonicContact OD2-CZ 2.72Å; D111-R115 IonicContact OD2-NE 2.79Å; D111-R115 PolarHBondContact OD2-NE 3.09Å; D111-P126 WeakPolarHBondContact OD1-CG 3.47Å |
| 112 | W | 98.6 | Very high | 97.9 | Very high | 31 Ų | 31 | 39 Ų | 39 | 12% | 0.117 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.8 | -38 | 177.9 | -54.5 | -10.1 | 0 | 0 | 0 | 112.4 | Q108 F109 I110 G116 T155 L159 T168 A169 | Q108-W112 HydrophobicContact CB-CZ2 4.04Å; Q108-W112 PolarHBondContact O-N 3.3Å; Q108-W112 PolarHBondContact O-NE1 3.11Å; F109-W112 HydrophobicContact CD2-CE3 4.13Å; F109-W112 WeakPolarHBondContact O-CB 3.45Å; F109-W112 PolarHBondContact O-N 2.93Å; F109-W112 VanDerWaalsContact O-N 3.15Å; I110-W112 VanDerWaalsContact C-N 3.32Å; I110-W112 PolarHBondContact O-N 3.45Å; W112-G116 PolarHBondContact O-N 3.17Å; W112-T155 HydrophobicContact CB-CG2 4.41Å; W112-T155 HydrophobicContact CE3-CG2 4.32Å; W112-L159 HydrophobicContact CZ3-CD1 4.01Å; W112-L159 HydrophobicContact CZ3-CD2 3.96Å; W112-T168 HydrophobicContact CE3-CG2 4.02Å; W112-T168 HydrophobicContact CZ3-CG2 4.43Å; W112-A169 VanDerWaalsContact CD1-CA 3.41Å; W112-A169 HydrophobicContact CD2-CB 4.49Å; W112-A169 HydrophobicContact CG-CB 4.49Å; W112-A169 HydrophobicContact CZ2-CB 4.4Å |
| 113 | I | 98.8 | Very high | 98.2 | Very high | 6 Ų | 6 | 32.3 Ų | 32.3 | 3% | 0.031 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64.2 | -48.5 | 174.7 | -62.4 | -49 | 0 | 0 | 0 | 110.8 | F109 I110 D111 R115 G116 I117 T151 V152 T155 | F109-I113 HydrophobicContact CD1-CG1 4.22Å; F109-I113 HydrophobicContact CE1-CD1 4.05Å; F109-I113 HydrophobicContact CE1-CG1 3.9Å; F109-I113 HydrophobicContact CE2-CD1 4.37Å; F109-I113 HydrophobicContact CZ-CD1 3.85Å; F109-I113 HydrophobicContact CZ-CG1 4.21Å; F109-I113 WeakPolarHBondContact O-CG1 3.26Å; F109-I113 PolarHBondContact O-N 2.87Å; I110-I113 PolarHBondContact O-N 3.34Å; D111-I113 PolarHBondContact O-N 3.41Å; I113-R115 PolarHBondContact O-N 3.04Å; I113-G116 CarbonylContact O-C 3.58Å; I113-G116 WeakPolarHBondContact O-CA 3.46Å; I113-G116 PolarHBondContact O-N 3.48Å; I113-G116 VanDerWaalsContact O-N 3.08Å; I113-I117 HydrophobicContact CG2-CD1 4.3Å; I113-I117 WeakPolarHBondContact O-CG1 3.29Å; I113-I117 PolarHBondContact O-N 3.26Å; I113-T151 HydrophobicContact CB-CG2 4.47Å; I113-T151 HydrophobicContact CD1-CG2 4.09Å; I113-T151 HydrophobicContact CG2-CG2 3.92Å; I113-V152 HydrophobicContact CD1-CB 4.42Å; I113-V152 HydrophobicContact CD1-CG2 4.02Å; I113-V152 HydrophobicContact CG1-CG2 4.1Å; I113-V152 HydrophobicContact CG2-CG2 4.36Å; I113-T155 HydrophobicContact CD1-CG2 4.04Å; I113-T155 VanDerWaalsContact CD1-OG1 3.3Å; I113-T155 WeakPolarHBondContact CD1-OG1 3.22Å |
| 114 | L | 98.8 | Very high | 98.3 | Very high | 25 Ų | 25 | 30.6 Ų | 30.6 | 13% | 0.131 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65 | -41.7 | -178.8 | -67.2 | 172.3 | 0 | 0 | 0 | 111.9 | I110 D111 G116 I117 S118 P126 G129 I130 | I110-L114 HydrophobicContact CG2-CD1 3.96Å; I110-L114 HydrophobicContact CG2-CG 4.39Å; I110-L114 WeakPolarHBondContact O-CG 3.35Å; I110-L114 PolarHBondContact O-N 3.36Å; D111-L114 PolarHBondContact O-N 3.07Å; L114-G116 VanDerWaalsContact C-N 3.29Å; L114-G116 PolarHBondContact O-N 3.43Å; L114-I117 PolarHBondContact O-N 3.23Å; L114-S118 PolarHBondContact O-N 2.86Å; L114-S118 VanDerWaalsContact O-N 3.11Å; L114-P126 HydrophobicContact CB-CB 3.79Å; L114-P126 HydrophobicContact CD1-CB 4.19Å; L114-G129 WeakPolarHBondContact O-CA 3.37Å; L114-I130 HydrophobicContact CD1-CD1 4Å; L114-I130 HydrophobicContact CD1-CG1 3.76Å; L114-I130 HydrophobicContact CD2-CG1 3.74Å; L114-I130 HydrophobicContact CG-CG1 4.34Å |
| 115 | R | 98.8 | Very high | 98.4 | Very high | 4 Ų | 4 | 26.5 Ų | 26.5 | 2% | 0.015 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -61.4 | -39.9 | 170.3 | -70.7 | 170.8 | -177.7 | -79.3 | -5.8 | 111.2 | D92 M93 D111 I113 I117 S118 Q119 N124 P126 A169 | D92-R115 PolarHBondContact O-NH1 3.15Å; D92-R115 PolarHBondContact O-NH2 3.48Å; M93-R115 PolarHBondContact O-NH2 3.37Å; D111-R115 WeakPolarHBondContact O-CB 3.49Å; D111-R115 VanDerWaalsContact O-CG 3.28Å; D111-R115 WeakPolarHBondContact O-CG 3.45Å; D111-R115 PolarHBondContact O-N 2.88Å; D111-R115 IonicContact OD1-CZ 2.72Å; D111-R115 IonicContact OD1-NE 3.71Å; D111-R115 PolarHBondContact OD1-NE 3.5Å; D111-R115 IonicContact OD1-NH2 3.74Å; D111-R115 WeakPolarHBondContact OD2-CD 3.37Å; D111-R115 IonicContact OD2-CZ 2.72Å; D111-R115 IonicContact OD2-NE 2.79Å; D111-R115 PolarHBondContact OD2-NE 3.09Å; I113-R115 PolarHBondContact O-N 3.04Å; R115-I117 VanDerWaalsContact C-N 3.33Å; R115-I117 PolarHBondContact O-N 2.89Å; R115-S118 WeakPolarHBondContact CA-OG 3.49Å; R115-S118 PolarHBondContact O-N 3.24Å; R115-S118 PolarHBondContact O-OG 2.86Å; R115-Q119 WeakPolarHBondContact O-CB 3.25Å; R115-Q119 WeakPolarHBondContact O-CG 3.49Å; R115-Q119 PolarHBondContact O-N 2.85Å; R115-N124 VanDerWaalsContact CD-OD1 3.3Å; R115-N124 WeakPolarHBondContact CD-OD1 3.41Å; R115-N124 WeakPolarHBondContact CG-OD1 3.37Å; R115-N124 PolarHBondContact NH1-O 3.44Å; R115-N124 PolarHBondContact NH1-OD1 2.94Å; R115-P126 HydrophobicContact CG-CB 4.37Å; R115-A169 WeakPolarHBondContact CD-O 3.36Å |
| 116 | G | 98.8 | Very high | 98.5 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -58.8 | -42.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | W112 I113 L114 Q119 G171 Y175 | W112-G116 PolarHBondContact O-N 3.17Å; I113-G116 CarbonylContact O-C 3.58Å; I113-G116 WeakPolarHBondContact O-CA 3.46Å; I113-G116 PolarHBondContact O-N 3.48Å; I113-G116 VanDerWaalsContact O-N 3.08Å; L114-G116 VanDerWaalsContact C-N 3.29Å; L114-G116 PolarHBondContact O-N 3.43Å; G116-Q119 PolarHBondContact O-N 3.3Å; G116-G171 WeakPolarHBondContact CA-O 3.3Å; G116-Y175 WeakPolarHBondContact O-CA 3.49Å; G116-Y175 WeakPolarHBondContact O-CB 3.34Å; G116-Y175 PolarHBondContact O-N 3.26Å |
| 117 | I | 98.9 | Very high | 98.5 | Very high | 1 Ų | 1 | 22 Ų | 22 | 1% | 0.005 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -63.3 | -47 | 175.2 | -66.8 | 167.1 | 0 | 0 | 0 | 110.3 | I113 L114 R115 Q119 V120 I132 L133 T151 T178 Y285 | I113-I117 HydrophobicContact CG2-CD1 4.3Å; I113-I117 WeakPolarHBondContact O-CG1 3.29Å; I113-I117 PolarHBondContact O-N 3.26Å; L114-I117 PolarHBondContact O-N 3.23Å; R115-I117 VanDerWaalsContact C-N 3.33Å; R115-I117 PolarHBondContact O-N 2.89Å; I117-Q119 VanDerWaalsContact C-N 3.3Å; I117-Q119 PolarHBondContact O-N 2.93Å; I117-V120 PolarHBondContact O-N 3.35Å; I117-I132 HydrophobicContact CG2-CB 4Å; I117-I132 HydrophobicContact CG2-CG2 3.53Å; I117-L133 HydrophobicContact CD1-CD1 4.42Å; I117-T151 HydrophobicContact CG1-CG2 4.31Å; I117-T178 HydrophobicContact CG1-CG2 4.16Å; I117-Y285 PolarHBondContact O-OH 3.42Å |
| 118 | S | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -69.5 | -25.3 | -178.4 | 65.8 | 0 | 0 | 0 | 0 | 114.2 | L114 R115 V120 V121 V123 N125 | L114-S118 PolarHBondContact O-N 2.86Å; L114-S118 VanDerWaalsContact O-N 3.11Å; R115-S118 WeakPolarHBondContact CA-OG 3.49Å; R115-S118 PolarHBondContact O-N 3.24Å; R115-S118 PolarHBondContact O-OG 2.86Å; S118-V120 PolarHBondContact O-N 2.96Å; S118-V121 WeakPolarHBondContact O-CG2 3.41Å; S118-V121 PolarHBondContact O-N 3.48Å; S118-V123 CarbonylContact C-O 3.57Å; S118-V123 VanDerWaalsContact CB-O 3.3Å; S118-V123 WeakPolarHBondContact CB-O 3.46Å; S118-V123 PolarHBondContact O-N 2.8Å; S118-V123 PolarHBondContact OG-O 2.97Å; S118-N125 PolarHBondContact OG-N 2.89Å; S118-N125 PolarHBondContact OG-O 3.01Å |
| 119 | Q | 98.8 | Very high | 98.7 | Very high | 19 Ų | 19 | 16 Ų | 16 | 9% | 0.089 | 8% | 0.078 | C | C | . | . | G | 310 helix | trans | -67.3 | -14.4 | -178.4 | -82 | -73.7 | 18.6 | 0 | 0 | 113.8 | R115 G116 I117 V121 F122 V123 S170 L172 Y175 | R115-Q119 WeakPolarHBondContact O-CB 3.25Å; R115-Q119 WeakPolarHBondContact O-CG 3.49Å; R115-Q119 PolarHBondContact O-N 2.85Å; G116-Q119 PolarHBondContact O-N 3.3Å; I117-Q119 VanDerWaalsContact C-N 3.3Å; I117-Q119 PolarHBondContact O-N 2.93Å; Q119-V121 PolarHBondContact O-N 3.26Å; Q119-F122 PolarHBondContact O-N 2.99Å; Q119-V123 WeakPolarHBondContact CA-O 3.17Å; Q119-V123 PolarHBondContact N-O 2.71Å; Q119-V123 VanDerWaalsContact N-O 3.09Å; Q119-S170 VanDerWaalsContact CG-O 3.29Å; Q119-S170 WeakPolarHBondContact CG-O 3.34Å; Q119-S170 PolarHBondContact NE2-O 3.18Å; Q119-L172 HydrophobicContact CG-CD2 4.42Å; Q119-Y175 HydrophobicContact CB-CD1 3.83Å; Q119-Y175 HydrophobicContact CB-CG 4.01Å |
| 120 | V | 98.8 | Very high | 98.7 | Very high | 1 Ų | 1 | 17.4 Ų | 17.4 | 1% | 0.006 | 9% | 0.087 | C | C | . | . | G | 310 helix | trans | -56.3 | -32.9 | 171.6 | 168 | 0 | 0 | 0 | 0 | 111.2 | I117 S118 Y175 T178 L179 I284 Y285 | I117-V120 PolarHBondContact O-N 3.35Å; S118-V120 PolarHBondContact O-N 2.96Å; V120-Y175 WeakPolarHBondContact CG2-O 3.48Å; V120-T178 HydrophobicContact CG2-CG2 4.48Å; V120-L179 HydrophobicContact CG1-CD1 4.07Å; V120-L179 HydrophobicContact CG1-CD2 3.72Å; V120-L179 HydrophobicContact CG1-CG 4Å; V120-L179 HydrophobicContact CG2-CD1 4.42Å; V120-L179 HydrophobicContact CG2-CD2 4.29Å; V120-L179 HydrophobicContact CG2-CG 3.92Å; V120-I284 HydrophobicContact CG1-CG2 3.69Å; V120-Y285 HydrophobicContact CB-CE1 3.6Å; V120-Y285 HydrophobicContact CB-CE2 4.38Å; V120-Y285 WeakPolarHBondContact CB-OH 3.25Å; V120-Y285 HydrophobicContact CG1-CD1 4.11Å; V120-Y285 HydrophobicContact CG1-CD2 4.39Å; V120-Y285 HydrophobicContact CG1-CE1 3.59Å; V120-Y285 HydrophobicContact CG1-CE2 3.91Å; V120-Y285 HydrophobicContact CG1-CG 4.48Å; V120-Y285 VanDerWaalsContact CG1-CZ 3.49Å; V120-Y285 HydrophobicContact CG2-CD1 4.45Å; V120-Y285 HydrophobicContact CG2-CE1 3.66Å |
| 121 | V | 98.7 | Very high | 98.7 | Very high | 2 Ų | 2 | 16.5 Ų | 16.5 | 1% | 0.012 | 8% | 0.082 | C | C | . | . | G | 310 helix | trans | -106.1 | 24.8 | 175.6 | -66.5 | 0 | 0 | 0 | 0 | 112.5 | S118 Q119 V123 I132 I284 Y285 I300 M307 L343 | S118-V121 WeakPolarHBondContact O-CG2 3.41Å; S118-V121 PolarHBondContact O-N 3.48Å; Q119-V121 PolarHBondContact O-N 3.26Å; V121-V123 HydrophobicContact CG2-CB 4.27Å; V121-V123 HydrophobicContact CG2-CG2 4.01Å; V121-V123 PolarHBondContact O-N 3.39Å; V121-I132 HydrophobicContact CG2-CD1 4.26Å; V121-I284 HydrophobicContact CG1-CD1 4.03Å; V121-I284 HydrophobicContact CG1-CG2 3.87Å; V121-Y285 HydrophobicContact CG1-CE2 3.97Å; V121-I300 HydrophobicContact CB-CD1 4.14Å; V121-I300 HydrophobicContact CB-CG1 4.29Å; V121-I300 HydrophobicContact CG1-CD1 4.22Å; V121-I300 HydrophobicContact CG2-CD1 4.19Å; V121-I300 HydrophobicContact CG2-CG1 3.83Å; V121-M307 WeakPolarHBondContact O-CE 3.38Å; V121-L343 HydrophobicContact CG1-CD2 4.47Å |
| 122 | F | 98.7 | Very high | 98.7 | Very high | 19 Ų | 19 | 16 Ų | 16 | 8% | 0.083 | 8% | 0.08 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 63.6 | 15.5 | -178.3 | -38.2 | -70.4 | 0 | 0 | 0 | 115.4 | Q119 F227 M307 L343 I346 A347 M351 F352 F393 | Q119-F122 PolarHBondContact O-N 2.99Å; F122-F227 AromaticContact CE1-CD1 3.83Å; F122-F227 HydrophobicContact CE1-CD1 3.83Å; F122-F227 HydrophobicContact CE1-CE1 4.09Å; F122-F227 HydrophobicContact CZ-CD1 4.42Å; F122-M307 HydrophobicContact CB-CE 3.91Å; F122-L343 HydrophobicContact CE2-CD2 3.92Å; F122-L343 HydrophobicContact CZ-CD2 4.13Å; F122-I346 HydrophobicContact CD2-CB 4.19Å; F122-I346 HydrophobicContact CD2-CG2 3.7Å; F122-I346 HydrophobicContact CE2-CB 4.26Å; F122-I346 HydrophobicContact CE2-CG2 4.27Å; F122-A347 HydrophobicContact CE2-CB 4.06Å; F122-A347 HydrophobicContact CZ-CB 4.18Å; F122-M351 HydrophobicContact CB-CG 4.06Å; F122-M351 HydrophobicContact CB-SD 4.29Å; F122-M351 HydrophobicContact CG-CG 4.43Å; F122-F352 AromaticContact CD1-CE2 3.9Å; F122-F352 HydrophobicContact CD1-CE2 3.9Å; F122-F352 HydrophobicContact CD1-CZ 4.21Å; F122-F352 HydrophobicContact CE1-CE2 4.2Å; F122-F352 HydrophobicContact CG-CE2 4.28Å; F122-F393 AromaticContact CE1-CZ 3.97Å; F122-F393 HydrophobicContact CE1-CZ 3.97Å; F122-F393 HydrophobicContact CE2-CZ 4.49Å; F122-F393 HydrophobicContact CZ-CE1 4.21Å; F122-F393 AromaticContact CZ-CE2 3.84Å; F122-F393 HydrophobicContact CZ-CE2 3.84Å; F122-F393 AromaticContact CZ-CZ 3.4Å; F122-F393 HydrophobicContact CZ-CZ 3.4Å |
| 123 | V | 98.7 | Very high | 98.7 | Very high | 1 Ų | 1 | 16.4 Ų | 16.4 | 1% | 0.006 | 8% | 0.084 | C | C | . | . | trans | -92.4 | 128.5 | -179.9 | 170.6 | 0 | 0 | 0 | 0 | 109.6 | S118 Q119 V121 N125 M307 | S118-V123 CarbonylContact C-O 3.57Å; S118-V123 VanDerWaalsContact CB-O 3.3Å; S118-V123 WeakPolarHBondContact CB-O 3.46Å; S118-V123 PolarHBondContact O-N 2.8Å; S118-V123 PolarHBondContact OG-O 2.97Å; Q119-V123 WeakPolarHBondContact CA-O 3.17Å; Q119-V123 PolarHBondContact N-O 2.71Å; Q119-V123 VanDerWaalsContact N-O 3.09Å; V121-V123 HydrophobicContact CG2-CB 4.27Å; V121-V123 HydrophobicContact CG2-CG2 4.01Å; V121-V123 PolarHBondContact O-N 3.39Å; V123-N125 HydrophobicContact CG1-CB 3.52Å; V123-M307 HydrophobicContact CG2-CE 3.66Å; V123-M307 HydrophobicContact CG2-SD 4.19Å | ||
| 124 | N | 98.5 | Very high | 98.7 | Very high | 27 Ų | 27 | 19.5 Ų | 19.5 | 14% | 0.144 | 10% | 0.103 | C | C | . | . | trans | -102.9 | 63.3 | 174.3 | -174.2 | 11 | 0 | 0 | 0 | 111.1 | D92 R115 S170 | D92-N124 CarbonylContact C-O 3.31Å; D92-N124 VanDerWaalsContact C-O 3.31Å; D92-N124 WeakPolarHBondContact CA-O 3.38Å; D92-N124 HydrophobicContact CB-CB 4.36Å; R115-N124 VanDerWaalsContact CD-OD1 3.3Å; R115-N124 WeakPolarHBondContact CD-OD1 3.41Å; R115-N124 WeakPolarHBondContact CG-OD1 3.37Å; R115-N124 PolarHBondContact NH1-O 3.44Å; R115-N124 PolarHBondContact NH1-OD1 2.94Å; N124-S170 PolarHBondContact OD1-O 3.18Å | ||
| 125 | N | 98.7 | Very high | 98.7 | Very high | 0 Ų | 0 | 18.3 Ų | 18.3 | 0% | 0 | 10% | 0.097 | C | C | . | . | trans | -141.4 | 116.4 | -172.4 | -175.6 | -49.1 | 0 | 0 | 0 | 111 | V89 G91 M93 S118 V123 I127 S128 G129 | V89-N125 PolarHBondContact O-ND2 3.28Å; G91-N125 PolarHBondContact O-ND2 3.16Å; M93-N125 WeakPolarHBondContact CG-ND2 3.29Å; M93-N125 VanDerWaalsContact SD-CG 3.57Å; M93-N125 PolarHBondContact SD-OD1 2.92Å; S118-N125 PolarHBondContact OG-N 2.89Å; S118-N125 PolarHBondContact OG-O 3.01Å; V123-N125 HydrophobicContact CG1-CB 3.52Å; N125-I127 VanDerWaalsContact C-N 3.31Å; N125-I127 PolarHBondContact O-N 3.37Å; N125-I127 WeakPolarHBondContact OD1-CA 3.44Å; N125-I127 WeakPolarHBondContact OD1-CB 3.21Å; N125-I127 PolarHBondContact OD1-N 2.72Å; N125-S128 WeakPolarHBondContact O-CB 3.28Å; N125-S128 PolarHBondContact O-N 2.79Å; N125-S128 PolarHBondContact OD1-N 3.18Å; N125-G129 PolarHBondContact O-N 3.19Å | ||
| 126 | P | 98.5 | Very high | 98.7 | Very high | 4 Ų | 4 | 18.2 Ų | 18.2 | 3% | 0.026 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66.3 | -29.5 | -176.9 | 27.7 | -36.7 | 0 | 0 | 0 | 113.2 | M93 L96 D111 L114 R115 G129 I130 | M93-P126 HydrophobicContact CE-CG 4.48Å; M93-P126 HydrophobicContact SD-CG 3.9Å; L96-P126 HydrophobicContact CD2-CG 3.74Å; D111-P126 WeakPolarHBondContact OD1-CG 3.47Å; L114-P126 HydrophobicContact CB-CB 3.79Å; L114-P126 HydrophobicContact CD1-CB 4.19Å; R115-P126 HydrophobicContact CG-CB 4.37Å; P126-G129 WeakPolarHBondContact O-CA 3.35Å; P126-G129 PolarHBondContact O-N 3.29Å; P126-I130 WeakPolarHBondContact O-CG1 3.47Å; P126-I130 PolarHBondContact O-N 3.29Å |
| 127 | I | 98.5 | Very high | 98.7 | Very high | 59 Ų | 59 | 22.5 Ų | 22.5 | 30% | 0.303 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -72 | -41 | 177 | -53.6 | -59 | 0 | 0 | 0 | 110.4 | M93 N125 G129 I130 L131 L302 | M93-I127 HydrophobicContact CE-CG1 3.8Å; M93-I127 HydrophobicContact SD-CB 4.34Å; M93-I127 HydrophobicContact SD-CG1 3.67Å; N125-I127 VanDerWaalsContact C-N 3.31Å; N125-I127 PolarHBondContact O-N 3.37Å; N125-I127 WeakPolarHBondContact OD1-CA 3.44Å; N125-I127 WeakPolarHBondContact OD1-CB 3.21Å; N125-I127 PolarHBondContact OD1-N 2.72Å; I127-G129 PolarHBondContact O-N 3.46Å; I127-I130 HydrophobicContact CD1-CD1 4.16Å; I127-I130 PolarHBondContact O-N 3.39Å; I127-L131 WeakPolarHBondContact O-CG 3.44Å; I127-L131 PolarHBondContact O-N 3.43Å; I127-L302 HydrophobicContact CB-CD2 3.97Å; I127-L302 HydrophobicContact CG2-CD2 3.53Å |
| 128 | S | 98.7 | Very high | 98.6 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -57.8 | -40.2 | 168.5 | -59.4 | 0 | 0 | 0 | 0 | 111 | N125 I130 L131 I132 A299 | N125-S128 WeakPolarHBondContact O-CB 3.28Å; N125-S128 PolarHBondContact O-N 2.79Å; N125-S128 PolarHBondContact OD1-N 3.18Å; S128-I130 PolarHBondContact O-N 2.83Å; S128-L131 PolarHBondContact O-N 2.82Å; S128-I132 WeakPolarHBondContact O-CD1 3.45Å; S128-I132 VanDerWaalsContact O-CG1 3.29Å; S128-I132 WeakPolarHBondContact O-CG1 3.49Å; S128-I132 PolarHBondContact O-N 2.87Å; S128-A299 WeakPolarHBondContact CB-O 3.34Å; S128-A299 PolarHBondContact OG-O 2.84Å |
| 129 | G | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -58.9 | -42.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | L114 N125 P126 I127 I132 L133 | L114-G129 WeakPolarHBondContact O-CA 3.37Å; N125-G129 PolarHBondContact O-N 3.19Å; P126-G129 WeakPolarHBondContact O-CA 3.35Å; P126-G129 PolarHBondContact O-N 3.29Å; I127-G129 PolarHBondContact O-N 3.46Å; G129-I132 PolarHBondContact O-N 3.16Å; G129-L133 WeakPolarHBondContact O-CB 3.48Å; G129-L133 PolarHBondContact O-N 2.95Å |
| 130 | I | 98.8 | Very high | 98.6 | Very high | 73 Ų | 73 | 29.9 Ų | 29.9 | 37% | 0.374 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -62.6 | -46.7 | 174.1 | -66.9 | 168.1 | 0 | 0 | 0 | 110.7 | L114 P126 I127 S128 I132 L133 V134 | L114-I130 HydrophobicContact CD1-CD1 4Å; L114-I130 HydrophobicContact CD1-CG1 3.76Å; L114-I130 HydrophobicContact CD2-CG1 3.74Å; L114-I130 HydrophobicContact CG-CG1 4.34Å; P126-I130 WeakPolarHBondContact O-CG1 3.47Å; P126-I130 PolarHBondContact O-N 3.29Å; I127-I130 HydrophobicContact CD1-CD1 4.16Å; I127-I130 PolarHBondContact O-N 3.39Å; S128-I130 PolarHBondContact O-N 2.83Å; I130-I132 VanDerWaalsContact C-N 3.32Å; I130-I132 PolarHBondContact O-N 3.07Å; I130-L133 WeakPolarHBondContact O-CB 3.35Å; I130-L133 PolarHBondContact O-N 2.95Å; I130-L133 VanDerWaalsContact O-N 3.15Å; I130-V134 WeakPolarHBondContact O-CG2 3.46Å; I130-V134 PolarHBondContact O-N 3.37Å |
| 131 | L | 98.8 | Very high | 98.6 | Very high | 63 Ų | 63 | 32.9 Ų | 32.9 | 33% | 0.33 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -62 | -40.8 | 179 | -68.6 | 175.5 | 0 | 0 | 0 | 111.7 | I127 S128 V134 G135 I295 A299 L302 | I127-L131 WeakPolarHBondContact O-CG 3.44Å; I127-L131 PolarHBondContact O-N 3.43Å; S128-L131 PolarHBondContact O-N 2.82Å; L131-V134 PolarHBondContact O-N 3.1Å; L131-G135 PolarHBondContact O-N 3.37Å; L131-I295 WeakPolarHBondContact O-CG2 3.44Å; L131-A299 HydrophobicContact CB-CB 3.71Å; L131-A299 HydrophobicContact CD1-CB 4.22Å; L131-L302 HydrophobicContact CD1-CD2 3.92Å |
| 132 | I | 98.9 | Very high | 98.6 | Very high | 1 Ų | 1 | 32.8 Ų | 32.8 | 1% | 0.005 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.9 | -44.1 | 173.5 | -70 | 157.2 | 0 | 0 | 0 | 110.3 | I117 V121 S128 G129 I130 V134 G135 L136 Y285 F296 A299 | I117-I132 HydrophobicContact CG2-CB 4Å; I117-I132 HydrophobicContact CG2-CG2 3.53Å; V121-I132 HydrophobicContact CG2-CD1 4.26Å; S128-I132 WeakPolarHBondContact O-CD1 3.45Å; S128-I132 VanDerWaalsContact O-CG1 3.29Å; S128-I132 WeakPolarHBondContact O-CG1 3.49Å; S128-I132 PolarHBondContact O-N 2.87Å; G129-I132 PolarHBondContact O-N 3.16Å; I130-I132 VanDerWaalsContact C-N 3.32Å; I130-I132 PolarHBondContact O-N 3.07Å; I132-V134 VanDerWaalsContact C-N 3.3Å; I132-V134 PolarHBondContact O-N 3.38Å; I132-G135 PolarHBondContact O-N 2.65Å; I132-G135 VanDerWaalsContact O-N 3.11Å; I132-L136 HydrophobicContact CG2-CD1 4.22Å; I132-L136 HydrophobicContact CG2-CG 4.45Å; I132-L136 WeakPolarHBondContact O-CG 3.42Å; I132-L136 PolarHBondContact O-N 2.94Å; I132-Y285 WeakPolarHBondContact CD1-OH 3.49Å; I132-Y285 HydrophobicContact CG2-CD1 4.43Å; I132-Y285 HydrophobicContact CG2-CE1 3.77Å; I132-Y285 HydrophobicContact CG2-CE2 4.16Å; I132-F296 HydrophobicContact CB-CD1 4.29Å; I132-F296 HydrophobicContact CB-CE1 4.26Å; I132-F296 HydrophobicContact CG1-CD1 4.04Å; I132-F296 HydrophobicContact CG1-CE1 4.48Å; I132-F296 HydrophobicContact CG2-CD1 4.26Å; I132-F296 HydrophobicContact CG2-CE1 3.88Å; I132-F296 HydrophobicContact CG2-CZ 4.38Å; I132-F296 WeakPolarHBondContact O-CE1 3.3Å; I132-A299 HydrophobicContact CD1-CB 4.21Å; I132-A299 HydrophobicContact CG1-CB 3.79Å |
| 133 | L | 98.8 | Very high | 98.6 | Very high | 39 Ų | 39 | 33.3 Ų | 33.3 | 20% | 0.204 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.5 | -38.3 | 176.4 | -172.4 | 62.6 | 0 | 0 | 0 | 112.2 | I117 G129 I130 L136 L137 A144 | I117-L133 HydrophobicContact CD1-CD1 4.42Å; G129-L133 WeakPolarHBondContact O-CB 3.48Å; G129-L133 PolarHBondContact O-N 2.95Å; I130-L133 WeakPolarHBondContact O-CB 3.35Å; I130-L133 PolarHBondContact O-N 2.95Å; I130-L133 VanDerWaalsContact O-N 3.15Å; L133-L136 PolarHBondContact O-N 3.16Å; L133-L137 WeakPolarHBondContact O-CG 3.34Å; L133-L137 PolarHBondContact O-N 3.24Å; L133-A144 HydrophobicContact CD1-CB 4.3Å |
| 134 | V | 98.6 | Very high | 98.6 | Very high | 72 Ų | 72 | 33.4 Ų | 33.4 | 44% | 0.436 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -62.9 | -43.4 | 172.4 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | I130 L131 I132 L136 L137 F138 | I130-V134 WeakPolarHBondContact O-CG2 3.46Å; I130-V134 PolarHBondContact O-N 3.37Å; L131-V134 PolarHBondContact O-N 3.1Å; I132-V134 VanDerWaalsContact C-N 3.3Å; I132-V134 PolarHBondContact O-N 3.38Å; V134-L136 VanDerWaalsContact C-N 3.32Å; V134-L136 PolarHBondContact O-N 3.36Å; V134-L137 PolarHBondContact O-N 3.46Å; V134-F138 WeakPolarHBondContact O-CB 3.44Å; V134-F138 PolarHBondContact O-N 2.91Å |
| 135 | G | 98.6 | Very high | 98.6 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61.7 | -39.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L131 I132 F138 Q139 T292 | L131-G135 PolarHBondContact O-N 3.37Å; I132-G135 PolarHBondContact O-N 2.65Å; I132-G135 VanDerWaalsContact O-N 3.11Å; G135-F138 PolarHBondContact O-N 3.37Å; G135-Q139 PolarHBondContact O-N 3.32Å; G135-T292 WeakPolarHBondContact O-CG2 3.48Å; G135-T292 PolarHBondContact O-OG1 3.14Å |
| 136 | L | 98.8 | Very high | 98.6 | Very high | 2 Ų | 2 | 35 Ų | 35 | 1% | 0.01 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.5 | -42.2 | 174.2 | -69.2 | 171.9 | 0 | 0 | 0 | 111.8 | I132 L133 V134 F138 Q139 N140 A144 I182 Y285 F296 | I132-L136 HydrophobicContact CG2-CD1 4.22Å; I132-L136 HydrophobicContact CG2-CG 4.45Å; I132-L136 WeakPolarHBondContact O-CG 3.42Å; I132-L136 PolarHBondContact O-N 2.94Å; L133-L136 PolarHBondContact O-N 3.16Å; V134-L136 VanDerWaalsContact C-N 3.32Å; V134-L136 PolarHBondContact O-N 3.36Å; L136-F138 VanDerWaalsContact C-N 3.28Å; L136-F138 PolarHBondContact O-N 3.33Å; L136-Q139 WeakPolarHBondContact O-CB 3.45Å; L136-Q139 PolarHBondContact O-N 3.02Å; L136-N140 CarbonylContact O-C 3.47Å; L136-N140 PolarHBondContact O-N 3.29Å; L136-N140 VanDerWaalsContact O-O 3.08Å; L136-A144 HydrophobicContact CB-CB 3.81Å; L136-I182 HydrophobicContact CD1-CD1 3.89Å; L136-I182 HydrophobicContact CD2-CD1 3.83Å; L136-Y285 HydrophobicContact CD2-CD1 4.44Å; L136-Y285 HydrophobicContact CD2-CG 4.42Å; L136-F296 HydrophobicContact CD2-CZ 3.94Å; L136-F296 HydrophobicContact CG-CE1 4.45Å; L136-F296 HydrophobicContact CG-CZ 4.09Å |
| 137 | L | 98.6 | Very high | 98.6 | Very high | 89 Ų | 89 | 34.8 Ų | 34.8 | 47% | 0.466 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -62.9 | -36.5 | 174.4 | -73.6 | 166.7 | 0 | 0 | 0 | 111.8 | L133 V134 P141 A144 | L133-L137 WeakPolarHBondContact O-CG 3.34Å; L133-L137 PolarHBondContact O-N 3.24Å; V134-L137 PolarHBondContact O-N 3.46Å; L137-P141 HydrophobicContact CD2-CB 4.25Å; L137-P141 WeakPolarHBondContact O-CD 3.42Å; L137-A144 HydrophobicContact CD2-CB 3.74Å; L137-A144 HydrophobicContact CG-CB 3.92Å |
| 138 | F | 97.1 | Very high | 98.7 | Very high | 123 Ų | 123 | 37.2 Ų | 37.2 | 54% | 0.539 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -70.8 | -31.7 | 176.2 | -162.6 | -105.9 | 0 | 0 | 0 | 112.8 | V134 G135 L136 W291 | V134-F138 WeakPolarHBondContact O-CB 3.44Å; V134-F138 PolarHBondContact O-N 2.91Å; G135-F138 PolarHBondContact O-N 3.37Å; L136-F138 VanDerWaalsContact C-N 3.28Å; L136-F138 PolarHBondContact O-N 3.33Å; F138-W291 HydrophobicContact CD1-CB 4.1Å; F138-W291 HydrophobicContact CE1-CB 3.66Å; F138-W291 HydrophobicContact CE1-CG 4.15Å |
| 139 | Q | 98.4 | Very high | 98.7 | Very high | 34 Ų | 34 | 38.8 Ų | 38.8 | 16% | 0.159 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -70.6 | -62.8 | 172.2 | 173.2 | 68.1 | 48.6 | 0 | 0 | 110.7 | G135 L136 W143 C287 D288 T292 | G135-Q139 PolarHBondContact O-N 3.32Å; L136-Q139 WeakPolarHBondContact O-CB 3.45Å; L136-Q139 PolarHBondContact O-N 3.02Å; Q139-W143 HydrophobicContact CG-CE3 3.58Å; Q139-W143 HydrophobicContact CG-CH2 4.46Å; Q139-W143 HydrophobicContact CG-CZ3 3.49Å; Q139-W143 VanDerWaalsContact CG-CZ3 3.49Å; Q139-C287 HydrophobicContact CB-CB 4.31Å; Q139-C287 HydrophobicContact CG-CB 3.87Å; Q139-D288 PolarHBondContact NE2-OD1 3Å; Q139-D288 PolarHBondContact OE1-OD1 2.92Å; Q139-T292 HydrophobicContact CB-CG2 4.15Å |
| 140 | N | 98.7 | Very high | 98.7 | Very high | 18 Ų | 18 | 38.8 Ų | 38.8 | 10% | 0.096 | 19% | 0.194 | C | C | . | . | trans | -163.1 | 115.8 | -178.4 | -169.4 | -40.1 | 0 | 0 | 0 | 110.1 | L136 W142 W143 A144 D192 | L136-N140 CarbonylContact O-C 3.47Å; L136-N140 PolarHBondContact O-N 3.29Å; L136-N140 VanDerWaalsContact O-O 3.08Å; N140-W142 PolarHBondContact O-N 3.41Å; N140-W142 VanDerWaalsContact OD1-CB 3.23Å; N140-W142 WeakPolarHBondContact OD1-CB 3.39Å; N140-W142 PolarHBondContact OD1-N 2.95Å; N140-W143 HydrophobicContact CB-CB 4.15Å; N140-W143 HydrophobicContact CB-CD2 3.62Å; N140-W143 HydrophobicContact CB-CE3 4.05Å; N140-W143 HydrophobicContact CB-CG 3.68Å; N140-W143 PolarHBondContact ND2-NE1 3.36Å; N140-W143 PolarHBondContact O-N 3.45Å; N140-W143 VanDerWaalsContact O-N 3.07Å; N140-A144 PolarHBondContact O-N 2.83Å; N140-A144 VanDerWaalsContact O-N 3.07Å; N140-D192 VanDerWaalsContact ND2-CG 3.31Å; N140-D192 PolarHBondContact ND2-OD1 3.26Å; N140-D192 VanDerWaalsContact ND2-OD1 3.13Å; N140-D192 PolarHBondContact ND2-OD2 3.45Å | ||
| 141 | P | 98.7 | Very high | 98.7 | Very high | 64 Ų | 64 | 35.3 Ų | 35.3 | 42% | 0.416 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -59.1 | -29.5 | 178.6 | -25.6 | 34.7 | 0 | 0 | 0 | 114.7 | L137 A144 L145 | L137-P141 HydrophobicContact CD2-CB 4.25Å; L137-P141 WeakPolarHBondContact O-CD 3.42Å; P141-A144 PolarHBondContact O-N 3.16Å; P141-L145 WeakPolarHBondContact O-CB 3.31Å; P141-L145 PolarHBondContact O-N 3.01Å |
| 142 | W | 98.8 | Very high | 98.7 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -65.4 | -42.5 | 175.3 | 175.8 | -122.9 | 0 | 0 | 0 | 111.4 | N140 L145 T146 D192 Y193 F194 W195 L197 L198 | N140-W142 PolarHBondContact O-N 3.41Å; N140-W142 VanDerWaalsContact OD1-CB 3.23Å; N140-W142 WeakPolarHBondContact OD1-CB 3.39Å; N140-W142 PolarHBondContact OD1-N 2.95Å; W142-L145 HydrophobicContact CE3-CD2 3.95Å; W142-L145 HydrophobicContact CZ3-CD2 3.85Å; W142-L145 WeakPolarHBondContact O-CB 3.37Å; W142-L145 PolarHBondContact O-N 3.43Å; W142-T146 HydrophobicContact CD2-CG2 4.14Å; W142-T146 HydrophobicContact CE3-CG2 4.4Å; W142-T146 HydrophobicContact CH2-CG2 4.13Å; W142-T146 HydrophobicContact CZ2-CG2 3.86Å; W142-T146 HydrophobicContact CZ3-CG2 4.4Å; W142-T146 WeakPolarHBondContact O-CG2 3.37Å; W142-T146 PolarHBondContact O-N 3.06Å; W142-T146 PolarHBondContact O-OG1 3.16Å; W142-D192 HydrophobicContact CB-CB 4.22Å; W142-D192 HydrophobicContact CG-CB 4.26Å; W142-Y193 HydrophobicContact CB-CE1 4.32Å; W142-Y193 HydrophobicContact CD2-CD1 4.41Å; W142-Y193 AromaticContact CE3-CD1 3.77Å; W142-Y193 HydrophobicContact CE3-CD1 3.77Å; W142-Y193 HydrophobicContact CE3-CE1 4.28Å; W142-Y193 HydrophobicContact CE3-CG 4.37Å; W142-Y193 HydrophobicContact CZ3-CD1 4.38Å; W142-F194 WeakPolarHBondContact CZ2-O 3.4Å; W142-W195 HydrophobicContact CH2-CE3 4.24Å; W142-W195 HydrophobicContact CZ3-CD2 4.4Å; W142-W195 AromaticContact CZ3-CE3 3.91Å; W142-W195 HydrophobicContact CZ3-CE3 3.91Å; W142-W195 HydrophobicContact CZ3-CH2 4.3Å; W142-W195 AromaticContact CZ3-CZ3 3.86Å; W142-W195 HydrophobicContact CZ3-CZ3 3.86Å; W142-L197 HydrophobicContact CZ2-CB 4.18Å; W142-L197 HydrophobicContact CZ2-CD2 4.16Å; W142-L198 HydrophobicContact CH2-CD2 3.61Å; W142-L198 HydrophobicContact CH2-CG 4.07Å; W142-L198 HydrophobicContact CZ2-CD2 4.42Å; W142-L198 HydrophobicContact CZ3-CD2 4.06Å |
| 143 | W | 98.7 | Very high | 98.7 | Very high | 31 Ų | 31 | 34.2 Ų | 34.2 | 12% | 0.117 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -69.9 | -37.8 | 178.7 | -57.2 | 1.8 | 0 | 0 | 0 | 111.2 | Q139 N140 L145 T146 G147 I182 A185 V186 G286 | Q139-W143 HydrophobicContact CG-CE3 3.58Å; Q139-W143 HydrophobicContact CG-CH2 4.46Å; Q139-W143 HydrophobicContact CG-CZ3 3.49Å; Q139-W143 VanDerWaalsContact CG-CZ3 3.49Å; N140-W143 HydrophobicContact CB-CB 4.15Å; N140-W143 HydrophobicContact CB-CD2 3.62Å; N140-W143 HydrophobicContact CB-CE3 4.05Å; N140-W143 HydrophobicContact CB-CG 3.68Å; N140-W143 PolarHBondContact ND2-NE1 3.36Å; N140-W143 PolarHBondContact O-N 3.45Å; N140-W143 VanDerWaalsContact O-N 3.07Å; W143-L145 VanDerWaalsContact C-N 3.33Å; W143-L145 PolarHBondContact O-N 2.84Å; W143-T146 PolarHBondContact O-N 3.32Å; W143-T146 PolarHBondContact O-OG1 2.99Å; W143-G147 PolarHBondContact O-N 3.12Å; W143-I182 HydrophobicContact CB-CG2 4.23Å; W143-A185 HydrophobicContact CG-CB 4.47Å; W143-V186 HydrophobicContact CD2-CG2 3.81Å; W143-V186 HydrophobicContact CE3-CG2 3.79Å; W143-V186 HydrophobicContact CG-CG2 4.5Å; W143-V186 HydrophobicContact CH2-CG2 4.01Å; W143-V186 HydrophobicContact CZ2-CG2 4.03Å; W143-V186 HydrophobicContact CZ3-CG2 3.89Å; W143-G286 VanDerWaalsContact CZ3-O 3.24Å; W143-G286 WeakPolarHBondContact CZ3-O 3.21Å |
| 144 | A | 98.8 | Very high | 98.7 | Very high | 2 Ų | 2 | 32.3 Ų | 32.3 | 2% | 0.017 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.6 | -43.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L133 L136 L137 N140 P141 W148 | L133-A144 HydrophobicContact CD1-CB 4.3Å; L136-A144 HydrophobicContact CB-CB 3.81Å; L137-A144 HydrophobicContact CD2-CB 3.74Å; L137-A144 HydrophobicContact CG-CB 3.92Å; N140-A144 PolarHBondContact O-N 2.83Å; N140-A144 VanDerWaalsContact O-N 3.07Å; P141-A144 PolarHBondContact O-N 3.16Å; A144-W148 VanDerWaalsContact O-CB 3.23Å; A144-W148 WeakPolarHBondContact O-CB 3.18Å; A144-W148 PolarHBondContact O-N 3.44Å |
| 145 | L | 98.8 | Very high | 98.7 | Very high | 60 Ų | 60 | 29 Ų | 29 | 31% | 0.314 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -63.6 | -50 | 177.6 | 175.9 | 64.5 | 0 | 0 | 0 | 112 | P141 W142 W143 W148 L149 W195 | P141-L145 WeakPolarHBondContact O-CB 3.31Å; P141-L145 PolarHBondContact O-N 3.01Å; W142-L145 HydrophobicContact CE3-CD2 3.95Å; W142-L145 HydrophobicContact CZ3-CD2 3.85Å; W142-L145 WeakPolarHBondContact O-CB 3.37Å; W142-L145 PolarHBondContact O-N 3.43Å; W143-L145 VanDerWaalsContact C-N 3.33Å; W143-L145 PolarHBondContact O-N 2.84Å; L145-W148 HydrophobicContact CD1-CE3 4.48Å; L145-W148 PolarHBondContact O-N 3.28Å; L145-L149 VanDerWaalsContact O-CB 3.29Å; L145-L149 WeakPolarHBondContact O-CB 3.45Å; L145-L149 PolarHBondContact O-N 3.21Å; L145-W195 HydrophobicContact CD2-CH2 4.06Å; L145-W195 HydrophobicContact CD2-CZ3 3.87Å |
| 146 | T | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -67.6 | -38.1 | -178.6 | 58.7 | 0 | 0 | 0 | 0 | 111.7 | W142 W143 L149 G150 G181 A185 L198 | W142-T146 HydrophobicContact CD2-CG2 4.14Å; W142-T146 HydrophobicContact CE3-CG2 4.4Å; W142-T146 HydrophobicContact CH2-CG2 4.13Å; W142-T146 HydrophobicContact CZ2-CG2 3.86Å; W142-T146 HydrophobicContact CZ3-CG2 4.4Å; W142-T146 WeakPolarHBondContact O-CG2 3.37Å; W142-T146 PolarHBondContact O-N 3.06Å; W142-T146 PolarHBondContact O-OG1 3.16Å; W143-T146 PolarHBondContact O-N 3.32Å; W143-T146 PolarHBondContact O-OG1 2.99Å; T146-L149 PolarHBondContact O-N 3.17Å; T146-G150 PolarHBondContact O-N 3.46Å; T146-G181 VanDerWaalsContact CB-O 3.25Å; T146-G181 WeakPolarHBondContact CB-O 3.49Å; T146-G181 WeakPolarHBondContact O-CA 3.36Å; T146-G181 PolarHBondContact OG1-O 3.43Å; T146-A185 HydrophobicContact CG2-CB 4.33Å; T146-L198 HydrophobicContact CG2-CD2 3.93Å |
