| 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 | 36.3 | Very low | 38.2 | Very low | 230 Ų | 230 | 169.4 Ų | 169.4 | 100% | 1.133 | 85% | 0.849 | S | S | * | * | 0 | 136.2 | 0 | -61.1 | 82.7 | 171.4 | 0 | 0 | 107.3 | |||||
| 2 | K | 31.6 | Very low | 38 | Very low | 206 Ų | 206 | 165.2 Ų | 165.2 | 90% | 0.896 | 84% | 0.839 | S | S | * | * | 67.7 | 121.5 | 52.1 | -86.7 | -166.9 | 172.2 | -174.8 | 0 | 113.9 | |||||
| 3 | F | 35.3 | Very low | 37.3 | Very low | 185 Ų | 185 | 163.3 Ų | 163.3 | 81% | 0.811 | 83% | 0.832 | S | S | * | * | trans | -68.5 | 166.9 | 173.1 | -59.5 | -91.6 | 0 | 0 | 0 | 112.1 | I5 | F3-I5 HydrophobicContact CB-CD1 4.35Å; F3-I5 HydrophobicContact CB-CG1 4.2Å | ||
| 4 | P | 51.8 | Low | 37 | Very low | 122 Ų | 122 | 167.6 Ų | 167.6 | 79% | 0.792 | 83% | 0.833 | S | S | * | * | -113.7 | 167.3 | 71.2 | -2.9 | 25.1 | 0 | 0 | 0 | 112.8 | |||||
| 5 | I | 44 | Very low | 36.9 | Very low | 138 Ų | 138 | 166.1 Ų | 166.1 | 71% | 0.708 | 83% | 0.829 | S | S | * | * | cis | 73.2 | 99.6 | 23.1 | -53.1 | 173.7 | 0 | 0 | 0 | 115.2 | F3 | F3-I5 HydrophobicContact CB-CD1 4.35Å; F3-I5 HydrophobicContact CB-CG1 4.2Å | ||
| 6 | E | 37.9 | Very low | 37.3 | Very low | 197 Ų | 197 | 163.1 Ų | 163.1 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | -161.8 | 163.6 | 129 | -118.6 | 170.4 | -162.4 | 0 | 0 | 112 | |||||
| 7 | N | 36 | Very low | 36.9 | Very low | 140 Ų | 140 | 164 Ų | 164 | 75% | 0.749 | 83% | 0.826 | S | S | * | * | trans | -154.2 | 144.1 | -172.8 | -169.5 | 5.8 | 0 | 0 | 0 | 107.5 | ||||
| 8 | P | 47.5 | Very low | 36.8 | Very low | 114 Ų | 114 | 165.6 Ų | 165.6 | 74% | 0.74 | 83% | 0.83 | S | S | * | * | -150 | 133.9 | 119.7 | 34 | -16 | 0 | 0 | 0 | 116.9 | |||||
| 9 | T | 35 | Very low | 36.6 | Very low | 124 Ų | 124 | 163.8 Ų | 163.8 | 76% | 0.761 | 83% | 0.829 | S | S | * | * | trans | 23.7 | 126.7 | 140.6 | 59.9 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 10 | K | 31.5 | Very low | 36.4 | Very low | 212 Ų | 212 | 160.4 Ų | 160.4 | 92% | 0.922 | 83% | 0.826 | S | S | * | * | -146.9 | 142.8 | 128.3 | -125.9 | 174 | -175.8 | 178.2 | 0 | 111.2 | |||||
| 11 | Q | 33.6 | Very low | 36.2 | Very low | 195 Ų | 195 | 158.8 Ų | 158.8 | 91% | 0.911 | 82% | 0.824 | S | S | * | * | trans | -82.3 | 149.1 | 177.4 | -67.4 | 168.8 | -41.4 | 0 | 0 | 110.9 | ||||
| 12 | V | 35.8 | Very low | 35.9 | Very low | 119 Ų | 119 | 156 Ų | 156 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | trans | -132 | 126.8 | 157.8 | -179.6 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 13 | N | 29.1 | Very low | 36.2 | Very low | 141 Ų | 141 | 151.3 Ų | 151.3 | 75% | 0.754 | 80% | 0.797 | S | S | * | * | trans | -101.8 | 148.4 | 176.5 | -170.7 | 37.8 | 0 | 0 | 0 | 109.5 | ||||
| 14 | W | 32.5 | Very low | 35.8 | Very low | 223 Ų | 223 | 150.5 Ų | 150.5 | 85% | 0.845 | 80% | 0.795 | S | S | * | * | trans | -139.6 | 112.5 | 175.6 | -77.3 | 109.5 | 0 | 0 | 0 | 110.5 | ||||
| 15 | D | 35.1 | Very low | 34.8 | Very low | 145 Ų | 145 | 152 Ų | 152 | 78% | 0.775 | 80% | 0.796 | S | S | * | * | trans | -144.6 | 155.4 | 164.3 | -112.4 | -33.6 | 0 | 0 | 0 | 108.2 | ||||
| 16 | P | 44.1 | Very low | 34.1 | Very low | 119 Ų | 119 | 151.4 Ų | 151.4 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | -89 | 156.6 | -161.9 | 34.5 | -36.5 | 0 | 0 | 0 | 115.1 | ||||
| 17 | E | 30.8 | Very low | 35.1 | Very low | 178 Ų | 178 | 147.5 Ų | 147.5 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | trans | -96.8 | 143.8 | -176.6 | -168.2 | 170.7 | -143.3 | 0 | 0 | 113.2 | V19 | E17-V19 HydrophobicContact CG-CG2 4.38Š| ||
| 18 | Q | 34.3 | Very low | 35.8 | Very low | 193 Ų | 193 | 145.7 Ų | 145.7 | 90% | 0.902 | 79% | 0.786 | S | S | * | * | trans | -132.5 | 142.7 | 169.4 | -70.4 | -170.6 | 2.4 | 0 | 0 | 110.3 | ||||
| 19 | V | 32.8 | Very low | 34.8 | Very low | 132 Ų | 132 | 149.4 Ų | 149.4 | 80% | 0.8 | 79% | 0.79 | S | S | * | * | trans | -143.3 | 145 | 175.6 | -174.4 | 0 | 0 | 0 | 0 | 111 | E17 | E17-V19 HydrophobicContact CG-CG2 4.38Š| ||
| 20 | A | 32.3 | Very low | 34.5 | Very low | 95 Ų | 95 | 152.3 Ų | 152.3 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | -159.4 | 178.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 21 | V | 32.6 | Very low | 34.1 | Very low | 127 Ų | 127 | 150.1 Ų | 150.1 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | cis | -160.9 | 165.4 | 4.4 | 77.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 22 | Q | 30.6 | Very low | 33.9 | Very low | 171 Ų | 171 | 149.1 Ų | 149.1 | 80% | 0.799 | 78% | 0.783 | S | S | * | * | trans | 169.9 | 123.6 | 150.1 | -94.5 | 169.9 | 24.3 | 0 | 0 | 110.3 | ||||
| 23 | T | 37.6 | Very low | 34.3 | Very low | 107 Ų | 107 | 149.1 Ų | 149.1 | 66% | 0.656 | 79% | 0.785 | S | S | * | * | 78.5 | 128.9 | 65.1 | 63.1 | 0 | 0 | 0 | 0 | 117.2 | |||||
| 24 | H | 27.5 | Very low | 34.2 | Very low | 169 Ų | 169 | 146.1 Ų | 146.1 | 78% | 0.782 | 79% | 0.787 | S | S | * | * | trans | -177.3 | 127.3 | 134.5 | -110.5 | -79.7 | 0 | 0 | 0 | 117.1 | ||||
| 25 | L | 30.4 | Very low | 34.2 | Very low | 153 Ų | 153 | 143.1 Ų | 143.1 | 80% | 0.801 | 79% | 0.785 | S | S | * | * | trans | 59.5 | 175.1 | 146.7 | -105.8 | 67.3 | 0 | 0 | 0 | 125.5 | ||||
| 26 | V | 28.3 | Very low | 33.9 | Very low | 126 Ų | 126 | 142.6 Ų | 142.6 | 76% | 0.764 | 79% | 0.787 | S | S | * | * | trans | -159.3 | 179.8 | -151.5 | -170 | 0 | 0 | 0 | 0 | 109 | ||||
| 27 | P | 60.7 | Low | 33.3 | Very low | 115 Ų | 115 | 145.2 Ų | 145.2 | 75% | 0.747 | 79% | 0.786 | S | S | * | * | cis | -107.1 | -118.2 | -34 | 21.4 | 5.1 | 0 | 0 | 0 | 110.5 | ||||
| 28 | P | 48.7 | Very low | 33.2 | Very low | 102 Ų | 102 | 142 Ų | 142 | 66% | 0.662 | 78% | 0.783 | S | S | * | * | cis | -142 | 159.3 | -28.1 | 39.2 | -18.7 | 0 | 0 | 0 | 120.9 | ||||
| 29 | K | 28.2 | Very low | 33 | Very low | 191 Ų | 191 | 137.6 Ų | 137.6 | 83% | 0.83 | 77% | 0.774 | S | S | * | * | trans | 80.5 | 135.1 | 138.9 | -87.5 | 173.3 | 178.6 | 169 | 0 | 125.3 | ||||
| 30 | K | 28 | Very low | 32.8 | Very low | 185 Ų | 185 | 138.6 Ų | 138.6 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | 75.6 | 149.7 | 148.6 | -75.7 | -171.6 | 175.1 | -170.8 | 0 | 118.9 | ||||
| 31 | M | 24.1 | Very low | 32.6 | Very low | 167 Ų | 167 | 140.1 Ų | 140.1 | 82% | 0.823 | 77% | 0.773 | S | S | * | * | cis | -164.3 | 159.2 | -11.9 | 173 | 161.3 | 157.7 | 0 | 0 | 111.6 | ||||
| 32 | Q | 27.8 | Very low | 32.5 | Very low | 173 Ų | 173 | 143 Ų | 143 | 81% | 0.808 | 78% | 0.777 | S | S | * | * | trans | -80.1 | 180 | 177.2 | -96.9 | -170.1 | 17 | 0 | 0 | 113.7 | ||||
| 33 | P | 43.9 | Very low | 32.5 | Very low | 120 Ų | 120 | 139.3 Ų | 139.3 | 78% | 0.779 | 78% | 0.776 | S | S | * | * | cis | -140.9 | 178.4 | 17.5 | 43 | -24.2 | 0 | 0 | 0 | 118.7 | ||||
| 34 | G | 28.3 | Very low | 32.1 | Very low | 77 Ų | 77 | 139.8 Ų | 139.8 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | trans | 179.9 | 138.6 | 165.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 35 | M | 31.5 | Very low | 32.2 | Very low | 160 Ų | 160 | 138.2 Ų | 138.2 | 79% | 0.788 | 79% | 0.786 | S | S | * | * | trans | -95 | 164.2 | -179.1 | -75.3 | -160.3 | -45.3 | 0 | 0 | 111.9 | ||||
| 36 | V | 29.1 | Very low | 32.1 | Very low | 135 Ų | 135 | 135 Ų | 135 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | -146.4 | 148.6 | 50.9 | 176.9 | 0 | 0 | 0 | 0 | 115 | |||||
| 37 | K | 32.8 | Very low | 32.2 | Very low | 174 Ų | 174 | 135.2 Ų | 135.2 | 76% | 0.757 | 78% | 0.783 | S | S | * | * | trans | -56.1 | 169.7 | -180 | -56.2 | 166.3 | 177.7 | 176.4 | 0 | 115 | ||||
| 38 | S | 28.5 | Very low | 30.6 | Very low | 111 Ų | 111 | 138.5 Ų | 138.5 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | cis | -155.6 | -176.6 | 8.5 | -141.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 39 | S | 28.6 | Very low | 29.7 | Very low | 100 Ų | 100 | 141.8 Ų | 141.8 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | cis | -156.8 | 167.7 | 2.1 | -157.7 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 40 | L | 28.8 | Very low | 29.7 | Very low | 152 Ų | 152 | 140 Ų | 140 | 80% | 0.796 | 80% | 0.796 | S | S | * | * | cis | 69.3 | 128.5 | 30.6 | -105.3 | 73.3 | 0 | 0 | 0 | 115.3 | ||||
| 41 | V | 29.2 | Very low | 30.7 | Very low | 128 Ų | 128 | 136.2 Ų | 136.2 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | cis | -141.4 | 165.5 | 17.1 | -178.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 42 | H | 30.5 | Very low | 30.9 | Very low | 187 Ų | 187 | 136.8 Ų | 136.8 | 87% | 0.866 | 79% | 0.794 | S | S | * | * | trans | -115.5 | 120.1 | 175 | 177.5 | -108.3 | 0 | 0 | 0 | 111.1 | ||||
| 43 | A | 29.1 | Very low | 30.9 | Very low | 93 Ų | 93 | 132.3 Ų | 132.3 | 77% | 0.769 | 79% | 0.794 | S | S | * | * | trans | -163 | 165.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 44 | S | 29.6 | Very low | 30 | Very low | 117 Ų | 117 | 137.3 Ų | 137.3 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -135.8 | -178.5 | -178.1 | -55.9 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 45 | V | 30.1 | Very low | 30.2 | Very low | 137 Ų | 137 | 140.2 Ų | 140.2 | 83% | 0.83 | 80% | 0.796 | S | S | * | * | trans | 106.9 | 111.9 | 160.6 | -177.1 | 0 | 0 | 0 | 0 | 118 | ||||
| 46 | A | 29.2 | Very low | 30.8 | Very low | 84 Ų | 84 | 136.7 Ų | 136.7 | 69% | 0.694 | 79% | 0.785 | S | S | * | * | trans | 57.9 | 167.7 | 148.5 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 47 | T | 29.1 | Very low | 30.8 | Very low | 132 Ų | 132 | 141.5 Ų | 141.5 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | cis | -156.6 | -177.3 | 9 | -25.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 48 | M | 26.9 | Very low | 30.6 | Very low | 184 Ų | 184 | 138.1 Ų | 138.1 | 91% | 0.906 | 79% | 0.793 | S | S | * | * | trans | 99.3 | 159.3 | 155.5 | -76.5 | -171.3 | 168.7 | 0 | 0 | 121.4 | ||||
| 49 | Q | 30.1 | Very low | 30.8 | Very low | 171 Ų | 171 | 141.3 Ų | 141.3 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | trans | -123.8 | 141.4 | -153.4 | -102.9 | 140.6 | -66.9 | 0 | 0 | 113.6 | ||||
| 50 | N | 29.3 | Very low | 30.8 | Very low | 152 Ų | 152 | 140.2 Ų | 140.2 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | trans | 56.7 | 178.8 | 141.2 | -85.5 | -10.8 | 0 | 0 | 0 | 119.1 | ||||
| 51 | P | 47.6 | Very low | 30.8 | Very low | 106 Ų | 106 | 142.6 Ų | 142.6 | 69% | 0.688 | 81% | 0.813 | S | S | * | * | cis | -130.9 | 170.2 | -2.8 | 23.9 | 0.2 | 0 | 0 | 0 | 117.6 | ||||
| 52 | M | 28.7 | Very low | 30.9 | Very low | 180 Ų | 180 | 142.9 Ų | 142.9 | 89% | 0.887 | 82% | 0.819 | S | S | * | * | trans | 65.3 | 133.3 | 145.6 | -71.2 | -77.3 | -81.5 | 0 | 0 | 122.1 | ||||
| 53 | G | 27 | Very low | 31 | Very low | 78 Ų | 78 | 138.9 Ų | 138.9 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | -179.5 | 98 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 54 | Y | 26.3 | Very low | 31.1 | Very low | 226 Ų | 226 | 142.4 Ų | 142.4 | 89% | 0.886 | 82% | 0.823 | S | S | * | * | trans | -53.7 | 157.1 | -165.6 | -143 | -113.7 | 0 | 0 | 0 | 119.6 | ||||
| 55 | D | 31.4 | Very low | 31.2 | Very low | 137 Ų | 137 | 142.2 Ų | 142.2 | 73% | 0.733 | 82% | 0.819 | S | S | * | * | trans | -81 | -171.9 | 173.3 | -152.7 | 37 | 0 | 0 | 0 | 110.4 | ||||
| 56 | P | 45.3 | Very low | 31.3 | Very low | 86 Ų | 86 | 147.3 Ų | 147.3 | 56% | 0.558 | 82% | 0.823 | S | S | * | * | cis | -149.6 | -178.9 | 9.5 | 47.8 | -27.1 | 0 | 0 | 0 | 120.6 | ||||
| 57 | R | 28.9 | Very low | 31.3 | Very low | 236 Ų | 236 | 150.9 Ų | 150.9 | 89% | 0.891 | 83% | 0.83 | S | S | * | * | trans | 75.1 | 113 | 157.6 | -60.1 | 175.7 | -170.9 | 178.3 | 3 | 120.7 | ||||
| 58 | A | 28.5 | Very low | 31.3 | Very low | 103 Ų | 103 | 149.9 Ų | 149.9 | 85% | 0.851 | 83% | 0.829 | S | S | * | * | -164.1 | 151.5 | 124.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 59 | N | 31.7 | Very low | 31.6 | Very low | 178 Ų | 178 | 148.7 Ų | 148.7 | 95% | 0.952 | 82% | 0.824 | S | S | * | * | trans | -85.4 | 149.9 | -179.5 | -65.4 | -31.4 | 0 | 0 | 0 | 112.6 | ||||
| 60 | G | 29.6 | Very low | 31.6 | Very low | 78 Ų | 78 | 145.5 Ų | 145.5 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | trans | 173.4 | 79.1 | 169.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 61 | H | 28.8 | Very low | 31.9 | Very low | 201 Ų | 201 | 143.2 Ų | 143.2 | 93% | 0.931 | 82% | 0.817 | S | S | * | * | trans | -82.2 | 129.4 | 165 | -80.6 | -15.9 | 0 | 0 | 0 | 111.2 | ||||
| 62 | C | 31 | Very low | 31.2 | Very low | 135 Ų | 135 | 149.8 Ų | 149.8 | 91% | 0.912 | 83% | 0.828 | S | S | * | * | trans | -153.1 | 101.9 | 162.4 | -128.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 63 | A | 32.8 | Very low | 31.3 | Very low | 103 Ų | 103 | 146.1 Ų | 146.1 | 85% | 0.851 | 82% | 0.82 | S | S | * | * | trans | -96.9 | 127 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 64 | L | 30.4 | Very low | 31.6 | Very low | 167 Ų | 167 | 147.4 Ų | 147.4 | 87% | 0.874 | 82% | 0.823 | S | S | * | * | trans | -76.7 | 130.2 | 175.3 | -76.1 | 163.1 | 0 | 0 | 0 | 111.1 | R66 | L64-R66 PolarHBondContact O-N 3.11Å; L64-R66 VanDerWaalsContact O-N 3.16Å | ||
| 65 | P | 32.1 | Very low | 32.1 | Very low | 112 Ų | 112 | 142 Ų | 142 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | trans | -76.5 | 103.6 | -178.4 | 29.6 | -34.1 | 0 | 0 | 0 | 112.2 | L67 | P65-L67 PolarHBondContact O-N 3.34Å; P65-L67 VanDerWaalsContact O-N 3.14Å | ||
| 66 | R | 32 | Very low | 32.3 | Very low | 244 Ų | 244 | 144.2 Ų | 144.2 | 92% | 0.921 | 83% | 0.827 | S | S | * | * | trans | -74.6 | 94.1 | 167.1 | -86.1 | -172.2 | 168.3 | -171.6 | -1.8 | 110.9 | L64 S68 | L64-R66 PolarHBondContact O-N 3.11Å; L64-R66 VanDerWaalsContact O-N 3.16Å; R66-S68 PolarHBondContact O-N 3.16Å | ||
| 67 | L | 30.3 | Very low | 31.9 | Very low | 159 Ų | 159 | 146.3 Ų | 146.3 | 83% | 0.832 | 84% | 0.838 | S | S | * | * | trans | -81.2 | 89.2 | 168.8 | -78.1 | 167.8 | 0 | 0 | 0 | 111.2 | P65 | P65-L67 PolarHBondContact O-N 3.34Å; P65-L67 VanDerWaalsContact O-N 3.14Å | ||
| 68 | S | 28.7 | Very low | 32.2 | Very low | 112 Ų | 112 | 140 Ų | 140 | 78% | 0.783 | 84% | 0.835 | S | S | * | * | trans | -88 | 100 | 169.8 | 55.3 | 0 | 0 | 0 | 0 | 111 | R66 S70 | R66-S68 PolarHBondContact O-N 3.16Å; S68-S70 PolarHBondContact O-N 3.44Å | ||
| 69 | I | 33 | Very low | 32.3 | Very low | 159 Ų | 159 | 140.6 Ų | 140.6 | 82% | 0.815 | 83% | 0.834 | S | S | * | * | trans | -85.9 | 103.9 | 172.2 | -60.5 | 177.6 | 0 | 0 | 0 | 108.4 | S71 | I69-S71 PolarHBondContact O-N 2.87Š| ||
| 70 | S | 29.7 | Very low | 32.9 | Very low | 104 Ų | 104 | 139.5 Ų | 139.5 | 73% | 0.727 | 83% | 0.827 | S | S | * | * | trans | -77.4 | 116.2 | 176.3 | -176.8 | 0 | 0 | 0 | 0 | 110.9 | S68 R72 | S68-S70 PolarHBondContact O-N 3.44Å; S70-R72 PolarHBondContact O-N 3.41Å | ||
| 71 | S | 35 | Very low | 33 | Very low | 104 Ų | 104 | 142.8 Ų | 142.8 | 73% | 0.727 | 83% | 0.826 | S | S | * | * | trans | -76.7 | 101.2 | 173.2 | 52.1 | 0 | 0 | 0 | 0 | 110.4 | I69 S73 | I69-S71 PolarHBondContact O-N 2.87Å; S71-S73 PolarHBondContact O-N 2.92Å | ||
| 72 | R | 34.1 | Very low | 33.2 | Very low | 243 Ų | 243 | 137.4 Ų | 137.4 | 92% | 0.917 | 82% | 0.816 | S | S | * | * | trans | -74 | 87.8 | 171.1 | -75.5 | -170 | 173.8 | -157.5 | -1.3 | 111.2 | S70 | S70-R72 PolarHBondContact O-N 3.41Š| ||
| 73 | S | 31 | Very low | 33.2 | Very low | 103 Ų | 103 | 136.3 Ų | 136.3 | 72% | 0.72 | 81% | 0.81 | S | S | * | * | trans | -73.4 | 133.9 | 158.8 | -58.4 | 0 | 0 | 0 | 0 | 109.3 | S71 S75 | S71-S73 PolarHBondContact O-N 2.92Å; S73-S75 PolarHBondContact O-N 3.27Å; S73-S75 VanDerWaalsContact O-N 3.07Å | ||
| 74 | A | 33 | Very low | 33.7 | Very low | 106 Ų | 106 | 137 Ų | 137 | 88% | 0.876 | 80% | 0.804 | S | S | * | * | trans | -80.7 | 87.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 75 | S | 36.3 | Very low | 34.1 | Very low | 111 Ų | 111 | 136.4 Ų | 136.4 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | trans | -82.9 | 128.6 | 166.8 | -174 | 0 | 0 | 0 | 0 | 110.3 | S73 V77 | S73-S75 PolarHBondContact O-N 3.27Å; S73-S75 VanDerWaalsContact O-N 3.07Å; S75-V77 PolarHBondContact O-N 3.16Å | ||
| 76 | M | 36.6 | Very low | 34.5 | Very low | 185 Ų | 185 | 134 Ų | 134 | 91% | 0.911 | 80% | 0.798 | S | S | * | * | trans | -89.6 | 92 | 177.8 | -66.9 | -158.4 | -55.9 | 0 | 0 | 111.7 | ||||
| 77 | V | 36 | Very low | 34.7 | Very low | 130 Ų | 130 | 127 Ų | 127 | 79% | 0.788 | 79% | 0.786 | S | S | * | * | trans | -133.6 | 103.8 | 152.5 | -176.6 | 0 | 0 | 0 | 0 | 107.4 | S75 S79 | S75-V77 PolarHBondContact O-N 3.16Å; V77-S79 PolarHBondContact O-N 3.15Å | ||
| 78 | A | 35.7 | Very low | 35 | Very low | 102 Ų | 102 | 126.5 Ų | 126.5 | 84% | 0.843 | 78% | 0.783 | S | S | * | * | trans | -81.1 | 105.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | L80 | A78-L80 PolarHBondContact O-N 3.27Š| ||
| 79 | S | 31.1 | Very low | 35.6 | Very low | 117 Ų | 117 | 125.9 Ų | 125.9 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -68.3 | 124.9 | 159.9 | -167.3 | 0 | 0 | 0 | 0 | 107.8 | V77 D81 | V77-S79 PolarHBondContact O-N 3.15Å; S79-D81 PolarHBondContact O-N 3.27Å | ||
| 80 | L | 42.7 | Very low | 36.1 | Very low | 154 Ų | 154 | 122.8 Ų | 122.8 | 81% | 0.806 | 78% | 0.782 | S | S | * | * | trans | -70.3 | 111.1 | 170.5 | -179.3 | 70.6 | 0 | 0 | 0 | 108.3 | A78 | A78-L80 PolarHBondContact O-N 3.27Š| ||
| 81 | D | 32.7 | Very low | 36.7 | Very low | 147 Ų | 147 | 125.2 Ų | 125.2 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | trans | 179.7 | 159.1 | 131.5 | -100.2 | -27.5 | 0 | 0 | 0 | 114.3 | S79 | S79-D81 PolarHBondContact O-N 3.27Š| ||
| 82 | A | 32.3 | Very low | 37 | Very low | 88 Ų | 88 | 128 Ų | 128 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | trans | 70.4 | 139.2 | 163.8 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 83 | S | 30.9 | Very low | 37.9 | Very low | 113 Ų | 113 | 122.4 Ų | 122.4 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | trans | 66.9 | 104.3 | 165.1 | 57.7 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 84 | T | 44.7 | Very low | 39 | Very low | 118 Ų | 118 | 122.6 Ų | 122.6 | 72% | 0.724 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -67.3 | 178.2 | 170.7 | -20.3 | 0 | 0 | 0 | 0 | 112.7 | G86 | T84-G86 VanDerWaalsContact C-N 3.27Å; T84-G86 PolarHBondContact O-N 2.96Å |
| 85 | D | 37.4 | Very low | 40.6 | Very low | 153 Ų | 153 | 122.7 Ų | 122.7 | 82% | 0.818 | 77% | 0.767 | S | S | * | * | S | Bend | trans | 69.7 | -18.8 | 163.5 | -54.5 | -15.5 | 0 | 0 | 0 | 119.1 | ||
| 86 | G | 42 | Very low | 42.8 | Very low | 63 Ų | 63 | 125.6 Ų | 125.6 | 65% | 0.649 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -83.6 | -44.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | T84 | T84-G86 VanDerWaalsContact C-N 3.27Å; T84-G86 PolarHBondContact O-N 2.96Å |
| 87 | S | 35.5 | Very low | 45.1 | Very low | 95 Ų | 95 | 125.9 Ų | 125.9 | 66% | 0.664 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -95.2 | -12.4 | -154 | -61.4 | 0 | 0 | 0 | 0 | 116.7 | A89 A90 | S87-A89 VanDerWaalsContact C-N 3.27Å; S87-A89 PolarHBondContact O-N 3.14Å; S87-A90 PolarHBondContact O-N 3.07Å |
| 88 | I | 37.4 | Very low | 47.4 | Very low | 149 Ų | 149 | 128.4 Ų | 128.4 | 76% | 0.764 | 76% | 0.757 | S | S | * | * | G | 310 helix | trans | -67.7 | -26.7 | -171.4 | -63.2 | 178.5 | 0 | 0 | 0 | 112.4 | A90 | I88-A90 VanDerWaalsContact C-N 3.25Å; I88-A90 PolarHBondContact O-N 3.3Å |
| 89 | A | 40.7 | Very low | 49.7 | Very low | 99 Ų | 99 | 125.6 Ų | 125.6 | 82% | 0.818 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -67.4 | -18.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | S87 | S87-A89 VanDerWaalsContact C-N 3.27Å; S87-A89 PolarHBondContact O-N 3.14Å |
| 90 | A | 44 | Very low | 52.3 | Low | 94 Ų | 94 | 122.6 Ų | 122.6 | 78% | 0.777 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -87.8 | -19.1 | -171.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | S87 I88 | S87-A90 PolarHBondContact O-N 3.07Å; I88-A90 VanDerWaalsContact C-N 3.25Å; I88-A90 PolarHBondContact O-N 3.3Å |
| 91 | L | 41.2 | Very low | 54.6 | Low | 155 Ų | 155 | 118.7 Ų | 118.7 | 81% | 0.812 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -102.6 | -6.1 | -164 | -112.3 | 165 | 0 | 0 | 0 | 115.6 | ||
| 92 | Q | 42.8 | Very low | 57.1 | Low | 162 Ų | 162 | 114.4 Ų | 114.4 | 76% | 0.757 | 67% | 0.669 | S | S | * | * | trans | -135.8 | 70.4 | -178.2 | -74.1 | -166 | -6.8 | 0 | 0 | 113.8 | V94 | Q92-V94 HydrophobicContact CB-CG2 4.14Å; Q92-V94 HydrophobicContact CG-CG2 4.45Å; Q92-V94 PolarHBondContact O-N 3.37Å | ||
| 93 | S | 51.5 | Low | 59.8 | Low | 126 Ų | 126 | 113.7 Ų | 113.7 | 88% | 0.881 | 66% | 0.655 | S | S | * | * | trans | -75.6 | 53.4 | 160.1 | -169 | 0 | 0 | 0 | 0 | 111.2 | M95 | S93-M95 PolarHBondContact O-N 3.36Š| ||
| 94 | V | 55.2 | Low | 62.7 | Low | 108 Ų | 108 | 114.4 Ų | 114.4 | 66% | 0.655 | 64% | 0.644 | S | S | * | * | trans | -64.2 | 121.2 | 176.2 | 177.4 | 0 | 0 | 0 | 0 | 108 | Q92 K96 | Q92-V94 HydrophobicContact CB-CG2 4.14Å; Q92-V94 HydrophobicContact CG-CG2 4.45Å; Q92-V94 PolarHBondContact O-N 3.37Å; V94-K96 PolarHBondContact O-N 3.36Å | ||
| 95 | M | 65.2 | Low | 65 | Low | 108 Ų | 108 | 112.7 Ų | 112.7 | 53% | 0.532 | 63% | 0.634 | S | S | . | * | trans | -56.7 | 115.5 | 175.3 | -79.1 | 177.4 | 58.1 | 0 | 0 | 109 | S93 W97 T99 V100 V103 | S93-M95 PolarHBondContact O-N 3.36Å; M95-W97 PolarHBondContact O-N 2.9Å; M95-T99 HydrophobicContact CE-CG2 3.91Å; M95-V100 HydrophobicContact CB-CG2 3.67Å; M95-V100 HydrophobicContact CE-CG2 4.36Å; M95-V100 WeakPolarHBondContact O-CG2 3.35Å; M95-V103 HydrophobicContact CE-CG2 4.35Å | ||
| 96 | K | 83.8 | Confident | 67.6 | Low | 171 Ų | 171 | 110 Ų | 110 | 74% | 0.743 | 62% | 0.623 | S | S | * | * | trans | -45.6 | 128 | 177.5 | -62.2 | -178.7 | -179 | -179.5 | 0 | 109.1 | V94 K98 T99 V100 | V94-K96 PolarHBondContact O-N 3.36Å; K96-K98 PolarHBondContact O-N 3.13Å; K96-T99 WeakPolarHBondContact O-CA 3.29Å; K96-T99 VanDerWaalsContact O-CB 3.32Å; K96-T99 WeakPolarHBondContact O-CB 3.33Å; K96-T99 PolarHBondContact O-N 3.17Å; K96-T99 PolarHBondContact O-OG1 2.77Å; K96-V100 PolarHBondContact O-N 3.42Å | ||
| 97 | W | 84 | Confident | 70 | Confident | 191 Ų | 191 | 110.6 Ų | 110.6 | 72% | 0.723 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -45.4 | -40.6 | -172.8 | -176.3 | -94.1 | 0 | 0 | 0 | 113.8 | M95 T99 V100 M101 | M95-W97 PolarHBondContact O-N 2.9Å; W97-T99 VanDerWaalsContact C-N 3.26Å; W97-T99 PolarHBondContact O-N 3.1Å; W97-V100 WeakPolarHBondContact O-CB 3.46Å; W97-V100 PolarHBondContact O-N 2.97Å; W97-M101 HydrophobicContact CD2-CE 4.37Å; W97-M101 HydrophobicContact CG-CG 4.36Å; W97-M101 HydrophobicContact CH2-CE 4.17Å; W97-M101 HydrophobicContact CZ2-CE 3.65Å; W97-M101 HydrophobicContact CZ2-SD 4.04Å; W97-M101 WeakPolarHBondContact O-CG 3.48Å; W97-M101 PolarHBondContact O-N 2.7Å |
| 98 | K | 84.6 | Confident | 73 | Confident | 184 Ų | 184 | 108.9 Ų | 108.9 | 80% | 0.8 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -56.7 | -33.9 | 175.7 | -62.2 | -178 | 177.7 | -179.5 | 0 | 113.9 | K96 A102 | K96-K98 PolarHBondContact O-N 3.13Å; K98-A102 WeakPolarHBondContact O-CB 3.4Å; K98-A102 PolarHBondContact O-N 2.94Å; K98-A102 VanDerWaalsContact O-N 3.16Å |
| 99 | T | 83.4 | Confident | 75.8 | Confident | 42 Ų | 42 | 107.1 Ų | 107.1 | 26% | 0.258 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -75.9 | -38.5 | 174 | -46.4 | 0 | 0 | 0 | 0 | 111.6 | M95 K96 W97 A102 V103 | M95-T99 HydrophobicContact CE-CG2 3.91Å; K96-T99 WeakPolarHBondContact O-CA 3.29Å; K96-T99 VanDerWaalsContact O-CB 3.32Å; K96-T99 WeakPolarHBondContact O-CB 3.33Å; K96-T99 PolarHBondContact O-N 3.17Å; K96-T99 PolarHBondContact O-OG1 2.77Å; W97-T99 VanDerWaalsContact C-N 3.26Å; W97-T99 PolarHBondContact O-N 3.1Å; T99-A102 PolarHBondContact O-N 3.49Å; T99-V103 WeakPolarHBondContact O-CG2 3.28Å; T99-V103 PolarHBondContact O-N 3.35Å |
| 100 | V | 87.3 | Confident | 78.4 | Confident | 55 Ų | 55 | 111.1 Ų | 111.1 | 33% | 0.333 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -62.9 | -47.4 | 175.9 | -177.8 | 0 | 0 | 0 | 0 | 110.1 | M95 K96 W97 A102 V103 F104 | M95-V100 HydrophobicContact CB-CG2 3.67Å; M95-V100 HydrophobicContact CE-CG2 4.36Å; M95-V100 WeakPolarHBondContact O-CG2 3.35Å; K96-V100 PolarHBondContact O-N 3.42Å; W97-V100 WeakPolarHBondContact O-CB 3.46Å; W97-V100 PolarHBondContact O-N 2.97Å; V100-A102 VanDerWaalsContact C-N 3.34Å; V100-A102 PolarHBondContact O-N 3.41Å; V100-V103 PolarHBondContact O-N 3.31Å; V100-F104 WeakPolarHBondContact O-CB 3.5Å; V100-F104 PolarHBondContact O-N 3.28Å |
| 101 | M | 89.6 | Confident | 81 | Confident | 72 Ų | 72 | 112 Ų | 112 | 36% | 0.355 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -60 | -40.4 | 174.5 | -63.6 | -66.2 | 98.9 | 0 | 0 | 112.4 | W97 F104 V105 | W97-M101 HydrophobicContact CD2-CE 4.37Å; W97-M101 HydrophobicContact CG-CG 4.36Å; W97-M101 HydrophobicContact CH2-CE 4.17Å; W97-M101 HydrophobicContact CZ2-CE 3.65Å; W97-M101 HydrophobicContact CZ2-SD 4.04Å; W97-M101 WeakPolarHBondContact O-CG 3.48Å; W97-M101 PolarHBondContact O-N 2.7Å; M101-F104 PolarHBondContact O-N 3.43Å; M101-V105 WeakPolarHBondContact O-CG2 3.31Å; M101-V105 PolarHBondContact O-N 3.35Å |
| 102 | A | 86.5 | Confident | 83.7 | Confident | 56 Ų | 56 | 108.3 Ų | 108.3 | 46% | 0.463 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.1 | -42 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | K98 T99 V100 V105 V106 | K98-A102 WeakPolarHBondContact O-CB 3.4Å; K98-A102 PolarHBondContact O-N 2.94Å; K98-A102 VanDerWaalsContact O-N 3.16Å; T99-A102 PolarHBondContact O-N 3.49Å; V100-A102 VanDerWaalsContact C-N 3.34Å; V100-A102 PolarHBondContact O-N 3.41Å; A102-V105 PolarHBondContact O-N 3.14Å; A102-V106 WeakPolarHBondContact O-CG2 3.44Å; A102-V106 PolarHBondContact O-N 2.99Å |
| 103 | V | 87.6 | Confident | 86.3 | Confident | 74 Ų | 74 | 103.4 Ų | 103.4 | 45% | 0.448 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66 | -41.4 | 174.6 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | M95 T99 V100 V105 V106 V107 | M95-V103 HydrophobicContact CE-CG2 4.35Å; T99-V103 WeakPolarHBondContact O-CG2 3.28Å; T99-V103 PolarHBondContact O-N 3.35Å; V100-V103 PolarHBondContact O-N 3.31Å; V103-V105 PolarHBondContact O-N 3Å; V103-V106 PolarHBondContact O-N 3.02Å; V103-V107 HydrophobicContact CG1-CG2 4.41Å; V103-V107 WeakPolarHBondContact O-CG2 3.49Å; V103-V107 PolarHBondContact O-N 3.16Å |
| 104 | F | 91.7 | Very high | 88.5 | Confident | 127 Ų | 127 | 98.5 Ų | 98.5 | 56% | 0.557 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -58.2 | -45.8 | 175.7 | 177.1 | -101 | 0 | 0 | 0 | 112.2 | V100 M101 V106 V107 V108 | V100-F104 WeakPolarHBondContact O-CB 3.5Å; V100-F104 PolarHBondContact O-N 3.28Å; M101-F104 PolarHBondContact O-N 3.43Å; F104-V106 VanDerWaalsContact C-N 3.33Å; F104-V106 PolarHBondContact O-N 2.81Å; F104-V107 PolarHBondContact O-N 3.06Å; F104-V108 HydrophobicContact CD1-CG2 4.25Å; F104-V108 HydrophobicContact CD2-CG2 4.44Å; F104-V108 HydrophobicContact CE1-CG2 3.82Å; F104-V108 HydrophobicContact CE2-CG2 4.03Å; F104-V108 HydrophobicContact CZ-CG2 3.7Å; F104-V108 WeakPolarHBondContact O-CG2 3.35Å; F104-V108 PolarHBondContact O-N 3.33Å |
| 105 | V | 94.1 | Very high | 90.5 | Very high | 82 Ų | 82 | 96.4 Ų | 96.4 | 50% | 0.497 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.1 | -40.7 | 175.6 | 170.9 | 0 | 0 | 0 | 0 | 111.8 | M101 A102 V103 V108 L109 | M101-V105 WeakPolarHBondContact O-CG2 3.31Å; M101-V105 PolarHBondContact O-N 3.35Å; A102-V105 PolarHBondContact O-N 3.14Å; V103-V105 PolarHBondContact O-N 3Å; V105-V108 PolarHBondContact O-N 3.38Å; V105-L109 HydrophobicContact CG1-CD1 4.01Å; V105-L109 HydrophobicContact CG1-CG 4.47Å; V105-L109 WeakPolarHBondContact O-CB 3.5Å; V105-L109 VanDerWaalsContact O-CG 3.31Å; V105-L109 WeakPolarHBondContact O-CG 3.2Å; V105-L109 PolarHBondContact O-N 3.01Å |
| 106 | V | 91.3 | Very high | 92.1 | Very high | 98 Ų | 98 | 96.6 Ų | 96.6 | 59% | 0.594 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.9 | -40.8 | 175.4 | 172.2 | 0 | 0 | 0 | 0 | 111.6 | A102 V103 F104 L109 Y110 | A102-V106 WeakPolarHBondContact O-CG2 3.44Å; A102-V106 PolarHBondContact O-N 2.99Å; V103-V106 PolarHBondContact O-N 3.02Å; F104-V106 VanDerWaalsContact C-N 3.33Å; F104-V106 PolarHBondContact O-N 2.81Å; V106-L109 PolarHBondContact O-N 3.43Å; V106-Y110 WeakPolarHBondContact O-CB 3.26Å; V106-Y110 PolarHBondContact O-N 2.84Å |
| 107 | V | 93.5 | Very high | 92.8 | Very high | 74 Ų | 74 | 90.8 Ų | 90.8 | 45% | 0.448 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.5 | -43 | 175.8 | 171.9 | 0 | 0 | 0 | 0 | 111.4 | V103 F104 L109 Y110 L111 | V103-V107 HydrophobicContact CG1-CG2 4.41Å; V103-V107 WeakPolarHBondContact O-CG2 3.49Å; V103-V107 PolarHBondContact O-N 3.16Å; F104-V107 PolarHBondContact O-N 3.06Å; V107-L109 PolarHBondContact O-N 3.27Å; V107-Y110 PolarHBondContact O-N 3.36Å; V107-L111 HydrophobicContact CG1-CD1 4.04Å; V107-L111 HydrophobicContact CG1-CG 4.41Å; V107-L111 WeakPolarHBondContact O-CG 3.5Å; V107-L111 PolarHBondContact O-N 2.99Å |
| 108 | V | 96.8 | Very high | 93.4 | Very high | 59 Ų | 59 | 88.3 Ų | 88.3 | 36% | 0.358 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.1 | -43.3 | 176.2 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | F104 V105 Y110 L111 V112 | F104-V108 HydrophobicContact CD1-CG2 4.25Å; F104-V108 HydrophobicContact CD2-CG2 4.44Å; F104-V108 HydrophobicContact CE1-CG2 3.82Å; F104-V108 HydrophobicContact CE2-CG2 4.03Å; F104-V108 HydrophobicContact CZ-CG2 3.7Å; F104-V108 WeakPolarHBondContact O-CG2 3.35Å; F104-V108 PolarHBondContact O-N 3.33Å; V105-V108 PolarHBondContact O-N 3.38Å; V108-Y110 VanDerWaalsContact C-N 3.35Å; V108-Y110 PolarHBondContact O-N 2.98Å; V108-L111 PolarHBondContact O-N 2.68Å; V108-V112 WeakPolarHBondContact O-CG2 3.32Å; V108-V112 PolarHBondContact O-N 2.77Å |
| 109 | L | 96.4 | Very high | 94 | Very high | 113 Ų | 113 | 85.7 Ų | 85.7 | 59% | 0.592 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63.5 | -39.6 | 175.6 | -71.6 | 169.9 | 0 | 0 | 0 | 112.2 | V105 V106 V107 V112 A113 | V105-L109 HydrophobicContact CG1-CD1 4.01Å; V105-L109 HydrophobicContact CG1-CG 4.47Å; V105-L109 WeakPolarHBondContact O-CB 3.5Å; V105-L109 VanDerWaalsContact O-CG 3.31Å; V105-L109 WeakPolarHBondContact O-CG 3.2Å; V105-L109 PolarHBondContact O-N 3.01Å; V106-L109 PolarHBondContact O-N 3.43Å; V107-L109 PolarHBondContact O-N 3.27Å; L109-V112 PolarHBondContact O-N 3.01Å; L109-A113 WeakPolarHBondContact O-CB 3.34Å; L109-A113 PolarHBondContact O-N 2.8Å |
| 110 | Y | 96.2 | Very high | 94.7 | Very high | 182 Ų | 182 | 87.2 Ų | 87.2 | 71% | 0.714 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.3 | -43.4 | 174.4 | -179.7 | -97.8 | 0 | 0 | 0 | 112.1 | V106 V107 V108 A113 G114 | V106-Y110 WeakPolarHBondContact O-CB 3.26Å; V106-Y110 PolarHBondContact O-N 2.84Å; V107-Y110 PolarHBondContact O-N 3.36Å; V108-Y110 VanDerWaalsContact C-N 3.35Å; V108-Y110 PolarHBondContact O-N 2.98Å; Y110-A113 PolarHBondContact O-N 3.12Å; Y110-G114 PolarHBondContact O-N 2.83Å |
| 111 | L | 97.8 | Very high | 95.2 | Very high | 112 Ų | 112 | 90.3 Ų | 90.3 | 59% | 0.586 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.7 | -40.7 | 176.1 | -70.9 | 171.3 | 0 | 0 | 0 | 112.3 | V107 V108 G114 A115 | V107-L111 HydrophobicContact CG1-CD1 4.04Å; V107-L111 HydrophobicContact CG1-CG 4.41Å; V107-L111 WeakPolarHBondContact O-CG 3.5Å; V107-L111 PolarHBondContact O-N 2.99Å; V108-L111 PolarHBondContact O-N 2.68Å; L111-G114 PolarHBondContact O-N 3.31Å; L111-A115 VanDerWaalsContact O-CB 3.29Å; L111-A115 WeakPolarHBondContact O-CB 3.31Å; L111-A115 PolarHBondContact O-N 2.86Å |
| 112 | V | 98.1 | Very high | 95.5 | Very high | 79 Ų | 79 | 91.6 Ų | 91.6 | 48% | 0.479 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.2 | -43.7 | 175.5 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | V108 L109 A115 L116 | V108-V112 WeakPolarHBondContact O-CG2 3.32Å; V108-V112 PolarHBondContact O-N 2.77Å; L109-V112 PolarHBondContact O-N 3.01Å; V112-A115 PolarHBondContact O-N 2.65Å; V112-L116 HydrophobicContact CG1-CD1 4.13Å; V112-L116 WeakPolarHBondContact O-CG 3.44Å; V112-L116 PolarHBondContact O-N 3.13Å |
| 113 | A | 97.7 | Very high | 96 | Very high | 59 Ų | 59 | 93.7 Ų | 93.7 | 49% | 0.488 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L109 Y110 L116 A117 | L109-A113 WeakPolarHBondContact O-CB 3.34Å; L109-A113 PolarHBondContact O-N 2.8Å; Y110-A113 PolarHBondContact O-N 3.12Å; A113-L116 PolarHBondContact O-N 3.25Å; A113-A117 WeakPolarHBondContact O-CB 3.42Å; A113-A117 PolarHBondContact O-N 2.96Å |
| 114 | G | 97.7 | Very high | 96.5 | Very high | 23 Ų | 23 | 93.5 Ų | 93.5 | 24% | 0.237 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -62 | -45.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y110 L111 L116 A117 F118 | Y110-G114 PolarHBondContact O-N 2.83Å; L111-G114 PolarHBondContact O-N 3.31Å; G114-L116 VanDerWaalsContact C-N 3.35Å; G114-L116 PolarHBondContact O-N 2.91Å; G114-A117 PolarHBondContact O-N 3.49Å; G114-F118 VanDerWaalsContact O-CD2 3.26Å; G114-F118 WeakPolarHBondContact O-CD2 3.38Å; G114-F118 PolarHBondContact O-N 2.77Å |
| 115 | A | 97.6 | Very high | 96.7 | Very high | 63 Ų | 63 | 93.5 Ų | 93.5 | 52% | 0.521 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.1 | -38.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L111 V112 K119 | L111-A115 VanDerWaalsContact O-CB 3.29Å; L111-A115 WeakPolarHBondContact O-CB 3.31Å; L111-A115 PolarHBondContact O-N 2.86Å; V112-A115 PolarHBondContact O-N 2.65Å; A115-K119 WeakPolarHBondContact O-CB 3.22Å; A115-K119 PolarHBondContact O-N 3.39Å |
| 116 | L | 98.2 | Very high | 96.8 | Very high | 112 Ų | 112 | 94.1 Ų | 94.1 | 59% | 0.586 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -66.9 | -40.4 | 173.8 | -70.6 | 171.9 | 0 | 0 | 0 | 112 | V112 A113 G114 A120 | V112-L116 HydrophobicContact CG1-CD1 4.13Å; V112-L116 WeakPolarHBondContact O-CG 3.44Å; V112-L116 PolarHBondContact O-N 3.13Å; A113-L116 PolarHBondContact O-N 3.25Å; G114-L116 VanDerWaalsContact C-N 3.35Å; G114-L116 PolarHBondContact O-N 2.91Å; L116-A120 WeakPolarHBondContact O-CB 3.46Å; L116-A120 PolarHBondContact O-N 3.17Å |
| 117 | A | 97.9 | Very high | 97 | Very high | 49 Ų | 49 | 92.3 Ų | 92.3 | 41% | 0.405 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.1 | -51.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | A113 G114 K119 A120 L121 | A113-A117 WeakPolarHBondContact O-CB 3.42Å; A113-A117 PolarHBondContact O-N 2.96Å; G114-A117 PolarHBondContact O-N 3.49Å; A117-K119 VanDerWaalsContact C-N 3.33Å; A117-K119 PolarHBondContact O-N 3.07Å; A117-A120 PolarHBondContact O-N 3.47Å; A117-A120 VanDerWaalsContact O-N 3.16Å; A117-L121 WeakPolarHBondContact O-CG 3.3Å; A117-L121 PolarHBondContact O-N 2.89Å |
