| 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 | 37 | Very low | 51.4 | Low | 249 Ų | 249 | 141.6 Ų | 141.6 | 100% | 1.227 | 84% | 0.842 | S | S | * | * | 0 | 117.7 | 0 | -86.5 | 162.4 | 153.5 | 0 | 0 | 106.6 | |||||
| 2 | T | 40.1 | Very low | 52.2 | Low | 128 Ų | 128 | 145.9 Ų | 145.9 | 79% | 0.785 | 84% | 0.843 | S | S | * | * | trans | -73.9 | 143 | -174.8 | 31.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 3 | D | 45.3 | Very low | 52.7 | Low | 123 Ų | 123 | 149.3 Ų | 149.3 | 66% | 0.658 | 84% | 0.842 | S | S | * | * | trans | 38.3 | 129.4 | 146.1 | -51 | -63 | 0 | 0 | 0 | 121.2 | ||||
| 4 | D | 48.9 | Very low | 53.3 | Low | 155 Ų | 155 | 146 Ų | 146 | 83% | 0.829 | 83% | 0.833 | S | S | * | * | trans | -160.2 | 90.3 | 134.6 | -88.2 | -40.4 | 0 | 0 | 0 | 110 | K6 | D4-K6 PolarHBondContact O-N 3.1Š| ||
| 5 | N | 51.6 | Low | 53.1 | Low | 141 Ų | 141 | 142.1 Ų | 142.1 | 75% | 0.754 | 82% | 0.818 | S | S | * | * | trans | -65.1 | 108.4 | 166.8 | -73.1 | -60.7 | 0 | 0 | 0 | 109.5 | S7 | N5-S7 VanDerWaalsContact C-N 3.26Å; N5-S7 PolarHBondContact O-N 2.84Å | ||
| 6 | K | 52.7 | Low | 53.2 | Low | 209 Ų | 209 | 146.6 Ų | 146.6 | 91% | 0.909 | 82% | 0.82 | S | S | * | * | trans | -76.1 | 78.3 | 167.7 | -96 | 129.6 | 177.3 | 159.9 | 0 | 110.3 | D4 | D4-K6 PolarHBondContact O-N 3.1Š| ||
| 7 | S | 59.3 | Low | 53.3 | Low | 112 Ų | 112 | 147.2 Ų | 147.2 | 78% | 0.783 | 82% | 0.821 | S | S | * | * | trans | -96.2 | 113.1 | 160 | 54.7 | 0 | 0 | 0 | 0 | 108.9 | N5 | N5-S7 VanDerWaalsContact C-N 3.26Å; N5-S7 PolarHBondContact O-N 2.84Å | ||
| 8 | G | 58.2 | Low | 53.3 | Low | 82 Ų | 82 | 147 Ų | 147 | 85% | 0.845 | 82% | 0.818 | S | S | * | * | trans | 153.1 | 69.7 | 169.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 9 | S | 55.2 | Low | 53.1 | Low | 119 Ų | 119 | 148.5 Ų | 148.5 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | trans | -151.2 | 35.9 | 164 | -179.8 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 10 | L | 55 | Low | 52.9 | Low | 164 Ų | 164 | 146.7 Ų | 146.7 | 86% | 0.859 | 82% | 0.821 | S | S | * | * | trans | -129.8 | 40.9 | 175.6 | -86.2 | 158.7 | 0 | 0 | 0 | 111.1 | F12 | L10-F12 PolarHBondContact O-N 2.88Š| ||
| 11 | G | 62.4 | Low | 52.5 | Low | 76 Ų | 76 | 147.4 Ų | 147.4 | 78% | 0.784 | 82% | 0.823 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | 22.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 12 | F | 60.8 | Low | 53.2 | Low | 193 Ų | 193 | 140.3 Ų | 140.3 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.1 | -11.9 | 178.1 | -167.3 | -100.9 | 0 | 0 | 0 | 113.6 | L10 | L10-F12 PolarHBondContact O-N 2.88Š|
| 13 | F | 59.1 | Low | 53.5 | Low | 190 Ų | 190 | 139.5 Ų | 139.5 | 83% | 0.833 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -104.9 | -13.4 | -177.8 | -135.5 | -92.5 | 0 | 0 | 0 | 114.1 | ||
| 14 | S | 60 | Low | 53.4 | Low | 103 Ų | 103 | 138.6 Ų | 138.6 | 72% | 0.72 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -92 | 7.3 | -174.4 | -56.6 | 0 | 0 | 0 | 0 | 115.1 | ||
| 15 | S | 51.3 | Low | 53.2 | Low | 87 Ų | 87 | 138 Ų | 138 | 61% | 0.608 | 80% | 0.798 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.8 | 10.7 | -174.9 | 66.7 | 0 | 0 | 0 | 0 | 114.9 | ||
| 16 | Y | 54.1 | Low | 52.7 | Low | 215 Ų | 215 | 136.6 Ų | 136.6 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118 | 13.2 | -174.6 | -80.6 | -80.8 | 0 | 0 | 0 | 114.8 | ||
| 17 | D | 55.7 | Low | 52.5 | Low | 157 Ų | 157 | 133.7 Ų | 133.7 | 84% | 0.84 | 79% | 0.793 | S | S | * | * | trans | -114.7 | 16.9 | -177.9 | -145.2 | 81 | 0 | 0 | 0 | 114 | ||||
| 18 | D | 52.8 | Low | 51.5 | Low | 143 Ų | 143 | 137.8 Ų | 137.8 | 77% | 0.765 | 80% | 0.8 | S | S | * | * | trans | -109.6 | 55.9 | 178 | -168 | 39 | 0 | 0 | 0 | 112.7 | ||||
| 19 | L | 49.3 | Very low | 51.2 | Low | 175 Ų | 175 | 143.1 Ų | 143.1 | 92% | 0.916 | 80% | 0.803 | S | S | * | * | trans | -128.2 | 70.8 | 160.1 | -67.5 | 178.4 | 0 | 0 | 0 | 109 | D21 | L19-D21 PolarHBondContact O-N 3.35Š| ||
| 20 | S | 49.2 | Very low | 50.2 | Low | 112 Ų | 112 | 141 Ų | 141 | 78% | 0.783 | 80% | 0.799 | S | S | * | * | trans | -74.7 | 101.6 | 159.6 | -172.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 21 | D | 45.4 | Very low | 49.7 | Very low | 163 Ų | 163 | 139.8 Ų | 139.8 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | trans | -95.2 | 134.3 | 156.9 | -171.1 | 30.5 | 0 | 0 | 0 | 109 | L19 | L19-D21 PolarHBondContact O-N 3.35Š| ||
| 22 | S | 50.9 | Low | 48.6 | Very low | 99 Ų | 99 | 141 Ų | 141 | 69% | 0.692 | 79% | 0.79 | S | S | * | * | trans | -112 | 125 | -158.2 | -179.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 23 | S | 47.1 | Very low | 47.5 | Very low | 111 Ų | 111 | 142 Ų | 142 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | trans | -166.3 | 103.2 | 158.4 | -165.2 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 24 | S | 43 | Very low | 46.7 | Very low | 105 Ų | 105 | 142.5 Ų | 142.5 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | 50.3 | 124.2 | 63.1 | -154.6 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 25 | D | 44 | Very low | 45.4 | Very low | 143 Ų | 143 | 146.8 Ų | 146.8 | 77% | 0.765 | 80% | 0.796 | S | S | * | * | cis | -171.5 | 160.1 | 0.4 | 178.7 | 94.6 | 0 | 0 | 0 | 104.5 | ||||
| 26 | S | 40.7 | Very low | 44.6 | Very low | 110 Ų | 110 | 151.8 Ų | 151.8 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | trans | 138.3 | 112.2 | 143.2 | -158.7 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 27 | D | 48.8 | Very low | 43.7 | Very low | 148 Ų | 148 | 146.5 Ų | 146.5 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | trans | -65.1 | 153.8 | 170.6 | -61.2 | -80.4 | 0 | 0 | 0 | 113.9 | ||||
| 28 | E | 38.9 | Very low | 42.6 | Very low | 199 Ų | 199 | 142.3 Ų | 142.3 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | trans | -158.7 | 119.4 | 135.9 | -120.9 | -168.7 | 170.6 | 0 | 0 | 112.2 | ||||
| 29 | E | 51.2 | Low | 41.7 | Very low | 194 Ų | 194 | 142.3 Ų | 142.3 | 91% | 0.907 | 81% | 0.807 | S | S | * | * | trans | -72.8 | 145.4 | 164.8 | -79.5 | -88.9 | 138.7 | 0 | 0 | 110.7 | ||||
| 30 | G | 34.6 | Very low | 41 | Very low | 73 Ų | 73 | 142.9 Ų | 142.9 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | trans | -173.8 | 81.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 31 | D | 45.2 | Very low | 40.3 | Very low | 140 Ų | 140 | 142.4 Ų | 142.4 | 75% | 0.749 | 81% | 0.808 | S | S | * | * | trans | -60.7 | 128.2 | 162.1 | 173.3 | 38.3 | 0 | 0 | 0 | 111.6 | ||||
| 32 | S | 37.4 | Very low | 39.7 | Very low | 101 Ų | 101 | 144.1 Ų | 144.1 | 71% | 0.706 | 81% | 0.811 | S | S | * | * | trans | -167.8 | 103.2 | 147.2 | 43.4 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 33 | R | 39.5 | Very low | 38.8 | Very low | 214 Ų | 214 | 142.5 Ų | 142.5 | 81% | 0.808 | 81% | 0.81 | S | S | * | * | 48.6 | 123.9 | 127.1 | -55.5 | 177.6 | -151 | 173.6 | 8.3 | 121.3 | |||||
| 34 | K | 41.4 | Very low | 38.1 | Very low | 200 Ų | 200 | 143.1 Ų | 143.1 | 87% | 0.87 | 81% | 0.814 | S | S | * | * | trans | 55.1 | 119 | 134.7 | -77.4 | 179.7 | 172.9 | 173.2 | 0 | 118.9 | ||||
| 35 | K | 33.9 | Very low | 37.8 | Very low | 193 Ų | 193 | 141.9 Ų | 141.9 | 84% | 0.839 | 82% | 0.818 | S | S | * | * | -178.6 | 134.4 | 104.5 | -105.3 | -175.4 | -178.5 | 174.5 | 0 | 114.6 | |||||
| 36 | K | 32.9 | Very low | 37.4 | Very low | 193 Ų | 193 | 139.5 Ų | 139.5 | 84% | 0.839 | 82% | 0.817 | S | S | * | * | trans | 61.9 | 116.9 | 141.1 | -77.3 | -164.1 | 172.6 | -170 | 0 | 122 | ||||
| 37 | A | 36 | Very low | 37.3 | Very low | 103 Ų | 103 | 142.6 Ų | 142.6 | 85% | 0.851 | 82% | 0.82 | S | S | * | * | trans | -31.9 | 149.4 | 145.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 38 | G | 32.9 | Very low | 37.1 | Very low | 69 Ų | 69 | 141.5 Ų | 141.5 | 71% | 0.711 | 82% | 0.824 | S | S | * | * | trans | 124.3 | 118.7 | 138.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 39 | T | 32.8 | Very low | 37.2 | Very low | 143 Ų | 143 | 137.9 Ų | 137.9 | 88% | 0.877 | 82% | 0.815 | S | S | * | * | 147.4 | 113.1 | 117.4 | -49 | 0 | 0 | 0 | 0 | 110 | |||||
| 40 | E | 35.2 | Very low | 37 | Very low | 187 Ų | 187 | 133.3 Ų | 133.3 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | trans | -51.1 | 135.9 | 164.3 | -54.8 | -88.1 | 154.3 | 0 | 0 | 111 | ||||
| 41 | A | 33.4 | Very low | 37.7 | Very low | 103 Ų | 103 | 138.6 Ų | 138.6 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | trans | -159.2 | 110.8 | 153.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 42 | E | 33.7 | Very low | 38 | Very low | 199 Ų | 199 | 143 Ų | 143 | 93% | 0.93 | 82% | 0.819 | S | S | * | * | trans | -62.5 | 145.8 | 169.7 | -165.6 | 177.2 | 156 | 0 | 0 | 111.9 | ||||
