| 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 | 41.8 | Very low | 37.1 | Very low | 238 Ų | 238 | 154 Ų | 154 | 100% | 1.172 | 84% | 0.84 | S | S | * | * | 0 | 122.4 | 0 | -79 | 151.4 | 66 | 0 | 0 | 107.8 | |||||
| 2 | V | 31.3 | Very low | 36.9 | Very low | 132 Ų | 132 | 157.3 Ų | 157.3 | 80% | 0.8 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -102.8 | 118.9 | 179.9 | 178.1 | 0 | 0 | 0 | 0 | 107.4 | ||
| 3 | I | 44.1 | Very low | 36.5 | Very low | 162 Ų | 162 | 159 Ų | 159 | 83% | 0.831 | 85% | 0.852 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 124.2 | 175.9 | -63.8 | 174.3 | 0 | 0 | 0 | 107.7 | ||
| 4 | W | 37.2 | Very low | 36.2 | Very low | 234 Ų | 234 | 152.3 Ų | 152.3 | 89% | 0.886 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 147.3 | 177.7 | -90.9 | 48.6 | 0 | 0 | 0 | 111.9 | ||
| 5 | V | 38.8 | Very low | 35.9 | Very low | 115 Ų | 115 | 151.6 Ų | 151.6 | 70% | 0.697 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 144.7 | 175.5 | 173.3 | 0 | 0 | 0 | 0 | 110.3 | L7 | V5-L7 HydrophobicContact CG1-CB 3.93Š|
| 6 | N | 38 | Very low | 35.7 | Very low | 166 Ų | 166 | 149.6 Ų | 149.6 | 89% | 0.888 | 84% | 0.841 | S | S | * | * | trans | -124.9 | 109.1 | 151.6 | -99.5 | -54.8 | 0 | 0 | 0 | 109.4 | ||||
| 7 | L | 34.6 | Very low | 35.4 | Very low | 144 Ų | 144 | 145.2 Ų | 145.2 | 75% | 0.754 | 84% | 0.837 | S | S | * | * | trans | -107.5 | 103.6 | 178 | -179.6 | 76.2 | 0 | 0 | 0 | 106.9 | V5 | V5-L7 HydrophobicContact CG1-CB 3.93Š| ||
| 8 | S | 39.3 | Very low | 35.3 | Very low | 119 Ų | 119 | 147.5 Ų | 147.5 | 83% | 0.832 | 85% | 0.845 | S | S | * | * | trans | -96.6 | 101.7 | 174.4 | -63.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 9 | L | 36.6 | Very low | 35.2 | Very low | 144 Ų | 144 | 145.8 Ų | 145.8 | 75% | 0.754 | 84% | 0.843 | S | S | * | * | trans | -92.5 | 164.9 | 167.6 | -151.1 | 91.4 | 0 | 0 | 0 | 109.7 | ||||
| 10 | L | 34.6 | Very low | 35.1 | Very low | 168 Ų | 168 | 143.2 Ų | 143.2 | 88% | 0.88 | 84% | 0.839 | S | S | * | * | trans | 102.3 | 132.5 | 155.8 | -138.6 | 75.5 | 0 | 0 | 0 | 118.7 | ||||
| 11 | G | 31.4 | Very low | 34.9 | Very low | 72 Ų | 72 | 141.2 Ų | 141.2 | 74% | 0.742 | 83% | 0.833 | S | S | * | * | trans | 115.1 | 112.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 12 | E | 34.4 | Very low | 34.6 | Very low | 193 Ų | 193 | 136.8 Ų | 136.8 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | cis | -159.4 | 161.8 | -16.8 | -136.4 | 171.4 | -160.2 | 0 | 0 | 109.5 | ||||
| 13 | L | 32.8 | Very low | 34.9 | Very low | 180 Ų | 180 | 139.4 Ų | 139.4 | 94% | 0.942 | 81% | 0.814 | S | S | * | * | trans | -78 | 137.3 | 174.9 | -110.9 | 72.8 | 0 | 0 | 0 | 110.6 | ||||
| 14 | G | 31.2 | Very low | 34.5 | Very low | 65 Ų | 65 | 138.3 Ų | 138.3 | 67% | 0.67 | 81% | 0.81 | S | S | * | * | trans | -167 | 73.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 15 | T | 32.8 | Very low | 34.4 | Very low | 142 Ų | 142 | 136.4 Ų | 136.4 | 87% | 0.871 | 81% | 0.813 | S | S | * | * | trans | 54.5 | 129.7 | 147.5 | 52.6 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 16 | S | 32.9 | Very low | 34.2 | Very low | 119 Ų | 119 | 139.8 Ų | 139.8 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | trans | -49.1 | 140.2 | 162.9 | 51.2 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 17 | G | 30.5 | Very low | 34.2 | Very low | 75 Ų | 75 | 140.9 Ų | 140.9 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | trans | -147.1 | 88.1 | 167.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S19 | G17-S19 PolarHBondContact O-N 3.21Š| ||
| 18 | L | 33.9 | Very low | 34.5 | Very low | 187 Ų | 187 | 139.2 Ų | 139.2 | 98% | 0.979 | 82% | 0.819 | S | S | * | * | trans | -67.8 | 118.4 | 167.9 | -74 | 165.7 | 0 | 0 | 0 | 109.1 | ||||
| 19 | S | 32.9 | Very low | 34.4 | Very low | 116 Ų | 116 | 138.6 Ų | 138.6 | 81% | 0.811 | 81% | 0.814 | S | S | * | * | trans | -128 | 90.2 | 168.8 | -168.1 | 0 | 0 | 0 | 0 | 110.1 | G17 S21 | G17-S19 PolarHBondContact O-N 3.21Å; S19-S21 PolarHBondContact O-N 3.21Å | ||
| 20 | A | 32.3 | Very low | 34.5 | Very low | 93 Ų | 93 | 140.4 Ų | 140.4 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | trans | -73.7 | 105.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 109 | L22 | A20-L22 VanDerWaalsContact C-N 3.32Å; A20-L22 PolarHBondContact O-N 3.37Å | ||
| 21 | S | 30.6 | Very low | 34.4 | Very low | 101 Ų | 101 | 139.7 Ų | 139.7 | 71% | 0.706 | 81% | 0.814 | S | S | * | * | trans | -80.4 | 80.6 | 175.5 | -159.9 | 0 | 0 | 0 | 0 | 110.8 | S19 K23 | S19-S21 PolarHBondContact O-N 3.21Å; S21-K23 PolarHBondContact O-N 3.32Å; S21-K23 VanDerWaalsContact O-N 3.14Å | ||
| 22 | L | 36.8 | Very low | 34.5 | Very low | 146 Ų | 146 | 143.9 Ų | 143.9 | 76% | 0.764 | 81% | 0.812 | S | S | * | * | trans | -66.6 | 103.4 | 165.9 | -89.2 | 165 | 0 | 0 | 0 | 109.6 | A20 | A20-L22 VanDerWaalsContact C-N 3.32Å; A20-L22 PolarHBondContact O-N 3.37Å | ||
| 23 | K | 36.7 | Very low | 34.4 | Very low | 187 Ų | 187 | 141 Ų | 141 | 81% | 0.813 | 81% | 0.811 | S | S | * | * | trans | -98.5 | 85.4 | 165.5 | -77.4 | -170.3 | 176.6 | -178.6 | 0 | 110.6 | S21 | S21-K23 PolarHBondContact O-N 3.32Å; S21-K23 VanDerWaalsContact O-N 3.14Å | ||
| 24 | N | 37.3 | Very low | 34.4 | Very low | 138 Ų | 138 | 140.1 Ų | 140.1 | 74% | 0.738 | 80% | 0.802 | S | S | * | * | trans | -73.3 | 121.4 | 157.7 | -66.5 | -31.6 | 0 | 0 | 0 | 108.4 | ||||
| 25 | M | 33.1 | Very low | 34.6 | Very low | 194 Ų | 194 | 142.6 Ų | 142.6 | 96% | 0.956 | 81% | 0.809 | S | S | * | * | trans | -144.5 | 95.4 | 156.8 | -86.8 | -147.3 | 176.4 | 0 | 0 | 110 | ||||
| 26 | E | 36.1 | Very low | 34.6 | Very low | 187 Ų | 187 | 144 Ų | 144 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -105.8 | 122.6 | 161.9 | 179.9 | -178.1 | -152.4 | 0 | 0 | 107.2 | ||||
| 27 | Q | 38.5 | Very low | 34.8 | Very low | 189 Ų | 189 | 147.9 Ų | 147.9 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | -167.5 | 151 | 145.4 | -108 | -180 | 37.7 | 0 | 0 | 111 | ||||
| 28 | P | 39.1 | Very low | 35 | Very low | 108 Ų | 108 | 153.8 Ų | 153.8 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | trans | -92.7 | 151.2 | -158.9 | 35.5 | -36.4 | 0 | 0 | 0 | 114.7 | K30 | P28-K30 PolarHBondContact O-N 3.08Š| ||
| 29 | S | 37.8 | Very low | 35.1 | Very low | 106 Ų | 106 | 150.4 Ų | 150.4 | 74% | 0.741 | 80% | 0.803 | S | S | * | * | trans | -71.1 | 113.9 | 170.2 | 47.3 | 0 | 0 | 0 | 0 | 111.6 | N31 | S29-N31 PolarHBondContact O-N 3.08Š| ||
| 30 | K | 39.1 | Very low | 35.2 | Very low | 182 Ų | 182 | 150.5 Ų | 150.5 | 79% | 0.791 | 80% | 0.804 | S | S | * | * | trans | -79.2 | 109.3 | 170.5 | -75.2 | 174.7 | 177.7 | 169.9 | 0 | 110.1 | P28 F32 | P28-K30 PolarHBondContact O-N 3.08Å; K30-F32 PolarHBondContact O-N 2.93Å | ||
| 31 | N | 32.8 | Very low | 35.6 | Very low | 154 Ų | 154 | 154.1 Ų | 154.1 | 82% | 0.824 | 81% | 0.81 | S | S | * | * | trans | -71.7 | 111.6 | 173 | -68.7 | -35.7 | 0 | 0 | 0 | 110.9 | S29 | S29-N31 PolarHBondContact O-N 3.08Š| ||
| 32 | F | 32.9 | Very low | 35.7 | Very low | 160 Ų | 160 | 153.1 Ų | 153.1 | 70% | 0.702 | 82% | 0.816 | S | S | * | * | trans | -106.2 | 110.9 | 165.5 | -98.8 | -91 | 0 | 0 | 0 | 109.5 | K30 H34 | K30-F32 PolarHBondContact O-N 2.93Å; F32-H34 AromaticContact CD1-NE2 3.83Å | ||
| 33 | C | 32.1 | Very low | 35.4 | Very low | 132 Ų | 132 | 151.2 Ų | 151.2 | 89% | 0.892 | 82% | 0.815 | S | S | * | * | trans | -125.7 | 104.5 | 166 | -83.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 34 | H | 33.3 | Very low | 35.3 | Very low | 161 Ų | 161 | 147.5 Ų | 147.5 | 75% | 0.745 | 81% | 0.808 | S | S | * | * | trans | -76.3 | 124 | 172.5 | -71.6 | -74 | 0 | 0 | 0 | 110.6 | F32 H36 | F32-H34 AromaticContact CD1-NE2 3.83Å; H34-H36 PolarHBondContact O-N 3.13Å | ||