| 118 | F | 97.6 | Very high | 97.2 | Very high | 139 Ų | 139 | 94.1 Ų | 94.1 | 61% | 0.61 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.1 | -39 | 176.3 | -77.9 | -64.4 | 0 | 0 | 0 | 112.1 | G114 A120 L121 E122 | G114-F118 VanDerWaalsContact O-CD2 3.26Å; G114-F118 WeakPolarHBondContact O-CD2 3.38Å; G114-F118 PolarHBondContact O-N 2.77Å; F118-A120 VanDerWaalsContact C-N 3.34Å; F118-A120 PolarHBondContact O-N 3.02Å; F118-L121 PolarHBondContact O-N 2.61Å; F118-E122 HydrophobicContact CD1-CG 4.42Å; F118-E122 WeakPolarHBondContact O-CB 3.33Å; F118-E122 WeakPolarHBondContact O-CG 3.37Å; F118-E122 PolarHBondContact O-N 3.39Å |
| 119 | K | 97.4 | Very high | 97.1 | Very high | 129 Ų | 129 | 96.3 Ų | 96.3 | 56% | 0.561 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.5 | -44.2 | 173.2 | -176.9 | -179 | 177.5 | -176.2 | 0 | 111.8 | A115 A117 L121 Q123 | A115-K119 WeakPolarHBondContact O-CB 3.22Å; A115-K119 PolarHBondContact O-N 3.39Å; A117-K119 VanDerWaalsContact C-N 3.33Å; A117-K119 PolarHBondContact O-N 3.07Å; K119-L121 VanDerWaalsContact C-N 3.33Å; K119-L121 PolarHBondContact O-N 3.12Å; K119-Q123 HydrophobicContact CG-CB 4.39Å; K119-Q123 WeakPolarHBondContact O-CB 3.36Å; K119-Q123 PolarHBondContact O-N 3.44Å |
| 120 | A | 97.8 | Very high | 97 | Very high | 75 Ų | 75 | 96.1 Ų | 96.1 | 62% | 0.62 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -67.4 | -31.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L116 A117 F118 | L116-A120 WeakPolarHBondContact O-CB 3.46Å; L116-A120 PolarHBondContact O-N 3.17Å; A117-A120 PolarHBondContact O-N 3.47Å; A117-A120 VanDerWaalsContact O-N 3.16Å; F118-A120 VanDerWaalsContact C-N 3.34Å; F118-A120 PolarHBondContact O-N 3.02Å |
| 121 | L | 96.9 | Very high | 97 | Very high | 119 Ų | 119 | 91.6 Ų | 91.6 | 62% | 0.623 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -85.3 | -47.8 | -179.7 | -65.7 | 169.6 | 0 | 0 | 0 | 112.8 | A117 F118 K119 | A117-L121 WeakPolarHBondContact O-CG 3.3Å; A117-L121 PolarHBondContact O-N 2.89Å; F118-L121 PolarHBondContact O-N 2.61Å; K119-L121 VanDerWaalsContact C-N 3.33Å; K119-L121 PolarHBondContact O-N 3.12Å |
| 122 | E | 96.9 | Very high | 97 | Very high | 100 Ų | 100 | 89.7 Ų | 89.7 | 47% | 0.467 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -91 | -33.1 | -169.1 | -56.4 | -53.2 | 142.1 | 0 | 0 | 113.8 | F118 P124 F125 E126 | F118-E122 HydrophobicContact CD1-CG 4.42Å; F118-E122 WeakPolarHBondContact O-CB 3.33Å; F118-E122 WeakPolarHBondContact O-CG 3.37Å; F118-E122 PolarHBondContact O-N 3.39Å; E122-P124 VanDerWaalsContact C-CD 3.48Å; E122-F125 PolarHBondContact O-N 2.92Å; E122-F125 VanDerWaalsContact O-N 3.08Å; E122-E126 WeakPolarHBondContact O-CB 3.49Å; E122-E126 PolarHBondContact O-N 2.98Å |
| 123 | Q | 97.3 | Very high | 96.8 | Very high | 100 Ų | 100 | 91.3 Ų | 91.3 | 47% | 0.467 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.6 | -38.8 | -177.3 | -168.7 | -170.4 | -25.2 | 0 | 0 | 113.4 | K119 S127 | K119-Q123 HydrophobicContact CG-CB 4.39Å; K119-Q123 WeakPolarHBondContact O-CB 3.36Å; K119-Q123 PolarHBondContact O-N 3.44Å; Q123-S127 VanDerWaalsContact O-CB 3.32Å; Q123-S127 WeakPolarHBondContact O-CB 3.47Å; Q123-S127 PolarHBondContact O-N 3.23Å |
| 124 | P | 97.4 | Very high | 96.7 | Very high | 70 Ų | 70 | 92.5 Ų | 92.5 | 46% | 0.455 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.4 | -41 | 174.1 | -22.7 | 34.7 | 0 | 0 | 0 | 112.8 | E122 N128 | E122-P124 VanDerWaalsContact C-CD 3.48Å; P124-N128 VanDerWaalsContact O-CG 3.23Å; P124-N128 PolarHBondContact O-N 3.23Å; P124-N128 VanDerWaalsContact O-N 3.1Å; P124-N128 PolarHBondContact O-ND2 3.49Å |
| 125 | F | 95.9 | Very high | 96.6 | Very high | 126 Ų | 126 | 96.4 Ų | 96.4 | 55% | 0.553 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -68.1 | -44.8 | 177.8 | -179.9 | -106.6 | 0 | 0 | 0 | 111.5 | E122 S127 N128 Q129 | E122-F125 PolarHBondContact O-N 2.92Å; E122-F125 VanDerWaalsContact O-N 3.08Å; F125-S127 VanDerWaalsContact C-N 3.34Å; F125-S127 PolarHBondContact O-N 3.44Å; F125-N128 PolarHBondContact O-N 3.42Å; F125-Q129 HydrophobicContact CD1-CG 4.26Å; F125-Q129 HydrophobicContact CE1-CG 3.94Å; F125-Q129 HydrophobicContact CE2-CG 4.43Å; F125-Q129 HydrophobicContact CZ-CG 4.04Å; F125-Q129 WeakPolarHBondContact O-CB 3.19Å; F125-Q129 WeakPolarHBondContact O-CG 3.45Å; F125-Q129 PolarHBondContact O-N 3.17Å |
| 126 | E | 96 | Very high | 96.5 | Very high | 96 Ų | 96 | 98.5 Ų | 98.5 | 45% | 0.449 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.5 | -42 | 175.5 | -163.7 | -146 | -162.1 | 0 | 0 | 112 | E122 Q129 K130 | E122-E126 WeakPolarHBondContact O-CB 3.49Å; E122-E126 PolarHBondContact O-N 2.98Å; E126-Q129 PolarHBondContact O-N 3.26Å; E126-K130 VanDerWaalsContact CD-CE 3.42Å; E126-K130 HydrophobicContact CG-CD 4.41Å; E126-K130 WeakPolarHBondContact O-CB 3.23Å; E126-K130 VanDerWaalsContact O-CG 3.3Å; E126-K130 WeakPolarHBondContact O-CG 3.4Å; E126-K130 PolarHBondContact O-N 3.46Å; E126-K130 VanDerWaalsContact OE1-CE 3.25Å; E126-K130 WeakPolarHBondContact OE1-CE 3.45Å; E126-K130 IonicContact OE1-NZ 3.31Å; E126-K130 PolarHBondContact OE1-NZ 3.38Å; E126-K130 IonicContact OE2-NZ 3.19Å; E126-K130 PolarHBondContact OE2-NZ 3.07Å |
| 127 | S | 96.6 | Very high | 96.3 | Very high | 60 Ų | 60 | 96.2 Ų | 96.2 | 42% | 0.42 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.4 | -38.4 | 176.4 | -172.4 | 0 | 0 | 0 | 0 | 112.5 | Q123 F125 T131 | Q123-S127 VanDerWaalsContact O-CB 3.32Å; Q123-S127 WeakPolarHBondContact O-CB 3.47Å; Q123-S127 PolarHBondContact O-N 3.23Å; F125-S127 VanDerWaalsContact C-N 3.34Å; F125-S127 PolarHBondContact O-N 3.44Å; S127-T131 WeakPolarHBondContact O-CB 3.4Å; S127-T131 PolarHBondContact O-N 3.01Å; S127-T131 VanDerWaalsContact O-N 3.11Å; S127-T131 PolarHBondContact O-OG1 3.34Å |
| 128 | N | 97 | Very high | 96.1 | Very high | 111 Ų | 111 | 95.5 Ų | 95.5 | 59% | 0.594 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -70.1 | -42.4 | 176 | -70.5 | -16.3 | 0 | 0 | 0 | 111.4 | P124 F125 T131 S132 | P124-N128 VanDerWaalsContact O-CG 3.23Å; P124-N128 PolarHBondContact O-N 3.23Å; P124-N128 VanDerWaalsContact O-N 3.1Å; P124-N128 PolarHBondContact O-ND2 3.49Å; F125-N128 PolarHBondContact O-N 3.42Å; N128-T131 PolarHBondContact O-N 3.36Å; N128-S132 WeakPolarHBondContact O-CB 3.43Å; N128-S132 PolarHBondContact O-N 3.46Å |
| 129 | Q | 95.4 | Very high | 96.1 | Very high | 105 Ų | 105 | 90.5 Ų | 90.5 | 49% | 0.491 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -55.4 | -52.3 | 172.2 | -81.3 | -81.3 | -5.3 | 0 | 0 | 111.7 | F125 E126 T131 S132 I133 | F125-Q129 HydrophobicContact CD1-CG 4.26Å; F125-Q129 HydrophobicContact CE1-CG 3.94Å; F125-Q129 HydrophobicContact CE2-CG 4.43Å; F125-Q129 HydrophobicContact CZ-CG 4.04Å; F125-Q129 WeakPolarHBondContact O-CB 3.19Å; F125-Q129 WeakPolarHBondContact O-CG 3.45Å; F125-Q129 PolarHBondContact O-N 3.17Å; E126-Q129 PolarHBondContact O-N 3.26Å; Q129-T131 VanDerWaalsContact C-N 3.3Å; Q129-T131 PolarHBondContact O-N 3.05Å; Q129-S132 PolarHBondContact O-N 3.26Å; Q129-I133 WeakPolarHBondContact O-CG2 3.4Å; Q129-I133 PolarHBondContact O-N 3.1Å |
| 130 | K | 94.7 | Very high | 96 | Very high | 110 Ų | 110 | 88.1 Ų | 88.1 | 48% | 0.478 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -57.7 | -40.3 | 177.5 | -75.7 | 169.2 | -179.8 | 170.3 | 0 | 112.8 | E126 I133 T134 | E126-K130 VanDerWaalsContact CD-CE 3.42Å; E126-K130 HydrophobicContact CG-CD 4.41Å; E126-K130 WeakPolarHBondContact O-CB 3.23Å; E126-K130 VanDerWaalsContact O-CG 3.3Å; E126-K130 WeakPolarHBondContact O-CG 3.4Å; E126-K130 PolarHBondContact O-N 3.46Å; E126-K130 VanDerWaalsContact OE1-CE 3.25Å; E126-K130 WeakPolarHBondContact OE1-CE 3.45Å; E126-K130 IonicContact OE1-NZ 3.31Å; E126-K130 PolarHBondContact OE1-NZ 3.38Å; E126-K130 IonicContact OE2-NZ 3.19Å; E126-K130 PolarHBondContact OE2-NZ 3.07Å; K130-I133 WeakPolarHBondContact O-CG2 3.25Å; K130-T134 WeakPolarHBondContact O-CB 3.46Å; K130-T134 PolarHBondContact O-N 3.3Å; K130-T134 PolarHBondContact O-OG1 3.46Å |
| 131 | T | 96.1 | Very high | 95.9 | Very high | 87 Ų | 87 | 86.3 Ų | 86.3 | 53% | 0.534 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -67.3 | -46.2 | 176.3 | -54.6 | 0 | 0 | 0 | 0 | 111.3 | S127 N128 Q129 T134 L135 | S127-T131 WeakPolarHBondContact O-CB 3.4Å; S127-T131 PolarHBondContact O-N 3.01Å; S127-T131 VanDerWaalsContact O-N 3.11Å; S127-T131 PolarHBondContact O-OG1 3.34Å; N128-T131 PolarHBondContact O-N 3.36Å; Q129-T131 VanDerWaalsContact C-N 3.3Å; Q129-T131 PolarHBondContact O-N 3.05Å; T131-T134 PolarHBondContact O-N 3.35Å; T131-L135 PolarHBondContact O-N 3.3Å |
| 132 | S | 96.6 | Very high | 95.8 | Very high | 71 Ų | 71 | 88 Ų | 88 | 50% | 0.497 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.1 | -51.3 | -179.2 | -169 | 0 | 0 | 0 | 0 | 112.4 | N128 Q129 T134 L135 E136 | N128-S132 WeakPolarHBondContact O-CB 3.43Å; N128-S132 PolarHBondContact O-N 3.46Å; Q129-S132 PolarHBondContact O-N 3.26Å; S132-T134 VanDerWaalsContact C-N 3.27Å; S132-T134 PolarHBondContact O-N 3.11Å; S132-L135 PolarHBondContact O-N 3Å; S132-L135 VanDerWaalsContact O-N 3.15Å; S132-E136 PolarHBondContact O-N 2.89Å |
| 133 | I | 95.1 | Very high | 95.9 | Very high | 113 Ų | 113 | 90.4 Ų | 90.4 | 58% | 0.579 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -64.8 | -31 | 179.9 | -165.1 | 171 | 0 | 0 | 0 | 112.5 | Q129 K130 K137 | Q129-I133 WeakPolarHBondContact O-CG2 3.4Å; Q129-I133 PolarHBondContact O-N 3.1Å; K130-I133 WeakPolarHBondContact O-CG2 3.25Å; I133-K137 VanDerWaalsContact O-CB 3.24Å; I133-K137 WeakPolarHBondContact O-CB 3.39Å; I133-K137 PolarHBondContact O-N 2.87Å |
| 134 | T | 94.2 | Very high | 95.8 | Very high | 85 Ų | 85 | 88.3 Ų | 88.3 | 52% | 0.521 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -69.4 | -40.9 | 175.3 | -57.6 | 0 | 0 | 0 | 0 | 111.1 | K130 T131 S132 A138 | K130-T134 WeakPolarHBondContact O-CB 3.46Å; K130-T134 PolarHBondContact O-N 3.3Å; K130-T134 PolarHBondContact O-OG1 3.46Å; T131-T134 PolarHBondContact O-N 3.35Å; S132-T134 VanDerWaalsContact C-N 3.27Å; S132-T134 PolarHBondContact O-N 3.11Å; T134-A138 PolarHBondContact O-N 3.48Å |
| 135 | L | 95.9 | Very high | 95.6 | Very high | 104 Ų | 104 | 90.7 Ų | 90.7 | 55% | 0.545 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.4 | -45.3 | 177.4 | -172.9 | 153.6 | 0 | 0 | 0 | 111.9 | T131 S132 A138 S139 | T131-L135 PolarHBondContact O-N 3.3Å; S132-L135 PolarHBondContact O-N 3Å; S132-L135 VanDerWaalsContact O-N 3.15Å; L135-A138 PolarHBondContact O-N 2.94Å; L135-S139 WeakPolarHBondContact O-CB 3.47Å; L135-S139 PolarHBondContact O-N 2.95Å |
| 136 | E | 95.4 | Very high | 95.6 | Very high | 108 Ų | 108 | 90 Ų | 90 | 51% | 0.505 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 175.2 | -78.3 | -67.7 | 177 | 0 | 0 | 111.9 | S132 A138 S139 F140 R143 | S132-E136 PolarHBondContact O-N 2.89Å; E136-A138 PolarHBondContact O-N 3.28Å; E136-S139 PolarHBondContact O-N 2.86Å; E136-F140 WeakPolarHBondContact O-CB 3.38Å; E136-F140 PolarHBondContact O-N 3.48Å; E136-R143 IonicContact OE2-NH2 3.32Å; E136-R143 PolarHBondContact OE2-NH2 3.16Å |
| 137 | K | 94.8 | Very high | 95.6 | Very high | 63 Ų | 63 | 87.4 Ų | 87.4 | 27% | 0.274 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.4 | -43.9 | 174.7 | -175.5 | -179.2 | 173.9 | -177.8 | 0 | 111.8 | I133 F140 L141 L152 D153 | I133-K137 VanDerWaalsContact O-CB 3.24Å; I133-K137 WeakPolarHBondContact O-CB 3.39Å; I133-K137 PolarHBondContact O-N 2.87Å; K137-F140 PolarHBondContact O-N 2.74Å; K137-L141 HydrophobicContact CG-CD1 4.29Å; K137-L141 WeakPolarHBondContact O-CG 3.41Å; K137-L141 PolarHBondContact O-N 2.87Å; K137-L152 HydrophobicContact CG-CD2 3.76Å; K137-D153 IonicContact NZ-OD1 2.66Å; K137-D153 PolarHBondContact NZ-OD1 2.98Å; K137-D153 IonicContact NZ-OD2 2.69Å; K137-D153 PolarHBondContact NZ-OD2 3.47Å |
| 138 | A | 93.9 | Very high | 95.5 | Very high | 35 Ų | 35 | 87.2 Ų | 87.2 | 29% | 0.289 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.5 | -49.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | T134 L135 E136 F140 L141 E142 | T134-A138 PolarHBondContact O-N 3.48Å; L135-A138 PolarHBondContact O-N 2.94Å; E136-A138 PolarHBondContact O-N 3.28Å; A138-F140 VanDerWaalsContact C-N 3.27Å; A138-F140 PolarHBondContact O-N 3.46Å; A138-L141 PolarHBondContact O-N 3.28Å; A138-L141 VanDerWaalsContact O-N 3.1Å; A138-E142 WeakPolarHBondContact O-CG 3.27Å; A138-E142 PolarHBondContact O-N 3.46Å |
| 139 | S | 96.3 | Very high | 95.4 | Very high | 34 Ų | 34 | 85.4 Ų | 85.4 | 24% | 0.238 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -61.2 | -32.7 | 178.6 | -176.6 | 0 | 0 | 0 | 0 | 113.2 | L135 E136 R143 | L135-S139 WeakPolarHBondContact O-CB 3.47Å; L135-S139 PolarHBondContact O-N 2.95Å; E136-S139 PolarHBondContact O-N 2.86Å; S139-R143 WeakPolarHBondContact O-CB 3.16Å; S139-R143 VanDerWaalsContact O-CG 3.3Å; S139-R143 WeakPolarHBondContact O-CG 3.41Å; S139-R143 PolarHBondContact O-N 3.17Å; S139-R143 VanDerWaalsContact O-N 3.14Å; S139-R143 PolarHBondContact O-NE 2.98Å; S139-R143 PolarHBondContact OG-NE 3.37Å; S139-R143 PolarHBondContact OG-NH2 3.27Å |
| 140 | F | 96.4 | Very high | 95.3 | Very high | 79 Ų | 79 | 85.5 Ų | 85.5 | 35% | 0.346 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68.9 | -43.1 | 173.8 | -178.9 | -86.9 | 0 | 0 | 0 | 111.8 | E136 K137 A138 R143 N144 V147 L152 | E136-F140 WeakPolarHBondContact O-CB 3.38Å; E136-F140 PolarHBondContact O-N 3.48Å; K137-F140 PolarHBondContact O-N 2.74Å; A138-F140 VanDerWaalsContact C-N 3.27Å; A138-F140 PolarHBondContact O-N 3.46Å; F140-R143 PolarHBondContact O-N 2.92Å; F140-N144 HydrophobicContact CE1-CB 4.23Å; F140-N144 HydrophobicContact CZ-CB 4.44Å; F140-N144 WeakPolarHBondContact O-CB 3.41Å; F140-N144 PolarHBondContact O-N 2.85Å; F140-N144 PolarHBondContact O-ND2 3.13Å; F140-V147 HydrophobicContact CE1-CB 4.49Å; F140-V147 HydrophobicContact CE1-CG1 4.41Å; F140-V147 HydrophobicContact CE1-CG2 4.41Å; F140-L152 HydrophobicContact CD1-CD1 4.12Å; F140-L152 HydrophobicContact CD1-CD2 3.79Å; F140-L152 HydrophobicContact CE1-CD1 4.06Å; F140-L152 HydrophobicContact CE1-CD2 4.38Å |
| 141 | L | 95.4 | Very high | 95.3 | Very high | 36 Ų | 36 | 85.1 Ų | 85.1 | 19% | 0.188 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -67.7 | -39.2 | 178.6 | -70.3 | 165.5 | 0 | 0 | 0 | 112 | K137 A138 R143 N144 V147 P149 L152 | K137-L141 HydrophobicContact CG-CD1 4.29Å; K137-L141 WeakPolarHBondContact O-CG 3.41Å; K137-L141 PolarHBondContact O-N 2.87Å; A138-L141 PolarHBondContact O-N 3.28Å; A138-L141 VanDerWaalsContact O-N 3.1Å; L141-R143 VanDerWaalsContact C-N 3.33Å; L141-R143 PolarHBondContact O-N 3.35Å; L141-N144 CarbonylContact O-C 3.47Å; L141-N144 PolarHBondContact O-N 3.19Å; L141-V147 WeakPolarHBondContact CD2-O 3.34Å; L141-P149 HydrophobicContact CD1-CB 4.19Å; L141-P149 HydrophobicContact CD1-CG 4.12Å; L141-P149 HydrophobicContact CD2-CG 4.4Å; L141-L152 HydrophobicContact CD1-CD2 4.11Å; L141-L152 HydrophobicContact CD2-CB 4.41Å; L141-L152 HydrophobicContact CD2-CD2 3.75Å; L141-L152 HydrophobicContact CG-CD2 3.72Å |
| 142 | E | 95.3 | Very high | 95.3 | Very high | 156 Ų | 156 | 82 Ų | 82 | 73% | 0.729 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.9 | -39.9 | 172.2 | -72 | 177.6 | 170.6 | 0 | 0 | 112.1 | A138 | A138-E142 WeakPolarHBondContact O-CG 3.27Å; A138-E142 PolarHBondContact O-N 3.46Å |
| 143 | R | 97.4 | Very high | 95.2 | Very high | 150 Ų | 150 | 81.1 Ų | 81.1 | 57% | 0.566 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -73.2 | -23 | 176.1 | -77.9 | 178.4 | -80.8 | 168.4 | -9.4 | 113.8 | E136 S139 F140 L141 | E136-R143 IonicContact OE2-NH2 3.32Å; E136-R143 PolarHBondContact OE2-NH2 3.16Å; S139-R143 WeakPolarHBondContact O-CB 3.16Å; S139-R143 VanDerWaalsContact O-CG 3.3Å; S139-R143 WeakPolarHBondContact O-CG 3.41Å; S139-R143 PolarHBondContact O-N 3.17Å; S139-R143 VanDerWaalsContact O-N 3.14Å; S139-R143 PolarHBondContact O-NE 2.98Å; S139-R143 PolarHBondContact OG-NE 3.37Å; S139-R143 PolarHBondContact OG-NH2 3.27Å; F140-R143 PolarHBondContact O-N 2.92Å; L141-R143 VanDerWaalsContact C-N 3.33Å; L141-R143 PolarHBondContact O-N 3.35Å |
| 144 | N | 95.9 | Very high | 95.2 | Very high | 55 Ų | 55 | 78.3 Ų | 78.3 | 29% | 0.294 | 43% | 0.432 | S | S | . | . | trans | -130.9 | 72.1 | -174.8 | -58.8 | -88.7 | 0 | 0 | 0 | 112 | F140 L141 C146 V147 | F140-N144 HydrophobicContact CE1-CB 4.23Å; F140-N144 HydrophobicContact CZ-CB 4.44Å; F140-N144 WeakPolarHBondContact O-CB 3.41Å; F140-N144 PolarHBondContact O-N 2.85Å; F140-N144 PolarHBondContact O-ND2 3.13Å; L141-N144 CarbonylContact O-C 3.47Å; L141-N144 PolarHBondContact O-N 3.19Å; N144-C146 PolarHBondContact O-N 2.95Å; N144-V147 HydrophobicContact CB-CG2 4.2Å; N144-V147 PolarHBondContact O-N 2.78Å | ||
| 145 | P | 93.5 | Very high | 95.2 | Very high | 121 Ų | 121 | 79.5 Ų | 79.5 | 79% | 0.786 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -10.4 | -177.3 | -24 | 35.1 | 0 | 0 | 0 | 115.5 | ||
| 146 | C | 95.8 | Very high | 95.1 | Very high | 112 Ų | 112 | 77.7 Ų | 77.7 | 76% | 0.757 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.8 | -9.5 | 175.1 | 54.8 | 0 | 0 | 0 | 0 | 114.4 | N144 | N144-C146 PolarHBondContact O-N 2.95Š|
| 147 | V | 96.3 | Very high | 95 | Very high | 40 Ų | 40 | 78.6 Ų | 78.6 | 24% | 0.242 | 43% | 0.427 | C | S | . | . | S | Bend | trans | -105.3 | 121 | 179.1 | -178.6 | 0 | 0 | 0 | 0 | 109.4 | F140 L141 N144 E151 L152 | F140-V147 HydrophobicContact CE1-CB 4.49Å; F140-V147 HydrophobicContact CE1-CG1 4.41Å; F140-V147 HydrophobicContact CE1-CG2 4.41Å; L141-V147 WeakPolarHBondContact CD2-O 3.34Å; N144-V147 HydrophobicContact CB-CG2 4.2Å; N144-V147 PolarHBondContact O-N 2.78Å; V147-E151 HydrophobicContact CG1-CB 4.44Å; V147-L152 HydrophobicContact CG1-CB 4.11Å |
| 148 | T | 94.7 | Very high | 94.9 | Very high | 57 Ų | 57 | 82.3 Ų | 82.3 | 35% | 0.35 | 45% | 0.445 | S | S | . | . | trans | -73.7 | 151.8 | 175 | 67.2 | 0 | 0 | 0 | 0 | 111.4 | T150 E151 L152 | T148-T150 WeakPolarHBondContact CB-OG1 3.5Å; T148-T150 PolarHBondContact O-N 3.23Å; T148-T150 VanDerWaalsContact O-N 3.14Å; T148-T150 PolarHBondContact OG1-OG1 3.34Å; T148-E151 VanDerWaalsContact CB-OE2 3.24Å; T148-E151 WeakPolarHBondContact CB-OE2 3.44Å; T148-E151 VanDerWaalsContact CG2-OE2 3.3Å; T148-E151 WeakPolarHBondContact CG2-OE2 3.39Å; T148-E151 PolarHBondContact N-OE2 3.42Å; T148-E151 PolarHBondContact O-N 2.93Å; T148-E151 VanDerWaalsContact O-N 3.13Å; T148-E151 VanDerWaalsContact OG1-CG 3.25Å; T148-E151 WeakPolarHBondContact OG1-CG 3.39Å; T148-E151 PolarHBondContact OG1-N 3.35Å; T148-E151 PolarHBondContact OG1-OE2 2.82Å; T148-L152 PolarHBondContact O-N 2.95Å; T148-L152 VanDerWaalsContact O-N 3.09Å | ||
| 149 | P | 93.4 | Very high | 94.8 | Very high | 73 Ų | 73 | 82 Ų | 82 | 47% | 0.474 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -55.3 | -33.4 | 174.1 | -25.3 | 34 | 0 | 0 | 0 | 113 | L141 D153 | L141-P149 HydrophobicContact CD1-CB 4.19Å; L141-P149 HydrophobicContact CD1-CG 4.12Å; L141-P149 HydrophobicContact CD2-CG 4.4Å; P149-D153 WeakPolarHBondContact O-CB 3.34Å; P149-D153 PolarHBondContact O-N 2.93Å |
| 150 | T | 94.4 | Very high | 94.5 | Very high | 107 Ų | 107 | 85.3 Ų | 85.3 | 66% | 0.656 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -68.1 | -39.9 | 177.5 | 30.8 | 0 | 0 | 0 | 0 | 113.8 | T148 A154 | T148-T150 WeakPolarHBondContact CB-OG1 3.5Å; T148-T150 PolarHBondContact O-N 3.23Å; T148-T150 VanDerWaalsContact O-N 3.14Å; T148-T150 PolarHBondContact OG1-OG1 3.34Å; T150-A154 WeakPolarHBondContact O-CB 3.18Å; T150-A154 PolarHBondContact O-N 3.33Å |
| 151 | E | 94.8 | Very high | 94.1 | Very high | 102 Ų | 102 | 86.3 Ų | 86.3 | 48% | 0.477 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -70.7 | -40.7 | 175.6 | -71.7 | 156.6 | 142 | 0 | 0 | 110.8 | V147 T148 D153 A154 I155 | V147-E151 HydrophobicContact CG1-CB 4.44Å; T148-E151 VanDerWaalsContact CB-OE2 3.24Å; T148-E151 WeakPolarHBondContact CB-OE2 3.44Å; T148-E151 VanDerWaalsContact CG2-OE2 3.3Å; T148-E151 WeakPolarHBondContact CG2-OE2 3.39Å; T148-E151 PolarHBondContact N-OE2 3.42Å; T148-E151 PolarHBondContact O-N 2.93Å; T148-E151 VanDerWaalsContact O-N 3.13Å; T148-E151 VanDerWaalsContact OG1-CG 3.25Å; T148-E151 WeakPolarHBondContact OG1-CG 3.39Å; T148-E151 PolarHBondContact OG1-N 3.35Å; T148-E151 PolarHBondContact OG1-OE2 2.82Å; E151-D153 PolarHBondContact O-N 3.34Å; E151-A154 WeakPolarHBondContact O-CB 3.39Å; E151-A154 PolarHBondContact O-N 3.2Å; E151-A154 VanDerWaalsContact O-N 3.14Å; E151-I155 WeakPolarHBondContact O-CG1 3.41Å; E151-I155 PolarHBondContact O-N 3.22Å |
| 152 | L | 95.1 | Very high | 93.8 | Very high | 20 Ų | 20 | 85.6 Ų | 85.6 | 11% | 0.105 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 174.5 | -176.4 | 57.7 | 0 | 0 | 0 | 111.7 | K137 F140 L141 V147 T148 A154 I155 I156 | K137-L152 HydrophobicContact CG-CD2 3.76Å; F140-L152 HydrophobicContact CD1-CD1 4.12Å; F140-L152 HydrophobicContact CD1-CD2 3.79Å; F140-L152 HydrophobicContact CE1-CD1 4.06Å; F140-L152 HydrophobicContact CE1-CD2 4.38Å; L141-L152 HydrophobicContact CD1-CD2 4.11Å; L141-L152 HydrophobicContact CD2-CB 4.41Å; L141-L152 HydrophobicContact CD2-CD2 3.75Å; L141-L152 HydrophobicContact CG-CD2 3.72Å; V147-L152 HydrophobicContact CG1-CB 4.11Å; T148-L152 PolarHBondContact O-N 2.95Å; T148-L152 VanDerWaalsContact O-N 3.09Å; L152-A154 VanDerWaalsContact C-N 3.32Å; L152-A154 PolarHBondContact O-N 3.34Å; L152-I155 PolarHBondContact O-N 2.84Å; L152-I156 HydrophobicContact CD1-CD1 4.06Å; L152-I156 HydrophobicContact CD1-CG1 4.42Å; L152-I156 HydrophobicContact CG-CD1 3.93Å; L152-I156 WeakPolarHBondContact O-CB 3.22Å; L152-I156 VanDerWaalsContact O-CG1 3.24Å; L152-I156 WeakPolarHBondContact O-CG1 3.34Å; L152-I156 PolarHBondContact O-N 3.06Å |
| 153 | D | 94.6 | Very high | 93.3 | Very high | 53 Ų | 53 | 82.2 Ų | 82.2 | 28% | 0.283 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -66.1 | -31.1 | 173.9 | -81.1 | -42.4 | 0 | 0 | 0 | 113.4 | K137 P149 E151 K157 | K137-D153 IonicContact NZ-OD1 2.66Å; K137-D153 PolarHBondContact NZ-OD1 2.98Å; K137-D153 IonicContact NZ-OD2 2.69Å; K137-D153 PolarHBondContact NZ-OD2 3.47Å; P149-D153 WeakPolarHBondContact O-CB 3.34Å; P149-D153 PolarHBondContact O-N 2.93Å; E151-D153 PolarHBondContact O-N 3.34Å; D153-K157 WeakPolarHBondContact O-CB 3.44Å; D153-K157 VanDerWaalsContact O-CD 3.3Å; D153-K157 WeakPolarHBondContact O-CD 3.23Å; D153-K157 WeakPolarHBondContact O-CG 3.33Å; D153-K157 PolarHBondContact O-N 2.9Å |
| 154 | A | 94.9 | Very high | 92.7 | Very high | 55 Ų | 55 | 79 Ų | 79 | 46% | 0.455 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -69.2 | -43.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | T150 E151 L152 K157 H158 | T150-A154 WeakPolarHBondContact O-CB 3.18Å; T150-A154 PolarHBondContact O-N 3.33Å; E151-A154 WeakPolarHBondContact O-CB 3.39Å; E151-A154 PolarHBondContact O-N 3.2Å; E151-A154 VanDerWaalsContact O-N 3.14Å; L152-A154 VanDerWaalsContact C-N 3.32Å; L152-A154 PolarHBondContact O-N 3.34Å; A154-K157 PolarHBondContact O-N 2.85Å; A154-H158 WeakPolarHBondContact O-CB 3.49Å; A154-H158 PolarHBondContact O-N 3.32Å |
| 155 | I | 94.1 | Very high | 92.1 | Very high | 110 Ų | 110 | 78.9 Ų | 78.9 | 56% | 0.564 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -63.7 | -44.9 | 175.8 | -67.5 | 165 | 0 | 0 | 0 | 110.6 | E151 L152 K157 H158 A159 | E151-I155 WeakPolarHBondContact O-CG1 3.41Å; E151-I155 PolarHBondContact O-N 3.22Å; L152-I155 PolarHBondContact O-N 2.84Å; I155-K157 PolarHBondContact O-N 2.94Å; I155-H158 PolarHBondContact O-N 2.87Å; I155-A159 WeakPolarHBondContact O-CB 3.31Å; I155-A159 PolarHBondContact O-N 3.38Å |
| 156 | I | 93.9 | Very high | 91.5 | Very high | 65 Ų | 65 | 73.6 Ų | 73.6 | 33% | 0.333 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -61.8 | -43.9 | 177.7 | -70.4 | 166.5 | 0 | 0 | 0 | 111 | L152 A159 I160 | L152-I156 HydrophobicContact CD1-CD1 4.06Å; L152-I156 HydrophobicContact CD1-CG1 4.42Å; L152-I156 HydrophobicContact CG-CD1 3.93Å; L152-I156 WeakPolarHBondContact O-CB 3.22Å; L152-I156 VanDerWaalsContact O-CG1 3.24Å; L152-I156 WeakPolarHBondContact O-CG1 3.34Å; L152-I156 PolarHBondContact O-N 3.06Å; I156-A159 PolarHBondContact O-N 3.04Å; I156-I160 HydrophobicContact CG2-CD1 3.87Å; I156-I160 VanDerWaalsContact O-CG1 3.31Å; I156-I160 WeakPolarHBondContact O-CG1 3.43Å; I156-I160 PolarHBondContact O-N 2.91Å |
| 157 | K | 93.9 | Very high | 90.9 | Very high | 127 Ų | 127 | 72.3 Ų | 72.3 | 55% | 0.552 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -60.6 | -50.4 | 175 | -73.9 | 163.8 | -170.5 | 168.3 | 0 | 111.7 | D153 A154 I155 A159 I160 D161 | D153-K157 WeakPolarHBondContact O-CB 3.44Å; D153-K157 VanDerWaalsContact O-CD 3.3Å; D153-K157 WeakPolarHBondContact O-CD 3.23Å; D153-K157 WeakPolarHBondContact O-CG 3.33Å; D153-K157 PolarHBondContact O-N 2.9Å; A154-K157 PolarHBondContact O-N 2.85Å; I155-K157 PolarHBondContact O-N 2.94Å; K157-A159 VanDerWaalsContact C-N 3.25Å; K157-A159 PolarHBondContact O-N 3.39Å; K157-I160 WeakPolarHBondContact O-CB 3.4Å; K157-I160 PolarHBondContact O-N 3.01Å; K157-D161 PolarHBondContact O-N 3.31Å |
| 158 | H | 92.3 | Very high | 90.1 | Very high | 141 Ų | 141 | 74.9 Ų | 74.9 | 65% | 0.653 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -60.7 | -34.3 | 178.5 | -172.7 | -84.2 | 0 | 0 | 0 | 112.5 | A154 I155 A162 | A154-H158 WeakPolarHBondContact O-CB 3.49Å; A154-H158 PolarHBondContact O-N 3.32Å; I155-H158 PolarHBondContact O-N 2.87Å; H158-A162 VanDerWaalsContact O-CB 3.27Å; H158-A162 WeakPolarHBondContact O-CB 3.35Å; H158-A162 PolarHBondContact O-N 2.98Å |
| 159 | A | 92.1 | Very high | 89.4 | Confident | 28 Ų | 28 | 75.8 Ų | 75.8 | 23% | 0.231 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -67.8 | -40 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I155 I156 K157 A162 V163 P169 | I155-A159 WeakPolarHBondContact O-CB 3.31Å; I155-A159 PolarHBondContact O-N 3.38Å; I156-A159 PolarHBondContact O-N 3.04Å; K157-A159 VanDerWaalsContact C-N 3.25Å; K157-A159 PolarHBondContact O-N 3.39Å; A159-A162 PolarHBondContact O-N 3.01Å; A159-V163 VanDerWaalsContact O-CG2 3.32Å; A159-V163 WeakPolarHBondContact O-CG2 3.17Å; A159-V163 PolarHBondContact O-N 2.89Å; A159-P169 HydrophobicContact CB-CB 4.18Å; A159-P169 HydrophobicContact CB-CG 4.2Å |
| 160 | I | 90.7 | Very high | 88.7 | Confident | 105 Ų | 105 | 79.3 Ų | 79.3 | 54% | 0.538 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.4 | -45.2 | 174.3 | -68.3 | 163.3 | 0 | 0 | 0 | 110.8 | I156 K157 A162 V163 S164 | I156-I160 HydrophobicContact CG2-CD1 3.87Å; I156-I160 VanDerWaalsContact O-CG1 3.31Å; I156-I160 WeakPolarHBondContact O-CG1 3.43Å; I156-I160 PolarHBondContact O-N 2.91Å; K157-I160 WeakPolarHBondContact O-CB 3.4Å; K157-I160 PolarHBondContact O-N 3.01Å; I160-A162 VanDerWaalsContact C-N 3.34Å; I160-A162 PolarHBondContact O-N 3.32Å; I160-V163 PolarHBondContact O-N 3.09Å; I160-S164 PolarHBondContact O-N 3.27Å |
| 161 | D | 88.6 | Confident | 87.4 | Confident | 100 Ų | 100 | 77 Ų | 77 | 54% | 0.535 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -59.9 | -44.7 | 176.7 | -66.5 | -32.4 | 0 | 0 | 0 | 110.7 | K157 S164 A165 | K157-D161 PolarHBondContact O-N 3.31Å; D161-S164 PolarHBondContact O-N 2.94Å; D161-S164 PolarHBondContact O-OG 3.37Å; D161-A165 PolarHBondContact O-N 3Å; D161-A165 VanDerWaalsContact O-N 3.12Å |
| 162 | A | 87.6 | Confident | 85.6 | Confident | 20 Ų | 20 | 79.7 Ų | 79.7 | 17% | 0.165 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -59.8 | -45.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | H158 A159 I160 S164 A165 G166 V167 | H158-A162 VanDerWaalsContact O-CB 3.27Å; H158-A162 WeakPolarHBondContact O-CB 3.35Å; H158-A162 PolarHBondContact O-N 2.98Å; A159-A162 PolarHBondContact O-N 3.01Å; I160-A162 VanDerWaalsContact C-N 3.34Å; I160-A162 PolarHBondContact O-N 3.32Å; A162-S164 VanDerWaalsContact C-N 3.32Å; A162-S164 PolarHBondContact O-N 2.98Å; A162-A165 PolarHBondContact O-N 3.48Å; A162-G166 PolarHBondContact O-N 3.27Å; A162-V167 CarbonylContact C-O 3.3Å; A162-V167 VanDerWaalsContact C-O 3.3Å; A162-V167 HydrophobicContact CB-CB 4.19Å; A162-V167 WeakPolarHBondContact O-CA 3.44Å; A162-V167 WeakPolarHBondContact O-CB 3.4Å; A162-V167 PolarHBondContact O-N 2.9Å |
| 163 | V | 86.2 | Confident | 83.7 | Confident | 86 Ų | 86 | 83.4 Ų | 83.4 | 52% | 0.521 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60 | -42.1 | 174.9 | 168.8 | 0 | 0 | 0 | 0 | 111.1 | A159 I160 A165 G166 V167 P169 | A159-V163 VanDerWaalsContact O-CG2 3.32Å; A159-V163 WeakPolarHBondContact O-CG2 3.17Å; A159-V163 PolarHBondContact O-N 2.89Å; I160-V163 PolarHBondContact O-N 3.09Å; V163-A165 PolarHBondContact O-N 2.93Å; V163-G166 PolarHBondContact O-N 2.94Å; V163-V167 WeakPolarHBondContact CA-O 3.44Å; V163-V167 PolarHBondContact N-O 3.33Å; V163-P169 VanDerWaalsContact CG2-CD 3.46Å; V163-P169 HydrophobicContact CG2-CG 3.91Å |
| 164 | S | 84.3 | Confident | 81.9 | Confident | 83 Ų | 83 | 90 Ų | 90 | 58% | 0.58 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.1 | -29.6 | 178.2 | 83.5 | 0 | 0 | 0 | 0 | 113.3 | I160 D161 A162 G166 | I160-S164 PolarHBondContact O-N 3.27Å; D161-S164 PolarHBondContact O-N 2.94Å; D161-S164 PolarHBondContact O-OG 3.37Å; A162-S164 VanDerWaalsContact C-N 3.32Å; A162-S164 PolarHBondContact O-N 2.98Å; S164-G166 VanDerWaalsContact C-N 3.3Å |
| 165 | A | 83.8 | Confident | 80.6 | Confident | 51 Ų | 51 | 95 Ų | 95 | 42% | 0.421 | 52% | 0.518 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | -2.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | D161 A162 V163 | D161-A165 PolarHBondContact O-N 3Å; D161-A165 VanDerWaalsContact O-N 3.12Å; A162-A165 PolarHBondContact O-N 3.48Å; V163-A165 PolarHBondContact O-N 2.93Å |
| 166 | G | 79.8 | Confident | 79.5 | Confident | 10 Ų | 10 | 91.9 Ų | 91.9 | 10% | 0.103 | 51% | 0.506 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 84.8 | 19.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115 | A162 V163 S164 Y178 R317 | A162-G166 PolarHBondContact O-N 3.27Å; V163-G166 PolarHBondContact O-N 2.94Å; S164-G166 VanDerWaalsContact C-N 3.3Å; G166-Y178 WeakPolarHBondContact O-CD2 3.4Å; G166-Y178 WeakPolarHBondContact O-CE2 3.48Å; G166-R317 PolarHBondContact O-NH1 3.13Å; G166-R317 VanDerWaalsContact O-NH1 3.16Å |
| 167 | V | 82.9 | Confident | 78.9 | Confident | 85 Ų | 85 | 92 Ų | 92 | 52% | 0.515 | 51% | 0.513 | S | S | . | . | trans | -98.5 | 124.6 | 174 | -176.4 | 0 | 0 | 0 | 0 | 108.9 | A162 V163 P169 | A162-V167 CarbonylContact C-O 3.3Å; A162-V167 VanDerWaalsContact C-O 3.3Å; A162-V167 HydrophobicContact CB-CB 4.19Å; A162-V167 WeakPolarHBondContact O-CA 3.44Å; A162-V167 WeakPolarHBondContact O-CB 3.4Å; A162-V167 PolarHBondContact O-N 2.9Å; V163-V167 WeakPolarHBondContact CA-O 3.44Å; V163-V167 PolarHBondContact N-O 3.33Å; V167-P169 WeakPolarHBondContact O-CD 3.34Å | ||
| 168 | R | 79.4 | Confident | 78.2 | Confident | 94 Ų | 94 | 87.7 Ų | 87.7 | 36% | 0.355 | 49% | 0.493 | S | S | . | . | trans | -82.8 | 123.6 | 176.5 | -61.6 | -176.4 | -172.3 | -156.8 | -3.4 | 108.7 | I170 Y178 G315 N316 | R168-I170 PolarHBondContact O-N 2.6Å; R168-Y178 PolarHBondContact NE-OH 3.49Å; R168-Y178 PolarHBondContact NH2-OH 2.84Å; R168-G315 PolarHBondContact NH2-O 3.32Å; R168-N316 PolarHBondContact NH1-OD1 3.08Å | ||
| 169 | P | 81 | Confident | 78 | Confident | 76 Ų | 76 | 86.7 Ų | 86.7 | 49% | 0.494 | 48% | 0.484 | S | S | . | . | S | Bend | trans | -81.2 | 11.7 | 177.3 | 33 | -35 | 0 | 0 | 0 | 113.1 | A159 V163 V167 | A159-P169 HydrophobicContact CB-CB 4.18Å; A159-P169 HydrophobicContact CB-CG 4.2Å; V163-P169 VanDerWaalsContact CG2-CD 3.46Å; V163-P169 HydrophobicContact CG2-CG 3.91Å; V167-P169 WeakPolarHBondContact O-CD 3.34Å |
| 170 | I | 78.2 | Confident | 77.7 | Confident | 148 Ų | 148 | 88.4 Ų | 88.4 | 76% | 0.759 | 49% | 0.489 | S | S | * | . | S | Bend | trans | -133.2 | 124.4 | -174.1 | -56.5 | 173.2 | 0 | 0 | 0 | 108.4 | R168 | R168-I170 PolarHBondContact O-N 2.6Š|
| 171 | G | 68.1 | Low | 77.5 | Confident | 59 Ų | 59 | 91.4 Ų | 91.4 | 61% | 0.608 | 50% | 0.503 | S | S | * | . | S | Bend | trans | 95.6 | 149.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | T173 | G171-T173 VanDerWaalsContact C-N 3.26Å; G171-T173 PolarHBondContact O-N 3.12Å |
| 172 | E | 55.4 | Low | 77.3 | Confident | 158 Ų | 158 | 88.1 Ų | 88.1 | 74% | 0.738 | 49% | 0.493 | S | S | * | . | S | Bend | trans | -84.4 | 19.1 | -172.8 | -53.8 | -172.4 | 139 | 0 | 0 | 114.4 | Y174 | E172-Y174 VanDerWaalsContact C-N 3.34Å; E172-Y174 HydrophobicContact CB-CE2 4.07Å; E172-Y174 WeakPolarHBondContact O-CD2 3.2Å; E172-Y174 WeakPolarHBondContact O-CE2 3.16Å; E172-Y174 PolarHBondContact O-N 3.16Å |
| 173 | T | 55.2 | Low | 77.2 | Confident | 98 Ų | 98 | 87.6 Ų | 87.6 | 60% | 0.601 | 49% | 0.488 | S | S | * | . | trans | -90.1 | 60.4 | -166 | -36.6 | 0 | 0 | 0 | 0 | 113.3 | G171 N175 | G171-T173 VanDerWaalsContact C-N 3.26Å; G171-T173 PolarHBondContact O-N 3.12Å; T173-N175 PolarHBondContact O-N 2.87Å | ||
| 174 | Y | 57.6 | Low | 77.4 | Confident | 190 Ų | 190 | 84.8 Ų | 84.8 | 75% | 0.745 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | -16.2 | -174.6 | -44.1 | -69.5 | 0 | 0 | 0 | 115.4 | E172 S176 | E172-Y174 VanDerWaalsContact C-N 3.34Å; E172-Y174 HydrophobicContact CB-CE2 4.07Å; E172-Y174 WeakPolarHBondContact O-CD2 3.2Å; E172-Y174 WeakPolarHBondContact O-CE2 3.16Å; E172-Y174 PolarHBondContact O-N 3.16Å; Y174-S176 PolarHBondContact O-N 3.19Å |
| 175 | N | 67.1 | Low | 77.7 | Confident | 161 Ų | 161 | 86 Ų | 86 | 86% | 0.861 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87 | 2.2 | -164.1 | -64.8 | -16.5 | 0 | 0 | 0 | 115.8 | T173 | T173-N175 PolarHBondContact O-N 2.87Š|
| 176 | S | 71.9 | Confident | 78 | Confident | 44 Ų | 44 | 84.5 Ų | 84.5 | 31% | 0.308 | 45% | 0.452 | S | S | . | . | trans | -117.2 | 113.5 | -172.5 | 57.7 | 0 | 0 | 0 | 0 | 113.1 | Y174 R317 | Y174-S176 PolarHBondContact O-N 3.19Å; S176-R317 PolarHBondContact O-NE 2.89Å; S176-R317 PolarHBondContact O-NH2 3.45Å; S176-R317 WeakPolarHBondContact OG-CD 3.33Å; S176-R317 PolarHBondContact OG-NE 3.47Å | ||
| 177 | S | 80.6 | Confident | 78.5 | Confident | 69 Ų | 69 | 85.3 Ų | 85.3 | 48% | 0.483 | 45% | 0.453 | S | S | . | . | trans | -78 | 165.1 | 175.3 | -170.7 | 0 | 0 | 0 | 0 | 112.2 | W179 R317 | S177-W179 PolarHBondContact OG-N 3.38Å; S177-R317 PolarHBondContact O-NH2 2.95Å | ||
| 178 | Y | 79.2 | Confident | 79 | Confident | 35 Ų | 35 | 83.1 Ų | 83.1 | 14% | 0.137 | 44% | 0.44 | C | S | . | . | S | Bend | trans | -105.3 | -6 | 162.2 | -83.5 | -37.2 | 0 | 0 | 0 | 111.5 | G166 R168 S183 I200 R317 | G166-Y178 WeakPolarHBondContact O-CD2 3.4Å; G166-Y178 WeakPolarHBondContact O-CE2 3.48Å; R168-Y178 PolarHBondContact NE-OH 3.49Å; R168-Y178 PolarHBondContact NH2-OH 2.84Å; Y178-S183 WeakPolarHBondContact O-CB 3.13Å; Y178-I200 HydrophobicContact CD1-CD1 3.68Å; Y178-I200 HydrophobicContact CD1-CG1 4.29Å; Y178-I200 HydrophobicContact CD2-CD1 4.2Å; Y178-I200 HydrophobicContact CD2-CG1 3.93Å; Y178-I200 HydrophobicContact CE1-CD1 4.33Å; Y178-I200 HydrophobicContact CE2-CG1 4.38Å; Y178-I200 HydrophobicContact CG-CD1 3.65Å; Y178-I200 HydrophobicContact CG-CG1 3.89Å; Y178-R317 VanDerWaalsContact CE1-CZ 3.44Å; Y178-R317 VanDerWaalsContact CE2-NH1 3.34Å; Y178-R317 VanDerWaalsContact CZ-CZ 3.46Å |