| 147 | G | 98.8 | Very high | 98.7 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -59.7 | -53.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | W143 L149 G150 T151 | W143-G147 PolarHBondContact O-N 3.12Å; G147-L149 VanDerWaalsContact C-N 3.34Å; G147-L149 PolarHBondContact O-N 2.97Å; G147-G150 PolarHBondContact O-N 3.36Å; G147-T151 PolarHBondContact O-N 3.25Å; G147-T151 PolarHBondContact O-OG1 3.45Å |
| 148 | W | 98.9 | Very high | 98.7 | Very high | 110 Ų | 110 | 29.1 Ų | 29.1 | 42% | 0.417 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -58.9 | -44.4 | 177 | 174 | 86.4 | 0 | 0 | 0 | 112.1 | A144 L145 G150 T151 V152 | A144-W148 VanDerWaalsContact O-CB 3.23Å; A144-W148 WeakPolarHBondContact O-CB 3.18Å; A144-W148 PolarHBondContact O-N 3.44Å; L145-W148 HydrophobicContact CD1-CE3 4.48Å; L145-W148 PolarHBondContact O-N 3.28Å; W148-G150 VanDerWaalsContact C-N 3.31Å; W148-G150 PolarHBondContact O-N 2.61Å; W148-T151 WeakPolarHBondContact O-CB 3.33Å; W148-T151 PolarHBondContact O-N 2.79Å; W148-V152 HydrophobicContact CD2-CG2 4.07Å; W148-V152 HydrophobicContact CE3-CG2 4.44Å; W148-V152 HydrophobicContact CH2-CG2 4.14Å; W148-V152 HydrophobicContact CZ2-CG2 3.74Å; W148-V152 HydrophobicContact CZ3-CG2 4.47Å; W148-V152 WeakPolarHBondContact O-CG2 3.28Å; W148-V152 PolarHBondContact O-N 3.49Å |
| 149 | L | 98.9 | Very high | 98.8 | Very high | 33 Ų | 33 | 25 Ų | 25 | 17% | 0.173 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -59.2 | -44.5 | 176.4 | 177.8 | 64.1 | 0 | 0 | 0 | 111 | L145 T146 G147 T151 V152 V153 L198 V201 | L145-L149 VanDerWaalsContact O-CB 3.29Å; L145-L149 WeakPolarHBondContact O-CB 3.45Å; L145-L149 PolarHBondContact O-N 3.21Å; T146-L149 PolarHBondContact O-N 3.17Å; G147-L149 VanDerWaalsContact C-N 3.34Å; G147-L149 PolarHBondContact O-N 2.97Å; L149-T151 PolarHBondContact O-N 3Å; L149-V152 PolarHBondContact O-N 3.43Å; L149-V153 HydrophobicContact CD1-CG2 4.03Å; L149-V153 HydrophobicContact CG-CG2 4.35Å; L149-V153 VanDerWaalsContact O-CG2 3.3Å; L149-V153 WeakPolarHBondContact O-CG2 3.4Å; L149-V153 PolarHBondContact O-N 2.98Å; L149-L198 HydrophobicContact CD2-CB 4.11Å; L149-L198 HydrophobicContact CD2-CD1 4.38Å; L149-L198 HydrophobicContact CD2-CD2 3.76Å; L149-L198 HydrophobicContact CD2-CG 4.29Å; L149-V201 HydrophobicContact CD2-CG1 4.35Å |
| 150 | G | 98.9 | Very high | 98.8 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59.7 | -45.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | T146 G147 W148 V152 V153 S154 A177 S205 | T146-G150 PolarHBondContact O-N 3.46Å; G147-G150 PolarHBondContact O-N 3.36Å; W148-G150 VanDerWaalsContact C-N 3.31Å; W148-G150 PolarHBondContact O-N 2.61Å; G150-V152 VanDerWaalsContact C-N 3.35Å; G150-V152 PolarHBondContact O-N 3.15Å; G150-V153 PolarHBondContact O-N 2.99Å; G150-S154 WeakPolarHBondContact O-CB 3.47Å; G150-S154 PolarHBondContact O-N 2.86Å; G150-A177 WeakPolarHBondContact O-CB 3.4Å; G150-S205 WeakPolarHBondContact CA-OG 3.37Å |
| 151 | T | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -57.7 | -46.7 | 175.1 | -36.8 | 0 | 0 | 0 | 0 | 111.5 | I113 I117 G147 W148 L149 T155 T178 | I113-T151 HydrophobicContact CB-CG2 4.47Å; I113-T151 HydrophobicContact CD1-CG2 4.09Å; I113-T151 HydrophobicContact CG2-CG2 3.92Å; I117-T151 HydrophobicContact CG1-CG2 4.31Å; G147-T151 PolarHBondContact O-N 3.25Å; G147-T151 PolarHBondContact O-OG1 3.45Å; W148-T151 WeakPolarHBondContact O-CB 3.33Å; W148-T151 PolarHBondContact O-N 2.79Å; L149-T151 PolarHBondContact O-N 3Å; T151-T155 WeakPolarHBondContact O-CB 3.49Å; T151-T155 PolarHBondContact O-N 2.85Å; T151-T155 PolarHBondContact O-OG1 2.89Å; T151-T178 PolarHBondContact OG1-OG1 2.98Å |
| 152 | V | 98.9 | Very high | 98.7 | Very high | 20 Ų | 20 | 34.8 Ų | 34.8 | 12% | 0.121 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.2 | -51.6 | 179.8 | 170.5 | 0 | 0 | 0 | 0 | 111 | F109 I113 W148 L149 G150 S154 T155 L156 | F109-V152 HydrophobicContact CE1-CG1 4.23Å; F109-V152 HydrophobicContact CZ-CG1 4.22Å; I113-V152 HydrophobicContact CD1-CB 4.42Å; I113-V152 HydrophobicContact CD1-CG2 4.02Å; I113-V152 HydrophobicContact CG1-CG2 4.1Å; I113-V152 HydrophobicContact CG2-CG2 4.36Å; W148-V152 HydrophobicContact CD2-CG2 4.07Å; W148-V152 HydrophobicContact CE3-CG2 4.44Å; W148-V152 HydrophobicContact CH2-CG2 4.14Å; W148-V152 HydrophobicContact CZ2-CG2 3.74Å; W148-V152 HydrophobicContact CZ3-CG2 4.47Å; W148-V152 WeakPolarHBondContact O-CG2 3.28Å; W148-V152 PolarHBondContact O-N 3.49Å; L149-V152 PolarHBondContact O-N 3.43Å; G150-V152 VanDerWaalsContact C-N 3.35Å; G150-V152 PolarHBondContact O-N 3.15Å; V152-S154 PolarHBondContact O-N 3.28Å; V152-T155 PolarHBondContact O-N 3.5Å; V152-L156 HydrophobicContact CG1-CD1 3.97Å; V152-L156 WeakPolarHBondContact O-CG 3.3Å; V152-L156 PolarHBondContact O-N 3.32Å |
| 153 | V | 98.9 | Very high | 98.7 | Very high | 21 Ų | 21 | 36.4 Ų | 36.4 | 13% | 0.127 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.7 | -43.7 | -177.8 | 172.4 | 0 | 0 | 0 | 0 | 111.4 | L149 G150 L156 T157 C202 M206 | L149-V153 HydrophobicContact CD1-CG2 4.03Å; L149-V153 HydrophobicContact CG-CG2 4.35Å; L149-V153 VanDerWaalsContact O-CG2 3.3Å; L149-V153 WeakPolarHBondContact O-CG2 3.4Å; L149-V153 PolarHBondContact O-N 2.98Å; G150-V153 PolarHBondContact O-N 2.99Å; V153-L156 PolarHBondContact O-N 2.9Å; V153-T157 WeakPolarHBondContact O-CB 3.46Å; V153-T157 PolarHBondContact O-N 3.28Å; V153-T157 PolarHBondContact O-OG1 3.33Å; V153-C202 HydrophobicContact CG1-CB 4.5Å; V153-C202 WeakPolarHBondContact CG1-O 3.39Å; V153-C202 HydrophobicContact CG2-CB 4.4Å; V153-M206 HydrophobicContact CG1-CG 3.58Å |
| 154 | S | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.8 | -40.7 | 178.7 | -174.1 | 0 | 0 | 0 | 0 | 112.3 | G150 V152 T157 A158 Y173 P209 | G150-S154 WeakPolarHBondContact O-CB 3.47Å; G150-S154 PolarHBondContact O-N 2.86Å; V152-S154 PolarHBondContact O-N 3.28Å; S154-T157 PolarHBondContact O-N 3.11Å; S154-A158 PolarHBondContact O-N 3.45Å; S154-Y173 WeakPolarHBondContact CB-O 3.49Å; S154-Y173 PolarHBondContact OG-O 3.33Å; S154-P209 VanDerWaalsContact O-CG 3.27Å; S154-P209 WeakPolarHBondContact O-CG 3.29Å; S154-P209 WeakPolarHBondContact OG-CD 3.36Å; S154-P209 WeakPolarHBondContact OG-CG 3.48Å |
| 155 | T | 98.8 | Very high | 98.4 | Very high | 2 Ų | 2 | 45.7 Ų | 45.7 | 1% | 0.012 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.9 | -45.9 | 176.6 | -54.1 | 0 | 0 | 0 | 0 | 110.6 | F109 W112 I113 T151 V152 T157 A158 L159 T168 | F109-T155 HydrophobicContact CD2-CG2 4.21Å; F109-T155 HydrophobicContact CE2-CG2 3.6Å; F109-T155 HydrophobicContact CZ-CG2 4.32Å; W112-T155 HydrophobicContact CB-CG2 4.41Å; W112-T155 HydrophobicContact CE3-CG2 4.32Å; I113-T155 HydrophobicContact CD1-CG2 4.04Å; I113-T155 VanDerWaalsContact CD1-OG1 3.3Å; I113-T155 WeakPolarHBondContact CD1-OG1 3.22Å; T151-T155 WeakPolarHBondContact O-CB 3.49Å; T151-T155 PolarHBondContact O-N 2.85Å; T151-T155 PolarHBondContact O-OG1 2.89Å; V152-T155 PolarHBondContact O-N 3.5Å; T155-T157 VanDerWaalsContact C-N 3.31Å; T155-T157 PolarHBondContact O-N 3.48Å; T155-A158 PolarHBondContact O-N 2.91Å; T155-L159 WeakPolarHBondContact O-CG 3.36Å; T155-L159 PolarHBondContact O-N 2.84Å; T155-L159 VanDerWaalsContact O-N 3.13Å; T155-T168 HydrophobicContact CG2-CG2 3.92Å |
| 156 | L | 98.8 | Very high | 98.2 | Very high | 80 Ų | 80 | 46.3 Ų | 46.3 | 42% | 0.419 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -59.7 | -42.1 | 173.8 | -70.9 | 172.4 | 0 | 0 | 0 | 111.9 | F109 V152 V153 A158 L159 L160 | F109-L156 HydrophobicContact CE2-CD2 3.77Å; F109-L156 HydrophobicContact CE2-CG 4.1Å; F109-L156 HydrophobicContact CZ-CD2 3.74Å; F109-L156 HydrophobicContact CZ-CG 3.75Å; V152-L156 HydrophobicContact CG1-CD1 3.97Å; V152-L156 WeakPolarHBondContact O-CG 3.3Å; V152-L156 PolarHBondContact O-N 3.32Å; V153-L156 PolarHBondContact O-N 2.9Å; L156-A158 VanDerWaalsContact C-N 3.34Å; L156-A158 PolarHBondContact O-N 3.43Å; L156-L159 WeakPolarHBondContact O-CB 3.39Å; L156-L159 PolarHBondContact O-N 2.9Å; L156-L159 VanDerWaalsContact O-N 3.14Å; L156-L160 WeakPolarHBondContact O-CG 3.42Å; L156-L160 PolarHBondContact O-N 3.35Å |
| 157 | T | 98.8 | Very high | 98.1 | Very high | 13 Ų | 13 | 48.7 Ų | 48.7 | 8% | 0.08 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64 | -39.7 | 178.7 | -56.6 | 0 | 0 | 0 | 0 | 111.6 | V153 S154 T155 L159 L160 L161 M206 P209 | V153-T157 WeakPolarHBondContact O-CB 3.46Å; V153-T157 PolarHBondContact O-N 3.28Å; V153-T157 PolarHBondContact O-OG1 3.33Å; S154-T157 PolarHBondContact O-N 3.11Å; T155-T157 VanDerWaalsContact C-N 3.31Å; T155-T157 PolarHBondContact O-N 3.48Å; T157-L159 VanDerWaalsContact C-N 3.28Å; T157-L159 PolarHBondContact O-N 3.44Å; T157-L160 PolarHBondContact O-N 2.87Å; T157-L161 HydrophobicContact CG2-CD1 3.87Å; T157-L161 HydrophobicContact CG2-CG 4.22Å; T157-L161 WeakPolarHBondContact O-CB 3.44Å; T157-L161 VanDerWaalsContact O-CG 3.32Å; T157-L161 WeakPolarHBondContact O-CG 3.3Å; T157-L161 PolarHBondContact O-N 3.08Å; T157-M206 HydrophobicContact CG2-CB 4.27Å; T157-M206 WeakPolarHBondContact CG2-O 3.48Å; T157-P209 HydrophobicContact CG2-CG 4.22Å |
| 158 | A | 98.6 | Very high | 97.9 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.5 | -37.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | S154 T155 L156 S162 Q163 Y173 P209 | S154-A158 PolarHBondContact O-N 3.45Å; T155-A158 PolarHBondContact O-N 2.91Å; L156-A158 VanDerWaalsContact C-N 3.34Å; L156-A158 PolarHBondContact O-N 3.43Å; A158-S162 PolarHBondContact O-N 3.08Å; A158-Q163 HydrophobicContact CB-CB 4.15Å; A158-Q163 HydrophobicContact CB-CG 4.1Å; A158-Q163 WeakPolarHBondContact O-CB 3.45Å; A158-Q163 WeakPolarHBondContact O-CG 3.17Å; A158-Q163 PolarHBondContact O-N 3.5Å; A158-Y173 HydrophobicContact CB-CD1 4.1Å; A158-Y173 HydrophobicContact CB-CD2 4.23Å; A158-Y173 HydrophobicContact CB-CG 3.76Å; A158-P209 HydrophobicContact CB-CB 4.14Å; A158-P209 HydrophobicContact CB-CG 4.1Å |
| 159 | L | 98.3 | Very high | 97.8 | Very high | 36 Ų | 36 | 45 Ų | 45 | 19% | 0.188 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -66.4 | -44.4 | 173.9 | -60.7 | -174 | 0 | 0 | 0 | 112.4 | F109 W112 T155 L156 T157 L161 S162 T168 | F109-L159 HydrophobicContact CD2-CD1 4.43Å; F109-L159 HydrophobicContact CE2-CD1 4.39Å; W112-L159 HydrophobicContact CZ3-CD1 4.01Å; W112-L159 HydrophobicContact CZ3-CD2 3.96Å; T155-L159 WeakPolarHBondContact O-CG 3.36Å; T155-L159 PolarHBondContact O-N 2.84Å; T155-L159 VanDerWaalsContact O-N 3.13Å; L156-L159 WeakPolarHBondContact O-CB 3.39Å; L156-L159 PolarHBondContact O-N 2.9Å; L156-L159 VanDerWaalsContact O-N 3.14Å; T157-L159 VanDerWaalsContact C-N 3.28Å; T157-L159 PolarHBondContact O-N 3.44Å; L159-L161 VanDerWaalsContact C-N 3.32Å; L159-L161 PolarHBondContact O-N 3.44Å; L159-S162 PolarHBondContact O-N 3.44Å; L159-S162 VanDerWaalsContact O-N 3.12Å; L159-T168 HydrophobicContact CD2-CG2 3.89Å |
| 160 | L | 98.4 | Very high | 97.7 | Very high | 141 Ų | 141 | 44.4 Ų | 44.4 | 74% | 0.738 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -62.6 | -39.8 | 177.5 | -70.6 | 172 | 0 | 0 | 0 | 111.7 | L156 T157 S162 | L156-L160 WeakPolarHBondContact O-CG 3.42Å; L156-L160 PolarHBondContact O-N 3.35Å; T157-L160 PolarHBondContact O-N 2.87Å; L160-S162 PolarHBondContact O-N 3.32Å |
| 161 | L | 98.2 | Very high | 97.7 | Very high | 79 Ų | 79 | 44.5 Ų | 44.5 | 41% | 0.414 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81 | 10 | 176.6 | -64.2 | 178.3 | 0 | 0 | 0 | 113.4 | T157 L159 Q163 P209 I210 | T157-L161 HydrophobicContact CG2-CD1 3.87Å; T157-L161 HydrophobicContact CG2-CG 4.22Å; T157-L161 WeakPolarHBondContact O-CB 3.44Å; T157-L161 VanDerWaalsContact O-CG 3.32Å; T157-L161 WeakPolarHBondContact O-CG 3.3Å; T157-L161 PolarHBondContact O-N 3.08Å; L159-L161 VanDerWaalsContact C-N 3.32Å; L159-L161 PolarHBondContact O-N 3.44Å; L161-Q163 HydrophobicContact CB-CG 4.15Å; L161-Q163 PolarHBondContact O-N 2.79Å; L161-Q163 VanDerWaalsContact O-N 3.14Å; L161-Q163 PolarHBondContact O-NE2 3.05Å; L161-Q163 VanDerWaalsContact O-NE2 3.1Å; L161-P209 HydrophobicContact CD1-CB 4.45Å; L161-I210 HydrophobicContact CD1-CG1 3.83Å |
| 162 | S | 98.1 | Very high | 97.6 | Very high | 103 Ų | 103 | 47.2 Ų | 47.2 | 72% | 0.72 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.8 | 39.3 | 177.9 | -59.5 | 0 | 0 | 0 | 0 | 113.6 | A158 L159 L160 | A158-S162 PolarHBondContact O-N 3.08Å; L159-S162 PolarHBondContact O-N 3.44Å; L159-S162 VanDerWaalsContact O-N 3.12Å; L160-S162 PolarHBondContact O-N 3.32Å |
| 163 | Q | 98.1 | Very high | 97.6 | Very high | 33 Ų | 33 | 47 Ų | 47 | 15% | 0.154 | 26% | 0.257 | C | S | . | . | trans | -67.8 | 163.6 | 175.9 | -60.7 | -60.1 | -72.4 | 0 | 0 | 111.3 | A158 L161 R165 Y173 S213 | A158-Q163 HydrophobicContact CB-CB 4.15Å; A158-Q163 HydrophobicContact CB-CG 4.1Å; A158-Q163 WeakPolarHBondContact O-CB 3.45Å; A158-Q163 WeakPolarHBondContact O-CG 3.17Å; A158-Q163 PolarHBondContact O-N 3.5Å; L161-Q163 HydrophobicContact CB-CG 4.15Å; L161-Q163 PolarHBondContact O-N 2.79Å; L161-Q163 VanDerWaalsContact O-N 3.14Å; L161-Q163 PolarHBondContact O-NE2 3.05Å; L161-Q163 VanDerWaalsContact O-NE2 3.1Å; Q163-R165 PolarHBondContact O-N 2.93Å; Q163-Y173 HydrophobicContact CB-CD2 4.27Å; Q163-Y173 HydrophobicContact CB-CE1 4.23Å; Q163-Y173 HydrophobicContact CB-CE2 3.68Å; Q163-Y173 HydrophobicContact CG-CE1 3.96Å; Q163-Y173 HydrophobicContact CG-CE2 4.32Å; Q163-Y173 PolarHBondContact OE1-OH 2.91Å; Q163-S213 PolarHBondContact OE1-OG 3.28Å | ||
| 164 | D | 96.3 | Very high | 97.6 | Very high | 86 Ų | 86 | 46 Ų | 46 | 46% | 0.46 | 25% | 0.251 | S | S | . | . | trans | -54.9 | 124.1 | -178.9 | -171.2 | -38.6 | 0 | 0 | 0 | 111.1 | S166 L167 T168 | D164-S166 VanDerWaalsContact C-N 3.31Å; D164-S166 PolarHBondContact O-N 3.37Å; D164-S166 WeakPolarHBondContact OD1-CA 3.36Å; D164-S166 WeakPolarHBondContact OD1-CB 3.2Å; D164-S166 PolarHBondContact OD1-N 3.24Å; D164-S166 PolarHBondContact OD1-OG 2.95Å; D164-L167 HydrophobicContact CB-CB 4.2Å; D164-L167 HydrophobicContact CB-CD1 3.91Å; D164-L167 HydrophobicContact CB-CG 3.89Å; D164-L167 PolarHBondContact O-N 3.46Å; D164-T168 PolarHBondContact O-N 2.86Å; D164-T168 PolarHBondContact O-OG1 2.91Å | ||
| 165 | R | 95.2 | Very high | 97.6 | Very high | 142 Ų | 142 | 46.7 Ų | 46.7 | 54% | 0.536 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -66.6 | -31.7 | -177.8 | -68.3 | -65.6 | -176.8 | 151.2 | -3.8 | 112.6 | Q163 T168 A169 | Q163-R165 PolarHBondContact O-N 2.93Å; R165-T168 PolarHBondContact O-N 3.11Å; R165-A169 WeakPolarHBondContact O-CB 3.37Å; R165-A169 PolarHBondContact O-N 3.47Å |
| 166 | S | 95.4 | Very high | 97.6 | Very high | 73 Ų | 73 | 46.7 Ų | 46.7 | 51% | 0.51 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -69.6 | -41.6 | 177.4 | 71 | 0 | 0 | 0 | 0 | 111.8 | D164 A169 S170 | D164-S166 VanDerWaalsContact C-N 3.31Å; D164-S166 PolarHBondContact O-N 3.37Å; D164-S166 WeakPolarHBondContact OD1-CA 3.36Å; D164-S166 WeakPolarHBondContact OD1-CB 3.2Å; D164-S166 PolarHBondContact OD1-N 3.24Å; D164-S166 PolarHBondContact OD1-OG 2.95Å; S166-A169 PolarHBondContact O-N 3.37Å; S166-S170 WeakPolarHBondContact O-CB 3.42Å; S166-S170 PolarHBondContact O-N 2.98Å; S166-S170 VanDerWaalsContact O-N 3.08Å; S166-S170 PolarHBondContact O-OG 2.96Å |
| 167 | L | 95.6 | Very high | 97.6 | Very high | 50 Ų | 50 | 42.9 Ų | 42.9 | 26% | 0.262 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -67.3 | -39.3 | 174.9 | -59.2 | -176.8 | 0 | 0 | 0 | 111 | D164 S170 G171 L172 Y173 | D164-L167 HydrophobicContact CB-CB 4.2Å; D164-L167 HydrophobicContact CB-CD1 3.91Å; D164-L167 HydrophobicContact CB-CG 3.89Å; D164-L167 PolarHBondContact O-N 3.46Å; L167-S170 WeakPolarHBondContact CA-OG 3.45Å; L167-S170 PolarHBondContact O-OG 3.41Å; L167-S170 VanDerWaalsContact O-OG 3.05Å; L167-G171 PolarHBondContact O-N 2.93Å; L167-L172 HydrophobicContact CB-CB 4.4Å; L167-L172 HydrophobicContact CB-CD1 4.38Å; L167-L172 HydrophobicContact CD2-CD1 3.63Å; L167-L172 WeakPolarHBondContact O-CB 3.14Å; L167-L172 PolarHBondContact O-N 3.49Å; L167-Y173 HydrophobicContact CB-CD2 4.06Å; L167-Y173 HydrophobicContact CB-CE2 3.71Å; L167-Y173 HydrophobicContact CD1-CE2 4.21Å |
| 168 | T | 96 | Very high | 97.6 | Very high | 2 Ų | 2 | 42.3 Ų | 42.3 | 1% | 0.012 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -65.3 | -46.4 | 175.4 | -52.6 | 0 | 0 | 0 | 0 | 111.4 | W112 T155 L159 D164 R165 S170 G171 | W112-T168 HydrophobicContact CE3-CG2 4.02Å; W112-T168 HydrophobicContact CZ3-CG2 4.43Å; T155-T168 HydrophobicContact CG2-CG2 3.92Å; L159-T168 HydrophobicContact CD2-CG2 3.89Å; D164-T168 PolarHBondContact O-N 2.86Å; D164-T168 PolarHBondContact O-OG1 2.91Å; R165-T168 PolarHBondContact O-N 3.11Å; T168-S170 VanDerWaalsContact C-N 3.26Å; T168-S170 PolarHBondContact O-N 3.09Å; T168-G171 PolarHBondContact O-N 2.64Å |
| 169 | A | 96.5 | Very high | 97.6 | Very high | 30 Ų | 30 | 42.4 Ų | 42.4 | 25% | 0.248 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.8 | -26.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | W112 R115 R165 S166 G171 | W112-A169 VanDerWaalsContact CD1-CA 3.41Å; W112-A169 HydrophobicContact CD2-CB 4.49Å; W112-A169 HydrophobicContact CG-CB 4.49Å; W112-A169 HydrophobicContact CZ2-CB 4.4Å; R115-A169 WeakPolarHBondContact CD-O 3.36Å; R165-A169 WeakPolarHBondContact O-CB 3.37Å; R165-A169 PolarHBondContact O-N 3.47Å; S166-A169 PolarHBondContact O-N 3.37Å; A169-G171 VanDerWaalsContact C-N 3.27Å |
| 170 | S | 96.8 | Very high | 97.7 | Very high | 22 Ų | 22 | 40.7 Ų | 40.7 | 15% | 0.154 | 22% | 0.222 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 6 | 172.7 | 52.2 | 0 | 0 | 0 | 0 | 113.5 | Q119 N124 S166 L167 T168 L172 | Q119-S170 VanDerWaalsContact CG-O 3.29Å; Q119-S170 WeakPolarHBondContact CG-O 3.34Å; Q119-S170 PolarHBondContact NE2-O 3.18Å; N124-S170 PolarHBondContact OD1-O 3.18Å; S166-S170 WeakPolarHBondContact O-CB 3.42Å; S166-S170 PolarHBondContact O-N 2.98Å; S166-S170 VanDerWaalsContact O-N 3.08Å; S166-S170 PolarHBondContact O-OG 2.96Å; L167-S170 WeakPolarHBondContact CA-OG 3.45Å; L167-S170 PolarHBondContact O-OG 3.41Å; L167-S170 VanDerWaalsContact O-OG 3.05Å; T168-S170 VanDerWaalsContact C-N 3.26Å; T168-S170 PolarHBondContact O-N 3.09Å; S170-L172 VanDerWaalsContact C-N 3.33Å; S170-L172 PolarHBondContact O-N 3.24Å |
| 171 | G | 97.8 | Very high | 97.7 | Very high | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.01 | 19% | 0.187 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 79.8 | 5 | 176 | 0 | 0 | 0 | 0 | 0 | 115.3 | G116 L167 T168 A169 Y173 G174 Y175 | G116-G171 WeakPolarHBondContact CA-O 3.3Å; L167-G171 PolarHBondContact O-N 2.93Å; T168-G171 PolarHBondContact O-N 2.64Å; A169-G171 VanDerWaalsContact C-N 3.27Å; G171-Y173 PolarHBondContact O-N 3.11Å; G171-Y173 VanDerWaalsContact O-N 3.16Å; G171-G174 PolarHBondContact O-N 3.18Å; G171-Y175 PolarHBondContact O-N 2.95Å |
| 172 | L | 98.1 | Very high | 97.7 | Very high | 58 Ų | 58 | 30.2 Ų | 30.2 | 30% | 0.304 | 17% | 0.167 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.6 | -16.1 | -173.4 | -66.1 | 173.8 | 0 | 0 | 0 | 114.1 | Q119 L167 S170 Y175 | Q119-L172 HydrophobicContact CG-CD2 4.42Å; L167-L172 HydrophobicContact CB-CB 4.4Å; L167-L172 HydrophobicContact CB-CD1 4.38Å; L167-L172 HydrophobicContact CD2-CD1 3.63Å; L167-L172 WeakPolarHBondContact O-CB 3.14Å; L167-L172 PolarHBondContact O-N 3.49Å; S170-L172 VanDerWaalsContact C-N 3.33Å; S170-L172 PolarHBondContact O-N 3.24Å; L172-Y175 HydrophobicContact CB-CE1 4.42Å; L172-Y175 HydrophobicContact CD2-CE1 4.11Å; L172-Y175 WeakPolarHBondContact O-CD1 3.13Å; L172-Y175 WeakPolarHBondContact O-CE1 2.91Å |
| 173 | Y | 98.6 | Very high | 97.7 | Very high | 14 Ų | 14 | 26 Ų | 26 | 6% | 0.055 | 14% | 0.136 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -96.4 | 0.7 | 171.4 | -76.4 | -75.2 | 0 | 0 | 0 | 113.9 | S154 A158 Q163 L167 G171 P209 | S154-Y173 WeakPolarHBondContact CB-O 3.49Å; S154-Y173 PolarHBondContact OG-O 3.33Å; A158-Y173 HydrophobicContact CB-CD1 4.1Å; A158-Y173 HydrophobicContact CB-CD2 4.23Å; A158-Y173 HydrophobicContact CB-CG 3.76Å; Q163-Y173 HydrophobicContact CB-CD2 4.27Å; Q163-Y173 HydrophobicContact CB-CE1 4.23Å; Q163-Y173 HydrophobicContact CB-CE2 3.68Å; Q163-Y173 HydrophobicContact CG-CE1 3.96Å; Q163-Y173 HydrophobicContact CG-CE2 4.32Å; Q163-Y173 PolarHBondContact OE1-OH 2.91Å; L167-Y173 HydrophobicContact CB-CD2 4.06Å; L167-Y173 HydrophobicContact CB-CE2 3.71Å; L167-Y173 HydrophobicContact CD1-CE2 4.21Å; G171-Y173 PolarHBondContact O-N 3.11Å; G171-Y173 VanDerWaalsContact O-N 3.16Å; Y173-P209 HydrophobicContact CD1-CB 3.74Å; Y173-P209 HydrophobicContact CD1-CG 4.32Å; Y173-P209 HydrophobicContact CE1-CB 4.11Å |
| 174 | G | 98.4 | Very high | 97.8 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.129 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -102.9 | -37 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | G171 N176 A177 T178 | G171-G174 PolarHBondContact O-N 3.18Å; G174-N176 PolarHBondContact O-N 3.44Å; G174-A177 PolarHBondContact O-N 2.87Å; G174-T178 PolarHBondContact O-N 2.93Å; G174-T178 PolarHBondContact O-OG1 3.47Å |
| 175 | Y | 98.8 | Very high | 97.9 | Very high | 16 Ų | 16 | 20.6 Ų | 20.6 | 6% | 0.063 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -65.3 | -38.9 | -167.9 | 71.2 | -90.4 | 0 | 0 | 0 | 114.4 | G116 Q119 V120 G171 L172 A177 T178 L179 F227 T228 | G116-Y175 WeakPolarHBondContact O-CA 3.49Å; G116-Y175 WeakPolarHBondContact O-CB 3.34Å; G116-Y175 PolarHBondContact O-N 3.26Å; Q119-Y175 HydrophobicContact CB-CD1 3.83Å; Q119-Y175 HydrophobicContact CB-CG 4.01Å; V120-Y175 WeakPolarHBondContact CG2-O 3.48Å; G171-Y175 PolarHBondContact O-N 2.95Å; L172-Y175 HydrophobicContact CB-CE1 4.42Å; L172-Y175 HydrophobicContact CD2-CE1 4.11Å; L172-Y175 WeakPolarHBondContact O-CD1 3.13Å; L172-Y175 WeakPolarHBondContact O-CE1 2.91Å; Y175-A177 VanDerWaalsContact C-N 3.31Å; Y175-A177 PolarHBondContact O-N 3.01Å; Y175-T178 VanDerWaalsContact O-CB 3.28Å; Y175-T178 WeakPolarHBondContact O-CB 3.21Å; Y175-T178 PolarHBondContact O-N 3.42Å; Y175-L179 PolarHBondContact O-N 3.45Å; Y175-F227 WeakPolarHBondContact CE2-O 3.48Å; Y175-F227 PolarHBondContact OH-O 3.5Å; Y175-T228 HydrophobicContact CD2-CG2 4.3Å; Y175-T228 HydrophobicContact CE2-CG2 4.06Å |
| 176 | N | 98.9 | Very high | 98.1 | Very high | 1 Ų | 1 | 14.7 Ų | 14.7 | 1% | 0.005 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -60 | -43.8 | 177.8 | -82.5 | -74.4 | 0 | 0 | 0 | 111.2 | G174 T178 L179 V180 C208 F227 T228 P230 F231 | G174-N176 PolarHBondContact O-N 3.44Å; N176-T178 VanDerWaalsContact C-N 3.32Å; N176-T178 PolarHBondContact O-N 3.12Å; N176-L179 PolarHBondContact O-N 2.92Å; N176-V180 WeakPolarHBondContact O-CG2 3.43Å; N176-V180 PolarHBondContact O-N 3.39Å; N176-C208 HydrophobicContact CB-CB 4.31Å; N176-F227 PolarHBondContact ND2-O 3.11Å; N176-T228 VanDerWaalsContact OD1-CA 3.28Å; N176-T228 WeakPolarHBondContact OD1-CA 3.49Å; N176-P230 HydrophobicContact CB-CB 4Å; N176-P230 WeakPolarHBondContact OD1-CD 3.48Å; N176-F231 HydrophobicContact CB-CB 4.11Å; N176-F231 VanDerWaalsContact OD1-CB 3.28Å; N176-F231 WeakPolarHBondContact OD1-CB 3.48Å; N176-F231 PolarHBondContact OD1-N 3.06Å |
| 177 | A | 98.9 | Very high | 98.2 | Very high | 0 Ų | 0 | 13.3 Ų | 13.3 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -74 | -24.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | G150 G174 Y175 L179 V180 G181 C208 | G150-A177 WeakPolarHBondContact O-CB 3.4Å; G174-A177 PolarHBondContact O-N 2.87Å; Y175-A177 VanDerWaalsContact C-N 3.31Å; Y175-A177 PolarHBondContact O-N 3.01Å; A177-L179 VanDerWaalsContact C-N 3.34Å; A177-V180 PolarHBondContact O-N 3.19Å; A177-G181 PolarHBondContact O-N 3.21Å; A177-C208 HydrophobicContact CB-CB 4.09Å |
| 178 | T | 98.9 | Very high | 98.3 | Very high | 1 Ų | 1 | 11.2 Ų | 11.2 | 1% | 0.006 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -58.6 | -49.6 | 169.4 | -50 | 0 | 0 | 0 | 0 | 109.9 | I117 V120 T151 G174 Y175 N176 G181 I182 | I117-T178 HydrophobicContact CG1-CG2 4.16Å; V120-T178 HydrophobicContact CG2-CG2 4.48Å; T151-T178 PolarHBondContact OG1-OG1 2.98Å; G174-T178 PolarHBondContact O-N 2.93Å; G174-T178 PolarHBondContact O-OG1 3.47Å; Y175-T178 VanDerWaalsContact O-CB 3.28Å; Y175-T178 WeakPolarHBondContact O-CB 3.21Å; Y175-T178 PolarHBondContact O-N 3.42Å; N176-T178 VanDerWaalsContact C-N 3.32Å; N176-T178 PolarHBondContact O-N 3.12Å; T178-G181 PolarHBondContact O-N 3.33Å; T178-I182 HydrophobicContact CG2-CD1 4.01Å; T178-I182 WeakPolarHBondContact O-CD1 3.39Å; T178-I182 VanDerWaalsContact O-CG1 3.3Å; T178-I182 WeakPolarHBondContact O-CG1 3.29Å; T178-I182 PolarHBondContact O-N 3.11Å; T178-I182 VanDerWaalsContact O-N 3.11Å |
| 179 | L | 98.9 | Very high | 98.4 | Very high | 3 Ų | 3 | 15.3 Ų | 15.3 | 2% | 0.016 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -65.2 | -41.1 | 175.6 | -68.4 | 175.4 | 0 | 0 | 0 | 112.2 | V120 Y175 N176 A177 G181 I182 L183 T228 F231 I284 Y285 | V120-L179 HydrophobicContact CG1-CD1 4.07Å; V120-L179 HydrophobicContact CG1-CD2 3.72Å; V120-L179 HydrophobicContact CG1-CG 4Å; V120-L179 HydrophobicContact CG2-CD1 4.42Å; V120-L179 HydrophobicContact CG2-CD2 4.29Å; V120-L179 HydrophobicContact CG2-CG 3.92Å; Y175-L179 PolarHBondContact O-N 3.45Å; N176-L179 PolarHBondContact O-N 2.92Å; A177-L179 VanDerWaalsContact C-N 3.34Å; L179-G181 PolarHBondContact O-N 2.75Å; L179-I182 PolarHBondContact O-N 3.47Å; L179-L183 HydrophobicContact CB-CD2 4.34Å; L179-L183 HydrophobicContact CD2-CD2 4.09Å; L179-L183 WeakPolarHBondContact O-CB 3.42Å; L179-L183 WeakPolarHBondContact O-CD2 3.35Å; L179-L183 PolarHBondContact O-N 3.49Å; L179-T228 HydrophobicContact CD1-CG2 3.6Å; L179-F231 HydrophobicContact CB-CB 4.23Å; L179-F231 HydrophobicContact CB-CD1 4.16Å; L179-F231 HydrophobicContact CB-CD2 3.28Å; L179-F231 HydrophobicContact CB-CE1 4.39Å; L179-F231 HydrophobicContact CB-CE2 3.55Å; L179-F231 HydrophobicContact CB-CG 3.6Å; L179-F231 HydrophobicContact CB-CZ 4.11Å; L179-F231 HydrophobicContact CD1-CB 4.31Å; L179-F231 HydrophobicContact CD1-CD1 3.79Å; L179-F231 HydrophobicContact CD1-CD2 4.4Å; L179-F231 HydrophobicContact CD1-CE1 4.22Å; L179-F231 HydrophobicContact CD1-CG 3.89Å; L179-F231 HydrophobicContact CG-CD2 4.48Å; L179-F231 HydrophobicContact CG-CG 4.43Å; L179-I284 VanDerWaalsContact CD2-O 3.31Å; L179-I284 WeakPolarHBondContact CD2-O 3.29Å; L179-Y285 HydrophobicContact CD2-CD1 4.31Å |
| 180 | V | 98.9 | Very high | 98.5 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -56.7 | -51.4 | 175.9 | 168.6 | 0 | 0 | 0 | 0 | 110.2 | N176 A177 I182 L183 M184 M204 F231 A234 | N176-V180 WeakPolarHBondContact O-CG2 3.43Å; N176-V180 PolarHBondContact O-N 3.39Å; A177-V180 PolarHBondContact O-N 3.19Å; V180-I182 PolarHBondContact O-N 2.85Å; V180-L183 PolarHBondContact O-N 2.98Å; V180-M184 HydrophobicContact CG1-CG 4.2Å; V180-M184 HydrophobicContact CG1-SD 3.39Å; V180-M184 WeakPolarHBondContact CG1-SD 3.47Å; V180-M184 VanDerWaalsContact O-CB 3.25Å; V180-M184 WeakPolarHBondContact O-CB 3.26Å; V180-M184 WeakPolarHBondContact O-CG 3.47Å; V180-M184 PolarHBondContact O-N 2.72Å; V180-M204 HydrophobicContact CG1-CB 3.66Å; V180-F231 HydrophobicContact CB-CD2 4.5Å; V180-F231 HydrophobicContact CG2-CB 4.42Å; V180-F231 HydrophobicContact CG2-CD2 3.79Å; V180-A234 HydrophobicContact CG2-CB 3.98Å |
| 181 | G | 98.9 | Very high | 98.4 | Very high | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.1 | -44.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | T146 A177 T178 L179 A185 | T146-G181 VanDerWaalsContact CB-O 3.25Å; T146-G181 WeakPolarHBondContact CB-O 3.49Å; T146-G181 WeakPolarHBondContact O-CA 3.36Å; T146-G181 PolarHBondContact OG1-O 3.43Å; A177-G181 PolarHBondContact O-N 3.21Å; T178-G181 PolarHBondContact O-N 3.33Å; L179-G181 PolarHBondContact O-N 2.75Å; G181-A185 PolarHBondContact O-N 2.95Å |
| 182 | I | 98.9 | Very high | 98.4 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -66.7 | -52.9 | 179.2 | -63.4 | 162.8 | 0 | 0 | 0 | 110.5 | L136 W143 T178 L179 V180 M184 A185 V186 Y285 | L136-I182 HydrophobicContact CD1-CD1 3.89Å; L136-I182 HydrophobicContact CD2-CD1 3.83Å; W143-I182 HydrophobicContact CB-CG2 4.23Å; T178-I182 HydrophobicContact CG2-CD1 4.01Å; T178-I182 WeakPolarHBondContact O-CD1 3.39Å; T178-I182 VanDerWaalsContact O-CG1 3.3Å; T178-I182 WeakPolarHBondContact O-CG1 3.29Å; T178-I182 PolarHBondContact O-N 3.11Å; T178-I182 VanDerWaalsContact O-N 3.11Å; L179-I182 PolarHBondContact O-N 3.47Å; V180-I182 PolarHBondContact O-N 2.85Å; I182-M184 VanDerWaalsContact C-N 3.33Å; I182-M184 PolarHBondContact O-N 2.84Å; I182-A185 WeakPolarHBondContact O-CA 3.5Å; I182-A185 WeakPolarHBondContact O-CB 3.49Å; I182-A185 PolarHBondContact O-N 3.38Å; I182-V186 HydrophobicContact CG2-CG2 4.11Å; I182-V186 WeakPolarHBondContact O-CG2 3.3Å; I182-V186 PolarHBondContact O-N 3.29Å; I182-Y285 HydrophobicContact CD1-CD1 3.82Å; I182-Y285 WeakPolarHBondContact CG2-O 3.29Å |
| 183 | L | 98.8 | Very high | 98.4 | Very high | 13 Ų | 13 | 26 Ų | 26 | 7% | 0.068 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -74.6 | -23.9 | -171.6 | -77.3 | -53.8 | 0 | 0 | 0 | 112.6 | L179 V180 A185 V186 F187 F231 L235 | L179-L183 HydrophobicContact CB-CD2 4.34Å; L179-L183 HydrophobicContact CD2-CD2 4.09Å; L179-L183 WeakPolarHBondContact O-CB 3.42Å; L179-L183 WeakPolarHBondContact O-CD2 3.35Å; L179-L183 PolarHBondContact O-N 3.49Å; V180-L183 PolarHBondContact O-N 2.98Å; L183-A185 VanDerWaalsContact C-N 3.28Å; L183-A185 PolarHBondContact O-N 3.26Å; L183-V186 HydrophobicContact CD1-CB 4.04Å; L183-V186 HydrophobicContact CD1-CG1 4.23Å; L183-V186 HydrophobicContact CD1-CG2 4.17Å; L183-V186 PolarHBondContact O-N 3.27Å; L183-F187 HydrophobicContact CB-CD2 4.14Å; L183-F187 HydrophobicContact CB-CE2 4.2Å; L183-F187 HydrophobicContact CD1-CD2 4.41Å; L183-F187 HydrophobicContact CD1-CE2 3.89Å; L183-F187 HydrophobicContact CG-CE2 4.34Å; L183-F187 WeakPolarHBondContact O-CB 3.38Å; L183-F187 WeakPolarHBondContact O-CD2 3.14Å; L183-F187 PolarHBondContact O-N 3.34Å; L183-F231 HydrophobicContact CB-CE2 4.05Å; L183-F231 HydrophobicContact CB-CZ 4.29Å; L183-F231 HydrophobicContact CD2-CE2 4.25Å; L183-F231 HydrophobicContact CD2-CZ 4.21Å; L183-F231 HydrophobicContact CG-CE2 4.16Å; L183-F231 HydrophobicContact CG-CZ 3.99Å; L183-L235 HydrophobicContact CB-CD1 4.38Å; L183-L235 HydrophobicContact CB-CD2 3.66Å; L183-L235 HydrophobicContact CG-CD2 4.4Å |
| 184 | M | 98.8 | Very high | 98.4 | Very high | 1 Ų | 1 | 27.3 Ų | 27.3 | 1% | 0.005 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -63.4 | -35.3 | 166.8 | -74.3 | 175.6 | 70.3 | 0 | 0 | 112.1 | V180 I182 S188 P200 V201 M204 L235 Y238 | V180-M184 HydrophobicContact CG1-CG 4.2Å; V180-M184 HydrophobicContact CG1-SD 3.39Å; V180-M184 WeakPolarHBondContact CG1-SD 3.47Å; V180-M184 VanDerWaalsContact O-CB 3.25Å; V180-M184 WeakPolarHBondContact O-CB 3.26Å; V180-M184 WeakPolarHBondContact O-CG 3.47Å; V180-M184 PolarHBondContact O-N 2.72Å; I182-M184 VanDerWaalsContact C-N 3.33Å; I182-M184 PolarHBondContact O-N 2.84Å; M184-S188 WeakPolarHBondContact O-CB 3.26Å; M184-S188 PolarHBondContact O-N 2.88Å; M184-P200 HydrophobicContact CE-CB 3.68Å; M184-P200 HydrophobicContact CE-CG 4.05Å; M184-V201 HydrophobicContact CB-CG2 4.05Å; M184-V201 HydrophobicContact CE-CB 4.47Å; M184-V201 HydrophobicContact CE-CG2 3.9Å; M184-V201 HydrophobicContact SD-CG2 3.97Å; M184-M204 HydrophobicContact CE-CG 4.04Å; M184-M204 HydrophobicContact SD-CB 3.91Å; M184-M204 HydrophobicContact SD-CG 3.97Å; M184-L235 HydrophobicContact CG-CD1 3.74Å; M184-Y238 HydrophobicContact CB-CE1 4.41Å; M184-Y238 HydrophobicContact CE-CD1 3.89Å; M184-Y238 HydrophobicContact CE-CD2 3.83Å; M184-Y238 HydrophobicContact CE-CE1 3.68Å; M184-Y238 HydrophobicContact CE-CE2 3.61Å; M184-Y238 HydrophobicContact CE-CG 3.96Å; M184-Y238 HydrophobicContact CG-CD1 3.86Å; M184-Y238 HydrophobicContact CG-CE1 3.93Å; M184-Y238 HydrophobicContact SD-CD1 4.36Å |