| 35 | S | 35.3 | Very low | 35.1 | Very low | 117 Ų | 117 | 151 Ų | 151 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | -83.7 | 104.5 | 168.2 | 52.4 | 0 | 0 | 0 | 0 | 110.5 | K37 | S35-K37 PolarHBondContact O-N 2.98Š| ||
| 36 | H | 32.6 | Very low | 35.2 | Very low | 172 Ų | 172 | 147.6 Ų | 147.6 | 80% | 0.796 | 81% | 0.808 | S | S | * | * | trans | -72.7 | 113.5 | 175.9 | -124.1 | -69.4 | 0 | 0 | 0 | 110.4 | H34 K38 | H34-H36 PolarHBondContact O-N 3.13Å; H36-K38 PolarHBondContact O-N 3.29Å | ||
| 37 | K | 37.3 | Very low | 35.2 | Very low | 201 Ų | 201 | 143.5 Ų | 143.5 | 87% | 0.874 | 81% | 0.806 | S | S | * | * | trans | -67.8 | 127.5 | 165.3 | -79.1 | -178.6 | 175.4 | 176.3 | 0 | 109.7 | S35 | S35-K37 PolarHBondContact O-N 2.98Š| ||
| 38 | K | 33.8 | Very low | 35.1 | Very low | 199 Ų | 199 | 140 Ų | 140 | 87% | 0.865 | 80% | 0.802 | S | S | * | * | trans | -138 | 131.4 | 153.7 | -76.5 | -170.9 | 176 | 179.1 | 0 | 109.1 | H36 | H36-K38 PolarHBondContact O-N 3.29Š| ||
| 39 | S | 36.1 | Very low | 35.3 | Very low | 115 Ų | 115 | 140.2 Ų | 140.2 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -99.6 | 154.1 | 172.2 | 49.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 40 | S | 36.7 | Very low | 35.2 | Very low | 119 Ų | 119 | 145.7 Ų | 145.7 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -152.4 | 135.4 | 162 | 54.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 41 | N | 40.3 | Very low | 35.3 | Very low | 168 Ų | 168 | 142.6 Ų | 142.6 | 90% | 0.898 | 81% | 0.814 | S | S | * | * | trans | -96.2 | 158.6 | -167.5 | -64.2 | -24 | 0 | 0 | 0 | 113.5 | ||||
| 42 | G | 32.4 | Very low | 35.4 | Very low | 80 Ų | 80 | 140.3 Ų | 140.3 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | trans | 142.6 | 133.3 | 170 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 43 | S | 31.2 | Very low | 36.3 | Very low | 106 Ų | 106 | 138.5 Ų | 138.5 | 74% | 0.741 | 82% | 0.817 | S | S | * | * | cis | -151.3 | 159.5 | 2.2 | 169.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 44 | T | 34.4 | Very low | 37.1 | Very low | 110 Ų | 110 | 135.3 Ų | 135.3 | 68% | 0.675 | 81% | 0.807 | S | S | * | * | trans | -19.4 | 137.3 | 154.1 | -11.4 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 45 | Y | 32.3 | Very low | 37.8 | Very low | 210 Ų | 210 | 138 Ų | 138 | 82% | 0.824 | 82% | 0.816 | S | S | * | * | cis | -165.5 | 172 | 31.6 | 20.4 | -111.1 | 0 | 0 | 0 | 107.6 | ||||
| 46 | S | 35.8 | Very low | 38.6 | Very low | 124 Ų | 124 | 144.4 Ų | 144.4 | 87% | 0.867 | 82% | 0.822 | S | S | * | * | cis | -156.3 | -172.1 | 1.9 | -121.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 47 | A | 36.4 | Very low | 39.6 | Very low | 100 Ų | 100 | 145 Ų | 145 | 83% | 0.826 | 83% | 0.825 | S | S | * | * | trans | -94.5 | 146.9 | -173.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 48 | S | 34.7 | Very low | 40.4 | Very low | 115 Ų | 115 | 142.2 Ų | 142.2 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | trans | -154.7 | 131.6 | 142.2 | 72 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 49 | S | 43.9 | Very low | 41.3 | Very low | 113 Ų | 113 | 139.8 Ų | 139.8 | 79% | 0.79 | 82% | 0.816 | S | S | * | * | trans | -114.7 | 119.8 | -171.7 | 53.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 50 | Y | 35.8 | Very low | 42 | Very low | 222 Ų | 222 | 138.1 Ų | 138.1 | 87% | 0.871 | 81% | 0.809 | S | S | * | * | trans | -161 | 144.6 | 146.6 | 47 | -93 | 0 | 0 | 0 | 111.9 | ||||
| 51 | S | 40.8 | Very low | 42.5 | Very low | 117 Ų | 117 | 137.5 Ų | 137.5 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -93.7 | 142.2 | 177.3 | 177.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 52 | S | 35.6 | Very low | 43 | Very low | 106 Ų | 106 | 138 Ų | 138 | 74% | 0.741 | 80% | 0.798 | S | S | * | * | trans | -175.7 | 136.7 | 138.7 | -168.8 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 53 | S | 52.3 | Low | 44.1 | Very low | 121 Ų | 121 | 141.8 Ų | 141.8 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | trans | 31.8 | 104.5 | 144.3 | -161.7 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 54 | G | 48.9 | Very low | 45 | Very low | 66 Ų | 66 | 142.4 Ų | 142.4 | 68% | 0.68 | 80% | 0.798 | S | S | * | * | trans | 164.6 | 140.7 | 160.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 55 | K | 47.2 | Very low | 45.6 | Very low | 218 Ų | 218 | 142 Ų | 142 | 95% | 0.948 | 79% | 0.792 | S | S | * | * | trans | 73.3 | 45.2 | 174.1 | -49.3 | 175.5 | -178.9 | 177.6 | 0 | 117.4 | ||||
| 56 | R | 52.9 | Low | 46.7 | Very low | 250 Ų | 250 | 137.5 Ų | 137.5 | 94% | 0.943 | 79% | 0.788 | S | S | * | * | trans | -112.9 | 37.5 | 158 | -82.4 | -167.1 | 176.7 | 147.2 | -0.4 | 113.5 | ||||
| 57 | Q | 52.9 | Low | 47.5 | Very low | 184 Ų | 184 | 139.4 Ų | 139.4 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | trans | -142.3 | 65.5 | 179.2 | -65.3 | -178.1 | 4.6 | 0 | 0 | 110.9 | ||||
| 58 | N | 53.7 | Low | 48.2 | Very low | 144 Ų | 144 | 139.6 Ų | 139.6 | 77% | 0.77 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -159.2 | 18.5 | 168.2 | -129 | -41.2 | 0 | 0 | 0 | 116.5 | ||
| 59 | L | 54 | Low | 49 | Very low | 148 Ų | 148 | 137 Ų | 137 | 78% | 0.775 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -130.8 | 1.7 | 178.5 | -65 | 174.5 | 0 | 0 | 0 | 113.6 | ||
| 60 | A | 50.2 | Low | 49.6 | Very low | 79 Ų | 79 | 136.5 Ų | 136.5 | 65% | 0.653 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | 5.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 61 | C | 47.3 | Very low | 50.6 | Low | 106 Ų | 106 | 132.8 Ų | 132.8 | 72% | 0.716 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.6 | -3.8 | -175.6 | -61.1 | 0 | 0 | 0 | 0 | 114.6 | ||
| 62 | F | 51 | Low | 51.6 | Low | 180 Ų | 180 | 134 Ų | 134 | 79% | 0.789 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -99.2 | -0.3 | -178.7 | -67.5 | -69.7 | 0 | 0 | 0 | 114.6 | ||
| 63 | L | 55 | Low | 52.7 | Low | 158 Ų | 158 | 134.8 Ų | 134.8 | 83% | 0.827 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -109.2 | -0.5 | -173.2 | -71 | 170.9 | 0 | 0 | 0 | 114.5 | ||
| 64 | T | 49.9 | Very low | 53 | Low | 120 Ų | 120 | 133.7 Ų | 133.7 | 74% | 0.736 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -111.5 | 15.1 | -169.3 | 41.2 | 0 | 0 | 0 | 0 | 115 | ||
| 65 | N | 47.7 | Very low | 53.5 | Low | 101 Ų | 101 | 135.9 Ų | 135.9 | 54% | 0.54 | 75% | 0.745 | S | S | . | * | trans | -139.4 | 102.2 | 173.6 | -163.2 | -20.9 | 0 | 0 | 0 | 112.4 | H67 C68 | N65-H67 PolarHBondContact O-N 3.25Å; N65-H67 WeakPolarHBondContact OD1-CA 3.41Å; N65-H67 WeakPolarHBondContact OD1-CB 3.37Å; N65-H67 PolarHBondContact OD1-N 3.4Å; N65-C68 PolarHBondContact O-SG 3.03Å | ||
| 66 | P | 54.5 | Low | 54 | Low | 116 Ų | 116 | 129.3 Ų | 129.3 | 75% | 0.753 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 5.6 | 175.7 | 34.9 | -35.8 | 0 | 0 | 0 | 113.4 | ||
| 67 | H | 52 | Low | 54.4 | Low | 163 Ų | 163 | 125 Ų | 125 | 76% | 0.755 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.5 | 34.4 | 169.3 | -64 | -65.9 | 0 | 0 | 0 | 111.8 | N65 G69 | N65-H67 PolarHBondContact O-N 3.25Å; N65-H67 WeakPolarHBondContact OD1-CA 3.41Å; N65-H67 WeakPolarHBondContact OD1-CB 3.37Å; N65-H67 PolarHBondContact OD1-N 3.4Å; H67-G69 PolarHBondContact O-N 3.11Å |
| 68 | C | 51 | Low | 55 | Low | 104 Ų | 104 | 118.8 Ų | 118.8 | 70% | 0.703 | 72% | 0.715 | S | S | * | * | trans | -63 | 91.1 | 156.2 | 44.8 | 0 | 0 | 0 | 0 | 108.8 | N65 S70 | N65-C68 PolarHBondContact O-SG 3.03Å; C68-S70 PolarHBondContact O-N 3.04Å | ||
| 69 | G | 51.7 | Low | 55.7 | Low | 60 Ų | 60 | 116.3 Ų | 116.3 | 62% | 0.619 | 70% | 0.699 | S | S | * | * | trans | -49.2 | 137.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | H67 I71 | H67-G69 PolarHBondContact O-N 3.11Å; G69-I71 PolarHBondContact O-N 3.07Å | ||