| 179 | W | 87.8 | Confident | 79.7 | Confident | 121 Ų | 121 | 78.8 Ų | 78.8 | 46% | 0.458 | 43% | 0.425 | S | S | . | . | S | Bend | trans | -115.3 | 28.6 | -179.8 | -58.7 | 102.2 | 0 | 0 | 0 | 111.2 | S177 F187 I200 | S177-W179 PolarHBondContact OG-N 3.38Å; W179-F187 HydrophobicContact CH2-CD1 4Å; W179-F187 HydrophobicContact CH2-CD2 4.25Å; W179-F187 HydrophobicContact CH2-CE1 4.03Å; W179-F187 HydrophobicContact CH2-CE2 4.27Å; W179-F187 HydrophobicContact CH2-CG 4.14Å; W179-F187 HydrophobicContact CH2-CZ 4.18Å; W179-F187 AromaticContact CZ3-CD1 3.66Å; W179-F187 HydrophobicContact CZ3-CD1 3.66Å; W179-F187 HydrophobicContact CZ3-CE1 4.01Å; W179-F187 AromaticContact CZ3-CG 3.97Å; W179-F187 HydrophobicContact CZ3-CG 3.97Å; W179-I200 HydrophobicContact CH2-CG2 3.94Å; W179-I200 HydrophobicContact CZ2-CG2 3.47Å; W179-I200 VanDerWaalsContact CZ2-CG2 3.47Å |
| 180 | D | 86.6 | Confident | 80.3 | Confident | 63 Ų | 63 | 75.6 Ų | 75.6 | 34% | 0.337 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -65.9 | 161.4 | 160.8 | 71.1 | -89.3 | 0 | 0 | 0 | 110.4 | G182 S183 A184 | D180-G182 VanDerWaalsContact C-N 3.26Å; D180-G182 PolarHBondContact O-N 3.26Å; D180-G182 VanDerWaalsContact O-N 3.17Å; D180-G182 WeakPolarHBondContact OD2-CA 3.42Å; D180-G182 PolarHBondContact OD2-N 3.2Å; D180-S183 PolarHBondContact O-N 3.08Å; D180-S183 WeakPolarHBondContact OD1-CB 3.43Å; D180-S183 PolarHBondContact OD1-OG 3.14Å; D180-S183 PolarHBondContact OD2-N 2.85Å; D180-S183 PolarHBondContact OD2-OG 2.83Å; D180-A184 WeakPolarHBondContact O-CB 3.46Å; D180-A184 PolarHBondContact O-N 3.5Å |
| 181 | M | 86.6 | Confident | 81.1 | Confident | 168 Ų | 168 | 69.7 Ų | 69.7 | 83% | 0.828 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -55.8 | -36.6 | -175.8 | -173.4 | 64.1 | 73.2 | 0 | 0 | 113.6 | F185 | M181-F185 VanDerWaalsContact O-CB 3.27Å; M181-F185 WeakPolarHBondContact O-CB 3.18Å; M181-F185 PolarHBondContact O-N 3.41Å |
| 182 | G | 84.6 | Confident | 82.4 | Confident | 32 Ų | 32 | 68.1 Ų | 68.1 | 33% | 0.33 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -75.8 | -43.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | D180 F186 | D180-G182 VanDerWaalsContact C-N 3.26Å; D180-G182 PolarHBondContact O-N 3.26Å; D180-G182 VanDerWaalsContact O-N 3.17Å; D180-G182 WeakPolarHBondContact OD2-CA 3.42Å; D180-G182 PolarHBondContact OD2-N 3.2Å; G182-F186 WeakPolarHBondContact O-CB 3.36Å; G182-F186 PolarHBondContact O-N 3.22Å |
| 183 | S | 85.8 | Confident | 84.3 | Confident | 8 Ų | 8 | 60.7 Ų | 60.7 | 6% | 0.056 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -71.1 | -35.8 | 175.4 | -54.1 | 0 | 0 | 0 | 0 | 112.2 | Y178 D180 F186 F187 K326 | Y178-S183 WeakPolarHBondContact O-CB 3.13Å; D180-S183 PolarHBondContact O-N 3.08Å; D180-S183 WeakPolarHBondContact OD1-CB 3.43Å; D180-S183 PolarHBondContact OD1-OG 3.14Å; D180-S183 PolarHBondContact OD2-N 2.85Å; D180-S183 PolarHBondContact OD2-OG 2.83Å; S183-F186 PolarHBondContact O-N 3.43Å; S183-F187 WeakPolarHBondContact O-CB 3.32Å; S183-F187 PolarHBondContact O-N 3.21Å; S183-K326 PolarHBondContact OG-NZ 3.11Å |
| 184 | A | 90.4 | Very high | 86.2 | Confident | 27 Ų | 27 | 59.5 Ų | 59.5 | 22% | 0.223 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | D180 F186 F187 V188 | D180-A184 WeakPolarHBondContact O-CB 3.46Å; D180-A184 PolarHBondContact O-N 3.5Å; A184-F186 VanDerWaalsContact C-N 3.34Å; A184-F186 PolarHBondContact O-N 3Å; A184-F187 PolarHBondContact O-N 3.22Å; A184-V188 PolarHBondContact O-N 2.64Å |
| 185 | F | 89.6 | Confident | 88 | Confident | 109 Ų | 109 | 50.7 Ų | 50.7 | 48% | 0.478 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60 | -43.3 | 172.1 | -179.8 | -93.4 | 0 | 0 | 0 | 111.8 | M181 V188 G189 W330 | M181-F185 VanDerWaalsContact O-CB 3.27Å; M181-F185 WeakPolarHBondContact O-CB 3.18Å; M181-F185 PolarHBondContact O-N 3.41Å; F185-V188 WeakPolarHBondContact O-CG2 3.43Å; F185-G189 PolarHBondContact O-N 2.99Å; F185-W330 HydrophobicContact CE1-CD2 4.01Å; F185-W330 AromaticContact CE1-CG 3.96Å; F185-W330 HydrophobicContact CE1-CG 3.96Å; F185-W330 HydrophobicContact CZ-CD2 4.36Å |
| 186 | F | 89.6 | Confident | 89.2 | Confident | 19 Ų | 19 | 45.1 Ų | 45.1 | 8% | 0.083 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 175.2 | -174.7 | -97.2 | 0 | 0 | 0 | 111.8 | G182 S183 A184 G189 T190 Y197 V312 V329 I333 | G182-F186 WeakPolarHBondContact O-CB 3.36Å; G182-F186 PolarHBondContact O-N 3.22Å; S183-F186 PolarHBondContact O-N 3.43Å; A184-F186 VanDerWaalsContact C-N 3.34Å; A184-F186 PolarHBondContact O-N 3Å; F186-G189 CarbonylContact O-C 3.54Å; F186-G189 WeakPolarHBondContact O-CA 3.48Å; F186-G189 PolarHBondContact O-N 3.39Å; F186-G189 VanDerWaalsContact O-N 3.17Å; F186-T190 HydrophobicContact CD1-CG2 4.24Å; F186-T190 HydrophobicContact CE1-CG2 4.03Å; F186-T190 HydrophobicContact CZ-CG2 4.46Å; F186-T190 WeakPolarHBondContact O-CG2 3.39Å; F186-T190 PolarHBondContact O-N 3.32Å; F186-Y197 HydrophobicContact CE1-CD2 4.04Å; F186-Y197 AromaticContact CE1-CE2 3.71Å; F186-Y197 HydrophobicContact CE1-CE2 3.71Å; F186-Y197 HydrophobicContact CZ-CD2 4.42Å; F186-Y197 AromaticContact CZ-CE2 3.64Å; F186-Y197 HydrophobicContact CZ-CE2 3.64Å; F186-V312 HydrophobicContact CE1-CG1 3.76Å; F186-V312 HydrophobicContact CZ-CG1 4.11Å; F186-V329 HydrophobicContact CE2-CG1 4.08Å; F186-I333 HydrophobicContact CE2-CD1 4.44Å |
| 187 | F | 91.6 | Very high | 90.2 | Very high | 28 Ų | 28 | 43.3 Ų | 43.3 | 12% | 0.123 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.8 | -49.7 | 176.5 | 168.7 | -93.3 | 0 | 0 | 0 | 112.8 | W179 S183 A184 G189 T190 V191 I200 P202 | W179-F187 HydrophobicContact CH2-CD1 4Å; W179-F187 HydrophobicContact CH2-CD2 4.25Å; W179-F187 HydrophobicContact CH2-CE1 4.03Å; W179-F187 HydrophobicContact CH2-CE2 4.27Å; W179-F187 HydrophobicContact CH2-CG 4.14Å; W179-F187 HydrophobicContact CH2-CZ 4.18Å; W179-F187 AromaticContact CZ3-CD1 3.66Å; W179-F187 HydrophobicContact CZ3-CD1 3.66Å; W179-F187 HydrophobicContact CZ3-CE1 4.01Å; W179-F187 AromaticContact CZ3-CG 3.97Å; W179-F187 HydrophobicContact CZ3-CG 3.97Å; S183-F187 WeakPolarHBondContact O-CB 3.32Å; S183-F187 PolarHBondContact O-N 3.21Å; A184-F187 PolarHBondContact O-N 3.22Å; F187-G189 PolarHBondContact O-N 3.42Å; F187-T190 PolarHBondContact O-N 2.89Å; F187-T190 PolarHBondContact O-OG1 3.25Å; F187-V191 HydrophobicContact CE1-CG2 4.02Å; F187-V191 HydrophobicContact CE2-CG2 4.21Å; F187-V191 HydrophobicContact CZ-CG2 3.77Å; F187-V191 PolarHBondContact O-N 2.74Å; F187-V191 VanDerWaalsContact O-N 3.13Å; F187-I200 WeakPolarHBondContact CE2-O 3.42Å; F187-P202 HydrophobicContact CZ-CG 4.41Å |
| 188 | V | 93.4 | Very high | 90.4 | Very high | 39 Ų | 39 | 42.8 Ų | 42.8 | 24% | 0.236 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64.6 | -29.8 | 177.3 | -59.7 | 0 | 0 | 0 | 0 | 111.3 | A184 F185 V191 I192 Y214 | A184-V188 PolarHBondContact O-N 2.64Å; F185-V188 WeakPolarHBondContact O-CG2 3.43Å; V188-V191 PolarHBondContact O-N 2.96Å; V188-I192 PolarHBondContact O-N 3.45Å; V188-I192 VanDerWaalsContact O-N 3.14Å; V188-Y214 HydrophobicContact CB-CE1 3.64Å; V188-Y214 HydrophobicContact CG1-CE1 4.2Å |
| 189 | G | 92.9 | Very high | 90.7 | Very high | 3 Ų | 3 | 43.8 Ų | 43.8 | 3% | 0.031 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -56.7 | -48.2 | 166.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | F185 F186 F187 V191 I192 T193 | F185-G189 PolarHBondContact O-N 2.99Å; F186-G189 CarbonylContact O-C 3.54Å; F186-G189 WeakPolarHBondContact O-CA 3.48Å; F186-G189 PolarHBondContact O-N 3.39Å; F186-G189 VanDerWaalsContact O-N 3.17Å; F187-G189 PolarHBondContact O-N 3.42Å; G189-V191 VanDerWaalsContact C-N 3.27Å; G189-V191 PolarHBondContact O-N 3.21Å; G189-I192 PolarHBondContact O-N 3.01Å; G189-T193 WeakPolarHBondContact O-CB 3.4Å; G189-T193 VanDerWaalsContact O-CG2 3.23Å; G189-T193 WeakPolarHBondContact O-CG2 3.29Å; G189-T193 PolarHBondContact O-N 3.4Å; G189-T193 PolarHBondContact O-OG1 2.87Å |
| 190 | T | 93.8 | Very high | 90.6 | Very high | 9 Ų | 9 | 39.1 Ų | 39.1 | 6% | 0.055 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -69.6 | -25.5 | -179.2 | 62.7 | 0 | 0 | 0 | 0 | 112.4 | F186 F187 T193 T194 I195 G196 Y197 | F186-T190 HydrophobicContact CD1-CG2 4.24Å; F186-T190 HydrophobicContact CE1-CG2 4.03Å; F186-T190 HydrophobicContact CZ-CG2 4.46Å; F186-T190 WeakPolarHBondContact O-CG2 3.39Å; F186-T190 PolarHBondContact O-N 3.32Å; F187-T190 PolarHBondContact O-N 2.89Å; F187-T190 PolarHBondContact O-OG1 3.25Å; T190-T193 VanDerWaalsContact CA-OG1 3.32Å; T190-T193 WeakPolarHBondContact CA-OG1 3.37Å; T190-T193 PolarHBondContact O-OG1 3.04Å; T190-T194 PolarHBondContact O-N 3.38Å; T190-I195 PolarHBondContact O-N 3.42Å; T190-I195 VanDerWaalsContact O-N 3.12Å; T190-G196 PolarHBondContact O-N 2.86Å; T190-Y197 HydrophobicContact CG2-CD2 3.48Å; T190-Y197 VanDerWaalsContact CG2-CD2 3.48Å; T190-Y197 HydrophobicContact CG2-CE2 3.48Å; T190-Y197 VanDerWaalsContact CG2-CE2 3.48Å |
| 191 | V | 95.6 | Very high | 90.7 | Very high | 23 Ų | 23 | 38.3 Ų | 38.3 | 14% | 0.139 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -69.5 | -53.8 | 171.3 | 177.4 | 0 | 0 | 0 | 0 | 111.6 | F187 V188 G189 T193 T194 Y214 A215 | F187-V191 HydrophobicContact CE1-CG2 4.02Å; F187-V191 HydrophobicContact CE2-CG2 4.21Å; F187-V191 HydrophobicContact CZ-CG2 3.77Å; F187-V191 PolarHBondContact O-N 2.74Å; F187-V191 VanDerWaalsContact O-N 3.13Å; V188-V191 PolarHBondContact O-N 2.96Å; G189-V191 VanDerWaalsContact C-N 3.27Å; G189-V191 PolarHBondContact O-N 3.21Å; V191-T193 VanDerWaalsContact C-N 3.35Å; V191-T193 PolarHBondContact O-N 3.39Å; V191-T194 PolarHBondContact O-N 2.96Å; V191-T194 VanDerWaalsContact O-N 3.14Å; V191-Y214 HydrophobicContact CB-CD1 4.4Å; V191-Y214 HydrophobicContact CB-CE1 4.34Å; V191-Y214 HydrophobicContact CG1-CD1 3.98Å; V191-Y214 HydrophobicContact CG1-CE1 4.33Å; V191-A215 HydrophobicContact CG1-CB 3.92Å |
| 192 | I | 95.8 | Very high | 91 | Very high | 26 Ų | 26 | 31.6 Ų | 31.6 | 13% | 0.133 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -71.1 | -28.5 | -176.5 | 67.8 | 178 | 0 | 0 | 0 | 113.7 | V188 G189 T194 Y214 F222 | V188-I192 PolarHBondContact O-N 3.45Å; V188-I192 VanDerWaalsContact O-N 3.14Å; G189-I192 PolarHBondContact O-N 3.01Å; I192-T194 PolarHBondContact O-N 3.2Å; I192-Y214 HydrophobicContact CG2-CD1 4.3Å; I192-Y214 HydrophobicContact CG2-CE1 3.41Å; I192-Y214 VanDerWaalsContact CG2-CE1 3.41Å; I192-Y214 WeakPolarHBondContact CG2-OH 3.42Å; I192-F222 HydrophobicContact CB-CB 4.13Å; I192-F222 HydrophobicContact CD1-CD2 4.3Å; I192-F222 HydrophobicContact CG1-CB 4.33Å; I192-F222 HydrophobicContact CG1-CD2 4.27Å; I192-F222 HydrophobicContact CG1-CG 4.42Å; I192-F222 WeakPolarHBondContact O-CB 3.31Å; I192-F222 WeakPolarHBondContact O-CD1 3.39Å; I192-F222 WeakPolarHBondContact O-CG 3.49Å |
| 193 | T | 94.8 | Very high | 91.2 | Very high | 3 Ų | 3 | 33.2 Ų | 33.2 | 2% | 0.018 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.2 | -7.8 | 173.8 | 53.6 | 0 | 0 | 0 | 0 | 113.1 | G189 T190 V191 I195 F222 I333 L337 | G189-T193 WeakPolarHBondContact O-CB 3.4Å; G189-T193 VanDerWaalsContact O-CG2 3.23Å; G189-T193 WeakPolarHBondContact O-CG2 3.29Å; G189-T193 PolarHBondContact O-N 3.4Å; G189-T193 PolarHBondContact O-OG1 2.87Å; T190-T193 VanDerWaalsContact CA-OG1 3.32Å; T190-T193 WeakPolarHBondContact CA-OG1 3.37Å; T190-T193 PolarHBondContact O-OG1 3.04Å; V191-T193 VanDerWaalsContact C-N 3.35Å; V191-T193 PolarHBondContact O-N 3.39Å; T193-I195 PolarHBondContact O-N 3.18Å; T193-F222 HydrophobicContact CG2-CD2 4.25Å; T193-F222 HydrophobicContact CG2-CE1 4.08Å; T193-F222 HydrophobicContact CG2-CE2 3.7Å; T193-F222 HydrophobicContact CG2-CZ 3.64Å; T193-I333 HydrophobicContact CG2-CG2 4.21Å; T193-L337 HydrophobicContact CG2-CD1 3.83Å |
| 194 | T | 95.6 | Very high | 91.6 | Very high | 73 Ų | 73 | 37.4 Ų | 37.4 | 45% | 0.448 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.7 | 19.4 | -172.3 | 59.5 | 0 | 0 | 0 | 0 | 115.1 | T190 V191 I192 I219 | T190-T194 PolarHBondContact O-N 3.38Å; V191-T194 PolarHBondContact O-N 2.96Å; V191-T194 VanDerWaalsContact O-N 3.14Å; I192-T194 PolarHBondContact O-N 3.2Å; T194-I219 HydrophobicContact CG2-CB 4.47Å; T194-I219 HydrophobicContact CG2-CD1 3.61Å; T194-I219 HydrophobicContact CG2-CG1 3.76Å; T194-I219 HydrophobicContact CG2-CG2 3.85Å |
| 195 | I | 95.4 | Very high | 91.8 | Very high | 5 Ų | 5 | 43.7 Ų | 43.7 | 3% | 0.026 | 27% | 0.267 | C | S | . | . | trans | -73.2 | -46.8 | 172.8 | -62.3 | 167.3 | 0 | 0 | 0 | 110.2 | T190 T193 Y197 T302 T305 G307 I333 L337 | T190-I195 PolarHBondContact O-N 3.42Å; T190-I195 VanDerWaalsContact O-N 3.12Å; T193-I195 PolarHBondContact O-N 3.18Å; I195-Y197 HydrophobicContact CG2-CD1 3.82Å; I195-Y197 HydrophobicContact CG2-CD2 4.38Å; I195-Y197 HydrophobicContact CG2-CE1 3.54Å; I195-Y197 HydrophobicContact CG2-CE2 4.11Å; I195-Y197 HydrophobicContact CG2-CG 4.23Å; I195-Y197 PolarHBondContact O-N 3.46Å; I195-T302 HydrophobicContact CD1-CG2 4.1Å; I195-T305 HydrophobicContact CG1-CG2 3.99Å; I195-G307 WeakPolarHBondContact O-CA 3.41Å; I195-I333 HydrophobicContact CD1-CD1 4.32Å; I195-I333 HydrophobicContact CD1-CG2 3.53Å; I195-L337 HydrophobicContact CD1-CD1 4.24Å | ||
| 196 | G | 92.9 | Very high | 92.2 | Very high | 44 Ų | 44 | 41 Ų | 41 | 45% | 0.454 | 27% | 0.269 | S | S | . | . | trans | 53.3 | 45.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | T190 G198 | T190-G196 PolarHBondContact O-N 2.86Å; G196-G198 PolarHBondContact O-N 3.27Å | ||
| 197 | Y | 90.9 | Very high | 92.5 | Very high | 6 Ų | 6 | 41 Ų | 41 | 2% | 0.024 | 28% | 0.275 | C | S | . | . | trans | -43.9 | -20.8 | -174.3 | -61.3 | -64 | 0 | 0 | 0 | 117.9 | F186 T190 I195 N199 F298 T302 G307 G309 V312 | F186-Y197 HydrophobicContact CE1-CD2 4.04Å; F186-Y197 AromaticContact CE1-CE2 3.71Å; F186-Y197 HydrophobicContact CE1-CE2 3.71Å; F186-Y197 HydrophobicContact CZ-CD2 4.42Å; F186-Y197 AromaticContact CZ-CE2 3.64Å; F186-Y197 HydrophobicContact CZ-CE2 3.64Å; T190-Y197 HydrophobicContact CG2-CD2 3.48Å; T190-Y197 VanDerWaalsContact CG2-CD2 3.48Å; T190-Y197 HydrophobicContact CG2-CE2 3.48Å; T190-Y197 VanDerWaalsContact CG2-CE2 3.48Å; I195-Y197 HydrophobicContact CG2-CD1 3.82Å; I195-Y197 HydrophobicContact CG2-CD2 4.38Å; I195-Y197 HydrophobicContact CG2-CE1 3.54Å; I195-Y197 HydrophobicContact CG2-CE2 4.11Å; I195-Y197 HydrophobicContact CG2-CG 4.23Å; I195-Y197 PolarHBondContact O-N 3.46Å; Y197-N199 PolarHBondContact O-N 2.92Å; Y197-F298 AromaticContact CE1-CE2 3.99Å; Y197-F298 HydrophobicContact CE1-CE2 3.99Å; Y197-T302 VanDerWaalsContact OH-CG2 3.25Å; Y197-T302 WeakPolarHBondContact OH-CG2 3.28Å; Y197-T302 PolarHBondContact OH-OG1 2.99Å; Y197-G307 WeakPolarHBondContact CA-O 3.36Å; Y197-G309 WeakPolarHBondContact O-CA 3.37Å; Y197-V312 HydrophobicContact CD1-CG2 4.03Å; Y197-V312 HydrophobicContact CD2-CG1 4.01Å; Y197-V312 HydrophobicContact CD2-CG2 4.11Å; Y197-V312 HydrophobicContact CE2-CG1 4.13Å; Y197-V312 HydrophobicContact CG-CG2 3.8Å | ||
| 198 | G | 86.6 | Confident | 92.7 | Very high | 57 Ų | 57 | 44.7 Ų | 44.7 | 59% | 0.588 | 29% | 0.291 | S | S | * | . | trans | 71.7 | -17.1 | 176 | 0 | 0 | 0 | 0 | 0 | 116.1 | G196 I200 | G196-G198 PolarHBondContact O-N 3.27Å; G198-I200 PolarHBondContact O-N 2.96Å; G198-I200 VanDerWaalsContact O-N 3.08Å | ||
| 199 | N | 83.9 | Confident | 92.9 | Very high | 56 Ų | 56 | 47.9 Ų | 47.9 | 30% | 0.299 | 31% | 0.306 | S | S | . | . | S | Bend | trans | -57.8 | -21.4 | 176 | 77.2 | -49.6 | 0 | 0 | 0 | 114.1 | Y197 V312 | Y197-N199 PolarHBondContact O-N 2.92Å; N199-V312 HydrophobicContact CB-CG2 4.2Å |
| 200 | I | 85.4 | Confident | 93.1 | Very high | 23 Ų | 23 | 54 Ų | 54 | 12% | 0.118 | 33% | 0.332 | C | S | . | . | S | Bend | trans | -137.5 | 127 | 170 | -58.6 | 160.8 | 0 | 0 | 0 | 106.8 | Y178 W179 F187 G198 | Y178-I200 HydrophobicContact CD1-CD1 3.68Å; Y178-I200 HydrophobicContact CD1-CG1 4.29Å; Y178-I200 HydrophobicContact CD2-CD1 4.2Å; Y178-I200 HydrophobicContact CD2-CG1 3.93Å; Y178-I200 HydrophobicContact CE1-CD1 4.33Å; Y178-I200 HydrophobicContact CE2-CG1 4.38Å; Y178-I200 HydrophobicContact CG-CD1 3.65Å; Y178-I200 HydrophobicContact CG-CG1 3.89Å; W179-I200 HydrophobicContact CH2-CG2 3.94Å; W179-I200 HydrophobicContact CZ2-CG2 3.47Å; W179-I200 VanDerWaalsContact CZ2-CG2 3.47Å; F187-I200 WeakPolarHBondContact CE2-O 3.42Å; G198-I200 PolarHBondContact O-N 2.96Å; G198-I200 VanDerWaalsContact O-N 3.08Å |
| 201 | A | 89.9 | Confident | 93.2 | Very high | 47 Ų | 47 | 54.9 Ų | 54.9 | 39% | 0.388 | 34% | 0.338 | S | S | . | . | trans | -136.4 | 150 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | S203 | A201-S203 PolarHBondContact O-N 3Š| ||
| 202 | P | 92.4 | Very high | 93.3 | Very high | 26 Ų | 26 | 58.8 Ų | 58.8 | 17% | 0.169 | 36% | 0.357 | C | S | . | . | trans | -68.5 | 107.5 | 177.9 | 27.5 | -32.9 | 0 | 0 | 0 | 109.7 | F187 K208 C211 | F187-P202 HydrophobicContact CZ-CG 4.41Å; P202-K208 HydrophobicContact CG-CG 4.41Å; P202-K208 WeakPolarHBondContact O-CE 3.26Å; P202-K208 VanDerWaalsContact O-CG 3.26Å; P202-K208 WeakPolarHBondContact O-CG 3.19Å; P202-C211 HydrophobicContact CG-CB 4.08Å | ||
| 203 | S | 89.4 | Confident | 93.4 | Very high | 67 Ų | 67 | 62.1 Ų | 62.1 | 47% | 0.469 | 38% | 0.375 | S | S | . | . | trans | -77.1 | -32.8 | 179.7 | -67.6 | 0 | 0 | 0 | 0 | 112.7 | A201 K208 | A201-S203 PolarHBondContact O-N 3Å; S203-K208 WeakPolarHBondContact O-CE 3.47Å; S203-K208 PolarHBondContact O-NZ 2.9Å | ||
| 204 | T | 93 | Very high | 93.5 | Very high | 96 Ų | 96 | 65.2 Ų | 65.2 | 59% | 0.589 | 39% | 0.387 | S | S | * | . | S | Bend | trans | -74.3 | 149.2 | -178.2 | 61.1 | 0 | 0 | 0 | 0 | 112.6 | G207 K208 | T204-G207 PolarHBondContact O-N 3.38Å; T204-G207 PolarHBondContact OG1-N 2.93Å; T204-K208 WeakPolarHBondContact O-CG 3.41Å; T204-K208 PolarHBondContact O-N 2.96Å |
| 205 | E | 95.4 | Very high | 93.6 | Very high | 159 Ų | 159 | 62.9 Ų | 62.9 | 74% | 0.743 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -60.5 | -47.9 | 179.1 | -60.4 | -177 | 161.8 | 0 | 0 | 112.1 | G207 K208 I209 | E205-G207 VanDerWaalsContact C-N 3.29Å; E205-G207 PolarHBondContact O-N 3.41Å; E205-K208 WeakPolarHBondContact O-CB 3.06Å; E205-K208 PolarHBondContact O-N 2.86Å; E205-K208 VanDerWaalsContact O-N 3.16Å; E205-I209 WeakPolarHBondContact O-CG1 3.32Å; E205-I209 PolarHBondContact O-N 3.48Å |
| 206 | G | 97.3 | Very high | 93.7 | Very high | 51 Ų | 51 | 67.4 Ų | 67.4 | 53% | 0.526 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.2 | -37.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | I209 F210 | G206-I209 PolarHBondContact O-N 3.27Å; G206-F210 VanDerWaalsContact O-CB 3.31Å; G206-F210 WeakPolarHBondContact O-CB 3.33Å; G206-F210 PolarHBondContact O-N 3.44Å |
| 207 | G | 95.5 | Very high | 93.9 | Very high | 20 Ų | 20 | 72.7 Ų | 72.7 | 21% | 0.206 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -65.8 | -39.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | T204 E205 C211 | T204-G207 PolarHBondContact O-N 3.38Å; T204-G207 PolarHBondContact OG1-N 2.93Å; E205-G207 VanDerWaalsContact C-N 3.29Å; E205-G207 PolarHBondContact O-N 3.41Å; G207-C211 VanDerWaalsContact O-CB 3.24Å; G207-C211 WeakPolarHBondContact O-CB 3.5Å; G207-C211 PolarHBondContact O-N 3.44Å |
| 208 | K | 96.2 | Very high | 94.2 | Very high | 106 Ų | 106 | 72.8 Ų | 72.8 | 46% | 0.461 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64.5 | -47.9 | 174.6 | -70.9 | 160 | 173.2 | 158.2 | 0 | 111.3 | P202 S203 T204 E205 C211 I212 | P202-K208 HydrophobicContact CG-CG 4.41Å; P202-K208 WeakPolarHBondContact O-CE 3.26Å; P202-K208 VanDerWaalsContact O-CG 3.26Å; P202-K208 WeakPolarHBondContact O-CG 3.19Å; S203-K208 WeakPolarHBondContact O-CE 3.47Å; S203-K208 PolarHBondContact O-NZ 2.9Å; T204-K208 WeakPolarHBondContact O-CG 3.41Å; T204-K208 PolarHBondContact O-N 2.96Å; E205-K208 WeakPolarHBondContact O-CB 3.06Å; E205-K208 PolarHBondContact O-N 2.86Å; E205-K208 VanDerWaalsContact O-N 3.16Å; K208-C211 PolarHBondContact O-N 3.31Å; K208-I212 WeakPolarHBondContact O-CG1 3.36Å; K208-I212 PolarHBondContact O-N 3.44Å |
| 209 | I | 97.8 | Very high | 94.6 | Very high | 106 Ų | 106 | 73.3 Ų | 73.3 | 54% | 0.544 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60.9 | -46.1 | 177.4 | -66 | 164.8 | 0 | 0 | 0 | 110.8 | E205 G206 I212 L213 | E205-I209 WeakPolarHBondContact O-CG1 3.32Å; E205-I209 PolarHBondContact O-N 3.48Å; G206-I209 PolarHBondContact O-N 3.27Å; I209-I212 PolarHBondContact O-N 3.16Å; I209-L213 HydrophobicContact CG2-CD1 4.5Å; I209-L213 PolarHBondContact O-N 2.88Å |
| 210 | F | 97.3 | Very high | 95.2 | Very high | 132 Ų | 132 | 74.8 Ų | 74.8 | 58% | 0.579 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -61.9 | -43.5 | 176 | -179.6 | -97.7 | 0 | 0 | 0 | 112 | G206 I212 L213 Y214 | G206-F210 VanDerWaalsContact O-CB 3.31Å; G206-F210 WeakPolarHBondContact O-CB 3.33Å; G206-F210 PolarHBondContact O-N 3.44Å; F210-I212 VanDerWaalsContact C-N 3.32Å; F210-I212 PolarHBondContact O-N 3.01Å; F210-L213 PolarHBondContact O-N 3.21Å; F210-Y214 HydrophobicContact CE1-CD2 4.45Å; F210-Y214 HydrophobicContact CE1-CG 4.33Å; F210-Y214 HydrophobicContact CZ-CD2 4.36Å; F210-Y214 WeakPolarHBondContact O-CB 3.45Å; F210-Y214 PolarHBondContact O-N 2.96Å |
| 211 | C | 97 | Very high | 95.7 | Very high | 27 Ų | 27 | 79.6 Ų | 79.6 | 18% | 0.182 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -59.8 | -40.7 | 178.3 | -169.1 | 0 | 0 | 0 | 0 | 112.3 | P202 G207 K208 Y214 A215 | P202-C211 HydrophobicContact CG-CB 4.08Å; G207-C211 VanDerWaalsContact O-CB 3.24Å; G207-C211 WeakPolarHBondContact O-CB 3.5Å; G207-C211 PolarHBondContact O-N 3.44Å; K208-C211 PolarHBondContact O-N 3.31Å; C211-Y214 PolarHBondContact O-N 3.49Å; C211-A215 VanDerWaalsContact O-CB 3.3Å; C211-A215 WeakPolarHBondContact O-CB 3.39Å; C211-A215 PolarHBondContact O-N 3.45Å |
| 212 | I | 97.4 | Very high | 95.9 | Very high | 105 Ų | 105 | 78 Ų | 78 | 54% | 0.538 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -60.4 | -51.8 | 175.7 | -68 | 162.3 | 0 | 0 | 0 | 110.7 | K208 I209 F210 Y214 A215 I216 | K208-I212 WeakPolarHBondContact O-CG1 3.36Å; K208-I212 PolarHBondContact O-N 3.44Å; I209-I212 PolarHBondContact O-N 3.16Å; F210-I212 VanDerWaalsContact C-N 3.32Å; F210-I212 PolarHBondContact O-N 3.01Å; I212-Y214 VanDerWaalsContact C-N 3.34Å; I212-Y214 PolarHBondContact O-N 3.47Å; I212-A215 PolarHBondContact O-N 3.18Å; I212-I216 HydrophobicContact CG2-CD1 3.93Å; I212-I216 WeakPolarHBondContact O-CD1 3.43Å; I212-I216 VanDerWaalsContact O-CG1 3.28Å; I212-I216 WeakPolarHBondContact O-CG1 3.37Å; I212-I216 PolarHBondContact O-N 2.98Å; I212-I216 VanDerWaalsContact O-N 3.15Å |
| 213 | L | 97.7 | Very high | 96 | Very high | 95 Ų | 95 | 78.5 Ų | 78.5 | 50% | 0.497 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.8 | -41.8 | 179 | -65.7 | 174.3 | 0 | 0 | 0 | 111.8 | I209 F210 I216 F217 | I209-L213 HydrophobicContact CG2-CD1 4.5Å; I209-L213 PolarHBondContact O-N 2.88Å; F210-L213 PolarHBondContact O-N 3.21Å; L213-I216 PolarHBondContact O-N 3.18Å; L213-F217 VanDerWaalsContact O-CD2 3.31Å; L213-F217 WeakPolarHBondContact O-CD2 3.46Å; L213-F217 PolarHBondContact O-N 3.02Å |
| 214 | Y | 97.3 | Very high | 96.1 | Very high | 69 Ų | 69 | 83.3 Ų | 83.3 | 27% | 0.271 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.4 | -41.8 | 179.1 | -178.1 | -104.8 | 0 | 0 | 0 | 112.3 | V188 V191 I192 F210 C211 I212 G218 | V188-Y214 HydrophobicContact CB-CE1 3.64Å; V188-Y214 HydrophobicContact CG1-CE1 4.2Å; V191-Y214 HydrophobicContact CB-CD1 4.4Å; V191-Y214 HydrophobicContact CB-CE1 4.34Å; V191-Y214 HydrophobicContact CG1-CD1 3.98Å; V191-Y214 HydrophobicContact CG1-CE1 4.33Å; I192-Y214 HydrophobicContact CG2-CD1 4.3Å; I192-Y214 HydrophobicContact CG2-CE1 3.41Å; I192-Y214 VanDerWaalsContact CG2-CE1 3.41Å; I192-Y214 WeakPolarHBondContact CG2-OH 3.42Å; F210-Y214 HydrophobicContact CE1-CD2 4.45Å; F210-Y214 HydrophobicContact CE1-CG 4.33Å; F210-Y214 HydrophobicContact CZ-CD2 4.36Å; F210-Y214 WeakPolarHBondContact O-CB 3.45Å; F210-Y214 PolarHBondContact O-N 2.96Å; C211-Y214 PolarHBondContact O-N 3.49Å; I212-Y214 VanDerWaalsContact C-N 3.34Å; I212-Y214 PolarHBondContact O-N 3.47Å; Y214-G218 WeakPolarHBondContact O-CA 3.38Å; Y214-G218 PolarHBondContact O-N 3.44Å |
| 215 | A | 97.1 | Very high | 96.1 | Very high | 23 Ų | 23 | 82.3 Ų | 82.3 | 19% | 0.19 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.8 | -42.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | V191 C211 I212 F217 G218 I219 | V191-A215 HydrophobicContact CG1-CB 3.92Å; C211-A215 VanDerWaalsContact O-CB 3.3Å; C211-A215 WeakPolarHBondContact O-CB 3.39Å; C211-A215 PolarHBondContact O-N 3.45Å; I212-A215 PolarHBondContact O-N 3.18Å; A215-F217 VanDerWaalsContact C-N 3.31Å; A215-F217 PolarHBondContact O-N 3.45Å; A215-G218 PolarHBondContact O-N 2.96Å; A215-I219 HydrophobicContact CB-CD1 3.98Å; A215-I219 WeakPolarHBondContact O-CB 3.43Å; A215-I219 WeakPolarHBondContact O-CG1 3.34Å; A215-I219 PolarHBondContact O-N 2.9Å |
| 216 | I | 97.2 | Very high | 95.9 | Very high | 100 Ų | 100 | 76.7 Ų | 76.7 | 51% | 0.513 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -57.1 | -41.1 | -178.6 | -73.5 | 164.8 | 0 | 0 | 0 | 112.3 | I212 L213 P220 | I212-I216 HydrophobicContact CG2-CD1 3.93Å; I212-I216 WeakPolarHBondContact O-CD1 3.43Å; I212-I216 VanDerWaalsContact O-CG1 3.28Å; I212-I216 WeakPolarHBondContact O-CG1 3.37Å; I212-I216 PolarHBondContact O-N 2.98Å; I212-I216 VanDerWaalsContact O-N 3.15Å; L213-I216 PolarHBondContact O-N 3.18Å; I216-P220 WeakPolarHBondContact O-CD 3.5Å; I216-P220 WeakPolarHBondContact O-CG 3.35Å |
| 217 | F | 96.6 | Very high | 95.4 | Very high | 155 Ų | 155 | 77 Ų | 77 | 68% | 0.68 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -93.2 | -33.1 | 178.1 | -62.8 | -70.6 | 0 | 0 | 0 | 113.4 | L213 A215 L221 | L213-F217 VanDerWaalsContact O-CD2 3.31Å; L213-F217 WeakPolarHBondContact O-CD2 3.46Å; L213-F217 PolarHBondContact O-N 3.02Å; A215-F217 VanDerWaalsContact C-N 3.31Å; A215-F217 PolarHBondContact O-N 3.45Å; F217-L221 WeakPolarHBondContact O-CB 3.32Å; F217-L221 PolarHBondContact O-N 3.42Å |
| 218 | G | 96.8 | Very high | 95.1 | Very high | 9 Ų | 9 | 77.8 Ų | 77.8 | 9% | 0.093 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -71.4 | -39.4 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y214 A215 L221 F222 | Y214-G218 WeakPolarHBondContact O-CA 3.38Å; Y214-G218 PolarHBondContact O-N 3.44Å; A215-G218 PolarHBondContact O-N 2.96Å; G218-L221 PolarHBondContact O-N 2.8Å; G218-F222 WeakPolarHBondContact O-CB 3.48Å; G218-F222 PolarHBondContact O-N 3.43Å |
| 219 | I | 96.3 | Very high | 94.8 | Very high | 68 Ų | 68 | 74.5 Ų | 74.5 | 35% | 0.349 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -67.3 | -45.9 | -179.2 | -62.9 | 165.6 | 0 | 0 | 0 | 111.5 | T194 A215 L221 F222 G223 | T194-I219 HydrophobicContact CG2-CB 4.47Å; T194-I219 HydrophobicContact CG2-CD1 3.61Å; T194-I219 HydrophobicContact CG2-CG1 3.76Å; T194-I219 HydrophobicContact CG2-CG2 3.85Å; A215-I219 HydrophobicContact CB-CD1 3.98Å; A215-I219 WeakPolarHBondContact O-CB 3.43Å; A215-I219 WeakPolarHBondContact O-CG1 3.34Å; A215-I219 PolarHBondContact O-N 2.9Å; I219-L221 PolarHBondContact O-N 3.44Å; I219-F222 PolarHBondContact O-N 3.34Å; I219-G223 PolarHBondContact O-N 3.05Å |
| 220 | P | 96.8 | Very high | 94.2 | Very high | 86 Ų | 86 | 70.4 Ų | 70.4 | 56% | 0.558 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -61.6 | -39.1 | 172.7 | -25.7 | 35.9 | 0 | 0 | 0 | 113.7 | I216 G223 F224 | I216-P220 WeakPolarHBondContact O-CD 3.5Å; I216-P220 WeakPolarHBondContact O-CG 3.35Å; P220-G223 PolarHBondContact O-N 2.9Å; P220-F224 PolarHBondContact O-N 3.47Å |
| 221 | L | 95.5 | Very high | 93.6 | Very high | 125 Ų | 125 | 69.8 Ų | 69.8 | 65% | 0.654 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -64.5 | -43.4 | 176.9 | -179.6 | 63 | 0 | 0 | 0 | 111.6 | F217 G218 I219 G223 F224 L225 | F217-L221 WeakPolarHBondContact O-CB 3.32Å; F217-L221 PolarHBondContact O-N 3.42Å; G218-L221 PolarHBondContact O-N 2.8Å; I219-L221 PolarHBondContact O-N 3.44Å; L221-G223 VanDerWaalsContact C-N 3.34Å; L221-F224 PolarHBondContact O-N 3.35Å; L221-L225 PolarHBondContact O-N 3.13Å; L221-L225 VanDerWaalsContact O-N 3.14Å |
| 222 | F | 94.6 | Very high | 93.1 | Very high | 14 Ų | 14 | 74.1 Ų | 74.1 | 6% | 0.061 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -64.4 | -38.7 | 172.9 | -177.1 | -98.5 | 0 | 0 | 0 | 111.7 | I192 T193 G218 I219 F224 L225 L226 L334 L337 | I192-F222 HydrophobicContact CB-CB 4.13Å; I192-F222 HydrophobicContact CD1-CD2 4.3Å; I192-F222 HydrophobicContact CG1-CB 4.33Å; I192-F222 HydrophobicContact CG1-CD2 4.27Å; I192-F222 HydrophobicContact CG1-CG 4.42Å; I192-F222 WeakPolarHBondContact O-CB 3.31Å; I192-F222 WeakPolarHBondContact O-CD1 3.39Å; I192-F222 WeakPolarHBondContact O-CG 3.49Å; T193-F222 HydrophobicContact CG2-CD2 4.25Å; T193-F222 HydrophobicContact CG2-CE1 4.08Å; T193-F222 HydrophobicContact CG2-CE2 3.7Å; T193-F222 HydrophobicContact CG2-CZ 3.64Å; G218-F222 WeakPolarHBondContact O-CB 3.48Å; G218-F222 PolarHBondContact O-N 3.43Å; I219-F222 PolarHBondContact O-N 3.34Å; F222-F224 VanDerWaalsContact C-N 3.32Å; F222-F224 PolarHBondContact O-N 3.48Å; F222-L225 HydrophobicContact CD2-CD2 4.43Å; F222-L225 WeakPolarHBondContact O-CB 3.33Å; F222-L225 PolarHBondContact O-N 3.26Å; F222-L226 HydrophobicContact CE1-CB 4.23Å; F222-L226 HydrophobicContact CE1-CD1 4.09Å; F222-L226 HydrophobicContact CE1-CD2 4.18Å; F222-L226 HydrophobicContact CE1-CG 4.41Å; F222-L226 HydrophobicContact CZ-CD1 4.04Å; F222-L226 VanDerWaalsContact O-CB 3.29Å; F222-L226 WeakPolarHBondContact O-CB 3.22Å; F222-L226 PolarHBondContact O-N 3.32Å; F222-L334 HydrophobicContact CE2-CD1 3.7Å; F222-L334 HydrophobicContact CZ-CD1 4.29Å; F222-L337 HydrophobicContact CE1-CD1 4.1Å; F222-L337 HydrophobicContact CZ-CD1 3.75Å |
| 223 | G | 93.1 | Very high | 92.4 | Very high | 35 Ų | 35 | 71.2 Ų | 71.2 | 36% | 0.361 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -58.6 | -39.9 | 174 | 0 | 0 | 0 | 0 | 0 | 113.4 | I219 P220 L221 A227 | I219-G223 PolarHBondContact O-N 3.05Å; P220-G223 PolarHBondContact O-N 2.9Å; L221-G223 VanDerWaalsContact C-N 3.34Å; G223-A227 WeakPolarHBondContact O-CB 3.49Å; G223-A227 PolarHBondContact O-N 3.19Å |
| 224 | F | 92.9 | Very high | 91.5 | Very high | 168 Ų | 168 | 68 Ų | 68 | 74% | 0.737 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -65.9 | -43.8 | 173.4 | 179.8 | -96.3 | 0 | 0 | 0 | 112.2 | P220 L221 F222 A227 G228 | P220-F224 PolarHBondContact O-N 3.47Å; L221-F224 PolarHBondContact O-N 3.35Å; F222-F224 VanDerWaalsContact C-N 3.32Å; F222-F224 PolarHBondContact O-N 3.48Å; F224-A227 PolarHBondContact O-N 3.48Å; F224-G228 PolarHBondContact O-N 3.33Å |
| 225 | L | 92.5 | Very high | 90.8 | Very high | 76 Ų | 76 | 67.3 Ų | 67.3 | 40% | 0.398 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.4 | -45.9 | 174.9 | 179 | 62 | 0 | 0 | 0 | 111.6 | L221 F222 A227 G228 I229 L334 | L221-L225 PolarHBondContact O-N 3.13Å; L221-L225 VanDerWaalsContact O-N 3.14Å; F222-L225 HydrophobicContact CD2-CD2 4.43Å; F222-L225 WeakPolarHBondContact O-CB 3.33Å; F222-L225 PolarHBondContact O-N 3.26Å; L225-A227 PolarHBondContact O-N 3.31Å; L225-G228 PolarHBondContact O-N 3.34Å; L225-I229 HydrophobicContact CD1-CD1 3.98Å; L225-I229 HydrophobicContact CD1-CG1 4.36Å; L225-I229 HydrophobicContact CG-CD1 3.99Å; L225-I229 WeakPolarHBondContact O-CG1 3.49Å; L225-I229 PolarHBondContact O-N 3.29Å; L225-L334 HydrophobicContact CD2-CD1 3.75Å; L225-L334 HydrophobicContact CG-CD1 4.18Å |
| 226 | L | 90.4 | Very high | 90.1 | Very high | 41 Ų | 41 | 70.9 Ų | 70.9 | 22% | 0.215 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.7 | -41.6 | 179.1 | -168.7 | 73.1 | 0 | 0 | 0 | 111.6 | F222 G230 L337 A338 A341 | F222-L226 HydrophobicContact CE1-CB 4.23Å; F222-L226 HydrophobicContact CE1-CD1 4.09Å; F222-L226 HydrophobicContact CE1-CD2 4.18Å; F222-L226 HydrophobicContact CE1-CG 4.41Å; F222-L226 HydrophobicContact CZ-CD1 4.04Å; F222-L226 VanDerWaalsContact O-CB 3.29Å; F222-L226 WeakPolarHBondContact O-CB 3.22Å; F222-L226 PolarHBondContact O-N 3.32Å; L226-G230 PolarHBondContact O-N 2.9Å; L226-L337 HydrophobicContact CD1-CB 3.79Å; L226-A338 HydrophobicContact CD1-CB 3.95Å; L226-A341 HydrophobicContact CD2-CB 4.43Å |
| 227 | A | 88.3 | Confident | 89.2 | Confident | 57 Ų | 57 | 67.9 Ų | 67.9 | 47% | 0.471 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.8 | -45.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G223 F224 L225 I229 G230 D231 | G223-A227 WeakPolarHBondContact O-CB 3.49Å; G223-A227 PolarHBondContact O-N 3.19Å; F224-A227 PolarHBondContact O-N 3.48Å; L225-A227 PolarHBondContact O-N 3.31Å; A227-I229 PolarHBondContact O-N 2.89Å; A227-G230 PolarHBondContact O-N 3.27Å; A227-D231 PolarHBondContact O-N 3.41Å |
| 228 | G | 89.1 | Confident | 88.4 | Confident | 37 Ų | 37 | 64.1 Ų | 64.1 | 38% | 0.381 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -61.8 | -40.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | F224 L225 Q232 | F224-G228 PolarHBondContact O-N 3.33Å; L225-G228 PolarHBondContact O-N 3.34Å; G228-Q232 WeakPolarHBondContact O-CG 3.32Å; G228-Q232 PolarHBondContact O-N 3.36Å |
| 229 | I | 89.1 | Confident | 87.7 | Confident | 37 Ų | 37 | 68 Ų | 68 | 19% | 0.19 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -70.6 | -40.8 | 174.6 | -60.9 | 168.3 | 0 | 0 | 0 | 110.4 | L225 A227 D231 Q232 L233 L334 A338 | L225-I229 HydrophobicContact CD1-CD1 3.98Å; L225-I229 HydrophobicContact CD1-CG1 4.36Å; L225-I229 HydrophobicContact CG-CD1 3.99Å; L225-I229 WeakPolarHBondContact O-CG1 3.49Å; L225-I229 PolarHBondContact O-N 3.29Å; A227-I229 PolarHBondContact O-N 2.89Å; I229-D231 PolarHBondContact O-N 2.96Å; I229-Q232 PolarHBondContact O-N 3.46Å; I229-L233 HydrophobicContact CG2-CD1 4.12Å; I229-L233 HydrophobicContact CG2-CG 4.33Å; I229-L233 WeakPolarHBondContact O-CG 3.46Å; I229-L233 PolarHBondContact O-N 3.15Å; I229-L334 HydrophobicContact CD1-CD1 3.7Å; I229-L334 HydrophobicContact CD1-CD2 4.01Å; I229-L334 HydrophobicContact CD1-CG 3.74Å; I229-A338 HydrophobicContact CB-CB 3.87Å; I229-A338 HydrophobicContact CG2-CB 3.41Å; I229-A338 VanDerWaalsContact CG2-CB 3.41Å |
| 230 | G | 85.4 | Confident | 86.9 | Confident | 20 Ų | 20 | 67.3 Ų | 67.3 | 21% | 0.206 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -58.4 | -43.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | L226 A227 L233 G234 | L226-G230 PolarHBondContact O-N 2.9Å; A227-G230 PolarHBondContact O-N 3.27Å; G230-L233 PolarHBondContact O-N 2.87Å; G230-G234 PolarHBondContact O-N 3.42Å |
| 231 | D | 84.6 | Confident | 86 | Confident | 118 Ų | 118 | 64.5 Ų | 64.5 | 63% | 0.631 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -62.3 | -44.9 | 173.6 | -90.2 | -10.4 | 0 | 0 | 0 | 111.6 | A227 I229 G234 T235 | A227-D231 PolarHBondContact O-N 3.41Å; I229-D231 PolarHBondContact O-N 2.96Å; D231-G234 CarbonylContact O-C 3.32Å; D231-G234 PolarHBondContact O-N 3.48Å; D231-T235 WeakPolarHBondContact O-CG2 3.47Å; D231-T235 PolarHBondContact O-N 3.28Å |
| 232 | Q | 86 | Confident | 85.2 | Confident | 119 Ų | 119 | 62.6 Ų | 62.6 | 56% | 0.556 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -61.4 | -49.2 | 177.4 | -69.4 | -62.5 | -20.2 | 0 | 0 | 111.6 | G228 I229 G234 T235 M236 | G228-Q232 WeakPolarHBondContact O-CG 3.32Å; G228-Q232 PolarHBondContact O-N 3.36Å; I229-Q232 PolarHBondContact O-N 3.46Å; Q232-G234 VanDerWaalsContact C-N 3.29Å; Q232-G234 PolarHBondContact O-N 2.97Å; Q232-T235 PolarHBondContact O-N 2.89Å; Q232-T235 PolarHBondContact O-OG1 3.27Å; Q232-M236 WeakPolarHBondContact O-CG 3.43Å; Q232-M236 PolarHBondContact O-N 3.08Å |