| 185 | A | 98.8 | Very high | 98.4 | Very high | 5 Ų | 5 | 34.6 Ų | 34.6 | 4% | 0.041 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -71.8 | -46.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | W143 T146 G181 I182 L183 F187 S188 L197 | W143-A185 HydrophobicContact CG-CB 4.47Å; T146-A185 HydrophobicContact CG2-CB 4.33Å; G181-A185 PolarHBondContact O-N 2.95Å; I182-A185 WeakPolarHBondContact O-CA 3.5Å; I182-A185 WeakPolarHBondContact O-CB 3.49Å; I182-A185 PolarHBondContact O-N 3.38Å; L183-A185 VanDerWaalsContact C-N 3.28Å; L183-A185 PolarHBondContact O-N 3.26Å; A185-F187 VanDerWaalsContact C-N 3.31Å; A185-F187 PolarHBondContact O-N 2.73Å; A185-S188 PolarHBondContact O-N 2.98Å; A185-S188 VanDerWaalsContact O-N 3.16Å; A185-L197 HydrophobicContact CB-CD2 4.12Å |
| 186 | V | 98.6 | Very high | 98.4 | Very high | 19 Ų | 19 | 42 Ų | 42 | 12% | 0.115 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.2 | -41.5 | 179 | 172.7 | 0 | 0 | 0 | 0 | 112.1 | W143 I182 L183 K252 | W143-V186 HydrophobicContact CD2-CG2 3.81Å; W143-V186 HydrophobicContact CE3-CG2 3.79Å; W143-V186 HydrophobicContact CG-CG2 4.5Å; W143-V186 HydrophobicContact CH2-CG2 4.01Å; W143-V186 HydrophobicContact CZ2-CG2 4.03Å; W143-V186 HydrophobicContact CZ3-CG2 3.89Å; I182-V186 HydrophobicContact CG2-CG2 4.11Å; I182-V186 WeakPolarHBondContact O-CG2 3.3Å; I182-V186 PolarHBondContact O-N 3.29Å; L183-V186 HydrophobicContact CD1-CB 4.04Å; L183-V186 HydrophobicContact CD1-CG1 4.23Å; L183-V186 HydrophobicContact CD1-CG2 4.17Å; L183-V186 PolarHBondContact O-N 3.27Å; V186-K252 WeakPolarHBondContact O-CD 3.29Å; V186-K252 WeakPolarHBondContact O-CE 3.34Å; V186-K252 PolarHBondContact O-NZ 2.83Å |
| 187 | F | 98.6 | Very high | 98.4 | Very high | 43 Ų | 43 | 41.9 Ų | 41.9 | 19% | 0.189 | 19% | 0.194 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | 3.9 | -179.3 | -68.1 | -61.5 | 0 | 0 | 0 | 114.2 | L183 A185 L235 L239 G251 K252 P387 | L183-F187 HydrophobicContact CB-CD2 4.14Å; L183-F187 HydrophobicContact CB-CE2 4.2Å; L183-F187 HydrophobicContact CD1-CD2 4.41Å; L183-F187 HydrophobicContact CD1-CE2 3.89Å; L183-F187 HydrophobicContact CG-CE2 4.34Å; L183-F187 WeakPolarHBondContact O-CB 3.38Å; L183-F187 WeakPolarHBondContact O-CD2 3.14Å; L183-F187 PolarHBondContact O-N 3.34Å; A185-F187 VanDerWaalsContact C-N 3.31Å; A185-F187 PolarHBondContact O-N 2.73Å; F187-L235 HydrophobicContact CD2-CD2 4.2Å; F187-L235 HydrophobicContact CE2-CD2 4.22Å; F187-L239 HydrophobicContact CB-CD1 4.24Å; F187-L239 HydrophobicContact CB-CD2 3.94Å; F187-L239 HydrophobicContact CD2-CD1 4.04Å; F187-L239 HydrophobicContact CG-CD1 4.2Å; F187-G251 CarbonylContact O-C 3.56Å; F187-G251 VanDerWaalsContact O-CA 3.24Å; F187-G251 WeakPolarHBondContact O-CA 2.98Å; F187-K252 PolarHBondContact O-N 3.25Å; F187-P387 HydrophobicContact CD1-CG 4.23Å; F187-P387 HydrophobicContact CD2-CG 4.09Å; F187-P387 HydrophobicContact CE1-CB 3.77Å; F187-P387 HydrophobicContact CE1-CG 3.82Å; F187-P387 HydrophobicContact CE2-CB 4.08Å; F187-P387 HydrophobicContact CE2-CG 3.66Å; F187-P387 HydrophobicContact CG-CG 4.38Å; F187-P387 HydrophobicContact CZ-CB 3.47Å; F187-P387 VanDerWaalsContact CZ-CB 3.47Å; F187-P387 HydrophobicContact CZ-CG 3.52Å |
| 188 | S | 98.5 | Very high | 98.4 | Very high | 6 Ų | 6 | 43.8 Ų | 43.8 | 4% | 0.042 | 20% | 0.204 | C | C | . | . | B | Isolated β-bridge | trans | -76.2 | 138.4 | 172.7 | -172.1 | 0 | 0 | 0 | 0 | 111.1 | M184 A185 K190 | M184-S188 WeakPolarHBondContact O-CB 3.26Å; M184-S188 PolarHBondContact O-N 2.88Å; A185-S188 PolarHBondContact O-N 2.98Å; A185-S188 VanDerWaalsContact O-N 3.16Å; S188-K190 VanDerWaalsContact C-N 3.32Å; S188-K190 PolarHBondContact OG-N 3.24Å |
| 189 | D | 97.9 | Very high | 98.3 | Very high | 88 Ų | 88 | 48.7 Ų | 48.7 | 47% | 0.471 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.2 | 0 | 174.4 | -157.1 | 49.1 | 0 | 0 | 0 | 112.8 | H244 P250 | D189-H244 IonicContact OD2-CE1 2.96Å; D189-P250 HydrophobicContact CB-CB 4.21Å; D189-P250 HydrophobicContact CB-CG 4.23Å; D189-P250 WeakPolarHBondContact CB-O 3.22Å; D189-P250 PolarHBondContact N-O 2.98Å |
| 190 | K | 97.7 | Very high | 98.3 | Very high | 104 Ų | 104 | 49.3 Ų | 49.3 | 45% | 0.452 | 23% | 0.234 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | -7.8 | 179.6 | -66.9 | -65.7 | -167.1 | -174.3 | 0 | 114 | S188 F194 P250 | S188-K190 VanDerWaalsContact C-N 3.32Å; S188-K190 PolarHBondContact OG-N 3.24Å; K190-F194 HydrophobicContact CB-CB 3.8Å; K190-F194 HydrophobicContact CB-CD1 3.59Å; K190-F194 HydrophobicContact CB-CD2 4.11Å; K190-F194 HydrophobicContact CB-CE1 4.18Å; K190-F194 HydrophobicContact CB-CG 3.57Å; K190-F194 HydrophobicContact CG-CD1 3.75Å; K190-F194 HydrophobicContact CG-CD2 4.28Å; K190-F194 HydrophobicContact CG-CE1 3.79Å; K190-F194 HydrophobicContact CG-CE2 4.31Å; K190-F194 HydrophobicContact CG-CG 4.02Å; K190-F194 HydrophobicContact CG-CZ 4.07Å; K190-P250 HydrophobicContact CD-CG 4.05Å; K190-P250 HydrophobicContact CG-CG 4.02Å |
| 191 | G | 94.6 | Very high | 98.3 | Very high | 37 Ų | 37 | 49.3 Ų | 49.3 | 38% | 0.381 | 23% | 0.234 | S | C | . | . | trans | 73.9 | -166.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 192 | D | 97.4 | Very high | 98.3 | Very high | 81 Ų | 81 | 51.1 Ų | 51.1 | 43% | 0.433 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | 151.8 | -174.5 | -69 | -20.6 | 0 | 0 | 0 | 112.9 | N140 W142 F194 | N140-D192 VanDerWaalsContact ND2-CG 3.31Å; N140-D192 PolarHBondContact ND2-OD1 3.26Å; N140-D192 VanDerWaalsContact ND2-OD1 3.13Å; N140-D192 PolarHBondContact ND2-OD2 3.45Å; W142-D192 HydrophobicContact CB-CB 4.22Å; W142-D192 HydrophobicContact CG-CB 4.26Å; D192-F194 PolarHBondContact O-N 2.98Å; D192-F194 VanDerWaalsContact O-N 3.14Å |
| 193 | Y | 98.4 | Very high | 98.3 | Very high | 115 Ų | 115 | 53.5 Ų | 53.5 | 45% | 0.451 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.5 | 25.1 | 177.1 | -53.3 | -78.3 | 0 | 0 | 0 | 114.9 | W142 W195 | W142-Y193 HydrophobicContact CB-CE1 4.32Å; W142-Y193 HydrophobicContact CD2-CD1 4.41Å; W142-Y193 AromaticContact CE3-CD1 3.77Å; W142-Y193 HydrophobicContact CE3-CD1 3.77Å; W142-Y193 HydrophobicContact CE3-CE1 4.28Å; W142-Y193 HydrophobicContact CE3-CG 4.37Å; W142-Y193 HydrophobicContact CZ3-CD1 4.38Å; Y193-W195 VanDerWaalsContact C-N 3.25Å; Y193-W195 HydrophobicContact CD1-CZ2 4.07Å; Y193-W195 PolarHBondContact O-N 3.01Å |
| 194 | F | 98.4 | Very high | 98.3 | Very high | 41 Ų | 41 | 53.9 Ų | 53.9 | 18% | 0.18 | 27% | 0.267 | C | S | . | . | trans | -70.7 | 83.7 | 164.1 | 178.9 | -126 | 0 | 0 | 0 | 109.8 | W142 K190 D192 W196 L197 F248 F249 | W142-F194 WeakPolarHBondContact CZ2-O 3.4Å; K190-F194 HydrophobicContact CB-CB 3.8Å; K190-F194 HydrophobicContact CB-CD1 3.59Å; K190-F194 HydrophobicContact CB-CD2 4.11Å; K190-F194 HydrophobicContact CB-CE1 4.18Å; K190-F194 HydrophobicContact CB-CG 3.57Å; K190-F194 HydrophobicContact CG-CD1 3.75Å; K190-F194 HydrophobicContact CG-CD2 4.28Å; K190-F194 HydrophobicContact CG-CE1 3.79Å; K190-F194 HydrophobicContact CG-CE2 4.31Å; K190-F194 HydrophobicContact CG-CG 4.02Å; K190-F194 HydrophobicContact CG-CZ 4.07Å; D192-F194 PolarHBondContact O-N 2.98Å; D192-F194 VanDerWaalsContact O-N 3.14Å; F194-W196 HydrophobicContact CD2-CB 4.38Å; F194-W196 HydrophobicContact CE1-CB 4.01Å; F194-W196 HydrophobicContact CE2-CB 3.77Å; F194-W196 AromaticContact CE2-CD1 3.73Å; F194-W196 HydrophobicContact CE2-CG 4.13Å; F194-W196 HydrophobicContact CZ-CB 3.55Å; F194-W196 HydrophobicContact CZ-CG 4.26Å; F194-W196 PolarHBondContact O-N 2.97Å; F194-L197 HydrophobicContact CD1-CB 3.86Å; F194-L197 HydrophobicContact CE1-CB 4.47Å; F194-L197 WeakPolarHBondContact O-CB 3.48Å; F194-L197 PolarHBondContact O-N 3.01Å; F194-F248 VanDerWaalsContact CZ-O 3.27Å; F194-F248 WeakPolarHBondContact CZ-O 3.46Å; F194-F249 AromaticContact CE1-CD1 3.79Å; F194-F249 HydrophobicContact CE1-CD1 3.79Å; F194-F249 HydrophobicContact CE1-CE1 4.07Å; F194-F249 HydrophobicContact CZ-CD1 4.37Å; F194-F249 HydrophobicContact CZ-CE1 4.39Å | ||
| 195 | W | 98.6 | Very high | 98.3 | Very high | 152 Ų | 152 | 53.9 Ų | 53.9 | 58% | 0.576 | 27% | 0.267 | S | S | * | . | G | 310 helix | trans | -55.3 | -29.2 | -171.7 | -67.9 | 106.4 | 0 | 0 | 0 | 115.1 | W142 L145 Y193 L197 L198 | W142-W195 HydrophobicContact CH2-CE3 4.24Å; W142-W195 HydrophobicContact CZ3-CD2 4.4Å; W142-W195 AromaticContact CZ3-CE3 3.91Å; W142-W195 HydrophobicContact CZ3-CE3 3.91Å; W142-W195 HydrophobicContact CZ3-CH2 4.3Å; W142-W195 AromaticContact CZ3-CZ3 3.86Å; W142-W195 HydrophobicContact CZ3-CZ3 3.86Å; L145-W195 HydrophobicContact CD2-CH2 4.06Å; L145-W195 HydrophobicContact CD2-CZ3 3.87Å; Y193-W195 VanDerWaalsContact C-N 3.25Å; Y193-W195 HydrophobicContact CD1-CZ2 4.07Å; Y193-W195 PolarHBondContact O-N 3.01Å; W195-L197 PolarHBondContact O-N 3.04Å; W195-L198 HydrophobicContact CE3-CD1 3.66Å; W195-L198 HydrophobicContact CE3-CG 4.33Å; W195-L198 HydrophobicContact CZ3-CD1 3.98Å; W195-L198 WeakPolarHBondContact O-CB 3.4Å; W195-L198 WeakPolarHBondContact O-CG 3.36Å; W195-L198 PolarHBondContact O-N 3.35Å; W195-L198 VanDerWaalsContact O-N 3.11Å |
| 196 | W | 98.5 | Very high | 98.3 | Very high | 171 Ų | 171 | 58.2 Ų | 58.2 | 65% | 0.648 | 29% | 0.288 | S | S | * | . | G | 310 helix | trans | -60.2 | -26.9 | 174.9 | -71.4 | 108.2 | 0 | 0 | 0 | 112.8 | F194 L198 L199 P200 F249 | F194-W196 HydrophobicContact CD2-CB 4.38Å; F194-W196 HydrophobicContact CE1-CB 4.01Å; F194-W196 HydrophobicContact CE2-CB 3.77Å; F194-W196 AromaticContact CE2-CD1 3.73Å; F194-W196 HydrophobicContact CE2-CG 4.13Å; F194-W196 HydrophobicContact CZ-CB 3.55Å; F194-W196 HydrophobicContact CZ-CG 4.26Å; F194-W196 PolarHBondContact O-N 2.97Å; W196-L198 PolarHBondContact O-N 2.84Å; W196-L199 HydrophobicContact CE3-CD1 3.65Å; W196-L199 HydrophobicContact CZ3-CD1 3.87Å; W196-L199 WeakPolarHBondContact O-CB 3.47Å; W196-L199 PolarHBondContact O-N 2.91Å; W196-L199 VanDerWaalsContact O-N 3.11Å; W196-P200 VanDerWaalsContact O-CD 3.24Å; W196-P200 WeakPolarHBondContact O-CD 3.49Å; W196-F249 HydrophobicContact CB-CE1 4.03Å; W196-F249 WeakPolarHBondContact O-CE1 3.4Å |
| 197 | L | 98.7 | Very high | 98.3 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 29% | 0.293 | C | S | . | . | G | 310 helix | trans | -60.2 | -23.6 | 176.6 | -166.2 | 66.9 | 0 | 0 | 0 | 112.9 | W142 A185 F194 W195 L199 P200 V201 | W142-L197 HydrophobicContact CZ2-CB 4.18Å; W142-L197 HydrophobicContact CZ2-CD2 4.16Å; A185-L197 HydrophobicContact CB-CD2 4.12Å; F194-L197 HydrophobicContact CD1-CB 3.86Å; F194-L197 HydrophobicContact CE1-CB 4.47Å; F194-L197 WeakPolarHBondContact O-CB 3.48Å; F194-L197 PolarHBondContact O-N 3.01Å; W195-L197 PolarHBondContact O-N 3.04Å; L197-L199 PolarHBondContact O-N 3.16Å; L197-P200 HydrophobicContact CD1-CG 4.24Å; L197-P200 WeakPolarHBondContact O-CD 3.5Å; L197-P200 VanDerWaalsContact O-CG 3.29Å; L197-P200 WeakPolarHBondContact O-CG 3.39Å; L197-V201 HydrophobicContact CG-CG2 4.22Å; L197-V201 WeakPolarHBondContact O-CB 3.43Å; L197-V201 VanDerWaalsContact O-CG2 3.23Å; L197-V201 WeakPolarHBondContact O-CG2 3.33Å; L197-V201 PolarHBondContact O-N 3.18Å |
| 198 | L | 98.8 | Very high | 98.4 | Very high | 39 Ų | 39 | 57 Ų | 57 | 20% | 0.204 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.3 | -30 | 176.7 | -59.4 | -170 | 0 | 0 | 0 | 112.1 | W142 T146 L149 W195 W196 V201 C202 | W142-L198 HydrophobicContact CH2-CD2 3.61Å; W142-L198 HydrophobicContact CH2-CG 4.07Å; W142-L198 HydrophobicContact CZ2-CD2 4.42Å; W142-L198 HydrophobicContact CZ3-CD2 4.06Å; T146-L198 HydrophobicContact CG2-CD2 3.93Å; L149-L198 HydrophobicContact CD2-CB 4.11Å; L149-L198 HydrophobicContact CD2-CD1 4.38Å; L149-L198 HydrophobicContact CD2-CD2 3.76Å; L149-L198 HydrophobicContact CD2-CG 4.29Å; W195-L198 HydrophobicContact CE3-CD1 3.66Å; W195-L198 HydrophobicContact CE3-CG 4.33Å; W195-L198 HydrophobicContact CZ3-CD1 3.98Å; W195-L198 WeakPolarHBondContact O-CB 3.4Å; W195-L198 WeakPolarHBondContact O-CG 3.36Å; W195-L198 PolarHBondContact O-N 3.35Å; W195-L198 VanDerWaalsContact O-N 3.11Å; W196-L198 PolarHBondContact O-N 2.84Å; L198-V201 PolarHBondContact O-N 3.37Å; L198-C202 WeakPolarHBondContact O-CB 3.23Å; L198-C202 PolarHBondContact O-N 3.43Å; L198-C202 PolarHBondContact O-SG 3.49Å |
| 199 | L | 98.7 | Very high | 98.4 | Very high | 105 Ų | 105 | 56.8 Ų | 56.8 | 55% | 0.55 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63.9 | -58.2 | 178.3 | -62.9 | -179.2 | 0 | 0 | 0 | 112.5 | W196 L197 V201 C202 A203 | W196-L199 HydrophobicContact CE3-CD1 3.65Å; W196-L199 HydrophobicContact CZ3-CD1 3.87Å; W196-L199 WeakPolarHBondContact O-CB 3.47Å; W196-L199 PolarHBondContact O-N 2.91Å; W196-L199 VanDerWaalsContact O-N 3.11Å; L197-L199 PolarHBondContact O-N 3.16Å; L199-V201 VanDerWaalsContact C-N 3.28Å; L199-V201 PolarHBondContact O-N 2.95Å; L199-C202 PolarHBondContact O-N 2.99Å; L199-A203 PolarHBondContact O-N 3.32Å |
| 200 | P | 98.7 | Very high | 98.4 | Very high | 16 Ų | 16 | 57.2 Ų | 57.2 | 10% | 0.104 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -66.1 | -30.6 | 176 | 28.5 | -36.7 | 0 | 0 | 0 | 111.9 | M184 W196 L197 C202 A203 M204 Y238 F249 | M184-P200 HydrophobicContact CE-CB 3.68Å; M184-P200 HydrophobicContact CE-CG 4.05Å; W196-P200 VanDerWaalsContact O-CD 3.24Å; W196-P200 WeakPolarHBondContact O-CD 3.49Å; L197-P200 HydrophobicContact CD1-CG 4.24Å; L197-P200 WeakPolarHBondContact O-CD 3.5Å; L197-P200 VanDerWaalsContact O-CG 3.29Å; L197-P200 WeakPolarHBondContact O-CG 3.39Å; P200-C202 PolarHBondContact O-N 2.98Å; P200-A203 PolarHBondContact O-N 3.18Å; P200-M204 WeakPolarHBondContact O-CB 3.43Å; P200-M204 VanDerWaalsContact O-CG 3.29Å; P200-M204 WeakPolarHBondContact O-CG 3.32Å; P200-M204 PolarHBondContact O-N 3.44Å; P200-Y238 HydrophobicContact CB-CD2 4.27Å; P200-Y238 HydrophobicContact CB-CE2 3.59Å; P200-Y238 HydrophobicContact CG-CE2 4.17Å; P200-F249 HydrophobicContact CG-CD1 3.9Å; P200-F249 HydrophobicContact CG-CE1 3.82Å; P200-F249 HydrophobicContact CG-CG 4.46Å; P200-F249 HydrophobicContact CG-CZ 4.31Å |
| 201 | V | 98.9 | Very high | 98.5 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.3 | -48.3 | 173.5 | 165.7 | 0 | 0 | 0 | 0 | 110.9 | L149 M184 L197 L198 L199 S205 | L149-V201 HydrophobicContact CD2-CG1 4.35Å; M184-V201 HydrophobicContact CB-CG2 4.05Å; M184-V201 HydrophobicContact CE-CB 4.47Å; M184-V201 HydrophobicContact CE-CG2 3.9Å; M184-V201 HydrophobicContact SD-CG2 3.97Å; L197-V201 HydrophobicContact CG-CG2 4.22Å; L197-V201 WeakPolarHBondContact O-CB 3.43Å; L197-V201 VanDerWaalsContact O-CG2 3.23Å; L197-V201 WeakPolarHBondContact O-CG2 3.33Å; L197-V201 PolarHBondContact O-N 3.18Å; L198-V201 PolarHBondContact O-N 3.37Å; L199-V201 VanDerWaalsContact C-N 3.28Å; L199-V201 PolarHBondContact O-N 2.95Å; V201-S205 WeakPolarHBondContact O-CB 3.3Å; V201-S205 PolarHBondContact O-N 3.35Å; V201-S205 PolarHBondContact O-OG 3.28Å |
| 202 | C | 98.9 | Very high | 98.6 | Very high | 38 Ų | 38 | 53.2 Ų | 53.2 | 26% | 0.257 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -59.6 | -50 | 174.4 | -71.7 | 0 | 0 | 0 | 0 | 111.2 | V153 L198 L199 P200 M204 S205 M206 | V153-C202 HydrophobicContact CG1-CB 4.5Å; V153-C202 WeakPolarHBondContact CG1-O 3.39Å; V153-C202 HydrophobicContact CG2-CB 4.4Å; L198-C202 WeakPolarHBondContact O-CB 3.23Å; L198-C202 PolarHBondContact O-N 3.43Å; L198-C202 PolarHBondContact O-SG 3.49Å; L199-C202 PolarHBondContact O-N 2.99Å; P200-C202 PolarHBondContact O-N 2.98Å; C202-M204 PolarHBondContact O-N 3.05Å; C202-S205 PolarHBondContact O-N 3.1Å; C202-M206 WeakPolarHBondContact O-CG 3.48Å; C202-M206 PolarHBondContact O-N 3.29Å |
| 203 | A | 98.8 | Very high | 98.7 | Very high | 50 Ų | 50 | 51.6 Ų | 51.6 | 41% | 0.413 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -58.5 | -47.9 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L199 P200 M206 | L199-A203 PolarHBondContact O-N 3.32Å; P200-A203 PolarHBondContact O-N 3.18Å; A203-M206 WeakPolarHBondContact O-CB 3.33Å; A203-M206 PolarHBondContact O-N 2.94Å |
| 204 | M | 98.8 | Very high | 98.7 | Very high | 21 Ų | 21 | 48.7 Ų | 48.7 | 10% | 0.103 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -69.4 | -34.8 | 179 | -62.8 | -49.2 | -55 | 0 | 0 | 112 | V180 M184 P200 C202 M206 T207 C208 A234 Y238 | V180-M204 HydrophobicContact CG1-CB 3.66Å; M184-M204 HydrophobicContact CE-CG 4.04Å; M184-M204 HydrophobicContact SD-CB 3.91Å; M184-M204 HydrophobicContact SD-CG 3.97Å; P200-M204 WeakPolarHBondContact O-CB 3.43Å; P200-M204 VanDerWaalsContact O-CG 3.29Å; P200-M204 WeakPolarHBondContact O-CG 3.32Å; P200-M204 PolarHBondContact O-N 3.44Å; C202-M204 PolarHBondContact O-N 3.05Å; M204-M206 VanDerWaalsContact C-N 3.31Å; M204-M206 PolarHBondContact O-N 3.3Å; M204-T207 WeakPolarHBondContact O-CB 3.41Å; M204-T207 PolarHBondContact O-N 2.98Å; M204-T207 VanDerWaalsContact O-N 3.07Å; M204-T207 PolarHBondContact O-OG1 3.24Å; M204-C208 PolarHBondContact O-N 3.42Å; M204-A234 HydrophobicContact CE-CB 3.82Å; M204-A234 WeakPolarHBondContact CE-O 3.47Å; M204-Y238 HydrophobicContact CG-CD2 4.08Å; M204-Y238 HydrophobicContact CG-CG 4.21Å; M204-Y238 HydrophobicContact SD-CD2 4.45Å |
| 205 | S | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -64.3 | -34.8 | 175.1 | -61.2 | 0 | 0 | 0 | 0 | 112.4 | G150 V201 C202 T207 C208 P209 | G150-S205 WeakPolarHBondContact CA-OG 3.37Å; V201-S205 WeakPolarHBondContact O-CB 3.3Å; V201-S205 PolarHBondContact O-N 3.35Å; V201-S205 PolarHBondContact O-OG 3.28Å; C202-S205 PolarHBondContact O-N 3.1Å; S205-T207 PolarHBondContact O-N 2.96Å; S205-C208 WeakPolarHBondContact O-CB 3.33Å; S205-C208 PolarHBondContact O-N 3.18Å; S205-P209 WeakPolarHBondContact O-CD 3.49Å |
| 206 | M | 98.8 | Very high | 98.6 | Very high | 97 Ų | 97 | 43.5 Ų | 43.5 | 48% | 0.478 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -64 | -26.4 | 173.1 | -66 | 172.2 | 69.8 | 0 | 0 | 112.7 | V153 T157 C202 A203 M204 C208 | V153-M206 HydrophobicContact CG1-CG 3.58Å; T157-M206 HydrophobicContact CG2-CB 4.27Å; T157-M206 WeakPolarHBondContact CG2-O 3.48Å; C202-M206 WeakPolarHBondContact O-CG 3.48Å; C202-M206 PolarHBondContact O-N 3.29Å; A203-M206 WeakPolarHBondContact O-CB 3.33Å; A203-M206 PolarHBondContact O-N 2.94Å; M204-M206 VanDerWaalsContact C-N 3.31Å; M204-M206 PolarHBondContact O-N 3.3Å; M206-C208 VanDerWaalsContact C-N 3.34Å |
| 207 | T | 98.8 | Very high | 98.6 | Very high | 36 Ų | 36 | 38.6 Ų | 38.6 | 22% | 0.221 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -76.7 | -21.4 | 176.7 | 74 | 0 | 0 | 0 | 0 | 113.1 | M204 S205 I210 F211 | M204-T207 WeakPolarHBondContact O-CB 3.41Å; M204-T207 PolarHBondContact O-N 2.98Å; M204-T207 VanDerWaalsContact O-N 3.07Å; M204-T207 PolarHBondContact O-OG1 3.24Å; S205-T207 PolarHBondContact O-N 2.96Å; T207-I210 WeakPolarHBondContact O-CB 3.06Å; T207-I210 PolarHBondContact O-N 2.97Å; T207-I210 VanDerWaalsContact O-N 3.09Å; T207-F211 WeakPolarHBondContact O-CD2 3.27Å; T207-F211 PolarHBondContact O-N 3.43Å |
| 208 | C | 98.8 | Very high | 98.6 | Very high | 1 Ų | 1 | 42.1 Ų | 42.1 | 1% | 0.007 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -59.8 | -47.7 | -173.9 | -72.2 | 0 | 0 | 0 | 0 | 112.9 | N176 A177 M204 S205 M206 I210 F211 S212 | N176-C208 HydrophobicContact CB-CB 4.31Å; A177-C208 HydrophobicContact CB-CB 4.09Å; M204-C208 PolarHBondContact O-N 3.42Å; S205-C208 WeakPolarHBondContact O-CB 3.33Å; S205-C208 PolarHBondContact O-N 3.18Å; M206-C208 VanDerWaalsContact C-N 3.34Å; C208-I210 VanDerWaalsContact C-N 3.25Å; C208-I210 PolarHBondContact O-N 3.32Å; C208-F211 PolarHBondContact O-N 2.71Å; C208-S212 WeakPolarHBondContact O-CB 3.48Å; C208-S212 PolarHBondContact O-N 3.19Å; C208-S212 PolarHBondContact O-OG 2.98Å; C208-S212 VanDerWaalsContact O-OG 3.05Å |
| 209 | P | 98.8 | Very high | 98.5 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.7 | -30.4 | 176.1 | -24.3 | 36.7 | 0 | 0 | 0 | 113.7 | S154 T157 A158 L161 Y173 S205 S213 | S154-P209 VanDerWaalsContact O-CG 3.27Å; S154-P209 WeakPolarHBondContact O-CG 3.29Å; S154-P209 WeakPolarHBondContact OG-CD 3.36Å; S154-P209 WeakPolarHBondContact OG-CG 3.48Å; T157-P209 HydrophobicContact CG2-CG 4.22Å; A158-P209 HydrophobicContact CB-CB 4.14Å; A158-P209 HydrophobicContact CB-CG 4.1Å; L161-P209 HydrophobicContact CD1-CB 4.45Å; Y173-P209 HydrophobicContact CD1-CB 3.74Å; Y173-P209 HydrophobicContact CD1-CG 4.32Å; Y173-P209 HydrophobicContact CE1-CB 4.11Å; S205-P209 WeakPolarHBondContact O-CD 3.49Å; P209-S213 VanDerWaalsContact O-CB 3.27Å; P209-S213 WeakPolarHBondContact O-CB 3.38Å; P209-S213 PolarHBondContact O-N 2.86Å |
| 210 | I | 98.7 | Very high | 98.4 | Very high | 97 Ų | 97 | 39.1 Ų | 39.1 | 50% | 0.497 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -66.1 | -51.7 | 176.8 | -55 | 175.5 | 0 | 0 | 0 | 109.5 | L161 T207 C208 S213 A214 | L161-I210 HydrophobicContact CD1-CG1 3.83Å; T207-I210 WeakPolarHBondContact O-CB 3.06Å; T207-I210 PolarHBondContact O-N 2.97Å; T207-I210 VanDerWaalsContact O-N 3.09Å; C208-I210 VanDerWaalsContact C-N 3.25Å; C208-I210 PolarHBondContact O-N 3.32Å; I210-S213 PolarHBondContact O-N 3.39Å; I210-A214 WeakPolarHBondContact O-CB 3.1Å; I210-A214 PolarHBondContact O-N 2.98Å |
| 211 | F | 98.7 | Very high | 98.4 | Very high | 52 Ų | 52 | 46.2 Ų | 46.2 | 23% | 0.228 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.2 | -46.1 | 175 | -77.4 | -60.2 | 0 | 0 | 0 | 111.7 | T207 C208 S213 A214 L215 P230 M233 A234 | T207-F211 WeakPolarHBondContact O-CD2 3.27Å; T207-F211 PolarHBondContact O-N 3.43Å; C208-F211 PolarHBondContact O-N 2.71Å; F211-S213 PolarHBondContact O-N 2.64Å; F211-A214 PolarHBondContact O-N 3.49Å; F211-L215 VanDerWaalsContact O-CB 3.29Å; F211-L215 WeakPolarHBondContact O-CB 3.39Å; F211-L215 VanDerWaalsContact O-CG 3.32Å; F211-L215 WeakPolarHBondContact O-CG 3.25Å; F211-L215 PolarHBondContact O-N 2.75Å; F211-P230 HydrophobicContact CB-CB 3.67Å; F211-P230 HydrophobicContact CB-CG 4.34Å; F211-M233 HydrophobicContact CD1-CB 4.25Å; F211-M233 HydrophobicContact CD1-SD 3.98Å; F211-M233 HydrophobicContact CE1-CB 4.09Å; F211-M233 HydrophobicContact CE1-SD 4.23Å; F211-M233 HydrophobicContact CZ-CB 4.23Å; F211-A234 HydrophobicContact CD2-CB 4.32Å; F211-A234 HydrophobicContact CE2-CB 4.12Å |
| 212 | S | 98.4 | Very high | 98.3 | Very high | 6 Ų | 6 | 53.6 Ų | 53.6 | 4% | 0.042 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -56.5 | -48.5 | 176.9 | -68 | 0 | 0 | 0 | 0 | 111.7 | C208 N216 P230 | C208-S212 WeakPolarHBondContact O-CB 3.48Å; C208-S212 PolarHBondContact O-N 3.19Å; C208-S212 PolarHBondContact O-OG 2.98Å; C208-S212 VanDerWaalsContact O-OG 3.05Å; S212-N216 WeakPolarHBondContact O-CB 3.43Å; S212-N216 PolarHBondContact O-N 2.94Å; S212-P230 WeakPolarHBondContact OG-CG 3.4Å |
| 213 | S | 98.4 | Very high | 98.2 | Very high | 46 Ų | 46 | 54.6 Ų | 54.6 | 32% | 0.322 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 179.1 | -174.8 | 0 | 0 | 0 | 0 | 112 | Q163 P209 I210 F211 N216 S217 | Q163-S213 PolarHBondContact OE1-OG 3.28Å; P209-S213 VanDerWaalsContact O-CB 3.27Å; P209-S213 WeakPolarHBondContact O-CB 3.38Å; P209-S213 PolarHBondContact O-N 2.86Å; I210-S213 PolarHBondContact O-N 3.39Å; F211-S213 PolarHBondContact O-N 2.64Å; S213-N216 PolarHBondContact O-N 2.87Å; S213-S217 PolarHBondContact O-N 3.2Å |
| 214 | A | 98.5 | Very high | 98.2 | Very high | 54 Ų | 54 | 52.3 Ų | 52.3 | 45% | 0.446 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.2 | -48.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | I210 F211 N216 S217 | I210-A214 WeakPolarHBondContact O-CB 3.1Å; I210-A214 PolarHBondContact O-N 2.98Å; F211-A214 PolarHBondContact O-N 3.49Å; A214-N216 PolarHBondContact O-N 2.72Å; A214-S217 PolarHBondContact O-N 2.94Å; A214-S217 PolarHBondContact O-OG 3.29Å |
| 215 | L | 98.4 | Very high | 98.1 | Very high | 28 Ų | 28 | 52.1 Ų | 52.1 | 15% | 0.147 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.9 | -41.6 | 177.1 | -73 | 166.1 | 0 | 0 | 0 | 111.7 | F211 S217 V218 L219 V226 L229 P230 M233 | F211-L215 VanDerWaalsContact O-CB 3.29Å; F211-L215 WeakPolarHBondContact O-CB 3.39Å; F211-L215 VanDerWaalsContact O-CG 3.32Å; F211-L215 WeakPolarHBondContact O-CG 3.25Å; F211-L215 PolarHBondContact O-N 2.75Å; L215-S217 VanDerWaalsContact C-N 3.29Å; L215-S217 PolarHBondContact O-N 3.5Å; L215-V218 PolarHBondContact O-N 3.07Å; L215-V218 VanDerWaalsContact O-N 3.12Å; L215-L219 WeakPolarHBondContact O-CB 3.4Å; L215-L219 PolarHBondContact O-N 3.07Å; L215-V226 HydrophobicContact CB-CB 4.19Å; L215-V226 HydrophobicContact CB-CG1 3.7Å; L215-L229 HydrophobicContact CD1-CB 3.61Å; L215-L229 HydrophobicContact CD1-CD1 4.49Å; L215-L229 HydrophobicContact CD2-CD1 4.33Å; L215-P230 HydrophobicContact CD1-CG 3.89Å; L215-M233 HydrophobicContact CD1-CE 4.37Å; L215-M233 HydrophobicContact CD1-SD 4.01Å; L215-M233 HydrophobicContact CD2-CE 3.95Å; L215-M233 HydrophobicContact CD2-SD 4.42Å |
| 216 | N | 97.3 | Very high | 98.1 | Very high | 56 Ų | 56 | 52.9 Ų | 52.9 | 30% | 0.299 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.2 | -36.9 | 178.3 | -168.3 | 52 | 0 | 0 | 0 | 111.3 | S212 S213 A214 V218 S220 V226 | S212-N216 WeakPolarHBondContact O-CB 3.43Å; S212-N216 PolarHBondContact O-N 2.94Å; S213-N216 PolarHBondContact O-N 2.87Å; A214-N216 PolarHBondContact O-N 2.72Å; N216-V218 PolarHBondContact O-N 3.44Å; N216-S220 WeakPolarHBondContact O-CB 3.1Å; N216-S220 PolarHBondContact O-N 2.95Å; N216-S220 PolarHBondContact O-OG 3.16Å; N216-V226 HydrophobicContact CB-CG1 3.81Å; N216-V226 VanDerWaalsContact N-CG1 3.35Å |
| 217 | S | 97.8 | Very high | 98.1 | Very high | 69 Ų | 69 | 48.4 Ų | 48.4 | 48% | 0.483 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.6 | -24.8 | 176.8 | 80.5 | 0 | 0 | 0 | 0 | 113.7 | S213 A214 L215 K221 | S213-S217 PolarHBondContact O-N 3.2Å; A214-S217 PolarHBondContact O-N 2.94Å; A214-S217 PolarHBondContact O-OG 3.29Å; L215-S217 VanDerWaalsContact C-N 3.29Å; L215-S217 PolarHBondContact O-N 3.5Å; S217-K221 WeakPolarHBondContact O-CE 3.37Å |
| 218 | V | 98.3 | Very high | 98.1 | Very high | 73 Ų | 73 | 46.7 Ų | 46.7 | 44% | 0.442 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -91.6 | -60.1 | 176.4 | 179.8 | 0 | 0 | 0 | 0 | 109.5 | L215 N216 S220 K221 W222 | L215-V218 PolarHBondContact O-N 3.07Å; L215-V218 VanDerWaalsContact O-N 3.12Å; N216-V218 PolarHBondContact O-N 3.44Å; V218-S220 PolarHBondContact O-N 3.39Å; V218-K221 WeakPolarHBondContact O-CB 3.49Å; V218-K221 WeakPolarHBondContact O-CG 3.3Å; V218-K221 PolarHBondContact O-N 2.96Å; V218-W222 HydrophobicContact CG1-CZ3 3.84Å; V218-W222 WeakPolarHBondContact O-CZ3 3.28Å |
| 219 | L | 98.1 | Very high | 98.1 | Very high | 26 Ų | 26 | 47.2 Ų | 47.2 | 14% | 0.136 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68.1 | -30.2 | -170 | -68 | 174.8 | 0 | 0 | 0 | 113.6 | L215 K221 W222 D223 L224 V226 L229 | L215-L219 WeakPolarHBondContact O-CB 3.4Å; L215-L219 PolarHBondContact O-N 3.07Å; L219-K221 PolarHBondContact O-N 2.84Å; L219-W222 CarbonylContact O-C 3Å; L219-W222 PolarHBondContact O-N 3.5Å; L219-D223 PolarHBondContact O-N 3.24Å; L219-L224 CarbonylContact C-O 3.37Å; L219-L224 HydrophobicContact CB-CB 4.04Å; L219-L224 WeakPolarHBondContact CB-O 3.09Å; L219-L224 HydrophobicContact CD2-CB 4.34Å; L219-L224 HydrophobicContact CD2-CD1 4.27Å; L219-L224 PolarHBondContact O-N 3.5Å; L219-V226 HydrophobicContact CD1-CG1 4.33Å; L219-L229 HydrophobicContact CD1-CD1 4.02Å |
| 220 | S | 96.6 | Very high | 98.1 | Very high | 56 Ų | 56 | 47.2 Ų | 47.2 | 39% | 0.392 | 26% | 0.255 | S | S | . | . | G | 310 helix | trans | -63.2 | -23.1 | 176 | 63.7 | 0 | 0 | 0 | 0 | 113.2 | N216 V218 W222 D223 | N216-S220 WeakPolarHBondContact O-CB 3.1Å; N216-S220 PolarHBondContact O-N 2.95Å; N216-S220 PolarHBondContact O-OG 3.16Å; V218-S220 PolarHBondContact O-N 3.39Å; S220-W222 PolarHBondContact O-N 2.95Å; S220-D223 PolarHBondContact O-N 3.03Å |
| 221 | K | 97.2 | Very high | 98.1 | Very high | 164 Ų | 164 | 42.7 Ų | 42.7 | 71% | 0.713 | 23% | 0.231 | S | C | * | . | G | 310 helix | trans | -63.8 | -24.4 | 174.4 | -60.8 | -179.1 | 179.6 | 179.7 | 0 | 112.8 | S217 V218 L219 | S217-K221 WeakPolarHBondContact O-CE 3.37Å; V218-K221 WeakPolarHBondContact O-CB 3.49Å; V218-K221 WeakPolarHBondContact O-CG 3.3Å; V218-K221 PolarHBondContact O-N 2.96Å; L219-K221 PolarHBondContact O-N 2.84Å |
| 222 | W | 97.2 | Very high | 98.1 | Very high | 156 Ų | 156 | 40.2 Ų | 40.2 | 59% | 0.591 | 22% | 0.221 | S | C | * | . | G | 310 helix | trans | -107 | 12.7 | 173.3 | -65.2 | -89.6 | 0 | 0 | 0 | 112.2 | V218 L219 S220 L224 K412 | V218-W222 HydrophobicContact CG1-CZ3 3.84Å; V218-W222 WeakPolarHBondContact O-CZ3 3.28Å; L219-W222 CarbonylContact O-C 3Å; L219-W222 PolarHBondContact O-N 3.5Å; S220-W222 PolarHBondContact O-N 2.95Å; W222-L224 VanDerWaalsContact C-N 3.27Å; W222-L224 HydrophobicContact CB-CD1 3.9Å; W222-L224 HydrophobicContact CB-CG 4.06Å; W222-L224 PolarHBondContact O-N 3.38Å; W222-K412 PolarHBondContact O-NZ 3.3Å |
| 223 | D | 97.4 | Very high | 98.2 | Very high | 58 Ų | 58 | 42.8 Ų | 42.8 | 31% | 0.31 | 23% | 0.233 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 52.8 | 45.3 | -175.1 | -162.4 | 44.6 | 0 | 0 | 0 | 111.4 | L219 S220 K412 P414 L415 | L219-D223 PolarHBondContact O-N 3.24Å; S220-D223 PolarHBondContact O-N 3.03Å; D223-K412 WeakPolarHBondContact O-CE 3.38Å; D223-K412 PolarHBondContact O-NZ 3.46Å; D223-P414 VanDerWaalsContact OD2-CA 3.29Å; D223-P414 WeakPolarHBondContact OD2-CA 3.49Å; D223-L415 VanDerWaalsContact C-CD1 3.4Å; D223-L415 VanDerWaalsContact OD1-CB 3.27Å; D223-L415 WeakPolarHBondContact OD1-CB 3.35Å; D223-L415 VanDerWaalsContact OD1-CG 3.25Å; D223-L415 WeakPolarHBondContact OD1-CG 3.46Å; D223-L415 PolarHBondContact OD1-N 2.84Å; D223-L415 PolarHBondContact OD2-N 2.91Å; D223-L415 VanDerWaalsContact OD2-N 3.17Å |
| 224 | L | 98.2 | Very high | 98.2 | Very high | 2 Ų | 2 | 40.6 Ų | 40.6 | 1% | 0.01 | 22% | 0.217 | C | C | . | . | trans | -110.9 | 139.9 | 179 | -68 | 171.1 | 0 | 0 | 0 | 111.3 | L219 W222 L398 L401 M402 | L219-L224 CarbonylContact C-O 3.37Å; L219-L224 HydrophobicContact CB-CB 4.04Å; L219-L224 WeakPolarHBondContact CB-O 3.09Å; L219-L224 HydrophobicContact CD2-CB 4.34Å; L219-L224 HydrophobicContact CD2-CD1 4.27Å; L219-L224 PolarHBondContact O-N 3.5Å; W222-L224 VanDerWaalsContact C-N 3.27Å; W222-L224 HydrophobicContact CB-CD1 3.9Å; W222-L224 HydrophobicContact CB-CG 4.06Å; W222-L224 PolarHBondContact O-N 3.38Å; L224-L398 HydrophobicContact CB-CD2 4.03Å; L224-L398 HydrophobicContact CD1-CD2 4.23Å; L224-L398 HydrophobicContact CD2-CD2 4.27Å; L224-L398 HydrophobicContact CG-CD2 4.41Å; L224-L401 HydrophobicContact CD2-CB 3.58Å; L224-L401 HydrophobicContact CD2-CD1 4.25Å; L224-M402 HydrophobicContact CD1-CG 3.61Å; L224-M402 HydrophobicContact CD1-SD 4Å; L224-M402 HydrophobicContact CD2-CG 4.39Å | ||
| 225 | P | 98.1 | Very high | 98.2 | Very high | 18 Ų | 18 | 38.1 Ų | 38.1 | 12% | 0.117 | 20% | 0.196 | C | C | . | . | trans | -77 | 157.6 | 176.7 | 34.9 | -35.5 | 0 | 0 | 0 | 110.6 | F227 F352 L401 L415 | P225-F227 VanDerWaalsContact C-N 3.32Å; P225-F227 HydrophobicContact CB-CD1 4.22Å; P225-F227 HydrophobicContact CB-CE1 4.2Å; P225-F227 HydrophobicContact CG-CD1 3.77Å; P225-F227 HydrophobicContact CG-CD2 4.19Å; P225-F227 HydrophobicContact CG-CE1 3.37Å; P225-F227 HydrophobicContact CG-CE2 3.8Å; P225-F227 HydrophobicContact CG-CG 4.18Å; P225-F227 HydrophobicContact CG-CZ 3.38Å; P225-F352 HydrophobicContact CB-CE1 3.85Å; P225-F352 HydrophobicContact CB-CZ 4.23Å; P225-F352 HydrophobicContact CG-CD1 4Å; P225-F352 HydrophobicContact CG-CE1 3.75Å; P225-F352 HydrophobicContact CG-CZ 4.14Å; P225-L401 HydrophobicContact CG-CD1 4.32Å; P225-L415 HydrophobicContact CB-CD2 4.28Å; P225-L415 HydrophobicContact CG-CD2 4.48Å | ||