| 43 | G | 32.9 | Very low | 38.8 | Very low | 65 Ų | 65 | 143.4 Ų | 143.4 | 67% | 0.67 | 82% | 0.818 | S | S | * | * | trans | 68.5 | 113.4 | 145.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 44 | S | 31.1 | Very low | 39.3 | Very low | 124 Ų | 124 | 140.6 Ų | 140.6 | 87% | 0.867 | 82% | 0.819 | S | S | * | * | 173.4 | 139.3 | 120 | 40.7 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 45 | G | 37.8 | Very low | 39.8 | Very low | 79 Ų | 79 | 135 Ų | 135 | 81% | 0.814 | 82% | 0.818 | S | S | * | * | trans | -62.6 | 147.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 46 | A | 35.8 | Very low | 40.9 | Very low | 92 Ų | 92 | 129.9 Ų | 129.9 | 76% | 0.76 | 82% | 0.819 | S | S | * | * | trans | -130 | 100.9 | 160.2 | 0 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 47 | Q | 37.9 | Very low | 42.5 | Very low | 176 Ų | 176 | 124.1 Ų | 124.1 | 82% | 0.822 | 81% | 0.808 | S | S | * | * | 48.4 | 101.8 | 98.2 | -83.2 | -175.5 | -55.3 | 0 | 0 | 112 | T49 | Q47-T49 VanDerWaalsContact C-N 3.32Å; Q47-T49 PolarHBondContact O-N 3.44Å | |||
| 48 | S | 45 | Very low | 44.6 | Very low | 125 Ų | 125 | 123.7 Ų | 123.7 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -52.7 | 89.2 | 163.5 | 42.1 | 0 | 0 | 0 | 0 | 111.1 | A50 | S48-A50 PolarHBondContact O-N 3.35Š| ||
| 49 | T | 40.7 | Very low | 46.9 | Very low | 122 Ų | 122 | 128.1 Ų | 128.1 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | trans | -87.9 | 89.3 | 159.8 | 57 | 0 | 0 | 0 | 0 | 108 | Q47 K51 | Q47-T49 VanDerWaalsContact C-N 3.32Å; Q47-T49 PolarHBondContact O-N 3.44Å; T49-K51 PolarHBondContact O-N 3.26Å | ||
| 50 | A | 46.5 | Very low | 49.2 | Very low | 98 Ų | 98 | 124.4 Ų | 124.4 | 81% | 0.81 | 79% | 0.789 | S | S | * | * | trans | -65.6 | 82.6 | 163.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | S48 R52 | S48-A50 PolarHBondContact O-N 3.35Å; A50-R52 PolarHBondContact O-N 3.36Å | ||
| 51 | K | 49.5 | Very low | 51.5 | Low | 185 Ų | 185 | 124.1 Ų | 124.1 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | -84.4 | 99.4 | 170.3 | -141.5 | 175.9 | -175.1 | -177.9 | 0 | 106.4 | T49 T53 | T49-K51 PolarHBondContact O-N 3.26Å; K51-T53 PolarHBondContact O-N 2.91Å; K51-T53 VanDerWaalsContact O-N 3.1Å | ||
| 52 | R | 52.3 | Low | 53.8 | Low | 232 Ų | 232 | 123 Ų | 123 | 88% | 0.875 | 76% | 0.764 | S | S | * | * | trans | -54.8 | 114 | 169.8 | -63.6 | -177.7 | -62.6 | -157.7 | 0.6 | 107.9 | A50 | A50-R52 PolarHBondContact O-N 3.36Š| ||
| 53 | T | 52.8 | Low | 55.9 | Low | 110 Ų | 110 | 119.5 Ų | 119.5 | 68% | 0.675 | 75% | 0.752 | S | S | * | * | trans | -91.5 | 104.2 | 162.5 | 48 | 0 | 0 | 0 | 0 | 107.2 | K51 | K51-T53 PolarHBondContact O-N 2.91Å; K51-T53 VanDerWaalsContact O-N 3.1Å | ||
| 54 | D | 49.9 | Very low | 58.3 | Low | 155 Ų | 155 | 121.7 Ų | 121.7 | 83% | 0.829 | 75% | 0.745 | S | S | * | * | trans | -56.4 | 136.5 | 166.5 | -82.4 | -45.4 | 0 | 0 | 0 | 110.2 | ||||
| 55 | G | 52.5 | Low | 60.7 | Low | 83 Ų | 83 | 120 Ų | 120 | 86% | 0.856 | 73% | 0.726 | S | S | * | * | S | Bend | trans | 57.6 | 90.1 | 150.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||
| 56 | G | 58.2 | Low | 62.7 | Low | 84 Ų | 84 | 123.2 Ų | 123.2 | 87% | 0.866 | 72% | 0.718 | S | S | * | * | trans | 111.2 | 5.9 | 157.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 57 | A | 66.4 | Low | 64.5 | Low | 72 Ų | 72 | 123.3 Ų | 123.3 | 60% | 0.595 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 132.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 58 | A | 78.4 | Confident | 66.1 | Low | 95 Ų | 95 | 119.6 Ų | 119.6 | 79% | 0.785 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -47 | 145.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 59 | L | 82.3 | Confident | 67.6 | Low | 161 Ų | 161 | 118.1 Ų | 118.1 | 84% | 0.843 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 138.2 | 178.8 | -66.7 | 172.1 | 0 | 0 | 0 | 109.9 | R61 | L59-R61 PolarHBondContact O-N 2.96Š|
| 60 | P | 81.1 | Confident | 69.4 | Low | 66 Ų | 66 | 117.4 Ų | 117.4 | 43% | 0.429 | 69% | 0.691 | S | S | . | * | P | Polyproline II helix | trans | -53.9 | 141.6 | 177 | 21.6 | -31.3 | 0 | 0 | 0 | 109.4 | L65 | P60-L65 HydrophobicContact CB-CD1 4.49Å; P60-L65 HydrophobicContact CB-CG 4.36Å; P60-L65 HydrophobicContact CG-CD1 4.03Å; P60-L65 HydrophobicContact CG-CD2 4.29Å; P60-L65 HydrophobicContact CG-CG 3.99Å; P60-L65 WeakPolarHBondContact O-CD1 3.39Å |
| 61 | R | 83.6 | Confident | 71 | Confident | 180 Ų | 180 | 119.5 Ų | 119.5 | 68% | 0.679 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 146.1 | 179.1 | -70.8 | -177.4 | 177.9 | -175.4 | 0.5 | 109 | L59 D63 E64 L65 | L59-R61 PolarHBondContact O-N 2.96Å; R61-D63 PolarHBondContact O-N 3.46Å; R61-D63 VanDerWaalsContact O-N 3.14Å; R61-E64 HydrophobicContact CB-CG 4.28Å; R61-E64 WeakPolarHBondContact O-CB 3.32Å; R61-E64 PolarHBondContact O-N 3.18Å; R61-L65 PolarHBondContact O-N 3.34Å |
| 62 | P | 80.4 | Confident | 72.3 | Confident | 79 Ų | 79 | 113.3 Ų | 113.3 | 51% | 0.513 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -52.9 | -39.3 | 179.6 | 20.9 | -32.4 | 0 | 0 | 0 | 111.5 | E64 L65 F66 | P62-E64 VanDerWaalsContact C-N 3.26Å; P62-E64 PolarHBondContact O-N 3.14Å; P62-L65 WeakPolarHBondContact O-CB 3.48Å; P62-L65 PolarHBondContact O-N 2.78Å; P62-L65 VanDerWaalsContact O-N 3.16Å; P62-F66 HydrophobicContact CB-CD2 4.28Å; P62-F66 HydrophobicContact CB-CE2 4Å; P62-F66 WeakPolarHBondContact O-CD2 3.4Å; P62-F66 PolarHBondContact O-N 3.47Å |
| 63 | D | 79.6 | Confident | 73.3 | Confident | 126 Ų | 126 | 108.3 Ų | 108.3 | 67% | 0.674 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -61 | -33.4 | 178.2 | -55.8 | -33.4 | 0 | 0 | 0 | 113.1 | R61 S67 | R61-D63 PolarHBondContact O-N 3.46Å; R61-D63 VanDerWaalsContact O-N 3.14Å; D63-S67 VanDerWaalsContact O-CB 3.32Å; D63-S67 WeakPolarHBondContact O-CB 2.92Å; D63-S67 PolarHBondContact O-N 3.16Å |
| 64 | E | 82.9 | Confident | 74.2 | Confident | 111 Ų | 111 | 110.6 Ų | 110.6 | 52% | 0.519 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -72.8 | -41.4 | 176.7 | -65.5 | 173.4 | -167.2 | 0 | 0 | 111.1 | R61 P62 F66 S67 S68 | R61-E64 HydrophobicContact CB-CG 4.28Å; R61-E64 WeakPolarHBondContact O-CB 3.32Å; R61-E64 PolarHBondContact O-N 3.18Å; P62-E64 VanDerWaalsContact C-N 3.26Å; P62-E64 PolarHBondContact O-N 3.14Å; E64-F66 VanDerWaalsContact C-N 3.34Å; E64-F66 PolarHBondContact O-N 2.93Å; E64-S67 PolarHBondContact O-N 2.79Å; E64-S67 PolarHBondContact O-OG 3.47Å; E64-S68 PolarHBondContact O-N 3.37Å |
| 65 | L | 82.1 | Confident | 75.3 | Confident | 89 Ų | 89 | 106.3 Ų | 106.3 | 47% | 0.466 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -58.1 | -46.8 | 173.7 | -79.9 | 146.7 | 0 | 0 | 0 | 111 | P60 R61 P62 S68 | P60-L65 HydrophobicContact CB-CD1 4.49Å; P60-L65 HydrophobicContact CB-CG 4.36Å; P60-L65 HydrophobicContact CG-CD1 4.03Å; P60-L65 HydrophobicContact CG-CD2 4.29Å; P60-L65 HydrophobicContact CG-CG 3.99Å; P60-L65 WeakPolarHBondContact O-CD1 3.39Å; R61-L65 PolarHBondContact O-N 3.34Å; P62-L65 WeakPolarHBondContact O-CB 3.48Å; P62-L65 PolarHBondContact O-N 2.78Å; P62-L65 VanDerWaalsContact O-N 3.16Å; L65-S68 PolarHBondContact O-N 2.95Å; L65-S68 PolarHBondContact O-OG 3.15Å |
| 66 | F | 78 | Confident | 76.1 | Confident | 147 Ų | 147 | 108.4 Ų | 108.4 | 65% | 0.645 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -78.9 | -19.4 | -178.1 | -62.8 | -62.8 | 0 | 0 | 0 | 113.9 | P62 E64 S68 | P62-F66 HydrophobicContact CB-CD2 4.28Å; P62-F66 HydrophobicContact CB-CE2 4Å; P62-F66 WeakPolarHBondContact O-CD2 3.4Å; P62-F66 PolarHBondContact O-N 3.47Å; E64-F66 VanDerWaalsContact C-N 3.34Å; E64-F66 PolarHBondContact O-N 2.93Å; F66-S68 VanDerWaalsContact C-N 3.35Å |
| 67 | S | 73.6 | Confident | 76.8 | Confident | 94 Ų | 94 | 107.5 Ų | 107.5 | 66% | 0.657 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -71.1 | -29.9 | 171.9 | 74.4 | 0 | 0 | 0 | 0 | 113.2 | D63 E64 V69 | D63-S67 VanDerWaalsContact O-CB 3.32Å; D63-S67 WeakPolarHBondContact O-CB 2.92Å; D63-S67 PolarHBondContact O-N 3.16Å; E64-S67 PolarHBondContact O-N 2.79Å; E64-S67 PolarHBondContact O-OG 3.47Å; S67-V69 VanDerWaalsContact C-N 3.32Å |
| 68 | S | 73.2 | Confident | 77.2 | Confident | 97 Ų | 97 | 109 Ų | 109 | 68% | 0.678 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -76.5 | -21.4 | 179.6 | 73.4 | 0 | 0 | 0 | 0 | 113.1 | E64 L65 F66 | E64-S68 PolarHBondContact O-N 3.37Å; L65-S68 PolarHBondContact O-N 2.95Å; L65-S68 PolarHBondContact O-OG 3.15Å; F66-S68 VanDerWaalsContact C-N 3.35Å |
| 69 | V | 75.9 | Confident | 76.9 | Confident | 94 Ų | 94 | 111.6 Ų | 111.6 | 57% | 0.57 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -92 | 117.2 | 177 | -177.6 | 0 | 0 | 0 | 0 | 107.8 | S67 K71 | S67-V69 VanDerWaalsContact C-N 3.32Å; V69-K71 PolarHBondContact O-N 2.89Å; V69-K71 VanDerWaalsContact O-N 3.11Å |
| 70 | S | 79.2 | Confident | 76.1 | Confident | 107 Ų | 107 | 108 Ų | 108 | 75% | 0.748 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 121.5 | 174.9 | 173.8 | 0 | 0 | 0 | 0 | 110.2 | ||
| 71 | K | 78.4 | Confident | 75.8 | Confident | 143 Ų | 143 | 112.2 Ų | 112.2 | 62% | 0.622 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -56 | 129.1 | 175.9 | -66.8 | -178.6 | -179.7 | -177.9 | 0 | 108.5 | V69 | V69-K71 PolarHBondContact O-N 2.89Å; V69-K71 VanDerWaalsContact O-N 3.11Å |