| 233 | L | 83.1 | Confident | 84.7 | Confident | 43 Ų | 43 | 69.8 Ų | 69.8 | 23% | 0.225 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -57.5 | -42.4 | 173.7 | -70.1 | 175.9 | 0 | 0 | 0 | 111.2 | I229 G230 M236 F237 A338 | I229-L233 HydrophobicContact CG2-CD1 4.12Å; I229-L233 HydrophobicContact CG2-CG 4.33Å; I229-L233 WeakPolarHBondContact O-CG 3.46Å; I229-L233 PolarHBondContact O-N 3.15Å; G230-L233 PolarHBondContact O-N 2.87Å; L233-M236 PolarHBondContact O-N 3.12Å; L233-F237 WeakPolarHBondContact O-CB 3.49Å; L233-F237 PolarHBondContact O-N 3.1Å; L233-A338 HydrophobicContact CD1-CB 3.74Å |
| 234 | G | 79.4 | Confident | 84 | Confident | 28 Ų | 28 | 70.9 Ų | 70.9 | 29% | 0.289 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -58.8 | -47.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | G230 D231 Q232 M236 F237 V238 | G230-G234 PolarHBondContact O-N 3.42Å; D231-G234 CarbonylContact O-C 3.32Å; D231-G234 PolarHBondContact O-N 3.48Å; Q232-G234 VanDerWaalsContact C-N 3.29Å; Q232-G234 PolarHBondContact O-N 2.97Å; G234-M236 VanDerWaalsContact C-N 3.33Å; G234-M236 PolarHBondContact O-N 3.28Å; G234-F237 PolarHBondContact O-N 3.26Å; G234-V238 WeakPolarHBondContact O-CG2 3.42Å; G234-V238 PolarHBondContact O-N 2.74Å |
| 235 | T | 82.3 | Confident | 83.3 | Confident | 55 Ų | 55 | 63.9 Ų | 63.9 | 34% | 0.337 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.2 | -35.9 | 175.9 | 79.5 | 0 | 0 | 0 | 0 | 112 | D231 Q232 V238 K239 | D231-T235 WeakPolarHBondContact O-CG2 3.47Å; D231-T235 PolarHBondContact O-N 3.28Å; Q232-T235 PolarHBondContact O-N 2.89Å; Q232-T235 PolarHBondContact O-OG1 3.27Å; T235-V238 PolarHBondContact O-N 3.39Å; T235-K239 VanDerWaalsContact O-CB 3.31Å; T235-K239 WeakPolarHBondContact O-CB 3.38Å; T235-K239 VanDerWaalsContact O-CD 3.23Å; T235-K239 WeakPolarHBondContact O-CD 3.49Å; T235-K239 WeakPolarHBondContact O-CG 3.38Å; T235-K239 PolarHBondContact O-N 2.93Å; T235-K239 PolarHBondContact OG1-NZ 2.81Å |
| 236 | M | 82.3 | Confident | 82.8 | Confident | 97 Ų | 97 | 66.8 Ų | 66.8 | 48% | 0.478 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -69.7 | -36.4 | 177.3 | -64.7 | -52.5 | 175.4 | 0 | 0 | 111.8 | Q232 L233 G234 K239 S240 | Q232-M236 WeakPolarHBondContact O-CG 3.43Å; Q232-M236 PolarHBondContact O-N 3.08Å; L233-M236 PolarHBondContact O-N 3.12Å; G234-M236 VanDerWaalsContact C-N 3.33Å; G234-M236 PolarHBondContact O-N 3.28Å; M236-K239 HydrophobicContact SD-CD 3.82Å; M236-S240 VanDerWaalsContact O-CB 3.3Å; M236-S240 WeakPolarHBondContact O-CB 3.33Å; M236-S240 PolarHBondContact O-N 3.2Å; M236-S240 PolarHBondContact O-OG 3.29Å |
| 237 | F | 78.1 | Confident | 82.3 | Confident | 37 Ų | 37 | 70 Ų | 70 | 16% | 0.162 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63 | -51 | 170.9 | 173.2 | -134.7 | 0 | 0 | 0 | 111.1 | L233 G234 K239 S240 I241 A265 F268 | L233-F237 WeakPolarHBondContact O-CB 3.49Å; L233-F237 PolarHBondContact O-N 3.1Å; G234-F237 PolarHBondContact O-N 3.26Å; F237-K239 PolarHBondContact O-N 3.35Å; F237-S240 CarbonylContact O-C 3.55Å; F237-S240 WeakPolarHBondContact O-CA 3.44Å; F237-S240 WeakPolarHBondContact O-CB 3.21Å; F237-S240 PolarHBondContact O-N 2.99Å; F237-I241 HydrophobicContact CD1-CD1 3.99Å; F237-I241 HydrophobicContact CD2-CD1 3.87Å; F237-I241 HydrophobicContact CD2-CG1 3.84Å; F237-I241 HydrophobicContact CE1-CD1 3.65Å; F237-I241 HydrophobicContact CE2-CD1 3.48Å; F237-I241 VanDerWaalsContact CE2-CD1 3.48Å; F237-I241 HydrophobicContact CE2-CG1 3.48Å; F237-I241 VanDerWaalsContact CE2-CG1 3.48Å; F237-I241 HydrophobicContact CG-CD1 4.1Å; F237-I241 HydrophobicContact CG-CG1 4.5Å; F237-I241 HydrophobicContact CZ-CD1 3.37Å; F237-I241 HydrophobicContact CZ-CG1 3.9Å; F237-I241 WeakPolarHBondContact O-CG1 3.3Å; F237-I241 PolarHBondContact O-N 2.99Å; F237-A265 HydrophobicContact CZ-CB 4.32Å; F237-F268 HydrophobicContact CB-CD2 4.21Å; F237-F268 HydrophobicContact CB-CE2 3.94Å; F237-F268 HydrophobicContact CB-CZ 4.19Å; F237-F268 HydrophobicContact CD1-CD1 4.36Å; F237-F268 HydrophobicContact CD1-CE1 4.42Å; F237-F268 HydrophobicContact CD2-CB 3.67Å; F237-F268 AromaticContact CD2-CD1 3.99Å; F237-F268 HydrophobicContact CD2-CD1 3.99Å; F237-F268 AromaticContact CD2-CD2 3.52Å; F237-F268 HydrophobicContact CD2-CD2 3.52Å; F237-F268 HydrophobicContact CD2-CE2 4.11Å; F237-F268 AromaticContact CD2-CG 3.44Å; F237-F268 HydrophobicContact CD2-CG 3.44Å; F237-F268 VanDerWaalsContact CD2-CG 3.44Å; F237-F268 HydrophobicContact CE1-CD1 4.34Å; F237-F268 HydrophobicContact CE2-CB 3.32Å; F237-F268 AromaticContact CE2-CD1 4Å; F237-F268 HydrophobicContact CE2-CD1 4Å; F237-F268 HydrophobicContact CE2-CD2 4.11Å; F237-F268 AromaticContact CE2-CG 3.55Å; F237-F268 HydrophobicContact CE2-CG 3.55Å; F237-F268 HydrophobicContact CG-CD1 4.19Å; F237-F268 AromaticContact CG-CD2 3.98Å; F237-F268 HydrophobicContact CG-CD2 3.98Å; F237-F268 HydrophobicContact CG-CE1 4.31Å; F237-F268 HydrophobicContact CG-CE2 4.11Å; F237-F268 HydrophobicContact CG-CG 4.02Å; F237-F268 HydrophobicContact CG-CZ 4.27Å; F237-F268 HydrophobicContact CZ-CB 4.06Å; F237-F268 HydrophobicContact CZ-CD1 4.17Å; F237-F268 HydrophobicContact CZ-CG 4.18Å |
| 238 | V | 78.9 | Confident | 81.7 | Confident | 77 Ų | 77 | 71.6 Ų | 71.6 | 47% | 0.467 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -59.4 | -44.3 | 176.9 | 172 | 0 | 0 | 0 | 0 | 111.9 | G234 T235 S240 I241 L242 | G234-V238 WeakPolarHBondContact O-CG2 3.42Å; G234-V238 PolarHBondContact O-N 2.74Å; T235-V238 PolarHBondContact O-N 3.39Å; V238-S240 VanDerWaalsContact C-N 3.25Å; V238-S240 PolarHBondContact O-N 3.23Å; V238-I241 PolarHBondContact O-N 3.28Å; V238-L242 HydrophobicContact CG1-CD1 4.03Å; V238-L242 VanDerWaalsContact O-CG 3.31Å; V238-L242 WeakPolarHBondContact O-CG 3.49Å; V238-L242 PolarHBondContact O-N 3.19Å |
| 239 | K | 83.4 | Confident | 81 | Confident | 91 Ų | 91 | 74.9 Ų | 74.9 | 40% | 0.396 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -58.6 | -38.1 | 173.3 | -71.9 | 158.8 | -171.1 | 156.9 | 0 | 111.4 | T235 M236 F237 R243 | T235-K239 VanDerWaalsContact O-CB 3.31Å; T235-K239 WeakPolarHBondContact O-CB 3.38Å; T235-K239 VanDerWaalsContact O-CD 3.23Å; T235-K239 WeakPolarHBondContact O-CD 3.49Å; T235-K239 WeakPolarHBondContact O-CG 3.38Å; T235-K239 PolarHBondContact O-N 2.93Å; T235-K239 PolarHBondContact OG1-NZ 2.81Å; M236-K239 HydrophobicContact SD-CD 3.82Å; F237-K239 PolarHBondContact O-N 3.35Å; K239-R243 WeakPolarHBondContact O-CG 3.45Å; K239-R243 PolarHBondContact O-N 3.49Å; K239-R243 VanDerWaalsContact O-N 3.13Å |
| 240 | S | 78.1 | Confident | 80.4 | Confident | 52 Ų | 52 | 81.1 Ų | 81.1 | 36% | 0.364 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -72.6 | -42.4 | 178.8 | -59.8 | 0 | 0 | 0 | 0 | 112.6 | M236 F237 V238 L242 R243 V244 | M236-S240 VanDerWaalsContact O-CB 3.3Å; M236-S240 WeakPolarHBondContact O-CB 3.33Å; M236-S240 PolarHBondContact O-N 3.2Å; M236-S240 PolarHBondContact O-OG 3.29Å; F237-S240 CarbonylContact O-C 3.55Å; F237-S240 WeakPolarHBondContact O-CA 3.44Å; F237-S240 WeakPolarHBondContact O-CB 3.21Å; F237-S240 PolarHBondContact O-N 2.99Å; V238-S240 VanDerWaalsContact C-N 3.25Å; V238-S240 PolarHBondContact O-N 3.23Å; S240-L242 VanDerWaalsContact C-N 3.31Å; S240-L242 PolarHBondContact O-N 3.38Å; S240-R243 PolarHBondContact O-N 2.95Å; S240-R243 VanDerWaalsContact O-N 3.16Å; S240-V244 WeakPolarHBondContact O-CG2 3.43Å; S240-V244 PolarHBondContact O-N 3.42Å |
| 241 | I | 79 | Confident | 79.7 | Confident | 27 Ų | 27 | 88.2 Ų | 88.2 | 14% | 0.138 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -54.1 | -50 | 170.8 | -62.9 | 161.4 | 0 | 0 | 0 | 109.7 | F237 V238 R243 V244 E245 | F237-I241 HydrophobicContact CD1-CD1 3.99Å; F237-I241 HydrophobicContact CD2-CD1 3.87Å; F237-I241 HydrophobicContact CD2-CG1 3.84Å; F237-I241 HydrophobicContact CE1-CD1 3.65Å; F237-I241 HydrophobicContact CE2-CD1 3.48Å; F237-I241 VanDerWaalsContact CE2-CD1 3.48Å; F237-I241 HydrophobicContact CE2-CG1 3.48Å; F237-I241 VanDerWaalsContact CE2-CG1 3.48Å; F237-I241 HydrophobicContact CG-CD1 4.1Å; F237-I241 HydrophobicContact CG-CG1 4.5Å; F237-I241 HydrophobicContact CZ-CD1 3.37Å; F237-I241 HydrophobicContact CZ-CG1 3.9Å; F237-I241 WeakPolarHBondContact O-CG1 3.3Å; F237-I241 PolarHBondContact O-N 2.99Å; V238-I241 PolarHBondContact O-N 3.28Å; I241-R243 VanDerWaalsContact C-N 3.28Å; I241-R243 PolarHBondContact O-N 2.96Å; I241-V244 PolarHBondContact O-N 3.16Å; I241-E245 WeakPolarHBondContact O-CB 3.25Å; I241-E245 PolarHBondContact O-N 3.03Å |
| 242 | L | 79.6 | Confident | 78.9 | Confident | 85 Ų | 85 | 87.5 Ų | 87.5 | 45% | 0.445 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.4 | -27.2 | -178.6 | -69 | 169.9 | 0 | 0 | 0 | 113.3 | V238 S240 K246 | V238-L242 HydrophobicContact CG1-CD1 4.03Å; V238-L242 VanDerWaalsContact O-CG 3.31Å; V238-L242 WeakPolarHBondContact O-CG 3.49Å; V238-L242 PolarHBondContact O-N 3.19Å; S240-L242 VanDerWaalsContact C-N 3.31Å; S240-L242 PolarHBondContact O-N 3.38Å; L242-K246 WeakPolarHBondContact O-CB 3.43Å; L242-K246 VanDerWaalsContact O-CG 3.24Å; L242-K246 WeakPolarHBondContact O-CG 3.37Å; L242-K246 PolarHBondContact O-N 3.06Å |
| 243 | R | 82.5 | Confident | 77.9 | Confident | 166 Ų | 166 | 93.3 Ų | 93.3 | 63% | 0.626 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -71.6 | -52.7 | 170 | -70.8 | 172.2 | -168.1 | 177.3 | 3.4 | 111.1 | K239 S240 I241 E245 K246 I247 | K239-R243 WeakPolarHBondContact O-CG 3.45Å; K239-R243 PolarHBondContact O-N 3.49Å; K239-R243 VanDerWaalsContact O-N 3.13Å; S240-R243 PolarHBondContact O-N 2.95Å; S240-R243 VanDerWaalsContact O-N 3.16Å; I241-R243 VanDerWaalsContact C-N 3.28Å; I241-R243 PolarHBondContact O-N 2.96Å; R243-E245 VanDerWaalsContact C-N 3.29Å; R243-E245 PolarHBondContact O-N 3.44Å; R243-K246 PolarHBondContact O-N 3.1Å; R243-I247 WeakPolarHBondContact O-CG1 3.22Å; R243-I247 PolarHBondContact O-N 2.78Å; R243-I247 VanDerWaalsContact O-N 3.1Å |
| 244 | V | 78.9 | Confident | 77.3 | Confident | 57 Ų | 57 | 100.5 Ų | 100.5 | 35% | 0.345 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -58 | -43.8 | 179.4 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | S240 I241 I247 F248 | S240-V244 WeakPolarHBondContact O-CG2 3.43Å; S240-V244 PolarHBondContact O-N 3.42Å; I241-V244 PolarHBondContact O-N 3.16Å; V244-I247 PolarHBondContact O-N 2.84Å; V244-F248 WeakPolarHBondContact O-CB 3.47Å; V244-F248 PolarHBondContact O-N 3.32Å |
| 245 | E | 78.6 | Confident | 76.9 | Confident | 21 Ų | 21 | 102.2 Ų | 102.2 | 10% | 0.098 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -65.8 | -37 | 178.6 | -171.9 | -171.5 | -145.6 | 0 | 0 | 112.9 | I241 R243 F248 R249 Q257 I260 | I241-E245 WeakPolarHBondContact O-CB 3.25Å; I241-E245 PolarHBondContact O-N 3.03Å; R243-E245 VanDerWaalsContact C-N 3.29Å; R243-E245 PolarHBondContact O-N 3.44Å; E245-F248 PolarHBondContact O-N 3.37Å; E245-R249 WeakPolarHBondContact O-CB 3.36Å; E245-R249 PolarHBondContact O-N 2.7Å; E245-R249 IonicContact OE1-CZ 2.75Å; E245-R249 IonicContact OE1-NH1 3.56Å; E245-R249 PolarHBondContact OE1-NH1 3.11Å; E245-R249 IonicContact OE1-NH2 2.67Å; E245-R249 IonicContact OE2-CZ 3.53Å; E245-R249 VanDerWaalsContact OE2-CZ 3.31Å; E245-R249 IonicContact OE2-NH1 2.65Å; E245-R249 PolarHBondContact OE2-NH1 3.42Å; E245-R249 IonicContact OE2-NH2 3.72Å; E245-R249 PolarHBondContact OE2-NH2 3.41Å; E245-Q257 PolarHBondContact OE1-NE2 3.32Å; E245-Q257 PolarHBondContact OE1-OE1 2.85Å; E245-I260 HydrophobicContact CB-CG2 4.09Å; E245-I260 HydrophobicContact CG-CD1 4.23Å; E245-I260 HydrophobicContact CG-CG2 3.98Å |
| 246 | K | 81 | Confident | 76.6 | Confident | 137 Ų | 137 | 102.6 Ų | 102.6 | 60% | 0.596 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -61.5 | -48.3 | 172.2 | -80.9 | 174.1 | 179.2 | -174.4 | 0 | 111.1 | L242 R243 F248 R249 Q250 | L242-K246 WeakPolarHBondContact O-CB 3.43Å; L242-K246 VanDerWaalsContact O-CG 3.24Å; L242-K246 WeakPolarHBondContact O-CG 3.37Å; L242-K246 PolarHBondContact O-N 3.06Å; R243-K246 PolarHBondContact O-N 3.1Å; K246-F248 VanDerWaalsContact C-N 3.35Å; K246-F248 PolarHBondContact O-N 3.1Å; K246-R249 PolarHBondContact O-N 3.21Å; K246-Q250 WeakPolarHBondContact O-CG 3.46Å; K246-Q250 PolarHBondContact O-N 3.36Å |
| 247 | I | 80.6 | Confident | 76.1 | Confident | 108 Ų | 108 | 102.8 Ų | 102.8 | 55% | 0.554 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -60.6 | -45.2 | 177.3 | -63.4 | 163.5 | 0 | 0 | 0 | 110.4 | R243 V244 Q250 K251 | R243-I247 WeakPolarHBondContact O-CG1 3.22Å; R243-I247 PolarHBondContact O-N 2.78Å; R243-I247 VanDerWaalsContact O-N 3.1Å; V244-I247 PolarHBondContact O-N 2.84Å; I247-Q250 PolarHBondContact O-N 3.08Å; I247-K251 PolarHBondContact O-N 2.86Å; I247-K251 VanDerWaalsContact O-N 3.1Å |
| 248 | F | 76.5 | Confident | 76 | Confident | 92 Ų | 92 | 105.9 Ų | 105.9 | 40% | 0.404 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.6 | -39.6 | 179.8 | -119 | -85.7 | 0 | 0 | 0 | 113 | V244 E245 K246 K251 H252 I255 | V244-F248 WeakPolarHBondContact O-CB 3.47Å; V244-F248 PolarHBondContact O-N 3.32Å; E245-F248 PolarHBondContact O-N 3.37Å; K246-F248 VanDerWaalsContact C-N 3.35Å; K246-F248 PolarHBondContact O-N 3.1Å; F248-K251 PolarHBondContact O-N 3.19Å; F248-H252 PolarHBondContact O-N 2.94Å; F248-I255 HydrophobicContact CD1-CD1 3.79Å; F248-I255 HydrophobicContact CE1-CD1 3.63Å |
| 249 | R | 73.3 | Confident | 76.1 | Confident | 105 Ų | 105 | 109.2 Ų | 109.2 | 40% | 0.396 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.6 | -32.8 | 174.3 | -79.9 | -166.4 | -70.8 | -118 | -10.2 | 112.9 | E245 K246 Q257 | E245-R249 WeakPolarHBondContact O-CB 3.36Å; E245-R249 PolarHBondContact O-N 2.7Å; E245-R249 IonicContact OE1-CZ 2.75Å; E245-R249 IonicContact OE1-NH1 3.56Å; E245-R249 PolarHBondContact OE1-NH1 3.11Å; E245-R249 IonicContact OE1-NH2 2.67Å; E245-R249 IonicContact OE2-CZ 3.53Å; E245-R249 VanDerWaalsContact OE2-CZ 3.31Å; E245-R249 IonicContact OE2-NH1 2.65Å; E245-R249 PolarHBondContact OE2-NH1 3.42Å; E245-R249 IonicContact OE2-NH2 3.72Å; E245-R249 PolarHBondContact OE2-NH2 3.41Å; K246-R249 PolarHBondContact O-N 3.21Å; R249-Q257 VanDerWaalsContact NH1-OE1 3.09Å |
| 250 | Q | 75.9 | Confident | 75.9 | Confident | 169 Ų | 169 | 105.4 Ų | 105.4 | 79% | 0.79 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -66.9 | -35.5 | 172.7 | -76.3 | 175.6 | -48.6 | 0 | 0 | 112.1 | K246 I247 | K246-Q250 WeakPolarHBondContact O-CG 3.46Å; K246-Q250 PolarHBondContact O-N 3.36Å; I247-Q250 PolarHBondContact O-N 3.08Å |
| 251 | K | 72.2 | Confident | 75.9 | Confident | 168 Ų | 168 | 112 Ų | 112 | 73% | 0.73 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -90.4 | -33.5 | -177.6 | -162 | 171.1 | -178 | 176.7 | 0 | 114.7 | I247 F248 | I247-K251 PolarHBondContact O-N 2.86Å; I247-K251 VanDerWaalsContact O-N 3.1Å; F248-K251 PolarHBondContact O-N 3.19Å |
| 252 | H | 67.1 | Low | 76 | Confident | 103 Ų | 103 | 113.7 Ų | 113.7 | 48% | 0.477 | 52% | 0.521 | S | S | . | . | trans | -139 | 98.9 | -178.3 | -72.3 | -80.9 | 0 | 0 | 0 | 112.3 | F248 Q254 I255 | F248-H252 PolarHBondContact O-N 2.94Å; H252-Q254 VanDerWaalsContact C-N 3.3Å; H252-Q254 PolarHBondContact O-N 3.32Å; H252-I255 HydrophobicContact CB-CD1 3.65Å; H252-I255 HydrophobicContact CB-CG1 4.07Å | ||
| 253 | R | 66.1 | Low | 76.2 | Confident | 242 Ų | 242 | 113.2 Ų | 113.2 | 91% | 0.913 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.2 | -10.8 | -173.1 | -172.5 | 168.2 | 171.8 | 165.9 | -3.6 | 116 | ||
| 254 | Q | 69.4 | Low | 76.2 | Confident | 193 Ų | 193 | 105.7 Ų | 105.7 | 90% | 0.902 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.1 | 2.6 | -173.1 | -72.1 | -170.3 | -10.8 | 0 | 0 | 115.8 | H252 | H252-Q254 VanDerWaalsContact C-N 3.3Å; H252-Q254 PolarHBondContact O-N 3.32Å |
| 255 | I | 72.1 | Confident | 76.3 | Confident | 65 Ų | 65 | 103.5 Ų | 103.5 | 33% | 0.333 | 48% | 0.482 | S | S | . | . | trans | -84.1 | 125 | -173 | -59.1 | 178.2 | 0 | 0 | 0 | 111.5 | F248 H252 K259 I260 | F248-I255 HydrophobicContact CD1-CD1 3.79Å; F248-I255 HydrophobicContact CE1-CD1 3.63Å; H252-I255 HydrophobicContact CB-CD1 3.65Å; H252-I255 HydrophobicContact CB-CG1 4.07Å; I255-K259 HydrophobicContact CG2-CB 4.26Å; I255-I260 HydrophobicContact CB-CD1 4.42Å; I255-I260 HydrophobicContact CB-CG1 4.42Å; I255-I260 HydrophobicContact CG2-CD1 4.24Å; I255-I260 HydrophobicContact CG2-CG1 3.72Å | ||
| 256 | S | 75.2 | Confident | 76.7 | Confident | 63 Ų | 63 | 107.9 Ų | 107.9 | 44% | 0.441 | 51% | 0.506 | S | S | . | . | trans | -59 | 136.5 | 178.7 | 173.7 | 0 | 0 | 0 | 0 | 112.8 | T258 K259 I260 | S256-T258 VanDerWaalsContact C-N 3.26Å; S256-T258 PolarHBondContact O-N 2.91Å; S256-K259 WeakPolarHBondContact O-CB 3.29Å; S256-K259 PolarHBondContact O-N 3.37Å; S256-I260 PolarHBondContact O-N 2.81Å | ||
| 257 | Q | 71.4 | Confident | 77 | Confident | 100 Ų | 100 | 105.7 Ų | 105.7 | 47% | 0.467 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -51.5 | -41.5 | 179.1 | -65.3 | -77 | -101.7 | 0 | 0 | 112.9 | E245 R249 K259 I260 R261 | E245-Q257 PolarHBondContact OE1-NE2 3.32Å; E245-Q257 PolarHBondContact OE1-OE1 2.85Å; R249-Q257 VanDerWaalsContact NH1-OE1 3.09Å; Q257-K259 VanDerWaalsContact C-N 3.33Å; Q257-K259 PolarHBondContact O-N 3.47Å; Q257-I260 PolarHBondContact O-N 3.15Å; Q257-R261 PolarHBondContact O-N 3.49Å |
| 258 | T | 76.8 | Confident | 77.2 | Confident | 102 Ų | 102 | 102.7 Ų | 102.7 | 63% | 0.626 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.6 | -39.4 | 179 | -42.4 | 0 | 0 | 0 | 0 | 111.8 | S256 R261 V262 | S256-T258 VanDerWaalsContact C-N 3.26Å; S256-T258 PolarHBondContact O-N 2.91Å; T258-R261 PolarHBondContact O-N 2.81Å; T258-V262 WeakPolarHBondContact O-CG2 3.4Å; T258-V262 PolarHBondContact O-N 3.13Å; T258-V262 VanDerWaalsContact O-N 3.08Å |
| 259 | K | 79.9 | Confident | 77.8 | Confident | 148 Ų | 148 | 100.9 Ų | 100.9 | 64% | 0.643 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -65.4 | -45.8 | 176.7 | -67.2 | -170.3 | 176.5 | -173.9 | 0 | 110.8 | I255 S256 Q257 R261 V262 T263 | I255-K259 HydrophobicContact CG2-CB 4.26Å; S256-K259 WeakPolarHBondContact O-CB 3.29Å; S256-K259 PolarHBondContact O-N 3.37Å; Q257-K259 VanDerWaalsContact C-N 3.33Å; Q257-K259 PolarHBondContact O-N 3.47Å; K259-R261 VanDerWaalsContact C-N 3.34Å; K259-R261 PolarHBondContact O-N 3.36Å; K259-V262 PolarHBondContact O-N 3.42Å; K259-T263 PolarHBondContact O-N 2.84Å; K259-T263 PolarHBondContact O-OG1 2.95Å; K259-T263 VanDerWaalsContact O-OG1 3.12Å |
| 260 | I | 79 | Confident | 78.7 | Confident | 11 Ų | 11 | 100.7 Ų | 100.7 | 6% | 0.056 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -61.1 | -43.8 | 178.6 | -54.7 | 170.1 | 0 | 0 | 0 | 110.9 | E245 I255 S256 Q257 V262 T263 S264 | E245-I260 HydrophobicContact CB-CG2 4.09Å; E245-I260 HydrophobicContact CG-CD1 4.23Å; E245-I260 HydrophobicContact CG-CG2 3.98Å; I255-I260 HydrophobicContact CB-CD1 4.42Å; I255-I260 HydrophobicContact CB-CG1 4.42Å; I255-I260 HydrophobicContact CG2-CD1 4.24Å; I255-I260 HydrophobicContact CG2-CG1 3.72Å; S256-I260 PolarHBondContact O-N 2.81Å; Q257-I260 PolarHBondContact O-N 3.15Å; I260-V262 PolarHBondContact O-N 2.69Å; I260-T263 PolarHBondContact O-N 3.3Å; I260-S264 WeakPolarHBondContact O-CB 3.38Å; I260-S264 PolarHBondContact O-N 3.45Å; I260-S264 PolarHBondContact O-OG 3.01Å |
| 261 | R | 77.8 | Confident | 79.3 | Confident | 191 Ų | 191 | 95 Ų | 95 | 72% | 0.721 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -60.3 | -45.6 | 177.6 | -166.1 | 176.8 | -177.5 | -161.2 | -1.1 | 111.6 | Q257 T258 K259 S264 A265 | Q257-R261 PolarHBondContact O-N 3.49Å; T258-R261 PolarHBondContact O-N 2.81Å; K259-R261 VanDerWaalsContact C-N 3.34Å; K259-R261 PolarHBondContact O-N 3.36Å; R261-S264 WeakPolarHBondContact CA-OG 3.48Å; R261-S264 PolarHBondContact O-N 3.24Å; R261-S264 PolarHBondContact O-OG 3.25Å; R261-A265 WeakPolarHBondContact O-CB 3.44Å; R261-A265 PolarHBondContact O-N 3.19Å |
| 262 | V | 82.5 | Confident | 80.2 | Confident | 61 Ų | 61 | 87.3 Ų | 87.3 | 37% | 0.37 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 176.3 | 170.3 | 0 | 0 | 0 | 0 | 111.9 | T258 K259 I260 S264 A265 L266 W350 | T258-V262 WeakPolarHBondContact O-CG2 3.4Å; T258-V262 PolarHBondContact O-N 3.13Å; T258-V262 VanDerWaalsContact O-N 3.08Å; K259-V262 PolarHBondContact O-N 3.42Å; I260-V262 PolarHBondContact O-N 2.69Å; V262-S264 VanDerWaalsContact C-N 3.33Å; V262-S264 PolarHBondContact O-N 2.95Å; V262-A265 PolarHBondContact O-N 2.79Å; V262-L266 PolarHBondContact O-N 3.37Å; V262-W350 HydrophobicContact CG1-CH2 4.37Å; V262-W350 HydrophobicContact CG1-CZ2 4.11Å; V262-W350 HydrophobicContact CG2-CZ2 4.21Å |
| 263 | T | 83 | Confident | 81.4 | Confident | 76 Ų | 76 | 84.7 Ų | 84.7 | 47% | 0.466 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -60.4 | -42.2 | 177.1 | -58 | 0 | 0 | 0 | 0 | 111.7 | K259 I260 A265 L266 L267 | K259-T263 PolarHBondContact O-N 2.84Å; K259-T263 PolarHBondContact O-OG1 2.95Å; K259-T263 VanDerWaalsContact O-OG1 3.12Å; I260-T263 PolarHBondContact O-N 3.3Å; T263-A265 PolarHBondContact O-N 3.46Å; T263-L266 PolarHBondContact O-N 3.24Å; T263-L267 HydrophobicContact CG2-CD1 4.1Å; T263-L267 WeakPolarHBondContact O-CB 3.34Å; T263-L267 WeakPolarHBondContact O-CG 3.35Å; T263-L267 PolarHBondContact O-N 3.27Å |
| 264 | S | 82.1 | Confident | 82.6 | Confident | 8 Ų | 8 | 77 Ų | 77 | 6% | 0.056 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -67.4 | -34.1 | 178.8 | 68.8 | 0 | 0 | 0 | 0 | 113.3 | I260 R261 V262 F268 | I260-S264 WeakPolarHBondContact O-CB 3.38Å; I260-S264 PolarHBondContact O-N 3.45Å; I260-S264 PolarHBondContact O-OG 3.01Å; R261-S264 WeakPolarHBondContact CA-OG 3.48Å; R261-S264 PolarHBondContact O-N 3.24Å; R261-S264 PolarHBondContact O-OG 3.25Å; V262-S264 VanDerWaalsContact C-N 3.33Å; V262-S264 PolarHBondContact O-N 2.95Å; S264-F268 PolarHBondContact O-N 3.31Å; S264-F268 VanDerWaalsContact O-N 3.13Å |
| 265 | A | 82.4 | Confident | 83.8 | Confident | 10 Ų | 10 | 71.5 Ų | 71.5 | 8% | 0.083 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -68.2 | -44.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | F237 R261 V262 T263 L267 F268 I269 M346 | F237-A265 HydrophobicContact CZ-CB 4.32Å; R261-A265 WeakPolarHBondContact O-CB 3.44Å; R261-A265 PolarHBondContact O-N 3.19Å; V262-A265 PolarHBondContact O-N 2.79Å; T263-A265 PolarHBondContact O-N 3.46Å; A265-L267 VanDerWaalsContact C-N 3.34Å; A265-L267 PolarHBondContact O-N 2.86Å; A265-F268 PolarHBondContact O-N 3.47Å; A265-F268 VanDerWaalsContact O-N 3.15Å; A265-I269 WeakPolarHBondContact O-CG1 3.31Å; A265-I269 PolarHBondContact O-N 3.1Å; A265-M346 HydrophobicContact CB-CE 4.23Å; A265-M346 HydrophobicContact CB-SD 3.73Å |
| 266 | L | 86.7 | Confident | 84.7 | Confident | 114 Ų | 114 | 69.9 Ų | 69.9 | 60% | 0.597 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -62.6 | -39.9 | 176.6 | -176.2 | 62.1 | 0 | 0 | 0 | 112 | V262 T263 F268 I269 L270 | V262-L266 PolarHBondContact O-N 3.37Å; T263-L266 PolarHBondContact O-N 3.24Å; L266-F268 VanDerWaalsContact C-N 3.32Å; L266-F268 PolarHBondContact O-N 2.95Å; L266-I269 PolarHBondContact O-N 3.34Å; L266-L270 WeakPolarHBondContact O-CB 3.36Å; L266-L270 PolarHBondContact O-N 2.67Å |
| 267 | L | 86.9 | Confident | 85.6 | Confident | 90 Ų | 90 | 68.5 Ų | 68.5 | 47% | 0.471 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -65.6 | -32.2 | 174.3 | -73.1 | 171.1 | 0 | 0 | 0 | 112.9 | T263 A265 A271 | T263-L267 HydrophobicContact CG2-CD1 4.1Å; T263-L267 WeakPolarHBondContact O-CB 3.34Å; T263-L267 WeakPolarHBondContact O-CG 3.35Å; T263-L267 PolarHBondContact O-N 3.27Å; A265-L267 VanDerWaalsContact C-N 3.34Å; A265-L267 PolarHBondContact O-N 2.86Å; L267-A271 VanDerWaalsContact O-CB 3.22Å; L267-A271 WeakPolarHBondContact O-CB 3.43Å; L267-A271 PolarHBondContact O-N 3.18Å |
| 268 | F | 85.6 | Confident | 86.7 | Confident | 46 Ų | 46 | 66.9 Ų | 66.9 | 20% | 0.202 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -75.7 | -33.8 | 175 | 175.5 | -101.5 | 0 | 0 | 0 | 113 | F237 S264 A265 L266 G272 Y339 | F237-F268 HydrophobicContact CB-CD2 4.21Å; F237-F268 HydrophobicContact CB-CE2 3.94Å; F237-F268 HydrophobicContact CB-CZ 4.19Å; F237-F268 HydrophobicContact CD1-CD1 4.36Å; F237-F268 HydrophobicContact CD1-CE1 4.42Å; F237-F268 HydrophobicContact CD2-CB 3.67Å; F237-F268 AromaticContact CD2-CD1 3.99Å; F237-F268 HydrophobicContact CD2-CD1 3.99Å; F237-F268 AromaticContact CD2-CD2 3.52Å; F237-F268 HydrophobicContact CD2-CD2 3.52Å; F237-F268 HydrophobicContact CD2-CE2 4.11Å; F237-F268 AromaticContact CD2-CG 3.44Å; F237-F268 HydrophobicContact CD2-CG 3.44Å; F237-F268 VanDerWaalsContact CD2-CG 3.44Å; F237-F268 HydrophobicContact CE1-CD1 4.34Å; F237-F268 HydrophobicContact CE2-CB 3.32Å; F237-F268 AromaticContact CE2-CD1 4Å; F237-F268 HydrophobicContact CE2-CD1 4Å; F237-F268 HydrophobicContact CE2-CD2 4.11Å; F237-F268 AromaticContact CE2-CG 3.55Å; F237-F268 HydrophobicContact CE2-CG 3.55Å; F237-F268 HydrophobicContact CG-CD1 4.19Å; F237-F268 AromaticContact CG-CD2 3.98Å; F237-F268 HydrophobicContact CG-CD2 3.98Å; F237-F268 HydrophobicContact CG-CE1 4.31Å; F237-F268 HydrophobicContact CG-CE2 4.11Å; F237-F268 HydrophobicContact CG-CG 4.02Å; F237-F268 HydrophobicContact CG-CZ 4.27Å; F237-F268 HydrophobicContact CZ-CB 4.06Å; F237-F268 HydrophobicContact CZ-CD1 4.17Å; F237-F268 HydrophobicContact CZ-CG 4.18Å; S264-F268 PolarHBondContact O-N 3.31Å; S264-F268 VanDerWaalsContact O-N 3.13Å; A265-F268 PolarHBondContact O-N 3.47Å; A265-F268 VanDerWaalsContact O-N 3.15Å; L266-F268 VanDerWaalsContact C-N 3.32Å; L266-F268 PolarHBondContact O-N 2.95Å; F268-G272 PolarHBondContact O-N 2.7Å; F268-G272 VanDerWaalsContact O-N 3.1Å; F268-Y339 HydrophobicContact CD1-CE2 4.27Å; F268-Y339 HydrophobicContact CE1-CD2 4.19Å; F268-Y339 AromaticContact CE1-CE2 3.67Å; F268-Y339 HydrophobicContact CE1-CE2 3.67Å; F268-Y339 HydrophobicContact CE2-CD2 4.49Å; F268-Y339 HydrophobicContact CE2-CE2 4.19Å; F268-Y339 AromaticContact CZ-CD2 3.82Å; F268-Y339 HydrophobicContact CZ-CD2 3.82Å; F268-Y339 AromaticContact CZ-CE2 3.63Å; F268-Y339 HydrophobicContact CZ-CE2 3.63Å; F268-Y339 PolarHBondContact O-OH 3.48Å; F268-Y339 VanDerWaalsContact O-OH 3.05Å |
| 269 | I | 88.9 | Confident | 87.6 | Confident | 54 Ų | 54 | 66.3 Ų | 66.3 | 28% | 0.277 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -59.5 | -56.1 | 165.8 | -63.3 | 167.1 | 0 | 0 | 0 | 108.6 | A265 L266 A271 G272 C273 Y339 M346 | A265-I269 WeakPolarHBondContact O-CG1 3.31Å; A265-I269 PolarHBondContact O-N 3.1Å; L266-I269 PolarHBondContact O-N 3.34Å; I269-A271 PolarHBondContact O-N 3.31Å; I269-G272 PolarHBondContact O-N 2.75Å; I269-C273 WeakPolarHBondContact O-CB 3.41Å; I269-C273 PolarHBondContact O-N 3.35Å; I269-C273 PolarHBondContact O-SG 2.96Å; I269-Y339 WeakPolarHBondContact CA-OH 3.45Å; I269-Y339 PolarHBondContact O-OH 2.72Å; I269-M346 HydrophobicContact CD1-CE 3.67Å; I269-M346 HydrophobicContact CG1-CE 3.67Å |
| 270 | L | 90.8 | Very high | 88.3 | Confident | 101 Ų | 101 | 59.7 Ų | 59.7 | 53% | 0.529 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -58.2 | -47.2 | -176.4 | -175.8 | 63.5 | 0 | 0 | 0 | 112.9 | L266 C273 I274 | L266-L270 WeakPolarHBondContact O-CB 3.36Å; L266-L270 PolarHBondContact O-N 2.67Å; L270-C273 PolarHBondContact O-N 3.3Å; L270-I274 HydrophobicContact CG-CD1 4.34Å; L270-I274 WeakPolarHBondContact O-CG1 3.26Å; L270-I274 PolarHBondContact O-N 3.44Å |
| 271 | A | 89.8 | Confident | 89.1 | Confident | 50 Ų | 50 | 59.5 Ų | 59.5 | 41% | 0.413 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.6 | -40.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L267 I269 I274 V275 | L267-A271 VanDerWaalsContact O-CB 3.22Å; L267-A271 WeakPolarHBondContact O-CB 3.43Å; L267-A271 PolarHBondContact O-N 3.18Å; I269-A271 PolarHBondContact O-N 3.31Å; A271-I274 PolarHBondContact O-N 2.87Å; A271-V275 WeakPolarHBondContact O-CG2 3.34Å; A271-V275 PolarHBondContact O-N 3.45Å |
| 272 | G | 89.9 | Confident | 90 | Very high | 5 Ų | 5 | 54.3 Ų | 54.3 | 5% | 0.052 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -75.3 | -30.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | F268 I269 I274 V275 F276 Y339 | F268-G272 PolarHBondContact O-N 2.7Å; F268-G272 VanDerWaalsContact O-N 3.1Å; I269-G272 PolarHBondContact O-N 2.75Å; G272-I274 VanDerWaalsContact C-N 3.3Å; G272-I274 PolarHBondContact O-N 2.88Å; G272-V275 PolarHBondContact O-N 3.36Å; G272-F276 WeakPolarHBondContact O-CB 3.22Å; G272-F276 WeakPolarHBondContact O-CD2 3.36Å; G272-F276 PolarHBondContact O-N 3.04Å; G272-Y339 VanDerWaalsContact CA-CZ 3.45Å; G272-Y339 WeakPolarHBondContact CA-OH 3.31Å |
| 273 | C | 92 | Very high | 90.6 | Very high | 49 Ų | 49 | 55.2 Ų | 55.2 | 33% | 0.331 | 31% | 0.314 | S | S | . | . | I | π-helix | trans | -60.5 | -39.9 | 165.5 | -70.4 | 0 | 0 | 0 | 0 | 111.3 | I269 L270 V277 T278 | I269-C273 WeakPolarHBondContact O-CB 3.41Å; I269-C273 PolarHBondContact O-N 3.35Å; I269-C273 PolarHBondContact O-SG 2.96Å; L270-C273 PolarHBondContact O-N 3.3Å; C273-V277 CarbonylContact O-C 3.57Å; C273-V277 VanDerWaalsContact O-CA 3.28Å; C273-V277 WeakPolarHBondContact O-CA 3.24Å; C273-V277 WeakPolarHBondContact O-CB 3.49Å; C273-V277 PolarHBondContact O-N 3.19Å; C273-T278 PolarHBondContact O-N 2.94Å |
| 274 | I | 93.2 | Very high | 91.1 | Very high | 80 Ų | 80 | 51.9 Ų | 51.9 | 41% | 0.41 | 29% | 0.293 | S | S | . | . | I | π-helix | trans | -64.6 | -48.7 | 175.5 | -67.4 | 162.8 | 0 | 0 | 0 | 111.1 | L270 A271 G272 T278 I279 | L270-I274 HydrophobicContact CG-CD1 4.34Å; L270-I274 WeakPolarHBondContact O-CG1 3.26Å; L270-I274 PolarHBondContact O-N 3.44Å; A271-I274 PolarHBondContact O-N 2.87Å; G272-I274 VanDerWaalsContact C-N 3.3Å; G272-I274 PolarHBondContact O-N 2.88Å; I274-T278 VanDerWaalsContact CA-OG1 3.32Å; I274-T278 WeakPolarHBondContact CA-OG1 3.24Å; I274-T278 PolarHBondContact O-N 3.41Å; I274-T278 PolarHBondContact O-OG1 3.04Å; I274-I279 HydrophobicContact CG2-CD1 4.34Å; I274-I279 WeakPolarHBondContact O-CG1 3.45Å; I274-I279 PolarHBondContact O-N 2.75Å |
| 275 | V | 93 | Very high | 91.7 | Very high | 77 Ų | 77 | 55.4 Ų | 55.4 | 47% | 0.467 | 31% | 0.307 | S | S | . | . | I | π-helix | trans | -74 | -42.2 | -174.1 | 172.2 | 0 | 0 | 0 | 0 | 113.6 | A271 G272 P280 | A271-V275 WeakPolarHBondContact O-CG2 3.34Å; A271-V275 PolarHBondContact O-N 3.45Å; G272-V275 PolarHBondContact O-N 3.36Å; V275-P280 VanDerWaalsContact O-CD 3.28Å; V275-P280 WeakPolarHBondContact O-CD 3.32Å |
| 276 | F | 92.6 | Very high | 92.2 | Very high | 32 Ų | 32 | 61.9 Ų | 61.9 | 14% | 0.14 | 34% | 0.335 | C | S | . | . | I | π-helix | trans | -102.8 | -16.4 | -173.7 | -59.9 | -67.8 | 0 | 0 | 0 | 114.2 | G272 P280 L303 W332 V335 Y339 | G272-F276 WeakPolarHBondContact O-CB 3.22Å; G272-F276 WeakPolarHBondContact O-CD2 3.36Å; G272-F276 PolarHBondContact O-N 3.04Å; F276-P280 WeakPolarHBondContact O-CG 3.42Å; F276-L303 HydrophobicContact CB-CD1 4.27Å; F276-W332 PolarHBondContact O-NE1 2.79Å; F276-W332 VanDerWaalsContact O-NE1 3.16Å; F276-V335 HydrophobicContact CE1-CB 4.15Å; F276-V335 HydrophobicContact CE1-CG1 3.6Å; F276-V335 HydrophobicContact CZ-CG1 3.74Å; F276-Y339 HydrophobicContact CB-CD1 4.39Å; F276-Y339 AromaticContact CD2-CD1 3.59Å; F276-Y339 HydrophobicContact CD2-CD1 3.59Å; F276-Y339 AromaticContact CD2-CD2 3.94Å; F276-Y339 HydrophobicContact CD2-CD2 3.94Å; F276-Y339 HydrophobicContact CD2-CE1 4.15Å; F276-Y339 HydrophobicContact CD2-CE2 4.46Å; F276-Y339 AromaticContact CD2-CG 3.48Å; F276-Y339 HydrophobicContact CD2-CG 3.48Å; F276-Y339 VanDerWaalsContact CD2-CG 3.48Å; F276-Y339 HydrophobicContact CE2-CD1 4.26Å; F276-Y339 AromaticContact CE2-CD2 3.82Å; F276-Y339 HydrophobicContact CE2-CD2 3.82Å; F276-Y339 AromaticContact CE2-CG 3.66Å; F276-Y339 HydrophobicContact CE2-CG 3.66Å; F276-Y339 HydrophobicContact CG-CD1 4.25Å; F276-Y339 HydrophobicContact CG-CG 4.38Å |
| 277 | V | 93.7 | Very high | 92.4 | Very high | 33 Ų | 33 | 59.6 Ų | 59.6 | 20% | 0.2 | 32% | 0.323 | C | S | . | . | I | π-helix | trans | -109.5 | -62 | 176.4 | -177.1 | 0 | 0 | 0 | 0 | 112.2 | C273 A281 V299 | C273-V277 CarbonylContact O-C 3.57Å; C273-V277 VanDerWaalsContact O-CA 3.28Å; C273-V277 WeakPolarHBondContact O-CA 3.24Å; C273-V277 WeakPolarHBondContact O-CB 3.49Å; C273-V277 PolarHBondContact O-N 3.19Å; V277-A281 VanDerWaalsContact O-CB 3.26Å; V277-A281 WeakPolarHBondContact O-CB 3.25Å; V277-A281 PolarHBondContact O-N 2.96Å; V277-V299 HydrophobicContact CB-CG1 4Å; V277-V299 HydrophobicContact CG1-CG1 3.74Å; V277-V299 HydrophobicContact CG2-CG1 4.1Å |
| 278 | T | 94.3 | Very high | 92.6 | Very high | 67 Ų | 67 | 55.9 Ų | 55.9 | 41% | 0.411 | 30% | 0.303 | S | S | . | . | I | π-helix | trans | -73.2 | -41.6 | -169.3 | 68.6 | 0 | 0 | 0 | 0 | 113.7 | C273 I274 A281 V282 | C273-T278 PolarHBondContact O-N 2.94Å; I274-T278 VanDerWaalsContact CA-OG1 3.32Å; I274-T278 WeakPolarHBondContact CA-OG1 3.24Å; I274-T278 PolarHBondContact O-N 3.41Å; I274-T278 PolarHBondContact O-OG1 3.04Å; T278-A281 PolarHBondContact O-N 2.85Å; T278-V282 WeakPolarHBondContact O-CG2 3.34Å; T278-V282 PolarHBondContact O-N 3.29Å; T278-V282 VanDerWaalsContact O-N 3.08Å |
| 279 | I | 95.1 | Very high | 92.9 | Very high | 89 Ų | 89 | 56.8 Ų | 56.8 | 46% | 0.456 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -64.2 | -49.3 | 178.5 | -71.3 | 170.3 | 0 | 0 | 0 | 111 | I274 A281 V282 I283 | I274-I279 HydrophobicContact CG2-CD1 4.34Å; I274-I279 WeakPolarHBondContact O-CG1 3.45Å; I274-I279 PolarHBondContact O-N 2.75Å; I279-A281 PolarHBondContact O-N 3.22Å; I279-V282 PolarHBondContact O-N 3.03Å; I279-I283 HydrophobicContact CG2-CD1 3.93Å; I279-I283 WeakPolarHBondContact O-CG1 3.26Å; I279-I283 PolarHBondContact O-N 3.43Å; I279-I283 VanDerWaalsContact O-N 3.08Å |
| 280 | P | 95.3 | Very high | 93.2 | Very high | 10 Ų | 10 | 55.9 Ų | 55.9 | 7% | 0.065 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -59.8 | -42.3 | 173.7 | -28.7 | 38.9 | 0 | 0 | 0 | 113.4 | V275 F276 V282 I283 F284 V299 W332 | V275-P280 VanDerWaalsContact O-CD 3.28Å; V275-P280 WeakPolarHBondContact O-CD 3.32Å; F276-P280 WeakPolarHBondContact O-CG 3.42Å; P280-V282 VanDerWaalsContact C-N 3.3Å; P280-V282 PolarHBondContact O-N 3.05Å; P280-I283 WeakPolarHBondContact O-CB 3.44Å; P280-I283 PolarHBondContact O-N 2.96Å; P280-F284 HydrophobicContact CB-CD2 4.17Å; P280-F284 HydrophobicContact CB-CE2 3.76Å; P280-F284 WeakPolarHBondContact O-CD2 3.34Å; P280-F284 WeakPolarHBondContact O-CG 3.35Å; P280-F284 PolarHBondContact O-N 3.25Å; P280-V299 HydrophobicContact CB-CG2 4.15Å; P280-W332 HydrophobicContact CB-CZ2 4.34Å; P280-W332 HydrophobicContact CG-CG 4.45Å |