| 226 | V | 98.4 | Very high | 98.2 | Very high | 16 Ų | 16 | 37.7 Ų | 37.7 | 10% | 0.097 | 20% | 0.196 | C | C | . | . | trans | -77.2 | -17.8 | 177 | -58 | 0 | 0 | 0 | 0 | 113.7 | L215 N216 L219 L229 P230 | L215-V226 HydrophobicContact CB-CB 4.19Å; L215-V226 HydrophobicContact CB-CG1 3.7Å; N216-V226 HydrophobicContact CB-CG1 3.81Å; N216-V226 VanDerWaalsContact N-CG1 3.35Å; L219-V226 HydrophobicContact CD1-CG1 4.33Å; V226-L229 VanDerWaalsContact O-CB 3.27Å; V226-L229 WeakPolarHBondContact O-CB 3.36Å; V226-L229 WeakPolarHBondContact O-CG 3.29Å; V226-L229 PolarHBondContact O-N 2.98Å; V226-P230 HydrophobicContact CG2-CG 4.3Å | ||
| 227 | F | 98.7 | Very high | 98.3 | Very high | 2 Ų | 2 | 40.7 Ų | 40.7 | 1% | 0.009 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 47.5 | -146.9 | -174 | -65.3 | -46.4 | 0 | 0 | 0 | 112.4 | F122 Y175 N176 P225 L229 P230 A347 F352 F393 T397 L398 L401 | F122-F227 AromaticContact CE1-CD1 3.83Å; F122-F227 HydrophobicContact CE1-CD1 3.83Å; F122-F227 HydrophobicContact CE1-CE1 4.09Å; F122-F227 HydrophobicContact CZ-CD1 4.42Å; Y175-F227 WeakPolarHBondContact CE2-O 3.48Å; Y175-F227 PolarHBondContact OH-O 3.5Å; N176-F227 PolarHBondContact ND2-O 3.11Å; P225-F227 VanDerWaalsContact C-N 3.32Å; P225-F227 HydrophobicContact CB-CD1 4.22Å; P225-F227 HydrophobicContact CB-CE1 4.2Å; P225-F227 HydrophobicContact CG-CD1 3.77Å; P225-F227 HydrophobicContact CG-CD2 4.19Å; P225-F227 HydrophobicContact CG-CE1 3.37Å; P225-F227 HydrophobicContact CG-CE2 3.8Å; P225-F227 HydrophobicContact CG-CG 4.18Å; P225-F227 HydrophobicContact CG-CZ 3.38Å; F227-L229 PolarHBondContact O-N 2.7Å; F227-P230 WeakPolarHBondContact O-CD 3.2Å; F227-A347 HydrophobicContact CE1-CB 4.43Å; F227-F352 HydrophobicContact CD1-CE2 4.47Å; F227-F352 AromaticContact CE1-CD2 3.92Å; F227-F352 HydrophobicContact CE1-CD2 3.92Å; F227-F352 AromaticContact CE1-CE2 3.55Å; F227-F352 HydrophobicContact CE1-CE2 3.55Å; F227-F352 AromaticContact CE1-CZ 3.9Å; F227-F352 HydrophobicContact CE1-CZ 3.9Å; F227-F352 HydrophobicContact CZ-CD2 4.28Å; F227-F352 HydrophobicContact CZ-CE2 4.35Å; F227-F393 HydrophobicContact CB-CE1 3.82Å; F227-F393 HydrophobicContact CB-CZ 3.92Å; F227-F393 HydrophobicContact CD1-CE1 4.35Å; F227-F393 AromaticContact CD1-CZ 3.62Å; F227-F393 HydrophobicContact CD1-CZ 3.62Å; F227-F393 HydrophobicContact CD2-CZ 4.2Å; F227-F393 HydrophobicContact CE1-CZ 4.05Å; F227-F393 HydrophobicContact CG-CE1 4.11Å; F227-F393 AromaticContact CG-CZ 3.68Å; F227-F393 HydrophobicContact CG-CZ 3.68Å; F227-T397 HydrophobicContact CE1-CG2 4.37Å; F227-T397 HydrophobicContact CE2-CG2 3.64Å; F227-T397 HydrophobicContact CZ-CG2 3.41Å; F227-T397 VanDerWaalsContact CZ-CG2 3.41Å; F227-L398 HydrophobicContact CD2-CD1 4.5Å; F227-L398 HydrophobicContact CD2-CD2 3.96Å; F227-L398 HydrophobicContact CD2-CG 3.85Å; F227-L398 HydrophobicContact CE2-CD2 3.82Å; F227-L398 HydrophobicContact CE2-CG 3.88Å; F227-L401 HydrophobicContact CE2-CD1 4.07Å; F227-L401 HydrophobicContact CZ-CD1 3.68Å |
| 228 | T | 98.7 | Very high | 98.3 | Very high | 1 Ų | 1 | 38.2 Ų | 38.2 | 1% | 0.006 | 19% | 0.19 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.9 | 19.2 | 177.9 | 57.5 | 0 | 0 | 0 | 0 | 112.6 | Y175 N176 L179 F231 N232 T390 F393 C394 | Y175-T228 HydrophobicContact CD2-CG2 4.3Å; Y175-T228 HydrophobicContact CE2-CG2 4.06Å; N176-T228 VanDerWaalsContact OD1-CA 3.28Å; N176-T228 WeakPolarHBondContact OD1-CA 3.49Å; L179-T228 HydrophobicContact CD1-CG2 3.6Å; T228-F231 WeakPolarHBondContact O-CB 3.4Å; T228-F231 PolarHBondContact O-N 3.08Å; T228-N232 PolarHBondContact O-N 3.4Å; T228-N232 PolarHBondContact O-ND2 3.06Å; T228-N232 PolarHBondContact OG1-ND2 2.86Å; T228-T390 PolarHBondContact OG1-OG1 3.33Å; T228-F393 HydrophobicContact CG2-CE1 4.41Å; T228-C394 PolarHBondContact OG1-SG 3.29Å |
| 229 | L | 98.9 | Very high | 98.3 | Very high | 11 Ų | 11 | 35.5 Ų | 35.5 | 6% | 0.058 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -56.9 | -43.2 | 174.8 | -70.9 | 174.3 | 0 | 0 | 0 | 112.6 | L215 L219 V226 F227 F231 N232 M233 W391 C394 L398 | L215-L229 HydrophobicContact CD1-CB 3.61Å; L215-L229 HydrophobicContact CD1-CD1 4.49Å; L215-L229 HydrophobicContact CD2-CD1 4.33Å; L219-L229 HydrophobicContact CD1-CD1 4.02Å; V226-L229 VanDerWaalsContact O-CB 3.27Å; V226-L229 WeakPolarHBondContact O-CB 3.36Å; V226-L229 WeakPolarHBondContact O-CG 3.29Å; V226-L229 PolarHBondContact O-N 2.98Å; F227-L229 PolarHBondContact O-N 2.7Å; L229-F231 VanDerWaalsContact C-N 3.34Å; L229-F231 PolarHBondContact O-N 2.95Å; L229-N232 PolarHBondContact O-N 3.17Å; L229-M233 WeakPolarHBondContact O-CB 3.25Å; L229-M233 VanDerWaalsContact O-CG 3.3Å; L229-M233 WeakPolarHBondContact O-CG 3.45Å; L229-M233 PolarHBondContact O-N 3.04Å; L229-W391 HydrophobicContact CD2-CE3 3.9Å; L229-W391 HydrophobicContact CD2-CH2 4.31Å; L229-W391 HydrophobicContact CD2-CZ3 3.5Å; L229-W391 VanDerWaalsContact CD2-CZ3 3.5Å; L229-C394 HydrophobicContact CD2-CB 3.56Å; L229-C394 HydrophobicContact CG-CB 3.91Å; L229-L398 HydrophobicContact CD1-CD1 3.82Å |
| 230 | P | 98.9 | Very high | 98.3 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -57 | -45.2 | 175.3 | -23.4 | 32.2 | 0 | 0 | 0 | 113 | N176 F211 S212 L215 V226 F227 A234 | N176-P230 HydrophobicContact CB-CB 4Å; N176-P230 WeakPolarHBondContact OD1-CD 3.48Å; F211-P230 HydrophobicContact CB-CB 3.67Å; F211-P230 HydrophobicContact CB-CG 4.34Å; S212-P230 WeakPolarHBondContact OG-CG 3.4Å; L215-P230 HydrophobicContact CD1-CG 3.89Å; V226-P230 HydrophobicContact CG2-CG 4.3Å; F227-P230 WeakPolarHBondContact O-CD 3.2Å; P230-A234 VanDerWaalsContact O-CB 3.3Å; P230-A234 WeakPolarHBondContact O-CB 3.47Å; P230-A234 PolarHBondContact O-N 3.23Å |
| 231 | F | 98.9 | Very high | 98.4 | Very high | 2 Ų | 2 | 38.9 Ų | 38.9 | 1% | 0.009 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.5 | -51.8 | 174.5 | 152.1 | -106.5 | 0 | 0 | 0 | 111.7 | N176 L179 V180 L183 T228 L229 M233 A234 L235 C389 T390 | N176-F231 HydrophobicContact CB-CB 4.11Å; N176-F231 VanDerWaalsContact OD1-CB 3.28Å; N176-F231 WeakPolarHBondContact OD1-CB 3.48Å; N176-F231 PolarHBondContact OD1-N 3.06Å; L179-F231 HydrophobicContact CB-CB 4.23Å; L179-F231 HydrophobicContact CB-CD1 4.16Å; L179-F231 HydrophobicContact CB-CD2 3.28Å; L179-F231 HydrophobicContact CB-CE1 4.39Å; L179-F231 HydrophobicContact CB-CE2 3.55Å; L179-F231 HydrophobicContact CB-CG 3.6Å; L179-F231 HydrophobicContact CB-CZ 4.11Å; L179-F231 HydrophobicContact CD1-CB 4.31Å; L179-F231 HydrophobicContact CD1-CD1 3.79Å; L179-F231 HydrophobicContact CD1-CD2 4.4Å; L179-F231 HydrophobicContact CD1-CE1 4.22Å; L179-F231 HydrophobicContact CD1-CG 3.89Å; L179-F231 HydrophobicContact CG-CD2 4.48Å; L179-F231 HydrophobicContact CG-CG 4.43Å; V180-F231 HydrophobicContact CB-CD2 4.5Å; V180-F231 HydrophobicContact CG2-CB 4.42Å; V180-F231 HydrophobicContact CG2-CD2 3.79Å; L183-F231 HydrophobicContact CB-CE2 4.05Å; L183-F231 HydrophobicContact CB-CZ 4.29Å; L183-F231 HydrophobicContact CD2-CE2 4.25Å; L183-F231 HydrophobicContact CD2-CZ 4.21Å; L183-F231 HydrophobicContact CG-CE2 4.16Å; L183-F231 HydrophobicContact CG-CZ 3.99Å; T228-F231 WeakPolarHBondContact O-CB 3.4Å; T228-F231 PolarHBondContact O-N 3.08Å; L229-F231 VanDerWaalsContact C-N 3.34Å; L229-F231 PolarHBondContact O-N 2.95Å; F231-M233 VanDerWaalsContact C-N 3.35Å; F231-M233 PolarHBondContact O-N 3.2Å; F231-A234 PolarHBondContact O-N 3.29Å; F231-L235 HydrophobicContact CD2-CB 4.36Å; F231-L235 HydrophobicContact CE2-CB 4.02Å; F231-L235 HydrophobicContact CE2-CD2 3.6Å; F231-L235 HydrophobicContact CE2-CG 4.37Å; F231-L235 HydrophobicContact CZ-CD2 3.67Å; F231-L235 WeakPolarHBondContact O-CB 3.38Å; F231-L235 PolarHBondContact O-N 3.07Å; F231-C389 HydrophobicContact CE1-CB 3.9Å; F231-C389 HydrophobicContact CZ-CB 4Å; F231-T390 WeakPolarHBondContact CE1-OG1 3.29Å |
| 232 | N | 98.9 | Very high | 98.5 | Very high | 1 Ų | 1 | 32.1 Ų | 32.1 | 1% | 0.005 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.5 | -40.6 | -175.5 | -78 | -65.6 | 0 | 0 | 0 | 111.4 | T228 L229 S236 C389 T390 W391 | T228-N232 PolarHBondContact O-N 3.4Å; T228-N232 PolarHBondContact O-ND2 3.06Å; T228-N232 PolarHBondContact OG1-ND2 2.86Å; L229-N232 PolarHBondContact O-N 3.17Å; N232-S236 VanDerWaalsContact O-CB 3.22Å; N232-S236 WeakPolarHBondContact O-CB 3.17Å; N232-S236 PolarHBondContact O-N 2.95Å; N232-S236 PolarHBondContact O-OG 2.9Å; N232-C389 WeakPolarHBondContact OD1-CB 3.45Å; N232-T390 PolarHBondContact ND2-O 3Å; N232-T390 PolarHBondContact ND2-OG1 3.14Å; N232-T390 PolarHBondContact OD1-N 3.41Å; N232-T390 PolarHBondContact OD1-OG1 3.22Å; N232-W391 HydrophobicContact CB-CD2 3.79Å; N232-W391 HydrophobicContact CB-CE3 4.47Å; N232-W391 HydrophobicContact CB-CG 3.96Å; N232-W391 HydrophobicContact CB-CZ2 3.99Å; N232-W391 PolarHBondContact ND2-N 3.28Å; N232-W391 PolarHBondContact OD1-N 2.87Å; N232-W391 VanDerWaalsContact OD1-N 3.12Å |
| 233 | M | 98.9 | Very high | 98.4 | Very high | 60 Ų | 60 | 25.9 Ų | 25.9 | 30% | 0.296 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -63.1 | -48.5 | 174.2 | -71.4 | -179 | 176.9 | 0 | 0 | 111.9 | F211 L215 L229 F231 M237 W391 | F211-M233 HydrophobicContact CD1-CB 4.25Å; F211-M233 HydrophobicContact CD1-SD 3.98Å; F211-M233 HydrophobicContact CE1-CB 4.09Å; F211-M233 HydrophobicContact CE1-SD 4.23Å; F211-M233 HydrophobicContact CZ-CB 4.23Å; L215-M233 HydrophobicContact CD1-CE 4.37Å; L215-M233 HydrophobicContact CD1-SD 4.01Å; L215-M233 HydrophobicContact CD2-CE 3.95Å; L215-M233 HydrophobicContact CD2-SD 4.42Å; L229-M233 WeakPolarHBondContact O-CB 3.25Å; L229-M233 VanDerWaalsContact O-CG 3.3Å; L229-M233 WeakPolarHBondContact O-CG 3.45Å; L229-M233 PolarHBondContact O-N 3.04Å; F231-M233 VanDerWaalsContact C-N 3.35Å; F231-M233 PolarHBondContact O-N 3.2Å; M233-M237 WeakPolarHBondContact O-CB 3.4Å; M233-M237 PolarHBondContact O-N 3.43Å; M233-W391 HydrophobicContact CE-CH2 3.94Å; M233-W391 HydrophobicContact CG-CH2 3.63Å; M233-W391 HydrophobicContact CG-CZ2 3.85Å |
| 234 | A | 98.8 | Very high | 98.5 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.4 | -49.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | V180 M204 F211 P230 F231 M237 Y238 | V180-A234 HydrophobicContact CG2-CB 3.98Å; M204-A234 HydrophobicContact CE-CB 3.82Å; M204-A234 WeakPolarHBondContact CE-O 3.47Å; F211-A234 HydrophobicContact CD2-CB 4.32Å; F211-A234 HydrophobicContact CE2-CB 4.12Å; P230-A234 VanDerWaalsContact O-CB 3.3Å; P230-A234 WeakPolarHBondContact O-CB 3.47Å; P230-A234 PolarHBondContact O-N 3.23Å; F231-A234 PolarHBondContact O-N 3.29Å; A234-M237 PolarHBondContact O-N 3.33Å; A234-Y238 WeakPolarHBondContact O-CB 3.36Å; A234-Y238 PolarHBondContact O-N 3.37Å |
| 235 | L | 98.8 | Very high | 98.4 | Very high | 1 Ų | 1 | 35.2 Ų | 35.2 | 1% | 0.005 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -67.1 | -43.8 | -178.3 | -174.4 | 68.8 | 0 | 0 | 0 | 112 | L183 M184 F187 F231 M237 Y238 L239 C389 | L183-L235 HydrophobicContact CB-CD1 4.38Å; L183-L235 HydrophobicContact CB-CD2 3.66Å; L183-L235 HydrophobicContact CG-CD2 4.4Å; M184-L235 HydrophobicContact CG-CD1 3.74Å; F187-L235 HydrophobicContact CD2-CD2 4.2Å; F187-L235 HydrophobicContact CE2-CD2 4.22Å; F231-L235 HydrophobicContact CD2-CB 4.36Å; F231-L235 HydrophobicContact CE2-CB 4.02Å; F231-L235 HydrophobicContact CE2-CD2 3.6Å; F231-L235 HydrophobicContact CE2-CG 4.37Å; F231-L235 HydrophobicContact CZ-CD2 3.67Å; F231-L235 WeakPolarHBondContact O-CB 3.38Å; F231-L235 PolarHBondContact O-N 3.07Å; L235-M237 VanDerWaalsContact C-N 3.32Å; L235-M237 PolarHBondContact O-N 3.44Å; L235-Y238 HydrophobicContact CD1-CD1 4.45Å; L235-Y238 PolarHBondContact O-N 3.36Å; L235-L239 HydrophobicContact CD1-CD1 4.05Å; L235-L239 HydrophobicContact CD1-CG 4.03Å; L235-L239 HydrophobicContact CD2-CD1 4.3Å; L235-L239 HydrophobicContact CG-CD1 3.85Å; L235-L239 HydrophobicContact CG-CG 4.18Å; L235-L239 WeakPolarHBondContact O-CB 3.37Å; L235-L239 WeakPolarHBondContact O-CG 3.39Å; L235-L239 PolarHBondContact O-N 3.44Å; L235-C389 VanDerWaalsContact CD2-SG 3.55Å |
| 236 | S | 98.8 | Very high | 98.4 | Very high | 20 Ų | 20 | 36.4 Ų | 36.4 | 14% | 0.14 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.2 | -43.4 | 175 | -65.9 | 0 | 0 | 0 | 0 | 111.2 | N232 S240 W391 | N232-S236 VanDerWaalsContact O-CB 3.22Å; N232-S236 WeakPolarHBondContact O-CB 3.17Å; N232-S236 PolarHBondContact O-N 2.95Å; N232-S236 PolarHBondContact O-OG 2.9Å; S236-S240 WeakPolarHBondContact O-CB 3.35Å; S236-S240 PolarHBondContact O-N 3.49Å; S236-S240 PolarHBondContact O-OG 3.37Å; S236-S240 VanDerWaalsContact O-OG 3.08Å; S236-W391 PolarHBondContact OG-NE1 2.89Å; S236-W391 VanDerWaalsContact OG-NE1 3.11Å |
| 237 | M | 98.6 | Very high | 98.4 | Very high | 119 Ų | 119 | 40.9 Ų | 40.9 | 59% | 0.586 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -59.8 | -47.5 | 175.6 | 179.9 | -179.3 | 178.1 | 0 | 0 | 111.9 | M233 A234 L235 A241 | M233-M237 WeakPolarHBondContact O-CB 3.4Å; M233-M237 PolarHBondContact O-N 3.43Å; A234-M237 PolarHBondContact O-N 3.33Å; L235-M237 VanDerWaalsContact C-N 3.32Å; L235-M237 PolarHBondContact O-N 3.44Å; M237-A241 VanDerWaalsContact O-CB 3.27Å; M237-A241 WeakPolarHBondContact O-CB 3.35Å; M237-A241 PolarHBondContact O-N 3.18Å |
| 238 | Y | 98.8 | Very high | 98.3 | Very high | 16 Ų | 16 | 47.9 Ų | 47.9 | 6% | 0.063 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62 | -52.5 | 178.7 | 169.5 | -104 | 0 | 0 | 0 | 112.1 | M184 P200 M204 A234 L235 S240 A241 T242 | M184-Y238 HydrophobicContact CB-CE1 4.41Å; M184-Y238 HydrophobicContact CE-CD1 3.89Å; M184-Y238 HydrophobicContact CE-CD2 3.83Å; M184-Y238 HydrophobicContact CE-CE1 3.68Å; M184-Y238 HydrophobicContact CE-CE2 3.61Å; M184-Y238 HydrophobicContact CE-CG 3.96Å; M184-Y238 HydrophobicContact CG-CD1 3.86Å; M184-Y238 HydrophobicContact CG-CE1 3.93Å; M184-Y238 HydrophobicContact SD-CD1 4.36Å; P200-Y238 HydrophobicContact CB-CD2 4.27Å; P200-Y238 HydrophobicContact CB-CE2 3.59Å; P200-Y238 HydrophobicContact CG-CE2 4.17Å; M204-Y238 HydrophobicContact CG-CD2 4.08Å; M204-Y238 HydrophobicContact CG-CG 4.21Å; M204-Y238 HydrophobicContact SD-CD2 4.45Å; A234-Y238 WeakPolarHBondContact O-CB 3.36Å; A234-Y238 PolarHBondContact O-N 3.37Å; L235-Y238 HydrophobicContact CD1-CD1 4.45Å; L235-Y238 PolarHBondContact O-N 3.36Å; Y238-S240 VanDerWaalsContact C-N 3.3Å; Y238-S240 PolarHBondContact O-N 3.49Å; Y238-A241 PolarHBondContact O-N 3.17Å; Y238-A241 VanDerWaalsContact O-N 3.11Å; Y238-T242 HydrophobicContact CD2-CG2 4.13Å; Y238-T242 HydrophobicContact CE2-CG2 3.63Å; Y238-T242 PolarHBondContact O-N 3.45Å; Y238-T242 PolarHBondContact O-OG1 2.84Å |
| 239 | L | 98.6 | Very high | 98.3 | Very high | 16 Ų | 16 | 49.9 Ų | 49.9 | 8% | 0.084 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.7 | -31.6 | -177.3 | -67.8 | 179.5 | 0 | 0 | 0 | 112.4 | F187 L235 G243 L386 P387 | F187-L239 HydrophobicContact CB-CD1 4.24Å; F187-L239 HydrophobicContact CB-CD2 3.94Å; F187-L239 HydrophobicContact CD2-CD1 4.04Å; F187-L239 HydrophobicContact CG-CD1 4.2Å; L235-L239 HydrophobicContact CD1-CD1 4.05Å; L235-L239 HydrophobicContact CD1-CG 4.03Å; L235-L239 HydrophobicContact CD2-CD1 4.3Å; L235-L239 HydrophobicContact CG-CD1 3.85Å; L235-L239 HydrophobicContact CG-CG 4.18Å; L235-L239 WeakPolarHBondContact O-CB 3.37Å; L235-L239 WeakPolarHBondContact O-CG 3.39Å; L235-L239 PolarHBondContact O-N 3.44Å; L239-G243 VanDerWaalsContact O-CA 3.24Å; L239-G243 WeakPolarHBondContact O-CA 3.41Å; L239-G243 PolarHBondContact O-N 2.78Å; L239-L386 HydrophobicContact CB-CD2 3.61Å; L239-P387 HydrophobicContact CD1-CG 3.66Å |
| 240 | S | 98.1 | Very high | 98.3 | Very high | 74 Ų | 74 | 50 Ų | 50 | 52% | 0.517 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -71.3 | -37.9 | 171.3 | -68.7 | 0 | 0 | 0 | 0 | 112.8 | S236 Y238 L386 | S236-S240 WeakPolarHBondContact O-CB 3.35Å; S236-S240 PolarHBondContact O-N 3.49Å; S236-S240 PolarHBondContact O-OG 3.37Å; S236-S240 VanDerWaalsContact O-OG 3.08Å; Y238-S240 VanDerWaalsContact C-N 3.3Å; Y238-S240 PolarHBondContact O-N 3.49Å; S240-L386 WeakPolarHBondContact OG-CD1 3.3Å |
| 241 | A | 98.3 | Very high | 98.2 | Very high | 79 Ų | 79 | 50.3 Ų | 50.3 | 65% | 0.653 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -71.2 | -35 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | M237 Y238 | M237-A241 VanDerWaalsContact O-CB 3.27Å; M237-A241 WeakPolarHBondContact O-CB 3.35Å; M237-A241 PolarHBondContact O-N 3.18Å; Y238-A241 PolarHBondContact O-N 3.17Å; Y238-A241 VanDerWaalsContact O-N 3.11Å |
| 242 | T | 97.8 | Very high | 98.1 | Very high | 22 Ų | 22 | 55.1 Ų | 55.1 | 14% | 0.135 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -87.1 | -57 | 174.8 | 58.4 | 0 | 0 | 0 | 0 | 111.1 | Y238 N246 F249 | Y238-T242 HydrophobicContact CD2-CG2 4.13Å; Y238-T242 HydrophobicContact CE2-CG2 3.63Å; Y238-T242 PolarHBondContact O-N 3.45Å; Y238-T242 PolarHBondContact O-OG1 2.84Å; T242-N246 WeakPolarHBondContact O-CB 3.42Å; T242-F249 VanDerWaalsContact CB-O 3.3Å; T242-F249 WeakPolarHBondContact CB-O 3.29Å; T242-F249 HydrophobicContact CG2-CB 3.91Å |
| 243 | G | 97.1 | Very high | 98 | Very high | 26 Ų | 26 | 59.6 Ų | 59.6 | 27% | 0.268 | 32% | 0.318 | S | S | . | . | trans | 63 | -174.9 | -171.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L239 Y245 G251 | L239-G243 VanDerWaalsContact O-CA 3.24Å; L239-G243 WeakPolarHBondContact O-CA 3.41Å; L239-G243 PolarHBondContact O-N 2.78Å; G243-Y245 VanDerWaalsContact C-N 3.34Å; G243-G251 PolarHBondContact O-N 2.97Å | ||
| 244 | H | 97.8 | Very high | 97.9 | Very high | 58 Ų | 58 | 58.7 Ų | 58.7 | 27% | 0.269 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -32 | 179.9 | -178.1 | 59.5 | 0 | 0 | 0 | 113.1 | D189 N246 P250 G251 L253 | D189-H244 IonicContact OD2-CE1 2.96Å; H244-N246 PolarHBondContact O-N 2.7Å; H244-P250 WeakPolarHBondContact O-CB 3.19Å; H244-G251 WeakPolarHBondContact CA-O 3.18Å; H244-G251 PolarHBondContact ND1-O 3.19Å; H244-L253 HydrophobicContact CB-CD1 4Å |
| 245 | Y | 97.1 | Very high | 97.7 | Very high | 198 Ų | 198 | 63.2 Ų | 63.2 | 78% | 0.776 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | 9.4 | -171.5 | -55.1 | -69 | 0 | 0 | 0 | 114.4 | G243 P247 | G243-Y245 VanDerWaalsContact C-N 3.34Å; Y245-P247 WeakPolarHBondContact O-CD 3.4Å |
| 246 | N | 98.4 | Very high | 97.6 | Very high | 43 Ų | 43 | 65 Ų | 65 | 23% | 0.23 | 36% | 0.355 | C | S | . | . | trans | -64.4 | 129.9 | 176.3 | -164.4 | -90.7 | 0 | 0 | 0 | 110.8 | T242 H244 F248 F249 P250 | T242-N246 WeakPolarHBondContact O-CB 3.42Å; H244-N246 PolarHBondContact O-N 2.7Å; N246-F248 VanDerWaalsContact C-N 3.29Å; N246-F248 PolarHBondContact O-N 3.39Å; N246-F248 PolarHBondContact OD1-N 2.9Å; N246-F249 PolarHBondContact OD1-N 3.45Å; N246-P250 WeakPolarHBondContact O-CD 3.32Å | ||
| 247 | P | 97.6 | Very high | 97.3 | Very high | 109 Ų | 109 | 68.9 Ų | 68.9 | 71% | 0.708 | 38% | 0.378 | S | S | * | . | S | Bend | trans | -62.8 | -32.3 | 179.4 | -25.4 | 35 | 0 | 0 | 0 | 114.3 | Y245 | Y245-P247 WeakPolarHBondContact O-CD 3.4Š|
| 248 | F | 97.3 | Very high | 97 | Very high | 149 Ų | 149 | 69 Ų | 69 | 65% | 0.654 | 39% | 0.385 | S | S | * | . | S | Bend | trans | -98 | -48.7 | -175.1 | -69.9 | -76.4 | 0 | 0 | 0 | 112.6 | F194 N246 P250 | F194-F248 VanDerWaalsContact CZ-O 3.27Å; F194-F248 WeakPolarHBondContact CZ-O 3.46Å; N246-F248 VanDerWaalsContact C-N 3.29Å; N246-F248 PolarHBondContact O-N 3.39Å; N246-F248 PolarHBondContact OD1-N 2.9Å; F248-P250 VanDerWaalsContact O-CD 3.31Å; F248-P250 WeakPolarHBondContact O-CD 3.38Å |
| 249 | F | 98.3 | Very high | 96.8 | Very high | 44 Ų | 44 | 73.2 Ų | 73.2 | 19% | 0.193 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -123.4 | 57.8 | -170.4 | -54.1 | -74.3 | 0 | 0 | 0 | 112.2 | F194 W196 P200 T242 N246 G251 | F194-F249 AromaticContact CE1-CD1 3.79Å; F194-F249 HydrophobicContact CE1-CD1 3.79Å; F194-F249 HydrophobicContact CE1-CE1 4.07Å; F194-F249 HydrophobicContact CZ-CD1 4.37Å; F194-F249 HydrophobicContact CZ-CE1 4.39Å; W196-F249 HydrophobicContact CB-CE1 4.03Å; W196-F249 WeakPolarHBondContact O-CE1 3.4Å; P200-F249 HydrophobicContact CG-CD1 3.9Å; P200-F249 HydrophobicContact CG-CE1 3.82Å; P200-F249 HydrophobicContact CG-CG 4.46Å; P200-F249 HydrophobicContact CG-CZ 4.31Å; T242-F249 VanDerWaalsContact CB-O 3.3Å; T242-F249 WeakPolarHBondContact CB-O 3.29Å; T242-F249 HydrophobicContact CG2-CB 3.91Å; N246-F249 PolarHBondContact OD1-N 3.45Å; F249-G251 PolarHBondContact O-N 3.35Å |
| 250 | P | 98.2 | Very high | 96.5 | Very high | 13 Ų | 13 | 77 Ų | 77 | 8% | 0.084 | 45% | 0.447 | C | S | . | . | P | Polyproline II helix | trans | -64.2 | 132 | -179.5 | 28.8 | -34.6 | 0 | 0 | 0 | 110.6 | D189 K190 H244 N246 F248 | D189-P250 HydrophobicContact CB-CB 4.21Å; D189-P250 HydrophobicContact CB-CG 4.23Å; D189-P250 WeakPolarHBondContact CB-O 3.22Å; D189-P250 PolarHBondContact N-O 2.98Å; K190-P250 HydrophobicContact CD-CG 4.05Å; K190-P250 HydrophobicContact CG-CG 4.02Å; H244-P250 WeakPolarHBondContact O-CB 3.19Å; N246-P250 WeakPolarHBondContact O-CD 3.32Å; F248-P250 VanDerWaalsContact O-CD 3.31Å; F248-P250 WeakPolarHBondContact O-CD 3.38Å |
| 251 | G | 97.3 | Very high | 96.2 | Very high | 7 Ų | 7 | 76.7 Ų | 76.7 | 7% | 0.072 | 44% | 0.443 | C | S | . | . | B | Isolated β-bridge | trans | -85 | 156.6 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F187 G243 H244 F249 L253 | F187-G251 CarbonylContact O-C 3.56Å; F187-G251 VanDerWaalsContact O-CA 3.24Å; F187-G251 WeakPolarHBondContact O-CA 2.98Å; G243-G251 PolarHBondContact O-N 2.97Å; H244-G251 WeakPolarHBondContact CA-O 3.18Å; H244-G251 PolarHBondContact ND1-O 3.19Å; F249-G251 PolarHBondContact O-N 3.35Å; G251-L253 PolarHBondContact O-N 2.93Å |
| 252 | K | 97.3 | Very high | 95.9 | Very high | 102 Ų | 102 | 81.1 Ų | 81.1 | 44% | 0.443 | 46% | 0.455 | S | S | . | . | P | Polyproline II helix | trans | -58 | 137.4 | 170.7 | -72.7 | -178.9 | 177.5 | 167.9 | 0 | 110 | V186 F187 V254 | V186-K252 WeakPolarHBondContact O-CD 3.29Å; V186-K252 WeakPolarHBondContact O-CE 3.34Å; V186-K252 PolarHBondContact O-NZ 2.83Å; F187-K252 PolarHBondContact O-N 3.25Å; K252-V254 PolarHBondContact O-N 3.4Å |
| 253 | L | 96.6 | Very high | 95.7 | Very high | 96 Ų | 96 | 81.6 Ų | 81.6 | 50% | 0.503 | 46% | 0.457 | S | S | . | . | P | Polyproline II helix | trans | -70.3 | 120.8 | 179.8 | -175.5 | 65.7 | 0 | 0 | 0 | 110.3 | H244 G251 T255 | H244-L253 HydrophobicContact CB-CD1 4Å; G251-L253 PolarHBondContact O-N 2.93Å; L253-T255 HydrophobicContact CD1-CG2 4.5Å; L253-T255 HydrophobicContact CD2-CG2 3.97Å; L253-T255 HydrophobicContact CG-CG2 3.91Å |
| 254 | V | 96.1 | Very high | 95.6 | Very high | 40 Ų | 40 | 82.8 Ų | 82.8 | 24% | 0.242 | 46% | 0.461 | C | S | . | . | trans | -105.5 | 119.4 | 172.1 | -177.7 | 0 | 0 | 0 | 0 | 108.3 | K252 A382 | K252-V254 PolarHBondContact O-N 3.4Å; V254-A382 HydrophobicContact CG1-CB 3.94Å | ||
| 255 | T | 95.2 | Very high | 95.4 | Very high | 96 Ų | 96 | 86.8 Ų | 86.8 | 59% | 0.589 | 47% | 0.474 | S | S | * | . | trans | -115.1 | 144.4 | 179.8 | 52.9 | 0 | 0 | 0 | 0 | 111.4 | L253 | L253-T255 HydrophobicContact CD1-CG2 4.5Å; L253-T255 HydrophobicContact CD2-CG2 3.97Å; L253-T255 HydrophobicContact CG-CG2 3.91Å | ||
| 256 | P | 96 | Very high | 95.4 | Very high | 37 Ų | 37 | 82.1 Ų | 82.1 | 24% | 0.24 | 47% | 0.47 | C | S | . | . | trans | -68.8 | 147.8 | 173.8 | 30.6 | -34.8 | 0 | 0 | 0 | 111 | T258 A382 | P256-T258 PolarHBondContact O-N 2.96Å; P256-A382 HydrophobicContact CB-CB 4.34Å | ||
| 257 | V | 93.1 | Very high | 95.2 | Very high | 102 Ų | 102 | 85.3 Ų | 85.3 | 62% | 0.618 | 49% | 0.487 | S | S | * | . | trans | -66.7 | 124.1 | 171.1 | -177.9 | 0 | 0 | 0 | 0 | 109.2 | T259 | V257-T259 VanDerWaalsContact CG1-O 3.27Å; V257-T259 WeakPolarHBondContact CG1-O 3.27Å | ||
| 258 | T | 93.3 | Very high | 95.2 | Very high | 121 Ų | 121 | 82.9 Ų | 82.9 | 74% | 0.742 | 47% | 0.468 | S | S | * | . | trans | -111.5 | -14.7 | -178.4 | 51.5 | 0 | 0 | 0 | 0 | 113.9 | P256 | P256-T258 PolarHBondContact O-N 2.96Š| ||
| 259 | T | 93.1 | Very high | 95.2 | Very high | 106 Ų | 106 | 77.8 Ų | 77.8 | 65% | 0.65 | 45% | 0.451 | S | S | * | . | S | Bend | trans | -132.2 | 146.7 | -177.5 | 50.7 | 0 | 0 | 0 | 0 | 109.9 | V257 | V257-T259 VanDerWaalsContact CG1-O 3.27Å; V257-T259 WeakPolarHBondContact CG1-O 3.27Å |
| 260 | A | 92 | Very high | 95.1 | Very high | 96 Ų | 96 | 79.6 Ų | 79.6 | 79% | 0.793 | 47% | 0.474 | S | S | * | . | trans | -62.4 | 132.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 261 | P | 91.6 | Very high | 95.1 | Very high | 67 Ų | 67 | 83.9 Ų | 83.9 | 44% | 0.435 | 50% | 0.495 | S | S | . | . | trans | -68 | 140.9 | 176.2 | 28.8 | -34.1 | 0 | 0 | 0 | 110.2 | I263 P328 | P261-I263 HydrophobicContact CB-CD1 4.32Å; P261-I263 HydrophobicContact CB-CG1 4.2Å; P261-I263 HydrophobicContact CG-CD1 3.92Å; P261-I263 HydrophobicContact CG-CG1 4.31Å; P261-I263 PolarHBondContact O-N 2.99Å; P261-P328 HydrophobicContact CB-CG 3.94Å; P261-P328 HydrophobicContact CG-CG 4.1Å | ||
| 262 | N | 92.5 | Very high | 95.1 | Very high | 171 Ų | 171 | 86.4 Ų | 86.4 | 91% | 0.914 | 51% | 0.505 | S | S | * | . | trans | -85.5 | 107.3 | 173.7 | -174 | 20.3 | 0 | 0 | 0 | 109.2 | ||||
| 263 | I | 93.8 | Very high | 95.2 | Very high | 32 Ų | 32 | 83.1 Ų | 83.1 | 16% | 0.164 | 49% | 0.493 | C | S | . | . | trans | -112.9 | 118.8 | -173.2 | -61.5 | 169 | 0 | 0 | 0 | 109.9 | P261 S326 F329 | P261-I263 HydrophobicContact CB-CD1 4.32Å; P261-I263 HydrophobicContact CB-CG1 4.2Å; P261-I263 HydrophobicContact CG-CD1 3.92Å; P261-I263 HydrophobicContact CG-CG1 4.31Å; P261-I263 PolarHBondContact O-N 2.99Å; I263-S326 WeakPolarHBondContact CD1-O 3.47Å; I263-S326 WeakPolarHBondContact CD1-OG 3.35Å; I263-F329 HydrophobicContact CG2-CE1 3.98Å; I263-F329 HydrophobicContact CG2-CE2 4.03Å; I263-F329 HydrophobicContact CG2-CZ 3.63Å | ||
| 264 | S | 94.4 | Very high | 95.2 | Very high | 51 Ų | 51 | 83.9 Ų | 83.9 | 36% | 0.357 | 50% | 0.497 | S | S | . | . | trans | -97.6 | 102.8 | 173 | -178.5 | 0 | 0 | 0 | 0 | 109.8 | S266 D267 F329 | S264-S266 PolarHBondContact O-N 3.21Å; S264-S266 VanDerWaalsContact O-N 3.13Å; S264-S266 PolarHBondContact OG-OG 3.37Å; S264-D267 VanDerWaalsContact CB-OD2 3.25Å; S264-D267 WeakPolarHBondContact CB-OD2 3.49Å; S264-D267 WeakPolarHBondContact O-CB 3.23Å; S264-D267 PolarHBondContact O-N 2.82Å; S264-D267 PolarHBondContact OG-OD1 3.14Å; S264-D267 PolarHBondContact OG-OD2 3.24Å; S264-F329 WeakPolarHBondContact O-CE2 3.21Å | ||
| 265 | W | 95.1 | Very high | 95.3 | Very high | 142 Ų | 142 | 85.7 Ų | 85.7 | 54% | 0.538 | 50% | 0.501 | S | S | . | . | G | 310 helix | trans | -64 | -17.3 | -177 | -70.6 | 88 | 0 | 0 | 0 | 114.1 | D267 L268 F329 | W265-D267 PolarHBondContact O-N 3.04Å; W265-L268 WeakPolarHBondContact O-CB 3.25Å; W265-L268 PolarHBondContact O-N 2.91Å; W265-F329 HydrophobicContact CD2-CZ 4.32Å; W265-F329 HydrophobicContact CE3-CE1 4.42Å; W265-F329 HydrophobicContact CE3-CZ 4.06Å; W265-F329 HydrophobicContact CZ3-CE1 4.4Å; W265-F329 HydrophobicContact CZ3-CZ 4.49Å |
| 266 | S | 95.7 | Very high | 95.5 | Very high | 101 Ų | 101 | 81.1 Ų | 81.1 | 71% | 0.706 | 47% | 0.473 | S | S | * | . | G | 310 helix | trans | -67.2 | -22.2 | 171.9 | 55.7 | 0 | 0 | 0 | 0 | 113.2 | S264 L268 | S264-S266 PolarHBondContact O-N 3.21Å; S264-S266 VanDerWaalsContact O-N 3.13Å; S264-S266 PolarHBondContact OG-OG 3.37Å; S266-L268 VanDerWaalsContact C-N 3.28Å |
| 267 | D | 95.3 | Very high | 95.6 | Very high | 109 Ų | 109 | 80.8 Ų | 80.8 | 58% | 0.583 | 47% | 0.469 | S | S | * | . | G | 310 helix | trans | -90.8 | 1.5 | -174.3 | -53.9 | -9.8 | 0 | 0 | 0 | 111.6 | S264 W265 S269 | S264-D267 VanDerWaalsContact CB-OD2 3.25Å; S264-D267 WeakPolarHBondContact CB-OD2 3.49Å; S264-D267 WeakPolarHBondContact O-CB 3.23Å; S264-D267 PolarHBondContact O-N 2.82Å; S264-D267 PolarHBondContact OG-OD1 3.14Å; S264-D267 PolarHBondContact OG-OD2 3.24Å; W265-D267 PolarHBondContact O-N 3.04Å; D267-S269 PolarHBondContact O-N 3.44Å |
| 268 | L | 96.4 | Very high | 95.9 | Very high | 59 Ų | 59 | 77.2 Ų | 77.2 | 31% | 0.309 | 45% | 0.448 | S | S | . | . | trans | -65 | 120.3 | 176.4 | -174.5 | 63.3 | 0 | 0 | 0 | 110.2 | W265 S266 L273 L323 F329 | W265-L268 WeakPolarHBondContact O-CB 3.25Å; W265-L268 PolarHBondContact O-N 2.91Å; S266-L268 VanDerWaalsContact C-N 3.28Å; L268-L273 HydrophobicContact CD1-CD1 3.9Å; L268-L273 HydrophobicContact CD1-CD2 4.16Å; L268-L273 HydrophobicContact CD1-CG 4.13Å; L268-L273 HydrophobicContact CD2-CD1 4.28Å; L268-L273 HydrophobicContact CG-CD1 4.08Å; L268-L323 HydrophobicContact CD1-CD2 3.95Å; L268-L323 HydrophobicContact CD2-CD2 4.46Å; L268-F329 HydrophobicContact CB-CE2 3.88Å; L268-F329 HydrophobicContact CB-CZ 3.95Å; L268-F329 HydrophobicContact CD1-CD1 3.92Å; L268-F329 HydrophobicContact CD1-CD2 4.29Å; L268-F329 HydrophobicContact CD1-CE1 3.76Å; L268-F329 HydrophobicContact CD1-CE2 4.12Å; L268-F329 HydrophobicContact CD1-CG 4.21Å; L268-F329 HydrophobicContact CD1-CZ 3.86Å; L268-F329 HydrophobicContact CG-CZ 4.38Å | ||
| 269 | S | 97.8 | Very high | 96.1 | Very high | 42 Ų | 42 | 71.8 Ų | 71.8 | 29% | 0.294 | 41% | 0.414 | S | S | . | . | trans | -105.6 | 117.2 | -177.3 | 174.8 | 0 | 0 | 0 | 0 | 110.8 | D267 L271 E272 L273 Y333 | D267-S269 PolarHBondContact O-N 3.44Å; S269-L271 PolarHBondContact O-N 2.99Å; S269-L271 PolarHBondContact OG-N 3.33Å; S269-E272 PolarHBondContact O-N 2.97Å; S269-E272 PolarHBondContact OG-N 2.9Å; S269-L273 WeakPolarHBondContact O-CG 3.45Å; S269-L273 PolarHBondContact O-N 3.42Å; S269-Y333 PolarHBondContact N-OH 3.26Å | ||
| 270 | A | 97.1 | Very high | 96.4 | Very high | 81 Ų | 81 | 66.7 Ų | 66.7 | 67% | 0.669 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -60.3 | -32.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L274 | A270-L274 PolarHBondContact O-N 3.27Å |
| 271 | L | 97.8 | Very high | 96.7 | Very high | 103 Ų | 103 | 62.1 Ų | 62.1 | 54% | 0.539 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -69.5 | -40.6 | 177.7 | 180 | 61.9 | 0 | 0 | 0 | 111.6 | S269 L274 K275 | S269-L271 PolarHBondContact O-N 2.99Å; S269-L271 PolarHBondContact OG-N 3.33Å; L271-L274 PolarHBondContact O-N 3.39Å; L271-K275 WeakPolarHBondContact O-CG 3.28Å; L271-K275 PolarHBondContact O-N 2.86Å |
| 272 | E | 97.8 | Very high | 97.1 | Very high | 60 Ų | 60 | 59 Ų | 59 | 28% | 0.28 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -70.5 | -34.8 | 176.7 | -63.1 | -54.4 | 137.3 | 0 | 0 | 111.5 | S269 L274 K275 S276 Y333 | S269-E272 PolarHBondContact O-N 2.97Å; S269-E272 PolarHBondContact OG-N 2.9Å; E272-L274 VanDerWaalsContact C-N 3.31Å; E272-L274 PolarHBondContact O-N 3.47Å; E272-K275 CarbonylContact O-C 3.14Å; E272-K275 PolarHBondContact O-N 2.83Å; E272-K275 IonicContact OE1-NZ 3.66Å; E272-K275 PolarHBondContact OE1-NZ 3.35Å; E272-K275 WeakPolarHBondContact OE2-CD 3.06Å; E272-K275 IonicContact OE2-NZ 3.5Å; E272-S276 PolarHBondContact O-N 2.97Å; E272-Y333 HydrophobicContact CB-CD1 3.57Å; E272-Y333 HydrophobicContact CB-CD2 3.81Å; E272-Y333 HydrophobicContact CB-CE1 3.53Å; E272-Y333 HydrophobicContact CB-CE2 3.77Å; E272-Y333 HydrophobicContact CB-CG 3.72Å; E272-Y333 HydrophobicContact CG-CD2 4.26Å; E272-Y333 HydrophobicContact CG-CE2 4.19Å |
| 273 | L | 97.9 | Very high | 97.4 | Very high | 34 Ų | 34 | 51.7 Ų | 51.7 | 18% | 0.178 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62.9 | -35.3 | 169 | -69.2 | 176.7 | 0 | 0 | 0 | 112.8 | L268 S269 S276 T319 L323 I332 Y333 | L268-L273 HydrophobicContact CD1-CD1 3.9Å; L268-L273 HydrophobicContact CD1-CD2 4.16Å; L268-L273 HydrophobicContact CD1-CG 4.13Å; L268-L273 HydrophobicContact CD2-CD1 4.28Å; L268-L273 HydrophobicContact CG-CD1 4.08Å; S269-L273 WeakPolarHBondContact O-CG 3.45Å; S269-L273 PolarHBondContact O-N 3.42Å; L273-S276 PolarHBondContact O-N 3.27Å; L273-S276 PolarHBondContact O-OG 3.19Å; L273-T319 HydrophobicContact CD2-CG2 3.78Å; L273-L323 HydrophobicContact CD1-CD1 4.25Å; L273-L323 HydrophobicContact CD2-CD1 4.04Å; L273-L323 HydrophobicContact CD2-CD2 4.37Å; L273-I332 HydrophobicContact CD2-CG2 4.04Å; L273-Y333 HydrophobicContact CD2-CD1 4.46Å; L273-Y333 HydrophobicContact CD2-CE1 3.9Å; L273-Y333 HydrophobicContact CG-CE1 4.12Å |