| 72 | P | 78.3 | Confident | 75.3 | Confident | 55 Ų | 55 | 110 Ų | 110 | 36% | 0.357 | 59% | 0.586 | S | S | . | * | P | Polyproline II helix | trans | -64.6 | 145.5 | -179.9 | 27.7 | -36.2 | 0 | 0 | 0 | 110.5 | F74 L75 | P72-F74 HydrophobicContact CB-CD1 3.68Å; P72-F74 HydrophobicContact CB-CE1 3.3Å; P72-F74 HydrophobicContact CB-CZ 3.87Å; P72-F74 HydrophobicContact CG-CD1 4.12Å; P72-F74 HydrophobicContact CG-CE1 3.46Å; P72-F74 VanDerWaalsContact CG-CE1 3.46Å; P72-F74 HydrophobicContact CG-CE2 4.12Å; P72-F74 HydrophobicContact CG-CZ 3.45Å; P72-F74 VanDerWaalsContact CG-CZ 3.45Å; P72-F74 PolarHBondContact O-N 2.66Å; P72-L75 HydrophobicContact CG-CD1 3.8Å; P72-L75 HydrophobicContact CG-CG 4.16Å; P72-L75 PolarHBondContact O-N 3.36Å |
| 73 | T | 72.9 | Confident | 75.1 | Confident | 127 Ų | 127 | 108.6 Ų | 108.6 | 78% | 0.779 | 57% | 0.574 | S | S | * | * | G | 310 helix | trans | -60.3 | -22.6 | -170.7 | 53.6 | 0 | 0 | 0 | 0 | 114.1 | L75 Y76 | T73-L75 VanDerWaalsContact C-N 3.3Å; T73-L75 PolarHBondContact O-N 2.79Å; T73-Y76 PolarHBondContact O-N 3.47Å |
| 74 | F | 71.8 | Confident | 74.8 | Confident | 158 Ų | 158 | 106.8 Ų | 106.8 | 69% | 0.693 | 56% | 0.564 | S | S | * | * | G | 310 helix | trans | -73.6 | -17.8 | 176.1 | 66.2 | -100.2 | 0 | 0 | 0 | 113.9 | P72 Y76 | P72-F74 HydrophobicContact CB-CD1 3.68Å; P72-F74 HydrophobicContact CB-CE1 3.3Å; P72-F74 HydrophobicContact CB-CZ 3.87Å; P72-F74 HydrophobicContact CG-CD1 4.12Å; P72-F74 HydrophobicContact CG-CE1 3.46Å; P72-F74 VanDerWaalsContact CG-CE1 3.46Å; P72-F74 HydrophobicContact CG-CE2 4.12Å; P72-F74 HydrophobicContact CG-CZ 3.45Å; P72-F74 VanDerWaalsContact CG-CZ 3.45Å; P72-F74 PolarHBondContact O-N 2.66Å; F74-Y76 VanDerWaalsContact C-N 3.35Å |
| 75 | L | 73.3 | Confident | 74.4 | Confident | 64 Ų | 64 | 110 Ų | 110 | 34% | 0.335 | 57% | 0.571 | S | S | . | * | G | 310 helix | trans | -87.9 | -8.2 | 171.5 | -67.8 | 174.5 | 0 | 0 | 0 | 112.4 | P72 T73 I83 W85 | P72-L75 HydrophobicContact CG-CD1 3.8Å; P72-L75 HydrophobicContact CG-CG 4.16Å; P72-L75 PolarHBondContact O-N 3.36Å; T73-L75 VanDerWaalsContact C-N 3.3Å; T73-L75 PolarHBondContact O-N 2.79Å; L75-I83 HydrophobicContact CB-CD1 4.5Å; L75-I83 HydrophobicContact CD2-CD1 3.69Å; L75-W85 HydrophobicContact CD2-CZ2 4.41Å |
| 76 | Y | 67.6 | Low | 73.8 | Confident | 128 Ų | 128 | 112.7 Ų | 112.7 | 50% | 0.502 | 59% | 0.586 | S | S | . | * | trans | -98.8 | 101.1 | -180 | -172.8 | -101.5 | 0 | 0 | 0 | 109.6 | T73 F74 P78 K81 | T73-Y76 PolarHBondContact O-N 3.47Å; F74-Y76 VanDerWaalsContact C-N 3.35Å; Y76-P78 HydrophobicContact CE1-CB 4.36Å; Y76-K81 HydrophobicContact CE2-CB 4.12Å; Y76-K81 HydrophobicContact CE2-CG 3.93Å | ||
| 77 | N | 73.3 | Confident | 73.3 | Confident | 65 Ų | 65 | 109.7 Ų | 109.7 | 35% | 0.348 | 58% | 0.584 | S | S | . | * | trans | -82.8 | 120.4 | 166 | 170.5 | 8.7 | 0 | 0 | 0 | 107.9 | L79 N80 K81 | N77-L79 PolarHBondContact O-N 3.26Å; N77-L79 PolarHBondContact OD1-N 3.32Å; N77-N80 CarbonylContact C-O 3.6Å; N77-N80 WeakPolarHBondContact CB-O 3.38Å; N77-N80 CarbonylContact O-C 3.58Å; N77-N80 PolarHBondContact O-N 3.05Å; N77-K81 PolarHBondContact O-N 3.26Å | ||
| 78 | P | 74.6 | Confident | 72.7 | Confident | 102 Ų | 102 | 110.2 Ų | 110.2 | 66% | 0.662 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -63.6 | -15.7 | -173.2 | 24.6 | -34.7 | 0 | 0 | 0 | 114.1 | Y76 | Y76-P78 HydrophobicContact CE1-CB 4.36Š|
| 79 | L | 73 | Confident | 72.2 | Confident | 151 Ų | 151 | 110.7 Ų | 110.7 | 79% | 0.791 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -92.8 | -45.2 | 175.7 | -62.1 | 173.7 | 0 | 0 | 0 | 111.7 | N77 | N77-L79 PolarHBondContact O-N 3.26Å; N77-L79 PolarHBondContact OD1-N 3.32Å |
| 80 | N | 65.5 | Low | 71.6 | Confident | 85 Ų | 85 | 111.8 Ų | 111.8 | 46% | 0.455 | 58% | 0.584 | S | S | . | * | S | Bend | trans | -121.9 | 105 | 177.7 | -62.3 | -8.6 | 0 | 0 | 0 | 107.2 | N77 E82 | N77-N80 CarbonylContact C-O 3.6Å; N77-N80 WeakPolarHBondContact CB-O 3.38Å; N77-N80 CarbonylContact O-C 3.58Å; N77-N80 PolarHBondContact O-N 3.05Å; N80-E82 PolarHBondContact O-N 3.11Å; N80-E82 VanDerWaalsContact O-O 3.11Å |
| 81 | K | 74.3 | Confident | 71 | Confident | 155 Ų | 155 | 115.4 Ų | 115.4 | 67% | 0.674 | 59% | 0.587 | S | S | * | * | S | Bend | trans | -56.7 | -7.9 | -172.3 | -60.6 | 175.3 | -179.2 | 174 | 0 | 114.7 | Y76 N77 | Y76-K81 HydrophobicContact CE2-CB 4.12Å; Y76-K81 HydrophobicContact CE2-CG 3.93Å; N77-K81 PolarHBondContact O-N 3.26Å |
| 82 | E | 74.3 | Confident | 70.6 | Confident | 132 Ų | 132 | 113.7 Ų | 113.7 | 62% | 0.617 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -129.2 | 141.2 | 177.6 | -62.4 | -177.9 | 165.8 | 0 | 0 | 109 | N80 D84 | N80-E82 PolarHBondContact O-N 3.11Å; N80-E82 VanDerWaalsContact O-O 3.11Å; E82-D84 PolarHBondContact O-N 3.47Å |
| 83 | I | 74.8 | Confident | 70.1 | Confident | 51 Ų | 51 | 116.3 Ų | 116.3 | 26% | 0.262 | 61% | 0.607 | S | S | . | * | trans | -75.5 | 116.2 | 172.1 | -65.8 | 167.7 | 0 | 0 | 0 | 107 | L75 W85 L88 | L75-I83 HydrophobicContact CB-CD1 4.5Å; L75-I83 HydrophobicContact CD2-CD1 3.69Å; I83-W85 VanDerWaalsContact C-N 3.29Å; I83-W85 HydrophobicContact CD1-CZ2 4.44Å; I83-W85 HydrophobicContact CG2-CD2 4.11Å; I83-W85 HydrophobicContact CG2-CE3 4.47Å; I83-W85 HydrophobicContact CG2-CG 4.43Å; I83-W85 HydrophobicContact CG2-CZ2 4.4Å; I83-W85 VanDerWaalsContact O-CD1 3.25Å; I83-W85 PolarHBondContact O-N 3.22Å; I83-L88 HydrophobicContact CG2-CD1 4.05Å | ||
| 84 | D | 73.8 | Confident | 69.8 | Low | 88 Ų | 88 | 119.4 Ų | 119.4 | 47% | 0.471 | 61% | 0.613 | S | S | . | * | trans | -69.1 | 88.6 | 170 | -64.6 | -35.2 | 0 | 0 | 0 | 108.8 | E82 D86 S87 | E82-D84 PolarHBondContact O-N 3.47Å; D84-D86 PolarHBondContact O-N 3.4Å; D84-D86 VanDerWaalsContact O-N 3.15Å; D84-S87 WeakPolarHBondContact O-CB 3.22Å; D84-S87 PolarHBondContact O-N 2.81Å; D84-S87 PolarHBondContact O-OG 2.95Å | ||
| 85 | W | 74.4 | Confident | 69.7 | Low | 177 Ų | 177 | 119.4 Ų | 119.4 | 67% | 0.67 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -58.2 | -24.9 | 177.5 | -69 | 102.6 | 0 | 0 | 0 | 112.4 | L75 I83 S87 L88 | L75-W85 HydrophobicContact CD2-CZ2 4.41Å; I83-W85 VanDerWaalsContact C-N 3.29Å; I83-W85 HydrophobicContact CD1-CZ2 4.44Å; I83-W85 HydrophobicContact CG2-CD2 4.11Å; I83-W85 HydrophobicContact CG2-CE3 4.47Å; I83-W85 HydrophobicContact CG2-CG 4.43Å; I83-W85 HydrophobicContact CG2-CZ2 4.4Å; I83-W85 VanDerWaalsContact O-CD1 3.25Å; I83-W85 PolarHBondContact O-N 3.22Å; W85-S87 VanDerWaalsContact C-N 3.29Å; W85-S87 PolarHBondContact O-N 2.84Å; W85-L88 HydrophobicContact CD2-CD1 4.49Å; W85-L88 HydrophobicContact CE3-CD1 3.71Å; W85-L88 HydrophobicContact CZ3-CD1 4.09Å; W85-L88 PolarHBondContact O-N 3.05Å |
| 86 | D | 69.7 | Low | 69.6 | Low | 146 Ų | 146 | 121.9 Ų | 121.9 | 78% | 0.781 | 64% | 0.635 | S | S | * | * | G | 310 helix | trans | -75.4 | -16.5 | 175.9 | -61.8 | -28.2 | 0 | 0 | 0 | 113.1 | D84 T89 | D84-D86 PolarHBondContact O-N 3.4Å; D84-D86 VanDerWaalsContact O-N 3.15Å; D86-T89 PolarHBondContact O-OG1 3.15Å |
| 87 | S | 66.8 | Low | 69.6 | Low | 84 Ų | 84 | 120.1 Ų | 120.1 | 59% | 0.587 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -84.5 | -12 | 175.7 | 76.4 | 0 | 0 | 0 | 0 | 113.2 | D84 W85 T89 | D84-S87 WeakPolarHBondContact O-CB 3.22Å; D84-S87 PolarHBondContact O-N 2.81Å; D84-S87 PolarHBondContact O-OG 2.95Å; W85-S87 VanDerWaalsContact C-N 3.29Å; W85-S87 PolarHBondContact O-N 2.84Å; S87-T89 VanDerWaalsContact C-N 3.32Å |
| 88 | L | 61.3 | Low | 69.5 | Low | 105 Ų | 105 | 128 Ų | 128 | 55% | 0.55 | 67% | 0.672 | S | S | . | * | G | 310 helix | trans | -82.3 | -7.3 | 178.2 | -85.6 | 140.1 | 0 | 0 | 0 | 113.4 | I83 W85 V90 | I83-L88 HydrophobicContact CG2-CD1 4.05Å; W85-L88 HydrophobicContact CD2-CD1 4.49Å; W85-L88 HydrophobicContact CE3-CD1 3.71Å; W85-L88 HydrophobicContact CZ3-CD1 4.09Å; W85-L88 PolarHBondContact O-N 3.05Å; L88-V90 PolarHBondContact O-N 3.28Å |
| 89 | T | 62.1 | Low | 69.6 | Low | 108 Ų | 108 | 131.1 Ų | 131.1 | 66% | 0.663 | 68% | 0.678 | S | S | * | * | trans | -74.4 | 71 | 163.4 | 64.6 | 0 | 0 | 0 | 0 | 108.4 | D86 S87 K91 | D86-T89 PolarHBondContact O-OG1 3.15Å; S87-T89 VanDerWaalsContact C-N 3.32Å; T89-K91 VanDerWaalsContact C-N 3.3Å; T89-K91 PolarHBondContact O-N 2.73Å | ||
| 90 | V | 64.2 | Low | 69.6 | Low | 117 Ų | 117 | 132.7 Ų | 132.7 | 71% | 0.709 | 68% | 0.678 | S | S | * | * | trans | -53.6 | 104.1 | 161.9 | 175.7 | 0 | 0 | 0 | 0 | 104.7 | L88 P92 | L88-V90 PolarHBondContact O-N 3.28Å; V90-P92 WeakPolarHBondContact O-CD 3.44Å | ||
| 91 | K | 67.4 | Low | 70.2 | Confident | 182 Ų | 182 | 137.6 Ų | 137.6 | 79% | 0.791 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 121.3 | 169.7 | -72.9 | -135.4 | 175.1 | 177.3 | 0 | 105.4 | T89 | T89-K91 VanDerWaalsContact C-N 3.3Å; T89-K91 PolarHBondContact O-N 2.73Å |
| 92 | P | 69.2 | Low | 70.4 | Confident | 108 Ų | 108 | 135 Ų | 135 | 70% | 0.701 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 135.8 | 178.4 | 21.9 | -31.3 | 0 | 0 | 0 | 106.9 | V90 E94 | V90-P92 WeakPolarHBondContact O-CD 3.44Å; P92-E94 PolarHBondContact O-N 3.44Å; P92-E94 VanDerWaalsContact O-N 3.15Å |