| 281 | A | 96 | Very high | 93.5 | Very high | 7 Ų | 7 | 54.8 Ų | 54.8 | 6% | 0.058 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.4 | -36.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113 | V277 T278 I279 K285 A295 I296 V299 | V277-A281 VanDerWaalsContact O-CB 3.26Å; V277-A281 WeakPolarHBondContact O-CB 3.25Å; V277-A281 PolarHBondContact O-N 2.96Å; T278-A281 PolarHBondContact O-N 2.85Å; I279-A281 PolarHBondContact O-N 3.22Å; A281-K285 VanDerWaalsContact O-CB 3.28Å; A281-K285 WeakPolarHBondContact O-CB 3.33Å; A281-K285 PolarHBondContact O-N 3.38Å; A281-A295 HydrophobicContact CB-CB 4.24Å; A281-A295 VanDerWaalsContact O-CB 3.26Å; A281-A295 WeakPolarHBondContact O-CB 3.19Å; A281-I296 HydrophobicContact CB-CG1 3.7Å; A281-V299 HydrophobicContact CB-CG2 4.33Å |
| 282 | V | 96.1 | Very high | 93.7 | Very high | 82 Ų | 82 | 56 Ų | 56 | 50% | 0.497 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66.6 | -41.6 | 172.1 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | T278 I279 P280 H286 | T278-V282 WeakPolarHBondContact O-CG2 3.34Å; T278-V282 PolarHBondContact O-N 3.29Å; T278-V282 VanDerWaalsContact O-N 3.08Å; I279-V282 PolarHBondContact O-N 3.03Å; P280-V282 VanDerWaalsContact C-N 3.3Å; P280-V282 PolarHBondContact O-N 3.05Å; V282-H286 PolarHBondContact O-CD2 2.82Å; V282-H286 PolarHBondContact O-N 3.36Å; V282-H286 VanDerWaalsContact O-N 3.16Å |
| 283 | I | 94.4 | Very high | 93.9 | Very high | 80 Ų | 80 | 62.2 Ų | 62.2 | 41% | 0.41 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.5 | -49.2 | 177 | -67.5 | 165.6 | 0 | 0 | 0 | 111 | I279 P280 K285 H286 I287 | I279-I283 HydrophobicContact CG2-CD1 3.93Å; I279-I283 WeakPolarHBondContact O-CG1 3.26Å; I279-I283 PolarHBondContact O-N 3.43Å; I279-I283 VanDerWaalsContact O-N 3.08Å; P280-I283 WeakPolarHBondContact O-CB 3.44Å; P280-I283 PolarHBondContact O-N 2.96Å; I283-K285 PolarHBondContact O-N 3.41Å; I283-H286 PolarHBondContact O-N 2.82Å; I283-H286 VanDerWaalsContact O-N 3.12Å; I283-I287 HydrophobicContact CG2-CD1 3.63Å; I283-I287 HydrophobicContact CG2-CG1 4.38Å; I283-I287 WeakPolarHBondContact O-CG1 3.42Å; I283-I287 PolarHBondContact O-N 3.41Å |
| 284 | F | 94.8 | Very high | 94.1 | Very high | 6 Ų | 6 | 62.4 Ų | 62.4 | 3% | 0.026 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 179 | -66.8 | -54.5 | 0 | 0 | 0 | 112.2 | P280 H286 I287 E288 W290 A295 F298 V299 A313 Y325 V329 W332 | P280-F284 HydrophobicContact CB-CD2 4.17Å; P280-F284 HydrophobicContact CB-CE2 3.76Å; P280-F284 WeakPolarHBondContact O-CD2 3.34Å; P280-F284 WeakPolarHBondContact O-CG 3.35Å; P280-F284 PolarHBondContact O-N 3.25Å; F284-H286 VanDerWaalsContact C-N 3.28Å; F284-H286 PolarHBondContact O-N 3.36Å; F284-I287 PolarHBondContact O-N 3.1Å; F284-E288 HydrophobicContact CD1-CG 4.44Å; F284-E288 VanDerWaalsContact O-CB 3.31Å; F284-E288 WeakPolarHBondContact O-CB 3.01Å; F284-E288 PolarHBondContact O-N 3.01Å; F284-W290 HydrophobicContact CB-CE3 3.89Å; F284-W290 HydrophobicContact CB-CZ3 3.88Å; F284-W290 HydrophobicContact CD1-CZ3 4.47Å; F284-W290 HydrophobicContact CG-CZ3 4.21Å; F284-A295 HydrophobicContact CB-CB 4.25Å; F284-F298 HydrophobicContact CD1-CE1 4.32Å; F284-F298 AromaticContact CD2-CD1 3.91Å; F284-F298 HydrophobicContact CD2-CD1 3.91Å; F284-F298 AromaticContact CD2-CE1 3.99Å; F284-F298 HydrophobicContact CD2-CE1 3.99Å; F284-F298 HydrophobicContact CE1-CE1 4.07Å; F284-F298 HydrophobicContact CE2-CD1 4.05Å; F284-F298 AromaticContact CE2-CE1 3.71Å; F284-F298 HydrophobicContact CE2-CE1 3.71Å; F284-F298 HydrophobicContact CG-CD1 4.27Å; F284-F298 HydrophobicContact CG-CE1 4.31Å; F284-F298 AromaticContact CZ-CE1 3.77Å; F284-F298 HydrophobicContact CZ-CE1 3.77Å; F284-V299 HydrophobicContact CD2-CG2 3.6Å; F284-V299 HydrophobicContact CE2-CG2 3.73Å; F284-A313 HydrophobicContact CD1-CB 3.91Å; F284-A313 HydrophobicContact CE1-CB 3.53Å; F284-A313 HydrophobicContact CZ-CB 4.36Å; F284-Y325 VanDerWaalsContact CD1-OH 3.3Å; F284-Y325 WeakPolarHBondContact CD1-OH 3.43Å; F284-Y325 HydrophobicContact CE1-CE2 4.4Å; F284-Y325 WeakPolarHBondContact CE1-OH 3.19Å; F284-V329 HydrophobicContact CE1-CG2 3.82Å; F284-V329 HydrophobicContact CZ-CG1 4.39Å; F284-V329 HydrophobicContact CZ-CG2 4.19Å; F284-W332 HydrophobicContact CE2-CD2 4.42Å; F284-W332 HydrophobicContact CE2-CE3 4.08Å; F284-W332 AromaticContact CE2-CH2 3.83Å; F284-W332 HydrophobicContact CE2-CH2 3.83Å; F284-W332 HydrophobicContact CE2-CZ2 4.17Å; F284-W332 AromaticContact CE2-CZ3 3.77Å; F284-W332 HydrophobicContact CE2-CZ3 3.77Å; F284-W332 HydrophobicContact CZ-CD2 4.36Å; F284-W332 AromaticContact CZ-CE3 3.73Å; F284-W332 HydrophobicContact CZ-CE3 3.73Å; F284-W332 HydrophobicContact CZ-CH2 4.18Å; F284-W332 AromaticContact CZ-CZ3 3.62Å; F284-W332 HydrophobicContact CZ-CZ3 3.62Å |
| 285 | K | 94.9 | Very high | 94.3 | Very high | 81 Ų | 81 | 58.6 Ų | 58.6 | 35% | 0.352 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -54.3 | -41.6 | 171.5 | 164.6 | 164.5 | -170.1 | -179.5 | 0 | 113 | A281 I283 G289 W290 T292 A295 | A281-K285 VanDerWaalsContact O-CB 3.28Å; A281-K285 WeakPolarHBondContact O-CB 3.33Å; A281-K285 PolarHBondContact O-N 3.38Å; I283-K285 PolarHBondContact O-N 3.41Å; K285-G289 WeakPolarHBondContact O-CA 3.14Å; K285-G289 PolarHBondContact O-N 3.4Å; K285-W290 WeakPolarHBondContact CA-O 3.38Å; K285-W290 VanDerWaalsContact CG-O 3.32Å; K285-W290 WeakPolarHBondContact CG-O 3.45Å; K285-T292 PolarHBondContact NZ-OG1 3.24Å; K285-A295 HydrophobicContact CB-CB 4.21Å |
| 286 | H | 92.5 | Very high | 94.4 | Very high | 147 Ų | 147 | 58.2 Ų | 58.2 | 68% | 0.681 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -81.1 | -29.5 | -178.7 | -78.3 | -65.8 | 0 | 0 | 0 | 114.3 | V282 I283 F284 | V282-H286 PolarHBondContact O-CD2 2.82Å; V282-H286 PolarHBondContact O-N 3.36Å; V282-H286 VanDerWaalsContact O-N 3.16Å; I283-H286 PolarHBondContact O-N 2.82Å; I283-H286 VanDerWaalsContact O-N 3.12Å; F284-H286 VanDerWaalsContact C-N 3.28Å; F284-H286 PolarHBondContact O-N 3.36Å |
| 287 | I | 91.7 | Very high | 94.6 | Very high | 66 Ų | 66 | 60.3 Ų | 60.3 | 34% | 0.338 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -90.5 | -43.6 | -178 | -64.8 | 177.8 | 0 | 0 | 0 | 112.2 | I283 F284 Y321 Y325 | I283-I287 HydrophobicContact CG2-CD1 3.63Å; I283-I287 HydrophobicContact CG2-CG1 4.38Å; I283-I287 WeakPolarHBondContact O-CG1 3.42Å; I283-I287 PolarHBondContact O-N 3.41Å; F284-I287 PolarHBondContact O-N 3.1Å; I287-Y321 HydrophobicContact CG2-CD1 4.09Å; I287-Y321 HydrophobicContact CG2-CE1 4.13Å; I287-Y325 HydrophobicContact CD1-CD2 4.07Å; I287-Y325 HydrophobicContact CD1-CE2 3.7Å; I287-Y325 HydrophobicContact CG2-CE1 4.02Å; I287-Y325 HydrophobicContact CG2-CE2 4.07Å |
| 288 | E | 91.1 | Very high | 94.7 | Very high | 12 Ų | 12 | 58.9 Ų | 58.9 | 6% | 0.056 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -92 | -10.9 | -175.7 | -53.4 | -68.4 | 173.1 | 0 | 0 | 112.9 | F284 W290 A313 G314 Y321 Y325 | F284-E288 HydrophobicContact CD1-CG 4.44Å; F284-E288 VanDerWaalsContact O-CB 3.31Å; F284-E288 WeakPolarHBondContact O-CB 3.01Å; F284-E288 PolarHBondContact O-N 3.01Å; E288-W290 VanDerWaalsContact C-N 3.27Å; E288-W290 HydrophobicContact CB-CD2 3.54Å; E288-W290 VanDerWaalsContact CB-CE2 3.4Å; E288-W290 HydrophobicContact CB-CE3 4.09Å; E288-W290 HydrophobicContact CB-CG 3.83Å; E288-W290 HydrophobicContact CB-CH2 4.38Å; E288-W290 HydrophobicContact CB-CZ2 3.86Å; E288-W290 HydrophobicContact CB-CZ3 4.46Å; E288-W290 HydrophobicContact CG-CD2 4.09Å; E288-W290 HydrophobicContact CG-CE3 4.19Å; E288-W290 HydrophobicContact CG-CH2 3.91Å; E288-W290 HydrophobicContact CG-CZ2 3.77Å; E288-W290 HydrophobicContact CG-CZ3 4.1Å; E288-W290 PolarHBondContact O-N 3.34Å; E288-A313 VanDerWaalsContact OE1-CA 3.24Å; E288-A313 WeakPolarHBondContact OE1-CA 3.36Å; E288-G314 PolarHBondContact OE1-N 2.82Å; E288-Y321 WeakPolarHBondContact OE1-CE1 3.41Å; E288-Y321 WeakPolarHBondContact OE2-CE1 3.44Å; E288-Y321 PolarHBondContact OE2-OH 3Å; E288-Y325 VanDerWaalsContact OE1-CE1 3.22Å; E288-Y325 WeakPolarHBondContact OE1-CE1 3.34Å; E288-Y325 VanDerWaalsContact OE1-CZ 3.31Å; E288-Y325 PolarHBondContact OE1-OH 3.35Å |
| 289 | G | 91.3 | Very high | 94.8 | Very high | 65 Ų | 65 | 55.7 Ų | 55.7 | 67% | 0.67 | 30% | 0.3 | S | S | * | . | trans | 77.9 | 4 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | K285 | K285-G289 WeakPolarHBondContact O-CA 3.14Å; K285-G289 PolarHBondContact O-N 3.4Å | ||
| 290 | W | 94.8 | Very high | 94.8 | Very high | 35 Ų | 35 | 54.6 Ų | 54.6 | 13% | 0.133 | 30% | 0.298 | C | S | . | . | trans | -64.1 | 152.7 | -178.5 | -58.3 | -22.2 | 0 | 0 | 0 | 113.3 | F284 K285 E288 E294 A295 F298 Y311 A313 | F284-W290 HydrophobicContact CB-CE3 3.89Å; F284-W290 HydrophobicContact CB-CZ3 3.88Å; F284-W290 HydrophobicContact CD1-CZ3 4.47Å; F284-W290 HydrophobicContact CG-CZ3 4.21Å; K285-W290 WeakPolarHBondContact CA-O 3.38Å; K285-W290 VanDerWaalsContact CG-O 3.32Å; K285-W290 WeakPolarHBondContact CG-O 3.45Å; E288-W290 VanDerWaalsContact C-N 3.27Å; E288-W290 HydrophobicContact CB-CD2 3.54Å; E288-W290 VanDerWaalsContact CB-CE2 3.4Å; E288-W290 HydrophobicContact CB-CE3 4.09Å; E288-W290 HydrophobicContact CB-CG 3.83Å; E288-W290 HydrophobicContact CB-CH2 4.38Å; E288-W290 HydrophobicContact CB-CZ2 3.86Å; E288-W290 HydrophobicContact CB-CZ3 4.46Å; E288-W290 HydrophobicContact CG-CD2 4.09Å; E288-W290 HydrophobicContact CG-CE3 4.19Å; E288-W290 HydrophobicContact CG-CH2 3.91Å; E288-W290 HydrophobicContact CG-CZ2 3.77Å; E288-W290 HydrophobicContact CG-CZ3 4.1Å; E288-W290 PolarHBondContact O-N 3.34Å; W290-E294 HydrophobicContact CB-CB 4.08Å; W290-A295 HydrophobicContact CB-CB 4.45Å; W290-A295 HydrophobicContact CE3-CB 4.3Å; W290-F298 HydrophobicContact CE3-CB 4.39Å; W290-F298 HydrophobicContact CH2-CB 4.36Å; W290-F298 HydrophobicContact CH2-CD1 4.02Å; W290-F298 HydrophobicContact CH2-CD2 4.04Å; W290-F298 HydrophobicContact CH2-CE1 4.36Å; W290-F298 HydrophobicContact CH2-CE2 4.39Å; W290-F298 AromaticContact CH2-CG 3.84Å; W290-F298 HydrophobicContact CH2-CG 3.84Å; W290-F298 HydrophobicContact CZ3-CB 3.77Å; W290-F298 AromaticContact CZ3-CD1 3.52Å; W290-F298 HydrophobicContact CZ3-CD1 3.52Å; W290-F298 HydrophobicContact CZ3-CD2 4.21Å; W290-F298 HydrophobicContact CZ3-CE1 4.18Å; W290-F298 AromaticContact CZ3-CG 3.53Å; W290-F298 HydrophobicContact CZ3-CG 3.53Å; W290-Y311 HydrophobicContact CD2-CD1 4.05Å; W290-Y311 AromaticContact CE2-CD1 3.78Å; W290-Y311 HydrophobicContact CG-CD1 4.27Å; W290-Y311 HydrophobicContact CZ2-CD1 4.21Å; W290-Y311 AromaticContact NE1-CD1 3.8Å; W290-A313 HydrophobicContact CH2-CB 4.34Å | ||
| 291 | T | 96.3 | Very high | 94.8 | Very high | 77 Ų | 77 | 55.4 Ų | 55.4 | 47% | 0.472 | 30% | 0.301 | S | S | . | . | trans | -65 | 164.3 | 168.4 | 69.6 | 0 | 0 | 0 | 0 | 111.6 | L293 E294 A295 | T291-L293 PolarHBondContact O-N 2.97Å; T291-E294 WeakPolarHBondContact CA-OE2 3.18Å; T291-E294 WeakPolarHBondContact CB-OE2 3.35Å; T291-E294 WeakPolarHBondContact CG2-OE2 3.39Å; T291-E294 PolarHBondContact N-OE2 3.16Å; T291-E294 PolarHBondContact O-N 2.88Å; T291-E294 VanDerWaalsContact OG1-CD 3.29Å; T291-E294 WeakPolarHBondContact OG1-CG 3.21Å; T291-E294 PolarHBondContact OG1-N 2.95Å; T291-E294 PolarHBondContact OG1-OE2 3.13Å; T291-A295 WeakPolarHBondContact O-CB 3.49Å; T291-A295 PolarHBondContact O-N 2.89Å | ||
| 292 | T | 94.9 | Very high | 94.8 | Very high | 76 Ų | 76 | 55 Ų | 55 | 47% | 0.466 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -59.4 | -31.8 | 176.8 | -46.7 | 0 | 0 | 0 | 0 | 112.4 | K285 I296 | K285-T292 PolarHBondContact NZ-OG1 3.24Å; T292-I296 HydrophobicContact CG2-CD1 4.04Å; T292-I296 WeakPolarHBondContact O-CD1 3.41Å; T292-I296 VanDerWaalsContact O-CG1 3.26Å; T292-I296 WeakPolarHBondContact O-CG1 3.14Å; T292-I296 PolarHBondContact O-N 3.27Å |
| 293 | L | 95 | Very high | 94.7 | Very high | 136 Ų | 136 | 51.5 Ų | 51.5 | 71% | 0.712 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -73.5 | -51.4 | -179.1 | -179.6 | 60.8 | 0 | 0 | 0 | 111.1 | T291 A295 I296 Y297 | T291-L293 PolarHBondContact O-N 2.97Å; L293-A295 VanDerWaalsContact C-N 3.31Å; L293-A295 PolarHBondContact O-N 2.91Å; L293-I296 PolarHBondContact O-N 3.01Å; L293-Y297 VanDerWaalsContact O-CB 3.29Å; L293-Y297 WeakPolarHBondContact O-CB 3.35Å; L293-Y297 PolarHBondContact O-N 3.29Å |
| 294 | E | 95.9 | Very high | 94.7 | Very high | 53 Ų | 53 | 49.4 Ų | 49.4 | 25% | 0.248 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -58.2 | -42 | 178 | -66 | 159 | 131.6 | 0 | 0 | 111.5 | W290 T291 Y297 F298 Y311 | W290-E294 HydrophobicContact CB-CB 4.08Å; T291-E294 WeakPolarHBondContact CA-OE2 3.18Å; T291-E294 WeakPolarHBondContact CB-OE2 3.35Å; T291-E294 WeakPolarHBondContact CG2-OE2 3.39Å; T291-E294 PolarHBondContact N-OE2 3.16Å; T291-E294 PolarHBondContact O-N 2.88Å; T291-E294 VanDerWaalsContact OG1-CD 3.29Å; T291-E294 WeakPolarHBondContact OG1-CG 3.21Å; T291-E294 PolarHBondContact OG1-N 2.95Å; T291-E294 PolarHBondContact OG1-OE2 3.13Å; E294-Y297 PolarHBondContact O-N 3.33Å; E294-F298 WeakPolarHBondContact O-CB 3.41Å; E294-F298 PolarHBondContact O-N 3.01Å; E294-Y311 HydrophobicContact CB-CD1 4.22Å; E294-Y311 HydrophobicContact CB-CE1 3.82Å; E294-Y311 HydrophobicContact CG-CE1 3.73Å; E294-Y311 HydrophobicContact CG-CE2 4.43Å; E294-Y311 WeakPolarHBondContact OE1-CE1 3.4Å; E294-Y311 PolarHBondContact OE1-OH 3.23Å |
| 295 | A | 96.8 | Very high | 94.7 | Very high | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -67.7 | -35.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | A281 F284 K285 W290 T291 L293 V299 | A281-A295 HydrophobicContact CB-CB 4.24Å; A281-A295 VanDerWaalsContact O-CB 3.26Å; A281-A295 WeakPolarHBondContact O-CB 3.19Å; F284-A295 HydrophobicContact CB-CB 4.25Å; K285-A295 HydrophobicContact CB-CB 4.21Å; W290-A295 HydrophobicContact CB-CB 4.45Å; W290-A295 HydrophobicContact CE3-CB 4.3Å; T291-A295 WeakPolarHBondContact O-CB 3.49Å; T291-A295 PolarHBondContact O-N 2.89Å; L293-A295 VanDerWaalsContact C-N 3.31Å; L293-A295 PolarHBondContact O-N 2.91Å; A295-V299 WeakPolarHBondContact O-CB 3.28Å; A295-V299 WeakPolarHBondContact O-CG2 3.48Å; A295-V299 PolarHBondContact O-N 3.36Å |
| 296 | I | 95.8 | Very high | 94.7 | Very high | 68 Ų | 68 | 52.1 Ų | 52.1 | 35% | 0.349 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -71.1 | -41.5 | 172.5 | -69.6 | 170.2 | 0 | 0 | 0 | 110.4 | A281 T292 L293 V299 V300 | A281-I296 HydrophobicContact CB-CG1 3.7Å; T292-I296 HydrophobicContact CG2-CD1 4.04Å; T292-I296 WeakPolarHBondContact O-CD1 3.41Å; T292-I296 VanDerWaalsContact O-CG1 3.26Å; T292-I296 WeakPolarHBondContact O-CG1 3.14Å; T292-I296 PolarHBondContact O-N 3.27Å; L293-I296 PolarHBondContact O-N 3.01Å; I296-V299 PolarHBondContact O-N 3.15Å; I296-V300 HydrophobicContact CG2-CG2 4.47Å; I296-V300 WeakPolarHBondContact O-CG2 3.48Å; I296-V300 PolarHBondContact O-N 3.3Å |
| 297 | Y | 96.2 | Very high | 94.8 | Very high | 77 Ų | 77 | 45.5 Ų | 45.5 | 30% | 0.302 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.3 | -52.1 | 177.4 | 166.2 | -95.7 | 0 | 0 | 0 | 111.7 | L293 E294 V299 V300 I301 I308 D310 Y311 | L293-Y297 VanDerWaalsContact O-CB 3.29Å; L293-Y297 WeakPolarHBondContact O-CB 3.35Å; L293-Y297 PolarHBondContact O-N 3.29Å; E294-Y297 PolarHBondContact O-N 3.33Å; Y297-V299 VanDerWaalsContact C-N 3.3Å; Y297-V299 PolarHBondContact O-N 2.87Å; Y297-V300 PolarHBondContact O-N 3.31Å; Y297-V300 VanDerWaalsContact O-N 3.15Å; Y297-I301 HydrophobicContact CD2-CG1 3.88Å; Y297-I301 HydrophobicContact CE1-CG1 4.3Å; Y297-I301 HydrophobicContact CE2-CD1 4.1Å; Y297-I301 HydrophobicContact CE2-CG1 3.66Å; Y297-I301 HydrophobicContact CG-CG1 4.32Å; Y297-I301 WeakPolarHBondContact O-CB 3.32Å; Y297-I301 WeakPolarHBondContact O-CG1 3.26Å; Y297-I301 PolarHBondContact O-N 3.06Å; Y297-I308 VanDerWaalsContact OH-CD1 3.26Å; Y297-I308 WeakPolarHBondContact OH-CD1 3.42Å; Y297-D310 WeakPolarHBondContact CE1-OD2 3.42Å; Y297-D310 VanDerWaalsContact CZ-OD2 3.31Å; Y297-D310 PolarHBondContact OH-OD2 3.45Å; Y297-Y311 AromaticContact CD1-CD2 3.97Å; Y297-Y311 HydrophobicContact CD1-CD2 3.97Å; Y297-Y311 HydrophobicContact CD1-CE2 4.32Å; Y297-Y311 AromaticContact CE1-CD2 3.79Å; Y297-Y311 HydrophobicContact CE1-CD2 3.79Å; Y297-Y311 HydrophobicContact CE1-CE2 4.13Å |
| 298 | F | 96.2 | Very high | 94.9 | Very high | 3 Ų | 3 | 46.7 Ų | 46.7 | 1% | 0.013 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -51.8 | -49.6 | 174.3 | 168 | -105 | 0 | 0 | 0 | 111.6 | Y197 F284 W290 E294 V300 I301 T302 Y311 A313 W332 | Y197-F298 AromaticContact CE1-CE2 3.99Å; Y197-F298 HydrophobicContact CE1-CE2 3.99Å; F284-F298 HydrophobicContact CD1-CE1 4.32Å; F284-F298 AromaticContact CD2-CD1 3.91Å; F284-F298 HydrophobicContact CD2-CD1 3.91Å; F284-F298 AromaticContact CD2-CE1 3.99Å; F284-F298 HydrophobicContact CD2-CE1 3.99Å; F284-F298 HydrophobicContact CE1-CE1 4.07Å; F284-F298 HydrophobicContact CE2-CD1 4.05Å; F284-F298 AromaticContact CE2-CE1 3.71Å; F284-F298 HydrophobicContact CE2-CE1 3.71Å; F284-F298 HydrophobicContact CG-CD1 4.27Å; F284-F298 HydrophobicContact CG-CE1 4.31Å; F284-F298 AromaticContact CZ-CE1 3.77Å; F284-F298 HydrophobicContact CZ-CE1 3.77Å; W290-F298 HydrophobicContact CE3-CB 4.39Å; W290-F298 HydrophobicContact CH2-CB 4.36Å; W290-F298 HydrophobicContact CH2-CD1 4.02Å; W290-F298 HydrophobicContact CH2-CD2 4.04Å; W290-F298 HydrophobicContact CH2-CE1 4.36Å; W290-F298 HydrophobicContact CH2-CE2 4.39Å; W290-F298 AromaticContact CH2-CG 3.84Å; W290-F298 HydrophobicContact CH2-CG 3.84Å; W290-F298 HydrophobicContact CZ3-CB 3.77Å; W290-F298 AromaticContact CZ3-CD1 3.52Å; W290-F298 HydrophobicContact CZ3-CD1 3.52Å; W290-F298 HydrophobicContact CZ3-CD2 4.21Å; W290-F298 HydrophobicContact CZ3-CE1 4.18Å; W290-F298 AromaticContact CZ3-CG 3.53Å; W290-F298 HydrophobicContact CZ3-CG 3.53Å; E294-F298 WeakPolarHBondContact O-CB 3.41Å; E294-F298 PolarHBondContact O-N 3.01Å; F298-V300 PolarHBondContact O-N 2.61Å; F298-I301 PolarHBondContact O-N 2.98Å; F298-T302 VanDerWaalsContact CE2-OG1 3.24Å; F298-T302 WeakPolarHBondContact CE2-OG1 3.11Å; F298-T302 WeakPolarHBondContact CZ-OG1 3.31Å; F298-T302 WeakPolarHBondContact O-CB 3.23Å; F298-T302 PolarHBondContact O-N 3.24Å; F298-T302 PolarHBondContact O-OG1 2.91Å; F298-Y311 WeakPolarHBondContact CD2-O 3.38Å; F298-Y311 WeakPolarHBondContact CE2-O 3.42Å; F298-A313 HydrophobicContact CE1-CB 3.91Å; F298-A313 HydrophobicContact CZ-CB 3.7Å; F298-W332 AromaticContact CE1-CH2 3.98Å; F298-W332 HydrophobicContact CE1-CH2 3.98Å; F298-W332 AromaticContact CE1-CZ3 3.93Å; F298-W332 HydrophobicContact CE1-CZ3 3.93Å; F298-W332 HydrophobicContact CZ-CZ3 4.34Å |
| 299 | V | 96.1 | Very high | 94.9 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60 | -43.7 | 180 | 158.2 | 0 | 0 | 0 | 0 | 112 | V277 P280 A281 F284 A295 I296 Y297 L303 W332 | V277-V299 HydrophobicContact CB-CG1 4Å; V277-V299 HydrophobicContact CG1-CG1 3.74Å; V277-V299 HydrophobicContact CG2-CG1 4.1Å; P280-V299 HydrophobicContact CB-CG2 4.15Å; A281-V299 HydrophobicContact CB-CG2 4.33Å; F284-V299 HydrophobicContact CD2-CG2 3.6Å; F284-V299 HydrophobicContact CE2-CG2 3.73Å; A295-V299 WeakPolarHBondContact O-CB 3.28Å; A295-V299 WeakPolarHBondContact O-CG2 3.48Å; A295-V299 PolarHBondContact O-N 3.36Å; I296-V299 PolarHBondContact O-N 3.15Å; Y297-V299 VanDerWaalsContact C-N 3.3Å; Y297-V299 PolarHBondContact O-N 2.87Å; V299-L303 WeakPolarHBondContact O-CB 3.3Å; V299-L303 WeakPolarHBondContact O-CG 3.42Å; V299-L303 PolarHBondContact O-N 3.08Å; V299-L303 VanDerWaalsContact O-N 3.08Å; V299-W332 HydrophobicContact CB-CZ2 4.28Å; V299-W332 HydrophobicContact CG1-CZ2 4.14Å; V299-W332 HydrophobicContact CG2-CH2 4.09Å; V299-W332 HydrophobicContact CG2-CZ2 3.89Å |
| 300 | V | 94.4 | Very high | 94.8 | Very high | 66 Ų | 66 | 47.7 Ų | 47.7 | 40% | 0.4 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -66.9 | -55.9 | 176.6 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | I296 Y297 F298 T302 L303 T304 | I296-V300 HydrophobicContact CG2-CG2 4.47Å; I296-V300 WeakPolarHBondContact O-CG2 3.48Å; I296-V300 PolarHBondContact O-N 3.3Å; Y297-V300 PolarHBondContact O-N 3.31Å; Y297-V300 VanDerWaalsContact O-N 3.15Å; F298-V300 PolarHBondContact O-N 2.61Å; V300-T302 PolarHBondContact O-N 2.97Å; V300-L303 PolarHBondContact O-N 3.35Å; V300-L303 VanDerWaalsContact O-N 3.14Å; V300-T304 HydrophobicContact CG1-CG2 3.93Å; V300-T304 WeakPolarHBondContact O-CB 3.4Å; V300-T304 VanDerWaalsContact O-CG2 3.22Å; V300-T304 WeakPolarHBondContact O-CG2 3.28Å; V300-T304 PolarHBondContact O-N 2.85Å; V300-T304 PolarHBondContact O-OG1 3.48Å |
| 301 | I | 95.4 | Very high | 94.8 | Very high | 26 Ų | 26 | 49 Ų | 49 | 13% | 0.133 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -57.4 | -33.6 | -177.7 | -67.6 | -62.2 | 0 | 0 | 0 | 112.5 | Y297 F298 T304 V306 G307 I308 | Y297-I301 HydrophobicContact CD2-CG1 3.88Å; Y297-I301 HydrophobicContact CE1-CG1 4.3Å; Y297-I301 HydrophobicContact CE2-CD1 4.1Å; Y297-I301 HydrophobicContact CE2-CG1 3.66Å; Y297-I301 HydrophobicContact CG-CG1 4.32Å; Y297-I301 WeakPolarHBondContact O-CB 3.32Å; Y297-I301 WeakPolarHBondContact O-CG1 3.26Å; Y297-I301 PolarHBondContact O-N 3.06Å; F298-I301 PolarHBondContact O-N 2.98Å; I301-T304 WeakPolarHBondContact CA-OG1 3.46Å; I301-T304 PolarHBondContact O-OG1 3.16Å; I301-V306 HydrophobicContact CD1-CB 4.32Å; I301-V306 HydrophobicContact CD1-CG1 4.12Å; I301-V306 HydrophobicContact CG2-CB 4.28Å; I301-V306 HydrophobicContact CG2-CG1 4.43Å; I301-V306 PolarHBondContact O-N 3.2Å; I301-G307 PolarHBondContact O-N 3.25Å; I301-I308 HydrophobicContact CD1-CD1 3.86Å; I301-I308 HydrophobicContact CG1-CD1 4.34Å; I301-I308 HydrophobicContact CG2-CB 4.14Å; I301-I308 HydrophobicContact CG2-CD1 4.26Å; I301-I308 HydrophobicContact CG2-CG1 4Å |
| 302 | T | 95.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -69.9 | -55.3 | 174 | -62.3 | 0 | 0 | 0 | 0 | 111.8 | I195 Y197 F298 V300 T304 T305 W332 I333 | I195-T302 HydrophobicContact CD1-CG2 4.1Å; Y197-T302 VanDerWaalsContact OH-CG2 3.25Å; Y197-T302 WeakPolarHBondContact OH-CG2 3.28Å; Y197-T302 PolarHBondContact OH-OG1 2.99Å; F298-T302 VanDerWaalsContact CE2-OG1 3.24Å; F298-T302 WeakPolarHBondContact CE2-OG1 3.11Å; F298-T302 WeakPolarHBondContact CZ-OG1 3.31Å; F298-T302 WeakPolarHBondContact O-CB 3.23Å; F298-T302 PolarHBondContact O-N 3.24Å; F298-T302 PolarHBondContact O-OG1 2.91Å; V300-T302 PolarHBondContact O-N 2.97Å; T302-T304 VanDerWaalsContact C-N 3.26Å; T302-T304 PolarHBondContact O-N 2.84Å; T302-T305 PolarHBondContact O-N 3.41Å; T302-T305 VanDerWaalsContact O-N 3.08Å; T302-W332 HydrophobicContact CG2-CH2 3.75Å; T302-W332 HydrophobicContact CG2-CZ3 3.93Å; T302-I333 HydrophobicContact CG2-CD1 3.99Å; T302-I333 HydrophobicContact CG2-CG1 3.83Å |
| 303 | L | 94.5 | Very high | 94.4 | Very high | 8 Ų | 8 | 42.6 Ų | 42.6 | 4% | 0.042 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -72.8 | -18.8 | -175.9 | -63.9 | -174.6 | 0 | 0 | 0 | 113.2 | F276 V299 V300 T305 W332 L337 F340 | F276-L303 HydrophobicContact CB-CD1 4.27Å; V299-L303 WeakPolarHBondContact O-CB 3.3Å; V299-L303 WeakPolarHBondContact O-CG 3.42Å; V299-L303 PolarHBondContact O-N 3.08Å; V299-L303 VanDerWaalsContact O-N 3.08Å; V300-L303 PolarHBondContact O-N 3.35Å; V300-L303 VanDerWaalsContact O-N 3.14Å; L303-T305 VanDerWaalsContact C-N 3.27Å; L303-W332 HydrophobicContact CD1-CZ2 3.87Å; L303-W332 HydrophobicContact CD2-CH2 4.35Å; L303-W332 HydrophobicContact CD2-CZ2 3.86Å; L303-W332 HydrophobicContact CG-CH2 4.35Å; L303-W332 HydrophobicContact CG-CZ2 3.73Å; L303-L337 WeakPolarHBondContact O-CD2 3.26Å; L303-F340 WeakPolarHBondContact O-CD1 3.38Å; L303-F340 WeakPolarHBondContact O-CG 3.47Å |
| 304 | T | 93.9 | Very high | 93.9 | Very high | 36 Ų | 36 | 36.5 Ų | 36.5 | 22% | 0.221 | 20% | 0.198 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | 1 | 170.2 | 60.6 | 0 | 0 | 0 | 0 | 113.9 | V300 I301 T302 V306 F340 | V300-T304 HydrophobicContact CG1-CG2 3.93Å; V300-T304 WeakPolarHBondContact O-CB 3.4Å; V300-T304 VanDerWaalsContact O-CG2 3.22Å; V300-T304 WeakPolarHBondContact O-CG2 3.28Å; V300-T304 PolarHBondContact O-N 2.85Å; V300-T304 PolarHBondContact O-OG1 3.48Å; I301-T304 WeakPolarHBondContact CA-OG1 3.46Å; I301-T304 PolarHBondContact O-OG1 3.16Å; T302-T304 VanDerWaalsContact C-N 3.26Å; T302-T304 PolarHBondContact O-N 2.84Å; T304-V306 PolarHBondContact O-N 3.18Å; T304-V306 VanDerWaalsContact OG1-CG2 3.25Å; T304-V306 WeakPolarHBondContact OG1-CG2 3.39Å; T304-F340 HydrophobicContact CG2-CE1 4.04Å; T304-F340 HydrophobicContact CG2-CE2 4Å; T304-F340 HydrophobicContact CG2-CZ 3.57Å |
| 305 | T | 95 | Very high | 93.2 | Very high | 58 Ų | 58 | 34.8 Ų | 34.8 | 36% | 0.356 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 47.2 | 42.5 | -169.8 | 67.6 | 0 | 0 | 0 | 0 | 113 | I195 T302 L303 L337 | I195-T305 HydrophobicContact CG1-CG2 3.99Å; T302-T305 PolarHBondContact O-N 3.41Å; T302-T305 VanDerWaalsContact O-N 3.08Å; L303-T305 VanDerWaalsContact C-N 3.27Å; T305-L337 HydrophobicContact CG2-CD2 3.41Å; T305-L337 VanDerWaalsContact CG2-CD2 3.41Å |
| 306 | V | 95.4 | Very high | 92.5 | Very high | 86 Ų | 86 | 37.3 Ų | 37.3 | 52% | 0.521 | 21% | 0.208 | S | C | . | . | trans | -97.3 | -36.1 | 174.5 | 174.5 | 0 | 0 | 0 | 0 | 110.5 | I301 T304 I308 | I301-V306 HydrophobicContact CD1-CB 4.32Å; I301-V306 HydrophobicContact CD1-CG1 4.12Å; I301-V306 HydrophobicContact CG2-CB 4.28Å; I301-V306 HydrophobicContact CG2-CG1 4.43Å; I301-V306 PolarHBondContact O-N 3.2Å; T304-V306 PolarHBondContact O-N 3.18Å; T304-V306 VanDerWaalsContact OG1-CG2 3.25Å; T304-V306 WeakPolarHBondContact OG1-CG2 3.39Å; V306-I308 HydrophobicContact CG1-CD1 4.38Å; V306-I308 HydrophobicContact CG1-CG1 4.09Å; V306-I308 PolarHBondContact O-N 3.45Å | ||
| 307 | G | 94.1 | Very high | 91.4 | Very high | 7 Ų | 7 | 36.7 Ų | 36.7 | 7% | 0.072 | 20% | 0.201 | C | C | . | . | trans | 51.1 | 55 | 162.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | I195 Y197 I301 G309 | I195-G307 WeakPolarHBondContact O-CA 3.41Å; Y197-G307 WeakPolarHBondContact CA-O 3.36Å; I301-G307 PolarHBondContact O-N 3.25Å; G307-G309 VanDerWaalsContact C-N 3.27Å; G307-G309 PolarHBondContact O-N 3.41Å | ||
| 308 | I | 93.3 | Very high | 90.4 | Very high | 92 Ų | 92 | 38.3 Ų | 38.3 | 47% | 0.472 | 22% | 0.22 | S | C | . | . | trans | -62.6 | -34.3 | 179.8 | -63.3 | 168.7 | 0 | 0 | 0 | 111.8 | Y297 I301 V306 D310 | Y297-I308 VanDerWaalsContact OH-CD1 3.26Å; Y297-I308 WeakPolarHBondContact OH-CD1 3.42Å; I301-I308 HydrophobicContact CD1-CD1 3.86Å; I301-I308 HydrophobicContact CG1-CD1 4.34Å; I301-I308 HydrophobicContact CG2-CB 4.14Å; I301-I308 HydrophobicContact CG2-CD1 4.26Å; I301-I308 HydrophobicContact CG2-CG1 4Å; V306-I308 HydrophobicContact CG1-CD1 4.38Å; V306-I308 HydrophobicContact CG1-CG1 4.09Å; V306-I308 PolarHBondContact O-N 3.45Å; I308-D310 VanDerWaalsContact C-N 3.25Å; I308-D310 HydrophobicContact CG2-CB 4.29Å; I308-D310 PolarHBondContact O-N 3.23Å | ||
| 309 | G | 90.8 | Very high | 89.7 | Confident | 14 Ų | 14 | 40.5 Ų | 40.5 | 14% | 0.144 | 23% | 0.231 | C | C | . | . | trans | 75.3 | 9 | 170.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | Y197 G307 Y311 | Y197-G309 WeakPolarHBondContact O-CA 3.37Å; G307-G309 VanDerWaalsContact C-N 3.27Å; G307-G309 PolarHBondContact O-N 3.41Å; G309-Y311 VanDerWaalsContact C-N 3.27Å | ||
| 310 | D | 90.9 | Very high | 88.9 | Confident | 84 Ų | 84 | 48.6 Ų | 48.6 | 45% | 0.449 | 27% | 0.274 | S | S | . | . | S | Bend | trans | -55.2 | -41.7 | 158.7 | 47.7 | 2.1 | 0 | 0 | 0 | 111.9 | Y297 I308 | Y297-D310 WeakPolarHBondContact CE1-OD2 3.42Å; Y297-D310 VanDerWaalsContact CZ-OD2 3.31Å; Y297-D310 PolarHBondContact OH-OD2 3.45Å; I308-D310 VanDerWaalsContact C-N 3.25Å; I308-D310 HydrophobicContact CG2-CB 4.29Å; I308-D310 PolarHBondContact O-N 3.23Å |
| 311 | Y | 93.3 | Very high | 88.4 | Confident | 63 Ų | 63 | 47.5 Ų | 47.5 | 25% | 0.247 | 26% | 0.263 | C | S | . | . | S | Bend | trans | -114.9 | 128.3 | 170.3 | -59.8 | -93.9 | 0 | 0 | 0 | 109.9 | W290 E294 Y297 F298 G309 | W290-Y311 HydrophobicContact CD2-CD1 4.05Å; W290-Y311 AromaticContact CE2-CD1 3.78Å; W290-Y311 HydrophobicContact CG-CD1 4.27Å; W290-Y311 HydrophobicContact CZ2-CD1 4.21Å; W290-Y311 AromaticContact NE1-CD1 3.8Å; E294-Y311 HydrophobicContact CB-CD1 4.22Å; E294-Y311 HydrophobicContact CB-CE1 3.82Å; E294-Y311 HydrophobicContact CG-CE1 3.73Å; E294-Y311 HydrophobicContact CG-CE2 4.43Å; E294-Y311 WeakPolarHBondContact OE1-CE1 3.4Å; E294-Y311 PolarHBondContact OE1-OH 3.23Å; Y297-Y311 AromaticContact CD1-CD2 3.97Å; Y297-Y311 HydrophobicContact CD1-CD2 3.97Å; Y297-Y311 HydrophobicContact CD1-CE2 4.32Å; Y297-Y311 AromaticContact CE1-CD2 3.79Å; Y297-Y311 HydrophobicContact CE1-CD2 3.79Å; Y297-Y311 HydrophobicContact CE1-CE2 4.13Å; F298-Y311 WeakPolarHBondContact CD2-O 3.38Å; F298-Y311 WeakPolarHBondContact CE2-O 3.42Å; G309-Y311 VanDerWaalsContact C-N 3.27Å |
| 312 | V | 92.1 | Very high | 87.9 | Confident | 15 Ų | 15 | 53.2 Ų | 53.2 | 9% | 0.091 | 29% | 0.291 | C | S | . | . | trans | -140.6 | 117.3 | 177 | -178.3 | 0 | 0 | 0 | 0 | 110.2 | F186 Y197 N199 G315 | F186-V312 HydrophobicContact CE1-CG1 3.76Å; F186-V312 HydrophobicContact CZ-CG1 4.11Å; Y197-V312 HydrophobicContact CD1-CG2 4.03Å; Y197-V312 HydrophobicContact CD2-CG1 4.01Å; Y197-V312 HydrophobicContact CD2-CG2 4.11Å; Y197-V312 HydrophobicContact CE2-CG1 4.13Å; Y197-V312 HydrophobicContact CG-CG2 3.8Å; N199-V312 HydrophobicContact CB-CG2 4.2Å; V312-G315 PolarHBondContact O-N 2.86Å; V312-G315 VanDerWaalsContact O-N 3.13Å | ||
| 313 | A | 91.1 | Very high | 87.3 | Confident | 3 Ų | 3 | 60.2 Ų | 60.2 | 3% | 0.025 | 33% | 0.328 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | 135.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | F284 E288 W290 F298 G315 V329 | F284-A313 HydrophobicContact CD1-CB 3.91Å; F284-A313 HydrophobicContact CE1-CB 3.53Å; F284-A313 HydrophobicContact CZ-CB 4.36Å; E288-A313 VanDerWaalsContact OE1-CA 3.24Å; E288-A313 WeakPolarHBondContact OE1-CA 3.36Å; W290-A313 HydrophobicContact CH2-CB 4.34Å; F298-A313 HydrophobicContact CE1-CB 3.91Å; F298-A313 HydrophobicContact CZ-CB 3.7Å; A313-G315 PolarHBondContact O-N 3.32Å; A313-V329 HydrophobicContact CB-CG1 4.14Å; A313-V329 HydrophobicContact CB-CG2 4.33Å |
| 314 | G | 85.6 | Confident | 86.8 | Confident | 7 Ų | 7 | 69.6 Ų | 69.6 | 7% | 0.072 | 36% | 0.363 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 74.7 | 10 | -174.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | E288 Y321 K326 | E288-G314 PolarHBondContact OE1-N 2.82Å; G314-Y321 VanDerWaalsContact CA-CZ 3.47Å; G314-K326 WeakPolarHBondContact O-CE 3.24Å; G314-K326 PolarHBondContact O-NZ 3.32Å |
| 315 | G | 80 | Confident | 86.6 | Confident | 17 Ų | 17 | 68.6 Ų | 68.6 | 18% | 0.175 | 36% | 0.356 | C | S | . | . | trans | -91.6 | -17.2 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | R168 V312 A313 R317 | R168-G315 PolarHBondContact NH2-O 3.32Å; V312-G315 PolarHBondContact O-N 2.86Å; V312-G315 VanDerWaalsContact O-N 3.13Å; A313-G315 PolarHBondContact O-N 3.32Å; G315-R317 PolarHBondContact O-N 2.86Å | ||
| 316 | N | 82.1 | Confident | 86.2 | Confident | 53 Ų | 53 | 68.4 Ų | 68.4 | 28% | 0.283 | 35% | 0.35 | S | S | . | . | trans | -92.8 | 105.2 | -174.5 | -167.9 | 19.1 | 0 | 0 | 0 | 113.9 | R168 T318 I319 Y321 | R168-N316 PolarHBondContact NH1-OD1 3.08Å; N316-T318 PolarHBondContact ND2-OG1 3.14Å; N316-T318 PolarHBondContact O-N 2.7Å; N316-T318 VanDerWaalsContact O-N 3.08Å; N316-T318 PolarHBondContact OD1-OG1 3.18Å; N316-I319 HydrophobicContact CB-CD1 4.25Å; N316-I319 HydrophobicContact CB-CG1 4.46Å; N316-I319 PolarHBondContact O-N 3.15Å; N316-Y321 WeakPolarHBondContact CA-OH 3.36Å; N316-Y321 WeakPolarHBondContact CB-OH 3.35Å; N316-Y321 PolarHBondContact N-OH 3.38Å; N316-Y321 VanDerWaalsContact O-CE2 3.28Å; N316-Y321 WeakPolarHBondContact O-CE2 3.31Å | ||
| 317 | R | 74 | Confident | 85.9 | Confident | 56 Ų | 56 | 67.4 Ų | 67.4 | 21% | 0.211 | 35% | 0.345 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -8.8 | -178.6 | -72 | 167.7 | 163.2 | 152.8 | 5.2 | 116.5 | G166 S176 S177 Y178 G315 | G166-R317 PolarHBondContact O-NH1 3.13Å; G166-R317 VanDerWaalsContact O-NH1 3.16Å; S176-R317 PolarHBondContact O-NE 2.89Å; S176-R317 PolarHBondContact O-NH2 3.45Å; S176-R317 WeakPolarHBondContact OG-CD 3.33Å; S176-R317 PolarHBondContact OG-NE 3.47Å; S177-R317 PolarHBondContact O-NH2 2.95Å; Y178-R317 VanDerWaalsContact CE1-CZ 3.44Å; Y178-R317 VanDerWaalsContact CE2-NH1 3.34Å; Y178-R317 VanDerWaalsContact CZ-CZ 3.46Å; G315-R317 PolarHBondContact O-N 2.86Å |
| 318 | T | 74.8 | Confident | 85.7 | Confident | 111 Ų | 111 | 72.3 Ų | 72.3 | 68% | 0.681 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | 3.7 | 172 | 67.5 | 0 | 0 | 0 | 0 | 112.7 | N316 | N316-T318 PolarHBondContact ND2-OG1 3.14Å; N316-T318 PolarHBondContact O-N 2.7Å; N316-T318 VanDerWaalsContact O-N 3.08Å; N316-T318 PolarHBondContact OD1-OG1 3.18Å |
| 319 | I | 81.4 | Confident | 85.7 | Confident | 48 Ų | 48 | 68.2 Ų | 68.2 | 25% | 0.246 | 35% | 0.349 | C | S | . | . | S | Bend | trans | -123.3 | 118 | -178.6 | -53.4 | 179.3 | 0 | 0 | 0 | 108.2 | N316 Y321 | N316-I319 HydrophobicContact CB-CD1 4.25Å; N316-I319 HydrophobicContact CB-CG1 4.46Å; N316-I319 PolarHBondContact O-N 3.15Å; I319-Y321 HydrophobicContact CB-CE1 4.19Å; I319-Y321 HydrophobicContact CB-CE2 4.2Å; I319-Y321 HydrophobicContact CG2-CD1 4.06Å; I319-Y321 HydrophobicContact CG2-CE1 3.9Å; I319-Y321 WeakPolarHBondContact O-CD2 3.2Å; I319-Y321 WeakPolarHBondContact O-CE2 3.3Å; I319-Y321 PolarHBondContact O-N 2.83Å |
| 320 | D | 79.9 | Confident | 85.7 | Confident | 171 Ų | 171 | 69.9 Ų | 69.9 | 91% | 0.914 | 35% | 0.35 | S | S | * | . | trans | -77 | 90 | 174 | -75.6 | -43.6 | 0 | 0 | 0 | 110.4 | ||||
| 321 | Y | 83.6 | Confident | 85.7 | Confident | 43 Ų | 43 | 72 Ų | 72 | 17% | 0.169 | 36% | 0.356 | C | S | . | . | trans | -71.1 | 139.8 | 178.4 | -55.4 | -81 | 0 | 0 | 0 | 112.5 | I287 E288 G314 N316 I319 Y325 | I287-Y321 HydrophobicContact CG2-CD1 4.09Å; I287-Y321 HydrophobicContact CG2-CE1 4.13Å; E288-Y321 WeakPolarHBondContact OE1-CE1 3.41Å; E288-Y321 WeakPolarHBondContact OE2-CE1 3.44Å; E288-Y321 PolarHBondContact OE2-OH 3Å; G314-Y321 VanDerWaalsContact CA-CZ 3.47Å; N316-Y321 WeakPolarHBondContact CA-OH 3.36Å; N316-Y321 WeakPolarHBondContact CB-OH 3.35Å; N316-Y321 PolarHBondContact N-OH 3.38Å; N316-Y321 VanDerWaalsContact O-CE2 3.28Å; N316-Y321 WeakPolarHBondContact O-CE2 3.31Å; I319-Y321 HydrophobicContact CB-CE1 4.19Å; I319-Y321 HydrophobicContact CB-CE2 4.2Å; I319-Y321 HydrophobicContact CG2-CD1 4.06Å; I319-Y321 HydrophobicContact CG2-CE1 3.9Å; I319-Y321 WeakPolarHBondContact O-CD2 3.2Å; I319-Y321 WeakPolarHBondContact O-CE2 3.3Å; I319-Y321 PolarHBondContact O-N 2.83Å; Y321-Y325 AromaticContact CD1-CD1 3.43Å; Y321-Y325 HydrophobicContact CD1-CD1 3.43Å; Y321-Y325 VanDerWaalsContact CD1-CD1 3.43Å; Y321-Y325 AromaticContact CD1-CE1 3.45Å; Y321-Y325 HydrophobicContact CD1-CE1 3.45Å; Y321-Y325 VanDerWaalsContact CD1-CE1 3.45Å; Y321-Y325 HydrophobicContact CD1-CG 4.48Å; Y321-Y325 HydrophobicContact CE1-CD1 4.1Å; Y321-Y325 AromaticContact CE1-CE1 3.63Å; Y321-Y325 HydrophobicContact CE1-CE1 3.63Å; Y321-Y325 AromaticContact CG-CD1 3.93Å; Y321-Y325 HydrophobicContact CG-CD1 3.93Å; Y321-Y325 HydrophobicContact CG-CE1 4.31Å | ||
| 322 | M | 84.8 | Confident | 85.8 | Confident | 145 Ų | 145 | 70.2 Ų | 70.2 | 71% | 0.714 | 35% | 0.349 | S | S | * | . | trans | -60.6 | 135.3 | 169.1 | -169.1 | 62.8 | 63.6 | 0 | 0 | 111.1 | W324 Y325 | M322-W324 PolarHBondContact O-N 3.4Å; M322-Y325 WeakPolarHBondContact O-CB 3.17Å; M322-Y325 PolarHBondContact O-N 3.22Å | ||