| 274 | L | 97.9 | Very high | 97.6 | Very high | 112 Ų | 112 | 50.3 Ų | 50.3 | 59% | 0.586 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -70.2 | -39.1 | 175.1 | -174.5 | 62.7 | 0 | 0 | 0 | 111.1 | A270 L271 E272 S276 I277 P278 | A270-L274 PolarHBondContact O-N 3.27Å; L271-L274 PolarHBondContact O-N 3.39Å; E272-L274 VanDerWaalsContact C-N 3.31Å; E272-L274 PolarHBondContact O-N 3.47Å; L274-S276 VanDerWaalsContact C-N 3.33Å; L274-I277 HydrophobicContact CD1-CD1 4.19Å; L274-I277 PolarHBondContact O-N 2.87Å; L274-P278 WeakPolarHBondContact O-CD 3.11Å |
| 275 | K | 98.1 | Very high | 97.8 | Very high | 77 Ų | 77 | 48 Ų | 48 | 34% | 0.335 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -67.5 | -30.1 | 174.7 | -70.7 | 171.2 | -176.8 | 171.9 | 0 | 112.6 | L271 E272 I277 P278 V279 | L271-K275 WeakPolarHBondContact O-CG 3.28Å; L271-K275 PolarHBondContact O-N 2.86Å; E272-K275 CarbonylContact O-C 3.14Å; E272-K275 PolarHBondContact O-N 2.83Å; E272-K275 IonicContact OE1-NZ 3.66Å; E272-K275 PolarHBondContact OE1-NZ 3.35Å; E272-K275 WeakPolarHBondContact OE2-CD 3.06Å; E272-K275 IonicContact OE2-NZ 3.5Å; K275-I277 PolarHBondContact O-N 3.41Å; K275-I277 VanDerWaalsContact O-N 3.17Å; K275-P278 WeakPolarHBondContact O-CD 3.3Å; K275-P278 VanDerWaalsContact O-CG 3.26Å; K275-P278 WeakPolarHBondContact O-CG 3.47Å; K275-V279 WeakPolarHBondContact O-CG2 3.31Å; K275-V279 PolarHBondContact O-N 3.25Å |
| 276 | S | 98.3 | Very high | 98 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -63.1 | -22.8 | 179 | 75.4 | 0 | 0 | 0 | 0 | 112.9 | E272 L273 L274 G280 T319 I332 | E272-S276 PolarHBondContact O-N 2.97Å; L273-S276 PolarHBondContact O-N 3.27Å; L273-S276 PolarHBondContact O-OG 3.19Å; L274-S276 VanDerWaalsContact C-N 3.33Å; S276-G280 PolarHBondContact O-N 2.99Å; S276-T319 WeakPolarHBondContact OG-CG2 3.39Å; S276-T319 PolarHBondContact OG-OG1 3.24Å; S276-T319 VanDerWaalsContact OG-OG1 3.04Å; S276-I332 VanDerWaalsContact CB-O 3.28Å; S276-I332 WeakPolarHBondContact CB-O 3.42Å |
| 277 | I | 98.6 | Very high | 98.1 | Very high | 30 Ų | 30 | 36.7 Ų | 36.7 | 15% | 0.154 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.8 | -60.9 | 178 | -56.8 | 175.1 | 0 | 0 | 0 | 111.3 | L274 K275 V279 G280 V281 A312 S315 L316 | L274-I277 HydrophobicContact CD1-CD1 4.19Å; L274-I277 PolarHBondContact O-N 2.87Å; K275-I277 PolarHBondContact O-N 3.41Å; K275-I277 VanDerWaalsContact O-N 3.17Å; I277-V279 VanDerWaalsContact C-N 3.33Å; I277-V279 PolarHBondContact O-N 3.14Å; I277-G280 PolarHBondContact O-N 3.26Å; I277-V281 PolarHBondContact O-N 3.12Å; I277-A312 HydrophobicContact CG2-CB 4.37Å; I277-S315 WeakPolarHBondContact CA-OG 3.4Å; I277-S315 WeakPolarHBondContact O-CB 3.45Å; I277-S315 PolarHBondContact O-OG 2.95Å; I277-L316 HydrophobicContact CD1-CB 4.36Å; I277-L316 HydrophobicContact CD1-CD1 3.98Å; I277-L316 HydrophobicContact CG1-CB 4.44Å; I277-L316 HydrophobicContact CG1-CD1 4.39Å |
| 278 | P | 98.7 | Very high | 98.2 | Very high | 27 Ų | 27 | 34.3 Ų | 34.3 | 18% | 0.175 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.3 | -36.2 | 175.1 | 24.8 | -34 | 0 | 0 | 0 | 112.2 | L274 K275 G280 V281 G282 P290 G293 L297 | L274-P278 WeakPolarHBondContact O-CD 3.11Å; K275-P278 WeakPolarHBondContact O-CD 3.3Å; K275-P278 VanDerWaalsContact O-CG 3.26Å; K275-P278 WeakPolarHBondContact O-CG 3.47Å; P278-G280 VanDerWaalsContact C-N 3.33Å; P278-G280 PolarHBondContact O-N 3.45Å; P278-V281 WeakPolarHBondContact O-CA 3.21Å; P278-V281 WeakPolarHBondContact O-CB 3.05Å; P278-V281 PolarHBondContact O-N 2.94Å; P278-G282 PolarHBondContact O-N 2.93Å; P278-P290 HydrophobicContact CG-CB 4.45Å; P278-G293 WeakPolarHBondContact O-CA 3.23Å; P278-L297 HydrophobicContact CB-CD1 4.35Å |
| 279 | V | 98.8 | Very high | 98.3 | Very high | 7 Ų | 7 | 33.4 Ų | 33.4 | 4% | 0.042 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61 | -42 | 176.9 | 177.8 | 0 | 0 | 0 | 0 | 111.3 | K275 I277 V281 G282 Q283 D288 P290 F334 | K275-V279 WeakPolarHBondContact O-CG2 3.31Å; K275-V279 PolarHBondContact O-N 3.25Å; I277-V279 VanDerWaalsContact C-N 3.33Å; I277-V279 PolarHBondContact O-N 3.14Å; V279-V281 PolarHBondContact O-N 3.4Å; V279-G282 CarbonylContact O-C 3.58Å; V279-G282 WeakPolarHBondContact O-CA 3.4Å; V279-G282 PolarHBondContact O-N 3.13Å; V279-Q283 HydrophobicContact CG1-CG 4.42Å; V279-Q283 WeakPolarHBondContact O-CG 3.09Å; V279-Q283 PolarHBondContact O-N 2.95Å; V279-D288 WeakPolarHBondContact CG1-O 3.43Å; V279-P290 HydrophobicContact CG2-CB 3.74Å; V279-P290 HydrophobicContact CG2-CG 4.44Å; V279-F334 VanDerWaalsContact CG1-C 3.5Å; V279-F334 WeakPolarHBondContact CG1-O 3.24Å |
| 280 | G | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.8 | -31.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S276 I277 P278 S315 F339 | S276-G280 PolarHBondContact O-N 2.99Å; I277-G280 PolarHBondContact O-N 3.26Å; P278-G280 VanDerWaalsContact C-N 3.33Å; P278-G280 PolarHBondContact O-N 3.45Å; G280-S315 WeakPolarHBondContact CA-OG 3.4Å; G280-F339 WeakPolarHBondContact O-CA 3.41Å; G280-F339 WeakPolarHBondContact O-CB 3.35Å; G280-F339 PolarHBondContact O-N 3.46Å |
| 281 | V | 98.9 | Very high | 98.4 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -74.2 | -37.6 | 171 | -178.9 | 0 | 0 | 0 | 0 | 111.3 | I277 P278 V279 Q283 I284 F296 L297 I300 A311 | I277-V281 PolarHBondContact O-N 3.12Å; P278-V281 WeakPolarHBondContact O-CA 3.21Å; P278-V281 WeakPolarHBondContact O-CB 3.05Å; P278-V281 PolarHBondContact O-N 2.94Å; V279-V281 PolarHBondContact O-N 3.4Å; V281-Q283 VanDerWaalsContact C-N 3.3Å; V281-Q283 PolarHBondContact O-N 3.5Å; V281-I284 HydrophobicContact CG1-CD1 4.2Å; V281-I284 VanDerWaalsContact O-CB 3.28Å; V281-I284 WeakPolarHBondContact O-CB 3.24Å; V281-I284 VanDerWaalsContact O-CG1 3.3Å; V281-I284 WeakPolarHBondContact O-CG1 3.41Å; V281-I284 PolarHBondContact O-N 3.28Å; V281-F296 HydrophobicContact CG1-CB 4.2Å; V281-L297 HydrophobicContact CB-CG 4.34Å; V281-L297 HydrophobicContact CG1-CD2 4.24Å; V281-L297 HydrophobicContact CG1-CG 4.1Å; V281-L297 HydrophobicContact CG2-CD1 4.43Å; V281-L297 HydrophobicContact CG2-CD2 4Å; V281-L297 HydrophobicContact CG2-CG 4.17Å; V281-I300 HydrophobicContact CG1-CD1 4.45Å; V281-A311 HydrophobicContact CG2-CB 4.49Å |
| 282 | G | 98.8 | Very high | 98.4 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -56.7 | -42.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | P278 V279 I284 Y285 C287 | P278-G282 PolarHBondContact O-N 2.93Å; V279-G282 CarbonylContact O-C 3.58Å; V279-G282 WeakPolarHBondContact O-CA 3.4Å; V279-G282 PolarHBondContact O-N 3.13Å; G282-I284 PolarHBondContact O-N 3.48Å; G282-Y285 PolarHBondContact O-N 2.89Å; G282-C287 CarbonylContact C-O 3.15Å; G282-C287 WeakPolarHBondContact CA-O 3.19Å; G282-C287 WeakPolarHBondContact O-CB 3.07Å; G282-C287 PolarHBondContact O-N 3.44Å; G282-C287 VanDerWaalsContact O-N 3.08Å |
| 283 | Q | 98.8 | Very high | 98.5 | Very high | 18 Ų | 18 | 30.9 Ų | 30.9 | 8% | 0.084 | 15% | 0.152 | C | C | . | . | G | 310 helix | trans | -65.1 | -11 | -179 | -73.6 | -65.6 | 0 | 0 | 0 | 113.9 | V279 V281 Y285 G286 C287 F334 F339 | V279-Q283 HydrophobicContact CG1-CG 4.42Å; V279-Q283 WeakPolarHBondContact O-CG 3.09Å; V279-Q283 PolarHBondContact O-N 2.95Å; V281-Q283 VanDerWaalsContact C-N 3.3Å; V281-Q283 PolarHBondContact O-N 3.5Å; Q283-Y285 PolarHBondContact O-N 3.47Å; Q283-G286 PolarHBondContact O-N 2.93Å; Q283-C287 PolarHBondContact N-O 3.26Å; Q283-F334 VanDerWaalsContact CG-O 3.24Å; Q283-F334 WeakPolarHBondContact CG-O 3.37Å; Q283-F334 PolarHBondContact NE2-O 3.25Å; Q283-F339 HydrophobicContact CB-CB 3.71Å; Q283-F339 HydrophobicContact CB-CD1 3.8Å; Q283-F339 HydrophobicContact CB-CG 3.95Å |
| 284 | I | 98.9 | Very high | 98.5 | Very high | 4 Ų | 4 | 30.9 Ų | 30.9 | 2% | 0.021 | 16% | 0.16 | C | C | . | . | G | 310 helix | trans | -55.8 | -35.8 | 167.4 | -65.4 | 175.7 | 0 | 0 | 0 | 110.8 | V120 V121 L179 V281 G282 F339 L343 | V120-I284 HydrophobicContact CG1-CG2 3.69Å; V121-I284 HydrophobicContact CG1-CD1 4.03Å; V121-I284 HydrophobicContact CG1-CG2 3.87Å; L179-I284 VanDerWaalsContact CD2-O 3.31Å; L179-I284 WeakPolarHBondContact CD2-O 3.29Å; V281-I284 HydrophobicContact CG1-CD1 4.2Å; V281-I284 VanDerWaalsContact O-CB 3.28Å; V281-I284 WeakPolarHBondContact O-CB 3.24Å; V281-I284 VanDerWaalsContact O-CG1 3.3Å; V281-I284 WeakPolarHBondContact O-CG1 3.41Å; V281-I284 PolarHBondContact O-N 3.28Å; G282-I284 PolarHBondContact O-N 3.48Å; I284-F339 HydrophobicContact CG1-CB 3.95Å; I284-L343 HydrophobicContact CD1-CD2 4Å; I284-L343 HydrophobicContact CD1-CG 3.99Å; I284-L343 HydrophobicContact CG1-CD1 4.45Å; I284-L343 HydrophobicContact CG1-CD2 4.39Å; I284-L343 HydrophobicContact CG1-CG 4.04Å; I284-L343 HydrophobicContact CG2-CD1 4.17Å; I284-L343 HydrophobicContact CG2-CD2 3.9Å; I284-L343 HydrophobicContact CG2-CG 4.19Å |
| 285 | Y | 98.8 | Very high | 98.6 | Very high | 1 Ų | 1 | 28 Ų | 28 | 0% | 0.004 | 15% | 0.145 | C | C | . | . | G | 310 helix | trans | -105 | 16.4 | 173.7 | -61.7 | -101.5 | 0 | 0 | 0 | 112.2 | I117 V120 V121 I132 L136 L179 I182 G282 Q283 C287 F296 | I117-Y285 PolarHBondContact O-OH 3.42Å; V120-Y285 HydrophobicContact CB-CE1 3.6Å; V120-Y285 HydrophobicContact CB-CE2 4.38Å; V120-Y285 WeakPolarHBondContact CB-OH 3.25Å; V120-Y285 HydrophobicContact CG1-CD1 4.11Å; V120-Y285 HydrophobicContact CG1-CD2 4.39Å; V120-Y285 HydrophobicContact CG1-CE1 3.59Å; V120-Y285 HydrophobicContact CG1-CE2 3.91Å; V120-Y285 HydrophobicContact CG1-CG 4.48Å; V120-Y285 VanDerWaalsContact CG1-CZ 3.49Å; V120-Y285 HydrophobicContact CG2-CD1 4.45Å; V120-Y285 HydrophobicContact CG2-CE1 3.66Å; V121-Y285 HydrophobicContact CG1-CE2 3.97Å; I132-Y285 WeakPolarHBondContact CD1-OH 3.49Å; I132-Y285 HydrophobicContact CG2-CD1 4.43Å; I132-Y285 HydrophobicContact CG2-CE1 3.77Å; I132-Y285 HydrophobicContact CG2-CE2 4.16Å; L136-Y285 HydrophobicContact CD2-CD1 4.44Å; L136-Y285 HydrophobicContact CD2-CG 4.42Å; L179-Y285 HydrophobicContact CD2-CD1 4.31Å; I182-Y285 HydrophobicContact CD1-CD1 3.82Å; I182-Y285 WeakPolarHBondContact CG2-O 3.29Å; G282-Y285 PolarHBondContact O-N 2.89Å; Q283-Y285 PolarHBondContact O-N 3.47Å; Y285-C287 VanDerWaalsContact C-N 3.32Å; Y285-C287 PolarHBondContact O-N 3.43Å; Y285-F296 AromaticContact CD2-CD2 3.75Å; Y285-F296 HydrophobicContact CD2-CD2 3.75Å; Y285-F296 AromaticContact CD2-CE2 3.42Å; Y285-F296 HydrophobicContact CD2-CE2 3.42Å; Y285-F296 VanDerWaalsContact CD2-CE2 3.42Å; Y285-F296 HydrophobicContact CD2-CZ 4.02Å; Y285-F296 HydrophobicContact CE2-CD2 4.14Å; Y285-F296 HydrophobicContact CE2-CE2 4.14Å; Y285-F296 AromaticContact CG-CE2 3.95Å; Y285-F296 HydrophobicContact CG-CE2 3.95Å; Y285-F296 HydrophobicContact CG-CZ 4.25Å |
| 286 | G | 98.3 | Very high | 98.6 | Very high | 7 Ų | 7 | 24.4 Ų | 24.4 | 7% | 0.072 | 13% | 0.129 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 69.4 | 24.6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | W143 Q283 | W143-G286 VanDerWaalsContact CZ3-O 3.24Å; W143-G286 WeakPolarHBondContact CZ3-O 3.21Å; Q283-G286 PolarHBondContact O-N 2.93Å |
| 287 | C | 98.6 | Very high | 98.6 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 14% | 0.136 | C | C | . | . | trans | -99.7 | 126.9 | -179.4 | -57.1 | 0 | 0 | 0 | 0 | 111.1 | Q139 G282 Q283 Y285 T292 F296 | Q139-C287 HydrophobicContact CB-CB 4.31Å; Q139-C287 HydrophobicContact CG-CB 3.87Å; G282-C287 CarbonylContact C-O 3.15Å; G282-C287 WeakPolarHBondContact CA-O 3.19Å; G282-C287 WeakPolarHBondContact O-CB 3.07Å; G282-C287 PolarHBondContact O-N 3.44Å; G282-C287 VanDerWaalsContact O-N 3.08Å; Q283-C287 PolarHBondContact N-O 3.26Å; Y285-C287 VanDerWaalsContact C-N 3.32Å; Y285-C287 PolarHBondContact O-N 3.43Å; C287-T292 HydrophobicContact CB-CG2 3.73Å; C287-F296 HydrophobicContact CB-CE2 4.32Å | ||
| 288 | D | 97.8 | Very high | 98.6 | Very high | 59 Ų | 59 | 25.9 Ų | 25.9 | 32% | 0.316 | 15% | 0.145 | S | C | . | . | trans | -98.8 | -9 | -179.1 | 63.4 | -23.3 | 0 | 0 | 0 | 113.7 | Q139 V279 F334 | Q139-D288 PolarHBondContact NE2-OD1 3Å; Q139-D288 PolarHBondContact OE1-OD1 2.92Å; V279-D288 WeakPolarHBondContact CG1-O 3.43Å; D288-F334 HydrophobicContact CB-CD2 3.93Å; D288-F334 HydrophobicContact CB-CE1 4.05Å; D288-F334 HydrophobicContact CB-CE2 3.36Å; D288-F334 HydrophobicContact CB-CG 4.48Å; D288-F334 HydrophobicContact CB-CZ 3.42Å; D288-F334 VanDerWaalsContact CB-CZ 3.42Å; D288-F334 WeakPolarHBondContact OD2-CE2 3.34Å; D288-F334 WeakPolarHBondContact OD2-CZ 3.45Å | ||
| 289 | N | 98.2 | Very high | 98.6 | Very high | 39 Ų | 39 | 24.6 Ų | 24.6 | 21% | 0.209 | 14% | 0.136 | C | C | . | . | trans | -74.2 | 122.1 | 178.3 | -173.4 | -27.7 | 0 | 0 | 0 | 111.4 | W291 T292 G293 | N289-W291 PolarHBondContact O-N 3.01Å; N289-W291 WeakPolarHBondContact OD1-CB 3.28Å; N289-W291 VanDerWaalsContact OD1-CD1 3.27Å; N289-W291 PolarHBondContact OD1-N 3.48Å; N289-T292 WeakPolarHBondContact O-CB 3.4Å; N289-T292 PolarHBondContact O-N 2.95Å; N289-T292 VanDerWaalsContact O-N 3.11Å; N289-G293 PolarHBondContact O-N 2.88Å; N289-G293 VanDerWaalsContact O-N 3.12Å | ||
| 290 | P | 98.2 | Very high | 98.6 | Very high | 46 Ų | 46 | 24.2 Ų | 24.2 | 30% | 0.299 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -61 | -31.2 | -179 | 23.3 | -33.9 | 0 | 0 | 0 | 113.2 | P278 V279 G293 G294 | P278-P290 HydrophobicContact CG-CB 4.45Å; V279-P290 HydrophobicContact CG2-CB 3.74Å; V279-P290 HydrophobicContact CG2-CG 4.44Å; P290-G293 PolarHBondContact O-N 3.46Å; P290-G294 PolarHBondContact O-N 3.27Å |
| 291 | W | 98.4 | Very high | 98.6 | Very high | 187 Ų | 187 | 28.5 Ų | 28.5 | 71% | 0.708 | 16% | 0.156 | S | C | * | . | H | α-helix | trans | -68.9 | -40.7 | 177.4 | -60.6 | 106.4 | 0 | 0 | 0 | 111.6 | F138 N289 G293 G294 I295 | F138-W291 HydrophobicContact CD1-CB 4.1Å; F138-W291 HydrophobicContact CE1-CB 3.66Å; F138-W291 HydrophobicContact CE1-CG 4.15Å; N289-W291 PolarHBondContact O-N 3.01Å; N289-W291 WeakPolarHBondContact OD1-CB 3.28Å; N289-W291 VanDerWaalsContact OD1-CD1 3.27Å; N289-W291 PolarHBondContact OD1-N 3.48Å; W291-G293 VanDerWaalsContact C-N 3.33Å; W291-G293 PolarHBondContact O-N 2.96Å; W291-G294 PolarHBondContact O-N 3.18Å; W291-I295 WeakPolarHBondContact O-CG1 3.18Å; W291-I295 PolarHBondContact O-N 3.13Å |
| 292 | T | 98.6 | Very high | 98.6 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -60.5 | -44.9 | 173.6 | -65.9 | 0 | 0 | 0 | 0 | 110.8 | G135 Q139 C287 N289 G294 I295 F296 | G135-T292 WeakPolarHBondContact O-CG2 3.48Å; G135-T292 PolarHBondContact O-OG1 3.14Å; Q139-T292 HydrophobicContact CB-CG2 4.15Å; C287-T292 HydrophobicContact CB-CG2 3.73Å; N289-T292 WeakPolarHBondContact O-CB 3.4Å; N289-T292 PolarHBondContact O-N 2.95Å; N289-T292 VanDerWaalsContact O-N 3.11Å; T292-G294 VanDerWaalsContact C-N 3.33Å; T292-G294 PolarHBondContact O-N 3.33Å; T292-I295 PolarHBondContact O-N 3.22Å; T292-F296 HydrophobicContact CG2-CD1 4.34Å; T292-F296 HydrophobicContact CG2-CD2 4.31Å; T292-F296 HydrophobicContact CG2-CE1 3.68Å; T292-F296 HydrophobicContact CG2-CE2 3.64Å; T292-F296 HydrophobicContact CG2-CZ 3.29Å; T292-F296 WeakPolarHBondContact O-CD1 3.37Å; T292-F296 WeakPolarHBondContact O-CG 3.15Å; T292-F296 PolarHBondContact O-N 2.96Å |
| 293 | G | 98.6 | Very high | 98.6 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.2 | -41.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | P278 N289 P290 W291 F296 L297 | P278-G293 WeakPolarHBondContact O-CA 3.23Å; N289-G293 PolarHBondContact O-N 2.88Å; N289-G293 VanDerWaalsContact O-N 3.12Å; P290-G293 PolarHBondContact O-N 3.46Å; W291-G293 VanDerWaalsContact C-N 3.33Å; W291-G293 PolarHBondContact O-N 2.96Å; G293-F296 PolarHBondContact O-N 2.8Å; G293-L297 PolarHBondContact O-N 3Å |
| 294 | G | 98.8 | Very high | 98.5 | Very high | 35 Ų | 35 | 29.5 Ų | 29.5 | 36% | 0.361 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -63.4 | -40.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | P290 W291 T292 F296 L297 G298 | P290-G294 PolarHBondContact O-N 3.27Å; W291-G294 PolarHBondContact O-N 3.18Å; T292-G294 VanDerWaalsContact C-N 3.33Å; T292-G294 PolarHBondContact O-N 3.33Å; G294-F296 VanDerWaalsContact C-N 3.35Å; G294-L297 PolarHBondContact O-N 2.83Å; G294-G298 PolarHBondContact O-N 2.91Å |
| 295 | I | 98.8 | Very high | 98.5 | Very high | 52 Ų | 52 | 32.8 Ų | 32.8 | 27% | 0.267 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -63.2 | -42 | 174.3 | -68.3 | 165.1 | 0 | 0 | 0 | 110.4 | L131 W291 T292 G298 A299 | L131-I295 WeakPolarHBondContact O-CG2 3.44Å; W291-I295 WeakPolarHBondContact O-CG1 3.18Å; W291-I295 PolarHBondContact O-N 3.13Å; T292-I295 PolarHBondContact O-N 3.22Å; I295-G298 CarbonylContact O-C 3.51Å; I295-G298 WeakPolarHBondContact O-CA 3.31Å; I295-G298 PolarHBondContact O-N 3.36Å; I295-G298 VanDerWaalsContact O-N 3.16Å; I295-A299 PolarHBondContact O-N 3.41Å |
| 296 | F | 98.8 | Very high | 98.5 | Very high | 1 Ų | 1 | 34.8 Ų | 34.8 | 0% | 0.004 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.9 | -42.1 | 176.6 | -64.5 | -9 | 0 | 0 | 0 | 112 | I132 L136 V281 Y285 C287 T292 G293 G294 G298 A299 I300 | I132-F296 HydrophobicContact CB-CD1 4.29Å; I132-F296 HydrophobicContact CB-CE1 4.26Å; I132-F296 HydrophobicContact CG1-CD1 4.04Å; I132-F296 HydrophobicContact CG1-CE1 4.48Å; I132-F296 HydrophobicContact CG2-CD1 4.26Å; I132-F296 HydrophobicContact CG2-CE1 3.88Å; I132-F296 HydrophobicContact CG2-CZ 4.38Å; I132-F296 WeakPolarHBondContact O-CE1 3.3Å; L136-F296 HydrophobicContact CD2-CZ 3.94Å; L136-F296 HydrophobicContact CG-CE1 4.45Å; L136-F296 HydrophobicContact CG-CZ 4.09Å; V281-F296 HydrophobicContact CG1-CB 4.2Å; Y285-F296 AromaticContact CD2-CD2 3.75Å; Y285-F296 HydrophobicContact CD2-CD2 3.75Å; Y285-F296 AromaticContact CD2-CE2 3.42Å; Y285-F296 HydrophobicContact CD2-CE2 3.42Å; Y285-F296 VanDerWaalsContact CD2-CE2 3.42Å; Y285-F296 HydrophobicContact CD2-CZ 4.02Å; Y285-F296 HydrophobicContact CE2-CD2 4.14Å; Y285-F296 HydrophobicContact CE2-CE2 4.14Å; Y285-F296 AromaticContact CG-CE2 3.95Å; Y285-F296 HydrophobicContact CG-CE2 3.95Å; Y285-F296 HydrophobicContact CG-CZ 4.25Å; C287-F296 HydrophobicContact CB-CE2 4.32Å; T292-F296 HydrophobicContact CG2-CD1 4.34Å; T292-F296 HydrophobicContact CG2-CD2 4.31Å; T292-F296 HydrophobicContact CG2-CE1 3.68Å; T292-F296 HydrophobicContact CG2-CE2 3.64Å; T292-F296 HydrophobicContact CG2-CZ 3.29Å; T292-F296 WeakPolarHBondContact O-CD1 3.37Å; T292-F296 WeakPolarHBondContact O-CG 3.15Å; T292-F296 PolarHBondContact O-N 2.96Å; G293-F296 PolarHBondContact O-N 2.8Å; G294-F296 VanDerWaalsContact C-N 3.35Å; F296-G298 VanDerWaalsContact C-N 3.31Å; F296-G298 PolarHBondContact O-N 3.5Å; F296-A299 WeakPolarHBondContact O-CB 3.12Å; F296-A299 PolarHBondContact O-N 3.11Å; F296-I300 VanDerWaalsContact O-CG1 3.3Å; F296-I300 WeakPolarHBondContact O-CG1 3.44Å; F296-I300 PolarHBondContact O-N 3.18Å |
| 297 | L | 98.9 | Very high | 98.6 | Very high | 28 Ų | 28 | 34.6 Ų | 34.6 | 15% | 0.147 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.3 | -43.6 | 170.9 | -78.6 | 170.4 | 0 | 0 | 0 | 111.5 | P278 V281 G293 G294 A299 I300 L301 C308 A311 A312 | P278-L297 HydrophobicContact CB-CD1 4.35Å; V281-L297 HydrophobicContact CB-CG 4.34Å; V281-L297 HydrophobicContact CG1-CD2 4.24Å; V281-L297 HydrophobicContact CG1-CG 4.1Å; V281-L297 HydrophobicContact CG2-CD1 4.43Å; V281-L297 HydrophobicContact CG2-CD2 4Å; V281-L297 HydrophobicContact CG2-CG 4.17Å; G293-L297 PolarHBondContact O-N 3Å; G294-L297 PolarHBondContact O-N 2.83Å; L297-A299 VanDerWaalsContact C-N 3.34Å; L297-A299 PolarHBondContact O-N 3.48Å; L297-I300 PolarHBondContact O-N 3.07Å; L297-L301 VanDerWaalsContact O-CB 3.26Å; L297-L301 WeakPolarHBondContact O-CB 3.23Å; L297-L301 PolarHBondContact O-N 3.35Å; L297-C308 PolarHBondContact O-SG 3.31Å; L297-A311 HydrophobicContact CD2-CB 3.93Å; L297-A312 HydrophobicContact CD2-CB 4.38Å |
| 298 | G | 98.7 | Very high | 98.6 | Very high | 32 Ų | 32 | 35.4 Ų | 35.4 | 33% | 0.33 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -60.5 | -40.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | G294 I295 F296 L301 L302 | G294-G298 PolarHBondContact O-N 2.91Å; I295-G298 CarbonylContact O-C 3.51Å; I295-G298 WeakPolarHBondContact O-CA 3.31Å; I295-G298 PolarHBondContact O-N 3.36Å; I295-G298 VanDerWaalsContact O-N 3.16Å; F296-G298 VanDerWaalsContact C-N 3.31Å; F296-G298 PolarHBondContact O-N 3.5Å; G298-L301 PolarHBondContact O-N 3.44Å; G298-L302 PolarHBondContact O-N 2.9Å |
| 299 | A | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -65 | -40.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | S128 L131 I132 I295 F296 L297 | S128-A299 WeakPolarHBondContact CB-O 3.34Å; S128-A299 PolarHBondContact OG-O 2.84Å; L131-A299 HydrophobicContact CB-CB 3.71Å; L131-A299 HydrophobicContact CD1-CB 4.22Å; I132-A299 HydrophobicContact CD1-CB 4.21Å; I132-A299 HydrophobicContact CG1-CB 3.79Å; I295-A299 PolarHBondContact O-N 3.41Å; F296-A299 WeakPolarHBondContact O-CB 3.12Å; F296-A299 PolarHBondContact O-N 3.11Å; L297-A299 VanDerWaalsContact C-N 3.34Å; L297-A299 PolarHBondContact O-N 3.48Å |
| 300 | I | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -68.2 | -44.7 | 174.9 | -62 | 164.5 | 0 | 0 | 0 | 110 | V121 V281 F296 L297 L302 S303 S304 M307 C308 A311 | V121-I300 HydrophobicContact CB-CD1 4.14Å; V121-I300 HydrophobicContact CB-CG1 4.29Å; V121-I300 HydrophobicContact CG1-CD1 4.22Å; V121-I300 HydrophobicContact CG2-CD1 4.19Å; V121-I300 HydrophobicContact CG2-CG1 3.83Å; V281-I300 HydrophobicContact CG1-CD1 4.45Å; F296-I300 VanDerWaalsContact O-CG1 3.3Å; F296-I300 WeakPolarHBondContact O-CG1 3.44Å; F296-I300 PolarHBondContact O-N 3.18Å; L297-I300 PolarHBondContact O-N 3.07Å; I300-L302 VanDerWaalsContact C-N 3.29Å; I300-L302 PolarHBondContact O-N 3.24Å; I300-S303 PolarHBondContact O-N 3.39Å; I300-S304 PolarHBondContact O-N 3.34Å; I300-M307 HydrophobicContact CG2-CB 3.49Å; I300-M307 VanDerWaalsContact CG2-CB 3.49Å; I300-C308 HydrophobicContact CB-CB 4.39Å; I300-C308 HydrophobicContact CG2-CB 4.01Å; I300-C308 VanDerWaalsContact CG2-N 3.34Å; I300-A311 HydrophobicContact CD1-CB 4.18Å |
| 301 | L | 98.7 | Very high | 98.7 | Very high | 89 Ų | 89 | 33 Ų | 33 | 47% | 0.466 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -57.7 | -40.4 | 178.8 | 177.7 | 60.3 | 0 | 0 | 0 | 112.3 | L297 G298 S303 P305 C308 | L297-L301 VanDerWaalsContact O-CB 3.26Å; L297-L301 WeakPolarHBondContact O-CB 3.23Å; L297-L301 PolarHBondContact O-N 3.35Å; G298-L301 PolarHBondContact O-N 3.44Å; L301-S303 PolarHBondContact O-N 3.38Å; L301-P305 HydrophobicContact CD1-CB 3.92Å; L301-P305 HydrophobicContact CD1-CG 4.07Å; L301-C308 HydrophobicContact CB-CB 3.91Å; L301-C308 HydrophobicContact CD1-CB 4.25Å |
| 302 | L | 98.1 | Very high | 98.7 | Very high | 35 Ų | 35 | 25.5 Ų | 25.5 | 18% | 0.183 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -57 | -40.9 | 175.8 | 178.1 | 65.9 | 0 | 0 | 0 | 111.6 | L86 V89 T90 I127 L131 G298 I300 | L86-L302 HydrophobicContact CD1-CD1 4.48Å; V89-L302 HydrophobicContact CB-CD1 4.47Å; V89-L302 HydrophobicContact CG2-CD1 3.9Å; T90-L302 WeakPolarHBondContact CA-O 3.35Å; T90-L302 WeakPolarHBondContact CG2-O 3.28Å; I127-L302 HydrophobicContact CB-CD2 3.97Å; I127-L302 HydrophobicContact CG2-CD2 3.53Å; L131-L302 HydrophobicContact CD1-CD2 3.92Å; G298-L302 PolarHBondContact O-N 2.9Å; I300-L302 VanDerWaalsContact C-N 3.29Å; I300-L302 PolarHBondContact O-N 3.24Å |
| 303 | S | 98.3 | Very high | 98.7 | Very high | 4 Ų | 4 | 27.4 Ų | 27.4 | 3% | 0.028 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -78.1 | -55.6 | 178.3 | -179.9 | 0 | 0 | 0 | 0 | 111.7 | G91 I300 L301 | G91-S303 WeakPolarHBondContact CA-O 3.46Å; G91-S303 PolarHBondContact N-O 2.63Å; G91-S303 PolarHBondContact O-OG 3.39Å; I300-S303 PolarHBondContact O-N 3.39Å; L301-S303 PolarHBondContact O-N 3.38Å |
| 304 | S | 98.6 | Very high | 98.7 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 17% | 0.17 | C | C | . | . | trans | -147.8 | 115.2 | -176.5 | 170.2 | 0 | 0 | 0 | 0 | 111.3 | I300 L306 M307 C308 E422 | I300-S304 PolarHBondContact O-N 3.34Å; S304-L306 PolarHBondContact O-N 3.3Å; S304-L306 PolarHBondContact OG-N 3.2Å; S304-M307 PolarHBondContact O-N 3.45Å; S304-M307 WeakPolarHBondContact OG-CG 3.34Å; S304-M307 PolarHBondContact OG-N 2.95Å; S304-M307 VanDerWaalsContact OG-N 3.16Å; S304-C308 PolarHBondContact O-N 3.25Å; S304-C308 VanDerWaalsContact O-N 3.1Å; S304-E422 WeakPolarHBondContact CB-OE2 3.35Å; S304-E422 VanDerWaalsContact OG-CD 3.25Å; S304-E422 PolarHBondContact OG-OE1 3.41Å; S304-E422 VanDerWaalsContact OG-OE1 3.07Å; S304-E422 PolarHBondContact OG-OE2 2.99Å | ||
| 305 | P | 98.6 | Very high | 98.7 | Very high | 74 Ų | 74 | 25.8 Ų | 25.8 | 48% | 0.481 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -56.9 | -35.5 | 170.4 | -26.2 | 34.1 | 0 | 0 | 0 | 113.8 | L301 C308 L309 E422 | L301-P305 HydrophobicContact CD1-CB 3.92Å; L301-P305 HydrophobicContact CD1-CG 4.07Å; P305-C308 PolarHBondContact O-N 3.37Å; P305-L309 WeakPolarHBondContact O-CB 3.45Å; P305-L309 PolarHBondContact O-N 2.95Å; P305-E422 WeakPolarHBondContact CD-OE1 3.45Å |
| 306 | L | 98.7 | Very high | 98.7 | Very high | 43 Ų | 43 | 27.5 Ų | 27.5 | 23% | 0.225 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -67.9 | -38 | 178.3 | -69.9 | 177.2 | 0 | 0 | 0 | 112.4 | S304 H310 L355 P421 E422 | S304-L306 PolarHBondContact O-N 3.3Å; S304-L306 PolarHBondContact OG-N 3.2Å; L306-H310 PolarHBondContact O-N 3.46Å; L306-H310 VanDerWaalsContact O-N 3.16Å; L306-H310 PolarHBondContact O-ND1 2.8Å; L306-L355 HydrophobicContact CD1-CD2 3.75Å; L306-L355 HydrophobicContact CD2-CD2 3.93Å; L306-L355 HydrophobicContact CG-CD2 4.36Å; L306-P421 HydrophobicContact CB-CB 3.84Å; L306-P421 HydrophobicContact CB-CG 4.29Å; L306-P421 HydrophobicContact CD1-CB 3.89Å; L306-E422 HydrophobicContact CD1-CG 3.83Å; L306-E422 HydrophobicContact CG-CG 4.35Å; L306-E422 WeakPolarHBondContact CG-OE1 3.24Å; L306-E422 PolarHBondContact N-OE1 2.86Å |
| 307 | M | 98.9 | Very high | 98.7 | Very high | 2 Ų | 2 | 29 Ų | 29 | 1% | 0.01 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.9 | -43.9 | 173.1 | -66.6 | 176.6 | 71.9 | 0 | 0 | 110.9 | V121 F122 V123 I300 S304 L309 H310 A311 I346 M351 P421 | V121-M307 WeakPolarHBondContact O-CE 3.38Å; F122-M307 HydrophobicContact CB-CE 3.91Å; V123-M307 HydrophobicContact CG2-CE 3.66Å; V123-M307 HydrophobicContact CG2-SD 4.19Å; I300-M307 HydrophobicContact CG2-CB 3.49Å; I300-M307 VanDerWaalsContact CG2-CB 3.49Å; S304-M307 PolarHBondContact O-N 3.45Å; S304-M307 WeakPolarHBondContact OG-CG 3.34Å; S304-M307 PolarHBondContact OG-N 2.95Å; S304-M307 VanDerWaalsContact OG-N 3.16Å; M307-L309 VanDerWaalsContact C-N 3.32Å; M307-L309 PolarHBondContact O-N 3.25Å; M307-H310 PolarHBondContact O-N 3.36Å; M307-A311 WeakPolarHBondContact O-CB 3.33Å; M307-A311 PolarHBondContact O-N 2.84Å; M307-I346 HydrophobicContact CB-CG2 4.09Å; M307-I346 HydrophobicContact CE-CG2 3.59Å; M307-I346 HydrophobicContact CG-CG2 4.11Å; M307-M351 HydrophobicContact CE-SD 4Å; M307-M351 HydrophobicContact SD-SD 4Å; M307-P421 VanDerWaalsContact CG-CD 3.47Å; M307-P421 HydrophobicContact CG-CG 3.53Å; M307-P421 HydrophobicContact SD-CG 4.43Å |
| 308 | C | 98.9 | Very high | 98.7 | Very high | 18 Ų | 18 | 27.7 Ų | 27.7 | 12% | 0.122 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.2 | -41.8 | 178.9 | -178.2 | 0 | 0 | 0 | 0 | 111.8 | L297 I300 L301 S304 P305 A311 A312 | L297-C308 PolarHBondContact O-SG 3.31Å; I300-C308 HydrophobicContact CB-CB 4.39Å; I300-C308 HydrophobicContact CG2-CB 4.01Å; I300-C308 VanDerWaalsContact CG2-N 3.34Å; L301-C308 HydrophobicContact CB-CB 3.91Å; L301-C308 HydrophobicContact CD1-CB 4.25Å; S304-C308 PolarHBondContact O-N 3.25Å; S304-C308 VanDerWaalsContact O-N 3.1Å; P305-C308 PolarHBondContact O-N 3.37Å; C308-A311 WeakPolarHBondContact O-CB 3.45Å; C308-A311 PolarHBondContact O-N 2.98Å; C308-A312 PolarHBondContact O-N 3.36Å; C308-A312 VanDerWaalsContact O-N 3.12Å |
| 309 | L | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 26.4 Ų | 26.4 | 48% | 0.476 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -59.4 | -49.6 | 175.9 | 177.8 | 63.9 | 0 | 0 | 0 | 111.3 | P305 M307 A311 A312 I313 | P305-L309 WeakPolarHBondContact O-CB 3.45Å; P305-L309 PolarHBondContact O-N 2.95Å; M307-L309 VanDerWaalsContact C-N 3.32Å; M307-L309 PolarHBondContact O-N 3.25Å; L309-A311 VanDerWaalsContact C-N 3.33Å; L309-A311 PolarHBondContact O-N 3.4Å; L309-A312 PolarHBondContact O-N 3.35Å; L309-I313 HydrophobicContact CD1-CD1 3.84Å; L309-I313 HydrophobicContact CD1-CG1 4.28Å; L309-I313 HydrophobicContact CD2-CD1 4.47Å; L309-I313 HydrophobicContact CG-CD1 3.78Å; L309-I313 VanDerWaalsContact O-CG1 3.3Å; L309-I313 WeakPolarHBondContact O-CG1 3.48Å; L309-I313 PolarHBondContact O-N 2.89Å |
| 310 | H | 98.9 | Very high | 98.7 | Very high | 2 Ų | 2 | 28.7 Ų | 28.7 | 1% | 0.009 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -68.8 | -31.3 | 179.6 | -72.1 | 89.7 | 0 | 0 | 0 | 112.6 | L306 M307 I313 G314 C345 G349 H360 | L306-H310 PolarHBondContact O-N 3.46Å; L306-H310 VanDerWaalsContact O-N 3.16Å; L306-H310 PolarHBondContact O-ND1 2.8Å; M307-H310 PolarHBondContact O-N 3.36Å; H310-I313 PolarHBondContact O-N 3.39Å; H310-G314 PolarHBondContact O-N 2.78Å; H310-C345 HydrophobicContact CB-CB 4.4Å; H310-C345 WeakPolarHBondContact O-CB 3.47Å; H310-G349 PolarHBondContact CE1-O 3.46Å; H310-G349 VanDerWaalsContact CE1-O 3.27Å; H310-G349 PolarHBondContact ND1-O 2.83Å; H310-H360 AromaticContact CD2-ND1 3.86Å; H310-H360 AromaticContact CE1-ND1 3.93Å; H310-H360 AromaticContact NE2-CE1 3.74Å; H310-H360 AromaticContact NE2-ND1 3.01Å; H310-H360 PolarHBondContact NE2-ND1 2.87Å |
| 311 | A | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.9 | -48.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | V281 L297 I300 M307 C308 L309 S315 S342 I346 | V281-A311 HydrophobicContact CG2-CB 4.49Å; L297-A311 HydrophobicContact CD2-CB 3.93Å; I300-A311 HydrophobicContact CD1-CB 4.18Å; M307-A311 WeakPolarHBondContact O-CB 3.33Å; M307-A311 PolarHBondContact O-N 2.84Å; C308-A311 WeakPolarHBondContact O-CB 3.45Å; C308-A311 PolarHBondContact O-N 2.98Å; L309-A311 VanDerWaalsContact C-N 3.33Å; L309-A311 PolarHBondContact O-N 3.4Å; A311-S315 PolarHBondContact O-N 3.23Å; A311-S315 VanDerWaalsContact O-N 3.11Å; A311-S342 VanDerWaalsContact CA-OG 3.29Å; A311-S342 WeakPolarHBondContact CA-OG 3.5Å; A311-S342 WeakPolarHBondContact O-CB 3.44Å; A311-S342 PolarHBondContact O-OG 3.32Å; A311-I346 HydrophobicContact CB-CD1 3.6Å; A311-I346 HydrophobicContact CB-CG1 3.74Å |
| 312 | A | 98.9 | Very high | 98.7 | Very high | 30 Ų | 30 | 24.4 Ų | 24.4 | 25% | 0.248 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -67.2 | -44.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | I277 L297 C308 L309 S315 L316 | I277-A312 HydrophobicContact CG2-CB 4.37Å; L297-A312 HydrophobicContact CD2-CB 4.38Å; C308-A312 PolarHBondContact O-N 3.36Å; C308-A312 VanDerWaalsContact O-N 3.12Å; L309-A312 PolarHBondContact O-N 3.35Å; A312-S315 PolarHBondContact O-N 3.45Å; A312-L316 WeakPolarHBondContact O-CB 3.35Å; A312-L316 PolarHBondContact O-N 3.05Å |