| 93 | P | 68 | Low | 70.4 | Confident | 110 Ų | 110 | 139 Ų | 139 | 71% | 0.714 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -46.4 | 129.2 | 174.7 | -24.1 | 31.3 | 0 | 0 | 0 | 108.1 | E95 | P93-E95 PolarHBondContact O-N 2.98Š|
| 94 | E | 66.6 | Low | 70.4 | Confident | 191 Ų | 191 | 145.9 Ų | 145.9 | 89% | 0.893 | 73% | 0.732 | S | S | * | * | trans | -61.8 | 92.4 | 177.5 | -175.3 | 176.9 | 170.1 | 0 | 0 | 107.5 | P92 P96 | P92-E94 PolarHBondContact O-N 3.44Å; P92-E94 VanDerWaalsContact O-N 3.15Å; E94-P96 WeakPolarHBondContact O-CD 3.47Å | ||
| 95 | E | 69.2 | Low | 70.3 | Confident | 159 Ų | 159 | 146.3 Ų | 146.3 | 74% | 0.743 | 74% | 0.738 | S | S | * | * | trans | -64.8 | 121.4 | 175.2 | -71 | -168.1 | 165.8 | 0 | 0 | 106.7 | P93 A97 | P93-E95 PolarHBondContact O-N 2.98Å; E95-A97 PolarHBondContact O-N 3.24Å | ||
| 96 | P | 71.4 | Confident | 70 | Confident | 115 Ų | 115 | 145.7 Ų | 145.7 | 75% | 0.747 | 75% | 0.748 | S | S | * | * | trans | -57.3 | 134.1 | 172.9 | 25.5 | -33 | 0 | 0 | 0 | 107.6 | E94 R98 | E94-P96 WeakPolarHBondContact O-CD 3.47Å; P96-R98 PolarHBondContact O-N 3.01Å | ||
| 97 | A | 68.4 | Low | 70 | Confident | 92 Ų | 92 | 142.2 Ų | 142.2 | 76% | 0.76 | 74% | 0.74 | S | S | * | * | trans | -42.8 | 109.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | E95 E99 | E95-A97 PolarHBondContact O-N 3.24Å; A97-E99 VanDerWaalsContact C-N 3.25Å; A97-E99 PolarHBondContact O-N 2.75Å | ||
| 98 | R | 70.5 | Confident | 70.1 | Confident | 229 Ų | 229 | 144.4 Ų | 144.4 | 86% | 0.864 | 75% | 0.749 | S | S | * | * | trans | -66.7 | 90.6 | -177.2 | -176.6 | 172.6 | 174.1 | 169.3 | -2.3 | 107.6 | P96 F100 | P96-R98 PolarHBondContact O-N 3.01Å; R98-F100 PolarHBondContact O-N 2.88Å | ||
| 99 | E | 77.6 | Confident | 70.8 | Confident | 169 Ų | 169 | 144.4 Ų | 144.4 | 79% | 0.79 | 76% | 0.755 | S | S | * | * | trans | -56.5 | 114.8 | 179 | -68.6 | -178.7 | -176.9 | 0 | 0 | 108.3 | A97 K101 | A97-E99 VanDerWaalsContact C-N 3.25Å; A97-E99 PolarHBondContact O-N 2.75Å; E99-K101 PolarHBondContact O-N 3.1Å | ||
| 100 | F | 71.3 | Confident | 71.1 | Confident | 184 Ų | 184 | 144.6 Ų | 144.6 | 81% | 0.807 | 76% | 0.759 | S | S | * | * | trans | -68.3 | 103 | -176.6 | -156.3 | -94.4 | 0 | 0 | 0 | 107.5 | R98 P102 | R98-F100 PolarHBondContact O-N 2.88Å; F100-P102 WeakPolarHBondContact O-CD 3.06Å | ||
| 101 | K | 79.6 | Confident | 71.3 | Confident | 188 Ų | 188 | 144.4 Ų | 144.4 | 82% | 0.817 | 76% | 0.76 | S | S | * | * | trans | -75.4 | 106.2 | 170 | -69.8 | -170.7 | 178.8 | 179.4 | 0 | 107 | E99 W103 | E99-K101 PolarHBondContact O-N 3.1Å; K101-W103 PolarHBondContact O-N 2.94Å | ||
| 102 | P | 78.2 | Confident | 71.1 | Confident | 100 Ų | 100 | 145.3 Ų | 145.3 | 65% | 0.649 | 77% | 0.767 | S | S | * | * | trans | -59.4 | 130.1 | 175.7 | 26.2 | -33.2 | 0 | 0 | 0 | 107.5 | F100 K104 | F100-P102 WeakPolarHBondContact O-CD 3.06Å; P102-K104 PolarHBondContact O-N 3.36Å | ||
| 103 | W | 73 | Confident | 70.3 | Confident | 217 Ų | 217 | 145.8 Ų | 145.8 | 82% | 0.822 | 77% | 0.768 | S | S | * | * | trans | -56.6 | 129.9 | 175.3 | 58.3 | 56.9 | 0 | 0 | 0 | 107.6 | K101 T105 | K101-W103 PolarHBondContact O-N 2.94Å; W103-T105 VanDerWaalsContact CD1-CG2 3.49Å; W103-T105 PolarHBondContact O-N 2.94Å | ||
| 104 | K | 75 | Confident | 69.7 | Low | 194 Ų | 194 | 151.2 Ų | 151.2 | 84% | 0.843 | 78% | 0.776 | S | S | * | * | trans | -80.8 | 107.5 | 166 | -71.2 | -171.3 | 176.3 | -176 | 0 | 105.4 | P102 N106 | P102-K104 PolarHBondContact O-N 3.36Å; K104-N106 PolarHBondContact O-N 3.47Å | ||
| 105 | T | 72.6 | Confident | 68.9 | Low | 98 Ų | 98 | 145.6 Ų | 145.6 | 60% | 0.601 | 76% | 0.762 | S | S | * | * | trans | -64.1 | 107.3 | 170.9 | 54.4 | 0 | 0 | 0 | 0 | 107.2 | W103 A107 | W103-T105 VanDerWaalsContact CD1-CG2 3.49Å; W103-T105 PolarHBondContact O-N 2.94Å; T105-A107 PolarHBondContact O-N 3.24Å | ||
| 106 | N | 68.3 | Low | 68.2 | Low | 163 Ų | 163 | 143.8 Ų | 143.8 | 87% | 0.872 | 76% | 0.764 | S | S | * | * | trans | -70.4 | 57.2 | 157.9 | -67 | -52.6 | 0 | 0 | 0 | 108 | K104 V108 | K104-N106 PolarHBondContact O-N 3.47Å; N106-V108 PolarHBondContact O-N 3.06Å; N106-V108 VanDerWaalsContact O-N 3.12Å | ||
| 107 | A | 69.1 | Low | 67.2 | Low | 74 Ų | 74 | 144.6 Ų | 144.6 | 61% | 0.612 | 76% | 0.758 | S | S | * | * | trans | -72.7 | 105.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 106.2 | T105 | T105-A107 PolarHBondContact O-N 3.24Š| ||
| 108 | V | 69.6 | Low | 66.5 | Low | 130 Ų | 130 | 145.1 Ų | 145.1 | 79% | 0.788 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 126 | 164 | 177.7 | 0 | 0 | 0 | 0 | 106.1 | N106 | N106-V108 PolarHBondContact O-N 3.06Å; N106-V108 VanDerWaalsContact O-N 3.12Å |
| 109 | P | 74.9 | Confident | 65.8 | Low | 104 Ų | 104 | 143 Ų | 143 | 68% | 0.675 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 139.9 | -178.9 | 21.9 | -32.2 | 0 | 0 | 0 | 109.6 | ||
| 110 | P | 69 | Low | 64.7 | Low | 113 Ų | 113 | 144.1 Ų | 144.1 | 73% | 0.734 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 136.3 | 176.5 | 23.5 | -31.3 | 0 | 0 | 0 | 109 | E112 | P110-E112 PolarHBondContact O-N 3.19Š|
| 111 | P | 69 | Low | 63.7 | Low | 113 Ų | 113 | 144.8 Ų | 144.8 | 73% | 0.734 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 134.4 | -179 | 24.5 | -33.1 | 0 | 0 | 0 | 110.3 | T113 | P111-T113 PolarHBondContact O-N 2.93Š|
| 112 | E | 62.1 | Low | 62.3 | Low | 201 Ų | 201 | 146 Ų | 146 | 94% | 0.939 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -68.9 | 0 | -173.4 | -69.8 | -172.4 | 149.5 | 0 | 0 | 114.8 | P110 | P110-E112 PolarHBondContact O-N 3.19Š|
| 113 | T | 52.8 | Low | 61.5 | Low | 118 Ų | 118 | 143.9 Ų | 143.9 | 72% | 0.724 | 75% | 0.754 | S | S | * | * | trans | -139.9 | 104 | 175.3 | 41.7 | 0 | 0 | 0 | 0 | 110.9 | P111 A115 | P111-T113 PolarHBondContact O-N 2.93Å; T113-A115 PolarHBondContact O-N 3.31Å | ||
| 114 | Y | 55.8 | Low | 60.8 | Low | 224 Ų | 224 | 139.5 Ų | 139.5 | 88% | 0.878 | 75% | 0.754 | S | S | * | * | trans | -74 | 81.9 | 161.1 | -156.4 | -91.9 | 0 | 0 | 0 | 107.7 | P116 | Y114-P116 WeakPolarHBondContact O-CD 3.15Š| ||
| 115 | A | 50.4 | Low | 60.4 | Low | 73 Ų | 73 | 136 Ų | 136 | 60% | 0.603 | 75% | 0.751 | S | S | * | * | trans | -67.6 | 125.8 | 165.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | T113 E117 | T113-A115 PolarHBondContact O-N 3.31Å; A115-E117 PolarHBondContact O-N 3.02Å | ||
| 116 | P | 53.3 | Low | 60.1 | Low | 120 Ų | 120 | 137.7 Ų | 137.7 | 78% | 0.779 | 76% | 0.764 | S | S | * | * | trans | -71 | 82.5 | 167.9 | 29.5 | -31.8 | 0 | 0 | 0 | 108.2 | Y114 | Y114-P116 WeakPolarHBondContact O-CD 3.15Š| ||
| 117 | E | 50.9 | Low | 59.9 | Low | 133 Ų | 133 | 133.4 Ų | 133.4 | 62% | 0.621 | 76% | 0.758 | S | S | * | * | trans | -66.6 | 132.6 | 167.7 | -168.2 | -176 | 163.1 | 0 | 0 | 108.3 | A115 R120 | A115-E117 PolarHBondContact O-N 3.02Å; E117-R120 IonicContact OE1-CZ 3.63Å; E117-R120 IonicContact OE1-NE 3.74Å; E117-R120 IonicContact OE1-NH2 2.81Å; E117-R120 PolarHBondContact OE1-NH2 3.05Å | ||
| 118 | P | 53.1 | Low | 59.7 | Low | 102 Ų | 102 | 136 Ų | 136 | 66% | 0.662 | 76% | 0.759 | S | S | * | * | trans | -61.5 | 145.4 | -168.6 | 23.4 | -36.3 | 0 | 0 | 0 | 113.3 | R120 | P118-R120 PolarHBondContact O-N 2.81Š| ||
| 119 | E | 55.5 | Low | 59.9 | Low | 186 Ų | 186 | 134.6 Ų | 134.6 | 87% | 0.869 | 75% | 0.747 | S | S | * | * | trans | -27.2 | 89.6 | 176.1 | -58.6 | -171.2 | 166.7 | 0 | 0 | 115.1 | K121 | E119-K121 PolarHBondContact O-N 2.92Š| ||
| 120 | R | 55.1 | Low | 60 | Low | 191 Ų | 191 | 135.2 Ų | 135.2 | 72% | 0.721 | 74% | 0.742 | S | S | * | * | trans | -78.7 | 103.9 | 161.2 | -61.5 | -68.8 | 177.4 | 113.3 | 12.1 | 107 | E117 P118 K122 | E117-R120 IonicContact OE1-CZ 3.63Å; E117-R120 IonicContact OE1-NE 3.74Å; E117-R120 IonicContact OE1-NH2 2.81Å; E117-R120 PolarHBondContact OE1-NH2 3.05Å; P118-R120 PolarHBondContact O-N 2.81Å; R120-K122 PolarHBondContact O-N 3.19Å | ||
| 121 | K | 51.5 | Low | 60 | Low | 199 Ų | 199 | 132.4 Ų | 132.4 | 87% | 0.865 | 73% | 0.729 | S | S | * | * | trans | -47 | 114.2 | 168.8 | -66.1 | -123.8 | 177.6 | -175.9 | 0 | 109.1 | E119 G123 | E119-K121 PolarHBondContact O-N 2.92Å; K121-G123 PolarHBondContact O-N 3.03Å | ||
| 122 | K | 49.3 | Very low | 60 | Low | 212 Ų | 212 | 131.2 Ų | 131.2 | 92% | 0.922 | 72% | 0.715 | S | S | * | * | trans | -67.8 | 95.4 | 175.3 | -66.9 | -177.6 | 179.2 | -177.6 | 0 | 108.8 | R120 | R120-K122 PolarHBondContact O-N 3.19Š| ||
| 123 | G | 61.2 | Low | 60.8 | Low | 56 Ų | 56 | 127.4 Ų | 127.4 | 58% | 0.577 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 156.6 | 157.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | K121 | K121-G123 PolarHBondContact O-N 3.03Š|
| 124 | P | 58.6 | Low | 61.7 | Low | 125 Ų | 125 | 130.5 Ų | 130.5 | 81% | 0.812 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -50 | 139.8 | 167.7 | -23.1 | 32.9 | 0 | 0 | 0 | 110.3 | ||