| 323 | N | 82.3 | Confident | 85.9 | Confident | 147 Ų | 147 | 69.7 Ų | 69.7 | 79% | 0.786 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.4 | -30.9 | -176.2 | -69.7 | -18.5 | 0 | 0 | 0 | 114.9 | Y325 P327 | N323-Y325 VanDerWaalsContact C-N 3.32Å; N323-Y325 PolarHBondContact O-N 2.98Å; N323-P327 WeakPolarHBondContact O-CD 3.25Å |
| 324 | W | 85.5 | Confident | 85.9 | Confident | 206 Ų | 206 | 70.6 Ų | 70.6 | 78% | 0.78 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | -12.1 | 178.9 | -68.4 | 92.6 | 0 | 0 | 0 | 114.5 | M322 P327 L328 | M322-W324 PolarHBondContact O-N 3.4Å; W324-P327 WeakPolarHBondContact O-CD 3.41Å; W324-L328 VanDerWaalsContact O-CB 3.31Å; W324-L328 WeakPolarHBondContact O-CB 3.38Å; W324-L328 PolarHBondContact O-N 2.92Å |
| 325 | Y | 89.1 | Confident | 86.2 | Confident | 15 Ų | 15 | 71.7 Ų | 71.7 | 6% | 0.059 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -66.8 | -52.4 | -174.9 | 178.4 | -124.1 | 0 | 0 | 0 | 112.8 | F284 I287 E288 Y321 M322 N323 L328 V329 | F284-Y325 VanDerWaalsContact CD1-OH 3.3Å; F284-Y325 WeakPolarHBondContact CD1-OH 3.43Å; F284-Y325 HydrophobicContact CE1-CE2 4.4Å; F284-Y325 WeakPolarHBondContact CE1-OH 3.19Å; I287-Y325 HydrophobicContact CD1-CD2 4.07Å; I287-Y325 HydrophobicContact CD1-CE2 3.7Å; I287-Y325 HydrophobicContact CG2-CE1 4.02Å; I287-Y325 HydrophobicContact CG2-CE2 4.07Å; E288-Y325 VanDerWaalsContact OE1-CE1 3.22Å; E288-Y325 WeakPolarHBondContact OE1-CE1 3.34Å; E288-Y325 VanDerWaalsContact OE1-CZ 3.31Å; E288-Y325 PolarHBondContact OE1-OH 3.35Å; Y321-Y325 AromaticContact CD1-CD1 3.43Å; Y321-Y325 HydrophobicContact CD1-CD1 3.43Å; Y321-Y325 VanDerWaalsContact CD1-CD1 3.43Å; Y321-Y325 AromaticContact CD1-CE1 3.45Å; Y321-Y325 HydrophobicContact CD1-CE1 3.45Å; Y321-Y325 VanDerWaalsContact CD1-CE1 3.45Å; Y321-Y325 HydrophobicContact CD1-CG 4.48Å; Y321-Y325 HydrophobicContact CE1-CD1 4.1Å; Y321-Y325 AromaticContact CE1-CE1 3.63Å; Y321-Y325 HydrophobicContact CE1-CE1 3.63Å; Y321-Y325 AromaticContact CG-CD1 3.93Å; Y321-Y325 HydrophobicContact CG-CD1 3.93Å; Y321-Y325 HydrophobicContact CG-CE1 4.31Å; M322-Y325 WeakPolarHBondContact O-CB 3.17Å; M322-Y325 PolarHBondContact O-N 3.22Å; N323-Y325 VanDerWaalsContact C-N 3.32Å; N323-Y325 PolarHBondContact O-N 2.98Å; Y325-L328 WeakPolarHBondContact O-CB 3.49Å; Y325-L328 PolarHBondContact O-N 2.8Å; Y325-V329 HydrophobicContact CD2-CG2 3.98Å; Y325-V329 HydrophobicContact CE1-CG2 4.41Å; Y325-V329 HydrophobicContact CE2-CG2 3.61Å; Y325-V329 WeakPolarHBondContact O-CG2 3.4Å; Y325-V329 PolarHBondContact O-N 3.35Å |
| 326 | K | 86.8 | Confident | 86.8 | Confident | 53 Ų | 53 | 70.9 Ų | 70.9 | 23% | 0.23 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -58.4 | -45.1 | 178.6 | -70.5 | 177.2 | 177.9 | 175 | 0 | 112.4 | S183 G314 L328 V329 W330 | S183-K326 PolarHBondContact OG-NZ 3.11Å; G314-K326 WeakPolarHBondContact O-CE 3.24Å; G314-K326 PolarHBondContact O-NZ 3.32Å; K326-L328 PolarHBondContact O-N 3.23Å; K326-V329 PolarHBondContact O-N 3.14Å; K326-W330 PolarHBondContact O-N 2.84Å |
| 327 | P | 88.4 | Confident | 87.3 | Confident | 66 Ų | 66 | 68.8 Ų | 68.8 | 43% | 0.429 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -59.2 | -40 | 169.9 | -27.3 | 35.3 | 0 | 0 | 0 | 114.8 | N323 W324 W330 F331 | N323-P327 WeakPolarHBondContact O-CD 3.25Å; W324-P327 WeakPolarHBondContact O-CD 3.41Å; P327-W330 PolarHBondContact O-N 2.98Å; P327-F331 PolarHBondContact O-N 2.59Å |
| 328 | L | 91.1 | Very high | 88.1 | Confident | 110 Ų | 110 | 66.1 Ų | 66.1 | 58% | 0.576 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -66.6 | -41.8 | 178.7 | -179.9 | 63.1 | 0 | 0 | 0 | 112 | W324 Y325 K326 W330 F331 W332 | W324-L328 VanDerWaalsContact O-CB 3.31Å; W324-L328 WeakPolarHBondContact O-CB 3.38Å; W324-L328 PolarHBondContact O-N 2.92Å; Y325-L328 WeakPolarHBondContact O-CB 3.49Å; Y325-L328 PolarHBondContact O-N 2.8Å; K326-L328 PolarHBondContact O-N 3.23Å; L328-W330 VanDerWaalsContact C-N 3.33Å; L328-F331 PolarHBondContact O-N 3.45Å; L328-W332 PolarHBondContact O-N 2.71Å |
| 329 | V | 93.1 | Very high | 88.9 | Confident | 6 Ų | 6 | 61.4 Ų | 61.4 | 4% | 0.036 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 172.6 | 174 | 0 | 0 | 0 | 0 | 110.4 | F186 F284 A313 Y325 K326 F331 W332 I333 | F186-V329 HydrophobicContact CE2-CG1 4.08Å; F284-V329 HydrophobicContact CE1-CG2 3.82Å; F284-V329 HydrophobicContact CZ-CG1 4.39Å; F284-V329 HydrophobicContact CZ-CG2 4.19Å; A313-V329 HydrophobicContact CB-CG1 4.14Å; A313-V329 HydrophobicContact CB-CG2 4.33Å; Y325-V329 HydrophobicContact CD2-CG2 3.98Å; Y325-V329 HydrophobicContact CE1-CG2 4.41Å; Y325-V329 HydrophobicContact CE2-CG2 3.61Å; Y325-V329 WeakPolarHBondContact O-CG2 3.4Å; Y325-V329 PolarHBondContact O-N 3.35Å; K326-V329 PolarHBondContact O-N 3.14Å; V329-F331 VanDerWaalsContact C-N 3.35Å; V329-F331 PolarHBondContact O-N 3.16Å; V329-W332 HydrophobicContact CG1-CE3 4.04Å; V329-W332 HydrophobicContact CG1-CZ3 4.24Å; V329-W332 PolarHBondContact O-N 3.4Å; V329-I333 HydrophobicContact CG1-CD1 4.1Å; V329-I333 WeakPolarHBondContact O-CG1 3.36Å; V329-I333 PolarHBondContact O-N 3.45Å |
| 330 | W | 90.1 | Very high | 89.3 | Confident | 48 Ų | 48 | 61.6 Ų | 61.6 | 18% | 0.182 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.4 | -39.6 | 176.6 | -162.5 | 95.5 | 0 | 0 | 0 | 112.7 | F185 K326 P327 L328 I333 L334 | F185-W330 HydrophobicContact CE1-CD2 4.01Å; F185-W330 AromaticContact CE1-CG 3.96Å; F185-W330 HydrophobicContact CE1-CG 3.96Å; F185-W330 HydrophobicContact CZ-CD2 4.36Å; K326-W330 PolarHBondContact O-N 2.84Å; P327-W330 PolarHBondContact O-N 2.98Å; L328-W330 VanDerWaalsContact C-N 3.33Å; W330-I333 PolarHBondContact O-N 3.32Å; W330-L334 HydrophobicContact CZ3-CB 4.31Å; W330-L334 HydrophobicContact CZ3-CD2 3.99Å; W330-L334 PolarHBondContact O-N 3.37Å |
| 331 | F | 90.9 | Very high | 89.7 | Confident | 128 Ų | 128 | 55.1 Ų | 55.1 | 56% | 0.561 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -66.2 | -41.4 | 173.8 | -180 | -97.5 | 0 | 0 | 0 | 112.7 | P327 L328 V329 I333 L334 V335 | P327-F331 PolarHBondContact O-N 2.59Å; L328-F331 PolarHBondContact O-N 3.45Å; V329-F331 VanDerWaalsContact C-N 3.35Å; V329-F331 PolarHBondContact O-N 3.16Å; F331-I333 VanDerWaalsContact C-N 3.35Å; F331-L334 PolarHBondContact O-N 2.98Å; F331-V335 HydrophobicContact CE1-CG2 4.07Å; F331-V335 HydrophobicContact CE2-CG2 4.08Å; F331-V335 HydrophobicContact CZ-CG2 3.83Å; F331-V335 PolarHBondContact O-N 3.16Å; F331-V335 VanDerWaalsContact O-N 3.13Å |
| 332 | W | 94.7 | Very high | 89.7 | Confident | 27 Ų | 27 | 54.5 Ų | 54.5 | 10% | 0.102 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.2 | -43.6 | 172.5 | 158.7 | 71.1 | 0 | 0 | 0 | 111.5 | F276 P280 F284 F298 V299 T302 L303 L328 V329 G336 | F276-W332 PolarHBondContact O-NE1 2.79Å; F276-W332 VanDerWaalsContact O-NE1 3.16Å; P280-W332 HydrophobicContact CB-CZ2 4.34Å; P280-W332 HydrophobicContact CG-CG 4.45Å; F284-W332 HydrophobicContact CE2-CD2 4.42Å; F284-W332 HydrophobicContact CE2-CE3 4.08Å; F284-W332 AromaticContact CE2-CH2 3.83Å; F284-W332 HydrophobicContact CE2-CH2 3.83Å; F284-W332 HydrophobicContact CE2-CZ2 4.17Å; F284-W332 AromaticContact CE2-CZ3 3.77Å; F284-W332 HydrophobicContact CE2-CZ3 3.77Å; F284-W332 HydrophobicContact CZ-CD2 4.36Å; F284-W332 AromaticContact CZ-CE3 3.73Å; F284-W332 HydrophobicContact CZ-CE3 3.73Å; F284-W332 HydrophobicContact CZ-CH2 4.18Å; F284-W332 AromaticContact CZ-CZ3 3.62Å; F284-W332 HydrophobicContact CZ-CZ3 3.62Å; F298-W332 AromaticContact CE1-CH2 3.98Å; F298-W332 HydrophobicContact CE1-CH2 3.98Å; F298-W332 AromaticContact CE1-CZ3 3.93Å; F298-W332 HydrophobicContact CE1-CZ3 3.93Å; F298-W332 HydrophobicContact CZ-CZ3 4.34Å; V299-W332 HydrophobicContact CB-CZ2 4.28Å; V299-W332 HydrophobicContact CG1-CZ2 4.14Å; V299-W332 HydrophobicContact CG2-CH2 4.09Å; V299-W332 HydrophobicContact CG2-CZ2 3.89Å; T302-W332 HydrophobicContact CG2-CH2 3.75Å; T302-W332 HydrophobicContact CG2-CZ3 3.93Å; L303-W332 HydrophobicContact CD1-CZ2 3.87Å; L303-W332 HydrophobicContact CD2-CH2 4.35Å; L303-W332 HydrophobicContact CD2-CZ2 3.86Å; L303-W332 HydrophobicContact CG-CH2 4.35Å; L303-W332 HydrophobicContact CG-CZ2 3.73Å; L328-W332 PolarHBondContact O-N 2.71Å; V329-W332 HydrophobicContact CG1-CE3 4.04Å; V329-W332 HydrophobicContact CG1-CZ3 4.24Å; V329-W332 PolarHBondContact O-N 3.4Å; W332-G336 WeakPolarHBondContact O-CA 3.34Å; W332-G336 PolarHBondContact O-N 3.38Å |
| 333 | I | 94.6 | Very high | 89.7 | Confident | 4 Ų | 4 | 48.3 Ų | 48.3 | 2% | 0.021 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -57.5 | -51.7 | 173.9 | -71.9 | 171.1 | 0 | 0 | 0 | 110.3 | F186 T193 I195 T302 V329 W330 F331 V335 G336 L337 | F186-I333 HydrophobicContact CE2-CD1 4.44Å; T193-I333 HydrophobicContact CG2-CG2 4.21Å; I195-I333 HydrophobicContact CD1-CD1 4.32Å; I195-I333 HydrophobicContact CD1-CG2 3.53Å; T302-I333 HydrophobicContact CG2-CD1 3.99Å; T302-I333 HydrophobicContact CG2-CG1 3.83Å; V329-I333 HydrophobicContact CG1-CD1 4.1Å; V329-I333 WeakPolarHBondContact O-CG1 3.36Å; V329-I333 PolarHBondContact O-N 3.45Å; W330-I333 PolarHBondContact O-N 3.32Å; F331-I333 VanDerWaalsContact C-N 3.35Å; I333-V335 PolarHBondContact O-N 3.26Å; I333-G336 PolarHBondContact O-N 3.29Å; I333-L337 HydrophobicContact CG2-CD1 3.6Å; I333-L337 HydrophobicContact CG2-CG 4.05Å; I333-L337 VanDerWaalsContact O-CB 3.31Å; I333-L337 WeakPolarHBondContact O-CB 3.3Å; I333-L337 WeakPolarHBondContact O-CG 3.01Å; I333-L337 PolarHBondContact O-N 3.06Å |
| 334 | L | 91.6 | Very high | 89.8 | Confident | 22 Ų | 22 | 45.5 Ų | 45.5 | 12% | 0.115 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -54.8 | -48.6 | -178.4 | 177.8 | 67.1 | 0 | 0 | 0 | 112.8 | F222 L225 I229 W330 F331 A338 | F222-L334 HydrophobicContact CE2-CD1 3.7Å; F222-L334 HydrophobicContact CZ-CD1 4.29Å; L225-L334 HydrophobicContact CD2-CD1 3.75Å; L225-L334 HydrophobicContact CG-CD1 4.18Å; I229-L334 HydrophobicContact CD1-CD1 3.7Å; I229-L334 HydrophobicContact CD1-CD2 4.01Å; I229-L334 HydrophobicContact CD1-CG 3.74Å; W330-L334 HydrophobicContact CZ3-CB 4.31Å; W330-L334 HydrophobicContact CZ3-CD2 3.99Å; W330-L334 PolarHBondContact O-N 3.37Å; F331-L334 PolarHBondContact O-N 2.98Å; L334-A338 PolarHBondContact O-N 2.82Å |
| 335 | V | 91.4 | Very high | 89.6 | Confident | 30 Ų | 30 | 39.4 Ų | 39.4 | 18% | 0.182 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -77.8 | -37.2 | -178.1 | -173.3 | 0 | 0 | 0 | 0 | 111.5 | F276 F331 I333 A338 Y339 | F276-V335 HydrophobicContact CE1-CB 4.15Å; F276-V335 HydrophobicContact CE1-CG1 3.6Å; F276-V335 HydrophobicContact CZ-CG1 3.74Å; F331-V335 HydrophobicContact CE1-CG2 4.07Å; F331-V335 HydrophobicContact CE2-CG2 4.08Å; F331-V335 HydrophobicContact CZ-CG2 3.83Å; F331-V335 PolarHBondContact O-N 3.16Å; F331-V335 VanDerWaalsContact O-N 3.13Å; I333-V335 PolarHBondContact O-N 3.26Å; V335-A338 PolarHBondContact O-N 3.23Å; V335-Y339 PolarHBondContact O-N 2.94Å |
| 336 | G | 93.3 | Very high | 89.2 | Confident | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.2 | -39.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | W332 I333 Y339 F340 | W332-G336 WeakPolarHBondContact O-CA 3.34Å; W332-G336 PolarHBondContact O-N 3.38Å; I333-G336 PolarHBondContact O-N 3.29Å; G336-Y339 PolarHBondContact O-N 2.88Å; G336-F340 WeakPolarHBondContact O-CB 3.47Å; G336-F340 PolarHBondContact O-N 3.03Å |
| 337 | L | 92.9 | Very high | 89 | Confident | 8 Ų | 8 | 41.5 Ų | 41.5 | 4% | 0.042 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.6 | -42.6 | 172.9 | -72.9 | 176.4 | 0 | 0 | 0 | 111.6 | T193 I195 F222 L226 L303 T305 I333 Y339 F340 A341 | T193-L337 HydrophobicContact CG2-CD1 3.83Å; I195-L337 HydrophobicContact CD1-CD1 4.24Å; F222-L337 HydrophobicContact CE1-CD1 4.1Å; F222-L337 HydrophobicContact CZ-CD1 3.75Å; L226-L337 HydrophobicContact CD1-CB 3.79Å; L303-L337 WeakPolarHBondContact O-CD2 3.26Å; T305-L337 HydrophobicContact CG2-CD2 3.41Å; T305-L337 VanDerWaalsContact CG2-CD2 3.41Å; I333-L337 HydrophobicContact CG2-CD1 3.6Å; I333-L337 HydrophobicContact CG2-CG 4.05Å; I333-L337 VanDerWaalsContact O-CB 3.31Å; I333-L337 WeakPolarHBondContact O-CB 3.3Å; I333-L337 WeakPolarHBondContact O-CG 3.01Å; I333-L337 PolarHBondContact O-N 3.06Å; L337-Y339 VanDerWaalsContact C-N 3.32Å; L337-Y339 PolarHBondContact O-N 3.48Å; L337-F340 PolarHBondContact O-N 2.78Å; L337-A341 WeakPolarHBondContact O-CB 3.49Å; L337-A341 PolarHBondContact O-N 3.28Å |
| 338 | A | 91.1 | Very high | 88.7 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.4 | -37.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L226 I229 L233 L334 V335 A342 | L226-A338 HydrophobicContact CD1-CB 3.95Å; I229-A338 HydrophobicContact CB-CB 3.87Å; I229-A338 HydrophobicContact CG2-CB 3.41Å; I229-A338 VanDerWaalsContact CG2-CB 3.41Å; L233-A338 HydrophobicContact CD1-CB 3.74Å; L334-A338 PolarHBondContact O-N 2.82Å; V335-A338 PolarHBondContact O-N 3.23Å; A338-A342 PolarHBondContact O-N 3.01Å |
| 339 | Y | 90.6 | Very high | 88.2 | Confident | 13 Ų | 13 | 38.4 Ų | 38.4 | 5% | 0.051 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.1 | -47.1 | 170.9 | 173 | -98.8 | 0 | 0 | 0 | 112 | F268 I269 G272 F276 V335 G336 L337 A341 A342 V343 | F268-Y339 HydrophobicContact CD1-CE2 4.27Å; F268-Y339 HydrophobicContact CE1-CD2 4.19Å; F268-Y339 AromaticContact CE1-CE2 3.67Å; F268-Y339 HydrophobicContact CE1-CE2 3.67Å; F268-Y339 HydrophobicContact CE2-CD2 4.49Å; F268-Y339 HydrophobicContact CE2-CE2 4.19Å; F268-Y339 AromaticContact CZ-CD2 3.82Å; F268-Y339 HydrophobicContact CZ-CD2 3.82Å; F268-Y339 AromaticContact CZ-CE2 3.63Å; F268-Y339 HydrophobicContact CZ-CE2 3.63Å; F268-Y339 PolarHBondContact O-OH 3.48Å; F268-Y339 VanDerWaalsContact O-OH 3.05Å; I269-Y339 WeakPolarHBondContact CA-OH 3.45Å; I269-Y339 PolarHBondContact O-OH 2.72Å; G272-Y339 VanDerWaalsContact CA-CZ 3.45Å; G272-Y339 WeakPolarHBondContact CA-OH 3.31Å; F276-Y339 HydrophobicContact CB-CD1 4.39Å; F276-Y339 AromaticContact CD2-CD1 3.59Å; F276-Y339 HydrophobicContact CD2-CD1 3.59Å; F276-Y339 AromaticContact CD2-CD2 3.94Å; F276-Y339 HydrophobicContact CD2-CD2 3.94Å; F276-Y339 HydrophobicContact CD2-CE1 4.15Å; F276-Y339 HydrophobicContact CD2-CE2 4.46Å; F276-Y339 AromaticContact CD2-CG 3.48Å; F276-Y339 HydrophobicContact CD2-CG 3.48Å; F276-Y339 VanDerWaalsContact CD2-CG 3.48Å; F276-Y339 HydrophobicContact CE2-CD1 4.26Å; F276-Y339 AromaticContact CE2-CD2 3.82Å; F276-Y339 HydrophobicContact CE2-CD2 3.82Å; F276-Y339 AromaticContact CE2-CG 3.66Å; F276-Y339 HydrophobicContact CE2-CG 3.66Å; F276-Y339 HydrophobicContact CG-CD1 4.25Å; F276-Y339 HydrophobicContact CG-CG 4.38Å; V335-Y339 PolarHBondContact O-N 2.94Å; G336-Y339 PolarHBondContact O-N 2.88Å; L337-Y339 VanDerWaalsContact C-N 3.32Å; L337-Y339 PolarHBondContact O-N 3.48Å; Y339-A341 PolarHBondContact O-N 3.46Å; Y339-A342 WeakPolarHBondContact O-CB 3.44Å; Y339-A342 PolarHBondContact O-N 3.47Å; Y339-V343 HydrophobicContact CD1-CG2 4.29Å; Y339-V343 HydrophobicContact CD2-CG2 4.5Å; Y339-V343 HydrophobicContact CE1-CG2 3.7Å; Y339-V343 HydrophobicContact CE2-CG2 3.94Å; Y339-V343 VanDerWaalsContact CZ-CG2 3.49Å; Y339-V343 WeakPolarHBondContact O-CG2 3.25Å; Y339-V343 PolarHBondContact O-N 3.03Å |
| 340 | F | 90.5 | Very high | 87.5 | Confident | 52 Ų | 52 | 45.5 Ų | 45.5 | 23% | 0.228 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.6 | -39.8 | -179.7 | -174.5 | -106.8 | 0 | 0 | 0 | 112.2 | L303 T304 G336 L337 A342 V343 L344 | L303-F340 WeakPolarHBondContact O-CD1 3.38Å; L303-F340 WeakPolarHBondContact O-CG 3.47Å; T304-F340 HydrophobicContact CG2-CE1 4.04Å; T304-F340 HydrophobicContact CG2-CE2 4Å; T304-F340 HydrophobicContact CG2-CZ 3.57Å; G336-F340 WeakPolarHBondContact O-CB 3.47Å; G336-F340 PolarHBondContact O-N 3.03Å; L337-F340 PolarHBondContact O-N 2.78Å; F340-A342 VanDerWaalsContact C-N 3.32Å; F340-A342 PolarHBondContact O-N 3.08Å; F340-V343 PolarHBondContact O-N 3.33Å; F340-V343 VanDerWaalsContact O-N 3.16Å; F340-L344 HydrophobicContact CD1-CD1 3.91Å; F340-L344 HydrophobicContact CD1-CG 4.01Å; F340-L344 HydrophobicContact CE1-CD1 3.39Å; F340-L344 HydrophobicContact CE1-CD2 3.97Å; F340-L344 HydrophobicContact CE1-CG 3.53Å; F340-L344 HydrophobicContact CE2-CD2 4.41Å; F340-L344 HydrophobicContact CE2-CG 4.36Å; F340-L344 HydrophobicContact CZ-CD1 4.02Å; F340-L344 HydrophobicContact CZ-CD2 3.69Å; F340-L344 HydrophobicContact CZ-CG 3.71Å; F340-L344 PolarHBondContact O-N 3.21Å |
| 341 | A | 87.2 | Confident | 86.8 | Confident | 34 Ų | 34 | 48.1 Ų | 48.1 | 28% | 0.281 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -60.6 | -38.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L226 L337 Y339 S345 | L226-A341 HydrophobicContact CD2-CB 4.43Å; L337-A341 WeakPolarHBondContact O-CB 3.49Å; L337-A341 PolarHBondContact O-N 3.28Å; Y339-A341 PolarHBondContact O-N 3.46Å; A341-S345 WeakPolarHBondContact O-CB 3.3Å; A341-S345 PolarHBondContact O-N 2.69Å; A341-S345 PolarHBondContact O-OG 3.07Å |
| 342 | A | 84.3 | Confident | 86.3 | Confident | 30 Ų | 30 | 50 Ų | 50 | 25% | 0.248 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.6 | -39.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A338 Y339 F340 S345 M346 | A338-A342 PolarHBondContact O-N 3.01Å; Y339-A342 WeakPolarHBondContact O-CB 3.44Å; Y339-A342 PolarHBondContact O-N 3.47Å; F340-A342 VanDerWaalsContact C-N 3.32Å; F340-A342 PolarHBondContact O-N 3.08Å; A342-S345 PolarHBondContact O-N 2.66Å; A342-M346 PolarHBondContact O-N 3.3Å |
| 343 | V | 84.6 | Confident | 85.7 | Confident | 15 Ų | 15 | 53.4 Ų | 53.4 | 9% | 0.091 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65.1 | -47 | 174.5 | 171.3 | 0 | 0 | 0 | 0 | 111.3 | Y339 F340 S345 M346 I347 | Y339-V343 HydrophobicContact CD1-CG2 4.29Å; Y339-V343 HydrophobicContact CD2-CG2 4.5Å; Y339-V343 HydrophobicContact CE1-CG2 3.7Å; Y339-V343 HydrophobicContact CE2-CG2 3.94Å; Y339-V343 VanDerWaalsContact CZ-CG2 3.49Å; Y339-V343 WeakPolarHBondContact O-CG2 3.25Å; Y339-V343 PolarHBondContact O-N 3.03Å; F340-V343 PolarHBondContact O-N 3.33Å; F340-V343 VanDerWaalsContact O-N 3.16Å; V343-S345 VanDerWaalsContact C-N 3.32Å; V343-S345 PolarHBondContact O-N 3.46Å; V343-M346 PolarHBondContact O-N 3Å; V343-I347 HydrophobicContact CG1-CD1 3.71Å; V343-I347 HydrophobicContact CG1-CG1 4.36Å; V343-I347 VanDerWaalsContact O-CG1 3.32Å; V343-I347 WeakPolarHBondContact O-CG1 3.24Å; V343-I347 PolarHBondContact O-N 3.12Å |
| 344 | L | 83.4 | Confident | 84.8 | Confident | 89 Ų | 89 | 58 Ų | 58 | 47% | 0.466 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -57.4 | -43.3 | 173.6 | -79.1 | -173.5 | 0 | 0 | 0 | 112.1 | F340 M346 I347 G348 | F340-L344 HydrophobicContact CD1-CD1 3.91Å; F340-L344 HydrophobicContact CD1-CG 4.01Å; F340-L344 HydrophobicContact CE1-CD1 3.39Å; F340-L344 HydrophobicContact CE1-CD2 3.97Å; F340-L344 HydrophobicContact CE1-CG 3.53Å; F340-L344 HydrophobicContact CE2-CD2 4.41Å; F340-L344 HydrophobicContact CE2-CG 4.36Å; F340-L344 HydrophobicContact CZ-CD1 4.02Å; F340-L344 HydrophobicContact CZ-CD2 3.69Å; F340-L344 HydrophobicContact CZ-CG 3.71Å; F340-L344 PolarHBondContact O-N 3.21Å; L344-M346 VanDerWaalsContact C-N 3.33Å; L344-M346 PolarHBondContact O-N 3.37Å; L344-I347 PolarHBondContact O-N 3.2Å; L344-G348 PolarHBondContact O-N 3.02Å |
| 345 | S | 82.1 | Confident | 84 | Confident | 78 Ų | 78 | 59.2 Ų | 59.2 | 55% | 0.545 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.8 | -43.4 | 177.3 | -61.6 | 0 | 0 | 0 | 0 | 111.4 | A341 A342 V343 G348 D349 | A341-S345 WeakPolarHBondContact O-CB 3.3Å; A341-S345 PolarHBondContact O-N 2.69Å; A341-S345 PolarHBondContact O-OG 3.07Å; A342-S345 PolarHBondContact O-N 2.66Å; V343-S345 VanDerWaalsContact C-N 3.32Å; V343-S345 PolarHBondContact O-N 3.46Å; S345-G348 PolarHBondContact O-N 3.49Å; S345-D349 PolarHBondContact O-N 3.14Å |
| 346 | M | 80.3 | Confident | 83.5 | Confident | 37 Ų | 37 | 64.2 Ų | 64.2 | 18% | 0.182 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -68.9 | -38.1 | 177.2 | -171.5 | 174.7 | 65.5 | 0 | 0 | 112.9 | A265 I269 A342 V343 L344 G348 D349 W350 | A265-M346 HydrophobicContact CB-CE 4.23Å; A265-M346 HydrophobicContact CB-SD 3.73Å; I269-M346 HydrophobicContact CD1-CE 3.67Å; I269-M346 HydrophobicContact CG1-CE 3.67Å; A342-M346 PolarHBondContact O-N 3.3Å; V343-M346 PolarHBondContact O-N 3Å; L344-M346 VanDerWaalsContact C-N 3.33Å; L344-M346 PolarHBondContact O-N 3.37Å; M346-G348 VanDerWaalsContact C-N 3.34Å; M346-D349 PolarHBondContact O-N 3.32Å; M346-W350 PolarHBondContact O-N 2.93Å |
| 347 | I | 83.5 | Confident | 83 | Confident | 75 Ų | 75 | 69.6 Ų | 69.6 | 39% | 0.385 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.3 | -41.9 | 171.9 | -69.5 | 167.8 | 0 | 0 | 0 | 109.9 | V343 L344 D349 W350 L351 | V343-I347 HydrophobicContact CG1-CD1 3.71Å; V343-I347 HydrophobicContact CG1-CG1 4.36Å; V343-I347 VanDerWaalsContact O-CG1 3.32Å; V343-I347 WeakPolarHBondContact O-CG1 3.24Å; V343-I347 PolarHBondContact O-N 3.12Å; L344-I347 PolarHBondContact O-N 3.2Å; I347-D349 PolarHBondContact O-N 3.26Å; I347-W350 WeakPolarHBondContact O-CB 3.5Å; I347-W350 PolarHBondContact O-N 3.1Å; I347-L351 HydrophobicContact CG2-CD1 3.91Å; I347-L351 HydrophobicContact CG2-CG 4.27Å; I347-L351 WeakPolarHBondContact O-CB 3.3Å; I347-L351 VanDerWaalsContact O-CG 3.32Å; I347-L351 WeakPolarHBondContact O-CG 3.17Å; I347-L351 PolarHBondContact O-N 3.18Å |
| 348 | G | 81.9 | Confident | 82.2 | Confident | 25 Ų | 25 | 72.2 Ų | 72.2 | 26% | 0.258 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -58.6 | -42.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L344 S345 M346 L351 R352 | L344-G348 PolarHBondContact O-N 3.02Å; S345-G348 PolarHBondContact O-N 3.49Å; M346-G348 VanDerWaalsContact C-N 3.34Å; G348-L351 PolarHBondContact O-N 2.87Å; G348-R352 WeakPolarHBondContact O-CB 3.42Å; G348-R352 WeakPolarHBondContact O-CD 3.43Å; G348-R352 WeakPolarHBondContact O-CG 3.34Å; G348-R352 PolarHBondContact O-N 2.95Å |
| 349 | D | 80.8 | Confident | 81.6 | Confident | 85 Ų | 85 | 77.8 Ų | 77.8 | 46% | 0.455 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -68.6 | -37 | 173.5 | -85 | -15.5 | 0 | 0 | 0 | 113.4 | S345 M346 I347 R352 V353 | S345-D349 PolarHBondContact O-N 3.14Å; M346-D349 PolarHBondContact O-N 3.32Å; I347-D349 PolarHBondContact O-N 3.26Å; D349-R352 PolarHBondContact O-N 3.29Å; D349-R352 WeakPolarHBondContact OD1-CD 3.24Å; D349-R352 IonicContact OD1-CZ 3.49Å; D349-R352 IonicContact OD1-NE 2.77Å; D349-R352 IonicContact OD1-NH1 2.61Å; D349-R352 PolarHBondContact OD1-NH1 2.82Å; D349-V353 WeakPolarHBondContact O-CG2 3.44Å; D349-V353 PolarHBondContact O-N 3.31Å |
| 350 | W | 77.2 | Confident | 81.1 | Confident | 155 Ų | 155 | 83.1 Ų | 83.1 | 59% | 0.587 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -61.5 | -45 | 170.4 | -96.8 | 59.8 | 0 | 0 | 0 | 112.2 | V262 M346 I347 R352 V353 L354 | V262-W350 HydrophobicContact CG1-CH2 4.37Å; V262-W350 HydrophobicContact CG1-CZ2 4.11Å; V262-W350 HydrophobicContact CG2-CZ2 4.21Å; M346-W350 PolarHBondContact O-N 2.93Å; I347-W350 WeakPolarHBondContact O-CB 3.5Å; I347-W350 PolarHBondContact O-N 3.1Å; W350-R352 VanDerWaalsContact C-N 3.33Å; W350-R352 PolarHBondContact O-N 3.49Å; W350-V353 PolarHBondContact O-N 2.84Å; W350-L354 WeakPolarHBondContact O-CB 3.45Å; W350-L354 PolarHBondContact O-N 3.36Å |
| 351 | L | 76 | Confident | 80.7 | Confident | 103 Ų | 103 | 84.2 Ų | 84.2 | 54% | 0.539 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.4 | -36.2 | 175.9 | -71.2 | 171.3 | 0 | 0 | 0 | 111.8 | I347 G348 S355 | I347-L351 HydrophobicContact CG2-CD1 3.91Å; I347-L351 HydrophobicContact CG2-CG 4.27Å; I347-L351 WeakPolarHBondContact O-CB 3.3Å; I347-L351 VanDerWaalsContact O-CG 3.32Å; I347-L351 WeakPolarHBondContact O-CG 3.17Å; I347-L351 PolarHBondContact O-N 3.18Å; G348-L351 PolarHBondContact O-N 2.87Å; L351-S355 WeakPolarHBondContact O-CB 3.31Å; L351-S355 PolarHBondContact O-N 3.47Å |
| 352 | R | 80.6 | Confident | 80.3 | Confident | 167 Ų | 167 | 86.7 Ų | 86.7 | 63% | 0.63 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -63.2 | -40.6 | 171.6 | -73.3 | 162.1 | 179.5 | 168.2 | 0 | 112 | G348 D349 W350 K356 | G348-R352 WeakPolarHBondContact O-CB 3.42Å; G348-R352 WeakPolarHBondContact O-CD 3.43Å; G348-R352 WeakPolarHBondContact O-CG 3.34Å; G348-R352 PolarHBondContact O-N 2.95Å; D349-R352 PolarHBondContact O-N 3.29Å; D349-R352 WeakPolarHBondContact OD1-CD 3.24Å; D349-R352 IonicContact OD1-CZ 3.49Å; D349-R352 IonicContact OD1-NE 2.77Å; D349-R352 IonicContact OD1-NH1 2.61Å; D349-R352 PolarHBondContact OD1-NH1 2.82Å; W350-R352 VanDerWaalsContact C-N 3.33Å; W350-R352 PolarHBondContact O-N 3.49Å; R352-K356 WeakPolarHBondContact O-CG 3.39Å; R352-K356 PolarHBondContact O-N 3.23Å |
| 353 | V | 81.1 | Confident | 80 | Confident | 100 Ų | 100 | 87.2 Ų | 87.2 | 61% | 0.606 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -69.4 | -46.9 | 176.3 | 170.7 | 0 | 0 | 0 | 0 | 111.3 | D349 W350 S355 K356 K357 | D349-V353 WeakPolarHBondContact O-CG2 3.44Å; D349-V353 PolarHBondContact O-N 3.31Å; W350-V353 PolarHBondContact O-N 2.84Å; V353-S355 VanDerWaalsContact C-N 3.33Å; V353-S355 PolarHBondContact O-N 2.84Å; V353-K356 WeakPolarHBondContact O-CB 3.48Å; V353-K356 PolarHBondContact O-N 3.49Å; V353-K356 VanDerWaalsContact O-N 3.08Å; V353-K357 PolarHBondContact O-N 3.46Å; V353-K357 VanDerWaalsContact O-N 3.11Å |
| 354 | L | 76.6 | Confident | 79.8 | Confident | 100 Ų | 100 | 92.2 Ų | 92.2 | 52% | 0.524 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.1 | -44.7 | 175.9 | -175.3 | 62.6 | 0 | 0 | 0 | 111 | W350 K356 K357 T358 | W350-L354 WeakPolarHBondContact O-CB 3.45Å; W350-L354 PolarHBondContact O-N 3.36Å; L354-K356 PolarHBondContact O-N 2.85Å; L354-K357 PolarHBondContact O-N 3.27Å; L354-K357 VanDerWaalsContact O-N 3.14Å; L354-T358 PolarHBondContact O-N 2.91Å; L354-T358 PolarHBondContact O-OG1 3.23Å; L354-T358 VanDerWaalsContact O-OG1 3.12Å |
| 355 | S | 75.6 | Confident | 79.7 | Confident | 48 Ų | 48 | 93.6 Ų | 93.6 | 34% | 0.336 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.4 | -19.3 | 176.6 | -166.6 | 0 | 0 | 0 | 0 | 114.2 | L351 V353 K359 | L351-S355 WeakPolarHBondContact O-CB 3.31Å; L351-S355 PolarHBondContact O-N 3.47Å; V353-S355 VanDerWaalsContact C-N 3.33Å; V353-S355 PolarHBondContact O-N 2.84Å; S355-K359 WeakPolarHBondContact O-CD 3.29Å; S355-K359 WeakPolarHBondContact O-CG 3.47Å; S355-K359 PolarHBondContact O-NZ 3.33Å; S355-K359 PolarHBondContact OG-NZ 3.31Å |
| 356 | K | 80.8 | Confident | 79.8 | Confident | 134 Ų | 134 | 97.2 Ų | 97.2 | 58% | 0.583 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -77.6 | -53.7 | 167.7 | -71.9 | 176.7 | -178.6 | -176.5 | 0 | 110.3 | R352 V353 L354 T358 K359 E360 | R352-K356 WeakPolarHBondContact O-CG 3.39Å; R352-K356 PolarHBondContact O-N 3.23Å; V353-K356 WeakPolarHBondContact O-CB 3.48Å; V353-K356 PolarHBondContact O-N 3.49Å; V353-K356 VanDerWaalsContact O-N 3.08Å; L354-K356 PolarHBondContact O-N 2.85Å; K356-T358 PolarHBondContact O-N 3.47Å; K356-K359 CarbonylContact O-C 3.6Å; K356-K359 WeakPolarHBondContact O-CA 3.45Å; K356-K359 WeakPolarHBondContact O-CB 3.39Å; K356-K359 PolarHBondContact O-N 3.34Å; K356-E360 PolarHBondContact O-N 3.44Å |
| 357 | K | 81.6 | Confident | 80 | Confident | 114 Ų | 114 | 98.2 Ų | 98.2 | 50% | 0.496 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -55.4 | -46.5 | -180 | -169.1 | 171.1 | -172.6 | -76.1 | 0 | 112.5 | V353 L354 K359 E360 E361 | V353-K357 PolarHBondContact O-N 3.46Å; V353-K357 VanDerWaalsContact O-N 3.11Å; L354-K357 PolarHBondContact O-N 3.27Å; L354-K357 VanDerWaalsContact O-N 3.14Å; K357-K359 VanDerWaalsContact C-N 3.29Å; K357-K359 PolarHBondContact O-N 2.84Å; K357-E360 WeakPolarHBondContact O-CB 3.36Å; K357-E360 PolarHBondContact O-N 2.8Å; K357-E360 VanDerWaalsContact O-N 3.13Å; K357-E361 IonicContact NZ-OE1 3.31Å; K357-E361 PolarHBondContact NZ-OE1 3Å; K357-E361 WeakPolarHBondContact O-CG 3.48Å; K357-E361 PolarHBondContact O-N 3.48Å |
| 358 | T | 77.2 | Confident | 80 | Confident | 63 Ų | 63 | 100 Ų | 100 | 39% | 0.387 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.4 | -29 | 176.4 | -51.9 | 0 | 0 | 0 | 0 | 112.8 | L354 K356 V362 | L354-T358 PolarHBondContact O-N 2.91Å; L354-T358 PolarHBondContact O-OG1 3.23Å; L354-T358 VanDerWaalsContact O-OG1 3.12Å; K356-T358 PolarHBondContact O-N 3.47Å; T358-V362 HydrophobicContact CG2-CG2 4.33Å; T358-V362 VanDerWaalsContact O-CB 3.23Å; T358-V362 WeakPolarHBondContact O-CB 3.32Å; T358-V362 WeakPolarHBondContact O-CG2 3.23Å; T358-V362 PolarHBondContact O-N 3.15Å |
| 359 | K | 78.1 | Confident | 80.1 | Confident | 116 Ų | 116 | 101.5 Ų | 101.5 | 50% | 0.504 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -75.7 | -30.6 | 173.3 | -76.9 | 173.3 | -172.8 | 125.3 | 0 | 112.7 | S355 K356 K357 G363 | S355-K359 WeakPolarHBondContact O-CD 3.29Å; S355-K359 WeakPolarHBondContact O-CG 3.47Å; S355-K359 PolarHBondContact O-NZ 3.33Å; S355-K359 PolarHBondContact OG-NZ 3.31Å; K356-K359 CarbonylContact O-C 3.6Å; K356-K359 WeakPolarHBondContact O-CA 3.45Å; K356-K359 WeakPolarHBondContact O-CB 3.39Å; K356-K359 PolarHBondContact O-N 3.34Å; K357-K359 VanDerWaalsContact C-N 3.29Å; K357-K359 PolarHBondContact O-N 2.84Å; K359-G363 PolarHBondContact O-N 2.9Å |
| 360 | E | 80.8 | Confident | 80.3 | Confident | 126 Ų | 126 | 100.2 Ų | 100.2 | 59% | 0.589 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -68.8 | -51.5 | 173.2 | -70.5 | 149.5 | -159.9 | 0 | 0 | 109.5 | K356 K357 V362 G363 E364 | K356-E360 PolarHBondContact O-N 3.44Å; K357-E360 WeakPolarHBondContact O-CB 3.36Å; K357-E360 PolarHBondContact O-N 2.8Å; K357-E360 VanDerWaalsContact O-N 3.13Å; E360-V362 PolarHBondContact O-N 3.2Å; E360-G363 CarbonylContact O-C 3.53Å; E360-G363 WeakPolarHBondContact O-CA 3.36Å; E360-G363 PolarHBondContact O-N 3.43Å; E360-E364 PolarHBondContact O-N 3.46Å |
| 361 | E | 80.4 | Confident | 80.8 | Confident | 74 Ų | 74 | 98.8 Ų | 98.8 | 35% | 0.346 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.3 | -46.7 | 176.3 | -68.6 | 165.5 | 160.6 | 0 | 0 | 112.7 | K357 G363 E364 I365 | K357-E361 IonicContact NZ-OE1 3.31Å; K357-E361 PolarHBondContact NZ-OE1 3Å; K357-E361 WeakPolarHBondContact O-CG 3.48Å; K357-E361 PolarHBondContact O-N 3.48Å; E361-G363 PolarHBondContact O-N 3.38Å; E361-E364 PolarHBondContact O-N 2.9Å; E361-I365 VanDerWaalsContact O-CG1 3.31Å; E361-I365 WeakPolarHBondContact O-CG1 3.35Å; E361-I365 PolarHBondContact O-N 3.35Å |
| 362 | V | 79.2 | Confident | 81.2 | Confident | 87 Ų | 87 | 102.3 Ų | 102.3 | 53% | 0.527 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.6 | -26.4 | 174.8 | 171.3 | 0 | 0 | 0 | 0 | 111.7 | T358 E360 K366 | T358-V362 HydrophobicContact CG2-CG2 4.33Å; T358-V362 VanDerWaalsContact O-CB 3.23Å; T358-V362 WeakPolarHBondContact O-CB 3.32Å; T358-V362 WeakPolarHBondContact O-CG2 3.23Å; T358-V362 PolarHBondContact O-N 3.15Å; E360-V362 PolarHBondContact O-N 3.2Å; V362-K366 WeakPolarHBondContact O-CB 3.4Å; V362-K366 PolarHBondContact O-N 3.31Å; V362-K366 VanDerWaalsContact O-N 3.09Å |
| 363 | G | 77.5 | Confident | 81.4 | Confident | 40 Ų | 40 | 101.3 Ų | 101.3 | 41% | 0.412 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -68.1 | -43.5 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | K359 E360 E361 K366 A367 | K359-G363 PolarHBondContact O-N 2.9Å; E360-G363 CarbonylContact O-C 3.53Å; E360-G363 WeakPolarHBondContact O-CA 3.36Å; E360-G363 PolarHBondContact O-N 3.43Å; E361-G363 PolarHBondContact O-N 3.38Å; G363-K366 PolarHBondContact O-N 2.85Å; G363-A367 PolarHBondContact O-N 2.95Å |
| 364 | E | 82.1 | Confident | 81.6 | Confident | 121 Ų | 121 | 99.2 Ų | 99.2 | 57% | 0.565 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.1 | -47.7 | 176.8 | -173.9 | 170.1 | -141.1 | 0 | 0 | 111.7 | E360 E361 K366 A367 H368 | E360-E364 PolarHBondContact O-N 3.46Å; E361-E364 PolarHBondContact O-N 2.9Å; E364-K366 PolarHBondContact O-N 2.83Å; E364-A367 WeakPolarHBondContact O-CA 3.36Å; E364-A367 WeakPolarHBondContact O-CB 3.46Å; E364-A367 PolarHBondContact O-N 3.12Å; E364-H368 PolarHBondContact O-N 3.06Å |
| 365 | I | 80.4 | Confident | 82.3 | Confident | 117 Ų | 117 | 99 Ų | 99 | 60% | 0.6 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -55.7 | -41.5 | 172 | -67.7 | 164.8 | 0 | 0 | 0 | 110.8 | E361 A369 | E361-I365 VanDerWaalsContact O-CG1 3.31Å; E361-I365 WeakPolarHBondContact O-CG1 3.35Å; E361-I365 PolarHBondContact O-N 3.35Å; I365-A369 WeakPolarHBondContact O-CB 3.33Å; I365-A369 PolarHBondContact O-N 3.08Å |
| 366 | K | 84.9 | Confident | 82.6 | Confident | 155 Ų | 155 | 98.6 Ų | 98.6 | 67% | 0.674 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -69.1 | -32 | 177 | -176.2 | 178.9 | 176.9 | -175.6 | 0 | 112.8 | V362 G363 E364 A370 | V362-K366 WeakPolarHBondContact O-CB 3.4Å; V362-K366 PolarHBondContact O-N 3.31Å; V362-K366 VanDerWaalsContact O-N 3.09Å; G363-K366 PolarHBondContact O-N 2.85Å; E364-K366 PolarHBondContact O-N 2.83Å; K366-A370 WeakPolarHBondContact O-CB 3.22Å; K366-A370 PolarHBondContact O-N 3.16Å |
| 367 | A | 83.9 | Confident | 82.7 | Confident | 58 Ų | 58 | 100.9 Ų | 100.9 | 48% | 0.479 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.8 | -50.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | G363 E364 A369 A370 E371 | G363-A367 PolarHBondContact O-N 2.95Å; E364-A367 WeakPolarHBondContact O-CA 3.36Å; E364-A367 WeakPolarHBondContact O-CB 3.46Å; E364-A367 PolarHBondContact O-N 3.12Å; A367-A369 VanDerWaalsContact C-N 3.33Å; A367-A369 PolarHBondContact O-N 3.17Å; A367-A370 WeakPolarHBondContact O-CA 3.24Å; A367-A370 WeakPolarHBondContact O-CB 3.44Å; A367-A370 PolarHBondContact O-N 3.27Å; A367-E371 PolarHBondContact O-N 3.32Å |
| 368 | H | 83.1 | Confident | 82.8 | Confident | 113 Ų | 113 | 97.3 Ų | 97.3 | 52% | 0.523 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.5 | -39.5 | 174.9 | -73.3 | -53 | 0 | 0 | 0 | 112.8 | E364 A370 E371 W372 | E364-H368 PolarHBondContact O-N 3.06Å; H368-A370 VanDerWaalsContact C-N 3.28Å; H368-A370 PolarHBondContact O-N 3.43Å; H368-E371 IonicContact ND1-OE2 2.7Å; H368-E371 PolarHBondContact ND1-OE2 2.6Å; H368-E371 PolarHBondContact O-N 2.89Å; H368-W372 WeakPolarHBondContact O-CB 3.41Å; H368-W372 PolarHBondContact O-N 3.17Å |
| 369 | A | 83.4 | Confident | 83 | Confident | 55 Ų | 55 | 99.9 Ų | 99.9 | 46% | 0.455 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.3 | -32 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | I365 A367 K373 | I365-A369 WeakPolarHBondContact O-CB 3.33Å; I365-A369 PolarHBondContact O-N 3.08Å; A367-A369 VanDerWaalsContact C-N 3.33Å; A367-A369 PolarHBondContact O-N 3.17Å; A369-K373 WeakPolarHBondContact O-CB 3.46Å; A369-K373 PolarHBondContact O-N 3.13Å |
| 370 | A | 86.8 | Confident | 82.8 | Confident | 58 Ų | 58 | 101.5 Ų | 101.5 | 48% | 0.479 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -75.5 | -39.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | K366 A367 H368 K373 A374 | K366-A370 WeakPolarHBondContact O-CB 3.22Å; K366-A370 PolarHBondContact O-N 3.16Å; A367-A370 WeakPolarHBondContact O-CA 3.24Å; A367-A370 WeakPolarHBondContact O-CB 3.44Å; A367-A370 PolarHBondContact O-N 3.27Å; H368-A370 VanDerWaalsContact C-N 3.28Å; H368-A370 PolarHBondContact O-N 3.43Å; A370-K373 PolarHBondContact O-N 3Å; A370-A374 WeakPolarHBondContact O-CB 3.21Å; A370-A374 PolarHBondContact O-N 2.98Å |