| 70 | S | 56.3 | Low | 56.6 | Low | 103 Ų | 103 | 114.7 Ų | 114.7 | 72% | 0.72 | 70% | 0.695 | S | S | * | * | trans | -51.7 | 116.9 | -179 | 44.2 | 0 | 0 | 0 | 0 | 108.9 | C68 I72 | C68-S70 PolarHBondContact O-N 3.04Å; S70-I72 PolarHBondContact O-N 3.15Å | ||
| 71 | I | 58.7 | Low | 57.8 | Low | 145 Ų | 145 | 116.7 Ų | 116.7 | 74% | 0.744 | 69% | 0.685 | S | S | * | * | trans | -69.9 | 88.8 | 168.3 | -58.3 | 172.3 | 0 | 0 | 0 | 104.5 | G69 N73 | G69-I71 PolarHBondContact O-N 3.07Å; I71-N73 PolarHBondContact O-N 3.05Å | ||
| 72 | I | 60.6 | Low | 59 | Low | 142 Ų | 142 | 114.9 Ų | 114.9 | 73% | 0.728 | 67% | 0.671 | S | S | * | * | trans | -64.6 | 91.2 | 165.6 | -58 | 172.5 | 0 | 0 | 0 | 103.8 | S70 A74 | S70-I72 PolarHBondContact O-N 3.15Å; I72-A74 PolarHBondContact O-N 3.33Å; I72-A74 VanDerWaalsContact O-N 3.16Å | ||
| 73 | N | 58.9 | Low | 60.1 | Low | 122 Ų | 122 | 113.5 Ų | 113.5 | 65% | 0.652 | 67% | 0.672 | S | S | * | * | trans | -54.1 | 123.3 | 163.1 | -62 | -50.7 | 0 | 0 | 0 | 105 | I71 D75 | I71-N73 PolarHBondContact O-N 3.05Å; N73-D75 PolarHBondContact O-N 3.06Å | ||
| 74 | A | 58.2 | Low | 61.2 | Low | 98 Ų | 98 | 117.8 Ų | 117.8 | 81% | 0.81 | 68% | 0.677 | S | S | * | * | trans | -68.7 | 88.7 | 165.2 | 0 | 0 | 0 | 0 | 0 | 106.3 | I72 G76 | I72-A74 PolarHBondContact O-N 3.33Å; I72-A74 VanDerWaalsContact O-N 3.16Å; A74-G76 PolarHBondContact O-N 3.4Å; A74-G76 VanDerWaalsContact O-N 3.1Å | ||
| 75 | D | 60.5 | Low | 62.5 | Low | 112 Ų | 112 | 116.1 Ų | 116.1 | 60% | 0.599 | 66% | 0.664 | S | S | * | * | trans | -53.9 | 116.8 | 162.9 | 43 | -47.9 | 0 | 0 | 0 | 106.8 | N73 H77 | N73-D75 PolarHBondContact O-N 3.06Å; D75-H77 PolarHBondContact O-N 3.2Å | ||
| 76 | G | 57 | Low | 63.8 | Low | 81 Ų | 81 | 116 Ų | 116 | 84% | 0.835 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -66 | 13 | -171.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | A74 G78 | A74-G76 PolarHBondContact O-N 3.4Å; A74-G76 VanDerWaalsContact O-N 3.1Å; G76-G78 PolarHBondContact O-N 3.28Å |
| 77 | H | 60.5 | Low | 65 | Low | 159 Ų | 159 | 115.3 Ų | 115.3 | 74% | 0.736 | 65% | 0.651 | S | S | * | * | trans | -70 | 80 | 166.9 | -62.2 | -54.8 | 0 | 0 | 0 | 109.2 | D75 | D75-H77 PolarHBondContact O-N 3.2Š| ||
| 78 | G | 66.1 | Low | 66.3 | Low | 53 Ų | 53 | 109.1 Ų | 109.1 | 55% | 0.546 | 63% | 0.626 | S | S | . | * | trans | -53.6 | 156.9 | 160.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | G76 V80 | G76-G78 PolarHBondContact O-N 3.28Å; G78-V80 WeakPolarHBondContact O-CG2 3.26Å; G78-V80 PolarHBondContact O-N 2.72Å | ||
| 79 | E | 69.8 | Low | 67.7 | Low | 93 Ų | 93 | 107.9 Ų | 107.9 | 44% | 0.435 | 61% | 0.609 | S | S | . | * | trans | -49.6 | 107.7 | 176 | 41.8 | -176.5 | -134.7 | 0 | 0 | 112 | W81 | E79-W81 VanDerWaalsContact CD-NE1 3.27Å; E79-W81 VanDerWaalsContact O-CD1 3.25Å; E79-W81 PolarHBondContact O-N 2.87Å; E79-W81 VanDerWaalsContact O-N 3.1Å; E79-W81 WeakPolarHBondContact OE1-CZ2 3.42Å; E79-W81 PolarHBondContact OE1-NE1 3.3Å | ||
| 80 | V | 72.3 | Confident | 69.1 | Low | 114 Ų | 114 | 106 Ų | 106 | 69% | 0.691 | 58% | 0.584 | S | S | * | * | trans | -80.6 | 91.2 | 179.7 | -177.9 | 0 | 0 | 0 | 0 | 108.9 | G78 Q92 | G78-V80 WeakPolarHBondContact O-CG2 3.26Å; G78-V80 PolarHBondContact O-N 2.72Å; V80-Q92 PolarHBondContact O-NE2 2.73Å | ||
| 81 | W | 74.3 | Confident | 70.2 | Confident | 120 Ų | 120 | 106.7 Ų | 106.7 | 46% | 0.455 | 57% | 0.574 | S | S | . | * | trans | -69.5 | 137.6 | 175.9 | -65.2 | 98.3 | 0 | 0 | 0 | 111.8 | E79 Q92 | E79-W81 VanDerWaalsContact CD-NE1 3.27Å; E79-W81 VanDerWaalsContact O-CD1 3.25Å; E79-W81 PolarHBondContact O-N 2.87Å; E79-W81 VanDerWaalsContact O-N 3.1Å; E79-W81 WeakPolarHBondContact OE1-CZ2 3.42Å; E79-W81 PolarHBondContact OE1-NE1 3.3Å; W81-Q92 HydrophobicContact CE3-CB 4.02Å; W81-Q92 HydrophobicContact CE3-CG 3.7Å; W81-Q92 HydrophobicContact CZ3-CB 3.83Å; W81-Q92 HydrophobicContact CZ3-CG 3.66Å; W81-Q92 WeakPolarHBondContact CZ3-O 3.31Å | ||
| 82 | T | 74.3 | Confident | 71.3 | Confident | 68 Ų | 68 | 102.2 Ų | 102.2 | 42% | 0.417 | 55% | 0.55 | S | S | . | . | trans | -98.6 | 95 | -179 | 52.3 | 0 | 0 | 0 | 0 | 110.8 | S88 Q92 | T82-S88 PolarHBondContact O-OG 2.91Å; T82-Q92 PolarHBondContact OG1-OE1 3.17Å | ||
| 83 | D | 73.3 | Confident | 72.2 | Confident | 151 Ų | 151 | 98.9 Ų | 98.9 | 81% | 0.807 | 53% | 0.529 | S | S | * | . | trans | -85.9 | -7.9 | -175.3 | 68 | -24.3 | 0 | 0 | 0 | 114.6 | N85 | D83-N85 PolarHBondContact O-N 2.86Š| ||
| 84 | W | 77.5 | Confident | 73.1 | Confident | 248 Ų | 248 | 93.7 Ų | 93.7 | 94% | 0.939 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -50.3 | -30.7 | -178 | -177.1 | -99.2 | 0 | 0 | 0 | 114.8 | ||
| 85 | N | 78.4 | Confident | 73.8 | Confident | 85 Ų | 85 | 97.7 Ų | 97.7 | 46% | 0.455 | 50% | 0.498 | S | S | . | . | S | Bend | trans | -133.2 | 132.4 | 175.1 | -177.6 | -1.5 | 0 | 0 | 0 | 110.1 | D83 M87 S88 | D83-N85 PolarHBondContact O-N 2.86Å; N85-M87 PolarHBondContact O-N 3.09Å; N85-M87 PolarHBondContact OD1-N 3.04Å; N85-S88 PolarHBondContact N-OG 2.78Å; N85-S88 PolarHBondContact O-N 2.76Å; N85-S88 PolarHBondContact O-OG 3.35Å |
| 86 | N | 73.8 | Confident | 74.2 | Confident | 98 Ų | 98 | 101.2 Ų | 101.2 | 52% | 0.524 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | -15.5 | 174.9 | -165.1 | 16.7 | 0 | 0 | 0 | 112.8 | K89 F90 N106 | N86-K89 VanDerWaalsContact O-CE 3.31Å; N86-K89 WeakPolarHBondContact O-CE 3.23Å; N86-K89 WeakPolarHBondContact O-CG 3.04Å; N86-K89 VanDerWaalsContact OD1-CE 3.31Å; N86-K89 WeakPolarHBondContact OD1-CE 3.28Å; N86-K89 PolarHBondContact OD1-NZ 3.46Å; N86-F90 WeakPolarHBondContact O-CE2 3.43Å; N86-N106 PolarHBondContact ND2-ND2 3.34Å; N86-N106 PolarHBondContact OD1-ND2 3.25Å |
| 87 | M | 80 | Confident | 74.9 | Confident | 102 Ų | 102 | 100.7 Ų | 100.7 | 50% | 0.502 | 49% | 0.486 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.2 | -29.8 | 171.6 | -156.1 | 70.3 | 72.9 | 0 | 0 | 114.4 | N85 K89 F90 F91 | N85-M87 PolarHBondContact O-N 3.09Å; N85-M87 PolarHBondContact OD1-N 3.04Å; M87-K89 VanDerWaalsContact C-N 3.29Å; M87-K89 PolarHBondContact O-N 3.23Å; M87-F90 HydrophobicContact CG-CD2 4.44Å; M87-F90 WeakPolarHBondContact O-CD2 3.32Å; M87-F90 PolarHBondContact O-N 2.77Å; M87-F90 HydrophobicContact SD-CD2 3.81Å; M87-F90 HydrophobicContact SD-CE2 4.05Å; M87-F91 HydrophobicContact CG-CE2 3.83Å; M87-F91 WeakPolarHBondContact O-CD2 2.84Å |
| 88 | S | 80.1 | Confident | 75.6 | Confident | 33 Ų | 33 | 99.8 Ų | 99.8 | 23% | 0.231 | 49% | 0.492 | C | S | . | . | G | 310 helix | trans | -65.8 | -33.5 | -175.7 | 50.4 | 0 | 0 | 0 | 0 | 112.4 | T82 N85 F90 F91 | T82-S88 PolarHBondContact O-OG 2.91Å; N85-S88 PolarHBondContact N-OG 2.78Å; N85-S88 PolarHBondContact O-N 2.76Å; N85-S88 PolarHBondContact O-OG 3.35Å; S88-F90 PolarHBondContact O-N 3.47Å; S88-F90 VanDerWaalsContact O-N 3.08Å; S88-F91 PolarHBondContact O-N 2.89Å; S88-F91 VanDerWaalsContact O-N 3.08Å |
| 89 | K | 79.9 | Confident | 76.2 | Confident | 79 Ų | 79 | 100.6 Ų | 100.6 | 34% | 0.343 | 49% | 0.486 | S | S | . | . | G | 310 helix | trans | -54.9 | -26.3 | 176.7 | 76.6 | -173.9 | -168.9 | -178.3 | 0 | 114.4 | N86 M87 N106 | N86-K89 VanDerWaalsContact O-CE 3.31Å; N86-K89 WeakPolarHBondContact O-CE 3.23Å; N86-K89 WeakPolarHBondContact O-CG 3.04Å; N86-K89 VanDerWaalsContact OD1-CE 3.31Å; N86-K89 WeakPolarHBondContact OD1-CE 3.28Å; N86-K89 PolarHBondContact OD1-NZ 3.46Å; M87-K89 VanDerWaalsContact C-N 3.29Å; M87-K89 PolarHBondContact O-N 3.23Å; K89-N106 PolarHBondContact NZ-OD1 3.03Å |