| 125 | P | 66.8 | Low | 62.2 | Low | 121 Ų | 121 | 122.4 Ų | 122.4 | 79% | 0.786 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 136.6 | -175.4 | 23.4 | -32.7 | 0 | 0 | 0 | 110.7 | G127 | P125-G127 PolarHBondContact O-N 3.49Š|
| 126 | P | 64.9 | Low | 63 | Low | 133 Ų | 133 | 122.9 Ų | 122.9 | 86% | 0.864 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -70.5 | 125.5 | -176.6 | 27 | -32.3 | 0 | 0 | 0 | 111.4 | ||
| 127 | G | 64.3 | Low | 63.8 | Low | 73 Ų | 73 | 121.7 Ų | 121.7 | 75% | 0.753 | 66% | 0.659 | S | S | * | * | S | Bend | trans | 100.8 | 8.5 | 134.6 | 0 | 0 | 0 | 0 | 0 | 119.7 | P125 | P125-G127 PolarHBondContact O-N 3.49Š|
| 128 | M | 64.9 | Low | 64.4 | Low | 129 Ų | 129 | 123.8 Ų | 123.8 | 64% | 0.635 | 66% | 0.663 | S | S | * | * | trans | -153.7 | 104.7 | 160.1 | -160.9 | 77.5 | 73.5 | 0 | 0 | 109 | M130 I132 K133 | M128-M130 PolarHBondContact O-N 2.81Å; M128-I132 HydrophobicContact SD-CG2 3.96Å; M128-K133 HydrophobicContact CB-CD 4.46Å; M128-K133 HydrophobicContact CB-CG 4.42Å; M128-K133 HydrophobicContact CG-CD 4.09Å; M128-K133 HydrophobicContact CG-CG 3.55Å | ||
| 129 | D | 73.7 | Confident | 64.9 | Low | 100 Ų | 100 | 126.4 Ų | 126.4 | 54% | 0.535 | 67% | 0.666 | S | S | . | * | trans | -56.3 | 133.3 | 175.3 | -170.9 | -4.2 | 0 | 0 | 0 | 108.5 | A131 I132 K133 | D129-A131 PolarHBondContact O-N 2.95Å; D129-A131 PolarHBondContact OD1-N 3.34Å; D129-A131 VanDerWaalsContact OD1-N 3.16Å; D129-I132 HydrophobicContact CB-CB 4.11Å; D129-I132 HydrophobicContact CB-CD1 3.63Å; D129-I132 HydrophobicContact CB-CG1 3.74Å; D129-I132 CarbonylContact O-C 3.1Å; D129-I132 WeakPolarHBondContact O-CA 3.29Å; D129-I132 WeakPolarHBondContact O-CB 3.21Å; D129-I132 PolarHBondContact O-N 2.99Å; D129-K133 PolarHBondContact O-N 3.01Å | ||
| 130 | M | 78.8 | Confident | 64.9 | Low | 117 Ų | 117 | 124.6 Ų | 124.6 | 58% | 0.576 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -63.4 | -27.4 | 179.2 | -161 | 149 | 59.5 | 0 | 0 | 110.4 | M128 K133 W134 | M128-M130 PolarHBondContact O-N 2.81Å; M130-K133 PolarHBondContact O-N 2.9Å; M130-W134 HydrophobicContact CG-CZ2 4.47Å; M130-W134 VanDerWaalsContact O-CD1 3.23Å; M130-W134 PolarHBondContact O-N 3.12Å |
| 131 | A | 69 | Low | 65 | Low | 54 Ų | 54 | 119.7 Ų | 119.7 | 45% | 0.446 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -63.7 | -39.1 | 168.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | D129 W134 S135 | D129-A131 PolarHBondContact O-N 2.95Å; D129-A131 PolarHBondContact OD1-N 3.34Å; D129-A131 VanDerWaalsContact OD1-N 3.16Å; A131-W134 PolarHBondContact O-N 3.03Å; A131-S135 PolarHBondContact O-N 2.95Å |
| 132 | I | 68 | Low | 65.2 | Low | 88 Ų | 88 | 113.4 Ų | 113.4 | 45% | 0.451 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -67.5 | -37.2 | 174 | -65.4 | 168.2 | 0 | 0 | 0 | 110.7 | M128 D129 W134 S135 S136 | M128-I132 HydrophobicContact SD-CG2 3.96Å; D129-I132 HydrophobicContact CB-CB 4.11Å; D129-I132 HydrophobicContact CB-CD1 3.63Å; D129-I132 HydrophobicContact CB-CG1 3.74Å; D129-I132 CarbonylContact O-C 3.1Å; D129-I132 WeakPolarHBondContact O-CA 3.29Å; D129-I132 WeakPolarHBondContact O-CB 3.21Å; D129-I132 PolarHBondContact O-N 2.99Å; I132-W134 VanDerWaalsContact C-N 3.29Å; I132-W134 PolarHBondContact O-N 3.44Å; I132-S135 WeakPolarHBondContact CA-OG 3.29Å; I132-S135 PolarHBondContact O-N 2.83Å; I132-S135 PolarHBondContact O-OG 2.9Å; I132-S136 PolarHBondContact O-N 3.16Å; I132-S136 VanDerWaalsContact O-N 3.12Å |
| 133 | K | 79.7 | Confident | 65.6 | Low | 122 Ų | 122 | 111.7 Ų | 111.7 | 53% | 0.53 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -64.9 | -34.1 | 172.5 | -66.3 | 175.3 | 58.5 | 178.4 | 0 | 112.3 | M128 D129 M130 | M128-K133 HydrophobicContact CB-CD 4.46Å; M128-K133 HydrophobicContact CB-CG 4.42Å; M128-K133 HydrophobicContact CG-CD 4.09Å; M128-K133 HydrophobicContact CG-CG 3.55Å; D129-K133 PolarHBondContact O-N 3.01Å; M130-K133 PolarHBondContact O-N 2.9Å |
| 134 | W | 70.9 | Confident | 65.8 | Low | 183 Ų | 183 | 115.7 Ų | 115.7 | 69% | 0.693 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -78.3 | -31.8 | 177 | -67.3 | 0.3 | 0 | 0 | 0 | 112.5 | M130 A131 I132 | M130-W134 HydrophobicContact CG-CZ2 4.47Å; M130-W134 VanDerWaalsContact O-CD1 3.23Å; M130-W134 PolarHBondContact O-N 3.12Å; A131-W134 PolarHBondContact O-N 3.03Å; I132-W134 VanDerWaalsContact C-N 3.29Å; I132-W134 PolarHBondContact O-N 3.44Å |
| 135 | S | 66.3 | Low | 65.8 | Low | 54 Ų | 54 | 112.6 Ų | 112.6 | 38% | 0.378 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -67.7 | -38.4 | 174.9 | 66.4 | 0 | 0 | 0 | 0 | 111.5 | A131 I132 V137 Y138 E139 | A131-S135 PolarHBondContact O-N 2.95Å; I132-S135 WeakPolarHBondContact CA-OG 3.29Å; I132-S135 PolarHBondContact O-N 2.83Å; I132-S135 PolarHBondContact O-OG 2.9Å; S135-V137 PolarHBondContact O-N 3.09Å; S135-Y138 PolarHBondContact O-N 3.36Å; S135-E139 PolarHBondContact O-N 2.93Å |
| 136 | S | 68.1 | Low | 65.5 | Low | 82 Ų | 82 | 113 Ų | 113 | 57% | 0.573 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.3 | -17 | -178.3 | -157.3 | 0 | 0 | 0 | 0 | 114.8 | I132 Y138 | I132-S136 PolarHBondContact O-N 3.16Å; I132-S136 VanDerWaalsContact O-N 3.12Å; S136-Y138 VanDerWaalsContact C-N 3.27Å; S136-Y138 PolarHBondContact O-N 3.19Å |
| 137 | V | 69.1 | Low | 65.5 | Low | 95 Ų | 95 | 116.2 Ų | 116.2 | 58% | 0.576 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | -19.9 | 176.8 | 170.2 | 0 | 0 | 0 | 0 | 112.2 | S135 | S135-V137 PolarHBondContact O-N 3.09Š|
| 138 | Y | 63.6 | Low | 65.4 | Low | 177 Ų | 177 | 117.4 Ų | 117.4 | 69% | 0.694 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.8 | -5.2 | -171.6 | -65.5 | -74.7 | 0 | 0 | 0 | 114.8 | S135 S136 D140 | S135-Y138 PolarHBondContact O-N 3.36Å; S136-Y138 VanDerWaalsContact C-N 3.27Å; S136-Y138 PolarHBondContact O-N 3.19Å; Y138-D140 VanDerWaalsContact C-N 3.29Å; Y138-D140 PolarHBondContact O-N 3.49Å |
| 139 | E | 62.8 | Low | 64.8 | Low | 157 Ų | 157 | 119.5 Ų | 119.5 | 73% | 0.734 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.1 | -16.5 | 176.7 | -76 | -170.5 | 155.5 | 0 | 0 | 113.7 | S135 | S135-E139 PolarHBondContact O-N 2.93Š|
| 140 | D | 57.1 | Low | 64.1 | Low | 149 Ų | 149 | 120.5 Ų | 120.5 | 80% | 0.797 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | 39.4 | 179.7 | -161.5 | 26.9 | 0 | 0 | 0 | 113.3 | Y138 | Y138-D140 VanDerWaalsContact C-N 3.29Å; Y138-D140 PolarHBondContact O-N 3.49Å |
| 141 | N | 56.3 | Low | 63.6 | Low | 87 Ų | 87 | 116.6 Ų | 116.6 | 47% | 0.465 | 65% | 0.649 | S | S | . | * | trans | -117.1 | 19.2 | 169.1 | -60.4 | -66.5 | 0 | 0 | 0 | 112.1 | D143 D144 | N141-D143 PolarHBondContact O-N 3.47Å; N141-D144 PolarHBondContact O-N 3.33Å | ||
| 142 | G | 55 | Low | 63 | Low | 67 Ų | 67 | 123.2 Ų | 123.2 | 69% | 0.691 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | -21.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 143 | D | 59.1 | Low | 62.5 | Low | 177 Ų | 177 | 121.3 Ų | 121.3 | 95% | 0.947 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -16.7 | -179.7 | -95.5 | -19.9 | 0 | 0 | 0 | 114.4 | N141 | N141-D143 PolarHBondContact O-N 3.47Š|
| 144 | D | 64 | Low | 61.4 | Low | 140 Ų | 140 | 126.6 Ų | 126.6 | 75% | 0.749 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.1 | -4.2 | 179.3 | -165.5 | 45.1 | 0 | 0 | 0 | 113.1 | N141 | N141-D144 PolarHBondContact O-N 3.33Š|
| 145 | A | 59.3 | Low | 60.8 | Low | 60 Ų | 60 | 126.4 Ų | 126.4 | 50% | 0.496 | 69% | 0.686 | S | S | . | * | S | Bend | trans | -67.1 | 124.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | K147 | A145-K147 PolarHBondContact O-N 3.22Š|
| 146 | P | 60.4 | Low | 60.1 | Low | 129 Ų | 129 | 131 Ų | 131 | 84% | 0.838 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 116.9 | 178.1 | 22.8 | -32 | 0 | 0 | 0 | 109.1 | A148 | P146-A148 PolarHBondContact O-N 2.85Š|
| 147 | K | 64.9 | Low | 59.2 | Low | 201 Ų | 201 | 132.9 Ų | 132.9 | 87% | 0.874 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 126.1 | 175.7 | -73.9 | 176.5 | -179.2 | 172.4 | 0 | 108.6 | A145 Y149 | A145-K147 PolarHBondContact O-N 3.22Å; K147-Y149 PolarHBondContact O-N 3.11Å |
| 148 | A | 62.5 | Low | 58.1 | Low | 97 Ų | 97 | 133.2 Ų | 133.2 | 80% | 0.802 | 73% | 0.728 | S | S | * | * | trans | -52.7 | 111.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | P146 S150 | P146-A148 PolarHBondContact O-N 2.85Å; A148-S150 PolarHBondContact O-N 3.42Å | ||
| 149 | Y | 53 | Low | 57.3 | Low | 173 Ų | 173 | 133.7 Ų | 133.7 | 68% | 0.678 | 74% | 0.737 | S | S | * | * | trans | -60.3 | 108.9 | -177.6 | -178.4 | -96.5 | 0 | 0 | 0 | 109.3 | K147 G151 A153 | K147-Y149 PolarHBondContact O-N 3.11Å; Y149-G151 VanDerWaalsContact C-N 3.28Å; Y149-G151 VanDerWaalsContact CD1-O 3.29Å; Y149-G151 WeakPolarHBondContact CD1-O 3.49Å; Y149-G151 VanDerWaalsContact CE1-C 3.41Å; Y149-G151 WeakPolarHBondContact CE1-O 3.41Å; Y149-A153 HydrophobicContact CD1-CB 4.23Å; Y149-A153 HydrophobicContact CE1-CB 3.9Å | ||
| 150 | S | 59 | Low | 56.7 | Low | 122 Ų | 122 | 135.1 Ų | 135.1 | 85% | 0.853 | 74% | 0.744 | S | S | * | * | trans | -88.1 | 7.2 | 179.7 | 62.6 | 0 | 0 | 0 | 0 | 113.4 | A148 | A148-S150 PolarHBondContact O-N 3.42Š| ||