| 371 | E | 86 | Confident | 82.7 | Confident | 125 Ų | 125 | 102 Ų | 102 | 58% | 0.584 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.9 | -52.1 | 174.5 | 179.3 | 177.3 | -145.3 | 0 | 0 | 111.5 | A367 H368 K373 A374 N375 | A367-E371 PolarHBondContact O-N 3.32Å; H368-E371 IonicContact ND1-OE2 2.7Å; H368-E371 PolarHBondContact ND1-OE2 2.6Å; H368-E371 PolarHBondContact O-N 2.89Å; E371-K373 VanDerWaalsContact C-N 3.3Å; E371-K373 PolarHBondContact O-N 3.14Å; E371-A374 CarbonylContact O-C 3.55Å; E371-A374 WeakPolarHBondContact O-CA 3.34Å; E371-A374 WeakPolarHBondContact O-CB 3.38Å; E371-A374 PolarHBondContact O-N 3.46Å; E371-N375 PolarHBondContact O-N 3.05Å |
| 372 | W | 84.6 | Confident | 82.4 | Confident | 177 Ų | 177 | 102.4 Ų | 102.4 | 67% | 0.67 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -54.9 | -46.5 | 174.2 | 176.3 | 83.4 | 0 | 0 | 0 | 111.5 | H368 A374 N375 V376 | H368-W372 WeakPolarHBondContact O-CB 3.41Å; H368-W372 PolarHBondContact O-N 3.17Å; W372-A374 VanDerWaalsContact C-N 3.27Å; W372-A374 PolarHBondContact O-N 3.14Å; W372-N375 PolarHBondContact O-N 3.03Å; W372-V376 HydrophobicContact CD2-CG2 4.17Å; W372-V376 HydrophobicContact CZ2-CG2 3.97Å; W372-V376 WeakPolarHBondContact O-CG2 3.36Å; W372-V376 PolarHBondContact O-N 3.09Å |
| 373 | K | 85 | Confident | 82 | Confident | 146 Ų | 146 | 102.1 Ų | 102.1 | 64% | 0.635 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -29.6 | 176.4 | -175.1 | 171.2 | -175.6 | 169.4 | 0 | 112.9 | A369 A370 E371 R377 | A369-K373 WeakPolarHBondContact O-CB 3.46Å; A369-K373 PolarHBondContact O-N 3.13Å; A370-K373 PolarHBondContact O-N 3Å; E371-K373 VanDerWaalsContact C-N 3.3Å; E371-K373 PolarHBondContact O-N 3.14Å; K373-R377 WeakPolarHBondContact O-CB 3.45Å; K373-R377 PolarHBondContact O-N 2.86Å |
| 374 | A | 86.8 | Confident | 81.8 | Confident | 57 Ų | 57 | 109.3 Ų | 109.3 | 47% | 0.471 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -74.7 | -41.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A370 E371 W372 R377 A378 | A370-A374 WeakPolarHBondContact O-CB 3.21Å; A370-A374 PolarHBondContact O-N 2.98Å; E371-A374 CarbonylContact O-C 3.55Å; E371-A374 WeakPolarHBondContact O-CA 3.34Å; E371-A374 WeakPolarHBondContact O-CB 3.38Å; E371-A374 PolarHBondContact O-N 3.46Å; W372-A374 VanDerWaalsContact C-N 3.27Å; W372-A374 PolarHBondContact O-N 3.14Å; A374-R377 CarbonylContact O-C 3.55Å; A374-R377 PolarHBondContact O-N 3.01Å; A374-A378 PolarHBondContact O-N 3.39Å |
| 375 | N | 90.1 | Very high | 81.3 | Confident | 95 Ų | 95 | 111.2 Ų | 111.2 | 51% | 0.508 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.3 | -50.6 | 179.4 | -169.7 | 59.1 | 0 | 0 | 0 | 112.2 | E371 W372 R377 A378 E379 | E371-N375 PolarHBondContact O-N 3.05Å; W372-N375 PolarHBondContact O-N 3.03Å; N375-R377 PolarHBondContact O-N 3.26Å; N375-A378 CarbonylContact O-C 3.6Å; N375-A378 WeakPolarHBondContact O-CA 3.28Å; N375-A378 VanDerWaalsContact O-CB 3.27Å; N375-A378 WeakPolarHBondContact O-CB 3.26Å; N375-A378 PolarHBondContact O-N 3.04Å; N375-E379 PolarHBondContact O-N 3.27Å |
| 376 | V | 82.6 | Confident | 80.8 | Confident | 40 Ų | 40 | 114.1 Ų | 114.1 | 24% | 0.242 | 54% | 0.54 | C | S | . | . | H | α-helix | trans | -56.2 | -40 | 173.3 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | W372 A378 E379 F380 | W372-V376 HydrophobicContact CD2-CG2 4.17Å; W372-V376 HydrophobicContact CZ2-CG2 3.97Å; W372-V376 WeakPolarHBondContact O-CG2 3.36Å; W372-V376 PolarHBondContact O-N 3.09Å; V376-A378 PolarHBondContact O-N 2.99Å; V376-E379 PolarHBondContact O-N 2.85Å; V376-F380 HydrophobicContact CG1-CD2 3.83Å; V376-F380 HydrophobicContact CG1-CE2 4.02Å; V376-F380 WeakPolarHBondContact O-CD2 3.34Å; V376-F380 PolarHBondContact O-N 3.33Å |
| 377 | R | 83.1 | Confident | 80 | Confident | 182 Ų | 182 | 111.7 Ų | 111.7 | 69% | 0.687 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -73 | -13.1 | 175.7 | -159.3 | 178.6 | -151.1 | -167.4 | 6.5 | 113.3 | K373 A374 N375 R381 | K373-R377 WeakPolarHBondContact O-CB 3.45Å; K373-R377 PolarHBondContact O-N 2.86Å; A374-R377 CarbonylContact O-C 3.55Å; A374-R377 PolarHBondContact O-N 3.01Å; N375-R377 PolarHBondContact O-N 3.26Å; R377-R381 VanDerWaalsContact O-CZ 3.29Å; R377-R381 PolarHBondContact O-NE 3.48Å; R377-R381 PolarHBondContact O-NH2 2.93Å |
| 378 | A | 82.8 | Confident | 79.3 | Confident | 39 Ų | 39 | 112.4 Ų | 112.4 | 32% | 0.322 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -83.8 | -48.6 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | A374 N375 V376 F380 R381 E382 | A374-A378 PolarHBondContact O-N 3.39Å; N375-A378 CarbonylContact O-C 3.6Å; N375-A378 WeakPolarHBondContact O-CA 3.28Å; N375-A378 VanDerWaalsContact O-CB 3.27Å; N375-A378 WeakPolarHBondContact O-CB 3.26Å; N375-A378 PolarHBondContact O-N 3.04Å; V376-A378 PolarHBondContact O-N 2.99Å; A378-F380 VanDerWaalsContact C-N 3.33Å; A378-F380 PolarHBondContact O-N 3.22Å; A378-R381 CarbonylContact O-C 3.58Å; A378-R381 WeakPolarHBondContact O-CA 3.44Å; A378-R381 WeakPolarHBondContact O-CB 3.48Å; A378-R381 PolarHBondContact O-N 3.45Å; A378-E382 PolarHBondContact O-N 2.9Å |
| 379 | E | 81.6 | Confident | 78.8 | Confident | 116 Ų | 116 | 111.9 Ų | 111.9 | 54% | 0.542 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -57.2 | -42.7 | 174.8 | -66.6 | -171.6 | 135.9 | 0 | 0 | 112.5 | N375 V376 R381 E382 T383 | N375-E379 PolarHBondContact O-N 3.27Å; V376-E379 PolarHBondContact O-N 2.85Å; E379-R381 PolarHBondContact O-N 3.49Å; E379-E382 PolarHBondContact O-N 3.08Å; E379-E382 VanDerWaalsContact O-N 3.13Å; E379-T383 WeakPolarHBondContact O-CB 3.3Å; E379-T383 WeakPolarHBondContact O-CG2 3.17Å; E379-T383 PolarHBondContact O-N 2.77Å; E379-T383 PolarHBondContact O-OG1 2.94Å |
| 380 | F | 74 | Confident | 78.4 | Confident | 150 Ų | 150 | 114 Ų | 114 | 66% | 0.658 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -65.6 | -21.3 | 173.8 | -92.3 | -74.3 | 0 | 0 | 0 | 114.3 | V376 A378 T383 R384 | V376-F380 HydrophobicContact CG1-CD2 3.83Å; V376-F380 HydrophobicContact CG1-CE2 4.02Å; V376-F380 WeakPolarHBondContact O-CD2 3.34Å; V376-F380 PolarHBondContact O-N 3.33Å; A378-F380 VanDerWaalsContact C-N 3.33Å; A378-F380 PolarHBondContact O-N 3.22Å; F380-T383 WeakPolarHBondContact CA-OG1 3.24Å; F380-T383 PolarHBondContact O-OG1 3.13Å; F380-R384 VanDerWaalsContact O-CB 3.23Å; F380-R384 WeakPolarHBondContact O-CB 3.34Å; F380-R384 PolarHBondContact O-N 3.41Å |
| 381 | R | 78.1 | Confident | 77.5 | Confident | 137 Ų | 137 | 115.4 Ų | 115.4 | 52% | 0.517 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -82.6 | -37.4 | 169.6 | -91.8 | 174 | -70.2 | 150.8 | 4.6 | 111.5 | R377 A378 E379 R385 | R377-R381 VanDerWaalsContact O-CZ 3.29Å; R377-R381 PolarHBondContact O-NE 3.48Å; R377-R381 PolarHBondContact O-NH2 2.93Å; A378-R381 CarbonylContact O-C 3.58Å; A378-R381 WeakPolarHBondContact O-CA 3.44Å; A378-R381 WeakPolarHBondContact O-CB 3.48Å; A378-R381 PolarHBondContact O-N 3.45Å; E379-R381 PolarHBondContact O-N 3.49Å; R381-R385 WeakPolarHBondContact O-CB 3.4Å; R381-R385 VanDerWaalsContact O-CG 3.25Å; R381-R385 WeakPolarHBondContact O-CG 3.27Å; R381-R385 PolarHBondContact O-N 3.4Å |
| 382 | E | 74.6 | Confident | 76.9 | Confident | 83 Ų | 83 | 115.1 Ų | 115.1 | 39% | 0.388 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -71.5 | -44.3 | -177.5 | -160.1 | 57.9 | -158.1 | 0 | 0 | 111.8 | A378 E379 R385 R386 | A378-E382 PolarHBondContact O-N 2.9Å; E379-E382 PolarHBondContact O-N 3.08Å; E379-E382 VanDerWaalsContact O-N 3.13Å; E382-R385 WeakPolarHBondContact O-CB 3.34Å; E382-R385 PolarHBondContact O-N 3.3Å; E382-R385 IonicContact OE2-NH1 3.01Å; E382-R385 PolarHBondContact OE2-NH1 3.47Å; E382-R386 WeakPolarHBondContact O-CG 3.42Å; E382-R386 PolarHBondContact O-N 3.14Å |
| 383 | T | 71.3 | Confident | 76.6 | Confident | 80 Ų | 80 | 109.6 Ų | 109.6 | 49% | 0.491 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 169.6 | 49.5 | 0 | 0 | 0 | 0 | 112 | E379 F380 R385 R386 L387 | E379-T383 WeakPolarHBondContact O-CB 3.3Å; E379-T383 WeakPolarHBondContact O-CG2 3.17Å; E379-T383 PolarHBondContact O-N 2.77Å; E379-T383 PolarHBondContact O-OG1 2.94Å; F380-T383 WeakPolarHBondContact CA-OG1 3.24Å; F380-T383 PolarHBondContact O-OG1 3.13Å; T383-R385 VanDerWaalsContact C-N 3.3Å; T383-R385 PolarHBondContact O-N 3.42Å; T383-R386 PolarHBondContact O-N 3.43Å; T383-L387 WeakPolarHBondContact O-CB 3.49Å; T383-L387 PolarHBondContact O-N 2.8Å |
| 384 | R | 73 | Confident | 76.3 | Confident | 192 Ų | 192 | 108.6 Ų | 108.6 | 73% | 0.725 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -58.6 | -39.7 | 173.4 | 177.7 | -179.2 | -82.1 | -150.8 | -3.8 | 112 | F380 S388 | F380-R384 VanDerWaalsContact O-CB 3.23Å; F380-R384 WeakPolarHBondContact O-CB 3.34Å; F380-R384 PolarHBondContact O-N 3.41Å; R384-S388 WeakPolarHBondContact O-CB 3.32Å; R384-S388 PolarHBondContact O-N 3.39Å |
| 385 | R | 70.6 | Confident | 75.8 | Confident | 161 Ų | 161 | 111.1 Ų | 111.1 | 61% | 0.608 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64 | -48.8 | 175.8 | -81.1 | 166 | 168.2 | 177.6 | -8.1 | 111.8 | R381 E382 T383 L387 S388 V389 | R381-R385 WeakPolarHBondContact O-CB 3.4Å; R381-R385 VanDerWaalsContact O-CG 3.25Å; R381-R385 WeakPolarHBondContact O-CG 3.27Å; R381-R385 PolarHBondContact O-N 3.4Å; E382-R385 WeakPolarHBondContact O-CB 3.34Å; E382-R385 PolarHBondContact O-N 3.3Å; E382-R385 IonicContact OE2-NH1 3.01Å; E382-R385 PolarHBondContact OE2-NH1 3.47Å; T383-R385 VanDerWaalsContact C-N 3.3Å; T383-R385 PolarHBondContact O-N 3.42Å; R385-L387 PolarHBondContact O-N 3.18Å; R385-S388 WeakPolarHBondContact O-CB 3.47Å; R385-S388 PolarHBondContact O-N 3.37Å; R385-S388 VanDerWaalsContact O-N 3.16Å; R385-V389 WeakPolarHBondContact O-CG2 3.37Å; R385-V389 PolarHBondContact O-N 3.14Å |
| 386 | R | 70.8 | Confident | 74.9 | Confident | 178 Ų | 178 | 112.1 Ų | 112.1 | 67% | 0.672 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -58.9 | -47.8 | 177.8 | -71.6 | 176.8 | -179.3 | -120.1 | -1 | 111.4 | E382 T383 S388 V389 E390 | E382-R386 WeakPolarHBondContact O-CG 3.42Å; E382-R386 PolarHBondContact O-N 3.14Å; T383-R386 PolarHBondContact O-N 3.43Å; R386-S388 VanDerWaalsContact C-N 3.33Å; R386-S388 PolarHBondContact O-N 3.06Å; R386-V389 PolarHBondContact O-N 2.85Å; R386-E390 PolarHBondContact O-N 3.4Å |
| 387 | L | 67.8 | Low | 74.7 | Confident | 104 Ų | 104 | 117.2 Ų | 117.2 | 55% | 0.545 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.9 | -40.7 | 175 | -167.2 | 73.3 | 0 | 0 | 0 | 111.9 | T383 R385 E390 I391 | T383-L387 WeakPolarHBondContact O-CB 3.49Å; T383-L387 PolarHBondContact O-N 2.8Å; R385-L387 PolarHBondContact O-N 3.18Å; L387-E390 PolarHBondContact O-N 2.98Å; L387-I391 HydrophobicContact CD2-CD1 4.38Å; L387-I391 HydrophobicContact CG-CD1 3.9Å; L387-I391 WeakPolarHBondContact O-CB 3.41Å; L387-I391 VanDerWaalsContact O-CG1 3.22Å; L387-I391 WeakPolarHBondContact O-CG1 3.46Å; L387-I391 PolarHBondContact O-N 3.35Å |
| 388 | S | 68.8 | Low | 74.2 | Confident | 73 Ų | 73 | 111 Ų | 111 | 51% | 0.51 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65 | -37 | 176.6 | -173.9 | 0 | 0 | 0 | 0 | 113 | R384 R385 R386 H392 | R384-S388 WeakPolarHBondContact O-CB 3.32Å; R384-S388 PolarHBondContact O-N 3.39Å; R385-S388 WeakPolarHBondContact O-CB 3.47Å; R385-S388 PolarHBondContact O-N 3.37Å; R385-S388 VanDerWaalsContact O-N 3.16Å; R386-S388 VanDerWaalsContact C-N 3.33Å; R386-S388 PolarHBondContact O-N 3.06Å; S388-H392 VanDerWaalsContact O-CB 3.3Å; S388-H392 WeakPolarHBondContact O-CB 3.36Å; S388-H392 PolarHBondContact O-N 2.94Å |
| 389 | V | 73.5 | Confident | 73.8 | Confident | 102 Ų | 102 | 111.9 Ų | 111.9 | 62% | 0.618 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -69.5 | -44.6 | 176.3 | 170.1 | 0 | 0 | 0 | 0 | 110.2 | R385 R386 I391 H392 D393 | R385-V389 WeakPolarHBondContact O-CG2 3.37Å; R385-V389 PolarHBondContact O-N 3.14Å; R386-V389 PolarHBondContact O-N 2.85Å; V389-I391 PolarHBondContact O-N 2.95Å; V389-H392 PolarHBondContact O-N 2.89Å; V389-D393 WeakPolarHBondContact O-CB 3.03Å; V389-D393 PolarHBondContact O-N 2.68Å |
| 390 | E | 73.8 | Confident | 73.5 | Confident | 98 Ų | 98 | 109.7 Ų | 109.7 | 46% | 0.458 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.5 | -40.1 | 177.8 | -164.7 | -170.4 | 145 | 0 | 0 | 112.3 | R386 L387 K394 | R386-E390 PolarHBondContact O-N 3.4Å; L387-E390 PolarHBondContact O-N 2.98Å; E390-K394 HydrophobicContact CG-CD 4.27Å; E390-K394 WeakPolarHBondContact O-CB 3.19Å; E390-K394 VanDerWaalsContact O-CG 3.31Å; E390-K394 WeakPolarHBondContact O-CG 3.45Å; E390-K394 PolarHBondContact O-N 3.23Å; E390-K394 WeakPolarHBondContact OE1-CE 3.32Å; E390-K394 IonicContact OE1-NZ 3.21Å; E390-K394 PolarHBondContact OE1-NZ 3.13Å |
| 391 | I | 69.3 | Low | 73.6 | Confident | 89 Ų | 89 | 107.4 Ų | 107.4 | 46% | 0.456 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.7 | -41.6 | 173.3 | -71.3 | 168.1 | 0 | 0 | 0 | 110.9 | L387 V389 L395 | L387-I391 HydrophobicContact CD2-CD1 4.38Å; L387-I391 HydrophobicContact CG-CD1 3.9Å; L387-I391 WeakPolarHBondContact O-CB 3.41Å; L387-I391 VanDerWaalsContact O-CG1 3.22Å; L387-I391 WeakPolarHBondContact O-CG1 3.46Å; L387-I391 PolarHBondContact O-N 3.35Å; V389-I391 PolarHBondContact O-N 2.95Å; I391-L395 HydrophobicContact CG2-CD1 3.92Å; I391-L395 WeakPolarHBondContact O-CB 3.5Å; I391-L395 WeakPolarHBondContact O-CG 3.5Å; I391-L395 PolarHBondContact O-N 2.95Å |
| 392 | H | 72.2 | Confident | 73.4 | Confident | 118 Ų | 118 | 109.1 Ų | 109.1 | 55% | 0.546 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.7 | -45.4 | 179.2 | -164.9 | 84.7 | 0 | 0 | 0 | 111.8 | S388 V389 L395 Q396 | S388-H392 VanDerWaalsContact O-CB 3.3Å; S388-H392 WeakPolarHBondContact O-CB 3.36Å; S388-H392 PolarHBondContact O-N 2.94Å; V389-H392 PolarHBondContact O-N 2.89Å; H392-L395 PolarHBondContact O-N 3.32Å; H392-Q396 VanDerWaalsContact O-CB 3.26Å; H392-Q396 WeakPolarHBondContact O-CB 3.28Å; H392-Q396 PolarHBondContact O-N 2.9Å |
| 393 | D | 78.7 | Confident | 73.2 | Confident | 61 Ų | 61 | 107.3 Ų | 107.3 | 33% | 0.326 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.1 | -45.7 | 175 | 178.8 | 20.9 | 0 | 0 | 0 | 111.3 | V389 L395 Q396 R397 | V389-D393 WeakPolarHBondContact O-CB 3.03Å; V389-D393 PolarHBondContact O-N 2.68Å; D393-L395 VanDerWaalsContact C-N 3.35Å; D393-L395 PolarHBondContact O-N 3.38Å; D393-Q396 PolarHBondContact O-N 3.13Å; D393-Q396 VanDerWaalsContact O-N 3.12Å; D393-R397 VanDerWaalsContact CG-NE 3.34Å; D393-R397 WeakPolarHBondContact O-CB 3.45Å; D393-R397 VanDerWaalsContact O-CG 3.31Å; D393-R397 WeakPolarHBondContact O-CG 3.19Å; D393-R397 PolarHBondContact O-N 2.91Å; D393-R397 IonicContact OD1-CZ 2.89Å; D393-R397 IonicContact OD1-NE 3.91Å; D393-R397 PolarHBondContact OD1-NE 2.96Å; D393-R397 IonicContact OD1-NH2 3.67Å; D393-R397 PolarHBondContact OD1-NH2 3.25Å; D393-R397 IonicContact OD2-CZ 3.53Å; D393-R397 IonicContact OD2-NE 2.77Å; D393-R397 PolarHBondContact OD2-NE 3.47Å; D393-R397 IonicContact OD2-NH2 3.36Å; D393-R397 PolarHBondContact OD2-NH2 2.96Å |
| 394 | K | 78.6 | Confident | 73.3 | Confident | 125 Ų | 125 | 109.3 Ų | 109.3 | 54% | 0.543 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.8 | -40 | 174.3 | -76.2 | 173.6 | 173.2 | 174.6 | 0 | 112.7 | E390 A398 | E390-K394 HydrophobicContact CG-CD 4.27Å; E390-K394 WeakPolarHBondContact O-CB 3.19Å; E390-K394 VanDerWaalsContact O-CG 3.31Å; E390-K394 WeakPolarHBondContact O-CG 3.45Å; E390-K394 PolarHBondContact O-N 3.23Å; E390-K394 WeakPolarHBondContact OE1-CE 3.32Å; E390-K394 IonicContact OE1-NZ 3.21Å; E390-K394 PolarHBondContact OE1-NZ 3.13Å; K394-A398 WeakPolarHBondContact O-CB 3.09Å; K394-A398 PolarHBondContact O-N 2.55Å |
| 395 | L | 75.8 | Confident | 73 | Confident | 111 Ų | 111 | 105 Ų | 105 | 58% | 0.581 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.8 | -39 | 172.6 | -78.8 | 167.8 | 0 | 0 | 0 | 112.4 | I391 H392 D393 A398 A399 | I391-L395 HydrophobicContact CG2-CD1 3.92Å; I391-L395 WeakPolarHBondContact O-CB 3.5Å; I391-L395 WeakPolarHBondContact O-CG 3.5Å; I391-L395 PolarHBondContact O-N 2.95Å; H392-L395 PolarHBondContact O-N 3.32Å; D393-L395 VanDerWaalsContact C-N 3.35Å; D393-L395 PolarHBondContact O-N 3.38Å; L395-A398 PolarHBondContact O-N 2.8Å; L395-A399 WeakPolarHBondContact O-CB 3.49Å; L395-A399 PolarHBondContact O-N 3.45Å |
| 396 | Q | 72.6 | Confident | 72.4 | Confident | 115 Ų | 115 | 103.9 Ų | 103.9 | 54% | 0.537 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.8 | -40.2 | -178.7 | -166.5 | 168.3 | -0 | 0 | 0 | 111.3 | H392 D393 A399 T400 | H392-Q396 VanDerWaalsContact O-CB 3.26Å; H392-Q396 WeakPolarHBondContact O-CB 3.28Å; H392-Q396 PolarHBondContact O-N 2.9Å; D393-Q396 PolarHBondContact O-N 3.13Å; D393-Q396 VanDerWaalsContact O-N 3.12Å; Q396-A399 PolarHBondContact O-N 2.57Å; Q396-T400 PolarHBondContact O-N 2.93Å; Q396-T400 PolarHBondContact O-OG1 2.78Å |
| 397 | R | 77.3 | Confident | 71.9 | Confident | 148 Ų | 148 | 103.4 Ų | 103.4 | 56% | 0.558 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.8 | -42.9 | 169 | -66 | 176 | -162.8 | -152 | 9.5 | 112 | D393 A399 T400 I401 | D393-R397 VanDerWaalsContact CG-NE 3.34Å; D393-R397 WeakPolarHBondContact O-CB 3.45Å; D393-R397 VanDerWaalsContact O-CG 3.31Å; D393-R397 WeakPolarHBondContact O-CG 3.19Å; D393-R397 PolarHBondContact O-N 2.91Å; D393-R397 IonicContact OD1-CZ 2.89Å; D393-R397 IonicContact OD1-NE 3.91Å; D393-R397 PolarHBondContact OD1-NE 2.96Å; D393-R397 IonicContact OD1-NH2 3.67Å; D393-R397 PolarHBondContact OD1-NH2 3.25Å; D393-R397 IonicContact OD2-CZ 3.53Å; D393-R397 IonicContact OD2-NE 2.77Å; D393-R397 PolarHBondContact OD2-NE 3.47Å; D393-R397 IonicContact OD2-NH2 3.36Å; D393-R397 PolarHBondContact OD2-NH2 2.96Å; R397-A399 VanDerWaalsContact C-N 3.29Å; R397-A399 PolarHBondContact O-N 3.26Å; R397-T400 PolarHBondContact O-N 3.44Å; R397-T400 PolarHBondContact O-OG1 3.37Å; R397-I401 WeakPolarHBondContact O-CD1 3.31Å; R397-I401 VanDerWaalsContact O-CG1 3.28Å; R397-I401 WeakPolarHBondContact O-CG1 3.17Å; R397-I401 PolarHBondContact O-N 3.39Å |
| 398 | A | 73.8 | Confident | 71.7 | Confident | 52 Ų | 52 | 106.6 Ų | 106.6 | 43% | 0.43 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.3 | -36.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | K394 L395 R402 | K394-A398 WeakPolarHBondContact O-CB 3.09Å; K394-A398 PolarHBondContact O-N 2.55Å; L395-A398 PolarHBondContact O-N 2.8Å; A398-R402 WeakPolarHBondContact O-CB 3.36Å; A398-R402 PolarHBondContact O-N 3.15Å |
| 399 | A | 73.1 | Confident | 71.2 | Confident | 56 Ų | 56 | 109.1 Ų | 109.1 | 46% | 0.463 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -70.1 | -35.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | L395 Q396 R397 R402 S403 | L395-A399 WeakPolarHBondContact O-CB 3.49Å; L395-A399 PolarHBondContact O-N 3.45Å; Q396-A399 PolarHBondContact O-N 2.57Å; R397-A399 VanDerWaalsContact C-N 3.29Å; R397-A399 PolarHBondContact O-N 3.26Å; A399-R402 CarbonylContact O-C 3.6Å; A399-S403 PolarHBondContact O-N 3.4Å |
| 400 | T | 75.6 | Confident | 70.3 | Confident | 71 Ų | 71 | 106.8 Ų | 106.8 | 44% | 0.436 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -74.2 | -39.2 | 175 | 53.6 | 0 | 0 | 0 | 0 | 112.4 | Q396 R397 R402 S403 M404 | Q396-T400 PolarHBondContact O-N 2.93Å; Q396-T400 PolarHBondContact O-OG1 2.78Å; R397-T400 PolarHBondContact O-N 3.44Å; R397-T400 PolarHBondContact O-OG1 3.37Å; T400-R402 VanDerWaalsContact C-N 3.29Å; T400-R402 PolarHBondContact O-N 3.46Å; T400-S403 PolarHBondContact O-N 2.9Å; T400-S403 VanDerWaalsContact O-N 3.1Å; T400-S403 PolarHBondContact O-OG 3.3Å; T400-M404 WeakPolarHBondContact O-CG 3.47Å; T400-M404 PolarHBondContact O-N 3.46Å |
| 401 | I | 77.1 | Confident | 69.5 | Low | 101 Ų | 101 | 106 Ų | 106 | 52% | 0.518 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -56.6 | -48.1 | 169.6 | -68.2 | 164.6 | 0 | 0 | 0 | 109.5 | R397 S403 M404 E405 | R397-I401 WeakPolarHBondContact O-CD1 3.31Å; R397-I401 VanDerWaalsContact O-CG1 3.28Å; R397-I401 WeakPolarHBondContact O-CG1 3.17Å; R397-I401 PolarHBondContact O-N 3.39Å; I401-S403 PolarHBondContact O-N 3.06Å; I401-M404 PolarHBondContact O-N 3.41Å; I401-M404 VanDerWaalsContact O-N 3.13Å; I401-E405 PolarHBondContact O-N 2.97Å |
| 402 | R | 73.4 | Confident | 68.5 | Low | 174 Ų | 174 | 106.8 Ų | 106.8 | 66% | 0.657 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -71.9 | -3.9 | 178.5 | -155.5 | 178.3 | -162.8 | 172.9 | 6.6 | 114.6 | A398 A399 T400 R406 | A398-R402 WeakPolarHBondContact O-CB 3.36Å; A398-R402 PolarHBondContact O-N 3.15Å; A399-R402 CarbonylContact O-C 3.6Å; T400-R402 VanDerWaalsContact C-N 3.29Å; T400-R402 PolarHBondContact O-N 3.46Å; R402-R406 PolarHBondContact O-NE 3.03Å; R402-R406 PolarHBondContact O-NH2 3.42Å |
| 403 | S | 70.3 | Confident | 67.2 | Low | 44 Ų | 44 | 109.2 Ų | 109.2 | 31% | 0.308 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -98.6 | -33.6 | 166.5 | 72.1 | 0 | 0 | 0 | 0 | 111.6 | A399 T400 I401 R406 R407 | A399-S403 PolarHBondContact O-N 3.4Å; T400-S403 PolarHBondContact O-N 2.9Å; T400-S403 VanDerWaalsContact O-N 3.1Å; T400-S403 PolarHBondContact O-OG 3.3Å; I401-S403 PolarHBondContact O-N 3.06Å; S403-R406 PolarHBondContact O-N 3.43Å; S403-R407 WeakPolarHBondContact O-CG 3.31Å; S403-R407 PolarHBondContact O-N 3.31Å; S403-R407 VanDerWaalsContact O-N 3.14Å |
| 404 | M | 73 | Confident | 65.6 | Low | 122 Ų | 122 | 115 Ų | 115 | 60% | 0.601 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.9 | -45.5 | 170.3 | -70.1 | -179.4 | 173 | 0 | 0 | 112.1 | T400 I401 R406 R407 Q408 | T400-M404 WeakPolarHBondContact O-CG 3.47Å; T400-M404 PolarHBondContact O-N 3.46Å; I401-M404 PolarHBondContact O-N 3.41Å; I401-M404 VanDerWaalsContact O-N 3.13Å; M404-R406 VanDerWaalsContact C-N 3.31Å; M404-R406 PolarHBondContact O-N 2.88Å; M404-R407 WeakPolarHBondContact O-CB 3.31Å; M404-R407 PolarHBondContact O-N 2.81Å; M404-Q408 PolarHBondContact O-N 3.32Å |
| 405 | E | 66.6 | Low | 64 | Low | 101 Ų | 101 | 112.4 Ų | 112.4 | 47% | 0.472 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -57.3 | -43.1 | 173.2 | -73.2 | -177.4 | 127.8 | 0 | 0 | 111.9 | I401 R407 Q408 L409 | I401-E405 PolarHBondContact O-N 2.97Å; E405-R407 PolarHBondContact O-N 3.42Å; E405-Q408 PolarHBondContact O-N 3.4Å; E405-L409 WeakPolarHBondContact O-CB 3.2Å; E405-L409 VanDerWaalsContact O-CG 3.29Å; E405-L409 WeakPolarHBondContact O-CG 3.13Å; E405-L409 PolarHBondContact O-N 3.46Å |
| 406 | R | 59 | Low | 62.5 | Low | 139 Ų | 139 | 113.8 Ų | 113.8 | 53% | 0.525 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.4 | -26 | 178 | -85 | -175.8 | -76.2 | 178 | -1.1 | 113.2 | R402 S403 M404 L411 | R402-R406 PolarHBondContact O-NE 3.03Å; R402-R406 PolarHBondContact O-NH2 3.42Å; S403-R406 PolarHBondContact O-N 3.43Å; M404-R406 VanDerWaalsContact C-N 3.31Å; M404-R406 PolarHBondContact O-N 2.88Å; R406-L411 PolarHBondContact O-N 3.35Å |
| 407 | R | 60.5 | Low | 61.1 | Low | 167 Ų | 167 | 111.2 Ų | 111.2 | 63% | 0.63 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -78.4 | -44 | 172.2 | -73.4 | 173 | 172.6 | 179.4 | -4.5 | 112 | S403 M404 E405 L409 G410 E412 | S403-R407 WeakPolarHBondContact O-CG 3.31Å; S403-R407 PolarHBondContact O-N 3.31Å; S403-R407 VanDerWaalsContact O-N 3.14Å; M404-R407 WeakPolarHBondContact O-CB 3.31Å; M404-R407 PolarHBondContact O-N 2.81Å; E405-R407 PolarHBondContact O-N 3.42Å; R407-L409 VanDerWaalsContact C-N 3.29Å; R407-L409 PolarHBondContact O-N 2.9Å; R407-G410 PolarHBondContact O-N 3.36Å; R407-G410 VanDerWaalsContact O-N 3.16Å; R407-E412 HydrophobicContact CG-CG 4.3Å; R407-E412 WeakPolarHBondContact CG-OE1 3.33Å; R407-E412 IonicContact CZ-OE1 2.6Å; R407-E412 IonicContact NE-OE1 3.28Å; R407-E412 PolarHBondContact NE-OE1 2.87Å; R407-E412 IonicContact NH2-OE1 2.64Å; R407-E412 PolarHBondContact NH2-OE1 3.27Å |
| 408 | Q | 62.9 | Low | 59.7 | Low | 171 Ų | 171 | 109.3 Ų | 109.3 | 80% | 0.799 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.2 | -33.1 | 175.3 | -72.9 | -177.8 | -68.4 | 0 | 0 | 112.8 | M404 E405 G410 | M404-Q408 PolarHBondContact O-N 3.32Å; E405-Q408 PolarHBondContact O-N 3.4Å; Q408-G410 VanDerWaalsContact C-N 3.28Å; Q408-G410 PolarHBondContact O-N 2.95Å |
| 409 | L | 58.9 | Low | 58.5 | Low | 126 Ų | 126 | 111.4 Ų | 111.4 | 66% | 0.66 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | 9.3 | 175.9 | -65.1 | 171.6 | 0 | 0 | 0 | 114 | E405 R407 L411 | E405-L409 WeakPolarHBondContact O-CB 3.2Å; E405-L409 VanDerWaalsContact O-CG 3.29Å; E405-L409 WeakPolarHBondContact O-CG 3.13Å; E405-L409 PolarHBondContact O-N 3.46Å; R407-L409 VanDerWaalsContact C-N 3.29Å; R407-L409 PolarHBondContact O-N 2.9Å; L409-L411 HydrophobicContact CB-CD1 4.16Å; L409-L411 PolarHBondContact O-N 2.89Å; L409-L411 VanDerWaalsContact O-N 3.11Å |
| 410 | G | 54.6 | Low | 57.4 | Low | 53 Ų | 53 | 115.5 Ų | 115.5 | 55% | 0.546 | 57% | 0.572 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 64.2 | 15.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | R407 Q408 E412 | R407-G410 PolarHBondContact O-N 3.36Å; R407-G410 VanDerWaalsContact O-N 3.16Å; Q408-G410 VanDerWaalsContact C-N 3.28Å; Q408-G410 PolarHBondContact O-N 2.95Å; G410-E412 VanDerWaalsContact C-N 3.35Å; G410-E412 PolarHBondContact O-N 2.97Å |
| 411 | L | 55.7 | Low | 56.2 | Low | 82 Ų | 82 | 115.2 Ų | 115.2 | 43% | 0.429 | 57% | 0.568 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.6 | -3.7 | -166 | -92.3 | 165.5 | 0 | 0 | 0 | 115.2 | R406 L409 Q413 R414 | R406-L411 PolarHBondContact O-N 3.35Å; L409-L411 HydrophobicContact CB-CD1 4.16Å; L409-L411 PolarHBondContact O-N 2.89Å; L409-L411 VanDerWaalsContact O-N 3.11Å; L411-Q413 PolarHBondContact O-N 3.18Å; L411-R414 HydrophobicContact CD2-CB 4.36Å; L411-R414 PolarHBondContact O-N 3.49Å; L411-R414 VanDerWaalsContact O-N 3.16Å |
| 412 | E | 48.3 | Very low | 55.4 | Low | 106 Ų | 106 | 113.1 Ų | 113.1 | 50% | 0.495 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.2 | -29.1 | 175.1 | -68.4 | -154.4 | 175.7 | 0 | 0 | 112.5 | R407 G410 R414 A415 H416 | R407-E412 HydrophobicContact CG-CG 4.3Å; R407-E412 WeakPolarHBondContact CG-OE1 3.33Å; R407-E412 IonicContact CZ-OE1 2.6Å; R407-E412 IonicContact NE-OE1 3.28Å; R407-E412 PolarHBondContact NE-OE1 2.87Å; R407-E412 IonicContact NH2-OE1 2.64Å; R407-E412 PolarHBondContact NH2-OE1 3.27Å; G410-E412 VanDerWaalsContact C-N 3.35Å; G410-E412 PolarHBondContact O-N 2.97Å; E412-R414 PolarHBondContact O-N 3.12Å; E412-R414 VanDerWaalsContact O-N 3.15Å; E412-A415 WeakPolarHBondContact O-CB 3.17Å; E412-A415 PolarHBondContact O-N 3.22Å; E412-H416 PolarHBondContact O-N 3.31Å; E412-H416 VanDerWaalsContact O-N 3.16Å |
| 413 | Q | 46.2 | Very low | 54.7 | Low | 169 Ų | 169 | 109.9 Ų | 109.9 | 79% | 0.79 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.1 | -24.3 | 178.4 | -154.7 | 148.3 | 7.2 | 0 | 0 | 112.9 | L411 S417 | L411-Q413 PolarHBondContact O-N 3.18Å; Q413-S417 PolarHBondContact O-N 3.43Å |
| 414 | R | 44.5 | Very low | 54.1 | Low | 183 Ų | 183 | 115 Ų | 115 | 69% | 0.691 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -79.1 | -31.2 | 173.1 | -163.5 | 169.7 | -171.5 | 138.3 | 2.9 | 112.9 | L411 E412 S417 L418 | L411-R414 HydrophobicContact CD2-CB 4.36Å; L411-R414 PolarHBondContact O-N 3.49Å; L411-R414 VanDerWaalsContact O-N 3.16Å; E412-R414 PolarHBondContact O-N 3.12Å; E412-R414 VanDerWaalsContact O-N 3.15Å; R414-S417 WeakPolarHBondContact CA-OG 3.09Å; R414-S417 PolarHBondContact O-N 2.69Å; R414-S417 PolarHBondContact O-OG 2.86Å; R414-L418 PolarHBondContact O-N 3.16Å |
| 415 | A | 45 | Very low | 53.2 | Low | 69 Ų | 69 | 114.7 Ų | 114.7 | 57% | 0.57 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -64.1 | -44.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | E412 S417 L418 | E412-A415 WeakPolarHBondContact O-CB 3.17Å; E412-A415 PolarHBondContact O-N 3.22Å; A415-S417 VanDerWaalsContact C-N 3.26Å; A415-S417 PolarHBondContact O-N 3.44Å; A415-L418 WeakPolarHBondContact O-CB 3.14Å; A415-L418 PolarHBondContact O-N 2.93Å; A415-L418 VanDerWaalsContact O-N 3.14Å |
| 416 | H | 43.3 | Very low | 52.9 | Low | 140 Ų | 140 | 115.2 Ų | 115.2 | 65% | 0.648 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.6 | -28.1 | 177.5 | -145.7 | -41.7 | 0 | 0 | 0 | 113.1 | E412 L418 D419 | E412-H416 PolarHBondContact O-N 3.31Å; E412-H416 VanDerWaalsContact O-N 3.16Å; H416-L418 VanDerWaalsContact C-N 3.32Å; H416-L418 PolarHBondContact O-N 3.14Å; H416-D419 PolarHBondContact O-N 3.02Å |
| 417 | S | 44 | Very low | 52.8 | Low | 62 Ų | 62 | 111.5 Ų | 111.5 | 43% | 0.434 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -70.5 | -23.4 | 174.9 | 77 | 0 | 0 | 0 | 0 | 114.3 | Q413 R414 A415 D419 | Q413-S417 PolarHBondContact O-N 3.43Å; R414-S417 WeakPolarHBondContact CA-OG 3.09Å; R414-S417 PolarHBondContact O-N 2.69Å; R414-S417 PolarHBondContact O-OG 2.86Å; A415-S417 VanDerWaalsContact C-N 3.26Å; A415-S417 PolarHBondContact O-N 3.44Å; S417-D419 VanDerWaalsContact C-N 3.34Å |
| 418 | L | 47.8 | Very low | 52.5 | Low | 108 Ų | 108 | 109.5 Ų | 109.5 | 57% | 0.565 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -76.2 | -22.6 | 174.9 | -101.6 | 157 | 0 | 0 | 0 | 112.6 | R414 A415 H416 I420 L421 | R414-L418 PolarHBondContact O-N 3.16Å; A415-L418 WeakPolarHBondContact O-CB 3.14Å; A415-L418 PolarHBondContact O-N 2.93Å; A415-L418 VanDerWaalsContact O-N 3.14Å; H416-L418 VanDerWaalsContact C-N 3.32Å; H416-L418 PolarHBondContact O-N 3.14Å; L418-I420 VanDerWaalsContact C-N 3.26Å; L418-I420 PolarHBondContact O-N 2.94Å; L418-L421 HydrophobicContact CD2-CD1 4.06Å |
| 419 | D | 47.7 | Very low | 52 | Low | 95 Ų | 95 | 108.3 Ų | 108.3 | 51% | 0.508 | 57% | 0.566 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79 | -7.2 | 177.9 | -143.4 | -18.8 | 0 | 0 | 0 | 113.3 | H416 S417 L421 R426 | H416-D419 PolarHBondContact O-N 3.02Å; S417-D419 VanDerWaalsContact C-N 3.34Å; D419-L421 VanDerWaalsContact C-N 3.33Å; D419-R426 PolarHBondContact O-NH2 2.93Å; D419-R426 IonicContact OD1-CZ 3.36Å; D419-R426 IonicContact OD1-NH1 3.31Å; D419-R426 PolarHBondContact OD1-NH1 3.08Å; D419-R426 IonicContact OD1-NH2 2.68Å; D419-R426 PolarHBondContact OD1-NH2 3.06Å |
| 420 | I | 50.3 | Low | 51.9 | Low | 143 Ų | 143 | 105.3 Ų | 105.3 | 73% | 0.733 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -9.8 | 176.8 | -62.8 | 175.2 | 0 | 0 | 0 | 111.7 | L418 | L418-I420 VanDerWaalsContact C-N 3.26Å; L418-I420 PolarHBondContact O-N 2.94Å |
| 421 | L | 50.6 | Low | 51.9 | Low | 65 Ų | 65 | 106.6 Ų | 106.6 | 34% | 0.34 | 56% | 0.56 | S | S | . | * | S | Bend | trans | -78.1 | 133.1 | 175.7 | -75.5 | 161.6 | 0 | 0 | 0 | 111.9 | L418 D419 K425 R426 | L418-L421 HydrophobicContact CD2-CD1 4.06Å; D419-L421 VanDerWaalsContact C-N 3.33Å; L421-K425 HydrophobicContact CB-CB 4.38Å; L421-K425 HydrophobicContact CD2-CB 4.28Å; L421-K425 HydrophobicContact CD2-CD 3.73Å; L421-R426 PolarHBondContact O-NE 3.25Å; L421-R426 VanDerWaalsContact O-NE 3.13Å; L421-R426 PolarHBondContact O-NH2 3.46Å |
| 422 | S | 61.6 | Low | 51.8 | Low | 56 Ų | 56 | 109.1 Ų | 109.1 | 39% | 0.392 | 57% | 0.574 | S | S | . | * | trans | -59.4 | 156.9 | 178.5 | 66.6 | 0 | 0 | 0 | 0 | 112.5 | E424 K425 R426 | S422-E424 VanDerWaalsContact C-N 3.27Å; S422-E424 PolarHBondContact O-N 2.95Å; S422-E424 VanDerWaalsContact O-N 3.12Å; S422-K425 PolarHBondContact O-N 3.26Å; S422-K425 VanDerWaalsContact O-N 3.07Å; S422-R426 PolarHBondContact O-N 3.17Å | ||
| 423 | P | 58.8 | Low | 51.7 | Low | 106 Ų | 106 | 110.3 Ų | 110.3 | 69% | 0.688 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -54.1 | -37.8 | -170.4 | -29.5 | 36.7 | 0 | 0 | 0 | 114.8 | K425 R426 A427 | P423-K425 VanDerWaalsContact C-N 3.34Å; P423-K425 PolarHBondContact O-N 3.22Å; P423-R426 WeakPolarHBondContact O-CB 3.27Å; P423-R426 PolarHBondContact O-N 2.91Å; P423-A427 PolarHBondContact O-N 3.02Å |
| 424 | E | 56.1 | Low | 51.7 | Low | 153 Ų | 153 | 106 Ų | 106 | 72% | 0.715 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -60.9 | -39.9 | -179.8 | -58.1 | 175.6 | 135.2 | 0 | 0 | 112.7 | S422 R426 A427 M428 | S422-E424 VanDerWaalsContact C-N 3.27Å; S422-E424 PolarHBondContact O-N 2.95Å; S422-E424 VanDerWaalsContact O-N 3.12Å; E424-R426 VanDerWaalsContact C-N 3.34Å; E424-A427 WeakPolarHBondContact O-CB 3.35Å; E424-A427 PolarHBondContact O-N 3.31Å; E424-M428 PolarHBondContact O-N 2.86Å; E424-M428 VanDerWaalsContact O-N 3.17Å |
| 425 | K | 54.8 | Low | 51.7 | Low | 115 Ų | 115 | 100.7 Ų | 100.7 | 50% | 0.5 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -72.6 | -29.4 | 178.9 | -70.3 | -175.8 | 178.9 | 177.9 | 0 | 111.7 | L421 S422 P423 F429 | L421-K425 HydrophobicContact CB-CB 4.38Å; L421-K425 HydrophobicContact CD2-CB 4.28Å; L421-K425 HydrophobicContact CD2-CD 3.73Å; S422-K425 PolarHBondContact O-N 3.26Å; S422-K425 VanDerWaalsContact O-N 3.07Å; P423-K425 VanDerWaalsContact C-N 3.34Å; P423-K425 PolarHBondContact O-N 3.22Å; K425-F429 WeakPolarHBondContact O-CD2 3.32Å; K425-F429 PolarHBondContact O-N 3.47Å |
| 426 | R | 59.9 | Low | 51.8 | Low | 111 Ų | 111 | 107 Ų | 107 | 42% | 0.419 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -66.6 | -41.2 | 168.7 | -87.9 | 179.7 | -102.3 | -156.5 | -15.5 | 112.1 | D419 L421 S422 P423 E424 M428 F429 A430 | D419-R426 PolarHBondContact O-NH2 2.93Å; D419-R426 IonicContact OD1-CZ 3.36Å; D419-R426 IonicContact OD1-NH1 3.31Å; D419-R426 PolarHBondContact OD1-NH1 3.08Å; D419-R426 IonicContact OD1-NH2 2.68Å; D419-R426 PolarHBondContact OD1-NH2 3.06Å; L421-R426 PolarHBondContact O-NE 3.25Å; L421-R426 VanDerWaalsContact O-NE 3.13Å; L421-R426 PolarHBondContact O-NH2 3.46Å; S422-R426 PolarHBondContact O-N 3.17Å; P423-R426 WeakPolarHBondContact O-CB 3.27Å; P423-R426 PolarHBondContact O-N 2.91Å; E424-R426 VanDerWaalsContact C-N 3.34Å; R426-M428 PolarHBondContact O-N 2.94Å; R426-F429 PolarHBondContact O-N 3.02Å; R426-A430 PolarHBondContact O-N 3.48Å |
| 427 | A | 57.7 | Low | 51.6 | Low | 61 Ų | 61 | 109.1 Ų | 109.1 | 50% | 0.504 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -61 | -41.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | P423 E424 F429 A430 S431 | P423-A427 PolarHBondContact O-N 3.02Å; E424-A427 WeakPolarHBondContact O-CB 3.35Å; E424-A427 PolarHBondContact O-N 3.31Å; A427-F429 PolarHBondContact O-N 3.05Å; A427-A430 PolarHBondContact O-N 3.03Å; A427-S431 PolarHBondContact O-N 3.49Å; A427-S431 VanDerWaalsContact O-N 3.07Å; A427-S431 PolarHBondContact O-OG 3.07Å |
| 428 | M | 53.6 | Low | 51.1 | Low | 125 Ų | 125 | 116 Ų | 116 | 62% | 0.616 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -66 | -31.3 | 177.1 | -87.9 | -162.6 | -76.1 | 0 | 0 | 114.5 | E424 R426 S431 L432 | E424-M428 PolarHBondContact O-N 2.86Å; E424-M428 VanDerWaalsContact O-N 3.17Å; R426-M428 PolarHBondContact O-N 2.94Å; M428-S431 PolarHBondContact O-OG 3.31Å; M428-S431 VanDerWaalsContact O-OG 3.1Å; M428-L432 WeakPolarHBondContact O-CD1 3.48Å |