| 90 | F | 81.3 | Confident | 76.7 | Confident | 21 Ų | 21 | 102.8 Ų | 102.8 | 9% | 0.092 | 50% | 0.501 | C | S | . | . | G | 310 helix | trans | -83 | -19.5 | -178.4 | -58.1 | -62.4 | 0 | 0 | 0 | 114 | N86 M87 S88 A103 Y104 N106 | N86-F90 WeakPolarHBondContact O-CE2 3.43Å; M87-F90 HydrophobicContact CG-CD2 4.44Å; M87-F90 WeakPolarHBondContact O-CD2 3.32Å; M87-F90 PolarHBondContact O-N 2.77Å; M87-F90 HydrophobicContact SD-CD2 3.81Å; M87-F90 HydrophobicContact SD-CE2 4.05Å; S88-F90 PolarHBondContact O-N 3.47Å; S88-F90 VanDerWaalsContact O-N 3.08Å; F90-A103 HydrophobicContact CB-CB 4.37Å; F90-A103 HydrophobicContact CD1-CB 4.01Å; F90-A103 PolarHBondContact O-N 3.14Å; F90-Y104 VanDerWaalsContact CD1-O 3.3Å; F90-Y104 WeakPolarHBondContact CD1-O 3.44Å; F90-Y104 WeakPolarHBondContact CE1-O 3.47Å; F90-N106 WeakPolarHBondContact CZ-OD1 3.42Å |
| 91 | F | 79.6 | Confident | 77.2 | Confident | 117 Ų | 117 | 103.6 Ų | 103.6 | 51% | 0.513 | 50% | 0.497 | S | S | . | . | G | 310 helix | trans | -98.7 | 5 | 178.7 | -59.8 | -70.3 | 0 | 0 | 0 | 112.2 | M87 S88 Y93 N102 | M87-F91 HydrophobicContact CG-CE2 3.83Å; M87-F91 WeakPolarHBondContact O-CD2 2.84Å; S88-F91 PolarHBondContact O-N 2.89Å; S88-F91 VanDerWaalsContact O-N 3.08Å; F91-Y93 WeakPolarHBondContact O-CD2 3.49Å; F91-Y93 WeakPolarHBondContact O-CE2 3.48Å; F91-N102 HydrophobicContact CD1-CB 4.36Å; F91-N102 VanDerWaalsContact CD1-OD1 3.25Å; F91-N102 WeakPolarHBondContact CD1-OD1 3.35Å; F91-N102 HydrophobicContact CE1-CB 4.42Å |
| 92 | Q | 81.3 | Confident | 77.6 | Confident | 50 Ų | 50 | 102 Ų | 102 | 23% | 0.234 | 50% | 0.498 | C | S | . | . | P | Polyproline II helix | trans | -98.4 | 119.9 | -177.5 | -175.1 | 161.6 | 10 | 0 | 0 | 110.9 | V80 W81 T82 | V80-Q92 PolarHBondContact O-NE2 2.73Å; W81-Q92 HydrophobicContact CE3-CB 4.02Å; W81-Q92 HydrophobicContact CE3-CG 3.7Å; W81-Q92 HydrophobicContact CZ3-CB 3.83Å; W81-Q92 HydrophobicContact CZ3-CG 3.66Å; W81-Q92 WeakPolarHBondContact CZ3-O 3.31Å; T82-Q92 PolarHBondContact OG1-OE1 3.17Å |
| 93 | Y | 79.9 | Confident | 77.8 | Confident | 73 Ų | 73 | 101.6 Ų | 101.6 | 29% | 0.286 | 50% | 0.501 | S | S | . | . | P | Polyproline II helix | trans | -100.9 | 125.5 | -178.6 | -63 | -83.6 | 0 | 0 | 0 | 110.2 | F91 C97 N100 E101 N102 | F91-Y93 WeakPolarHBondContact O-CD2 3.49Å; F91-Y93 WeakPolarHBondContact O-CE2 3.48Å; Y93-C97 HydrophobicContact CD1-CB 4.12Å; Y93-N100 WeakPolarHBondContact CE2-OD1 3.29Å; Y93-N100 VanDerWaalsContact OH-C 3.27Å; Y93-N100 PolarHBondContact OH-O 3.09Å; Y93-N100 PolarHBondContact OH-OD1 2.85Å; Y93-E101 WeakPolarHBondContact CE1-O 3.21Å; Y93-E101 PolarHBondContact OH-N 2.81Å; Y93-E101 PolarHBondContact OH-O 2.81Å; Y93-N102 VanDerWaalsContact OH-CA 3.31Å; Y93-N102 WeakPolarHBondContact OH-CA 3.5Å; Y93-N102 PolarHBondContact OH-N 2.97Å; Y93-N102 PolarHBondContact OH-OD1 3.11Å |
| 94 | G | 77.1 | Confident | 78.1 | Confident | 13 Ų | 13 | 101.8 Ų | 101.8 | 13% | 0.134 | 49% | 0.491 | C | S | . | . | P | Polyproline II helix | trans | -70.6 | 157.6 | 169.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | R96 C97 | G94-R96 PolarHBondContact O-N 3.5Å; G94-C97 PolarHBondContact N-SG 3.29Å; G94-C97 VanDerWaalsContact N-SG 3.42Å; G94-C97 VanDerWaalsContact O-CB 3.31Å; G94-C97 WeakPolarHBondContact O-CB 3.11Å; G94-C97 PolarHBondContact O-N 2.95Å |
| 95 | W | 73 | Confident | 78.1 | Confident | 181 Ų | 181 | 92.1 Ų | 92.1 | 69% | 0.686 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -6.5 | 175.5 | 54.3 | -85.7 | 0 | 0 | 0 | 114.5 | ||
| 96 | R | 69.3 | Low | 77.9 | Confident | 186 Ų | 186 | 91 Ų | 91 | 70% | 0.702 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98 | -7.1 | 172.9 | -63.7 | -174.2 | 172.6 | 119.1 | -8.9 | 114 | G94 T98 | G94-R96 PolarHBondContact O-N 3.5Å; R96-T98 PolarHBondContact O-N 2.75Å |
| 97 | C | 72.3 | Confident | 77.9 | Confident | 70 Ų | 70 | 94.5 Ų | 94.5 | 47% | 0.473 | 47% | 0.469 | S | S | . | . | trans | -73.1 | 120.2 | 178.7 | -65 | 0 | 0 | 0 | 0 | 110 | Y93 G94 | Y93-C97 HydrophobicContact CD1-CB 4.12Å; G94-C97 PolarHBondContact N-SG 3.29Å; G94-C97 VanDerWaalsContact N-SG 3.42Å; G94-C97 VanDerWaalsContact O-CB 3.31Å; G94-C97 WeakPolarHBondContact O-CB 3.11Å; G94-C97 PolarHBondContact O-N 2.95Å | ||
| 98 | T | 74.9 | Confident | 78 | Confident | 141 Ų | 141 | 92.1 Ų | 92.1 | 87% | 0.865 | 46% | 0.46 | S | S | * | . | trans | -89.6 | -14.7 | 175.5 | 51 | 0 | 0 | 0 | 0 | 113 | R96 | R96-T98 PolarHBondContact O-N 2.75Š| ||
| 99 | T | 78.6 | Confident | 77.9 | Confident | 69 Ų | 69 | 96 Ų | 96 | 42% | 0.423 | 48% | 0.477 | S | S | . | . | S | Bend | trans | -121.2 | 144.5 | -177.4 | 43.2 | 0 | 0 | 0 | 0 | 110.6 | E101 | T99-E101 VanDerWaalsContact C-N 3.25Å; T99-E101 VanDerWaalsContact CB-OE1 3.27Å; T99-E101 WeakPolarHBondContact CB-OE1 3.29Å; T99-E101 PolarHBondContact O-N 3.4Å; T99-E101 PolarHBondContact OG1-OE1 3.46Å |
| 100 | N | 79.1 | Confident | 77.9 | Confident | 139 Ų | 139 | 97.5 Ų | 97.5 | 74% | 0.743 | 49% | 0.487 | S | S | * | . | trans | -93.6 | 50.2 | 174.5 | -171 | 16.4 | 0 | 0 | 0 | 110.1 | Y93 | Y93-N100 WeakPolarHBondContact CE2-OD1 3.29Å; Y93-N100 VanDerWaalsContact OH-C 3.27Å; Y93-N100 PolarHBondContact OH-O 3.09Å; Y93-N100 PolarHBondContact OH-OD1 2.85Å | ||
| 101 | E | 82.5 | Confident | 78 | Confident | 132 Ų | 132 | 100.5 Ų | 100.5 | 62% | 0.617 | 52% | 0.523 | S | S | * | . | P | Polyproline II helix | trans | -102.8 | 118.6 | 179.7 | 68.2 | -164 | 139.2 | 0 | 0 | 110.8 | Y93 T99 | Y93-E101 WeakPolarHBondContact CE1-O 3.21Å; Y93-E101 PolarHBondContact OH-N 2.81Å; Y93-E101 PolarHBondContact OH-O 2.81Å; T99-E101 VanDerWaalsContact C-N 3.25Å; T99-E101 VanDerWaalsContact CB-OE1 3.27Å; T99-E101 WeakPolarHBondContact CB-OE1 3.29Å; T99-E101 PolarHBondContact O-N 3.4Å; T99-E101 PolarHBondContact OG1-OE1 3.46Å |
| 102 | N | 83.3 | Confident | 77.9 | Confident | 87 Ų | 87 | 98.9 Ų | 98.9 | 47% | 0.465 | 52% | 0.52 | S | S | . | . | P | Polyproline II helix | trans | -63.4 | 140.9 | -175.4 | -59.5 | -44.8 | 0 | 0 | 0 | 110.2 | F91 Y93 | F91-N102 HydrophobicContact CD1-CB 4.36Å; F91-N102 VanDerWaalsContact CD1-OD1 3.25Å; F91-N102 WeakPolarHBondContact CD1-OD1 3.35Å; F91-N102 HydrophobicContact CE1-CB 4.42Å; Y93-N102 VanDerWaalsContact OH-CA 3.31Å; Y93-N102 WeakPolarHBondContact OH-CA 3.5Å; Y93-N102 PolarHBondContact OH-N 2.97Å; Y93-N102 PolarHBondContact OH-OD1 3.11Å |
| 103 | A | 78.6 | Confident | 77.9 | Confident | 58 Ų | 58 | 100.9 Ų | 100.9 | 48% | 0.479 | 53% | 0.526 | S | S | . | . | P | Polyproline II helix | trans | -64.4 | 144.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | F90 | F90-A103 HydrophobicContact CB-CB 4.37Å; F90-A103 HydrophobicContact CD1-CB 4.01Å; F90-A103 PolarHBondContact O-N 3.14Å |
| 104 | Y | 78.9 | Confident | 77.9 | Confident | 155 Ų | 155 | 102.2 Ų | 102.2 | 61% | 0.608 | 54% | 0.538 | S | S | * | . | P | Polyproline II helix | trans | -64.3 | 145.5 | -179.7 | -65.2 | -73 | 0 | 0 | 0 | 112.4 | F90 T108 M110 | F90-Y104 VanDerWaalsContact CD1-O 3.3Å; F90-Y104 WeakPolarHBondContact CD1-O 3.44Å; F90-Y104 WeakPolarHBondContact CE1-O 3.47Å; Y104-T108 HydrophobicContact CD1-CG2 3.9Å; Y104-T108 HydrophobicContact CG-CG2 3.96Å; Y104-M110 HydrophobicContact CD2-CG 3.9Å; Y104-M110 HydrophobicContact CD2-SD 3.67Å; Y104-M110 HydrophobicContact CE2-SD 3.81Å; Y104-M110 HydrophobicContact CG-CG 4.19Å; Y104-M110 HydrophobicContact CG-SD 4.47Å |
| 105 | S | 77.6 | Confident | 78.1 | Confident | 45 Ų | 45 | 107.8 Ų | 107.8 | 32% | 0.315 | 56% | 0.561 | S | S | . | * | P | Polyproline II helix | trans | -61.3 | 159.5 | 178.4 | 75.8 | 0 | 0 | 0 | 0 | 112.9 | H107 T108 | S105-H107 PolarHBondContact O-N 2.93Å; S105-H107 PolarHBondContact OG-N 3.3Å; S105-T108 WeakPolarHBondContact O-CB 3.42Å; S105-T108 PolarHBondContact O-N 3.29Å; S105-T108 PolarHBondContact O-OG1 2.99Å; S105-T108 PolarHBondContact OG-N 3.18Å; S105-T108 PolarHBondContact OG-OG1 3.49Å; S105-T108 VanDerWaalsContact OG-OG1 3.13Å |