| 151 | G | 67 | Low | 55.9 | Low | 35 Ų | 35 | 136.9 Ų | 136.9 | 36% | 0.361 | 75% | 0.747 | S | S | . | * | S | Bend | trans | -83.3 | 155 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y149 A153 | Y149-G151 VanDerWaalsContact C-N 3.28Å; Y149-G151 VanDerWaalsContact CD1-O 3.29Å; Y149-G151 WeakPolarHBondContact CD1-O 3.49Å; Y149-G151 VanDerWaalsContact CE1-C 3.41Å; Y149-G151 WeakPolarHBondContact CE1-O 3.41Å; G151-A153 VanDerWaalsContact C-N 3.34Å; G151-A153 PolarHBondContact O-N 2.8Å |
| 152 | K | 57.8 | Low | 55 | Low | 193 Ų | 193 | 138.2 Ų | 138.2 | 84% | 0.839 | 76% | 0.76 | S | S | * | * | trans | -69.2 | 95.3 | 169 | -87.9 | 56.8 | -178.9 | 179.7 | 0 | 107.5 | R154 | K152-R154 PolarHBondContact O-N 2.92Š| ||
| 153 | A | 56.9 | Low | 54.5 | Low | 47 Ų | 47 | 140.7 Ų | 140.7 | 39% | 0.388 | 77% | 0.767 | S | S | . | * | trans | -62.7 | 110.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 108 | Y149 G151 F155 | Y149-A153 HydrophobicContact CD1-CB 4.23Å; Y149-A153 HydrophobicContact CE1-CB 3.9Å; G151-A153 VanDerWaalsContact C-N 3.34Å; G151-A153 PolarHBondContact O-N 2.8Å; A153-F155 HydrophobicContact CB-CD2 3.82Å; A153-F155 HydrophobicContact CB-CE2 3.5Å; A153-F155 VanDerWaalsContact CB-CE2 3.5Å; A153-F155 HydrophobicContact CB-CZ 4.39Å; A153-F155 PolarHBondContact O-N 3.04Å | ||
| 154 | R | 56.9 | Low | 53.2 | Low | 233 Ų | 233 | 140 Ų | 140 | 88% | 0.879 | 76% | 0.763 | S | S | * | * | trans | -71.9 | 81.6 | 171.2 | -77.4 | 177.4 | 150.5 | 171.7 | -7.5 | 108.3 | K152 L156 | K152-R154 PolarHBondContact O-N 2.92Å; R154-L156 PolarHBondContact O-N 3.48Å | ||
| 155 | F | 58.6 | Low | 52 | Low | 179 Ų | 179 | 138.4 Ų | 138.4 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | trans | -73.7 | 111.7 | 159.6 | -69.7 | -84.2 | 0 | 0 | 0 | 106.2 | A153 | A153-F155 HydrophobicContact CB-CD2 3.82Å; A153-F155 HydrophobicContact CB-CE2 3.5Å; A153-F155 VanDerWaalsContact CB-CE2 3.5Å; A153-F155 HydrophobicContact CB-CZ 4.39Å; A153-F155 PolarHBondContact O-N 3.04Å | ||
| 156 | L | 51.1 | Low | 50.8 | Low | 150 Ų | 150 | 141.6 Ų | 141.6 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | S | Bend | trans | 98.9 | 139.3 | 173.6 | -49.3 | 176.1 | 0 | 0 | 0 | 116.9 | R154 | R154-L156 PolarHBondContact O-N 3.48Š|
| 157 | P | 48.7 | Very low | 49.6 | Very low | 123 Ų | 123 | 143.6 Ų | 143.6 | 80% | 0.799 | 77% | 0.77 | S | S | * | * | trans | -58.8 | 143.8 | 163.1 | -22 | 33.8 | 0 | 0 | 0 | 112.2 | E159 | P157-E159 PolarHBondContact O-N 3.27Å; P157-E159 VanDerWaalsContact O-N 3.1Å | ||
| 158 | A | 45.8 | Very low | 48.8 | Very low | 102 Ų | 102 | 142.7 Ų | 142.7 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -84.4 | 39.2 | -162.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 159 | E | 48 | Very low | 48 | Very low | 186 Ų | 186 | 147 Ų | 147 | 87% | 0.869 | 77% | 0.773 | S | S | * | * | trans | -108 | -1.7 | -174 | -146.4 | -177 | 164.9 | 0 | 0 | 116.7 | P157 | P157-E159 PolarHBondContact O-N 3.27Å; P157-E159 VanDerWaalsContact O-N 3.1Å | ||
| 160 | E | 49 | Very low | 47.2 | Very low | 188 Ų | 188 | 143.4 Ų | 143.4 | 88% | 0.879 | 77% | 0.773 | S | S | * | * | trans | -128.7 | 84 | 176.3 | -113.9 | -175.5 | 147.3 | 0 | 0 | 112 | ||||
| 161 | Q | 40.1 | Very low | 46.6 | Very low | 186 Ų | 186 | 146 Ų | 146 | 87% | 0.869 | 77% | 0.771 | S | S | * | * | trans | -106.2 | 105.6 | 159.6 | -79.9 | -100.3 | -58.9 | 0 | 0 | 107.6 | ||||
| 162 | P | 38.4 | Very low | 45.7 | Very low | 115 Ų | 115 | 153.6 Ų | 153.6 | 75% | 0.747 | 80% | 0.798 | S | S | * | * | trans | -77.5 | 122.2 | 157.6 | 29 | -27.3 | 0 | 0 | 0 | 108.5 | D164 | P162-D164 PolarHBondContact O-N 2.99Š| ||
| 163 | S | 43.7 | Very low | 45 | Very low | 118 Ų | 118 | 149.8 Ų | 149.8 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -54 | 130 | 160.7 | -76.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 164 | D | 32.6 | Very low | 44.4 | Very low | 162 Ų | 162 | 152.3 Ų | 152.3 | 87% | 0.866 | 81% | 0.81 | S | S | * | * | trans | -138.5 | 98.4 | 154.4 | -135.7 | -54.8 | 0 | 0 | 0 | 108.2 | P162 | P162-D164 PolarHBondContact O-N 2.99Š| ||
| 165 | S | 37.5 | Very low | 43.7 | Very low | 108 Ų | 108 | 149.7 Ų | 149.7 | 76% | 0.755 | 81% | 0.81 | S | S | * | * | trans | -99.5 | 114.4 | 165.3 | 178.3 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 166 | D | 34.8 | Very low | 43.3 | Very low | 127 Ų | 127 | 146.3 Ų | 146.3 | 68% | 0.679 | 81% | 0.808 | S | S | * | * | 165.2 | 153.6 | 112.7 | -156.3 | 30.6 | 0 | 0 | 0 | 111.9 | |||||
| 167 | E | 35.8 | Very low | 43.1 | Very low | 171 Ų | 171 | 144 Ų | 144 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | trans | 84.6 | 97.5 | 160.5 | -49 | -164.2 | 142 | 0 | 0 | 120.3 | ||||
| 168 | E | 47.2 | Very low | 43.4 | Very low | 181 Ų | 181 | 147.5 Ų | 147.5 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | trans | -37.9 | 138 | 148.4 | -70.6 | -87.5 | 154.5 | 0 | 0 | 113.8 | ||||
| 169 | E | 46.6 | Very low | 44 | Very low | 188 Ų | 188 | 151 Ų | 151 | 88% | 0.879 | 81% | 0.81 | S | S | * | * | trans | 132.9 | 83.1 | 151.8 | -164.8 | 162.6 | -141.7 | 0 | 0 | 113.1 | ||||
| 170 | S | 35.9 | Very low | 44.5 | Very low | 98 Ų | 98 | 153.7 Ų | 153.7 | 69% | 0.685 | 81% | 0.812 | S | S | * | * | trans | -178.8 | 57.5 | 148.7 | 47.3 | 0 | 0 | 0 | 0 | 110.6 | Q172 | S170-Q172 PolarHBondContact O-N 3.29Š| ||
| 171 | Q | 46.9 | Very low | 45.2 | Very low | 175 Ų | 175 | 155.8 Ų | 155.8 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | 101.1 | 159.2 | -64.2 | -172 | 12.8 | 0 | 0 | 107.6 | ||
| 172 | Q | 47.3 | Very low | 46.5 | Very low | 196 Ų | 196 | 153.5 Ų | 153.5 | 92% | 0.916 | 81% | 0.81 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 165.6 | -8.8 | 138.6 | -89.6 | 161.6 | -14.9 | 0 | 0 | 116.8 | S170 | S170-Q172 PolarHBondContact O-N 3.29Š|
| 173 | S | 43.3 | Very low | 48.1 | Very low | 112 Ų | 112 | 151.2 Ų | 151.2 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -117.8 | 13 | -167 | 60.3 | 0 | 0 | 0 | 0 | 118 | ||
| 174 | S | 43.7 | Very low | 49.8 | Very low | 101 Ų | 101 | 149.8 Ų | 149.8 | 71% | 0.706 | 78% | 0.776 | S | S | * | * | trans | -124.8 | 8.5 | -175.8 | 67.8 | 0 | 0 | 0 | 0 | 116.8 | S176 | S174-S176 VanDerWaalsContact C-N 3.3Å; S174-S176 PolarHBondContact O-N 3.12Å | ||
| 175 | M | 43 | Very low | 51.7 | Low | 177 Ų | 177 | 149.8 Ų | 149.8 | 87% | 0.872 | 77% | 0.769 | S | S | * | * | trans | -82.5 | 6.3 | -179.2 | -74.9 | -90.6 | -176.2 | 0 | 0 | 115 | ||||
| 176 | S | 48.9 | Very low | 53.8 | Low | 108 Ų | 108 | 151 Ų | 151 | 76% | 0.755 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -107.2 | 126.6 | 177.1 | 106.8 | 0 | 0 | 0 | 0 | 110.3 | S174 | S174-S176 VanDerWaalsContact C-N 3.3Å; S174-S176 PolarHBondContact O-N 3.12Å |
| 177 | A | 47.8 | Very low | 56 | Low | 101 Ų | 101 | 149.4 Ų | 149.4 | 84% | 0.835 | 75% | 0.751 | S | S | * | * | S | Bend | trans | 92.1 | -0.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||
| 178 | K | 54.2 | Low | 58.3 | Low | 198 Ų | 198 | 147.7 Ų | 147.7 | 86% | 0.861 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -116.5 | 5.2 | 177 | -75.3 | 172 | 179.2 | 172.6 | 0 | 117.2 | ||
| 179 | K | 59.6 | Low | 60.2 | Low | 176 Ų | 176 | 142.4 Ų | 142.4 | 77% | 0.765 | 72% | 0.716 | S | S | * | * | trans | -132.2 | 82.1 | 170.2 | -64.2 | -179.3 | -177.4 | 173.9 | 0 | 108.9 | R181 | K179-R181 PolarHBondContact O-N 3.24Š| ||
| 180 | R | 57.6 | Low | 62.2 | Low | 241 Ų | 241 | 139.2 Ų | 139.2 | 91% | 0.909 | 70% | 0.699 | S | S | * | * | trans | -63.6 | 90.6 | 161.5 | -82.4 | -172 | -66.7 | 151.6 | 0.2 | 106.4 | V182 | R180-V182 PolarHBondContact O-N 3.29Š| ||
| 181 | R | 64.9 | Low | 64.6 | Low | 233 Ų | 233 | 141.9 Ų | 141.9 | 88% | 0.879 | 69% | 0.694 | S | S | * | * | trans | -52.8 | 115.7 | 165.5 | -86.4 | -176 | 167.8 | 165.6 | -2.7 | 105.9 | K179 E183 | K179-R181 PolarHBondContact O-N 3.24Å; R181-E183 PolarHBondContact O-N 3.06Å; R181-E183 VanDerWaalsContact O-N 3.09Å | ||
| 182 | V | 65.9 | Low | 66.5 | Low | 138 Ų | 138 | 140.8 Ų | 140.8 | 84% | 0.836 | 69% | 0.687 | S | S | * | * | trans | -57.5 | 115.7 | 170.9 | 175.7 | 0 | 0 | 0 | 0 | 106 | R180 T184 | R180-V182 PolarHBondContact O-N 3.29Å; V182-T184 PolarHBondContact O-N 3.12Å | ||
| 183 | E | 72.9 | Confident | 68.3 | Low | 66 Ų | 66 | 137.5 Ų | 137.5 | 31% | 0.308 | 67% | 0.666 | S | S | . | * | trans | -55.6 | 133.4 | 175.4 | -84 | -171.2 | 143.6 | 0 | 0 | 108.5 | R181 Q187 R191 | R181-E183 PolarHBondContact O-N 3.06Å; R181-E183 VanDerWaalsContact O-N 3.09Å; E183-Q187 HydrophobicContact CB-CB 4.23Å; E183-Q187 HydrophobicContact CB-CG 4.21Å; E183-Q187 HydrophobicContact CG-CG 3.97Å; E183-Q187 PolarHBondContact OE1-NE2 3.17Å; E183-R191 VanDerWaalsContact CD-NH1 3.28Å; E183-R191 IonicContact OE1-NH1 3.03Å; E183-R191 PolarHBondContact OE1-NH1 2.9Å; E183-R191 IonicContact OE2-CZ 3.97Å; E183-R191 IonicContact OE2-NH1 2.9Å; E183-R191 PolarHBondContact OE2-NH1 3.46Å | ||