| 429 | F | 53.6 | Low | 50.3 | Low | 146 Ų | 146 | 116.6 Ų | 116.6 | 64% | 0.64 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -78.3 | -35.6 | 174.1 | -85.8 | -81.6 | 0 | 0 | 0 | 112.3 | K425 R426 A427 S431 L432 D433 | K425-F429 WeakPolarHBondContact O-CD2 3.32Å; K425-F429 PolarHBondContact O-N 3.47Å; R426-F429 PolarHBondContact O-N 3.02Å; A427-F429 PolarHBondContact O-N 3.05Å; F429-S431 VanDerWaalsContact C-N 3.34Å; F429-S431 PolarHBondContact O-N 2.85Å; F429-L432 PolarHBondContact O-N 2.95Å; F429-D433 PolarHBondContact O-N 2.94Å |
| 430 | A | 55.8 | Low | 49.7 | Very low | 64 Ų | 64 | 118.2 Ų | 118.2 | 53% | 0.529 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -64.6 | -35.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | R426 A427 A434 | R426-A430 PolarHBondContact O-N 3.48Å; A427-A430 PolarHBondContact O-N 3.03Å; A430-A434 PolarHBondContact O-N 3.2Å |
| 431 | S | 54.9 | Low | 49.1 | Very low | 80 Ų | 80 | 116.1 Ų | 116.1 | 56% | 0.559 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -72.4 | -27.7 | 177.3 | 62.9 | 0 | 0 | 0 | 0 | 113.7 | A427 M428 F429 | A427-S431 PolarHBondContact O-N 3.49Å; A427-S431 VanDerWaalsContact O-N 3.07Å; A427-S431 PolarHBondContact O-OG 3.07Å; M428-S431 PolarHBondContact O-OG 3.31Å; M428-S431 VanDerWaalsContact O-OG 3.1Å; F429-S431 VanDerWaalsContact C-N 3.34Å; F429-S431 PolarHBondContact O-N 2.85Å |
| 432 | L | 53.4 | Low | 48.5 | Very low | 135 Ų | 135 | 122.4 Ų | 122.4 | 71% | 0.707 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -68.4 | -43.9 | 172.5 | -106 | 78.9 | 0 | 0 | 0 | 112.3 | M428 F429 G435 | M428-L432 WeakPolarHBondContact O-CD1 3.48Å; F429-L432 PolarHBondContact O-N 2.95Å; L432-G435 PolarHBondContact O-N 3.49Å |
| 433 | D | 44.9 | Very low | 46.9 | Very low | 131 Ų | 131 | 128.5 Ų | 128.5 | 70% | 0.701 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -73.4 | -34.4 | -174.3 | -150.8 | 35.1 | 0 | 0 | 0 | 111.8 | F429 G435 R436 | F429-D433 PolarHBondContact O-N 2.94Å; D433-G435 PolarHBondContact O-N 3.27Å; D433-R436 PolarHBondContact O-N 3.16Å; D433-R436 VanDerWaalsContact O-N 3.11Å |
| 434 | A | 47.8 | Very low | 45.8 | Very low | 78 Ų | 78 | 128 Ų | 128 | 65% | 0.645 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.2 | -14.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | A430 R436 | A430-A434 PolarHBondContact O-N 3.2Å; A434-R436 VanDerWaalsContact C-N 3.35Å |
| 435 | G | 44.4 | Very low | 44.9 | Very low | 71 Ų | 71 | 127.8 Ų | 127.8 | 73% | 0.732 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -6.3 | 176 | 0 | 0 | 0 | 0 | 0 | 115.2 | L432 D433 | L432-G435 PolarHBondContact O-N 3.49Å; D433-G435 PolarHBondContact O-N 3.27Å |
| 436 | R | 46.8 | Very low | 43.9 | Very low | 203 Ų | 203 | 130.1 Ų | 130.1 | 77% | 0.766 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -130.2 | 132.9 | -177.3 | -146.7 | 171.7 | -68.3 | -127.8 | 2 | 110.5 | D433 A434 | D433-R436 PolarHBondContact O-N 3.16Å; D433-R436 VanDerWaalsContact O-N 3.11Å; A434-R436 VanDerWaalsContact C-N 3.35Å |
| 437 | F | 38.9 | Very low | 42.8 | Very low | 183 Ų | 183 | 128.3 Ų | 128.3 | 80% | 0.803 | 73% | 0.728 | S | S | * | * | trans | 71 | 73 | -170.9 | -61.2 | -83 | 0 | 0 | 0 | 117.1 | ||||
| 438 | K | 32.9 | Very low | 41.6 | Very low | 207 Ų | 207 | 134.5 Ų | 134.5 | 90% | 0.9 | 74% | 0.743 | S | S | * | * | trans | -111.7 | 90.2 | 144 | -79.3 | -171.8 | 176.3 | -178.5 | 0 | 110.4 | S440 | K438-S440 PolarHBondContact O-N 2.9Š| ||
| 439 | T | 31.9 | Very low | 40.5 | Very low | 120 Ų | 120 | 135.8 Ų | 135.8 | 74% | 0.736 | 75% | 0.751 | S | S | * | * | trans | -81.4 | 108.3 | 166.6 | 48.7 | 0 | 0 | 0 | 0 | 109.2 | S441 | T439-S441 PolarHBondContact O-N 3.36Å; T439-S441 VanDerWaalsContact O-N 3.17Å | ||
| 440 | S | 35.4 | Very low | 39.4 | Very low | 130 Ų | 130 | 135.3 Ų | 135.3 | 91% | 0.909 | 76% | 0.756 | S | S | * | * | trans | -70.3 | 106.2 | -177.8 | -178.2 | 0 | 0 | 0 | 0 | 112.1 | K438 | K438-S440 PolarHBondContact O-N 2.9Š| ||
| 441 | S | 37.5 | Very low | 38.2 | Very low | 99 Ų | 99 | 138.9 Ų | 138.9 | 69% | 0.692 | 77% | 0.766 | S | S | * | * | trans | -165.5 | 44.9 | 166.7 | 68 | 0 | 0 | 0 | 0 | 116.3 | T439 | T439-S441 PolarHBondContact O-N 3.36Å; T439-S441 VanDerWaalsContact O-N 3.17Å | ||
| 442 | Q | 36.6 | Very low | 37 | Very low | 197 Ų | 197 | 142.3 Ų | 142.3 | 92% | 0.921 | 78% | 0.777 | S | S | * | * | trans | -166.3 | 100.5 | 158.3 | -117.9 | 168.9 | 14.1 | 0 | 0 | 115.3 | ||||
| 443 | E | 30.1 | Very low | 35.7 | Very low | 184 Ų | 184 | 146.3 Ų | 146.3 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | trans | -153 | 104.8 | 150.3 | -100.5 | 170.6 | 159.1 | 0 | 0 | 104.5 | ||||
| 444 | S | 34.1 | Very low | 34.9 | Very low | 94 Ų | 94 | 146.4 Ų | 146.4 | 66% | 0.657 | 78% | 0.783 | S | S | * | * | 57.3 | 86.4 | 76.7 | 71.6 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 445 | I | 37.9 | Very low | 33.9 | Very low | 150 Ų | 150 | 152.3 Ų | 152.3 | 77% | 0.769 | 79% | 0.794 | S | S | * | * | 93.8 | 129.5 | 70.7 | -78 | 163.5 | 0 | 0 | 0 | 112.2 | |||||
| 446 | N | 32.9 | Very low | 33 | Very low | 163 Ų | 163 | 152.8 Ų | 152.8 | 87% | 0.872 | 80% | 0.798 | S | S | * | * | trans | 63.8 | 146.3 | 171.7 | -67.3 | -17.6 | 0 | 0 | 0 | 117.3 | ||||
| 447 | G | 38.2 | Very low | 32.1 | Very low | 74 Ų | 74 | 147.7 Ų | 147.7 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | trans | -120.8 | 143.2 | 164.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 448 | K | 32.2 | Very low | 31.5 | Very low | 191 Ų | 191 | 144.2 Ų | 144.2 | 83% | 0.83 | 80% | 0.798 | S | S | * | * | trans | -158.8 | 129.3 | 159.3 | -136.6 | -177.2 | -178.3 | -176.1 | 0 | 112.3 | ||||
| 449 | L | 29.5 | Very low | 31.4 | Very low | 151 Ų | 151 | 143.3 Ų | 143.3 | 79% | 0.791 | 80% | 0.797 | S | S | * | * | trans | 64.6 | 142.8 | 154.3 | -79 | 159.9 | 0 | 0 | 0 | 120.8 | ||||
| 450 | N | 30.5 | Very low | 31.1 | Very low | 136 Ų | 136 | 142.7 Ų | 142.7 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | -74.2 | 146.9 | 174.2 | -43.7 | -24.8 | 0 | 0 | 0 | 110.4 | ||||
| 451 | N | 30.8 | Very low | 30.7 | Very low | 139 Ų | 139 | 146 Ų | 146 | 74% | 0.743 | 79% | 0.788 | S | S | * | * | 177 | 137.9 | 100 | -94.5 | -38.2 | 0 | 0 | 0 | 114.8 | |||||
| 452 | L | 29.4 | Very low | 30.2 | Very low | 153 Ų | 153 | 147 Ų | 147 | 80% | 0.801 | 79% | 0.785 | S | S | * | * | trans | 30.4 | 126.9 | 137.4 | -73.3 | 161.6 | 0 | 0 | 0 | 121.9 | ||||
| 453 | R | 27.5 | Very low | 29.8 | Very low | 218 Ų | 218 | 144.3 Ų | 144.3 | 82% | 0.823 | 77% | 0.773 | S | S | * | * | 106.4 | 124.3 | 123.3 | -119.5 | -171 | 177.3 | 174.7 | -1.1 | 121.2 | |||||
| 454 | L | 28.1 | Very low | 29.7 | Very low | 134 Ų | 134 | 144.4 Ų | 144.4 | 70% | 0.702 | 77% | 0.773 | S | S | * | * | 94.3 | 143.2 | 127.3 | -141.8 | 76.6 | 0 | 0 | 0 | 121 | |||||
| 455 | K | 26.9 | Very low | 29.5 | Very low | 202 Ų | 202 | 143.2 Ų | 143.2 | 88% | 0.878 | 78% | 0.776 | S | S | * | * | trans | 67.2 | 137.6 | 166.3 | -81.4 | -179.8 | 173.4 | -176.8 | 0 | 117.6 | ||||
| 456 | G | 24.2 | Very low | 28.9 | Very low | 80 Ų | 80 | 141 Ų | 141 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | cis | 158.7 | 126.9 | -13.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 457 | A | 28.8 | Very low | 28.6 | Very low | 97 Ų | 97 | 140.6 Ų | 140.6 | 80% | 0.802 | 77% | 0.766 | S | S | * | * | trans | -139 | 135.4 | 156.8 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 458 | S | 25.7 | Very low | 28.1 | Very low | 109 Ų | 109 | 144.4 Ų | 144.4 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | cis | 79 | 67.4 | 41.5 | -170.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 459 | E | 30.6 | Very low | 27.8 | Very low | 188 Ų | 188 | 141.3 Ų | 141.3 | 88% | 0.879 | 76% | 0.762 | S | S | * | * | trans | -157.7 | 145.8 | 131.9 | -111.7 | 156.5 | -147.5 | 0 | 0 | 112.4 | ||||
| 460 | T | 26.2 | Very low | 28.3 | Very low | 108 Ų | 108 | 138.9 Ų | 138.9 | 66% | 0.663 | 76% | 0.755 | S | S | * | * | trans | -44.3 | 163.9 | 166.8 | 23.6 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 461 | Y | 27.5 | Very low | 28.2 | Very low | 199 Ų | 199 | 140.6 Ų | 140.6 | 78% | 0.78 | 76% | 0.759 | S | S | * | * | cis | -153.6 | 148.2 | 23.6 | -125.5 | -65.1 | 0 | 0 | 0 | 113.3 | ||||
| 462 | D | 27.2 | Very low | 28 | Very low | 120 Ų | 120 | 140 Ų | 140 | 64% | 0.642 | 76% | 0.76 | S | S | * | * | trans | 65.1 | 139.1 | 147.7 | -99.6 | -18.8 | 0 | 0 | 0 | 128 | ||||
| 463 | Q | 28.6 | Very low | 27.9 | Very low | 141 Ų | 141 | 136.8 Ų | 136.8 | 66% | 0.659 | 76% | 0.756 | S | S | * | * | trans | 71 | 121.3 | 144 | -73.5 | 173.5 | 30.1 | 0 | 0 | 125.2 | ||||
| 464 | Q | 28 | Very low | 27.8 | Very low | 186 Ų | 186 | 131.6 Ų | 131.6 | 87% | 0.869 | 75% | 0.752 | S | S | * | * | trans | 58.3 | 139.6 | 139.9 | -62.9 | 175.4 | -28.4 | 0 | 0 | 119.9 | ||||
| 465 | G | 28 | Very low | 27.7 | Very low | 69 Ų | 69 | 130.1 Ų | 130.1 | 71% | 0.711 | 75% | 0.753 | S | S | * | * | cis | 179.1 | -177.7 | -1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 466 | S | 26.9 | Very low | 27.7 | Very low | 104 Ų | 104 | 126 Ų | 126 | 73% | 0.727 | 75% | 0.75 | S | S | * | * | trans | -34.3 | 153.6 | 165.6 | 46.2 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 467 | E | 26.8 | Very low | 27.9 | Very low | 153 Ų | 153 | 131.3 Ų | 131.3 | 72% | 0.715 | 75% | 0.753 | S | S | * | * | cis | -169.1 | 169.1 | 0.8 | -113.1 | 176.3 | 119.8 | 0 | 0 | 112.7 | ||||
| 468 | Q | 27.4 | Very low | 28 | Very low | 154 Ų | 154 | 135.5 Ų | 135.5 | 72% | 0.72 | 76% | 0.756 | S | S | * | * | trans | 37.5 | 119 | 148.1 | -56.4 | -174.7 | 42.1 | 0 | 0 | 123.2 | ||||
| 469 | T | 24.6 | Very low | 28.3 | Very low | 127 Ų | 127 | 138.4 Ų | 138.4 | 78% | 0.779 | 76% | 0.763 | S | S | * | * | -5.2 | 165 | 128.9 | 32 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 470 | P | 41.5 | Very low | 28.1 | Very low | 99 Ų | 99 | 136.9 Ų | 136.9 | 64% | 0.643 | 76% | 0.761 | S | S | * | * | cis | -141.7 | -175.9 | 6.2 | 41.2 | -22 | 0 | 0 | 0 | 117.9 | ||||
| 471 | Q | 27.5 | Very low | 28.2 | Very low | 173 Ų | 173 | 141.1 Ų | 141.1 | 81% | 0.808 | 77% | 0.77 | S | S | * | * | trans | 71.5 | 148.4 | 157.6 | -73.4 | 167.6 | 44 | 0 | 0 | 117.8 | ||||
| 472 | T | 26.3 | Very low | 28.3 | Very low | 127 Ų | 127 | 139.5 Ų | 139.5 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | cis | -150.4 | 159.8 | 9.5 | -9.2 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 473 | A | 26.8 | Very low | 28.5 | Very low | 85 Ų | 85 | 141.4 Ų | 141.4 | 70% | 0.702 | 78% | 0.784 | S | S | * | * | trans | 84.1 | 124.9 | 146.2 | 0 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 474 | S | 25.6 | Very low | 28.5 | Very low | 108 Ų | 108 | 145.6 Ų | 145.6 | 76% | 0.755 | 79% | 0.794 | S | S | * | * | trans | 78.7 | 122.9 | 138.8 | 52 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 475 | S | 26.1 | Very low | 28.4 | Very low | 103 Ų | 103 | 147.2 Ų | 147.2 | 72% | 0.72 | 80% | 0.799 | S | S | * | * | trans | 71 | 95.1 | 139.8 | 58.7 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 476 | S | 28.2 | Very low | 28.3 | Very low | 115 Ų | 115 | 147.3 Ų | 147.3 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | 62.1 | 104.9 | 124.6 | 64.2 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 477 | E | 28.3 | Very low | 28.4 | Very low | 192 Ų | 192 | 147.3 Ų | 147.3 | 90% | 0.897 | 80% | 0.799 | S | S | * | * | trans | -120.3 | 141.2 | 138.4 | -66.9 | -168.7 | 142.1 | 0 | 0 | 109 | ||||
| 478 | E | 30.7 | Very low | 28.4 | Very low | 185 Ų | 185 | 148.4 Ų | 148.4 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | trans | -164.8 | 124 | 140.3 | -85.4 | -147.4 | 156.3 | 0 | 0 | 108.5 | ||||
| 479 | N | 30.8 | Very low | 28.5 | Very low | 171 Ų | 171 | 146.1 Ų | 146.1 | 91% | 0.914 | 81% | 0.806 | S | S | * | * | trans | 171.7 | 112.4 | 138.5 | -101.5 | -75.8 | 0 | 0 | 0 | 110.2 | ||||
| 480 | L | 27.6 | Very low | 28.6 | Very low | 156 Ų | 156 | 149.3 Ų | 149.3 | 82% | 0.817 | 81% | 0.809 | S | S | * | * | trans | -138.1 | 98.6 | 178 | -172.9 | 152.4 | 0 | 0 | 0 | 110.5 | ||||
| 481 | F | 28.7 | Very low | 27.9 | Very low | 196 Ų | 196 | 152.2 Ų | 152.2 | 86% | 0.86 | 82% | 0.818 | S | S | * | * | trans | -160.9 | 119.8 | 162.3 | -95.8 | -69.9 | 0 | 0 | 0 | 110.9 | ||||
| 482 | N | 29.6 | Very low | 28 | Very low | 166 Ų | 166 | 147.5 Ų | 147.5 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | 178.3 | 139.4 | 125.4 | -97.6 | -52.3 | 0 | 0 | 0 | 111.8 | |||||
| 483 | L | 30 | Very low | 28 | Very low | 159 Ų | 159 | 152.3 Ų | 152.3 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -120.6 | 110.6 | 177.3 | -99.7 | 168.4 | 0 | 0 | 0 | 111.7 | ||||
| 484 | R | 28.3 | Very low | 28 | Very low | 230 Ų | 230 | 158.3 Ų | 158.3 | 87% | 0.868 | 82% | 0.817 | S | S | * | * | trans | 55.7 | 81.2 | 133.9 | -161.7 | 177.9 | -168.1 | 158.5 | 4 | 118 | ||||
| 485 | F | 26.6 | Very low | 28.1 | Very low | 220 Ų | 220 | 159.5 Ų | 159.5 | 97% | 0.965 | 82% | 0.815 | S | S | * | * | trans | -83.2 | 148.4 | 138.4 | -102.4 | -96.3 | 0 | 0 | 0 | 109.4 | ||||
| 486 | G | 26.8 | Very low | 28.3 | Very low | 70 Ų | 70 | 163 Ų | 163 | 72% | 0.722 | 82% | 0.817 | S | S | * | * | trans | 171.5 | 95 | 177.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 487 | S | 27.7 | Very low | 28.3 | Very low | 105 Ų | 105 | 164.7 Ų | 164.7 | 73% | 0.734 | 82% | 0.817 | S | S | * | * | trans | 10.2 | 129.8 | 155.4 | -166.3 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 488 | L | 27.5 | Very low | 28.4 | Very low | 176 Ų | 176 | 164.9 Ų | 164.9 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | trans | -117.2 | 116.5 | 156.6 | -111.1 | 171.2 | 0 | 0 | 0 | 109.4 | ||||
| 489 | T | 28.5 | Very low | 28.2 | Very low | 106 Ų | 106 | 161.3 Ų | 161.3 | 65% | 0.65 | 80% | 0.797 | S | S | * | * | trans | -143.6 | 151.6 | 173.4 | 54.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 490 | K | 27.4 | Very low | 28 | Very low | 193 Ų | 193 | 160.8 Ų | 160.8 | 84% | 0.839 | 79% | 0.793 | S | S | * | * | trans | 67.4 | 149.2 | 174.6 | -66.3 | 176.9 | -178.6 | 176.4 | 0 | 116.1 | ||||
| 491 | L | 27.8 | Very low | 28 | Very low | 160 Ų | 160 | 159.3 Ų | 159.3 | 84% | 0.838 | 79% | 0.794 | S | S | * | * | cis | -167 | 157.6 | -25 | -163.7 | 70.4 | 0 | 0 | 0 | 110.4 | ||||
| 492 | A | 27.9 | Very low | 27.9 | Very low | 75 Ų | 75 | 159.7 Ų | 159.7 | 62% | 0.62 | 79% | 0.79 | S | S | * | * | trans | 92.5 | 134.7 | 142 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 493 | R | 27.3 | Very low | 27.6 | Very low | 227 Ų | 227 | 158.1 Ų | 158.1 | 86% | 0.857 | 78% | 0.782 | S | S | * | * | trans | 75.3 | 143.6 | 143.7 | -85 | 171.9 | 179.7 | 176.3 | 0.2 | 117.8 | ||||
| 494 | R | 27.4 | Very low | 27.6 | Very low | 212 Ų | 212 | 156.6 Ų | 156.6 | 80% | 0.8 | 77% | 0.773 | S | S | * | * | cis | -158.7 | 120.3 | 4.4 | -170.7 | 171.8 | -172.2 | 152 | -0 | 114.7 | ||||
| 495 | N | 26.7 | Very low | 27.4 | Very low | 133 Ų | 133 | 151.1 Ų | 151.1 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | trans | 43.9 | 136.8 | 135 | -151.7 | 19.4 | 0 | 0 | 0 | 124.1 | ||||
| 496 | K | 31.1 | Very low | 27.4 | Very low | 176 Ų | 176 | 148.6 Ų | 148.6 | 77% | 0.765 | 76% | 0.757 | S | S | * | * | trans | 64.7 | 149.6 | 162.9 | -82.2 | 179.9 | 178.8 | -170.7 | 0 | 117.1 | ||||
| 497 | N | 26.7 | Very low | 27.4 | Very low | 150 Ų | 150 | 152.4 Ų | 152.4 | 80% | 0.802 | 76% | 0.761 | S | S | * | * | cis | -142.3 | -172.9 | 31.9 | -141.9 | 17.4 | 0 | 0 | 0 | 114.9 | ||||
| 498 | R | 31.2 | Very low | 27.3 | Very low | 196 Ų | 196 | 152.2 Ų | 152.2 | 74% | 0.74 | 76% | 0.759 | S | S | * | * | trans | -107.1 | 173.8 | -173 | -147.2 | -176.5 | 67.3 | 176.5 | 0 | 112.6 | ||||
| 499 | D | 27.1 | Very low | 27.2 | Very low | 111 Ų | 111 | 154.3 Ų | 154.3 | 59% | 0.594 | 76% | 0.755 | S | S | * | * | trans | 86.5 | 116.5 | 156.1 | -61.4 | -29.7 | 0 | 0 | 0 | 121.9 | ||||
| 500 | L | 25.6 | Very low | 27.2 | Very low | 159 Ų | 159 | 160 Ų | 160 | 83% | 0.832 | 76% | 0.764 | S | S | * | * | 62.9 | 116.9 | 124.7 | -163.7 | 74.2 | 0 | 0 | 0 | 120.6 | |||||
| 501 | C | 28.5 | Very low | 27.1 | Very low | 125 Ų | 125 | 156.4 Ų | 156.4 | 85% | 0.845 | 76% | 0.759 | S | S | * | * | trans | -148 | 125.2 | 133.3 | -160.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 502 | R | 25.8 | Very low | 26.9 | Very low | 204 Ų | 204 | 153.3 Ų | 153.3 | 77% | 0.77 | 75% | 0.75 | S | S | * | * | trans | -121.3 | 140.1 | 175.2 | 165.4 | -175.4 | 173.3 | 179.9 | -1.2 | 107.8 | ||||
| 503 | N | 24.3 | Very low | 26.8 | Very low | 134 Ų | 134 | 158.2 Ų | 158.2 | 72% | 0.717 | 76% | 0.763 | S | S | * | * | trans | -159.1 | 120.4 | 155.5 | -85.8 | -30.9 | 0 | 0 | 0 | 106.5 | ||||
| 504 | I | 28.3 | Very low | 26.7 | Very low | 127 Ų | 127 | 151.8 Ų | 151.8 | 65% | 0.651 | 76% | 0.758 | S | S | * | * | 72.2 | 135.9 | 77.5 | -65.7 | 174.2 | 0 | 0 | 0 | 111.2 | |||||
| 505 | T | 25.6 | Very low | 26.6 | Very low | 114 Ų | 114 | 149.8 Ų | 149.8 | 70% | 0.699 | 76% | 0.762 | S | S | * | * | cis | -107 | -148.8 | 0.8 | -0.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 506 | E | 25.5 | Very low | 26.4 | Very low | 168 Ų | 168 | 149.9 Ų | 149.9 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | cis | -151.9 | -176.5 | -0.5 | -139.7 | 138.2 | -74.6 | 0 | 0 | 112.4 | ||||
| 507 | D | 26.8 | Very low | 26.1 | Very low | 150 Ų | 150 | 147.3 Ų | 147.3 | 80% | 0.802 | 76% | 0.761 | S | S | * | * | trans | -82.4 | 156.5 | -176.7 | -78 | -40.5 | 0 | 0 | 0 | 116.7 | ||||
| 508 | S | 26.2 | Very low | 26.5 | Very low | 101 Ų | 101 | 145.5 Ų | 145.5 | 71% | 0.706 | 76% | 0.758 | S | S | * | * | 174.4 | 132.1 | 110.6 | -86.6 | 0 | 0 | 0 | 0 | 118.2 | |||||
| 509 | R | 26.1 | Very low | 26.3 | Very low | 220 Ų | 220 | 143 Ų | 143 | 83% | 0.83 | 76% | 0.756 | S | S | * | * | trans | 70.7 | 126 | 147 | -66.4 | 177 | -173.7 | -159.6 | -0.6 | 117.5 | ||||
| 510 | R | 27.6 | Very low | 26.2 | Very low | 224 Ų | 224 | 145.3 Ų | 145.3 | 85% | 0.845 | 76% | 0.764 | S | S | * | * | 66.7 | 135.8 | 68.5 | -70 | -175.5 | -172.1 | -176.4 | 2.8 | 111.9 | |||||
| 511 | T | 25.4 | Very low | 26.3 | Very low | 118 Ų | 118 | 140.8 Ų | 140.8 | 72% | 0.724 | 76% | 0.755 | S | S | * | * | cis | -159 | 131.2 | 18.3 | -2.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 512 | S | 24.5 | Very low | 26.2 | Very low | 95 Ų | 95 | 142.8 Ų | 142.8 | 66% | 0.664 | 75% | 0.752 | S | S | * | * | 73.6 | 150.9 | 93.7 | 77.9 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 513 | M | 24.9 | Very low | 26.3 | Very low | 178 Ų | 178 | 139.2 Ų | 139.2 | 88% | 0.877 | 74% | 0.744 | S | S | * | * | trans | 73.7 | 109.8 | -178.4 | -56.2 | 176.9 | 175.1 | 0 | 0 | 113.4 | ||||
| 514 | A | 24.6 | Very low | 26.6 | Very low | 92 Ų | 92 | 141.7 Ų | 141.7 | 76% | 0.76 | 74% | 0.743 | S | S | * | * | cis | 71.6 | 105.9 | 8.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 515 | I | 25.1 | Very low | 26.5 | Very low | 171 Ų | 171 | 141.9 Ų | 141.9 | 88% | 0.877 | 75% | 0.751 | S | S | * | * | trans | -138.8 | 148.8 | 152 | -67.8 | -172 | 0 | 0 | 0 | 107.3 | ||||
| 516 | N | 24.1 | Very low | 26.6 | Very low | 135 Ų | 135 | 139.5 Ų | 139.5 | 72% | 0.722 | 75% | 0.748 | S | S | * | * | trans | -83.4 | 159.2 | -168.4 | -67.8 | -16.2 | 0 | 0 | 0 | 113.4 | ||||
| 517 | T | 24 | Very low | 26.7 | Very low | 122 Ų | 122 | 140.2 Ų | 140.2 | 75% | 0.748 | 75% | 0.752 | S | S | * | * | 59.4 | 151.3 | 61.7 | -14.6 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 518 | P | 35.9 | Very low | 26.8 | Very low | 112 Ų | 112 | 140.4 Ų | 140.4 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | cis | -118.5 | -155.5 | 4.8 | 47.7 | -33.9 | 0 | 0 | 0 | 111.9 | ||||
| 519 | M | 26.1 | Very low | 26.9 | Very low | 142 Ų | 142 | 144.5 Ų | 144.5 | 70% | 0.7 | 76% | 0.761 | S | S | * | * | cis | -145.6 | 172.5 | 2 | -113 | -160.1 | -50.8 | 0 | 0 | 107 | ||||
| 520 | Q | 25.8 | Very low | 27.3 | Very low | 161 Ų | 161 | 143 Ų | 143 | 75% | 0.752 | 76% | 0.763 | S | S | * | * | cis | -115.4 | -158.8 | -0.4 | -120.5 | 113.5 | -26.8 | 0 | 0 | 108.3 | ||||
| 521 | G | 26.3 | Very low | 27.8 | Very low | 63 Ų | 63 | 137.4 Ų | 137.4 | 65% | 0.649 | 76% | 0.756 | S | S | * | * | cis | 107.9 | 122.5 | 2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 522 | E | 27.9 | Very low | 27.9 | Very low | 168 Ų | 168 | 139.4 Ų | 139.4 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | cis | -148.7 | 148.2 | 0.2 | -91 | 176.2 | 117.7 | 0 | 0 | 110.1 | ||||
| 523 | E | 27.8 | Very low | 28.3 | Very low | 129 Ų | 129 | 144.1 Ų | 144.1 | 60% | 0.603 | 77% | 0.774 | S | S | * | * | 47.9 | 147.8 | 128.6 | -57.3 | -156.2 | 135.8 | 0 | 0 | 122.5 | |||||
| 524 | R | 29.3 | Very low | 28.4 | Very low | 185 Ų | 185 | 144.4 Ų | 144.4 | 70% | 0.698 | 77% | 0.773 | S | S | * | * | cis | -161.5 | 159 | 4.2 | -125.7 | 175.1 | -152.6 | 159.2 | 19.3 | 111.9 | ||||
| 525 | T | 26.5 | Very low | 28.5 | Very low | 132 Ų | 132 | 144.8 Ų | 144.8 | 81% | 0.81 | 77% | 0.77 | S | S | * | * | trans | 56.7 | 134.2 | 152.3 | 49.8 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 526 | G | 28.2 | Very low | 28.5 | Very low | 63 Ų | 63 | 148.6 Ų | 148.6 | 65% | 0.649 | 77% | 0.773 | S | S | * | * | cis | 159.7 | 167 | -3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 527 | E | 28.2 | Very low | 28.7 | Very low | 183 Ų | 183 | 149.4 Ų | 149.4 | 86% | 0.855 | 77% | 0.773 | S | S | * | * | trans | 60.4 | 104.1 | 171 | -66.4 | 157.4 | -153 | 0 | 0 | 114.5 | ||||
| 528 | D | 27.3 | Very low | 29.1 | Very low | 155 Ų | 155 | 151.7 Ų | 151.7 | 83% | 0.829 | 77% | 0.772 | S | S | * | * | 85.9 | 156.4 | 70.8 | -78.5 | -47.5 | 0 | 0 | 0 | 114 | |||||
| 529 | E | 28.9 | Very low | 28.6 | Very low | 186 Ų | 186 | 154.2 Ų | 154.2 | 87% | 0.869 | 77% | 0.772 | S | S | * | * | trans | 82.9 | 94.4 | -178.7 | -54.4 | -166.1 | 167.4 | 0 | 0 | 118.6 | ||||
| 530 | E | 35.8 | Very low | 28.9 | Very low | 189 Ų | 189 | 157.2 Ų | 157.2 | 88% | 0.883 | 78% | 0.784 | S | S | * | * | trans | -72.9 | 154 | 134.8 | -67.6 | -174.5 | 140.5 | 0 | 0 | 108.7 | ||||
| 531 | P | 37.6 | Very low | 29.1 | Very low | 107 Ų | 107 | 155.7 Ų | 155.7 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | -146.9 | 145.6 | 107 | 36.8 | -22.2 | 0 | 0 | 0 | 117.1 | |||||
| 532 | D | 26.3 | Very low | 29.4 | Very low | 159 Ų | 159 | 160.9 Ų | 160.9 | 85% | 0.85 | 79% | 0.79 | S | S | * | * | trans | 50.5 | 132.9 | 139.6 | -61.8 | -31.6 | 0 | 0 | 0 | 123.2 | ||||
| 533 | E | 34.2 | Very low | 29.8 | Very low | 194 Ų | 194 | 159.5 Ų | 159.5 | 91% | 0.907 | 79% | 0.786 | S | S | * | * | trans | -72.6 | 132.3 | 155.8 | -57.5 | -178.8 | 115.6 | 0 | 0 | 111.2 | ||||
| 534 | E | 27.1 | Very low | 30.1 | Very low | 184 Ų | 184 | 156.5 Ų | 156.5 | 86% | 0.86 | 78% | 0.78 | S | S | * | * | -164.7 | 151.2 | 122.3 | -123.8 | -163.5 | 151.5 | 0 | 0 | 115.1 | |||||
| 535 | S | 25.3 | Very low | 30.8 | Very low | 100 Ų | 100 | 154.8 Ų | 154.8 | 70% | 0.699 | 78% | 0.784 | S | S | * | * | trans | 68.9 | 105.9 | 157.4 | 76.8 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 536 | R | 25.3 | Very low | 31.4 | Very low | 252 Ų | 252 | 153.3 Ų | 153.3 | 95% | 0.951 | 78% | 0.775 | S | S | * | * | -163.9 | 112 | 124.2 | -106.5 | 163.7 | -160.9 | -160.6 | 4.7 | 111.9 | |||||
| 537 | E | 29.5 | Very low | 31.9 | Very low | 152 Ų | 152 | 154.8 Ų | 154.8 | 71% | 0.71 | 77% | 0.768 | S | S | * | * | trans | -71.4 | 159 | 163.6 | -78.1 | -166.4 | 123.4 | 0 | 0 | 111.6 | ||||
| 538 | K | 31.4 | Very low | 32.9 | Very low | 169 Ų | 169 | 151 Ų | 151 | 74% | 0.735 | 75% | 0.753 | S | S | * | * | trans | 62.3 | 92 | 153.3 | -70.1 | 154.4 | -172.6 | 140.1 | 0 | 117.2 | ||||
| 539 | K | 25 | Very low | 33.5 | Very low | 165 Ų | 165 | 147.7 Ų | 147.7 | 72% | 0.717 | 74% | 0.742 | S | S | * | * | -148.8 | 107.2 | 127 | -129.9 | 180 | 176.5 | -162.2 | 0 | 110.7 | E541 | K539-E541 HydrophobicContact CB-CG 4.32Å; K539-E541 HydrophobicContact CD-CG 3.82Å; K539-E541 WeakPolarHBondContact CE-OE1 3.1Å; K539-E541 HydrophobicContact CG-CG 3.92Å; K539-E541 IonicContact NZ-OE1 2.69Å; K539-E541 PolarHBondContact NZ-OE1 3.47Å; K539-E541 PolarHBondContact O-N 3.22Å | |||
| 540 | E | 33.4 | Very low | 34 | Very low | 206 Ų | 206 | 145.9 Ų | 145.9 | 96% | 0.963 | 73% | 0.733 | S | S | * | * | trans | -77.9 | 105.9 | 157.9 | -71.8 | 179.2 | 126.2 | 0 | 0 | 106.7 | ||||
| 541 | E | 30.5 | Very low | 34.3 | Very low | 129 Ų | 129 | 145 Ų | 145 | 60% | 0.603 | 72% | 0.723 | S | S | * | * | trans | -108 | 136.4 | 169.1 | -68.7 | -166.4 | 132.1 | 0 | 0 | 109.6 | K539 I543 | K539-E541 HydrophobicContact CB-CG 4.32Å; K539-E541 HydrophobicContact CD-CG 3.82Å; K539-E541 WeakPolarHBondContact CE-OE1 3.1Å; K539-E541 HydrophobicContact CG-CG 3.92Å; K539-E541 IonicContact NZ-OE1 2.69Å; K539-E541 PolarHBondContact NZ-OE1 3.47Å; K539-E541 PolarHBondContact O-N 3.22Å; E541-I543 PolarHBondContact O-N 3.28Å | ||
| 542 | N | 32.5 | Very low | 34.7 | Very low | 172 Ų | 172 | 142.2 Ų | 142.2 | 92% | 0.92 | 71% | 0.709 | S | S | * | * | trans | -63.5 | 104.5 | 179.7 | -70.8 | -41 | 0 | 0 | 0 | 109.9 | S544 | N542-S544 PolarHBondContact O-N 3.04Š| ||
| 543 | I | 34.9 | Very low | 35.5 | Very low | 138 Ų | 138 | 137.2 Ų | 137.2 | 71% | 0.708 | 69% | 0.69 | S | S | * | * | trans | -66.5 | 116 | 170.3 | -58.8 | 178.8 | 0 | 0 | 0 | 107.7 | E541 | E541-I543 PolarHBondContact O-N 3.28Š| ||
| 544 | S | 35.5 | Very low | 35.8 | Very low | 67 Ų | 67 | 134.9 Ų | 134.9 | 47% | 0.469 | 68% | 0.679 | S | S | . | * | trans | -65.2 | 140.7 | 175.5 | 47.9 | 0 | 0 | 0 | 0 | 111 | N542 T546 N547 | N542-S544 PolarHBondContact O-N 3.04Å; S544-T546 PolarHBondContact O-N 2.91Å; S544-T546 PolarHBondContact OG-OG1 2.83Å; S544-N547 PolarHBondContact O-N 3.23Å; S544-N547 VanDerWaalsContact O-N 3.16Å | ||
| 545 | L | 42.6 | Very low | 36.5 | Very low | 149 Ų | 149 | 134.5 Ų | 134.5 | 78% | 0.78 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -50.4 | -28.4 | -177.7 | -81.9 | 156.8 | 0 | 0 | 0 | 114 | N547 L548 | L545-N547 PolarHBondContact O-N 3Å; L545-L548 PolarHBondContact O-N 3.33Å |
| 546 | T | 40.9 | Very low | 37.1 | Very low | 101 Ų | 101 | 133.9 Ų | 133.9 | 62% | 0.62 | 67% | 0.665 | S | S | * | * | G | 310 helix | trans | -57.9 | -27.9 | -179.6 | 49.9 | 0 | 0 | 0 | 0 | 114.7 | S544 | S544-T546 PolarHBondContact O-N 2.91Å; S544-T546 PolarHBondContact OG-OG1 2.83Å |
| 547 | N | 38.1 | Very low | 37.9 | Very low | 93 Ų | 93 | 130.3 Ų | 130.3 | 50% | 0.497 | 66% | 0.657 | S | S | . | * | G | 310 helix | trans | -95 | -9.6 | -172.3 | -66.1 | 13 | 0 | 0 | 0 | 113.4 | S544 L545 Y551 | S544-N547 PolarHBondContact O-N 3.23Å; S544-N547 VanDerWaalsContact O-N 3.16Å; L545-N547 PolarHBondContact O-N 3Å; N547-Y551 PolarHBondContact O-N 2.8Å |
| 548 | L | 47.9 | Very low | 38.6 | Very low | 104 Ų | 104 | 130 Ų | 130 | 55% | 0.545 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -72.9 | -34.3 | -173.4 | -156.6 | 76.7 | 0 | 0 | 0 | 112.8 | L545 Y551 A552 | L545-L548 PolarHBondContact O-N 3.33Å; L548-Y551 PolarHBondContact O-N 2.96Å; L548-A552 PolarHBondContact O-N 3.2Å |
| 549 | S | 41.5 | Very low | 38.9 | Very low | 85 Ų | 85 | 127.9 Ų | 127.9 | 59% | 0.594 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -62.6 | -41.8 | 178.8 | 55 | 0 | 0 | 0 | 0 | 112.4 | A552 A553 | S549-A552 PolarHBondContact O-N 3.47Å; S549-A553 WeakPolarHBondContact O-CB 3.06Å; S549-A553 PolarHBondContact O-N 3Å; S549-A553 VanDerWaalsContact O-N 3.1Å |
| 550 | Q | 39.7 | Very low | 39.4 | Very low | 148 Ų | 148 | 124.1 Ų | 124.1 | 69% | 0.692 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -68.4 | -40.9 | -179.7 | -150.6 | 166.6 | 8.4 | 0 | 0 | 111.2 | A552 A553 E554 | Q550-A552 PolarHBondContact O-N 3.49Å; Q550-A553 PolarHBondContact O-N 3.23Å; Q550-E554 PolarHBondContact O-N 3.01Å |
| 551 | Y | 41.2 | Very low | 39.4 | Very low | 171 Ų | 171 | 123.1 Ų | 123.1 | 67% | 0.671 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -66.9 | -33.7 | 176.5 | -144.7 | -92.9 | 0 | 0 | 0 | 112.9 | N547 L548 R555 | N547-Y551 PolarHBondContact O-N 2.8Å; L548-Y551 PolarHBondContact O-N 2.96Å; Y551-R555 PolarHBondContact O-N 3.29Å |
| 552 | A | 46.6 | Very low | 39.5 | Very low | 49 Ų | 49 | 123 Ų | 123 | 41% | 0.405 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -69.3 | -37.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L548 S549 Q550 E554 R555 S556 | L548-A552 PolarHBondContact O-N 3.2Å; S549-A552 PolarHBondContact O-N 3.47Å; Q550-A552 PolarHBondContact O-N 3.49Å; A552-E554 PolarHBondContact O-N 2.81Å; A552-R555 PolarHBondContact O-N 2.87Å; A552-S556 PolarHBondContact O-N 3.49Å; A552-S556 VanDerWaalsContact O-N 3.13Å |
| 553 | A | 42 | Very low | 39.7 | Very low | 53 Ų | 53 | 120.2 Ų | 120.2 | 44% | 0.438 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -72 | -22.3 | -178 | 0 | 0 | 0 | 0 | 0 | 114.7 | S549 Q550 S556 | S549-A553 WeakPolarHBondContact O-CB 3.06Å; S549-A553 PolarHBondContact O-N 3Å; S549-A553 VanDerWaalsContact O-N 3.1Å; Q550-A553 PolarHBondContact O-N 3.23Å; A553-S556 PolarHBondContact O-OG 2.55Å |
| 554 | E | 41 | Very low | 39.4 | Very low | 145 Ų | 145 | 120.3 Ų | 120.3 | 68% | 0.678 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -78.4 | -44.1 | 167 | -80.8 | -171.7 | 138.5 | 0 | 0 | 111.8 | Q550 A552 S556 K557 | Q550-E554 PolarHBondContact O-N 3.01Å; A552-E554 PolarHBondContact O-N 2.81Å; E554-S556 VanDerWaalsContact C-N 3.33Å; E554-S556 PolarHBondContact O-N 2.9Å; E554-K557 PolarHBondContact O-N 3.28Å |
| 555 | R | 40.8 | Very low | 39.2 | Very low | 177 Ų | 177 | 126 Ų | 126 | 67% | 0.668 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -69 | -28.7 | -173.5 | -154.2 | 173.5 | -167 | 173 | 4.7 | 113.6 | Y551 A552 K557 L558 | Y551-R555 PolarHBondContact O-N 3.29Å; A552-R555 PolarHBondContact O-N 2.87Å; R555-K557 PolarHBondContact O-N 3.04Å; R555-L558 PolarHBondContact O-N 3.03Å |
| 556 | S | 39.5 | Very low | 38.6 | Very low | 87 Ų | 87 | 123 Ų | 123 | 61% | 0.608 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | -24.4 | 175.2 | 62.6 | 0 | 0 | 0 | 0 | 113.6 | A552 A553 E554 L558 | A552-S556 PolarHBondContact O-N 3.49Å; A552-S556 VanDerWaalsContact O-N 3.13Å; A553-S556 PolarHBondContact O-OG 2.55Å; E554-S556 VanDerWaalsContact C-N 3.33Å; E554-S556 PolarHBondContact O-N 2.9Å; S556-L558 VanDerWaalsContact C-N 3.32Å; S556-L558 PolarHBondContact O-N 2.97Å |
| 557 | K | 41.7 | Very low | 38 | Very low | 177 Ų | 177 | 127.9 Ų | 127.9 | 77% | 0.77 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -15 | 178.4 | -62.2 | 177 | -175.7 | 172.7 | 0 | 113.8 | E554 R555 | E554-K557 PolarHBondContact O-N 3.28Å; R555-K557 PolarHBondContact O-N 3.04Å |
| 558 | L | 43.4 | Very low | 37.7 | Very low | 146 Ų | 146 | 130.6 Ų | 130.6 | 76% | 0.764 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | -23.7 | -173.5 | -153.6 | 72.2 | 0 | 0 | 0 | 113.6 | R555 S556 | R555-L558 PolarHBondContact O-N 3.03Å; S556-L558 VanDerWaalsContact C-N 3.32Å; S556-L558 PolarHBondContact O-N 2.97Å |
| 559 | N | 38 | Very low | 37 | Very low | 123 Ų | 123 | 137.2 Ų | 137.2 | 66% | 0.658 | 73% | 0.725 | S | S | * | * | trans | -111.4 | 85.3 | -175.6 | -77.3 | -4.7 | 0 | 0 | 0 | 111.9 | F561 | N559-F561 VanDerWaalsContact C-N 3.27Å; N559-F561 PolarHBondContact O-N 3.42Å | ||
| 560 | G | 36.6 | Very low | 36.5 | Very low | 87 Ų | 87 | 142.5 Ų | 142.5 | 90% | 0.897 | 74% | 0.74 | S | S | * | * | trans | -72.5 | 69.9 | 174 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 561 | F | 32 | Very low | 36.2 | Very low | 184 Ų | 184 | 140.6 Ų | 140.6 | 81% | 0.807 | 74% | 0.743 | S | S | * | * | trans | -143.4 | 100.9 | 170.6 | -157 | -92.2 | 0 | 0 | 0 | 111.9 | N559 | N559-F561 VanDerWaalsContact C-N 3.27Å; N559-F561 PolarHBondContact O-N 3.42Å | ||
| 562 | T | 33.8 | Very low | 35.7 | Very low | 127 Ų | 127 | 139.2 Ų | 139.2 | 78% | 0.779 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 123 | 176.7 | 48.1 | 0 | 0 | 0 | 0 | 111.1 | ||
| 563 | P | 35.2 | Very low | 35 | Very low | 113 Ų | 113 | 144.4 Ų | 144.4 | 73% | 0.734 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 138.7 | 168.2 | -18.3 | 32.1 | 0 | 0 | 0 | 110.8 | Q565 | P563-Q565 PolarHBondContact O-N 3.17Š|
| 564 | T | 30 | Very low | 34.7 | Very low | 141 Ų | 141 | 149.2 Ų | 149.2 | 87% | 0.865 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 125.4 | 173.7 | -39.4 | 0 | 0 | 0 | 0 | 109.7 | ||
| 565 | Q | 30.5 | Very low | 34.7 | Very low | 185 Ų | 185 | 147.9 Ų | 147.9 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 151.2 | 177.3 | -78.2 | -175.6 | -24.8 | 0 | 0 | 112 | P563 | P563-Q565 PolarHBondContact O-N 3.17Š|
| 566 | A | 30.6 | Very low | 34.5 | Very low | 87 Ų | 87 | 147.2 Ų | 147.2 | 72% | 0.719 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 138 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | D568 | A566-D568 PolarHBondContact O-N 3.02Š|
| 567 | K | 27.8 | Very low | 34.4 | Very low | 203 Ų | 203 | 151.5 Ų | 151.5 | 88% | 0.883 | 83% | 0.834 | S | S | * | * | trans | -88.5 | 85.7 | 179.7 | -173.1 | 175.9 | -179.7 | 173.8 | 0 | 110.2 | ||||
| 568 | D | 32.6 | Very low | 34.1 | Very low | 150 Ų | 150 | 150.3 Ų | 150.3 | 80% | 0.802 | 84% | 0.837 | S | S | * | * | trans | -59.4 | 148.8 | 164.9 | -77 | -47.5 | 0 | 0 | 0 | 110.9 | A566 | A566-D568 PolarHBondContact O-N 3.02Š| ||
| 569 | R | 31.5 | Very low | 33.6 | Very low | 244 Ų | 244 | 150.5 Ų | 150.5 | 92% | 0.921 | 84% | 0.841 | S | S | * | * | trans | -95.5 | 100.3 | -179.7 | -71.1 | -179.5 | 176.5 | 176.9 | -1.2 | 109.5 | ||||
| 570 | E | 31.1 | Very low | 33.3 | Very low | 196 Ų | 196 | 152 Ų | 152 | 92% | 0.916 | 85% | 0.851 | S | S | * | * | trans | -72.6 | 134.7 | 163.2 | -163.8 | 160.4 | -136.3 | 0 | 0 | 109.6 | ||||
| 571 | S | 33.8 | Very low | 33.1 | Very low | 108 Ų | 108 | 155.8 Ų | 155.8 | 76% | 0.755 | 85% | 0.849 | S | S | * | * | trans | -100.4 | 129.7 | -173.9 | 54 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 572 | D | 32 | Very low | 33.2 | Very low | 141 Ų | 141 | 154.1 Ų | 154.1 | 75% | 0.754 | 85% | 0.851 | S | S | * | * | trans | -157.6 | 164.1 | 157.1 | -150.1 | 4.5 | 0 | 0 | 0 | 114.9 | ||||
| 573 | Q | 30.6 | Very low | 33.2 | Very low | 158 Ų | 158 | 155.9 Ų | 155.9 | 74% | 0.738 | 86% | 0.856 | S | S | * | * | trans | 70.7 | 93.6 | 159.5 | -76.1 | 159.8 | 54.4 | 0 | 0 | 120.1 | ||||
| 574 | I | 37.2 | Very low | 33 | Very low | 155 Ų | 155 | 158.9 Ų | 158.9 | 80% | 0.795 | 87% | 0.865 | S | S | * | * | trans | -60.1 | 139.6 | 144.1 | -59.2 | 159.5 | 0 | 0 | 0 | 110 | ||||
| 575 | P | 40.6 | Very low | 33.2 | Very low | 116 Ų | 116 | 160.3 Ų | 160.3 | 75% | 0.753 | 87% | 0.865 | S | S | * | * | trans | -111 | 140.8 | 152 | 35 | -27.4 | 0 | 0 | 0 | 111.9 | ||||
| 576 | N | 35 | Very low | 33.5 | Very low | 163 Ų | 163 | 158.3 Ų | 158.3 | 87% | 0.872 | 87% | 0.865 | S | S | * | * | trans | -80.7 | 129.6 | 171.7 | -63.4 | -55.2 | 0 | 0 | 0 | 111.1 | ||||
| 577 | A | 38.9 | Very low | 33.7 | Very low | 178 Ų | 178 | 164.7 Ų | 164.7 | 100% | 1.471 | 88% | 0.878 | S | S | * | * | trans | -164 | 0 | 152.6 | 0 | 0 | 0 | 0 | 0 | 109.9 |
Retrieved 577 of 577 residues in 92.6 ms
(Link to these results)