| 106 | N | 74.8 | Confident | 78.5 | Confident | 61 Ų | 61 | 102.8 Ų | 102.8 | 33% | 0.326 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -9.3 | 172.7 | -45.2 | -60.7 | 0 | 0 | 0 | 113.4 | N86 K89 F90 | N86-N106 PolarHBondContact ND2-ND2 3.34Å; N86-N106 PolarHBondContact OD1-ND2 3.25Å; K89-N106 PolarHBondContact NZ-OD1 3.03Å; F90-N106 WeakPolarHBondContact CZ-OD1 3.42Å |
| 107 | H | 73.4 | Confident | 78.9 | Confident | 173 Ų | 173 | 100.5 Ų | 100.5 | 80% | 0.801 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.9 | -14.1 | 174.2 | -62.7 | -57.4 | 0 | 0 | 0 | 113.1 | S105 | S105-H107 PolarHBondContact O-N 2.93Å; S105-H107 PolarHBondContact OG-N 3.3Å |
| 108 | T | 81.7 | Confident | 79.2 | Confident | 51 Ų | 51 | 104.2 Ų | 104.2 | 31% | 0.313 | 54% | 0.541 | S | S | . | . | S | Bend | trans | -80.2 | 137 | 178.6 | -49.5 | 0 | 0 | 0 | 0 | 109.3 | Y104 S105 M110 | Y104-T108 HydrophobicContact CD1-CG2 3.9Å; Y104-T108 HydrophobicContact CG-CG2 3.96Å; S105-T108 WeakPolarHBondContact O-CB 3.42Å; S105-T108 PolarHBondContact O-N 3.29Å; S105-T108 PolarHBondContact O-OG1 2.99Å; S105-T108 PolarHBondContact OG-N 3.18Å; S105-T108 PolarHBondContact OG-OG1 3.49Å; S105-T108 VanDerWaalsContact OG-OG1 3.13Å; T108-M110 HydrophobicContact CG2-CG 3.73Å; T108-M110 PolarHBondContact O-N 3.3Å |
| 109 | L | 77.9 | Confident | 79.5 | Confident | 116 Ų | 116 | 100.5 Ų | 100.5 | 61% | 0.607 | 52% | 0.516 | S | S | * | . | trans | -76.8 | 62.8 | -173.2 | -41.8 | -176.4 | 0 | 0 | 0 | 111.9 | W113 | L109-W113 HydrophobicContact CB-CD2 4.4Å; L109-W113 HydrophobicContact CB-CG 4.21Å; L109-W113 HydrophobicContact CD2-CD2 3.96Å; L109-W113 HydrophobicContact CD2-CG 3.95Å; L109-W113 HydrophobicContact CD2-CZ2 4.1Å; L109-W113 VanDerWaalsContact CD2-NE1 3.28Å | ||
| 110 | M | 80.1 | Confident | 79.5 | Confident | 109 Ų | 109 | 103.2 Ų | 103.2 | 54% | 0.537 | 53% | 0.527 | S | S | . | . | trans | -118 | 137.9 | -173.7 | -68.7 | -96.5 | 67.2 | 0 | 0 | 111 | Y104 T108 N112 | Y104-M110 HydrophobicContact CD2-CG 3.9Å; Y104-M110 HydrophobicContact CD2-SD 3.67Å; Y104-M110 HydrophobicContact CE2-SD 3.81Å; Y104-M110 HydrophobicContact CG-CG 4.19Å; Y104-M110 HydrophobicContact CG-SD 4.47Å; T108-M110 HydrophobicContact CG2-CG 3.73Å; T108-M110 PolarHBondContact O-N 3.3Å; M110-N112 PolarHBondContact O-N 2.89Å; M110-N112 VanDerWaalsContact O-N 3.09Å | ||
| 111 | G | 83.1 | Confident | 79.6 | Confident | 84 Ų | 84 | 106 Ų | 106 | 87% | 0.866 | 53% | 0.528 | S | S | * | . | S | Bend | trans | 60.3 | -111.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | W113 | G111-W113 PolarHBondContact O-N 3.26Š|
| 112 | N | 78.6 | Confident | 79.4 | Confident | 84 Ų | 84 | 103.5 Ų | 103.5 | 45% | 0.449 | 52% | 0.518 | S | S | . | . | S | Bend | trans | -84.1 | 17.2 | -166.6 | -156.4 | 21.9 | 0 | 0 | 0 | 115.5 | M110 N114 Q115 E116 | M110-N112 PolarHBondContact O-N 2.89Å; M110-N112 VanDerWaalsContact O-N 3.09Å; N112-N114 PolarHBondContact O-N 3.1Å; N112-Q115 PolarHBondContact ND2-OE1 3.07Å; N112-Q115 PolarHBondContact O-N 3.23Å; N112-Q115 WeakPolarHBondContact OD1-CB 3.45Å; N112-Q115 PolarHBondContact OD1-OE1 3.21Å; N112-E116 PolarHBondContact O-N 3.44Å |
| 113 | W | 81 | Confident | 79.2 | Confident | 92 Ų | 92 | 104.3 Ų | 104.3 | 35% | 0.348 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -49.4 | -37.1 | -174.1 | 172.6 | 72.8 | 0 | 0 | 0 | 114.6 | L109 G111 Q115 E116 R117 | L109-W113 HydrophobicContact CB-CD2 4.4Å; L109-W113 HydrophobicContact CB-CG 4.21Å; L109-W113 HydrophobicContact CD2-CD2 3.96Å; L109-W113 HydrophobicContact CD2-CG 3.95Å; L109-W113 HydrophobicContact CD2-CZ2 4.1Å; L109-W113 VanDerWaalsContact CD2-NE1 3.28Å; G111-W113 PolarHBondContact O-N 3.26Å; W113-Q115 PolarHBondContact O-N 3.09Å; W113-E116 PolarHBondContact O-N 3.11Å; W113-R117 WeakPolarHBondContact O-CB 3.35Å; W113-R117 PolarHBondContact O-N 3.01Å |
| 114 | N | 80.6 | Confident | 79.3 | Confident | 100 Ų | 100 | 107.1 Ų | 107.1 | 54% | 0.535 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.7 | -37.8 | -179.9 | -171.5 | 55.2 | 0 | 0 | 0 | 112.4 | N112 Y118 | N112-N114 PolarHBondContact O-N 3.1Å; N114-Y118 WeakPolarHBondContact O-CD2 3.4Å; N114-Y118 WeakPolarHBondContact OD1-CE2 3.18Å |
| 115 | Q | 81.2 | Confident | 79.3 | Confident | 131 Ų | 131 | 105.6 Ų | 105.6 | 61% | 0.612 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -70.4 | -41.3 | 174.9 | -173.6 | -178.5 | -21.6 | 0 | 0 | 110.8 | N112 W113 R117 Y118 D119 | N112-Q115 PolarHBondContact ND2-OE1 3.07Å; N112-Q115 PolarHBondContact O-N 3.23Å; N112-Q115 WeakPolarHBondContact OD1-CB 3.45Å; N112-Q115 PolarHBondContact OD1-OE1 3.21Å; W113-Q115 PolarHBondContact O-N 3.09Å; Q115-R117 VanDerWaalsContact C-N 3.31Å; Q115-R117 PolarHBondContact O-N 3.29Å; Q115-Y118 CarbonylContact O-C 3.43Å; Q115-Y118 PolarHBondContact O-N 2.88Å; Q115-Y118 VanDerWaalsContact O-N 3.14Å; Q115-D119 PolarHBondContact O-N 3.32Å |
| 116 | E | 80.7 | Confident | 79.4 | Confident | 75 Ų | 75 | 109.1 Ų | 109.1 | 35% | 0.35 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.1 | -40 | 177 | -64.9 | 179.5 | 167 | 0 | 0 | 111.7 | N112 W113 Y118 D119 N122 | N112-E116 PolarHBondContact O-N 3.44Å; W113-E116 PolarHBondContact O-N 3.11Å; E116-Y118 PolarHBondContact O-N 3.13Å; E116-D119 WeakPolarHBondContact O-CB 3.43Å; E116-D119 PolarHBondContact O-N 2.98Å; E116-D119 VanDerWaalsContact O-N 3.16Å; E116-N122 PolarHBondContact O-ND2 3.32Å |
| 117 | R | 77 | Confident | 79.7 | Confident | 138 Ų | 138 | 115.5 Ų | 115.5 | 52% | 0.521 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -57.4 | -34.5 | 175.1 | -179.3 | 175.9 | -176.5 | 77.3 | 1 | 113.2 | W113 Q115 | W113-R117 WeakPolarHBondContact O-CB 3.35Å; W113-R117 PolarHBondContact O-N 3.01Å; Q115-R117 VanDerWaalsContact C-N 3.31Å; Q115-R117 PolarHBondContact O-N 3.29Å |
| 118 | Y | 78.6 | Confident | 80.3 | Confident | 149 Ų | 149 | 113 Ų | 113 | 58% | 0.584 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.2 | 13.7 | -180 | -60.9 | -64.7 | 0 | 0 | 0 | 113.4 | N114 Q115 E116 I123 | N114-Y118 WeakPolarHBondContact O-CD2 3.4Å; N114-Y118 WeakPolarHBondContact OD1-CE2 3.18Å; Q115-Y118 CarbonylContact O-C 3.43Å; Q115-Y118 PolarHBondContact O-N 2.88Å; Q115-Y118 VanDerWaalsContact O-N 3.14Å; E116-Y118 PolarHBondContact O-N 3.13Å; Y118-I123 VanDerWaalsContact O-CD1 3.29Å; Y118-I123 WeakPolarHBondContact O-CD1 3.31Å |
| 119 | D | 82.9 | Confident | 80.6 | Confident | 62 Ų | 62 | 118.5 Ų | 118.5 | 33% | 0.332 | 60% | 0.603 | S | S | . | * | trans | -62.7 | 138.3 | 170.4 | -175.8 | 6.5 | 0 | 0 | 0 | 109.9 | Q115 E116 R121 N122 I123 | Q115-D119 PolarHBondContact O-N 3.32Å; E116-D119 WeakPolarHBondContact O-CB 3.43Å; E116-D119 PolarHBondContact O-N 2.98Å; E116-D119 VanDerWaalsContact O-N 3.16Å; D119-R121 PolarHBondContact O-N 2.89Å; D119-R121 VanDerWaalsContact O-N 3.13Å; D119-R121 PolarHBondContact OD1-N 3.01Å; D119-R121 WeakPolarHBondContact OD2-CD 3.49Å; D119-R121 WeakPolarHBondContact OD2-CG 3.31Å; D119-N122 WeakPolarHBondContact O-CA 3.1Å; D119-N122 PolarHBondContact O-N 2.69Å; D119-I123 PolarHBondContact O-N 3.01Å | ||
| 120 | L | 78 | Confident | 81 | Confident | 127 Ų | 127 | 118.9 Ų | 118.9 | 67% | 0.665 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -54.1 | -33.3 | 176.5 | -64.7 | 175.5 | 0 | 0 | 0 | 111.5 | N122 I123 V124 | L120-N122 PolarHBondContact O-N 3.16Å; L120-I123 PolarHBondContact O-N 3.25Å; L120-V124 WeakPolarHBondContact O-CB 3.22Å; L120-V124 WeakPolarHBondContact O-CG2 3.49Å; L120-V124 PolarHBondContact O-N 3.14Å |