| 313 | I | 98.9 | Very high | 98.7 | Very high | 40 Ų | 40 | 24.7 Ų | 24.7 | 21% | 0.205 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -61.7 | -45.6 | 177.1 | -69.7 | 171.9 | 0 | 0 | 0 | 111 | L309 H310 S315 L316 L317 L364 | L309-I313 HydrophobicContact CD1-CD1 3.84Å; L309-I313 HydrophobicContact CD1-CG1 4.28Å; L309-I313 HydrophobicContact CD2-CD1 4.47Å; L309-I313 HydrophobicContact CG-CD1 3.78Å; L309-I313 VanDerWaalsContact O-CG1 3.3Å; L309-I313 WeakPolarHBondContact O-CG1 3.48Å; L309-I313 PolarHBondContact O-N 2.89Å; H310-I313 PolarHBondContact O-N 3.39Å; I313-S315 VanDerWaalsContact C-N 3.34Å; I313-S315 PolarHBondContact O-N 2.97Å; I313-L316 WeakPolarHBondContact O-CB 3.47Å; I313-L316 PolarHBondContact O-N 2.67Å; I313-L317 HydrophobicContact CG2-CD1 3.99Å; I313-L317 HydrophobicContact CG2-CG 4.27Å; I313-L317 WeakPolarHBondContact O-CG 3.43Å; I313-L317 PolarHBondContact O-N 3.26Å; I313-L364 HydrophobicContact CG2-CD2 3.41Å; I313-L364 VanDerWaalsContact CG2-CD2 3.41Å |
| 314 | G | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63 | -39.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | H310 L317 G318 S341 | H310-G314 PolarHBondContact O-N 2.78Å; G314-L317 PolarHBondContact O-N 3.36Å; G314-G318 PolarHBondContact O-N 2.94Å; G314-S341 VanDerWaalsContact O-CB 3.23Å; G314-S341 WeakPolarHBondContact O-CB 3.38Å; G314-S341 PolarHBondContact O-OG 2.94Å |
| 315 | S | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.7 | -42.2 | 174.3 | -171.8 | 0 | 0 | 0 | 0 | 112.3 | I277 G280 A311 A312 I313 G318 T319 | I277-S315 WeakPolarHBondContact CA-OG 3.4Å; I277-S315 WeakPolarHBondContact O-CB 3.45Å; I277-S315 PolarHBondContact O-OG 2.95Å; G280-S315 WeakPolarHBondContact CA-OG 3.4Å; A311-S315 PolarHBondContact O-N 3.23Å; A311-S315 VanDerWaalsContact O-N 3.11Å; A312-S315 PolarHBondContact O-N 3.45Å; I313-S315 VanDerWaalsContact C-N 3.34Å; I313-S315 PolarHBondContact O-N 2.97Å; S315-G318 PolarHBondContact O-N 3.34Å; S315-T319 PolarHBondContact O-N 3.14Å; S315-T319 PolarHBondContact O-OG1 2.82Å |
| 316 | L | 98.9 | Very high | 98.6 | Very high | 88 Ų | 88 | 31 Ų | 31 | 46% | 0.461 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -62.2 | -44.7 | 174.1 | 175.4 | 62.9 | 0 | 0 | 0 | 112.3 | I277 A312 I313 G318 T319 A320 | I277-L316 HydrophobicContact CD1-CB 4.36Å; I277-L316 HydrophobicContact CD1-CD1 3.98Å; I277-L316 HydrophobicContact CG1-CB 4.44Å; I277-L316 HydrophobicContact CG1-CD1 4.39Å; A312-L316 WeakPolarHBondContact O-CB 3.35Å; A312-L316 PolarHBondContact O-N 3.05Å; I313-L316 WeakPolarHBondContact O-CB 3.47Å; I313-L316 PolarHBondContact O-N 2.67Å; L316-G318 VanDerWaalsContact C-N 3.3Å; L316-G318 PolarHBondContact O-N 2.64Å; L316-T319 WeakPolarHBondContact O-CB 3.32Å; L316-T319 PolarHBondContact O-N 3.07Å; L316-A320 PolarHBondContact O-N 2.89Å |
| 317 | L | 98.9 | Very high | 98.6 | Very high | 33 Ų | 33 | 29.3 Ų | 29.3 | 17% | 0.173 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -65 | -35.2 | 177.6 | -72.9 | 177.1 | 0 | 0 | 0 | 112.2 | I313 G314 A320 A321 L364 A367 L368 | I313-L317 HydrophobicContact CG2-CD1 3.99Å; I313-L317 HydrophobicContact CG2-CG 4.27Å; I313-L317 WeakPolarHBondContact O-CG 3.43Å; I313-L317 PolarHBondContact O-N 3.26Å; G314-L317 PolarHBondContact O-N 3.36Å; L317-A320 PolarHBondContact O-N 3.18Å; L317-A321 WeakPolarHBondContact O-CB 3.11Å; L317-A321 PolarHBondContact O-N 2.93Å; L317-L364 HydrophobicContact CD1-CB 3.92Å; L317-L364 HydrophobicContact CD1-CD2 3.81Å; L317-L364 HydrophobicContact CD1-CG 4.42Å; L317-A367 HydrophobicContact CB-CB 4.46Å; L317-A367 HydrophobicContact CD1-CB 3.89Å; L317-L368 HydrophobicContact CB-CD2 4.05Å; L317-L368 HydrophobicContact CB-CG 4.26Å; L317-L368 HydrophobicContact CD1-CG 4.38Å; L317-L368 HydrophobicContact CD2-CD1 4.36Å; L317-L368 HydrophobicContact CD2-CD2 4.13Å; L317-L368 HydrophobicContact CD2-CG 4.16Å |
| 318 | G | 98.8 | Very high | 98.5 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.6 | -48.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112 | G314 S315 L316 A320 A321 G322 W337 S341 | G314-G318 PolarHBondContact O-N 2.94Å; S315-G318 PolarHBondContact O-N 3.34Å; L316-G318 VanDerWaalsContact C-N 3.3Å; L316-G318 PolarHBondContact O-N 2.64Å; G318-A320 VanDerWaalsContact C-N 3.31Å; G318-A320 PolarHBondContact O-N 3.3Å; G318-A321 WeakPolarHBondContact O-CB 3.32Å; G318-A321 PolarHBondContact O-N 3.49Å; G318-A321 VanDerWaalsContact O-N 3.14Å; G318-G322 PolarHBondContact O-N 3.46Å; G318-W337 WeakPolarHBondContact CA-O 3.43Å; G318-W337 WeakPolarHBondContact O-CB 3.1Å; G318-S341 WeakPolarHBondContact CA-OG 3.45Å |
| 319 | T | 98.6 | Very high | 98.5 | Very high | 5 Ų | 5 | 31.7 Ų | 31.7 | 3% | 0.031 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -55.2 | -46.1 | 173.6 | -63 | 0 | 0 | 0 | 0 | 111.4 | L273 S276 S315 L316 A321 G322 L323 I332 | L273-T319 HydrophobicContact CD2-CG2 3.78Å; S276-T319 WeakPolarHBondContact OG-CG2 3.39Å; S276-T319 PolarHBondContact OG-OG1 3.24Å; S276-T319 VanDerWaalsContact OG-OG1 3.04Å; S315-T319 PolarHBondContact O-N 3.14Å; S315-T319 PolarHBondContact O-OG1 2.82Å; L316-T319 WeakPolarHBondContact O-CB 3.32Å; L316-T319 PolarHBondContact O-N 3.07Å; T319-A321 PolarHBondContact O-N 3.14Å; T319-G322 PolarHBondContact O-N 3.38Å; T319-L323 PolarHBondContact O-N 3.38Å; T319-L323 VanDerWaalsContact O-N 3.09Å; T319-I332 HydrophobicContact CG2-CG2 3.69Å |
| 320 | A | 98.6 | Very high | 98.4 | Very high | 48 Ų | 48 | 35 Ų | 35 | 40% | 0.397 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -64.1 | -38 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | L316 L317 G318 G322 L323 S324 | L316-A320 PolarHBondContact O-N 2.89Å; L317-A320 PolarHBondContact O-N 3.18Å; G318-A320 VanDerWaalsContact C-N 3.31Å; G318-A320 PolarHBondContact O-N 3.3Å; A320-G322 VanDerWaalsContact C-N 3.35Å; A320-L323 PolarHBondContact O-N 2.95Å; A320-S324 PolarHBondContact O-N 3.42Å |
| 321 | A | 98.7 | Very high | 98.3 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67.5 | -33.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L317 G318 T319 S324 L325 W337 L368 A371 Y372 | L317-A321 WeakPolarHBondContact O-CB 3.11Å; L317-A321 PolarHBondContact O-N 2.93Å; G318-A321 WeakPolarHBondContact O-CB 3.32Å; G318-A321 PolarHBondContact O-N 3.49Å; G318-A321 VanDerWaalsContact O-N 3.14Å; T319-A321 PolarHBondContact O-N 3.14Å; A321-S324 PolarHBondContact O-N 3.5Å; A321-S324 PolarHBondContact O-OG 3.32Å; A321-L325 PolarHBondContact O-N 3.32Å; A321-W337 HydrophobicContact CB-CE3 4.4Å; A321-W337 HydrophobicContact CB-CZ3 4.48Å; A321-L368 HydrophobicContact CB-CD2 4.24Å; A321-A371 HydrophobicContact CB-CB 3.65Å; A321-Y372 HydrophobicContact CB-CD1 4.3Å; A321-Y372 HydrophobicContact CB-CE1 3.84Å |
| 322 | G | 98.4 | Very high | 98.3 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.4 | -45.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112 | G318 T319 A320 S324 L325 S326 A327 W337 | G318-G322 PolarHBondContact O-N 3.46Å; T319-G322 PolarHBondContact O-N 3.38Å; A320-G322 VanDerWaalsContact C-N 3.35Å; G322-S324 PolarHBondContact O-N 3.03Å; G322-L325 PolarHBondContact O-N 2.82Å; G322-S326 PolarHBondContact O-N 3.49Å; G322-A327 VanDerWaalsContact O-CB 3.28Å; G322-A327 WeakPolarHBondContact O-CB 3.49Å; G322-A327 PolarHBondContact O-N 3.09Å; G322-W337 VanDerWaalsContact N-CE3 3.29Å |
| 323 | L | 98.3 | Very high | 98.3 | Very high | 40 Ų | 40 | 38.7 Ų | 38.7 | 21% | 0.209 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.7 | -39.5 | 175.7 | -66.9 | 173.5 | 0 | 0 | 0 | 112.2 | L268 L273 T319 A320 L325 S326 F329 I332 | L268-L323 HydrophobicContact CD1-CD2 3.95Å; L268-L323 HydrophobicContact CD2-CD2 4.46Å; L273-L323 HydrophobicContact CD1-CD1 4.25Å; L273-L323 HydrophobicContact CD2-CD1 4.04Å; L273-L323 HydrophobicContact CD2-CD2 4.37Å; T319-L323 PolarHBondContact O-N 3.38Å; T319-L323 VanDerWaalsContact O-N 3.09Å; A320-L323 PolarHBondContact O-N 2.95Å; L323-L325 PolarHBondContact O-N 3.48Å; L323-S326 PolarHBondContact O-N 3.39Å; L323-F329 HydrophobicContact CD2-CD1 4.35Å; L323-F329 HydrophobicContact CD2-CE1 4.1Å; L323-I332 HydrophobicContact CD2-CD1 3.67Å; L323-I332 HydrophobicContact CG-CD1 3.99Å |
| 324 | S | 98.5 | Very high | 98.3 | Very high | 71 Ų | 71 | 41.2 Ų | 41.2 | 50% | 0.497 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -65.4 | -27.8 | -179.9 | 74.8 | 0 | 0 | 0 | 0 | 113.2 | A320 A321 G322 Y372 | A320-S324 PolarHBondContact O-N 3.42Å; A321-S324 PolarHBondContact O-N 3.5Å; A321-S324 PolarHBondContact O-OG 3.32Å; G322-S324 PolarHBondContact O-N 3.03Å; S324-Y372 PolarHBondContact OG-OH 3.02Å |
| 325 | L | 97.9 | Very high | 98.2 | Very high | 92 Ų | 92 | 41.2 Ų | 41.2 | 48% | 0.482 | 23% | 0.225 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | 8.7 | 174.4 | -69.6 | -177.5 | 0 | 0 | 0 | 113.8 | A321 G322 L323 A327 W337 Y372 V375 | A321-L325 PolarHBondContact O-N 3.32Å; G322-L325 PolarHBondContact O-N 2.82Å; L323-L325 PolarHBondContact O-N 3.48Å; L325-A327 PolarHBondContact O-N 3.23Å; L325-W337 HydrophobicContact CB-CH2 4.07Å; L325-W337 HydrophobicContact CD1-CH2 3.75Å; L325-W337 HydrophobicContact CD1-CZ3 4.05Å; L325-W337 HydrophobicContact CG-CH2 4.45Å; L325-Y372 HydrophobicContact CD1-CD1 3.52Å; L325-Y372 HydrophobicContact CD1-CE1 3.8Å; L325-Y372 HydrophobicContact CD2-CE1 4.38Å; L325-Y372 HydrophobicContact CG-CD1 4.08Å; L325-Y372 HydrophobicContact CG-CE1 3.81Å; L325-V375 HydrophobicContact CD1-CG1 3.84Å |
| 326 | S | 97.3 | Very high | 98.2 | Very high | 48 Ų | 48 | 44.7 Ų | 44.7 | 34% | 0.336 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 52.4 | 45.7 | -176.7 | -171.4 | 0 | 0 | 0 | 0 | 111.4 | I263 G322 L323 | I263-S326 WeakPolarHBondContact CD1-O 3.47Å; I263-S326 WeakPolarHBondContact CD1-OG 3.35Å; G322-S326 PolarHBondContact O-N 3.49Å; L323-S326 PolarHBondContact O-N 3.39Å |
| 327 | A | 97.5 | Very high | 98.2 | Very high | 8 Ų | 8 | 41.6 Ų | 41.6 | 7% | 0.066 | 23% | 0.225 | C | C | . | . | trans | -67.5 | 151 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | G322 L325 F329 I332 W337 | G322-A327 VanDerWaalsContact O-CB 3.28Å; G322-A327 WeakPolarHBondContact O-CB 3.49Å; G322-A327 PolarHBondContact O-N 3.09Å; L325-A327 PolarHBondContact O-N 3.23Å; A327-F329 PolarHBondContact O-N 3.47Å; A327-I332 HydrophobicContact CB-CD1 4.18Å; A327-I332 HydrophobicContact CB-CG1 4.2Å; A327-W337 VanDerWaalsContact CB-CE2 3.49Å; A327-W337 HydrophobicContact CB-CH2 4.19Å; A327-W337 HydrophobicContact CB-CZ2 3.29Å | ||
| 328 | P | 97.4 | Very high | 98.2 | Very high | 44 Ų | 44 | 40 Ų | 40 | 29% | 0.286 | 22% | 0.217 | S | C | . | . | trans | -52.2 | 132.1 | 171.1 | -24.3 | 34 | 0 | 0 | 0 | 110.9 | P261 E330 D331 I332 | P261-P328 HydrophobicContact CB-CG 3.94Å; P261-P328 HydrophobicContact CG-CG 4.1Å; P328-E330 PolarHBondContact O-N 3.46Å; P328-D331 PolarHBondContact O-N 2.91Å; P328-D331 VanDerWaalsContact O-N 3.14Å; P328-I332 PolarHBondContact O-N 3.13Å | ||
| 329 | F | 97.9 | Very high | 98.2 | Very high | 25 Ų | 25 | 41.2 Ų | 41.2 | 11% | 0.11 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62 | -30.2 | -176.3 | -61.4 | -26.2 | 0 | 0 | 0 | 112.6 | I263 S264 W265 L268 L323 A327 D331 I332 Y333 | I263-F329 HydrophobicContact CG2-CE1 3.98Å; I263-F329 HydrophobicContact CG2-CE2 4.03Å; I263-F329 HydrophobicContact CG2-CZ 3.63Å; S264-F329 WeakPolarHBondContact O-CE2 3.21Å; W265-F329 HydrophobicContact CD2-CZ 4.32Å; W265-F329 HydrophobicContact CE3-CE1 4.42Å; W265-F329 HydrophobicContact CE3-CZ 4.06Å; W265-F329 HydrophobicContact CZ3-CE1 4.4Å; W265-F329 HydrophobicContact CZ3-CZ 4.49Å; L268-F329 HydrophobicContact CB-CE2 3.88Å; L268-F329 HydrophobicContact CB-CZ 3.95Å; L268-F329 HydrophobicContact CD1-CD1 3.92Å; L268-F329 HydrophobicContact CD1-CD2 4.29Å; L268-F329 HydrophobicContact CD1-CE1 3.76Å; L268-F329 HydrophobicContact CD1-CE2 4.12Å; L268-F329 HydrophobicContact CD1-CG 4.21Å; L268-F329 HydrophobicContact CD1-CZ 3.86Å; L268-F329 HydrophobicContact CG-CZ 4.38Å; L323-F329 HydrophobicContact CD2-CD1 4.35Å; L323-F329 HydrophobicContact CD2-CE1 4.1Å; A327-F329 PolarHBondContact O-N 3.47Å; F329-D331 PolarHBondContact O-N 2.91Å; F329-I332 HydrophobicContact CD1-CD1 4.39Å; F329-I332 WeakPolarHBondContact O-CB 3.44Å; F329-I332 PolarHBondContact O-N 2.96Å; F329-Y333 HydrophobicContact CB-CD2 4.29Å; F329-Y333 HydrophobicContact CB-CE1 4.31Å; F329-Y333 HydrophobicContact CB-CE2 3.72Å; F329-Y333 WeakPolarHBondContact O-CB 3.32Å; F329-Y333 WeakPolarHBondContact O-CD1 3.42Å; F329-Y333 WeakPolarHBondContact O-CD2 3.49Å; F329-Y333 PolarHBondContact O-N 3.38Å |
| 330 | E | 97.2 | Very high | 98.2 | Very high | 161 Ų | 161 | 41.3 Ų | 41.3 | 75% | 0.752 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -58.6 | -45 | 175.2 | -63.7 | -178.1 | -179.5 | 0 | 0 | 112 | P328 I332 Y333 F334 | P328-E330 PolarHBondContact O-N 3.46Å; E330-I332 VanDerWaalsContact C-N 3.27Å; E330-I332 PolarHBondContact O-N 2.98Å; E330-Y333 PolarHBondContact O-N 3.4Å; E330-F334 WeakPolarHBondContact O-CB 3.41Å; E330-F334 PolarHBondContact O-N 3.2Å |
| 331 | D | 97.8 | Very high | 98.2 | Very high | 64 Ų | 64 | 39 Ų | 39 | 34% | 0.342 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -64 | -35.1 | 177.7 | -65 | -28.3 | 0 | 0 | 0 | 111.9 | P328 F329 G335 L336 | P328-D331 PolarHBondContact O-N 2.91Å; P328-D331 VanDerWaalsContact O-N 3.14Å; F329-D331 PolarHBondContact O-N 2.91Å; D331-G335 PolarHBondContact O-N 2.88Å; D331-L336 HydrophobicContact CB-CD1 4.28Å; D331-L336 WeakPolarHBondContact O-CB 3.5Å; D331-L336 PolarHBondContact O-N 3.14Å |
| 332 | I | 98.4 | Very high | 98.2 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -69.7 | -50.3 | 176.8 | -60.1 | 177.7 | 0 | 0 | 0 | 109.9 | L273 S276 T319 L323 A327 P328 F329 E330 F334 G335 W337 | L273-I332 HydrophobicContact CD2-CG2 4.04Å; S276-I332 VanDerWaalsContact CB-O 3.28Å; S276-I332 WeakPolarHBondContact CB-O 3.42Å; T319-I332 HydrophobicContact CG2-CG2 3.69Å; L323-I332 HydrophobicContact CD2-CD1 3.67Å; L323-I332 HydrophobicContact CG-CD1 3.99Å; A327-I332 HydrophobicContact CB-CD1 4.18Å; A327-I332 HydrophobicContact CB-CG1 4.2Å; P328-I332 PolarHBondContact O-N 3.13Å; F329-I332 HydrophobicContact CD1-CD1 4.39Å; F329-I332 WeakPolarHBondContact O-CB 3.44Å; F329-I332 PolarHBondContact O-N 2.96Å; E330-I332 VanDerWaalsContact C-N 3.27Å; E330-I332 PolarHBondContact O-N 2.98Å; I332-F334 VanDerWaalsContact C-N 3.28Å; I332-F334 PolarHBondContact O-N 3.11Å; I332-G335 WeakPolarHBondContact O-CA 3.25Å; I332-G335 PolarHBondContact O-N 3.1Å; I332-W337 HydrophobicContact CG1-CG 4.46Å |
| 333 | Y | 98.6 | Very high | 98.2 | Very high | 45 Ų | 45 | 39.1 Ų | 39.1 | 18% | 0.176 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -65.2 | -33.4 | -179.1 | -59.1 | -20.7 | 0 | 0 | 0 | 112.1 | S269 E272 L273 F329 E330 G335 | S269-Y333 PolarHBondContact N-OH 3.26Å; E272-Y333 HydrophobicContact CB-CD1 3.57Å; E272-Y333 HydrophobicContact CB-CD2 3.81Å; E272-Y333 HydrophobicContact CB-CE1 3.53Å; E272-Y333 HydrophobicContact CB-CE2 3.77Å; E272-Y333 HydrophobicContact CB-CG 3.72Å; E272-Y333 HydrophobicContact CG-CD2 4.26Å; E272-Y333 HydrophobicContact CG-CE2 4.19Å; L273-Y333 HydrophobicContact CD2-CD1 4.46Å; L273-Y333 HydrophobicContact CD2-CE1 3.9Å; L273-Y333 HydrophobicContact CG-CE1 4.12Å; F329-Y333 HydrophobicContact CB-CD2 4.29Å; F329-Y333 HydrophobicContact CB-CE1 4.31Å; F329-Y333 HydrophobicContact CB-CE2 3.72Å; F329-Y333 WeakPolarHBondContact O-CB 3.32Å; F329-Y333 WeakPolarHBondContact O-CD1 3.42Å; F329-Y333 WeakPolarHBondContact O-CD2 3.49Å; F329-Y333 PolarHBondContact O-N 3.38Å; E330-Y333 PolarHBondContact O-N 3.4Å; Y333-G335 PolarHBondContact O-N 3.35Å |
| 334 | F | 98.3 | Very high | 98.2 | Very high | 93 Ų | 93 | 37.2 Ų | 37.2 | 41% | 0.408 | 19% | 0.194 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -0.4 | 172.5 | -153.7 | -105.7 | 0 | 0 | 0 | 113.2 | V279 Q283 D288 E330 I332 L336 | V279-F334 VanDerWaalsContact CG1-C 3.5Å; V279-F334 WeakPolarHBondContact CG1-O 3.24Å; Q283-F334 VanDerWaalsContact CG-O 3.24Å; Q283-F334 WeakPolarHBondContact CG-O 3.37Å; Q283-F334 PolarHBondContact NE2-O 3.25Å; D288-F334 HydrophobicContact CB-CD2 3.93Å; D288-F334 HydrophobicContact CB-CE1 4.05Å; D288-F334 HydrophobicContact CB-CE2 3.36Å; D288-F334 HydrophobicContact CB-CG 4.48Å; D288-F334 HydrophobicContact CB-CZ 3.42Å; D288-F334 VanDerWaalsContact CB-CZ 3.42Å; D288-F334 WeakPolarHBondContact OD2-CE2 3.34Å; D288-F334 WeakPolarHBondContact OD2-CZ 3.45Å; E330-F334 WeakPolarHBondContact O-CB 3.41Å; E330-F334 PolarHBondContact O-N 3.2Å; I332-F334 VanDerWaalsContact C-N 3.28Å; I332-F334 PolarHBondContact O-N 3.11Å; F334-L336 VanDerWaalsContact C-N 3.3Å; F334-L336 HydrophobicContact CB-CG 4.37Å; F334-L336 HydrophobicContact CD1-CD1 4.34Å; F334-L336 HydrophobicContact CD1-CD2 3.83Å; F334-L336 HydrophobicContact CD1-CG 3.94Å; F334-L336 HydrophobicContact CE1-CD2 4.44Å; F334-L336 PolarHBondContact O-N 2.73Å |
| 335 | G | 98.3 | Very high | 98.3 | Very high | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 17% | 0.171 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 75.9 | 9.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115 | D331 I332 Y333 W337 G338 | D331-G335 PolarHBondContact O-N 2.88Å; I332-G335 WeakPolarHBondContact O-CA 3.25Å; I332-G335 PolarHBondContact O-N 3.1Å; Y333-G335 PolarHBondContact O-N 3.35Å; G335-W337 PolarHBondContact O-N 2.89Å; G335-W337 VanDerWaalsContact O-N 3.14Å; G335-G338 PolarHBondContact O-N 2.89Å |
| 336 | L | 98.3 | Very high | 98.3 | Very high | 73 Ų | 73 | 29.4 Ų | 29.4 | 38% | 0.382 | 15% | 0.148 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.6 | -23 | -175.9 | -62.2 | -177.9 | 0 | 0 | 0 | 113 | D331 F334 F339 | D331-L336 HydrophobicContact CB-CD1 4.28Å; D331-L336 WeakPolarHBondContact O-CB 3.5Å; D331-L336 PolarHBondContact O-N 3.14Å; F334-L336 VanDerWaalsContact C-N 3.3Å; F334-L336 HydrophobicContact CB-CG 4.37Å; F334-L336 HydrophobicContact CD1-CD1 4.34Å; F334-L336 HydrophobicContact CD1-CD2 3.83Å; F334-L336 HydrophobicContact CD1-CG 3.94Å; F334-L336 HydrophobicContact CE1-CD2 4.44Å; F334-L336 PolarHBondContact O-N 2.73Å; L336-F339 WeakPolarHBondContact O-CD1 3.39Å; L336-F339 WeakPolarHBondContact O-CE1 3.34Å |
| 337 | W | 98.7 | Very high | 98.4 | Very high | 23 Ų | 23 | 27.1 Ų | 27.1 | 9% | 0.087 | 13% | 0.132 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.3 | -17.1 | 175.9 | -73.8 | 80 | 0 | 0 | 0 | 113.8 | G318 A321 G322 L325 A327 I332 G335 S341 V375 | G318-W337 WeakPolarHBondContact CA-O 3.43Å; G318-W337 WeakPolarHBondContact O-CB 3.1Å; A321-W337 HydrophobicContact CB-CE3 4.4Å; A321-W337 HydrophobicContact CB-CZ3 4.48Å; G322-W337 VanDerWaalsContact N-CE3 3.29Å; L325-W337 HydrophobicContact CB-CH2 4.07Å; L325-W337 HydrophobicContact CD1-CH2 3.75Å; L325-W337 HydrophobicContact CD1-CZ3 4.05Å; L325-W337 HydrophobicContact CG-CH2 4.45Å; A327-W337 VanDerWaalsContact CB-CE2 3.49Å; A327-W337 HydrophobicContact CB-CH2 4.19Å; A327-W337 HydrophobicContact CB-CZ2 3.29Å; I332-W337 HydrophobicContact CG1-CG 4.46Å; G335-W337 PolarHBondContact O-N 2.89Å; G335-W337 VanDerWaalsContact O-N 3.14Å; W337-S341 PolarHBondContact O-OG 3.07Å; W337-V375 HydrophobicContact CH2-CB 3.52Å; W337-V375 HydrophobicContact CH2-CG1 3.55Å; W337-V375 HydrophobicContact CH2-CG2 3.74Å; W337-V375 HydrophobicContact CZ2-CB 3.85Å; W337-V375 HydrophobicContact CZ2-CG1 4.37Å; W337-V375 HydrophobicContact CZ2-CG2 3.74Å; W337-V375 HydrophobicContact CZ3-CB 4.02Å; W337-V375 HydrophobicContact CZ3-CG1 3.87Å |
| 338 | G | 98.2 | Very high | 98.4 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 13% | 0.129 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -97.1 | -28.6 | -167.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | G335 S341 S342 | G335-G338 PolarHBondContact O-N 2.89Å; G338-S341 PolarHBondContact O-OG 3.48Å; G338-S342 WeakPolarHBondContact O-CB 3.19Å; G338-S342 PolarHBondContact O-N 3.32Å |
| 339 | F | 98.7 | Very high | 98.5 | Very high | 26 Ų | 26 | 24.7 Ų | 24.7 | 11% | 0.114 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -73.1 | -43.2 | -168.3 | 67.4 | -85 | 0 | 0 | 0 | 114.1 | G280 Q283 I284 L336 S342 L343 C389 T390 | G280-F339 WeakPolarHBondContact O-CA 3.41Å; G280-F339 WeakPolarHBondContact O-CB 3.35Å; G280-F339 PolarHBondContact O-N 3.46Å; Q283-F339 HydrophobicContact CB-CB 3.71Å; Q283-F339 HydrophobicContact CB-CD1 3.8Å; Q283-F339 HydrophobicContact CB-CG 3.95Å; I284-F339 HydrophobicContact CG1-CB 3.95Å; L336-F339 WeakPolarHBondContact O-CD1 3.39Å; L336-F339 WeakPolarHBondContact O-CE1 3.34Å; F339-S342 PolarHBondContact O-N 3.14Å; F339-L343 PolarHBondContact O-N 2.67Å; F339-L343 VanDerWaalsContact O-N 3.07Å; F339-C389 VanDerWaalsContact CE2-O 3.26Å; F339-C389 WeakPolarHBondContact CE2-O 3.24Å; F339-T390 HydrophobicContact CD2-CG2 3.91Å; F339-T390 HydrophobicContact CE2-CG2 3.83Å |
| 340 | N | 98.9 | Very high | 98.5 | Very high | 7 Ų | 7 | 23.5 Ų | 23.5 | 4% | 0.037 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -63.8 | -45.3 | 177.5 | -88.3 | -71.3 | 0 | 0 | 0 | 111.4 | L343 A344 T370 C389 T390 P392 F393 | N340-L343 PolarHBondContact O-N 3.22Å; N340-A344 PolarHBondContact O-N 3.43Å; N340-T370 HydrophobicContact CB-CG2 3.82Å; N340-T370 WeakPolarHBondContact O-CG2 3.37Å; N340-C389 PolarHBondContact ND2-O 2.96Å; N340-C389 PolarHBondContact OD1-O 3.42Å; N340-T390 VanDerWaalsContact OD1-CA 3.31Å; N340-T390 WeakPolarHBondContact OD1-CA 3.16Å; N340-P392 HydrophobicContact CB-CB 4.41Å; N340-F393 HydrophobicContact CB-CB 4.3Å; N340-F393 WeakPolarHBondContact OD1-CB 3.23Å; N340-F393 PolarHBondContact OD1-N 3.18Å |
| 341 | S | 98.8 | Very high | 98.5 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -68 | -34.3 | 177.7 | 54.7 | 0 | 0 | 0 | 0 | 112.3 | G314 G318 W337 G338 C345 A367 | G314-S341 VanDerWaalsContact O-CB 3.23Å; G314-S341 WeakPolarHBondContact O-CB 3.38Å; G314-S341 PolarHBondContact O-OG 2.94Å; G318-S341 WeakPolarHBondContact CA-OG 3.45Å; W337-S341 PolarHBondContact O-OG 3.07Å; G338-S341 PolarHBondContact O-OG 3.48Å; S341-C345 VanDerWaalsContact O-CB 3.25Å; S341-C345 WeakPolarHBondContact O-CB 3.17Å; S341-C345 PolarHBondContact O-N 3.33Å; S341-A367 WeakPolarHBondContact CB-O 3.27Å |
| 342 | S | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -59.1 | -53.4 | 171.7 | -170.9 | 0 | 0 | 0 | 0 | 111.6 | A311 G338 F339 A344 C345 I346 | A311-S342 VanDerWaalsContact CA-OG 3.29Å; A311-S342 WeakPolarHBondContact CA-OG 3.5Å; A311-S342 WeakPolarHBondContact O-CB 3.44Å; A311-S342 PolarHBondContact O-OG 3.32Å; G338-S342 WeakPolarHBondContact O-CB 3.19Å; G338-S342 PolarHBondContact O-N 3.32Å; F339-S342 PolarHBondContact O-N 3.14Å; S342-A344 PolarHBondContact O-N 3.48Å; S342-C345 PolarHBondContact O-N 3.32Å; S342-I346 VanDerWaalsContact O-CG1 3.29Å; S342-I346 WeakPolarHBondContact O-CG1 3.4Å; S342-I346 PolarHBondContact O-N 3.18Å |
| 343 | L | 98.9 | Very high | 98.6 | Very high | 1 Ų | 1 | 14.1 Ų | 14.1 | 1% | 0.005 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -58.3 | -45.5 | 177.2 | -74.9 | 171.1 | 0 | 0 | 0 | 112.6 | V121 F122 I284 F339 N340 C345 I346 A347 T390 F393 | V121-L343 HydrophobicContact CG1-CD2 4.47Å; F122-L343 HydrophobicContact CE2-CD2 3.92Å; F122-L343 HydrophobicContact CZ-CD2 4.13Å; I284-L343 HydrophobicContact CD1-CD2 4Å; I284-L343 HydrophobicContact CD1-CG 3.99Å; I284-L343 HydrophobicContact CG1-CD1 4.45Å; I284-L343 HydrophobicContact CG1-CD2 4.39Å; I284-L343 HydrophobicContact CG1-CG 4.04Å; I284-L343 HydrophobicContact CG2-CD1 4.17Å; I284-L343 HydrophobicContact CG2-CD2 3.9Å; I284-L343 HydrophobicContact CG2-CG 4.19Å; F339-L343 PolarHBondContact O-N 2.67Å; F339-L343 VanDerWaalsContact O-N 3.07Å; N340-L343 PolarHBondContact O-N 3.22Å; L343-C345 VanDerWaalsContact C-N 3.32Å; L343-C345 PolarHBondContact O-N 2.96Å; L343-I346 PolarHBondContact O-N 3.42Å; L343-A347 WeakPolarHBondContact O-CB 3.44Å; L343-A347 PolarHBondContact O-N 2.99Å; L343-T390 HydrophobicContact CD1-CG2 3.76Å; L343-F393 HydrophobicContact CB-CB 4.31Å; L343-F393 HydrophobicContact CB-CD1 4.2Å; L343-F393 HydrophobicContact CB-CD2 3.49Å; L343-F393 VanDerWaalsContact CB-CD2 3.49Å; L343-F393 HydrophobicContact CB-CE2 3.88Å; L343-F393 HydrophobicContact CB-CG 3.69Å; L343-F393 HydrophobicContact CB-CZ 4.4Å; L343-F393 HydrophobicContact CD1-CB 4.46Å; L343-F393 HydrophobicContact CD1-CD1 3.88Å; L343-F393 HydrophobicContact CD1-CE1 4.36Å; L343-F393 HydrophobicContact CD1-CG 4.03Å |
| 344 | A | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -62.2 | -40.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | N340 S342 A347 M348 T370 F393 | N340-A344 PolarHBondContact O-N 3.43Å; S342-A344 PolarHBondContact O-N 3.48Å; A344-A347 PolarHBondContact O-N 3.01Å; A344-M348 WeakPolarHBondContact O-CB 3.37Å; A344-M348 WeakPolarHBondContact O-CG 3.28Å; A344-M348 PolarHBondContact O-N 3.49Å; A344-T370 HydrophobicContact CB-CG2 3.98Å; A344-T370 VanDerWaalsContact CB-OG1 3.31Å; A344-T370 WeakPolarHBondContact CB-OG1 3.49Å; A344-F393 HydrophobicContact CB-CD2 4.18Å |
| 345 | C | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 8.6 Ų | 8.6 | 0% | 0 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -67.1 | -41.1 | 178.7 | -153.8 | 0 | 0 | 0 | 0 | 111.7 | H310 S341 S342 L343 G349 A367 | H310-C345 HydrophobicContact CB-CB 4.4Å; H310-C345 WeakPolarHBondContact O-CB 3.47Å; S341-C345 VanDerWaalsContact O-CB 3.25Å; S341-C345 WeakPolarHBondContact O-CB 3.17Å; S341-C345 PolarHBondContact O-N 3.33Å; S342-C345 PolarHBondContact O-N 3.32Å; L343-C345 VanDerWaalsContact C-N 3.32Å; L343-C345 PolarHBondContact O-N 2.96Å; C345-G349 VanDerWaalsContact O-CA 3.26Å; C345-G349 WeakPolarHBondContact O-CA 3.43Å; C345-G349 PolarHBondContact O-N 3.47Å; C345-A367 HydrophobicContact CB-CB 3.9Å |
| 346 | I | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 9.1 Ų | 9.1 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -61.3 | -47.9 | 173.7 | -59.4 | 161.2 | 0 | 0 | 0 | 110 | F122 M307 A311 S342 L343 M348 G349 M351 | F122-I346 HydrophobicContact CD2-CB 4.19Å; F122-I346 HydrophobicContact CD2-CG2 3.7Å; F122-I346 HydrophobicContact CE2-CB 4.26Å; F122-I346 HydrophobicContact CE2-CG2 4.27Å; M307-I346 HydrophobicContact CB-CG2 4.09Å; M307-I346 HydrophobicContact CE-CG2 3.59Å; M307-I346 HydrophobicContact CG-CG2 4.11Å; A311-I346 HydrophobicContact CB-CD1 3.6Å; A311-I346 HydrophobicContact CB-CG1 3.74Å; S342-I346 VanDerWaalsContact O-CG1 3.29Å; S342-I346 WeakPolarHBondContact O-CG1 3.4Å; S342-I346 PolarHBondContact O-N 3.18Å; L343-I346 PolarHBondContact O-N 3.42Å; I346-M348 PolarHBondContact O-N 3.36Å; I346-G349 PolarHBondContact O-N 2.7Å; I346-M351 VanDerWaalsContact O-CB 3.29Å; I346-M351 WeakPolarHBondContact O-CB 3.38Å |
| 347 | A | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 6% | 0.059 | C | C | . | . | I | π-helix | trans | -62 | -44.3 | -177 | 0 | 0 | 0 | 0 | 0 | 112.7 | F122 F227 L343 A344 M351 F352 F393 T397 | F122-A347 HydrophobicContact CE2-CB 4.06Å; F122-A347 HydrophobicContact CZ-CB 4.18Å; F227-A347 HydrophobicContact CE1-CB 4.43Å; L343-A347 WeakPolarHBondContact O-CB 3.44Å; L343-A347 PolarHBondContact O-N 2.99Å; A344-A347 PolarHBondContact O-N 3.01Å; A347-M351 WeakPolarHBondContact O-CB 3.44Å; A347-F352 HydrophobicContact CB-CD2 3.89Å; A347-F352 HydrophobicContact CB-CE2 4.25Å; A347-F352 PolarHBondContact O-N 3.5Å; A347-F393 HydrophobicContact CB-CE2 4.22Å; A347-T397 HydrophobicContact CB-CG2 3.72Å |
| 348 | M | 98.8 | Very high | 98.6 | Very high | 1 Ų | 1 | 14.5 Ų | 14.5 | 1% | 0.005 | 6% | 0.062 | C | C | . | . | I | π-helix | trans | -83.6 | -26.2 | -179.2 | -64 | -57.9 | -64.4 | 0 | 0 | 113.1 | A344 I346 G350 V353 L362 A363 C366 T397 F400 L401 | A344-M348 WeakPolarHBondContact O-CB 3.37Å; A344-M348 WeakPolarHBondContact O-CG 3.28Å; A344-M348 PolarHBondContact O-N 3.49Å; I346-M348 PolarHBondContact O-N 3.36Å; M348-G350 PolarHBondContact O-N 3.45Å; M348-V353 HydrophobicContact CE-CG2 3.61Å; M348-V353 HydrophobicContact SD-CG2 4.13Å; M348-L362 HydrophobicContact CE-CD2 3.91Å; M348-L362 HydrophobicContact CE-CG 4.23Å; M348-A363 HydrophobicContact CB-CB 3.64Å; M348-C366 HydrophobicContact CG-CB 3.93Å; M348-T397 HydrophobicContact CG-CG2 4.22Å; M348-T397 HydrophobicContact SD-CG2 3.96Å; M348-F400 HydrophobicContact CE-CB 3.85Å; M348-F400 HydrophobicContact SD-CB 4.14Å; M348-L401 HydrophobicContact CE-CD2 4.34Å; M348-L401 HydrophobicContact SD-CD2 3.8Å; M348-L401 HydrophobicContact SD-CG 3.99Å |
| 349 | G | 98.3 | Very high | 98.6 | Very high | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 6% | 0.062 | C | C | . | . | I | π-helix | trans | -79.7 | 42.6 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | H310 C345 I346 | H310-G349 PolarHBondContact CE1-O 3.46Å; H310-G349 VanDerWaalsContact CE1-O 3.27Å; H310-G349 PolarHBondContact ND1-O 2.83Å; C345-G349 VanDerWaalsContact O-CA 3.26Å; C345-G349 WeakPolarHBondContact O-CA 3.43Å; C345-G349 PolarHBondContact O-N 3.47Å; I346-G349 PolarHBondContact O-N 2.7Å |
| 350 | G | 97.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 7% | 0.069 | C | C | . | . | I | π-helix | trans | 113.4 | -13.1 | 179 | 0 | 0 | 0 | 0 | 0 | 115.4 | M348 V353 P421 N424 | M348-G350 PolarHBondContact O-N 3.45Å; G350-V353 CarbonylContact C-O 3.05Å; G350-V353 WeakPolarHBondContact CA-O 3.28Å; G350-V353 PolarHBondContact N-O 2.92Å; G350-P421 WeakPolarHBondContact O-CA 3.3Å; G350-N424 PolarHBondContact O-ND2 3.14Å |
| 351 | M | 98.4 | Very high | 98.6 | Very high | 3 Ų | 3 | 20.4 Ų | 20.4 | 2% | 0.015 | 9% | 0.092 | C | C | . | . | I | π-helix | trans | -80.2 | -64.7 | -175.3 | -162.2 | 63.2 | -97.9 | 0 | 0 | 111.4 | F122 M307 I346 A347 V418 T419 N424 | F122-M351 HydrophobicContact CB-CG 4.06Å; F122-M351 HydrophobicContact CB-SD 4.29Å; F122-M351 HydrophobicContact CG-CG 4.43Å; M307-M351 HydrophobicContact CE-SD 4Å; M307-M351 HydrophobicContact SD-SD 4Å; I346-M351 VanDerWaalsContact O-CB 3.29Å; I346-M351 WeakPolarHBondContact O-CB 3.38Å; A347-M351 WeakPolarHBondContact O-CB 3.44Å; M351-V418 HydrophobicContact CE-CG1 3.27Å; M351-T419 WeakPolarHBondContact CE-O 3.31Å; M351-N424 VanDerWaalsContact CE-ND2 3.34Å; M351-N424 WeakPolarHBondContact CE-ND2 3.32Å; M351-N424 PolarHBondContact O-ND2 3.45Å |
| 352 | F | 98.6 | Very high | 98.5 | Very high | 21 Ų | 21 | 21.8 Ų | 21.8 | 9% | 0.092 | 10% | 0.099 | C | C | . | . | S | Bend | trans | -99.8 | -8.4 | 179.6 | -63.9 | -80.2 | 0 | 0 | 0 | 113.5 | F122 P225 F227 A347 L401 M413 L415 V418 | F122-F352 AromaticContact CD1-CE2 3.9Å; F122-F352 HydrophobicContact CD1-CE2 3.9Å; F122-F352 HydrophobicContact CD1-CZ 4.21Å; F122-F352 HydrophobicContact CE1-CE2 4.2Å; F122-F352 HydrophobicContact CG-CE2 4.28Å; P225-F352 HydrophobicContact CB-CE1 3.85Å; P225-F352 HydrophobicContact CB-CZ 4.23Å; P225-F352 HydrophobicContact CG-CD1 4Å; P225-F352 HydrophobicContact CG-CE1 3.75Å; P225-F352 HydrophobicContact CG-CZ 4.14Å; F227-F352 HydrophobicContact CD1-CE2 4.47Å; F227-F352 AromaticContact CE1-CD2 3.92Å; F227-F352 HydrophobicContact CE1-CD2 3.92Å; F227-F352 AromaticContact CE1-CE2 3.55Å; F227-F352 HydrophobicContact CE1-CE2 3.55Å; F227-F352 AromaticContact CE1-CZ 3.9Å; F227-F352 HydrophobicContact CE1-CZ 3.9Å; F227-F352 HydrophobicContact CZ-CD2 4.28Å; F227-F352 HydrophobicContact CZ-CE2 4.35Å; A347-F352 HydrophobicContact CB-CD2 3.89Å; A347-F352 HydrophobicContact CB-CE2 4.25Å; A347-F352 PolarHBondContact O-N 3.5Å; F352-L401 HydrophobicContact CB-CD1 4.02Å; F352-L401 HydrophobicContact CB-CD2 3.8Å; F352-L401 HydrophobicContact CG-CD1 4.4Å; F352-M413 PolarHBondContact O-N 3.5Å; F352-L415 HydrophobicContact CD1-CD2 3.87Å; F352-L415 HydrophobicContact CE1-CD2 3.97Å; F352-V418 HydrophobicContact CD1-CG1 4.32Å; F352-V418 HydrophobicContact CD1-CG2 4.28Å; F352-V418 HydrophobicContact CE1-CG1 4.13Å |
| 353 | V | 98.1 | Very high | 98.5 | Very high | 4 Ų | 4 | 21.8 Ų | 21.8 | 2% | 0.024 | 10% | 0.099 | C | C | . | . | B | Isolated β-bridge | trans | -129.7 | 133.3 | 171.6 | -172.4 | 0 | 0 | 0 | 0 | 107.1 | M348 G350 L355 T359 L401 Y411 | M348-V353 HydrophobicContact CE-CG2 3.61Å; M348-V353 HydrophobicContact SD-CG2 4.13Å; G350-V353 CarbonylContact C-O 3.05Å; G350-V353 WeakPolarHBondContact CA-O 3.28Å; G350-V353 PolarHBondContact N-O 2.92Å; V353-L355 PolarHBondContact O-N 3.09Å; V353-T359 HydrophobicContact CG1-CG2 3.41Å; V353-T359 VanDerWaalsContact CG1-CG2 3.41Å; V353-L401 HydrophobicContact CG2-CD2 3.57Å; V353-Y411 CarbonylContact C-O 3.59Å; V353-Y411 WeakPolarHBondContact CA-O 3.22Å; V353-Y411 WeakPolarHBondContact CG1-O 3.4Å |