| 184 | T | 79.1 | Confident | 70.2 | Confident | 88 Ų | 88 | 135.8 Ų | 135.8 | 54% | 0.54 | 65% | 0.648 | S | S | . | * | trans | -61.3 | 153 | 178.1 | 61.2 | 0 | 0 | 0 | 0 | 109.7 | V182 Q186 Q187 K188 | V182-T184 PolarHBondContact O-N 3.12Å; T184-Q186 PolarHBondContact O-N 3.46Å; T184-Q186 VanDerWaalsContact O-N 3.16Å; T184-Q187 WeakPolarHBondContact O-CA 3.44Å; T184-Q187 WeakPolarHBondContact O-CB 3.37Å; T184-Q187 PolarHBondContact O-N 2.84Å; T184-Q187 WeakPolarHBondContact OG1-CB 3.43Å; T184-Q187 PolarHBondContact OG1-N 3Å; T184-K188 PolarHBondContact O-N 2.96Å | ||
| 185 | F | 72.2 | Confident | 71.8 | Confident | 163 Ų | 163 | 136.5 Ų | 136.5 | 72% | 0.715 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -51.1 | -41.9 | -179.6 | 177.8 | -95.6 | 0 | 0 | 0 | 112.2 | Q187 K188 E189 | F185-Q187 VanDerWaalsContact C-N 3.35Å; F185-Q187 PolarHBondContact O-N 3.49Å; F185-K188 PolarHBondContact O-N 3.26Å; F185-E189 WeakPolarHBondContact O-CB 3.42Å; F185-E189 PolarHBondContact O-N 2.83Å |
| 186 | Q | 81.8 | Confident | 73.4 | Confident | 132 Ų | 132 | 130.1 Ų | 130.1 | 62% | 0.617 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -62.3 | -39 | 175.8 | -66.3 | -66.6 | 1.9 | 0 | 0 | 113.1 | T184 K190 | T184-Q186 PolarHBondContact O-N 3.46Å; T184-Q186 VanDerWaalsContact O-N 3.16Å; Q186-K190 VanDerWaalsContact O-CB 3.28Å; Q186-K190 WeakPolarHBondContact O-CB 3.49Å; Q186-K190 PolarHBondContact O-N 3.16Å |
| 187 | Q | 82.2 | Confident | 74.4 | Confident | 94 Ų | 94 | 131.1 Ų | 131.1 | 44% | 0.439 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -69.4 | -39.7 | 176.5 | -171.2 | 172.3 | -1.9 | 0 | 0 | 111.3 | E183 T184 F185 R191 | E183-Q187 HydrophobicContact CB-CB 4.23Å; E183-Q187 HydrophobicContact CB-CG 4.21Å; E183-Q187 HydrophobicContact CG-CG 3.97Å; E183-Q187 PolarHBondContact OE1-NE2 3.17Å; T184-Q187 WeakPolarHBondContact O-CA 3.44Å; T184-Q187 WeakPolarHBondContact O-CB 3.37Å; T184-Q187 PolarHBondContact O-N 2.84Å; T184-Q187 WeakPolarHBondContact OG1-CB 3.43Å; T184-Q187 PolarHBondContact OG1-N 3Å; F185-Q187 VanDerWaalsContact C-N 3.35Å; F185-Q187 PolarHBondContact O-N 3.49Å; Q187-R191 VanDerWaalsContact O-CB 3.28Å; Q187-R191 WeakPolarHBondContact O-CB 3.12Å; Q187-R191 PolarHBondContact O-N 3.19Å |
| 188 | K | 83.4 | Confident | 75.4 | Confident | 135 Ų | 135 | 129.7 Ų | 129.7 | 59% | 0.587 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -67.7 | -40.3 | 175.1 | -169.1 | 174.3 | -178.7 | -179.7 | 0 | 112 | T184 F185 R191 K192 | T184-K188 PolarHBondContact O-N 2.96Å; F185-K188 PolarHBondContact O-N 3.26Å; K188-R191 PolarHBondContact O-N 3.45Å; K188-K192 WeakPolarHBondContact O-CG 3.21Å; K188-K192 PolarHBondContact O-N 2.9Å |
| 189 | E | 86.7 | Confident | 76 | Confident | 70 Ų | 70 | 123.3 Ų | 123.3 | 33% | 0.327 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.6 | -47 | 175.3 | -169.2 | -161.4 | 136.4 | 0 | 0 | 111.2 | F185 R191 K192 R193 | F185-E189 WeakPolarHBondContact O-CB 3.42Å; F185-E189 PolarHBondContact O-N 2.83Å; E189-R191 PolarHBondContact O-N 3.35Å; E189-K192 PolarHBondContact O-N 2.73Å; E189-R193 PolarHBondContact O-N 2.81Å; E189-R193 IonicContact OE1-CZ 2.73Å; E189-R193 IonicContact OE1-NH2 3.8Å; E189-R193 PolarHBondContact OE1-NH2 2.91Å |
| 190 | K | 89.6 | Confident | 76.2 | Confident | 122 Ų | 122 | 117.2 Ų | 117.2 | 53% | 0.53 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -57.8 | -47.6 | 173.7 | -176.1 | 179.6 | 178.5 | -176.4 | 0 | 111.2 | Q186 K192 R193 D194 | Q186-K190 VanDerWaalsContact O-CB 3.28Å; Q186-K190 WeakPolarHBondContact O-CB 3.49Å; Q186-K190 PolarHBondContact O-N 3.16Å; K190-K192 VanDerWaalsContact C-N 3.3Å; K190-K192 PolarHBondContact O-N 2.9Å; K190-R193 PolarHBondContact O-N 3.25Å; K190-R193 VanDerWaalsContact O-N 3.16Å; K190-D194 WeakPolarHBondContact CE-OD2 3.28Å; K190-D194 WeakPolarHBondContact O-CB 3.11Å; K190-D194 PolarHBondContact O-N 3.44Å |
| 191 | R | 85.6 | Confident | 76.4 | Confident | 153 Ų | 153 | 111.3 Ų | 111.3 | 58% | 0.577 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -59.7 | -39 | 177.4 | -167.5 | -179.6 | -161.3 | 143.4 | 6.2 | 112.3 | E183 Q187 K188 E189 L195 | E183-R191 VanDerWaalsContact CD-NH1 3.28Å; E183-R191 IonicContact OE1-NH1 3.03Å; E183-R191 PolarHBondContact OE1-NH1 2.9Å; E183-R191 IonicContact OE2-CZ 3.97Å; E183-R191 IonicContact OE2-NH1 2.9Å; E183-R191 PolarHBondContact OE2-NH1 3.46Å; Q187-R191 VanDerWaalsContact O-CB 3.28Å; Q187-R191 WeakPolarHBondContact O-CB 3.12Å; Q187-R191 PolarHBondContact O-N 3.19Å; K188-R191 PolarHBondContact O-N 3.45Å; E189-R191 PolarHBondContact O-N 3.35Å; R191-L195 WeakPolarHBondContact O-CB 3.45Å; R191-L195 PolarHBondContact O-N 3.48Å |
| 192 | K | 86.4 | Confident | 76.4 | Confident | 152 Ų | 152 | 108.1 Ų | 108.1 | 66% | 0.661 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -68.1 | -39.8 | 175.3 | -76.9 | -170.5 | 72.7 | -173.8 | 0 | 112.5 | K188 E189 K190 G196 | K188-K192 WeakPolarHBondContact O-CG 3.21Å; K188-K192 PolarHBondContact O-N 2.9Å; E189-K192 PolarHBondContact O-N 2.73Å; K190-K192 VanDerWaalsContact C-N 3.3Å; K190-K192 PolarHBondContact O-N 2.9Å; K192-G196 PolarHBondContact O-N 3.24Å |
| 193 | R | 86.6 | Confident | 76.9 | Confident | 128 Ų | 128 | 105.2 Ų | 105.2 | 48% | 0.483 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.2 | -51.2 | 174.9 | -176.3 | -170.8 | -67.5 | 105.2 | 3.3 | 110.9 | E189 K190 L195 G196 Q197 | E189-R193 PolarHBondContact O-N 2.81Å; E189-R193 IonicContact OE1-CZ 2.73Å; E189-R193 IonicContact OE1-NH2 3.8Å; E189-R193 PolarHBondContact OE1-NH2 2.91Å; K190-R193 PolarHBondContact O-N 3.25Å; K190-R193 VanDerWaalsContact O-N 3.16Å; R193-L195 VanDerWaalsContact C-N 3.32Å; R193-L195 PolarHBondContact O-N 3.16Å; R193-G196 PolarHBondContact O-N 3.31Å; R193-Q197 PolarHBondContact O-N 2.93Å |
| 194 | D | 82.8 | Confident | 76.7 | Confident | 76 Ų | 76 | 108 Ų | 108 | 41% | 0.406 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64 | -38.8 | -179.2 | -68.7 | -4.9 | 0 | 0 | 0 | 110.8 | K190 Q197 A198 | K190-D194 WeakPolarHBondContact CE-OD2 3.28Å; K190-D194 WeakPolarHBondContact O-CB 3.11Å; K190-D194 PolarHBondContact O-N 3.44Å; D194-Q197 PolarHBondContact O-N 2.93Å; D194-A198 WeakPolarHBondContact O-CB 3.38Å; D194-A198 PolarHBondContact O-N 3.12Å |
| 195 | L | 76.9 | Confident | 76.6 | Confident | 116 Ų | 116 | 107.6 Ų | 107.6 | 61% | 0.607 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66.6 | -41.5 | 175.9 | -172 | 68.4 | 0 | 0 | 0 | 112.1 | R191 R193 A198 T199 | R191-L195 WeakPolarHBondContact O-CB 3.45Å; R191-L195 PolarHBondContact O-N 3.48Å; R193-L195 VanDerWaalsContact C-N 3.32Å; R193-L195 PolarHBondContact O-N 3.16Å; L195-A198 PolarHBondContact O-N 2.83Å; L195-T199 WeakPolarHBondContact O-CG2 3.37Å; L195-T199 PolarHBondContact O-N 3.39Å; L195-T199 PolarHBondContact O-OG1 3.44Å; L195-T199 VanDerWaalsContact O-OG1 3.12Å |
| 196 | G | 77.2 | Confident | 76.9 | Confident | 42 Ų | 42 | 105.1 Ų | 105.1 | 43% | 0.433 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.1 | -40.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | K192 R193 T199 S200 | K192-G196 PolarHBondContact O-N 3.24Å; R193-G196 PolarHBondContact O-N 3.31Å; G196-T199 PolarHBondContact O-OG1 3.46Å; G196-S200 PolarHBondContact O-N 3.19Å |
| 197 | Q | 69.8 | Low | 76.7 | Confident | 129 Ų | 129 | 103.5 Ų | 103.5 | 60% | 0.603 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -69 | -42.6 | 173.8 | -80.6 | -173.9 | -14.4 | 0 | 0 | 112.3 | R193 D194 T199 S200 | R193-Q197 PolarHBondContact O-N 2.93Å; D194-Q197 PolarHBondContact O-N 2.93Å; Q197-T199 PolarHBondContact O-N 3.23Å; Q197-T199 VanDerWaalsContact O-N 3.12Å; Q197-S200 PolarHBondContact O-N 3.03Å; Q197-S200 PolarHBondContact O-OG 3.41Å |
| 198 | A | 69 | Low | 76.7 | Confident | 71 Ų | 71 | 103.6 Ų | 103.6 | 59% | 0.587 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65.1 | -17.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | D194 L195 | D194-A198 WeakPolarHBondContact O-CB 3.38Å; D194-A198 PolarHBondContact O-N 3.12Å; L195-A198 PolarHBondContact O-N 2.83Å |
| 199 | T | 66.3 | Low | 76.8 | Confident | 65 Ų | 65 | 103.2 Ų | 103.2 | 40% | 0.399 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102 | -1.8 | 174.5 | 58.4 | 0 | 0 | 0 | 0 | 114.2 | L195 G196 Q197 D201 K202 N203 | L195-T199 WeakPolarHBondContact O-CG2 3.37Å; L195-T199 PolarHBondContact O-N 3.39Å; L195-T199 PolarHBondContact O-OG1 3.44Å; L195-T199 VanDerWaalsContact O-OG1 3.12Å; G196-T199 PolarHBondContact O-OG1 3.46Å; Q197-T199 PolarHBondContact O-N 3.23Å; Q197-T199 VanDerWaalsContact O-N 3.12Å; T199-D201 PolarHBondContact O-N 3.44Å; T199-K202 WeakPolarHBondContact O-CB 3.43Å; T199-K202 PolarHBondContact O-N 2.86Å; T199-N203 PolarHBondContact O-N 3.45Å |
| 200 | S | 62.7 | Low | 76.6 | Confident | 47 Ų | 47 | 107.8 Ų | 107.8 | 33% | 0.329 | 52% | 0.524 | S | S | . | . | G | 310 helix | trans | -59.7 | -37.6 | -179.6 | 64.5 | 0 | 0 | 0 | 0 | 111.4 | G196 Q197 K202 N203 | G196-S200 PolarHBondContact O-N 3.19Å; Q197-S200 PolarHBondContact O-N 3.03Å; Q197-S200 PolarHBondContact O-OG 3.41Å; S200-K202 PolarHBondContact O-N 3.21Å; S200-N203 WeakPolarHBondContact O-CB 3.38Å; S200-N203 PolarHBondContact O-N 2.87Å |