| 121 | R | 81.2 | Confident | 81.5 | Confident | 198 Ų | 198 | 117.5 Ų | 117.5 | 75% | 0.747 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -60.4 | -30.4 | 175.3 | -60.2 | -178.6 | 179.5 | -174 | -0.6 | 113.4 | D119 Q125 | D119-R121 PolarHBondContact O-N 2.89Å; D119-R121 VanDerWaalsContact O-N 3.13Å; D119-R121 PolarHBondContact OD1-N 3.01Å; D119-R121 WeakPolarHBondContact OD2-CD 3.49Å; D119-R121 WeakPolarHBondContact OD2-CG 3.31Å; R121-Q125 WeakPolarHBondContact O-CG 3.39Å; R121-Q125 PolarHBondContact O-NE2 2.9Å |
| 122 | N | 78.8 | Confident | 81.8 | Confident | 78 Ų | 78 | 120.8 Ų | 120.8 | 42% | 0.417 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -93.3 | -30.5 | 178.8 | -69.3 | -30.7 | 0 | 0 | 0 | 111.9 | E116 D119 L120 Q125 | E116-N122 PolarHBondContact O-ND2 3.32Å; D119-N122 WeakPolarHBondContact O-CA 3.1Å; D119-N122 PolarHBondContact O-N 2.69Å; L120-N122 PolarHBondContact O-N 3.16Å; N122-Q125 PolarHBondContact OD1-NE2 2.78Å |
| 123 | I | 78 | Confident | 82.5 | Confident | 105 Ų | 105 | 122.6 Ų | 122.6 | 54% | 0.538 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -69.9 | -35.5 | 174.5 | -64.3 | 169.3 | 0 | 0 | 0 | 111.9 | Y118 D119 L120 Q125 | Y118-I123 VanDerWaalsContact O-CD1 3.29Å; Y118-I123 WeakPolarHBondContact O-CD1 3.31Å; D119-I123 PolarHBondContact O-N 3.01Å; L120-I123 PolarHBondContact O-N 3.25Å; I123-Q125 VanDerWaalsContact C-N 3.3Å; I123-Q125 PolarHBondContact O-N 3.41Å |
| 124 | V | 80.5 | Confident | 82.6 | Confident | 117 Ų | 117 | 119.4 Ų | 119.4 | 71% | 0.709 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -77.2 | -14.2 | -179.7 | 172 | 0 | 0 | 0 | 0 | 112.6 | L120 P126 | L120-V124 WeakPolarHBondContact O-CB 3.22Å; L120-V124 WeakPolarHBondContact O-CG2 3.49Å; L120-V124 PolarHBondContact O-N 3.14Å; V124-P126 WeakPolarHBondContact O-CD 3.42Å |
| 125 | Q | 80.1 | Confident | 82.8 | Confident | 123 Ų | 123 | 119.5 Ų | 119.5 | 58% | 0.575 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -66.5 | 121.8 | 176.4 | -80 | 168.3 | 55.4 | 0 | 0 | 110.6 | R121 N122 I123 | R121-Q125 WeakPolarHBondContact O-CG 3.39Å; R121-Q125 PolarHBondContact O-NE2 2.9Å; N122-Q125 PolarHBondContact OD1-NE2 2.78Å; I123-Q125 VanDerWaalsContact C-N 3.3Å; I123-Q125 PolarHBondContact O-N 3.41Å |
| 126 | P | 79.8 | Confident | 83.1 | Confident | 119 Ų | 119 | 120.7 Ų | 120.7 | 77% | 0.773 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 147.2 | 176.1 | 28.6 | -34.2 | 0 | 0 | 0 | 109.9 | V124 | V124-P126 WeakPolarHBondContact O-CD 3.42Š|
| 127 | K | 80.6 | Confident | 83.5 | Confident | 195 Ų | 195 | 125.6 Ų | 125.6 | 85% | 0.848 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 144.4 | 171.3 | -67.4 | 177.8 | -178.3 | 175.8 | 0 | 109.5 | ||
| 128 | P | 85.7 | Confident | 83.9 | Confident | 121 Ų | 121 | 124.9 Ų | 124.9 | 79% | 0.786 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 155.2 | 174.6 | 26.9 | -35.4 | 0 | 0 | 0 | 110.6 | ||
| 129 | L | 87.3 | Confident | 84.3 | Confident | 165 Ų | 165 | 121.5 Ų | 121.5 | 86% | 0.864 | 62% | 0.621 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 144.3 | 175.1 | -67.5 | 174.2 | 0 | 0 | 0 | 110.5 | S131 | L129-S131 PolarHBondContact O-N 3.34Š|
| 130 | P | 88 | Confident | 84.3 | Confident | 124 Ų | 124 | 124.7 Ų | 124.7 | 81% | 0.805 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -59 | 138.8 | 178.3 | 25.4 | -34.2 | 0 | 0 | 0 | 110.5 | Q132 | P130-Q132 PolarHBondContact O-N 3.2Š|
| 131 | S | 88.7 | Confident | 84.6 | Confident | 80 Ų | 80 | 126.2 Ų | 126.2 | 56% | 0.559 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 127.1 | -179.5 | 175.5 | 0 | 0 | 0 | 0 | 110.9 | L129 F133 G134 | L129-S131 PolarHBondContact O-N 3.34Å; S131-F133 PolarHBondContact O-N 3.48Å; S131-F133 PolarHBondContact OG-N 2.93Å; S131-G134 PolarHBondContact O-N 2.95Å; S131-G134 VanDerWaalsContact O-N 3.15Å; S131-G134 PolarHBondContact OG-N 3.47Å |
| 132 | Q | 90.7 | Very high | 84.6 | Confident | 154 Ų | 154 | 120.4 Ų | 120.4 | 72% | 0.72 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | -22.3 | 174.6 | -175.6 | 176.6 | 6.5 | 0 | 0 | 112.9 | P130 H135 | P130-Q132 PolarHBondContact O-N 3.2Å; Q132-H135 PolarHBondContact O-CE1 3.03Å |
| 133 | F | 92.4 | Very high | 84.6 | Confident | 121 Ų | 121 | 121.2 Ų | 121.2 | 53% | 0.531 | 63% | 0.633 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -116 | -0.5 | -178.8 | -58.8 | -89.7 | 0 | 0 | 0 | 113.6 | S131 H135 Y136 | S131-F133 PolarHBondContact O-N 3.48Å; S131-F133 PolarHBondContact OG-N 2.93Å; F133-H135 VanDerWaalsContact C-N 3.35Å; F133-H135 PolarHBondContact O-N 2.97Å; F133-Y136 HydrophobicContact CB-CD2 3.94Å; F133-Y136 HydrophobicContact CB-CE2 4.21Å; F133-Y136 AromaticContact CD1-CD2 3.95Å; F133-Y136 HydrophobicContact CD1-CD2 3.95Å; F133-Y136 AromaticContact CD1-CE2 3.55Å; F133-Y136 HydrophobicContact CD1-CE2 3.55Å; F133-Y136 HydrophobicContact CE1-CE2 4.31Å; F133-Y136 HydrophobicContact CG-CD2 4.41Å; F133-Y136 HydrophobicContact CG-CE2 4.24Å; F133-Y136 WeakPolarHBondContact O-CD2 3.05Å; F133-Y136 PolarHBondContact O-N 2.82Å |
| 134 | G | 83.7 | Confident | 84.6 | Confident | 26 Ų | 26 | 119.6 Ų | 119.6 | 27% | 0.268 | 63% | 0.631 | S | S | . | * | G | 310 helix | trans | -63.1 | -40.4 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S131 Y136 F137 | S131-G134 PolarHBondContact O-N 2.95Å; S131-G134 VanDerWaalsContact O-N 3.15Å; S131-G134 PolarHBondContact OG-N 3.47Å; G134-Y136 PolarHBondContact O-N 3.38Å; G134-F137 PolarHBondContact O-N 3.3Å |
| 135 | H | 84.8 | Confident | 84.5 | Confident | 102 Ų | 102 | 121.5 Ų | 121.5 | 47% | 0.472 | 63% | 0.627 | S | S | . | * | G | 310 helix | trans | -66.7 | -16.9 | -177.1 | 62 | -95 | 0 | 0 | 0 | 114.4 | Q132 F133 F137 E138 | Q132-H135 PolarHBondContact O-CE1 3.03Å; F133-H135 VanDerWaalsContact C-N 3.35Å; F133-H135 PolarHBondContact O-N 2.97Å; H135-F137 PolarHBondContact O-N 3.27Å; H135-E138 PolarHBondContact O-N 3.13Å |
| 136 | Y | 88.6 | Confident | 84.1 | Confident | 155 Ų | 155 | 119.2 Ų | 119.2 | 61% | 0.608 | 62% | 0.619 | S | S | * | * | G | 310 helix | trans | -67.5 | -18.3 | 177.1 | -66.5 | -61.7 | 0 | 0 | 0 | 113.5 | F133 G134 | F133-Y136 HydrophobicContact CB-CD2 3.94Å; F133-Y136 HydrophobicContact CB-CE2 4.21Å; F133-Y136 AromaticContact CD1-CD2 3.95Å; F133-Y136 HydrophobicContact CD1-CD2 3.95Å; F133-Y136 AromaticContact CD1-CE2 3.55Å; F133-Y136 HydrophobicContact CD1-CE2 3.55Å; F133-Y136 HydrophobicContact CE1-CE2 4.31Å; F133-Y136 HydrophobicContact CG-CD2 4.41Å; F133-Y136 HydrophobicContact CG-CE2 4.24Å; F133-Y136 WeakPolarHBondContact O-CD2 3.05Å; F133-Y136 PolarHBondContact O-N 2.82Å; G134-Y136 PolarHBondContact O-N 3.38Å |
| 137 | F | 87.8 | Confident | 83.2 | Confident | 179 Ų | 179 | 120.3 Ų | 120.3 | 79% | 0.785 | 62% | 0.618 | S | S | * | * | G | 310 helix | trans | -106.6 | -2.8 | 179.2 | -51.4 | -75.5 | 0 | 0 | 0 | 112.7 | G134 H135 | G134-F137 PolarHBondContact O-N 3.3Å; H135-F137 PolarHBondContact O-N 3.27Å |
| 138 | E | 86.1 | Confident | 82.6 | Confident | 123 Ų | 123 | 119 Ų | 119 | 58% | 0.575 | 61% | 0.612 | S | S | * | * | trans | -84.1 | 126.8 | 175.8 | -66.5 | -178.7 | -178.4 | 0 | 0 | 109.4 | H135 | H135-E138 PolarHBondContact O-N 3.13Š| ||
| 139 | T | 86 | Confident | 81.5 | Confident | 77 Ų | 77 | 120.9 Ų | 120.9 | 47% | 0.472 | 61% | 0.612 | S | S | . | * | trans | -97.7 | 144.4 | 174.4 | 69.9 | 0 | 0 | 0 | 0 | 109.8 | Y141 D142 T143 | T139-Y141 PolarHBondContact O-N 2.98Å; T139-Y141 VanDerWaalsContact O-N 3.13Å; T139-D142 PolarHBondContact O-N 2.98Å; T139-D142 WeakPolarHBondContact OG1-CB 3.3Å; T139-D142 PolarHBondContact OG1-N 3.29Å; T139-T143 PolarHBondContact O-N 3.18Å; T139-T143 PolarHBondContact O-OG1 3.09Å; T139-T143 VanDerWaalsContact O-OG1 3.08Å | ||
| 140 | T | 82.8 | Confident | 80.4 | Confident | 130 Ų | 130 | 118.2 Ų | 118.2 | 80% | 0.798 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -57.3 | -27.1 | 173.8 | 26 | 0 | 0 | 0 | 0 | 113.1 | S144 | T140-S144 VanDerWaalsContact O-CB 3.26Å; T140-S144 WeakPolarHBondContact O-CB 3.32Å; T140-S144 PolarHBondContact O-N 2.79Å; T140-S144 VanDerWaalsContact O-N 3.08Å; T140-S144 PolarHBondContact O-OG 3.43Å |