| 354 | A | 98.1 | Very high | 98.5 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 11% | 0.109 | C | C | . | . | trans | -60.8 | 130.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | T356 T359 Y411 M413 Y428 | A354-T356 PolarHBondContact O-N 2.84Å; A354-T359 PolarHBondContact O-OG1 3.31Å; A354-Y411 HydrophobicContact CB-CD1 4.09Å; A354-Y411 PolarHBondContact N-O 3.05Å; A354-M413 HydrophobicContact CB-SD 3.92Å; A354-Y428 VanDerWaalsContact CB-CB 3.45Å; A354-Y428 HydrophobicContact CB-CD1 4.06Å; A354-Y428 HydrophobicContact CB-CD2 3.99Å; A354-Y428 HydrophobicContact CB-CG 3.55Å | ||
| 355 | L | 98.5 | Very high | 98.5 | Very high | 21 Ų | 21 | 25.3 Ų | 25.3 | 11% | 0.11 | 13% | 0.126 | C | C | . | . | trans | -67.4 | 123.4 | -176.6 | -173.9 | 63.8 | 0 | 0 | 0 | 110 | L306 V353 T359 H360 R425 | L306-L355 HydrophobicContact CD1-CD2 3.75Å; L306-L355 HydrophobicContact CD2-CD2 3.93Å; L306-L355 HydrophobicContact CG-CD2 4.36Å; V353-L355 PolarHBondContact O-N 3.09Å; L355-T359 WeakPolarHBondContact CA-OG1 3.29Å; L355-H360 HydrophobicContact CD1-CB 4.14Å; L355-R425 PolarHBondContact O-NH1 2.96Å | ||
| 356 | T | 98.3 | Very high | 98.5 | Very high | 11 Ų | 11 | 25.3 Ų | 25.3 | 7% | 0.067 | 13% | 0.126 | C | C | . | . | trans | -140.6 | 173.4 | 169.3 | 64.8 | 0 | 0 | 0 | 0 | 107.1 | A354 Q358 T359 H360 S409 Y428 | A354-T356 PolarHBondContact O-N 2.84Å; T356-Q358 PolarHBondContact O-N 3.32Å; T356-Q358 PolarHBondContact OG1-OE1 2.95Å; T356-T359 PolarHBondContact N-OG1 2.88Å; T356-T359 PolarHBondContact O-N 2.98Å; T356-T359 PolarHBondContact O-OG1 2.93Å; T356-T359 WeakPolarHBondContact OG1-CG2 3.33Å; T356-T359 PolarHBondContact OG1-N 3.37Å; T356-T359 PolarHBondContact OG1-OG1 2.79Å; T356-H360 WeakPolarHBondContact O-CB 3.42Å; T356-H360 PolarHBondContact O-N 2.93Å; T356-S409 WeakPolarHBondContact CG2-O 3.15Å; T356-S409 PolarHBondContact OG1-O 3.36Å; T356-Y428 HydrophobicContact CG2-CD1 4.43Å; T356-Y428 HydrophobicContact CG2-CE1 3.75Å | ||
| 357 | W | 98.2 | Very high | 98.5 | Very high | 180 Ų | 180 | 25.3 Ų | 25.3 | 68% | 0.682 | 13% | 0.126 | S | C | * | . | H | α-helix | trans | -67.2 | -32.4 | 176.6 | 70.3 | -96.9 | 0 | 0 | 0 | 111.2 | L361 | W357-L361 HydrophobicContact CE3-CD1 3.76Å; W357-L361 HydrophobicContact CZ3-CD1 3.7Å; W357-L361 WeakPolarHBondContact O-CG 3.14Å; W357-L361 PolarHBondContact O-N 3.25Å; W357-L361 VanDerWaalsContact O-N 3.1Å |
| 358 | Q | 98.5 | Very high | 98.5 | Very high | 30 Ų | 30 | 27.9 Ų | 27.9 | 14% | 0.14 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -66.3 | -45.1 | 176 | -60.1 | 90.9 | -24.8 | 0 | 0 | 111.5 | T356 H360 L361 L362 S409 I410 | T356-Q358 PolarHBondContact O-N 3.32Å; T356-Q358 PolarHBondContact OG1-OE1 2.95Å; Q358-H360 VanDerWaalsContact C-N 3.34Å; Q358-L361 PolarHBondContact O-N 2.94Å; Q358-L362 PolarHBondContact O-N 3.37Å; Q358-S409 PolarHBondContact NE2-OG 2.81Å; Q358-I410 HydrophobicContact CB-CG1 4.07Å |
| 359 | T | 98.2 | Very high | 98.5 | Very high | 1 Ų | 1 | 31.8 Ų | 31.8 | 1% | 0.006 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -76.2 | -25.7 | -179.8 | 59.5 | 0 | 0 | 0 | 0 | 112 | V353 A354 L355 T356 L362 A363 I410 | V353-T359 HydrophobicContact CG1-CG2 3.41Å; V353-T359 VanDerWaalsContact CG1-CG2 3.41Å; A354-T359 PolarHBondContact O-OG1 3.31Å; L355-T359 WeakPolarHBondContact CA-OG1 3.29Å; T356-T359 PolarHBondContact N-OG1 2.88Å; T356-T359 PolarHBondContact O-N 2.98Å; T356-T359 PolarHBondContact O-OG1 2.93Å; T356-T359 WeakPolarHBondContact OG1-CG2 3.33Å; T356-T359 PolarHBondContact OG1-N 3.37Å; T356-T359 PolarHBondContact OG1-OG1 2.79Å; T359-L362 PolarHBondContact O-N 3.44Å; T359-A363 WeakPolarHBondContact O-CB 3.45Å; T359-A363 PolarHBondContact O-N 3.33Å; T359-I410 HydrophobicContact CG2-CB 4.18Å; T359-I410 HydrophobicContact CG2-CG1 4.07Å; T359-I410 HydrophobicContact CG2-CG2 4.19Å |
| 360 | H | 98.7 | Very high | 98.6 | Very high | 57 Ų | 57 | 31.8 Ų | 31.8 | 26% | 0.264 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -60.4 | -51.2 | 166.3 | -179.9 | 65.2 | 0 | 0 | 0 | 111 | H310 L355 T356 Q358 L362 A363 L364 | H310-H360 AromaticContact CD2-ND1 3.86Å; H310-H360 AromaticContact CE1-ND1 3.93Å; H310-H360 AromaticContact NE2-CE1 3.74Å; H310-H360 AromaticContact NE2-ND1 3.01Å; H310-H360 PolarHBondContact NE2-ND1 2.87Å; L355-H360 HydrophobicContact CD1-CB 4.14Å; T356-H360 WeakPolarHBondContact O-CB 3.42Å; T356-H360 PolarHBondContact O-N 2.93Å; Q358-H360 VanDerWaalsContact C-N 3.34Å; H360-L362 VanDerWaalsContact C-N 3.29Å; H360-L362 PolarHBondContact O-N 3.43Å; H360-A363 WeakPolarHBondContact O-CA 3.34Å; H360-A363 WeakPolarHBondContact O-CB 3.37Å; H360-A363 PolarHBondContact O-N 3.16Å; H360-L364 WeakPolarHBondContact O-CG 3.27Å; H360-L364 PolarHBondContact O-N 3.39Å |
| 361 | L | 98.8 | Very high | 98.6 | Very high | 98 Ų | 98 | 32 Ų | 32 | 51% | 0.513 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -59.3 | -39.5 | 174.9 | -67.3 | 177.7 | 0 | 0 | 0 | 112.3 | W357 Q358 A363 L364 G365 | W357-L361 HydrophobicContact CE3-CD1 3.76Å; W357-L361 HydrophobicContact CZ3-CD1 3.7Å; W357-L361 WeakPolarHBondContact O-CG 3.14Å; W357-L361 PolarHBondContact O-N 3.25Å; W357-L361 VanDerWaalsContact O-N 3.1Å; Q358-L361 PolarHBondContact O-N 2.94Å; L361-A363 VanDerWaalsContact C-N 3.31Å; L361-A363 PolarHBondContact O-N 3.26Å; L361-L364 HydrophobicContact CD2-CD1 4.26Å; L361-L364 PolarHBondContact O-N 3.49Å; L361-G365 PolarHBondContact O-N 2.84Å |
| 362 | L | 98.6 | Very high | 98.6 | Very high | 29 Ų | 29 | 36.4 Ų | 36.4 | 15% | 0.152 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.7 | -39.4 | 174.2 | -174.4 | 64.7 | 0 | 0 | 0 | 111.8 | M348 Q358 T359 H360 G365 C366 F400 M403 I410 | M348-L362 HydrophobicContact CE-CD2 3.91Å; M348-L362 HydrophobicContact CE-CG 4.23Å; Q358-L362 PolarHBondContact O-N 3.37Å; T359-L362 PolarHBondContact O-N 3.44Å; H360-L362 VanDerWaalsContact C-N 3.29Å; H360-L362 PolarHBondContact O-N 3.43Å; L362-G365 PolarHBondContact O-N 2.9Å; L362-C366 WeakPolarHBondContact O-CB 3.47Å; L362-C366 PolarHBondContact O-N 3.41Å; L362-F400 HydrophobicContact CD1-CD1 3.78Å; L362-F400 HydrophobicContact CD1-CE1 3.91Å; L362-F400 HydrophobicContact CG-CD1 4.18Å; L362-M403 HydrophobicContact CD1-CE 3.95Å; L362-M403 HydrophobicContact CD2-CE 3.89Å; L362-I410 HydrophobicContact CD2-CG2 4.02Å |
| 363 | A | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66 | -37.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | M348 T359 H360 L361 C366 A367 | M348-A363 HydrophobicContact CB-CB 3.64Å; T359-A363 WeakPolarHBondContact O-CB 3.45Å; T359-A363 PolarHBondContact O-N 3.33Å; H360-A363 WeakPolarHBondContact O-CA 3.34Å; H360-A363 WeakPolarHBondContact O-CB 3.37Å; H360-A363 PolarHBondContact O-N 3.16Å; L361-A363 VanDerWaalsContact C-N 3.31Å; L361-A363 PolarHBondContact O-N 3.26Å; A363-C366 PolarHBondContact O-N 2.88Å; A363-A367 WeakPolarHBondContact O-CB 3.09Å; A363-A367 PolarHBondContact O-N 2.89Å |
| 364 | L | 98.9 | Very high | 98.6 | Very high | 41 Ų | 41 | 38.1 Ų | 38.1 | 22% | 0.215 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.4 | -45.6 | 172.7 | -53.5 | -175.1 | 0 | 0 | 0 | 111.1 | I313 L317 H360 L361 C366 A367 L368 | I313-L364 HydrophobicContact CG2-CD2 3.41Å; I313-L364 VanDerWaalsContact CG2-CD2 3.41Å; L317-L364 HydrophobicContact CD1-CB 3.92Å; L317-L364 HydrophobicContact CD1-CD2 3.81Å; L317-L364 HydrophobicContact CD1-CG 4.42Å; H360-L364 WeakPolarHBondContact O-CG 3.27Å; H360-L364 PolarHBondContact O-N 3.39Å; L361-L364 HydrophobicContact CD2-CD1 4.26Å; L361-L364 PolarHBondContact O-N 3.49Å; L364-C366 VanDerWaalsContact C-N 3.35Å; L364-C366 PolarHBondContact O-N 3.12Å; L364-A367 PolarHBondContact O-N 2.62Å; L364-L368 PolarHBondContact O-N 2.96Å |
| 365 | G | 98.8 | Very high | 98.7 | Very high | 34 Ų | 34 | 39.8 Ų | 39.8 | 35% | 0.351 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -61.2 | -42.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L361 L362 F369 | L361-G365 PolarHBondContact O-N 2.84Å; L362-G365 PolarHBondContact O-N 2.9Å; G365-F369 WeakPolarHBondContact O-CB 3.33Å; G365-F369 PolarHBondContact O-N 2.91Å |
| 366 | C | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.7 | -44.5 | 175.6 | -169 | 0 | 0 | 0 | 0 | 111.7 | M348 L362 A363 L364 L368 F369 T370 F400 | M348-C366 HydrophobicContact CG-CB 3.93Å; L362-C366 WeakPolarHBondContact O-CB 3.47Å; L362-C366 PolarHBondContact O-N 3.41Å; A363-C366 PolarHBondContact O-N 2.88Å; L364-C366 VanDerWaalsContact C-N 3.35Å; L364-C366 PolarHBondContact O-N 3.12Å; C366-L368 PolarHBondContact O-N 3.48Å; C366-F369 PolarHBondContact O-N 2.81Å; C366-T370 VanDerWaalsContact O-CB 3.23Å; C366-T370 WeakPolarHBondContact O-CB 3.25Å; C366-T370 PolarHBondContact O-N 3.39Å; C366-T370 PolarHBondContact O-OG1 3.13Å; C366-F400 VanDerWaalsContact CA-CE1 3.49Å; C366-F400 HydrophobicContact CB-CD1 3.52Å; C366-F400 HydrophobicContact CB-CD2 4.39Å; C366-F400 HydrophobicContact CB-CE1 3.57Å; C366-F400 HydrophobicContact CB-CE2 4.43Å; C366-F400 HydrophobicContact CB-CG 3.95Å; C366-F400 HydrophobicContact CB-CZ 4.04Å; C366-F400 VanDerWaalsContact SG-CG 3.58Å |
| 367 | A | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.9 | -46 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L317 S341 C345 A363 L364 T370 A371 | L317-A367 HydrophobicContact CB-CB 4.46Å; L317-A367 HydrophobicContact CD1-CB 3.89Å; S341-A367 WeakPolarHBondContact CB-O 3.27Å; C345-A367 HydrophobicContact CB-CB 3.9Å; A363-A367 WeakPolarHBondContact O-CB 3.09Å; A363-A367 PolarHBondContact O-N 2.89Å; L364-A367 PolarHBondContact O-N 2.62Å; A367-T370 PolarHBondContact O-N 3.17Å; A367-A371 PolarHBondContact O-N 3.29Å |
| 368 | L | 98.8 | Very high | 98.7 | Very high | 55 Ų | 55 | 34.8 Ų | 34.8 | 29% | 0.288 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -62.8 | -48.1 | 175.3 | -77.3 | 170.7 | 0 | 0 | 0 | 112.1 | L317 A321 L364 C366 T370 A371 Y372 | L317-L368 HydrophobicContact CB-CD2 4.05Å; L317-L368 HydrophobicContact CB-CG 4.26Å; L317-L368 HydrophobicContact CD1-CG 4.38Å; L317-L368 HydrophobicContact CD2-CD1 4.36Å; L317-L368 HydrophobicContact CD2-CD2 4.13Å; L317-L368 HydrophobicContact CD2-CG 4.16Å; A321-L368 HydrophobicContact CB-CD2 4.24Å; L364-L368 PolarHBondContact O-N 2.96Å; C366-L368 PolarHBondContact O-N 3.48Å; L368-T370 PolarHBondContact O-N 2.98Å; L368-A371 PolarHBondContact O-N 3.3Å; L368-Y372 WeakPolarHBondContact O-CD2 3.31Å; L368-Y372 PolarHBondContact O-N 3.44Å; L368-Y372 VanDerWaalsContact O-N 3.17Å |
| 369 | F | 98.9 | Very high | 98.6 | Very high | 83 Ų | 83 | 37.4 Ų | 37.4 | 36% | 0.364 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -56.3 | -42.6 | 175.6 | 177.1 | -88.3 | 0 | 0 | 0 | 111.3 | G365 C366 A371 Y372 L373 A396 L399 F400 | G365-F369 WeakPolarHBondContact O-CB 3.33Å; G365-F369 PolarHBondContact O-N 2.91Å; C366-F369 PolarHBondContact O-N 2.81Å; F369-A371 PolarHBondContact O-N 3.27Å; F369-Y372 PolarHBondContact O-N 3.43Å; F369-L373 HydrophobicContact CE1-CB 4.41Å; F369-L373 HydrophobicContact CE1-CD2 4.07Å; F369-L373 WeakPolarHBondContact O-CB 3.26Å; F369-L373 PolarHBondContact O-N 3.26Å; F369-A396 HydrophobicContact CD1-CB 3.67Å; F369-A396 HydrophobicContact CE1-CB 3.82Å; F369-L399 HydrophobicContact CE1-CD2 4.18Å; F369-L399 HydrophobicContact CZ-CD2 3.95Å; F369-F400 HydrophobicContact CB-CE2 4.06Å; F369-F400 HydrophobicContact CB-CZ 4.01Å; F369-F400 AromaticContact CD1-CE2 3.77Å; F369-F400 HydrophobicContact CD1-CE2 3.77Å; F369-F400 HydrophobicContact CD2-CE2 4.47Å; F369-F400 HydrophobicContact CE1-CE2 4.35Å; F369-F400 AromaticContact CG-CE2 3.84Å; F369-F400 HydrophobicContact CG-CE2 3.84Å; F369-F400 HydrophobicContact CG-CZ 4.23Å |
| 370 | T | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.6 | -38.9 | 180 | -58.4 | 0 | 0 | 0 | 0 | 111.9 | N340 A344 C366 A367 L368 L373 G374 F393 A396 | N340-T370 HydrophobicContact CB-CG2 3.82Å; N340-T370 WeakPolarHBondContact O-CG2 3.37Å; A344-T370 HydrophobicContact CB-CG2 3.98Å; A344-T370 VanDerWaalsContact CB-OG1 3.31Å; A344-T370 WeakPolarHBondContact CB-OG1 3.49Å; C366-T370 VanDerWaalsContact O-CB 3.23Å; C366-T370 WeakPolarHBondContact O-CB 3.25Å; C366-T370 PolarHBondContact O-N 3.39Å; C366-T370 PolarHBondContact O-OG1 3.13Å; A367-T370 PolarHBondContact O-N 3.17Å; L368-T370 PolarHBondContact O-N 2.98Å; T370-L373 PolarHBondContact O-N 3.12Å; T370-G374 PolarHBondContact O-N 3.17Å; T370-F393 HydrophobicContact CG2-CB 4.33Å; T370-A396 HydrophobicContact CG2-CB 4.16Å; T370-A396 WeakPolarHBondContact OG1-CB 3.2Å |
| 371 | A | 98.8 | Very high | 98.6 | Very high | 3 Ų | 3 | 40.4 Ų | 40.4 | 3% | 0.025 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.8 | -44.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A321 A367 L368 F369 G374 V375 | A321-A371 HydrophobicContact CB-CB 3.65Å; A367-A371 PolarHBondContact O-N 3.29Å; L368-A371 PolarHBondContact O-N 3.3Å; F369-A371 PolarHBondContact O-N 3.27Å; A371-G374 WeakPolarHBondContact O-CA 3.35Å; A371-G374 PolarHBondContact O-N 3.36Å; A371-G374 VanDerWaalsContact O-N 3.08Å; A371-V375 PolarHBondContact O-N 2.83Å |
| 372 | Y | 98.8 | Very high | 98.5 | Very high | 96 Ų | 96 | 36.2 Ų | 36.2 | 38% | 0.376 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -65.2 | -41.7 | 175.9 | -65.8 | -51.7 | 0 | 0 | 0 | 112.8 | A321 S324 L325 L368 F369 G374 V375 G376 | A321-Y372 HydrophobicContact CB-CD1 4.3Å; A321-Y372 HydrophobicContact CB-CE1 3.84Å; S324-Y372 PolarHBondContact OG-OH 3.02Å; L325-Y372 HydrophobicContact CD1-CD1 3.52Å; L325-Y372 HydrophobicContact CD1-CE1 3.8Å; L325-Y372 HydrophobicContact CD2-CE1 4.38Å; L325-Y372 HydrophobicContact CG-CD1 4.08Å; L325-Y372 HydrophobicContact CG-CE1 3.81Å; L368-Y372 WeakPolarHBondContact O-CD2 3.31Å; L368-Y372 PolarHBondContact O-N 3.44Å; L368-Y372 VanDerWaalsContact O-N 3.17Å; F369-Y372 PolarHBondContact O-N 3.43Å; Y372-G374 PolarHBondContact O-N 3.04Å; Y372-V375 VanDerWaalsContact O-CG1 3.23Å; Y372-V375 WeakPolarHBondContact O-CG1 3.23Å; Y372-G376 PolarHBondContact O-N 2.88Å; Y372-G376 VanDerWaalsContact O-N 3.14Å |
| 373 | L | 98.8 | Very high | 98.5 | Very high | 49 Ų | 49 | 43.4 Ų | 43.4 | 26% | 0.257 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.6 | -35 | 171.5 | -176.4 | 61.6 | 0 | 0 | 0 | 110.8 | F369 T370 G376 M377 P392 L395 A396 | F369-L373 HydrophobicContact CE1-CB 4.41Å; F369-L373 HydrophobicContact CE1-CD2 4.07Å; F369-L373 WeakPolarHBondContact O-CB 3.26Å; F369-L373 PolarHBondContact O-N 3.26Å; T370-L373 PolarHBondContact O-N 3.12Å; L373-G376 PolarHBondContact O-N 3.2Å; L373-M377 HydrophobicContact CD1-CG 3.97Å; L373-M377 HydrophobicContact CD1-SD 4.3Å; L373-M377 HydrophobicContact CG-CG 4.17Å; L373-M377 HydrophobicContact CG-SD 4.14Å; L373-M377 WeakPolarHBondContact O-CB 3.43Å; L373-M377 WeakPolarHBondContact O-CG 3.32Å; L373-M377 PolarHBondContact O-N 2.96Å; L373-P392 HydrophobicContact CB-CB 4.45Å; L373-P392 HydrophobicContact CD2-CB 4.49Å; L373-P392 HydrophobicContact CG-CB 4.21Å; L373-L395 HydrophobicContact CD2-CB 4.2Å; L373-A396 HydrophobicContact CD2-CB 4.04Å |
| 374 | G | 98.6 | Very high | 98.4 | Very high | 12 Ų | 12 | 49.2 Ų | 49.2 | 12% | 0.124 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -52.6 | -59.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | T370 A371 Y372 G376 M377 A378 | T370-G374 PolarHBondContact O-N 3.17Å; A371-G374 WeakPolarHBondContact O-CA 3.35Å; A371-G374 PolarHBondContact O-N 3.36Å; A371-G374 VanDerWaalsContact O-N 3.08Å; Y372-G374 PolarHBondContact O-N 3.04Å; G374-G376 VanDerWaalsContact C-N 3.32Å; G374-G376 PolarHBondContact O-N 3.27Å; G374-M377 PolarHBondContact O-N 3.24Å; G374-A378 WeakPolarHBondContact O-CB 3.33Å; G374-A378 PolarHBondContact O-N 3.1Å |
| 375 | V | 98.2 | Very high | 98.3 | Very high | 36 Ų | 36 | 49 Ų | 49 | 22% | 0.218 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.7 | -36.8 | 178 | 64.9 | 0 | 0 | 0 | 0 | 112 | L325 W337 A371 Y372 A378 N379 | L325-V375 HydrophobicContact CD1-CG1 3.84Å; W337-V375 HydrophobicContact CH2-CB 3.52Å; W337-V375 HydrophobicContact CH2-CG1 3.55Å; W337-V375 HydrophobicContact CH2-CG2 3.74Å; W337-V375 HydrophobicContact CZ2-CB 3.85Å; W337-V375 HydrophobicContact CZ2-CG1 4.37Å; W337-V375 HydrophobicContact CZ2-CG2 3.74Å; W337-V375 HydrophobicContact CZ3-CB 4.02Å; W337-V375 HydrophobicContact CZ3-CG1 3.87Å; A371-V375 PolarHBondContact O-N 2.83Å; Y372-V375 VanDerWaalsContact O-CG1 3.23Å; Y372-V375 WeakPolarHBondContact O-CG1 3.23Å; V375-A378 PolarHBondContact O-N 3.48Å; V375-N379 WeakPolarHBondContact O-CB 3.17Å; V375-N379 VanDerWaalsContact O-CG 3.26Å; V375-N379 PolarHBondContact O-N 2.74Å; V375-N379 PolarHBondContact O-ND2 3.47Å |
| 376 | G | 98.4 | Very high | 98.2 | Very high | 34 Ų | 34 | 47.7 Ų | 47.7 | 35% | 0.351 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60 | -48.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y372 L373 G374 N379 V380 | Y372-G376 PolarHBondContact O-N 2.88Å; Y372-G376 VanDerWaalsContact O-N 3.14Å; L373-G376 PolarHBondContact O-N 3.2Å; G374-G376 VanDerWaalsContact C-N 3.32Å; G374-G376 PolarHBondContact O-N 3.27Å; G376-N379 PolarHBondContact O-N 3.49Å; G376-V380 WeakPolarHBondContact O-CG2 3.5Å; G376-V380 PolarHBondContact O-N 3.42Å; G376-V380 VanDerWaalsContact O-N 3.16Å |
| 377 | M | 98.5 | Very high | 98.2 | Very high | 32 Ų | 32 | 48.6 Ų | 48.6 | 16% | 0.158 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -69 | -39.2 | 177.2 | -68.1 | -167 | 73.7 | 0 | 0 | 112.3 | L373 G374 N379 V380 M381 A388 W391 P392 L395 | L373-M377 HydrophobicContact CD1-CG 3.97Å; L373-M377 HydrophobicContact CD1-SD 4.3Å; L373-M377 HydrophobicContact CG-CG 4.17Å; L373-M377 HydrophobicContact CG-SD 4.14Å; L373-M377 WeakPolarHBondContact O-CB 3.43Å; L373-M377 WeakPolarHBondContact O-CG 3.32Å; L373-M377 PolarHBondContact O-N 2.96Å; G374-M377 PolarHBondContact O-N 3.24Å; M377-N379 VanDerWaalsContact C-N 3.3Å; M377-N379 PolarHBondContact O-N 3.45Å; M377-V380 PolarHBondContact O-N 3.01Å; M377-M381 HydrophobicContact CE-SD 4.28Å; M377-M381 WeakPolarHBondContact O-CB 3.32Å; M377-M381 WeakPolarHBondContact O-CG 3.28Å; M377-M381 PolarHBondContact O-N 3.19Å; M377-A388 HydrophobicContact CB-CB 3.97Å; M377-W391 HydrophobicContact CE-CB 3.51Å; M377-W391 HydrophobicContact CE-CG 4.14Å; M377-W391 HydrophobicContact SD-CB 3.99Å; M377-P392 HydrophobicContact CB-CG 4.16Å; M377-P392 HydrophobicContact CG-CG 4.41Å; M377-P392 HydrophobicContact SD-CB 4.28Å; M377-P392 HydrophobicContact SD-CG 3.93Å; M377-L395 HydrophobicContact CE-CD1 3.86Å; M377-L395 HydrophobicContact SD-CD1 3.85Å |
| 378 | A | 98.3 | Very high | 98.1 | Very high | 40 Ų | 40 | 49 Ų | 49 | 33% | 0.331 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -57.5 | -45.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | G374 V375 V380 M381 A382 A388 | G374-A378 WeakPolarHBondContact O-CB 3.33Å; G374-A378 PolarHBondContact O-N 3.1Å; V375-A378 PolarHBondContact O-N 3.48Å; A378-V380 PolarHBondContact O-N 2.95Å; A378-M381 PolarHBondContact O-N 3.5Å; A378-A382 VanDerWaalsContact O-CB 3.25Å; A378-A382 WeakPolarHBondContact O-CB 3.42Å; A378-A382 PolarHBondContact O-N 3.08Å; A378-A388 HydrophobicContact CB-CB 4.19Å |
| 379 | N | 97.8 | Very high | 98.1 | Very high | 85 Ų | 85 | 47.1 Ų | 47.1 | 46% | 0.455 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64.1 | -40.8 | 177.3 | -72.3 | -22.7 | 0 | 0 | 0 | 113.1 | V375 G376 M377 | V375-N379 WeakPolarHBondContact O-CB 3.17Å; V375-N379 VanDerWaalsContact O-CG 3.26Å; V375-N379 PolarHBondContact O-N 2.74Å; V375-N379 PolarHBondContact O-ND2 3.47Å; G376-N379 PolarHBondContact O-N 3.49Å; M377-N379 VanDerWaalsContact C-N 3.3Å; M377-N379 PolarHBondContact O-N 3.45Å |
| 380 | V | 98.1 | Very high | 98.1 | Very high | 103 Ų | 103 | 43.4 Ų | 43.4 | 62% | 0.624 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -68.3 | -46.5 | 177.4 | 171.4 | 0 | 0 | 0 | 0 | 110.9 | G376 M377 A378 A382 R383 | G376-V380 WeakPolarHBondContact O-CG2 3.5Å; G376-V380 PolarHBondContact O-N 3.42Å; G376-V380 VanDerWaalsContact O-N 3.16Å; M377-V380 PolarHBondContact O-N 3.01Å; A378-V380 PolarHBondContact O-N 2.95Å; V380-A382 PolarHBondContact O-N 3.47Å; V380-R383 VanDerWaalsContact O-CB 3.28Å; V380-R383 WeakPolarHBondContact O-CB 3.15Å; V380-R383 PolarHBondContact O-N 2.95Å |
| 381 | M | 98.3 | Very high | 98.1 | Very high | 19 Ų | 19 | 45.4 Ų | 45.4 | 9% | 0.094 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -72.2 | -29.4 | -176.4 | -68.7 | -176.1 | 68.7 | 0 | 0 | 112.6 | M377 A378 R383 I384 G385 L386 P387 A388 | M377-M381 HydrophobicContact CE-SD 4.28Å; M377-M381 WeakPolarHBondContact O-CB 3.32Å; M377-M381 WeakPolarHBondContact O-CG 3.28Å; M377-M381 PolarHBondContact O-N 3.19Å; A378-M381 PolarHBondContact O-N 3.5Å; M381-R383 PolarHBondContact O-N 3.01Å; M381-I384 CarbonylContact O-C 3.51Å; M381-I384 WeakPolarHBondContact O-CG1 3.49Å; M381-I384 PolarHBondContact O-N 2.81Å; M381-G385 PolarHBondContact O-N 3.37Å; M381-L386 CarbonylContact C-O 3.6Å; M381-L386 HydrophobicContact CB-CB 4.16Å; M381-L386 VanDerWaalsContact CB-O 3.31Å; M381-L386 WeakPolarHBondContact CB-O 3.25Å; M381-L386 HydrophobicContact CE-CB 3.89Å; M381-L386 HydrophobicContact CE-CD1 4.03Å; M381-L386 PolarHBondContact O-N 3.25Å; M381-P387 VanDerWaalsContact CE-O 3.22Å; M381-P387 WeakPolarHBondContact CE-O 3.48Å; M381-A388 VanDerWaalsContact SD-CA 3.57Å; M381-A388 HydrophobicContact SD-CB 4.01Å |
| 382 | A | 97.6 | Very high | 98.1 | Very high | 10 Ų | 10 | 45.2 Ų | 45.2 | 8% | 0.083 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.3 | -26.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V254 P256 A378 V380 I384 G385 L386 | V254-A382 HydrophobicContact CG1-CB 3.94Å; P256-A382 HydrophobicContact CB-CB 4.34Å; A378-A382 VanDerWaalsContact O-CB 3.25Å; A378-A382 WeakPolarHBondContact O-CB 3.42Å; A378-A382 PolarHBondContact O-N 3.08Å; V380-A382 PolarHBondContact O-N 3.47Å; A382-I384 PolarHBondContact O-N 3.47Å; A382-G385 PolarHBondContact O-N 3Å; A382-L386 PolarHBondContact N-O 3.32Å |
| 383 | R | 97.3 | Very high | 98.1 | Very high | 180 Ų | 180 | 40.7 Ų | 40.7 | 68% | 0.679 | 23% | 0.233 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -24.7 | 174.9 | -61.9 | -68.7 | -178.1 | 159.4 | 0.2 | 113.4 | V380 M381 | V380-R383 VanDerWaalsContact O-CB 3.28Å; V380-R383 WeakPolarHBondContact O-CB 3.15Å; V380-R383 PolarHBondContact O-N 2.95Å; M381-R383 PolarHBondContact O-N 3.01Å |
| 384 | I | 96.3 | Very high | 98.1 | Very high | 121 Ų | 121 | 38.3 Ų | 38.3 | 62% | 0.621 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -110 | 16 | 177.1 | 60.1 | 171.3 | 0 | 0 | 0 | 111.7 | M381 A382 L386 | M381-I384 CarbonylContact O-C 3.51Å; M381-I384 WeakPolarHBondContact O-CG1 3.49Å; M381-I384 PolarHBondContact O-N 2.81Å; A382-I384 PolarHBondContact O-N 3.47Å; I384-L386 HydrophobicContact CD1-CD1 3.76Å; I384-L386 HydrophobicContact CD1-CG 4.33Å; I384-L386 HydrophobicContact CG1-CB 4.35Å; I384-L386 HydrophobicContact CG1-CD1 4.19Å; I384-L386 HydrophobicContact CG1-CG 4.2Å; I384-L386 PolarHBondContact O-N 3.01Å |
| 385 | G | 96.9 | Very high | 98.1 | Very high | 36 Ų | 36 | 41.4 Ų | 41.4 | 37% | 0.371 | 23% | 0.234 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 71.5 | 24.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | M381 A382 | M381-G385 PolarHBondContact O-N 3.37Å; A382-G385 PolarHBondContact O-N 3Å |
| 386 | L | 98.2 | Very high | 98.2 | Very high | 7 Ų | 7 | 39.7 Ų | 39.7 | 4% | 0.037 | 22% | 0.224 | C | C | . | . | trans | -115.9 | 146.4 | -178 | -67.1 | -178 | 0 | 0 | 0 | 113.2 | L239 S240 M381 A382 I384 | L239-L386 HydrophobicContact CB-CD2 3.61Å; S240-L386 WeakPolarHBondContact OG-CD1 3.3Å; M381-L386 CarbonylContact C-O 3.6Å; M381-L386 HydrophobicContact CB-CB 4.16Å; M381-L386 VanDerWaalsContact CB-O 3.31Å; M381-L386 WeakPolarHBondContact CB-O 3.25Å; M381-L386 HydrophobicContact CE-CB 3.89Å; M381-L386 HydrophobicContact CE-CD1 4.03Å; M381-L386 PolarHBondContact O-N 3.25Å; A382-L386 PolarHBondContact N-O 3.32Å; I384-L386 HydrophobicContact CD1-CD1 3.76Å; I384-L386 HydrophobicContact CD1-CG 4.33Å; I384-L386 HydrophobicContact CG1-CB 4.35Å; I384-L386 HydrophobicContact CG1-CD1 4.19Å; I384-L386 HydrophobicContact CG1-CG 4.2Å; I384-L386 PolarHBondContact O-N 3.01Å | ||
| 387 | P | 97.9 | Very high | 98.2 | Very high | 20 Ų | 20 | 38.1 Ų | 38.1 | 13% | 0.13 | 21% | 0.207 | C | C | . | . | trans | -78.1 | 148 | 165.2 | 33 | -34 | 0 | 0 | 0 | 111.5 | F187 L239 M381 | F187-P387 HydrophobicContact CD1-CG 4.23Å; F187-P387 HydrophobicContact CD2-CG 4.09Å; F187-P387 HydrophobicContact CE1-CB 3.77Å; F187-P387 HydrophobicContact CE1-CG 3.82Å; F187-P387 HydrophobicContact CE2-CB 4.08Å; F187-P387 HydrophobicContact CE2-CG 3.66Å; F187-P387 HydrophobicContact CG-CG 4.38Å; F187-P387 HydrophobicContact CZ-CB 3.47Å; F187-P387 VanDerWaalsContact CZ-CB 3.47Å; F187-P387 HydrophobicContact CZ-CG 3.52Å; L239-P387 HydrophobicContact CD1-CG 3.66Å; M381-P387 VanDerWaalsContact CE-O 3.22Å; M381-P387 WeakPolarHBondContact CE-O 3.48Å | ||
| 388 | A | 97.8 | Very high | 98.2 | Very high | 9 Ų | 9 | 37.3 Ų | 37.3 | 7% | 0.074 | 20% | 0.203 | C | C | . | . | trans | -74.5 | -24.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | M377 A378 M381 T390 W391 P392 | M377-A388 HydrophobicContact CB-CB 3.97Å; A378-A388 HydrophobicContact CB-CB 4.19Å; M381-A388 VanDerWaalsContact SD-CA 3.57Å; M381-A388 HydrophobicContact SD-CB 4.01Å; A388-T390 PolarHBondContact O-N 3.27Å; A388-W391 WeakPolarHBondContact O-CB 3.27Å; A388-W391 PolarHBondContact O-N 3.32Å; A388-P392 HydrophobicContact CB-CG 4.33Å | ||
| 389 | C | 98.3 | Very high | 98.2 | Very high | 15 Ų | 15 | 39.7 Ų | 39.7 | 10% | 0.101 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 47.1 | -127.6 | -177.5 | -57.9 | 0 | 0 | 0 | 0 | 111.2 | F231 N232 L235 F339 N340 | F231-C389 HydrophobicContact CE1-CB 3.9Å; F231-C389 HydrophobicContact CZ-CB 4Å; N232-C389 WeakPolarHBondContact OD1-CB 3.45Å; L235-C389 VanDerWaalsContact CD2-SG 3.55Å; F339-C389 VanDerWaalsContact CE2-O 3.26Å; F339-C389 WeakPolarHBondContact CE2-O 3.24Å; N340-C389 PolarHBondContact ND2-O 2.96Å; N340-C389 PolarHBondContact OD1-O 3.42Å |
| 390 | T | 98.6 | Very high | 98.3 | Very high | 4 Ų | 4 | 37.4 Ų | 37.4 | 3% | 0.025 | 20% | 0.196 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -106.2 | 18.8 | -178.2 | 57.7 | 0 | 0 | 0 | 0 | 113.9 | T228 F231 N232 F339 N340 L343 A388 P392 F393 C394 | T228-T390 PolarHBondContact OG1-OG1 3.33Å; F231-T390 WeakPolarHBondContact CE1-OG1 3.29Å; N232-T390 PolarHBondContact ND2-O 3Å; N232-T390 PolarHBondContact ND2-OG1 3.14Å; N232-T390 PolarHBondContact OD1-N 3.41Å; N232-T390 PolarHBondContact OD1-OG1 3.22Å; F339-T390 HydrophobicContact CD2-CG2 3.91Å; F339-T390 HydrophobicContact CE2-CG2 3.83Å; N340-T390 VanDerWaalsContact OD1-CA 3.31Å; N340-T390 WeakPolarHBondContact OD1-CA 3.16Å; L343-T390 HydrophobicContact CD1-CG2 3.76Å; A388-T390 PolarHBondContact O-N 3.27Å; T390-P392 VanDerWaalsContact C-N 3.32Å; T390-F393 PolarHBondContact O-N 3.17Å; T390-C394 PolarHBondContact O-N 3.38Å; T390-C394 VanDerWaalsContact O-N 3.1Å; T390-C394 PolarHBondContact O-SG 3.35Å |
| 391 | W | 98.9 | Very high | 98.3 | Very high | 42 Ų | 42 | 33 Ų | 33 | 16% | 0.159 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -52.4 | -45 | 165.6 | -81 | 111.7 | 0 | 0 | 0 | 112.6 | L229 N232 M233 S236 M377 A388 F393 C394 L395 | L229-W391 HydrophobicContact CD2-CE3 3.9Å; L229-W391 HydrophobicContact CD2-CH2 4.31Å; L229-W391 HydrophobicContact CD2-CZ3 3.5Å; L229-W391 VanDerWaalsContact CD2-CZ3 3.5Å; N232-W391 HydrophobicContact CB-CD2 3.79Å; N232-W391 HydrophobicContact CB-CE3 4.47Å; N232-W391 HydrophobicContact CB-CG 3.96Å; N232-W391 HydrophobicContact CB-CZ2 3.99Å; N232-W391 PolarHBondContact ND2-N 3.28Å; N232-W391 PolarHBondContact OD1-N 2.87Å; N232-W391 VanDerWaalsContact OD1-N 3.12Å; M233-W391 HydrophobicContact CE-CH2 3.94Å; M233-W391 HydrophobicContact CG-CH2 3.63Å; M233-W391 HydrophobicContact CG-CZ2 3.85Å; S236-W391 PolarHBondContact OG-NE1 2.89Å; S236-W391 VanDerWaalsContact OG-NE1 3.11Å; M377-W391 HydrophobicContact CE-CB 3.51Å; M377-W391 HydrophobicContact CE-CG 4.14Å; M377-W391 HydrophobicContact SD-CB 3.99Å; A388-W391 WeakPolarHBondContact O-CB 3.27Å; A388-W391 PolarHBondContact O-N 3.32Å; W391-F393 PolarHBondContact O-N 3.19Å; W391-C394 PolarHBondContact O-N 3.32Å; W391-L395 HydrophobicContact CE3-CD1 4.45Å; W391-L395 HydrophobicContact CE3-CG 4.41Å; W391-L395 WeakPolarHBondContact O-CG 3.29Å; W391-L395 PolarHBondContact O-N 2.88Å |
| 392 | P | 98.9 | Very high | 98.3 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59.2 | -47.5 | 180 | -22 | 32.4 | 0 | 0 | 0 | 112.4 | N340 L373 M377 A388 T390 C394 L395 A396 | N340-P392 HydrophobicContact CB-CB 4.41Å; L373-P392 HydrophobicContact CB-CB 4.45Å; L373-P392 HydrophobicContact CD2-CB 4.49Å; L373-P392 HydrophobicContact CG-CB 4.21Å; M377-P392 HydrophobicContact CB-CG 4.16Å; M377-P392 HydrophobicContact CG-CG 4.41Å; M377-P392 HydrophobicContact SD-CB 4.28Å; M377-P392 HydrophobicContact SD-CG 3.93Å; A388-P392 HydrophobicContact CB-CG 4.33Å; T390-P392 VanDerWaalsContact C-N 3.32Å; P392-C394 PolarHBondContact O-N 2.93Å; P392-L395 PolarHBondContact O-N 3.27Å; P392-A396 WeakPolarHBondContact O-CB 3.43Å; P392-A396 PolarHBondContact O-N 3.35Å |
| 393 | F | 98.9 | Very high | 98.3 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -55 | -51.2 | 174.4 | 150.6 | -108.7 | 0 | 0 | 0 | 111.8 | F122 F227 T228 N340 L343 A344 A347 T370 T390 W391 L395 T397 | F122-F393 AromaticContact CE1-CZ 3.97Å; F122-F393 HydrophobicContact CE1-CZ 3.97Å; F122-F393 HydrophobicContact CE2-CZ 4.49Å; F122-F393 HydrophobicContact CZ-CE1 4.21Å; F122-F393 AromaticContact CZ-CE2 3.84Å; F122-F393 HydrophobicContact CZ-CE2 3.84Å; F122-F393 AromaticContact CZ-CZ 3.4Å; F122-F393 HydrophobicContact CZ-CZ 3.4Å; F227-F393 HydrophobicContact CB-CE1 3.82Å; F227-F393 HydrophobicContact CB-CZ 3.92Å; F227-F393 HydrophobicContact CD1-CE1 4.35Å; F227-F393 AromaticContact CD1-CZ 3.62Å; F227-F393 HydrophobicContact CD1-CZ 3.62Å; F227-F393 HydrophobicContact CD2-CZ 4.2Å; F227-F393 HydrophobicContact CE1-CZ 4.05Å; F227-F393 HydrophobicContact CG-CE1 4.11Å; F227-F393 AromaticContact CG-CZ 3.68Å; F227-F393 HydrophobicContact CG-CZ 3.68Å; T228-F393 HydrophobicContact CG2-CE1 4.41Å; N340-F393 HydrophobicContact CB-CB 4.3Å; N340-F393 WeakPolarHBondContact OD1-CB 3.23Å; N340-F393 PolarHBondContact OD1-N 3.18Å; L343-F393 HydrophobicContact CB-CB 4.31Å; L343-F393 HydrophobicContact CB-CD1 4.2Å; L343-F393 HydrophobicContact CB-CD2 3.49Å; L343-F393 VanDerWaalsContact CB-CD2 3.49Å; L343-F393 HydrophobicContact CB-CE2 3.88Å; L343-F393 HydrophobicContact CB-CG 3.69Å; L343-F393 HydrophobicContact CB-CZ 4.4Å; L343-F393 HydrophobicContact CD1-CB 4.46Å; L343-F393 HydrophobicContact CD1-CD1 3.88Å; L343-F393 HydrophobicContact CD1-CE1 4.36Å; L343-F393 HydrophobicContact CD1-CG 4.03Å; A344-F393 HydrophobicContact CB-CD2 4.18Å; A347-F393 HydrophobicContact CB-CE2 4.22Å; T370-F393 HydrophobicContact CG2-CB 4.33Å; T390-F393 PolarHBondContact O-N 3.17Å; W391-F393 PolarHBondContact O-N 3.19Å; F393-L395 PolarHBondContact O-N 3.48Å; F393-T397 VanDerWaalsContact CD2-OG1 3.25Å; F393-T397 WeakPolarHBondContact CD2-OG1 3.47Å; F393-T397 HydrophobicContact CE2-CG2 4.29Å; F393-T397 VanDerWaalsContact CE2-OG1 3.29Å; F393-T397 WeakPolarHBondContact CE2-OG1 3.47Å; F393-T397 VanDerWaalsContact O-CB 3.25Å; F393-T397 WeakPolarHBondContact O-CB 3.36Å; F393-T397 PolarHBondContact O-N 3.19Å; F393-T397 PolarHBondContact O-OG1 3.32Å |
| 394 | C | 98.9 | Very high | 98.2 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.5 | -51.5 | -177.2 | -68.4 | 0 | 0 | 0 | 0 | 111.5 | T228 L229 T390 W391 P392 L398 | T228-C394 PolarHBondContact OG1-SG 3.29Å; L229-C394 HydrophobicContact CD2-CB 3.56Å; L229-C394 HydrophobicContact CG-CB 3.91Å; T390-C394 PolarHBondContact O-N 3.38Å; T390-C394 VanDerWaalsContact O-N 3.1Å; T390-C394 PolarHBondContact O-SG 3.35Å; W391-C394 PolarHBondContact O-N 3.32Å; P392-C394 PolarHBondContact O-N 2.93Å; C394-L398 WeakPolarHBondContact O-CB 3.12Å; C394-L398 WeakPolarHBondContact O-CD1 3.42Å; C394-L398 WeakPolarHBondContact O-CG 3.3Å; C394-L398 PolarHBondContact O-N 3.05Å |