| 201 | D | 62.3 | Low | 76.3 | Confident | 117 Ų | 117 | 105.1 Ų | 105.1 | 63% | 0.626 | 52% | 0.515 | S | S | * | . | G | 310 helix | trans | -74.1 | -10.6 | 178.6 | -62.2 | -19.6 | 0 | 0 | 0 | 113.4 | T199 N203 | T199-D201 PolarHBondContact O-N 3.44Å; D201-N203 VanDerWaalsContact C-N 3.35Å |
| 202 | K | 65.8 | Low | 76.1 | Confident | 167 Ų | 167 | 103.1 Ų | 103.1 | 73% | 0.726 | 52% | 0.515 | S | S | * | . | G | 310 helix | trans | -92.7 | 0.5 | 171 | -59.5 | -178.7 | -177.2 | 177.9 | 0 | 112.1 | T199 S200 F204 | T199-K202 WeakPolarHBondContact O-CB 3.43Å; T199-K202 PolarHBondContact O-N 2.86Å; S200-K202 PolarHBondContact O-N 3.21Å; K202-F204 VanDerWaalsContact C-N 3.29Å; K202-F204 PolarHBondContact O-N 2.92Å |
| 203 | N | 74.9 | Confident | 75.9 | Confident | 77 Ų | 77 | 105.3 Ų | 105.3 | 41% | 0.412 | 52% | 0.519 | S | S | . | . | trans | -74.9 | 90.1 | 174 | -165 | -3.7 | 0 | 0 | 0 | 107.8 | T199 S200 D201 V205 E206 E207 | T199-N203 PolarHBondContact O-N 3.45Å; S200-N203 WeakPolarHBondContact O-CB 3.38Å; S200-N203 PolarHBondContact O-N 2.87Å; D201-N203 VanDerWaalsContact C-N 3.35Å; N203-V205 PolarHBondContact O-N 3.35Å; N203-E206 HydrophobicContact CB-CB 4.45Å; N203-E206 PolarHBondContact O-N 3.43Å; N203-E207 PolarHBondContact O-N 3.4Å; N203-E207 VanDerWaalsContact O-N 3.11Å | ||
| 204 | F | 69.3 | Low | 75.4 | Confident | 123 Ų | 123 | 105.7 Ų | 105.7 | 54% | 0.539 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -41.1 | -37.2 | -178.6 | -177.4 | -99.9 | 0 | 0 | 0 | 113 | K202 E207 E208 | K202-F204 VanDerWaalsContact C-N 3.29Å; K202-F204 PolarHBondContact O-N 2.92Å; F204-E207 PolarHBondContact O-N 2.91Å; F204-E208 HydrophobicContact CD1-CG 4.22Å; F204-E208 HydrophobicContact CE1-CG 3.86Å; F204-E208 VanDerWaalsContact CE1-OE1 3.29Å; F204-E208 WeakPolarHBondContact CE1-OE1 3.31Å; F204-E208 HydrophobicContact CE2-CG 4.37Å; F204-E208 HydrophobicContact CZ-CG 3.94Å; F204-E208 WeakPolarHBondContact CZ-OE1 3.48Å; F204-E208 WeakPolarHBondContact O-CB 3.3Å; F204-E208 WeakPolarHBondContact O-CG 3.42Å; F204-E208 PolarHBondContact O-N 2.92Å |
| 205 | V | 77.1 | Confident | 75.1 | Confident | 81 Ų | 81 | 109.7 Ų | 109.7 | 49% | 0.491 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.4 | -38.4 | 178.5 | 179.9 | 0 | 0 | 0 | 0 | 113.3 | N203 K209 | N203-V205 PolarHBondContact O-N 3.35Å; V205-K209 WeakPolarHBondContact O-CG 3.36Å; V205-K209 PolarHBondContact O-N 3.11Å |
| 206 | E | 78.8 | Confident | 75 | Confident | 111 Ų | 111 | 110.4 Ų | 110.4 | 52% | 0.519 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -77 | -36.2 | 176.3 | -69.7 | -171 | 168.8 | 0 | 0 | 111.5 | N203 K209 R210 | N203-E206 HydrophobicContact CB-CB 4.45Å; N203-E206 PolarHBondContact O-N 3.43Å; E206-K209 PolarHBondContact O-N 3.33Å; E206-R210 WeakPolarHBondContact O-CB 3.48Å; E206-R210 PolarHBondContact O-N 2.88Å |
| 207 | E | 78.1 | Confident | 73.9 | Confident | 97 Ų | 97 | 119.3 Ų | 119.3 | 45% | 0.453 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -63 | -46.2 | 173.5 | -170.1 | -177.8 | -161.3 | 0 | 0 | 111.5 | N203 F204 K209 R210 I211 | N203-E207 PolarHBondContact O-N 3.4Å; N203-E207 VanDerWaalsContact O-N 3.11Å; F204-E207 PolarHBondContact O-N 2.91Å; E207-K209 PolarHBondContact O-N 3.15Å; E207-R210 WeakPolarHBondContact O-CB 3.37Å; E207-R210 PolarHBondContact O-N 3.4Å; E207-R210 VanDerWaalsContact O-N 3.11Å; E207-I211 HydrophobicContact CG-CD1 3.97Å; E207-I211 VanDerWaalsContact O-CG1 3.31Å; E207-I211 WeakPolarHBondContact O-CG1 3.44Å; E207-I211 PolarHBondContact O-N 3.41Å |
| 208 | E | 82.4 | Confident | 74.1 | Confident | 97 Ų | 97 | 118.8 Ų | 118.8 | 45% | 0.453 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -61 | -43 | 175.1 | -77.7 | -162 | 141.3 | 0 | 0 | 112 | F204 R210 I211 L212 | F204-E208 HydrophobicContact CD1-CG 4.22Å; F204-E208 HydrophobicContact CE1-CG 3.86Å; F204-E208 VanDerWaalsContact CE1-OE1 3.29Å; F204-E208 WeakPolarHBondContact CE1-OE1 3.31Å; F204-E208 HydrophobicContact CE2-CG 4.37Å; F204-E208 HydrophobicContact CZ-CG 3.94Å; F204-E208 WeakPolarHBondContact CZ-OE1 3.48Å; F204-E208 WeakPolarHBondContact O-CB 3.3Å; F204-E208 WeakPolarHBondContact O-CG 3.42Å; F204-E208 PolarHBondContact O-N 2.92Å; E208-R210 VanDerWaalsContact C-N 3.28Å; E208-R210 PolarHBondContact O-N 2.99Å; E208-I211 PolarHBondContact O-N 3.48Å; E208-L212 WeakPolarHBondContact O-CB 3.33Å; E208-L212 WeakPolarHBondContact O-CG 3.37Å; E208-L212 PolarHBondContact O-N 2.99Å |
| 209 | K | 85.6 | Confident | 74.3 | Confident | 127 Ų | 127 | 121.3 Ų | 121.3 | 55% | 0.552 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.8 | -36.7 | 174.4 | -82.6 | 179.2 | 173.8 | 174.4 | 0 | 112.2 | V205 E206 E207 R213 | V205-K209 WeakPolarHBondContact O-CG 3.36Å; V205-K209 PolarHBondContact O-N 3.11Å; E206-K209 PolarHBondContact O-N 3.33Å; E207-K209 PolarHBondContact O-N 3.15Å; K209-R213 VanDerWaalsContact O-CG 3.3Å; K209-R213 WeakPolarHBondContact O-CG 3.42Å; K209-R213 PolarHBondContact O-N 2.87Å; K209-R213 VanDerWaalsContact O-N 3.15Å |
| 210 | R | 82.6 | Confident | 74.8 | Confident | 166 Ų | 166 | 124.4 Ų | 124.4 | 63% | 0.626 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67.2 | -48.1 | 176 | -171.6 | -177.5 | -161.4 | 143.8 | 3.1 | 111.1 | E206 E207 E208 L212 R213 Q214 | E206-R210 WeakPolarHBondContact O-CB 3.48Å; E206-R210 PolarHBondContact O-N 2.88Å; E207-R210 WeakPolarHBondContact O-CB 3.37Å; E207-R210 PolarHBondContact O-N 3.4Å; E207-R210 VanDerWaalsContact O-N 3.11Å; E208-R210 VanDerWaalsContact C-N 3.28Å; E208-R210 PolarHBondContact O-N 2.99Å; R210-L212 VanDerWaalsContact C-N 3.32Å; R210-L212 PolarHBondContact O-N 2.82Å; R210-R213 PolarHBondContact O-N 3.47Å; R210-Q214 PolarHBondContact O-N 3.38Å |
| 211 | I | 82.2 | Confident | 75.5 | Confident | 65 Ų | 65 | 129 Ų | 129 | 33% | 0.333 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -60.4 | -42.8 | 177.6 | -68 | 164.5 | 0 | 0 | 0 | 110.8 | E207 E208 R213 Q214 K215 | E207-I211 HydrophobicContact CG-CD1 3.97Å; E207-I211 VanDerWaalsContact O-CG1 3.31Å; E207-I211 WeakPolarHBondContact O-CG1 3.44Å; E207-I211 PolarHBondContact O-N 3.41Å; E208-I211 PolarHBondContact O-N 3.48Å; I211-R213 VanDerWaalsContact C-N 3.33Å; I211-R213 PolarHBondContact O-N 2.95Å; I211-Q214 PolarHBondContact O-N 3.18Å; I211-K215 HydrophobicContact CG2-CD 3.97Å; I211-K215 HydrophobicContact CG2-CG 4.35Å; I211-K215 WeakPolarHBondContact O-CB 3.28Å; I211-K215 WeakPolarHBondContact O-CG 3.37Å; I211-K215 PolarHBondContact O-N 3.02Å |
| 212 | L | 80.6 | Confident | 76.3 | Confident | 112 Ų | 112 | 129.8 Ų | 129.8 | 59% | 0.586 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -61.2 | -40.7 | 176.1 | -83.5 | 162.6 | 0 | 0 | 0 | 112.1 | E208 R210 K215 V216 | E208-L212 WeakPolarHBondContact O-CB 3.33Å; E208-L212 WeakPolarHBondContact O-CG 3.37Å; E208-L212 PolarHBondContact O-N 2.99Å; R210-L212 VanDerWaalsContact C-N 3.32Å; R210-L212 PolarHBondContact O-N 2.82Å; L212-K215 PolarHBondContact O-N 3.25Å; L212-V216 WeakPolarHBondContact O-CG2 3.2Å; L212-V216 PolarHBondContact O-N 2.87Å |
| 213 | R | 83.6 | Confident | 77 | Confident | 197 Ų | 197 | 127.3 Ų | 127.3 | 74% | 0.743 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -66.6 | -37.7 | 174.8 | -70.9 | 168.9 | -174 | -90.2 | 1.3 | 112.1 | K209 R210 I211 V216 | K209-R213 VanDerWaalsContact O-CG 3.3Å; K209-R213 WeakPolarHBondContact O-CG 3.42Å; K209-R213 PolarHBondContact O-N 2.87Å; K209-R213 VanDerWaalsContact O-N 3.15Å; R210-R213 PolarHBondContact O-N 3.47Å; I211-R213 VanDerWaalsContact C-N 3.33Å; I211-R213 PolarHBondContact O-N 2.95Å; R213-V216 PolarHBondContact O-N 2.81Å |
| 214 | Q | 75.9 | Confident | 77.2 | Confident | 136 Ų | 136 | 130.9 Ų | 130.9 | 64% | 0.636 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -72.1 | -27.2 | 179.1 | -127.7 | -179.7 | -12 | 0 | 0 | 113.5 | R210 I211 | R210-Q214 PolarHBondContact O-N 3.38Å; I211-Q214 PolarHBondContact O-N 3.18Å |
| 215 | K | 77.1 | Confident | 77.8 | Confident | 161 Ų | 161 | 131.5 Ų | 131.5 | 70% | 0.7 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -13.7 | 176.7 | -76.5 | 178.1 | 177.2 | 172.7 | 0 | 114 | I211 L212 | I211-K215 HydrophobicContact CG2-CD 3.97Å; I211-K215 HydrophobicContact CG2-CG 4.35Å; I211-K215 WeakPolarHBondContact O-CB 3.28Å; I211-K215 WeakPolarHBondContact O-CG 3.37Å; I211-K215 PolarHBondContact O-N 3.02Å; L212-K215 PolarHBondContact O-N 3.25Å |
| 216 | V | 72.8 | Confident | 77.8 | Confident | 131 Ų | 131 | 135.7 Ų | 135.7 | 79% | 0.794 | 62% | 0.622 | S | S | * | * | trans | -87.1 | -14.2 | 179.5 | 169.6 | 0 | 0 | 0 | 0 | 111.4 | L212 R213 | L212-V216 WeakPolarHBondContact O-CG2 3.2Å; L212-V216 PolarHBondContact O-N 2.87Å; R213-V216 PolarHBondContact O-N 2.81Å | ||
| 217 | E | 54 | Low | 77.7 | Confident | 228 Ų | 228 | 137.9 Ų | 137.9 | 100% | 1.065 | 63% | 0.631 | S | S | * | * | trans | -91.9 | 0 | 168 | -163 | 172.5 | -154.3 | 0 | 0 | 110.5 |
Retrieved 217 of 217 residues in 304.8 ms
(Link to these results)