| 141 | Y | 84.9 | Confident | 79.2 | Confident | 158 Ų | 158 | 120.6 Ų | 120.6 | 62% | 0.62 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.7 | -48.1 | 171.6 | -174.9 | -87.3 | 0 | 0 | 0 | 111.7 | T139 S144 Y145 | T139-Y141 PolarHBondContact O-N 2.98Å; T139-Y141 VanDerWaalsContact O-N 3.13Å; Y141-S144 PolarHBondContact O-N 3.4Å; Y141-S144 PolarHBondContact O-OG 2.83Å; Y141-S144 VanDerWaalsContact O-OG 3.11Å; Y141-Y145 HydrophobicContact CD1-CD2 4.19Å; Y141-Y145 AromaticContact CD2-CD2 3.68Å; Y141-Y145 HydrophobicContact CD2-CD2 3.68Å; Y141-Y145 AromaticContact CD2-CE2 3.66Å; Y141-Y145 HydrophobicContact CD2-CE2 3.66Å; Y141-Y145 HydrophobicContact CE1-CD2 4.03Å; Y141-Y145 AromaticContact CE2-CD2 3.5Å; Y141-Y145 HydrophobicContact CE2-CD2 3.5Å; Y141-Y145 VanDerWaalsContact CE2-CD2 3.5Å; Y141-Y145 AromaticContact CE2-CE2 3.37Å; Y141-Y145 HydrophobicContact CE2-CE2 3.37Å; Y141-Y145 HydrophobicContact CE2-CG 4.47Å; Y141-Y145 HydrophobicContact CG-CD2 4.02Å; Y141-Y145 HydrophobicContact CG-CE2 4.45Å; Y141-Y145 AromaticContact CZ-CD2 3.68Å; Y141-Y145 AromaticContact CZ-CE2 3.95Å; Y141-Y145 WeakPolarHBondContact O-CD2 3.25Å; Y141-Y145 PolarHBondContact O-N 3.35Å |
| 142 | D | 81.9 | Confident | 77.7 | Confident | 77 Ų | 77 | 120.9 Ų | 120.9 | 41% | 0.412 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -62 | -47.7 | 175.9 | -170.1 | 44.8 | 0 | 0 | 0 | 110.4 | T139 S144 Y145 N146 | T139-D142 PolarHBondContact O-N 2.98Å; T139-D142 WeakPolarHBondContact OG1-CB 3.3Å; T139-D142 PolarHBondContact OG1-N 3.29Å; D142-S144 VanDerWaalsContact C-N 3.27Å; D142-S144 PolarHBondContact O-N 3Å; D142-Y145 PolarHBondContact O-N 2.86Å; D142-N146 WeakPolarHBondContact O-CB 3.31Å; D142-N146 PolarHBondContact O-N 2.97Å; D142-N146 PolarHBondContact OD1-ND2 2.86Å |
| 143 | T | 78.2 | Confident | 76.1 | Confident | 94 Ų | 94 | 120.5 Ų | 120.5 | 58% | 0.577 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -60 | -33.1 | 178.1 | -39.3 | 0 | 0 | 0 | 0 | 113.4 | T139 | T139-T143 PolarHBondContact O-N 3.18Å; T139-T143 PolarHBondContact O-OG1 3.09Å; T139-T143 VanDerWaalsContact O-OG1 3.08Å |
| 144 | S | 78.4 | Confident | 74.4 | Confident | 72 Ų | 72 | 121.9 Ų | 121.9 | 50% | 0.503 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -84.2 | -31.5 | -177.7 | 69 | 0 | 0 | 0 | 0 | 114.3 | T140 Y141 D142 | T140-S144 VanDerWaalsContact O-CB 3.26Å; T140-S144 WeakPolarHBondContact O-CB 3.32Å; T140-S144 PolarHBondContact O-N 2.79Å; T140-S144 VanDerWaalsContact O-N 3.08Å; T140-S144 PolarHBondContact O-OG 3.43Å; Y141-S144 PolarHBondContact O-N 3.4Å; Y141-S144 PolarHBondContact O-OG 2.83Å; Y141-S144 VanDerWaalsContact O-OG 3.11Å; D142-S144 VanDerWaalsContact C-N 3.27Å; D142-S144 PolarHBondContact O-N 3Å |
| 145 | Y | 77.3 | Confident | 73.4 | Confident | 156 Ų | 156 | 131.1 Ų | 131.1 | 61% | 0.612 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -99.7 | -22.6 | -178.5 | -74.5 | -79.1 | 0 | 0 | 0 | 114.1 | Y141 D142 N147 | Y141-Y145 HydrophobicContact CD1-CD2 4.19Å; Y141-Y145 AromaticContact CD2-CD2 3.68Å; Y141-Y145 HydrophobicContact CD2-CD2 3.68Å; Y141-Y145 AromaticContact CD2-CE2 3.66Å; Y141-Y145 HydrophobicContact CD2-CE2 3.66Å; Y141-Y145 HydrophobicContact CE1-CD2 4.03Å; Y141-Y145 AromaticContact CE2-CD2 3.5Å; Y141-Y145 HydrophobicContact CE2-CD2 3.5Å; Y141-Y145 VanDerWaalsContact CE2-CD2 3.5Å; Y141-Y145 AromaticContact CE2-CE2 3.37Å; Y141-Y145 HydrophobicContact CE2-CE2 3.37Å; Y141-Y145 HydrophobicContact CE2-CG 4.47Å; Y141-Y145 HydrophobicContact CG-CD2 4.02Å; Y141-Y145 HydrophobicContact CG-CE2 4.45Å; Y141-Y145 AromaticContact CZ-CD2 3.68Å; Y141-Y145 AromaticContact CZ-CE2 3.95Å; Y141-Y145 WeakPolarHBondContact O-CD2 3.25Å; Y141-Y145 PolarHBondContact O-N 3.35Å; D142-Y145 PolarHBondContact O-N 2.86Å; Y145-N147 PolarHBondContact O-N 3.08Å |
| 146 | N | 71.8 | Confident | 72.4 | Confident | 76 Ų | 76 | 135.7 Ų | 135.7 | 41% | 0.406 | 67% | 0.674 | S | S | . | * | trans | -79 | 75.3 | 177 | -137.1 | -41.4 | 0 | 0 | 0 | 109.9 | D142 K148 | D142-N146 WeakPolarHBondContact O-CB 3.31Å; D142-N146 PolarHBondContact O-N 2.97Å; D142-N146 PolarHBondContact OD1-ND2 2.86Å; N146-K148 PolarHBondContact O-N 3.08Å | ||
| 147 | N | 62 | Low | 71.2 | Confident | 141 Ų | 141 | 137.3 Ų | 137.3 | 75% | 0.754 | 68% | 0.684 | S | S | * | * | trans | -65.2 | 64.7 | 173.3 | -82.4 | -62 | 0 | 0 | 0 | 111.8 | Y145 M149 | Y145-N147 PolarHBondContact O-N 3.08Å; N147-M149 PolarHBondContact O-N 2.96Å | ||
| 148 | K | 68.4 | Low | 70.2 | Confident | 169 Ų | 169 | 137.7 Ų | 137.7 | 74% | 0.735 | 68% | 0.68 | S | S | * | * | trans | -71.6 | 69.8 | 160 | -66.2 | 179.5 | -173 | 166.7 | 0 | 107.4 | N146 | N146-K148 PolarHBondContact O-N 3.08Š| ||
| 149 | M | 62.6 | Low | 69.7 | Low | 159 Ų | 159 | 139.6 Ų | 139.6 | 78% | 0.783 | 69% | 0.689 | S | S | * | * | trans | -51.2 | 118.3 | -177.4 | -171.7 | 138.8 | 81.4 | 0 | 0 | 107.4 | N147 L151 | N147-M149 PolarHBondContact O-N 2.96Å; M149-L151 PolarHBondContact O-N 3.02Å; M149-L151 VanDerWaalsContact O-N 3.09Å | ||
| 150 | P | 64.1 | Low | 69.1 | Low | 110 Ų | 110 | 141.5 Ų | 141.5 | 71% | 0.714 | 70% | 0.703 | S | S | * | * | trans | -56.5 | 125.1 | -177.2 | 21.5 | -32.3 | 0 | 0 | 0 | 107.5 | S152 | P150-S152 VanDerWaalsContact C-N 3.33Å; P150-S152 PolarHBondContact O-N 3.27Å | ||
| 151 | L | 62.6 | Low | 68.6 | Low | 174 Ų | 174 | 139.9 Ų | 139.9 | 91% | 0.911 | 69% | 0.686 | S | S | * | * | trans | -57 | 101.8 | -178.9 | -80.5 | 171.7 | 0 | 0 | 0 | 107.9 | M149 T153 | M149-L151 PolarHBondContact O-N 3.02Å; M149-L151 VanDerWaalsContact O-N 3.09Å; L151-T153 PolarHBondContact O-N 2.69Å | ||
| 152 | S | 56.3 | Low | 67.8 | Low | 85 Ų | 85 | 143.5 Ų | 143.5 | 59% | 0.594 | 70% | 0.699 | S | S | * | * | trans | -67.2 | 109.7 | -167.3 | 159.6 | 0 | 0 | 0 | 0 | 109.1 | P150 H154 | P150-S152 VanDerWaalsContact C-N 3.33Å; P150-S152 PolarHBondContact O-N 3.27Å; S152-H154 PolarHBondContact O-N 3.34Å; S152-H154 VanDerWaalsContact O-N 3.09Å; S152-H154 VanDerWaalsContact OG-CB 3.23Å; S152-H154 WeakPolarHBondContact OG-CB 3.48Å; S152-H154 PolarHBondContact OG-N 2.91Å; S152-H154 PolarHBondContact OG-O 3.48Å | ||
| 153 | T | 57.9 | Low | 67.2 | Low | 146 Ų | 146 | 147 Ų | 147 | 90% | 0.896 | 71% | 0.71 | S | S | * | * | trans | -62.4 | -11.8 | 169.8 | -29.6 | 0 | 0 | 0 | 0 | 112 | L151 R155 | L151-T153 PolarHBondContact O-N 2.69Å; T153-R155 PolarHBondContact O-N 3.03Å | ||
| 154 | H | 57.2 | Low | 66.9 | Low | 151 Ų | 151 | 148 Ų | 148 | 70% | 0.699 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -63.6 | 124 | 169.6 | -170.8 | -68.7 | 0 | 0 | 0 | 110.1 | S152 | S152-H154 PolarHBondContact O-N 3.34Å; S152-H154 VanDerWaalsContact O-N 3.09Å; S152-H154 VanDerWaalsContact OG-CB 3.23Å; S152-H154 WeakPolarHBondContact OG-CB 3.48Å; S152-H154 PolarHBondContact OG-N 2.91Å; S152-H154 PolarHBondContact OG-O 3.48Å |
| 155 | R | 61.8 | Low | 66.6 | Low | 220 Ų | 220 | 148.6 Ų | 148.6 | 83% | 0.83 | 74% | 0.736 | S | S | * | * | trans | -38 | 144 | -179.1 | -60.8 | 170.5 | -174.6 | 161.2 | 1.7 | 113.2 | T153 K157 | T153-R155 PolarHBondContact O-N 3.03Å; R155-K157 PolarHBondContact O-N 3.19Å | ||
| 156 | F | 64.7 | Low | 66.4 | Low | 198 Ų | 198 | 147 Ų | 147 | 87% | 0.868 | 73% | 0.734 | S | S | * | * | trans | -26.9 | 122.4 | 169.9 | -169.4 | -90.5 | 0 | 0 | 0 | 111.6 | R158 | F156-R158 PolarHBondContact O-N 3.46Š| ||
| 157 | K | 62.3 | Low | 66.9 | Low | 188 Ų | 188 | 149 Ų | 149 | 82% | 0.817 | 74% | 0.741 | S | S | * | * | trans | -60 | 97.1 | 179.3 | -70.8 | -94.3 | -174.4 | 171.1 | 0 | 108.1 | R155 E159 | R155-K157 PolarHBondContact O-N 3.19Å; K157-E159 PolarHBondContact O-N 3.39Å; K157-E159 VanDerWaalsContact O-N 3.17Å | ||