| 395 | L | 98.9 | Very high | 98.2 | Very high | 77 Ų | 77 | 36.2 Ų | 36.2 | 40% | 0.403 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -68.6 | -43.9 | -174.8 | -64 | 178.7 | 0 | 0 | 0 | 111.8 | L373 M377 W391 P392 F393 L399 | L373-L395 HydrophobicContact CD2-CB 4.2Å; M377-L395 HydrophobicContact CE-CD1 3.86Å; M377-L395 HydrophobicContact SD-CD1 3.85Å; W391-L395 HydrophobicContact CE3-CD1 4.45Å; W391-L395 HydrophobicContact CE3-CG 4.41Å; W391-L395 WeakPolarHBondContact O-CG 3.29Å; W391-L395 PolarHBondContact O-N 2.88Å; P392-L395 PolarHBondContact O-N 3.27Å; F393-L395 PolarHBondContact O-N 3.48Å; L395-L399 WeakPolarHBondContact O-CB 3.36Å; L395-L399 PolarHBondContact O-N 3.31Å |
| 396 | A | 98.9 | Very high | 98.1 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.8 | -48.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | F369 T370 L373 P392 L398 L399 F400 | F369-A396 HydrophobicContact CD1-CB 3.67Å; F369-A396 HydrophobicContact CE1-CB 3.82Å; T370-A396 HydrophobicContact CG2-CB 4.16Å; T370-A396 WeakPolarHBondContact OG1-CB 3.2Å; L373-A396 HydrophobicContact CD2-CB 4.04Å; P392-A396 WeakPolarHBondContact O-CB 3.43Å; P392-A396 PolarHBondContact O-N 3.35Å; A396-L398 PolarHBondContact O-N 3.11Å; A396-L399 WeakPolarHBondContact O-CB 3.49Å; A396-L399 PolarHBondContact O-N 2.88Å; A396-F400 VanDerWaalsContact O-CD2 3.23Å; A396-F400 WeakPolarHBondContact O-CD2 3.38Å; A396-F400 PolarHBondContact O-N 2.86Å |
| 397 | T | 98.8 | Very high | 98 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -67.5 | -40.2 | -176.3 | -49.8 | 0 | 0 | 0 | 0 | 111.2 | F227 A347 M348 F393 L399 F400 L401 | F227-T397 HydrophobicContact CE1-CG2 4.37Å; F227-T397 HydrophobicContact CE2-CG2 3.64Å; F227-T397 HydrophobicContact CZ-CG2 3.41Å; F227-T397 VanDerWaalsContact CZ-CG2 3.41Å; A347-T397 HydrophobicContact CB-CG2 3.72Å; M348-T397 HydrophobicContact CG-CG2 4.22Å; M348-T397 HydrophobicContact SD-CG2 3.96Å; F393-T397 VanDerWaalsContact CD2-OG1 3.25Å; F393-T397 WeakPolarHBondContact CD2-OG1 3.47Å; F393-T397 HydrophobicContact CE2-CG2 4.29Å; F393-T397 VanDerWaalsContact CE2-OG1 3.29Å; F393-T397 WeakPolarHBondContact CE2-OG1 3.47Å; F393-T397 VanDerWaalsContact O-CB 3.25Å; F393-T397 WeakPolarHBondContact O-CB 3.36Å; F393-T397 PolarHBondContact O-N 3.19Å; F393-T397 PolarHBondContact O-OG1 3.32Å; T397-L399 PolarHBondContact O-N 3.49Å; T397-F400 PolarHBondContact O-N 3.44Å; T397-L401 HydrophobicContact CG2-CD1 4.3Å; T397-L401 HydrophobicContact CG2-CG 4.45Å; T397-L401 WeakPolarHBondContact O-CB 3.3Å; T397-L401 WeakPolarHBondContact O-CG 3.22Å; T397-L401 PolarHBondContact O-N 3.26Å |
| 398 | L | 98.8 | Very high | 97.7 | Very high | 15 Ų | 15 | 51.2 Ų | 51.2 | 8% | 0.079 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.5 | -43.2 | 173.7 | -73.3 | 171.1 | 0 | 0 | 0 | 111.8 | L224 F227 L229 C394 A396 F400 L401 M402 | L224-L398 HydrophobicContact CB-CD2 4.03Å; L224-L398 HydrophobicContact CD1-CD2 4.23Å; L224-L398 HydrophobicContact CD2-CD2 4.27Å; L224-L398 HydrophobicContact CG-CD2 4.41Å; F227-L398 HydrophobicContact CD2-CD1 4.5Å; F227-L398 HydrophobicContact CD2-CD2 3.96Å; F227-L398 HydrophobicContact CD2-CG 3.85Å; F227-L398 HydrophobicContact CE2-CD2 3.82Å; F227-L398 HydrophobicContact CE2-CG 3.88Å; L229-L398 HydrophobicContact CD1-CD1 3.82Å; C394-L398 WeakPolarHBondContact O-CB 3.12Å; C394-L398 WeakPolarHBondContact O-CD1 3.42Å; C394-L398 WeakPolarHBondContact O-CG 3.3Å; C394-L398 PolarHBondContact O-N 3.05Å; A396-L398 PolarHBondContact O-N 3.11Å; L398-F400 VanDerWaalsContact C-N 3.32Å; L398-F400 PolarHBondContact O-N 3.05Å; L398-L401 PolarHBondContact O-N 3.02Å; L398-M402 WeakPolarHBondContact O-CB 3.24Å; L398-M402 WeakPolarHBondContact O-CE 3.42Å; L398-M402 WeakPolarHBondContact O-CG 3.36Å; L398-M402 PolarHBondContact O-N 3.25Å |
| 399 | L | 98.8 | Very high | 97.6 | Very high | 91 Ų | 91 | 51.9 Ų | 51.9 | 48% | 0.476 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -57 | -46.8 | 175.7 | 178.5 | 65.4 | 0 | 0 | 0 | 111.3 | F369 L395 A396 T397 M402 M403 | F369-L399 HydrophobicContact CE1-CD2 4.18Å; F369-L399 HydrophobicContact CZ-CD2 3.95Å; L395-L399 WeakPolarHBondContact O-CB 3.36Å; L395-L399 PolarHBondContact O-N 3.31Å; A396-L399 WeakPolarHBondContact O-CB 3.49Å; A396-L399 PolarHBondContact O-N 2.88Å; T397-L399 PolarHBondContact O-N 3.49Å; L399-M402 PolarHBondContact O-N 3.07Å; L399-M403 PolarHBondContact O-N 3.42Å |
| 400 | F | 98.6 | Very high | 97.5 | Very high | 37 Ų | 37 | 53.1 Ų | 53.1 | 16% | 0.162 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -68.7 | -34.8 | 179.2 | -84.7 | -115.1 | 0 | 0 | 0 | 112.7 | M348 L362 C366 F369 A396 T397 L398 M402 M403 | M348-F400 HydrophobicContact CE-CB 3.85Å; M348-F400 HydrophobicContact SD-CB 4.14Å; L362-F400 HydrophobicContact CD1-CD1 3.78Å; L362-F400 HydrophobicContact CD1-CE1 3.91Å; L362-F400 HydrophobicContact CG-CD1 4.18Å; C366-F400 VanDerWaalsContact CA-CE1 3.49Å; C366-F400 HydrophobicContact CB-CD1 3.52Å; C366-F400 HydrophobicContact CB-CD2 4.39Å; C366-F400 HydrophobicContact CB-CE1 3.57Å; C366-F400 HydrophobicContact CB-CE2 4.43Å; C366-F400 HydrophobicContact CB-CG 3.95Å; C366-F400 HydrophobicContact CB-CZ 4.04Å; C366-F400 VanDerWaalsContact SG-CG 3.58Å; F369-F400 HydrophobicContact CB-CE2 4.06Å; F369-F400 HydrophobicContact CB-CZ 4.01Å; F369-F400 AromaticContact CD1-CE2 3.77Å; F369-F400 HydrophobicContact CD1-CE2 3.77Å; F369-F400 HydrophobicContact CD2-CE2 4.47Å; F369-F400 HydrophobicContact CE1-CE2 4.35Å; F369-F400 AromaticContact CG-CE2 3.84Å; F369-F400 HydrophobicContact CG-CE2 3.84Å; F369-F400 HydrophobicContact CG-CZ 4.23Å; A396-F400 VanDerWaalsContact O-CD2 3.23Å; A396-F400 WeakPolarHBondContact O-CD2 3.38Å; A396-F400 PolarHBondContact O-N 2.86Å; T397-F400 PolarHBondContact O-N 3.44Å; L398-F400 VanDerWaalsContact C-N 3.32Å; L398-F400 PolarHBondContact O-N 3.05Å; F400-M402 VanDerWaalsContact C-N 3.32Å; F400-M403 WeakPolarHBondContact O-CB 3.37Å; F400-M403 PolarHBondContact O-N 2.85Å |
| 401 | L | 98.5 | Very high | 97.4 | Very high | 9 Ų | 9 | 55.6 Ų | 55.6 | 5% | 0.047 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -73.1 | -22.1 | 175.1 | -72.8 | 178.8 | 0 | 0 | 0 | 113.7 | L224 P225 F227 M348 F352 V353 T397 L398 | L224-L401 HydrophobicContact CD2-CB 3.58Å; L224-L401 HydrophobicContact CD2-CD1 4.25Å; P225-L401 HydrophobicContact CG-CD1 4.32Å; F227-L401 HydrophobicContact CE2-CD1 4.07Å; F227-L401 HydrophobicContact CZ-CD1 3.68Å; M348-L401 HydrophobicContact CE-CD2 4.34Å; M348-L401 HydrophobicContact SD-CD2 3.8Å; M348-L401 HydrophobicContact SD-CG 3.99Å; F352-L401 HydrophobicContact CB-CD1 4.02Å; F352-L401 HydrophobicContact CB-CD2 3.8Å; F352-L401 HydrophobicContact CG-CD1 4.4Å; V353-L401 HydrophobicContact CG2-CD2 3.57Å; T397-L401 HydrophobicContact CG2-CD1 4.3Å; T397-L401 HydrophobicContact CG2-CG 4.45Å; T397-L401 WeakPolarHBondContact O-CB 3.3Å; T397-L401 WeakPolarHBondContact O-CG 3.22Å; T397-L401 PolarHBondContact O-N 3.26Å; L398-L401 PolarHBondContact O-N 3.02Å |
| 402 | M | 97.9 | Very high | 97.4 | Very high | 106 Ų | 106 | 56.8 Ų | 56.8 | 52% | 0.522 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -82.9 | -17.1 | 173.4 | -74 | -173.7 | -64.3 | 0 | 0 | 113 | L224 L398 L399 F400 T404 | L224-M402 HydrophobicContact CD1-CG 3.61Å; L224-M402 HydrophobicContact CD1-SD 4Å; L224-M402 HydrophobicContact CD2-CG 4.39Å; L398-M402 WeakPolarHBondContact O-CB 3.24Å; L398-M402 WeakPolarHBondContact O-CE 3.42Å; L398-M402 WeakPolarHBondContact O-CG 3.36Å; L398-M402 PolarHBondContact O-N 3.25Å; L399-M402 PolarHBondContact O-N 3.07Å; F400-M402 VanDerWaalsContact C-N 3.32Å; M402-T404 PolarHBondContact O-N 3.33Å |
| 403 | M | 97.5 | Very high | 97.4 | Very high | 89 Ų | 89 | 56.8 Ų | 56.8 | 44% | 0.438 | 30% | 0.296 | S | S | . | . | trans | -61.5 | 127.7 | 176.6 | -175.5 | -168.2 | 67.8 | 0 | 0 | 110.2 | L362 L399 F400 | L362-M403 HydrophobicContact CD1-CE 3.95Å; L362-M403 HydrophobicContact CD2-CE 3.89Å; L399-M403 PolarHBondContact O-N 3.42Å; F400-M403 WeakPolarHBondContact O-CB 3.37Å; F400-M403 PolarHBondContact O-N 2.85Å | ||
| 404 | T | 95.9 | Very high | 97.3 | Very high | 135 Ų | 135 | 58.8 Ų | 58.8 | 83% | 0.828 | 31% | 0.309 | S | S | * | . | trans | -101 | 150.7 | 172.2 | 61 | 0 | 0 | 0 | 0 | 110.5 | M402 | M402-T404 PolarHBondContact O-N 3.33Š| ||
| 405 | T | 95.8 | Very high | 97.1 | Very high | 68 Ų | 68 | 60.8 Ų | 60.8 | 42% | 0.417 | 32% | 0.32 | S | S | . | . | trans | -150.7 | 150.4 | 179.9 | 179.1 | 0 | 0 | 0 | 0 | 110.8 | N407 I410 | T405-N407 HydrophobicContact CG2-CB 4.43Å; T405-N407 PolarHBondContact OG1-N 2.66Å; T405-I410 HydrophobicContact CG2-CB 3.63Å; T405-I410 HydrophobicContact CG2-CD1 4.09Å; T405-I410 HydrophobicContact CG2-CG1 4.41Å; T405-I410 HydrophobicContact CG2-CG2 3.7Å | ||
| 406 | K | 95.6 | Very high | 96.8 | Very high | 217 Ų | 217 | 60.8 Ų | 60.8 | 94% | 0.943 | 34% | 0.338 | S | S | * | . | S | Bend | trans | -80.7 | -6 | 173.2 | -64.8 | -175.3 | 178.5 | -178.7 | 0 | 112.7 | S408 | K406-S408 PolarHBondContact O-N 2.98Š|
| 407 | N | 95.3 | Very high | 96.7 | Very high | 65 Ų | 65 | 66.5 Ų | 66.5 | 35% | 0.348 | 36% | 0.363 | S | S | . | . | trans | -78.2 | 107.1 | 178.1 | -172.9 | -18.4 | 0 | 0 | 0 | 110.7 | T405 S409 I410 | T405-N407 HydrophobicContact CG2-CB 4.43Å; T405-N407 PolarHBondContact OG1-N 2.66Å; N407-S409 PolarHBondContact O-N 2.92Å; N407-S409 WeakPolarHBondContact OD1-CB 3.22Å; N407-S409 PolarHBondContact OD1-N 3.26Å; N407-I410 HydrophobicContact CB-CD1 4.32Å; N407-I410 HydrophobicContact CB-CG1 4.46Å; N407-I410 PolarHBondContact O-N 2.95Å | ||
| 408 | S | 92.9 | Very high | 96.7 | Very high | 96 Ų | 96 | 68.2 Ų | 68.2 | 67% | 0.671 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -10.9 | -179.9 | 60.6 | 0 | 0 | 0 | 0 | 115 | K406 Y428 | K406-S408 PolarHBondContact O-N 2.98Å; S408-Y428 PolarHBondContact O-OH 2.97Å |
| 409 | S | 94.7 | Very high | 96.6 | Very high | 23 Ų | 23 | 68.8 Ų | 68.8 | 16% | 0.161 | 38% | 0.377 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -13.3 | 173.3 | -57.7 | 0 | 0 | 0 | 0 | 113.6 | T356 Q358 N407 | T356-S409 WeakPolarHBondContact CG2-O 3.15Å; T356-S409 PolarHBondContact OG1-O 3.36Å; Q358-S409 PolarHBondContact NE2-OG 2.81Å; N407-S409 PolarHBondContact O-N 2.92Å; N407-S409 WeakPolarHBondContact OD1-CB 3.22Å; N407-S409 PolarHBondContact OD1-N 3.26Å |
| 410 | I | 96.8 | Very high | 96.6 | Very high | 42 Ų | 42 | 67 Ų | 67 | 22% | 0.215 | 37% | 0.365 | C | S | . | . | S | Bend | trans | -99.9 | 95 | 172.4 | -60.3 | 174.4 | 0 | 0 | 0 | 107.2 | Q358 T359 L362 T405 N407 | Q358-I410 HydrophobicContact CB-CG1 4.07Å; T359-I410 HydrophobicContact CG2-CB 4.18Å; T359-I410 HydrophobicContact CG2-CG1 4.07Å; T359-I410 HydrophobicContact CG2-CG2 4.19Å; L362-I410 HydrophobicContact CD2-CG2 4.02Å; T405-I410 HydrophobicContact CG2-CB 3.63Å; T405-I410 HydrophobicContact CG2-CD1 4.09Å; T405-I410 HydrophobicContact CG2-CG1 4.41Å; T405-I410 HydrophobicContact CG2-CG2 3.7Å; N407-I410 HydrophobicContact CB-CD1 4.32Å; N407-I410 HydrophobicContact CB-CG1 4.46Å; N407-I410 PolarHBondContact O-N 2.95Å |
| 411 | Y | 97.1 | Very high | 96.6 | Very high | 55 Ų | 55 | 65.2 Ų | 65.2 | 22% | 0.216 | 36% | 0.357 | C | S | . | . | trans | -118.7 | 112.1 | -172.2 | -179.9 | -93.4 | 0 | 0 | 0 | 110.8 | V353 A354 M413 F427 Y428 | V353-Y411 CarbonylContact C-O 3.59Å; V353-Y411 WeakPolarHBondContact CA-O 3.22Å; V353-Y411 WeakPolarHBondContact CG1-O 3.4Å; A354-Y411 HydrophobicContact CB-CD1 4.09Å; A354-Y411 PolarHBondContact N-O 3.05Å; Y411-M413 HydrophobicContact CD1-SD 4.19Å; Y411-M413 HydrophobicContact CE1-SD 4.08Å; Y411-F427 HydrophobicContact CE1-CE1 4.38Å; Y411-Y428 AromaticContact CD1-CD2 3.63Å; Y411-Y428 HydrophobicContact CD1-CD2 3.63Å; Y411-Y428 HydrophobicContact CD1-CE2 4.38Å; Y411-Y428 HydrophobicContact CD1-CG 4.43Å; Y411-Y428 HydrophobicContact CD2-CD2 4.26Å; Y411-Y428 HydrophobicContact CD2-CE2 4.38Å; Y411-Y428 HydrophobicContact CE1-CD2 4.36Å; Y411-Y428 AromaticContact CG-CD2 3.57Å; Y411-Y428 HydrophobicContact CG-CD2 3.57Å; Y411-Y428 AromaticContact CG-CE2 3.86Å; Y411-Y428 HydrophobicContact CG-CE2 3.86Å | ||
| 412 | K | 97.9 | Very high | 96.6 | Very high | 67 Ų | 67 | 67.2 Ų | 67.2 | 29% | 0.291 | 37% | 0.366 | S | S | . | . | B | Isolated β-bridge | trans | -68.8 | 130.9 | 171.7 | -179.6 | -177.8 | 170.1 | -174.7 | 0 | 109.5 | W222 D223 | W222-K412 PolarHBondContact O-NZ 3.3Å; D223-K412 WeakPolarHBondContact O-CE 3.38Å; D223-K412 PolarHBondContact O-NZ 3.46Å |
| 413 | M | 98 | Very high | 96.6 | Very high | 1 Ų | 1 | 65.4 Ų | 65.4 | 1% | 0.005 | 36% | 0.356 | C | S | . | . | P | Polyproline II helix | trans | -75 | 133.2 | 178.2 | -69.6 | -64.7 | -63.5 | 0 | 0 | 110.3 | F352 A354 Y411 L415 V418 N424 F427 | F352-M413 PolarHBondContact O-N 3.5Å; A354-M413 HydrophobicContact CB-SD 3.92Å; Y411-M413 HydrophobicContact CD1-SD 4.19Å; Y411-M413 HydrophobicContact CE1-SD 4.08Å; M413-L415 PolarHBondContact O-N 3.35Å; M413-V418 HydrophobicContact CB-CG2 3.68Å; M413-N424 HydrophobicContact CE-CB 3.69Å; M413-N424 HydrophobicContact CG-CB 4.44Å; M413-N424 HydrophobicContact SD-CB 4.12Å; M413-F427 HydrophobicContact CE-CB 4.32Å; M413-F427 HydrophobicContact CE-CD1 3.58Å; M413-F427 HydrophobicContact CE-CE1 4.29Å; M413-F427 HydrophobicContact CE-CG 4.21Å; M413-F427 HydrophobicContact SD-CD1 4.19Å |
| 414 | P | 97.1 | Very high | 96.6 | Very high | 41 Ų | 41 | 61.1 Ų | 61.1 | 27% | 0.266 | 34% | 0.335 | S | S | . | . | P | Polyproline II helix | trans | -60.9 | 129.6 | 168.2 | -21.1 | 32.4 | 0 | 0 | 0 | 110.2 | D223 G416 K417 V418 F427 | D223-P414 VanDerWaalsContact OD2-CA 3.29Å; D223-P414 WeakPolarHBondContact OD2-CA 3.49Å; P414-G416 VanDerWaalsContact C-N 3.28Å; P414-G416 PolarHBondContact O-N 2.88Å; P414-K417 HydrophobicContact CB-CB 4.5Å; P414-K417 HydrophobicContact CB-CG 4.31Å; P414-K417 WeakPolarHBondContact O-CA 3.23Å; P414-K417 WeakPolarHBondContact O-CB 3.36Å; P414-K417 PolarHBondContact O-N 3.31Å; P414-V418 PolarHBondContact O-N 2.98Å; P414-F427 HydrophobicContact CG-CE1 4.38Å |
| 415 | L | 94.7 | Very high | 96.7 | Very high | 43 Ų | 43 | 59.6 Ų | 59.6 | 23% | 0.225 | 31% | 0.314 | C | S | . | . | G | 310 helix | trans | -57.7 | -39.2 | -171.9 | -70.5 | -179.4 | 0 | 0 | 0 | 113.5 | D223 P225 F352 M413 K417 V418 | D223-L415 VanDerWaalsContact C-CD1 3.4Å; D223-L415 VanDerWaalsContact OD1-CB 3.27Å; D223-L415 WeakPolarHBondContact OD1-CB 3.35Å; D223-L415 VanDerWaalsContact OD1-CG 3.25Å; D223-L415 WeakPolarHBondContact OD1-CG 3.46Å; D223-L415 PolarHBondContact OD1-N 2.84Å; D223-L415 PolarHBondContact OD2-N 2.91Å; D223-L415 VanDerWaalsContact OD2-N 3.17Å; P225-L415 HydrophobicContact CB-CD2 4.28Å; P225-L415 HydrophobicContact CG-CD2 4.48Å; F352-L415 HydrophobicContact CD1-CD2 3.87Å; F352-L415 HydrophobicContact CE1-CD2 3.97Å; M413-L415 PolarHBondContact O-N 3.35Å; L415-K417 PolarHBondContact O-N 3.45Å; L415-V418 HydrophobicContact CD2-CG2 4.4Å; L415-V418 WeakPolarHBondContact O-CB 2.88Å; L415-V418 PolarHBondContact O-N 2.97Å; L415-V418 VanDerWaalsContact O-N 3.11Å |
| 416 | G | 93.9 | Very high | 96.8 | Very high | 77 Ų | 77 | 60.9 Ų | 60.9 | 79% | 0.794 | 32% | 0.318 | S | S | * | . | G | 310 helix | trans | -65.9 | -2.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115 | P414 | P414-G416 VanDerWaalsContact C-N 3.28Å; P414-G416 PolarHBondContact O-N 2.88Å |
| 417 | K | 96.3 | Very high | 96.9 | Very high | 120 Ų | 120 | 53.5 Ų | 53.5 | 52% | 0.522 | 29% | 0.286 | S | S | . | . | G | 310 helix | trans | -117 | -3.7 | 176.7 | -59.5 | -61.4 | -179.3 | -170.4 | 0 | 113.2 | P414 L415 T419 F427 | P414-K417 HydrophobicContact CB-CB 4.5Å; P414-K417 HydrophobicContact CB-CG 4.31Å; P414-K417 WeakPolarHBondContact O-CA 3.23Å; P414-K417 WeakPolarHBondContact O-CB 3.36Å; P414-K417 PolarHBondContact O-N 3.31Å; L415-K417 PolarHBondContact O-N 3.45Å; K417-T419 PolarHBondContact O-N 2.89Å; K417-F427 HydrophobicContact CB-CE1 4.39Å; K417-F427 HydrophobicContact CB-CE2 4.31Å; K417-F427 HydrophobicContact CB-CZ 4.22Å; K417-F427 HydrophobicContact CD-CE2 4.05Å; K417-F427 HydrophobicContact CD-CZ 4.47Å; K417-F427 HydrophobicContact CG-CE1 4.45Å; K417-F427 HydrophobicContact CG-CE2 3.89Å; K417-F427 HydrophobicContact CG-CZ 3.83Å |
| 418 | V | 97.9 | Very high | 97 | Very high | 35 Ų | 35 | 50.6 Ų | 50.6 | 21% | 0.212 | 27% | 0.27 | C | S | . | . | trans | -70.4 | 127.5 | 179.7 | 173.8 | 0 | 0 | 0 | 0 | 109.9 | M351 F352 M413 P414 L415 | M351-V418 HydrophobicContact CE-CG1 3.27Å; F352-V418 HydrophobicContact CD1-CG1 4.32Å; F352-V418 HydrophobicContact CD1-CG2 4.28Å; F352-V418 HydrophobicContact CE1-CG1 4.13Å; M413-V418 HydrophobicContact CB-CG2 3.68Å; P414-V418 PolarHBondContact O-N 2.98Å; L415-V418 HydrophobicContact CD2-CG2 4.4Å; L415-V418 WeakPolarHBondContact O-CB 2.88Å; L415-V418 PolarHBondContact O-N 2.97Å; L415-V418 VanDerWaalsContact O-N 3.11Å | ||
| 419 | T | 97.7 | Very high | 97.2 | Very high | 27 Ų | 27 | 48.6 Ų | 48.6 | 17% | 0.166 | 25% | 0.252 | C | S | . | . | trans | -133.8 | -84.2 | 178.1 | 47.4 | 0 | 0 | 0 | 0 | 110.6 | D92 M351 K417 N424 | D92-T419 VanDerWaalsContact OD2-CB 3.28Å; D92-T419 WeakPolarHBondContact OD2-CB 3.17Å; M351-T419 WeakPolarHBondContact CE-O 3.31Å; K417-T419 PolarHBondContact O-N 2.89Å; T419-N424 PolarHBondContact N-OD1 2.65Å; T419-N424 PolarHBondContact OG1-OD1 2.98Å; T419-N424 VanDerWaalsContact OG1-OD1 3.07Å | ||
| 420 | Y | 98.3 | Very high | 97.2 | Very high | 54 Ų | 54 | 52.2 Ų | 52.2 | 21% | 0.212 | 27% | 0.266 | C | S | . | . | trans | -148.2 | 158.7 | 171.9 | 59 | -84 | 0 | 0 | 0 | 110.2 | E422 E423 N424 | Y420-E422 VanDerWaalsContact C-N 3.33Å; Y420-E422 HydrophobicContact CD2-CB 4Å; Y420-E422 WeakPolarHBondContact CD2-OE2 3.41Å; Y420-E422 HydrophobicContact CE2-CB 3.82Å; Y420-E422 PolarHBondContact O-N 2.93Å; Y420-E422 VanDerWaalsContact O-N 3.14Å; Y420-E423 HydrophobicContact CD1-CB 4.32Å; Y420-E423 HydrophobicContact CD2-CB 4.48Å; Y420-E423 HydrophobicContact CE1-CB 3.91Å; Y420-E423 WeakPolarHBondContact CE1-OE2 3.17Å; Y420-E423 HydrophobicContact CE2-CB 4.12Å; Y420-E423 PolarHBondContact O-N 3.45Å; Y420-E423 VanDerWaalsContact O-N 3.12Å; Y420-N424 WeakPolarHBondContact O-CB 3.33Å; Y420-N424 PolarHBondContact O-N 3.29Å; Y420-N424 PolarHBondContact O-ND2 3.11Å; Y420-N424 PolarHBondContact O-OD1 3.41Å | ||
| 421 | P | 98.6 | Very high | 97 | Very high | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -53.1 | -39.4 | -166.6 | -33.1 | 38.7 | 0 | 0 | 0 | 116.7 | L306 M307 G350 R425 | L306-P421 HydrophobicContact CB-CB 3.84Å; L306-P421 HydrophobicContact CB-CG 4.29Å; L306-P421 HydrophobicContact CD1-CB 3.89Å; M307-P421 VanDerWaalsContact CG-CD 3.47Å; M307-P421 HydrophobicContact CG-CG 3.53Å; M307-P421 HydrophobicContact SD-CG 4.43Å; G350-P421 WeakPolarHBondContact O-CA 3.3Å; P421-R425 VanDerWaalsContact O-CB 3.3Å; P421-R425 WeakPolarHBondContact O-CB 3.38Å; P421-R425 PolarHBondContact O-N 2.84Å |
| 422 | E | 98.4 | Very high | 96.6 | Very high | 51 Ų | 51 | 53.8 Ų | 53.8 | 24% | 0.238 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.1 | -46.5 | 179.9 | -67.4 | 79.8 | 174.7 | 0 | 0 | 111.3 | S304 P305 L306 Y420 I426 | S304-E422 WeakPolarHBondContact CB-OE2 3.35Å; S304-E422 VanDerWaalsContact OG-CD 3.25Å; S304-E422 PolarHBondContact OG-OE1 3.41Å; S304-E422 VanDerWaalsContact OG-OE1 3.07Å; S304-E422 PolarHBondContact OG-OE2 2.99Å; P305-E422 WeakPolarHBondContact CD-OE1 3.45Å; L306-E422 HydrophobicContact CD1-CG 3.83Å; L306-E422 HydrophobicContact CG-CG 4.35Å; L306-E422 WeakPolarHBondContact CG-OE1 3.24Å; L306-E422 PolarHBondContact N-OE1 2.86Å; Y420-E422 VanDerWaalsContact C-N 3.33Å; Y420-E422 HydrophobicContact CD2-CB 4Å; Y420-E422 WeakPolarHBondContact CD2-OE2 3.41Å; Y420-E422 HydrophobicContact CE2-CB 3.82Å; Y420-E422 PolarHBondContact O-N 2.93Å; Y420-E422 VanDerWaalsContact O-N 3.14Å; E422-I426 WeakPolarHBondContact O-CG1 3.44Å; E422-I426 PolarHBondContact O-N 3.38Å |
| 423 | E | 97.8 | Very high | 96.3 | Very high | 67 Ų | 67 | 57.2 Ų | 57.2 | 31% | 0.313 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -73.3 | -39.3 | 178.2 | -171.6 | 172.6 | -177.5 | 0 | 0 | 111.4 | K94 Y420 R425 I426 F427 | K94-E423 IonicContact NZ-OE1 2.86Å; K94-E423 PolarHBondContact NZ-OE1 2.93Å; K94-E423 IonicContact NZ-OE2 3.88Å; K94-E423 PolarHBondContact NZ-OE2 3.34Å; Y420-E423 HydrophobicContact CD1-CB 4.32Å; Y420-E423 HydrophobicContact CD2-CB 4.48Å; Y420-E423 HydrophobicContact CE1-CB 3.91Å; Y420-E423 WeakPolarHBondContact CE1-OE2 3.17Å; Y420-E423 HydrophobicContact CE2-CB 4.12Å; Y420-E423 PolarHBondContact O-N 3.45Å; Y420-E423 VanDerWaalsContact O-N 3.12Å; E423-R425 VanDerWaalsContact C-N 3.3Å; E423-R425 PolarHBondContact O-N 3.15Å; E423-I426 WeakPolarHBondContact O-CB 3.31Å; E423-I426 PolarHBondContact O-N 3.11Å; E423-I426 VanDerWaalsContact O-N 3.11Å; E423-F427 PolarHBondContact O-N 2.97Å |
| 424 | N | 98.4 | Very high | 95.8 | Very high | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -58.5 | -41.5 | 174.9 | -67.5 | -15.8 | 0 | 0 | 0 | 112.1 | G350 M351 M413 T419 Y420 I426 F427 Y428 | G350-N424 PolarHBondContact O-ND2 3.14Å; M351-N424 VanDerWaalsContact CE-ND2 3.34Å; M351-N424 WeakPolarHBondContact CE-ND2 3.32Å; M351-N424 PolarHBondContact O-ND2 3.45Å; M413-N424 HydrophobicContact CE-CB 3.69Å; M413-N424 HydrophobicContact CG-CB 4.44Å; M413-N424 HydrophobicContact SD-CB 4.12Å; T419-N424 PolarHBondContact N-OD1 2.65Å; T419-N424 PolarHBondContact OG1-OD1 2.98Å; T419-N424 VanDerWaalsContact OG1-OD1 3.07Å; Y420-N424 WeakPolarHBondContact O-CB 3.33Å; Y420-N424 PolarHBondContact O-N 3.29Å; Y420-N424 PolarHBondContact O-ND2 3.11Å; Y420-N424 PolarHBondContact O-OD1 3.41Å; N424-I426 VanDerWaalsContact C-N 3.34Å; N424-I426 PolarHBondContact O-N 3.37Å; N424-F427 WeakPolarHBondContact O-CB 3.34Å; N424-F427 PolarHBondContact O-N 2.81Å; N424-Y428 PolarHBondContact O-N 3.31Å |
| 425 | R | 98.1 | Very high | 95.1 | Very high | 102 Ų | 102 | 69.4 Ų | 69.4 | 39% | 0.385 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -64.9 | -38.1 | 176.7 | -178.5 | 173.9 | 169 | 92.7 | -4.6 | 111.7 | L355 P421 E423 Y428 L429 | L355-R425 PolarHBondContact O-NH1 2.96Å; P421-R425 VanDerWaalsContact O-CB 3.3Å; P421-R425 WeakPolarHBondContact O-CB 3.38Å; P421-R425 PolarHBondContact O-N 2.84Å; E423-R425 VanDerWaalsContact C-N 3.3Å; E423-R425 PolarHBondContact O-N 3.15Å; R425-Y428 PolarHBondContact O-N 3.48Å; R425-L429 HydrophobicContact CG-CD1 4.23Å; R425-L429 VanDerWaalsContact O-CG 3.29Å; R425-L429 WeakPolarHBondContact O-CG 3.27Å; R425-L429 PolarHBondContact O-N 3.39Å |
| 426 | I | 97.9 | Very high | 94.4 | Very high | 96 Ų | 96 | 72.8 Ų | 72.8 | 49% | 0.492 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62.6 | -46.9 | 175.3 | -66.4 | 167.6 | 0 | 0 | 0 | 110.1 | E422 E423 N424 Y428 L429 Q430 | E422-I426 WeakPolarHBondContact O-CG1 3.44Å; E422-I426 PolarHBondContact O-N 3.38Å; E423-I426 WeakPolarHBondContact O-CB 3.31Å; E423-I426 PolarHBondContact O-N 3.11Å; E423-I426 VanDerWaalsContact O-N 3.11Å; N424-I426 VanDerWaalsContact C-N 3.34Å; N424-I426 PolarHBondContact O-N 3.37Å; I426-Y428 PolarHBondContact O-N 2.87Å; I426-L429 PolarHBondContact O-N 3.49Å; I426-Q430 WeakPolarHBondContact O-CG 3.12Å; I426-Q430 PolarHBondContact O-N 2.93Å |
| 427 | F | 97.4 | Very high | 93.6 | Very high | 61 Ų | 61 | 76.2 Ų | 76.2 | 27% | 0.268 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -55.8 | -48.7 | 176.2 | 174.5 | -93.1 | 0 | 0 | 0 | 111.8 | Y411 M413 P414 K417 E423 N424 L429 Q430 A431 | Y411-F427 HydrophobicContact CE1-CE1 4.38Å; M413-F427 HydrophobicContact CE-CB 4.32Å; M413-F427 HydrophobicContact CE-CD1 3.58Å; M413-F427 HydrophobicContact CE-CE1 4.29Å; M413-F427 HydrophobicContact CE-CG 4.21Å; M413-F427 HydrophobicContact SD-CD1 4.19Å; P414-F427 HydrophobicContact CG-CE1 4.38Å; K417-F427 HydrophobicContact CB-CE1 4.39Å; K417-F427 HydrophobicContact CB-CE2 4.31Å; K417-F427 HydrophobicContact CB-CZ 4.22Å; K417-F427 HydrophobicContact CD-CE2 4.05Å; K417-F427 HydrophobicContact CD-CZ 4.47Å; K417-F427 HydrophobicContact CG-CE1 4.45Å; K417-F427 HydrophobicContact CG-CE2 3.89Å; K417-F427 HydrophobicContact CG-CZ 3.83Å; E423-F427 PolarHBondContact O-N 2.97Å; N424-F427 WeakPolarHBondContact O-CB 3.34Å; N424-F427 PolarHBondContact O-N 2.81Å; F427-L429 PolarHBondContact O-N 3Å; F427-Q430 PolarHBondContact O-N 3.08Å; F427-A431 WeakPolarHBondContact O-CB 3.33Å; F427-A431 PolarHBondContact O-N 3.31Å |
| 428 | Y | 96.9 | Very high | 92 | Very high | 5 Ų | 5 | 74.8 Ų | 74.8 | 2% | 0.02 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -59.2 | -45.8 | 177.2 | 164.6 | -107.2 | 0 | 0 | 0 | 112.7 | A354 T356 S408 Y411 N424 R425 I426 Q430 A431 R432 | A354-Y428 VanDerWaalsContact CB-CB 3.45Å; A354-Y428 HydrophobicContact CB-CD1 4.06Å; A354-Y428 HydrophobicContact CB-CD2 3.99Å; A354-Y428 HydrophobicContact CB-CG 3.55Å; T356-Y428 HydrophobicContact CG2-CD1 4.43Å; T356-Y428 HydrophobicContact CG2-CE1 3.75Å; S408-Y428 PolarHBondContact O-OH 2.97Å; Y411-Y428 AromaticContact CD1-CD2 3.63Å; Y411-Y428 HydrophobicContact CD1-CD2 3.63Å; Y411-Y428 HydrophobicContact CD1-CE2 4.38Å; Y411-Y428 HydrophobicContact CD1-CG 4.43Å; Y411-Y428 HydrophobicContact CD2-CD2 4.26Å; Y411-Y428 HydrophobicContact CD2-CE2 4.38Å; Y411-Y428 HydrophobicContact CE1-CD2 4.36Å; Y411-Y428 AromaticContact CG-CD2 3.57Å; Y411-Y428 HydrophobicContact CG-CD2 3.57Å; Y411-Y428 AromaticContact CG-CE2 3.86Å; Y411-Y428 HydrophobicContact CG-CE2 3.86Å; N424-Y428 PolarHBondContact O-N 3.31Å; R425-Y428 PolarHBondContact O-N 3.48Å; I426-Y428 PolarHBondContact O-N 2.87Å; Y428-Q430 VanDerWaalsContact C-N 3.29Å; Y428-Q430 PolarHBondContact O-N 3.49Å; Y428-A431 PolarHBondContact O-N 2.83Å; Y428-R432 WeakPolarHBondContact O-CB 3.25Å; Y428-R432 PolarHBondContact O-N 3.46Å; Y428-R432 WeakPolarHBondContact OH-CD 3.4Å; Y428-R432 PolarHBondContact OH-NH1 3Å |
| 429 | L | 96.8 | Very high | 90.1 | Very high | 54 Ų | 54 | 78.1 Ų | 78.1 | 28% | 0.283 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.6 | -36.9 | -179.9 | -71.2 | 173.2 | 0 | 0 | 0 | 112 | R425 I426 F427 K433 | R425-L429 HydrophobicContact CG-CD1 4.23Å; R425-L429 VanDerWaalsContact O-CG 3.29Å; R425-L429 WeakPolarHBondContact O-CG 3.27Å; R425-L429 PolarHBondContact O-N 3.39Å; I426-L429 PolarHBondContact O-N 3.49Å; F427-L429 PolarHBondContact O-N 3Å; L429-K433 WeakPolarHBondContact O-CG 3.33Å; L429-K433 PolarHBondContact O-N 2.91Å; L429-K433 VanDerWaalsContact O-N 3.09Å |
| 430 | Q | 95.4 | Very high | 87.6 | Confident | 98 Ų | 98 | 88.5 Ų | 88.5 | 46% | 0.458 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -68 | -45.6 | 174.6 | -69.4 | 174.5 | -3.3 | 0 | 0 | 111.7 | I426 F427 Y428 R432 K433 R434 | I426-Q430 WeakPolarHBondContact O-CG 3.12Å; I426-Q430 PolarHBondContact O-N 2.93Å; F427-Q430 PolarHBondContact O-N 3.08Å; Y428-Q430 VanDerWaalsContact C-N 3.29Å; Y428-Q430 PolarHBondContact O-N 3.49Å; Q430-R432 VanDerWaalsContact C-N 3.32Å; Q430-R432 PolarHBondContact O-N 3.23Å; Q430-K433 PolarHBondContact O-N 3.01Å; Q430-R434 WeakPolarHBondContact O-CG 3.27Å; Q430-R434 PolarHBondContact O-N 3.19Å; Q430-R434 VanDerWaalsContact O-N 3.17Å |
| 431 | A | 91.7 | Very high | 87 | Confident | 20 Ų | 20 | 90.2 Ų | 90.2 | 17% | 0.165 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -60.6 | -42.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | F427 Y428 K433 R434 M435 | F427-A431 WeakPolarHBondContact O-CB 3.33Å; F427-A431 PolarHBondContact O-N 3.31Å; Y428-A431 PolarHBondContact O-N 2.83Å; A431-K433 PolarHBondContact O-N 3.4Å; A431-R434 PolarHBondContact O-N 3.16Å; A431-M435 WeakPolarHBondContact O-CG 3.37Å; A431-M435 PolarHBondContact O-N 3.48Å |
| 432 | R | 90.5 | Very high | 86.4 | Confident | 111 Ų | 111 | 94.9 Ų | 94.9 | 42% | 0.419 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64 | -40.6 | 177.4 | -168.8 | 179.3 | 72.5 | -175.8 | 6.2 | 112.6 | Y428 Q430 M435 V436 | Y428-R432 WeakPolarHBondContact O-CB 3.25Å; Y428-R432 PolarHBondContact O-N 3.46Å; Y428-R432 WeakPolarHBondContact OH-CD 3.4Å; Y428-R432 PolarHBondContact OH-NH1 3Å; Q430-R432 VanDerWaalsContact C-N 3.32Å; Q430-R432 PolarHBondContact O-N 3.23Å; R432-M435 PolarHBondContact O-N 3.17Å; R432-V436 WeakPolarHBondContact O-CG2 3.28Å; R432-V436 PolarHBondContact O-N 3.31Å |
| 433 | K | 90.1 | Very high | 85.8 | Confident | 138 Ų | 138 | 97.4 Ų | 97.4 | 60% | 0.6 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -59.9 | -46.2 | 174.9 | -77 | 179.8 | 179.1 | -169.8 | 0 | 111.4 | L429 Q430 A431 M435 V436 E437 | L429-K433 WeakPolarHBondContact O-CG 3.33Å; L429-K433 PolarHBondContact O-N 2.91Å; L429-K433 VanDerWaalsContact O-N 3.09Å; Q430-K433 PolarHBondContact O-N 3.01Å; A431-K433 PolarHBondContact O-N 3.4Å; K433-M435 VanDerWaalsContact C-N 3.31Å; K433-M435 PolarHBondContact O-N 3.48Å; K433-V436 PolarHBondContact O-N 3.5Å; K433-V436 VanDerWaalsContact O-N 3.07Å; K433-E437 WeakPolarHBondContact O-CG 3.48Å; K433-E437 PolarHBondContact O-N 3.24Å |
| 434 | R | 87.8 | Confident | 85 | Confident | 176 Ų | 176 | 99.2 Ų | 99.2 | 66% | 0.664 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.5 | -38.6 | 177.1 | -65.5 | 178.4 | -166.8 | -175.4 | 3.4 | 112.7 | Q430 A431 V436 E437 S438 | Q430-R434 WeakPolarHBondContact O-CG 3.27Å; Q430-R434 PolarHBondContact O-N 3.19Å; Q430-R434 VanDerWaalsContact O-N 3.17Å; A431-R434 PolarHBondContact O-N 3.16Å; R434-V436 VanDerWaalsContact C-N 3.29Å; R434-V436 PolarHBondContact O-N 3.3Å; R434-E437 PolarHBondContact O-N 2.97Å; R434-S438 PolarHBondContact O-N 3.2Å |
| 435 | M | 82 | Confident | 84.2 | Confident | 122 Ų | 122 | 105.4 Ų | 105.4 | 60% | 0.601 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.5 | -31.1 | 175.6 | -71.1 | 176.9 | 178.3 | 0 | 0 | 113.1 | A431 R432 K433 | A431-M435 WeakPolarHBondContact O-CG 3.37Å; A431-M435 PolarHBondContact O-N 3.48Å; R432-M435 PolarHBondContact O-N 3.17Å; K433-M435 VanDerWaalsContact C-N 3.31Å; K433-M435 PolarHBondContact O-N 3.48Å |
| 436 | V | 81.6 | Confident | 83.3 | Confident | 114 Ų | 114 | 105.6 Ų | 105.6 | 69% | 0.691 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -79.5 | -35.1 | 177.6 | 174.8 | 0 | 0 | 0 | 0 | 111.5 | R432 K433 R434 | R432-V436 WeakPolarHBondContact O-CG2 3.28Å; R432-V436 PolarHBondContact O-N 3.31Å; K433-V436 PolarHBondContact O-N 3.5Å; K433-V436 VanDerWaalsContact O-N 3.07Å; R434-V436 VanDerWaalsContact C-N 3.29Å; R434-V436 PolarHBondContact O-N 3.3Å |
| 437 | E | 77.1 | Confident | 82.2 | Confident | 149 Ų | 149 | 106.3 Ų | 106.3 | 70% | 0.696 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -80.7 | -18.8 | 179.6 | -70.6 | 168.7 | -172.3 | 0 | 0 | 113.2 | K433 R434 | K433-E437 WeakPolarHBondContact O-CG 3.48Å; K433-E437 PolarHBondContact O-N 3.24Å; R434-E437 PolarHBondContact O-N 2.97Å |
| 438 | S | 61.3 | Low | 81.1 | Confident | 90 Ų | 90 | 109.8 Ų | 109.8 | 63% | 0.629 | 55% | 0.553 | S | S | * | * | S | Bend | trans | -137.2 | 71 | 174.8 | -62.7 | 0 | 0 | 0 | 0 | 110.6 | R434 L440 | R434-S438 PolarHBondContact O-N 3.2Å; S438-L440 PolarHBondContact O-N 3.36Å; S438-L440 VanDerWaalsContact O-N 3.16Å |
| 439 | P | 58.1 | Low | 79.8 | Confident | 105 Ų | 105 | 118.5 Ų | 118.5 | 68% | 0.682 | 60% | 0.598 | S | S | * | * | trans | -65.4 | 115 | 169.3 | 27 | -28.6 | 0 | 0 | 0 | 107.7 | ||||
| 440 | L | 44.7 | Very low | 78.2 | Confident | 245 Ų | 245 | 124.4 Ų | 124.4 | 100% | 1.283 | 63% | 0.626 | S | S | * | * | trans | -58.8 | 0 | 171.9 | -84.4 | 162.7 | 0 | 0 | 0 | 111.6 | S438 | S438-L440 PolarHBondContact O-N 3.36Å; S438-L440 VanDerWaalsContact O-N 3.16Å |
Retrieved 440 of 440 residues in 106.5 ms
(Link to these results)