| 158 | R | 67.2 | Low | 67.4 | Low | 188 Ų | 188 | 146 Ų | 146 | 71% | 0.709 | 73% | 0.729 | S | S | * | * | trans | -64.3 | 116.6 | 172 | -174.5 | 174.9 | 179.9 | 153.6 | -2.5 | 106.6 | F156 H161 | F156-R158 PolarHBondContact O-N 3.46Å; R158-H161 PolarHBondContact NH2-CD2 3Å; R158-H161 PolarHBondContact NH2-NE2 2.6Å | ||
| 159 | E | 74.8 | Confident | 67.9 | Low | 162 Ų | 162 | 145.7 Ų | 145.7 | 76% | 0.757 | 73% | 0.73 | S | S | * | * | trans | -55.6 | 150.6 | 172.7 | -67.5 | -174.4 | 155 | 0 | 0 | 109.8 | K157 H161 | K157-E159 PolarHBondContact O-N 3.39Å; K157-E159 VanDerWaalsContact O-N 3.17Å; E159-H161 PolarHBondContact O-N 3.26Å | ||
| 160 | P | 74.3 | Confident | 68.6 | Low | 118 Ų | 118 | 144.4 Ų | 144.4 | 77% | 0.766 | 73% | 0.726 | S | S | * | * | trans | -67.4 | 83.1 | 176.8 | 27.7 | -33.1 | 0 | 0 | 0 | 110.2 | W162 | P160-W162 PolarHBondContact O-N 3.33Å; P160-W162 VanDerWaalsContact O-N 3.14Å | ||
| 161 | H | 72 | Confident | 69.4 | Low | 95 Ų | 95 | 141.6 Ų | 141.6 | 44% | 0.44 | 71% | 0.705 | S | S | . | * | trans | -65.1 | 113.2 | 175 | 70.3 | -29.3 | 0 | 0 | 0 | 109.5 | R158 E159 F163 | R158-H161 PolarHBondContact NH2-CD2 3Å; R158-H161 PolarHBondContact NH2-NE2 2.6Å; E159-H161 PolarHBondContact O-N 3.26Å; H161-F163 AromaticContact CD2-CE2 3.76Å; H161-F163 AromaticContact NE2-CD2 3.96Å; H161-F163 AromaticContact NE2-CE2 3.28Å; H161-F163 VanDerWaalsContact NE2-CE2 3.28Å; H161-F163 WeakPolarHBondContact NE2-CE2 3.35Å; H161-F163 AromaticContact NE2-CZ 3.86Å | ||
| 162 | W | 68.3 | Low | 70.3 | Confident | 234 Ų | 234 | 136.6 Ų | 136.6 | 89% | 0.886 | 68% | 0.683 | S | S | * | * | trans | -78 | 119 | 156.6 | -116.6 | -93.7 | 0 | 0 | 0 | 106.8 | P160 | P160-W162 PolarHBondContact O-N 3.33Å; P160-W162 VanDerWaalsContact O-N 3.14Å | ||
| 163 | F | 68.3 | Low | 71.2 | Confident | 150 Ų | 150 | 138 Ų | 138 | 66% | 0.658 | 69% | 0.69 | S | S | * | * | trans | -58.8 | 142.5 | 162 | -82.6 | -86.4 | 0 | 0 | 0 | 108.2 | H161 G165 | H161-F163 AromaticContact CD2-CE2 3.76Å; H161-F163 AromaticContact NE2-CD2 3.96Å; H161-F163 AromaticContact NE2-CE2 3.28Å; H161-F163 VanDerWaalsContact NE2-CE2 3.28Å; H161-F163 WeakPolarHBondContact NE2-CE2 3.35Å; H161-F163 AromaticContact NE2-CZ 3.86Å; F163-G165 VanDerWaalsContact C-N 3.28Å; F163-G165 PolarHBondContact O-N 2.83Å | ||
| 164 | P | 73.1 | Confident | 71.9 | Confident | 115 Ų | 115 | 142.1 Ų | 142.1 | 75% | 0.747 | 69% | 0.689 | S | S | * | * | trans | -64.7 | 91.5 | 173.9 | 26.4 | -33 | 0 | 0 | 0 | 109.1 | H166 | P164-H166 PolarHBondContact O-N 3.1Š| ||
| 165 | G | 70.8 | Confident | 72.6 | Confident | 85 Ų | 85 | 143.8 Ų | 143.8 | 88% | 0.876 | 69% | 0.69 | S | S | * | * | trans | -76.2 | 14.2 | -168.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | F163 | F163-G165 VanDerWaalsContact C-N 3.28Å; F163-G165 PolarHBondContact O-N 2.83Å | ||
| 166 | H | 74.3 | Confident | 73.4 | Confident | 122 Ų | 122 | 137.6 Ų | 137.6 | 57% | 0.565 | 67% | 0.67 | S | S | * | * | trans | -141.5 | 123.2 | 178.8 | -177.7 | 39.3 | 0 | 0 | 0 | 109.1 | P164 D171 | P164-H166 PolarHBondContact O-N 3.1Å; H166-D171 IonicContact CE1-OD1 3.57Å; H166-D171 IonicContact CE1-OD2 3.23Å; H166-D171 PolarHBondContact CE1-OD2 2.92Å; H166-D171 VanDerWaalsContact CE1-OD2 3.23Å; H166-D171 IonicContact NE2-OD2 3.89Å | ||
| 167 | Q | 80.9 | Confident | 73.9 | Confident | 120 Ų | 120 | 134.5 Ų | 134.5 | 56% | 0.561 | 67% | 0.671 | S | S | * | * | trans | -115.7 | 97.5 | 173.9 | -68.1 | -176.4 | -62.4 | 0 | 0 | 107.9 | E169 L170 | Q167-E169 PolarHBondContact O-N 2.78Å; Q167-L170 HydrophobicContact CB-CD1 4.19Å; Q167-L170 HydrophobicContact CB-CG 4.18Å; Q167-L170 PolarHBondContact O-N 3.42Å | ||
| 168 | P | 73.9 | Confident | 74.4 | Confident | 76 Ų | 76 | 131.5 Ų | 131.5 | 49% | 0.494 | 67% | 0.668 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -58.9 | -17.5 | -176.7 | -25.9 | 35.1 | 0 | 0 | 0 | 114.3 | L170 D171 | P168-L170 VanDerWaalsContact C-N 3.31Å; P168-L170 PolarHBondContact O-N 3.14Å; P168-D171 WeakPolarHBondContact CA-OD2 3.35Å |
| 169 | E | 77.9 | Confident | 75 | Confident | 163 Ų | 163 | 131 Ų | 131 | 76% | 0.762 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | -32.2 | 174.2 | -63.9 | 178.3 | -174.3 | 0 | 0 | 112.7 | Q167 K176 | Q167-E169 PolarHBondContact O-N 2.78Å; E169-K176 PolarHBondContact O-NZ 2.98Å |
| 170 | L | 77.4 | Confident | 75.3 | Confident | 132 Ų | 132 | 129.7 Ų | 129.7 | 69% | 0.691 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -85.3 | -10.3 | -178.8 | -62.2 | -177.6 | 0 | 0 | 0 | 114 | Q167 P168 | Q167-L170 HydrophobicContact CB-CD1 4.19Å; Q167-L170 HydrophobicContact CB-CG 4.18Å; Q167-L170 PolarHBondContact O-N 3.42Å; P168-L170 VanDerWaalsContact C-N 3.31Å; P168-L170 PolarHBondContact O-N 3.14Å |
| 171 | D | 81 | Confident | 75.8 | Confident | 52 Ų | 52 | 127.1 Ų | 127.1 | 28% | 0.278 | 65% | 0.651 | S | S | . | * | S | Bend | trans | -62.9 | 138.5 | -179.4 | -67.1 | -31.2 | 0 | 0 | 0 | 111.1 | H166 P168 K176 | H166-D171 IonicContact CE1-OD1 3.57Å; H166-D171 IonicContact CE1-OD2 3.23Å; H166-D171 PolarHBondContact CE1-OD2 2.92Å; H166-D171 VanDerWaalsContact CE1-OD2 3.23Å; H166-D171 IonicContact NE2-OD2 3.89Å; P168-D171 WeakPolarHBondContact CA-OD2 3.35Å; D171-K176 WeakPolarHBondContact O-CE 3.35Å |
| 172 | P | 81.8 | Confident | 76.2 | Confident | 69 Ų | 69 | 128.4 Ų | 128.4 | 45% | 0.448 | 67% | 0.665 | S | S | . | * | trans | -57.4 | 145.8 | 176.9 | -26 | 33 | 0 | 0 | 0 | 112.2 | R174 Y175 | P172-R174 PolarHBondContact O-N 2.94Å; P172-Y175 HydrophobicContact CB-CD2 3.99Å; P172-Y175 HydrophobicContact CB-CE2 4.33Å; P172-Y175 HydrophobicContact CG-CD2 4.09Å; P172-Y175 HydrophobicContact CG-CE2 4.27Å; P172-Y175 PolarHBondContact O-N 3.4Å | ||
| 173 | P | 74.9 | Confident | 76.9 | Confident | 113 Ų | 113 | 124.8 Ų | 124.8 | 73% | 0.734 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54 | -23.1 | -177.2 | -28.6 | 35 | 0 | 0 | 0 | 115.4 | Y175 K176 | P173-Y175 PolarHBondContact O-N 3.1Å; P173-K176 PolarHBondContact O-N 2.96Å |
| 174 | R | 74 | Confident | 77.6 | Confident | 234 Ų | 234 | 123.3 Ų | 123.3 | 88% | 0.883 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | -19.3 | 176.5 | -62.6 | -175 | 179.6 | -165.7 | -0.3 | 114.3 | P172 | P172-R174 PolarHBondContact O-N 2.94Š|
| 175 | Y | 71 | Confident | 77.9 | Confident | 186 Ų | 186 | 121.8 Ų | 121.8 | 73% | 0.729 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.6 | -7.1 | -179.7 | -57.2 | -70.2 | 0 | 0 | 0 | 113 | P172 P173 | P172-Y175 HydrophobicContact CB-CD2 3.99Å; P172-Y175 HydrophobicContact CB-CE2 4.33Å; P172-Y175 HydrophobicContact CG-CD2 4.09Å; P172-Y175 HydrophobicContact CG-CE2 4.27Å; P172-Y175 PolarHBondContact O-N 3.4Å; P173-Y175 PolarHBondContact O-N 3.1Å |
| 176 | K | 78.5 | Confident | 78.5 | Confident | 90 Ų | 90 | 121.6 Ų | 121.6 | 39% | 0.391 | 62% | 0.62 | S | S | . | * | S | Bend | trans | -75.5 | 141.2 | 175.4 | -60.2 | -160.4 | -176.6 | -162.7 | 0 | 109.9 | E169 D171 P173 T178 | E169-K176 PolarHBondContact O-NZ 2.98Å; D171-K176 WeakPolarHBondContact O-CE 3.35Å; P173-K176 PolarHBondContact O-N 2.96Å; K176-T178 PolarHBondContact O-N 2.76Å; K176-T178 VanDerWaalsContact O-N 3.11Å |
| 177 | C | 74.6 | Confident | 78.7 | Confident | 133 Ų | 133 | 123.8 Ų | 123.8 | 90% | 0.899 | 63% | 0.625 | S | S | * | * | trans | -64 | 112.8 | 171.6 | -171.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 178 | T | 73.7 | Confident | 78.4 | Confident | 124 Ų | 124 | 121.3 Ų | 121.3 | 76% | 0.761 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -70 | 134.7 | 174.2 | -53.2 | 0 | 0 | 0 | 0 | 109.4 | K176 | K176-T178 PolarHBondContact O-N 2.76Å; K176-T178 VanDerWaalsContact O-N 3.11Å |
| 179 | E | 79.7 | Confident | 78.2 | Confident | 177 Ų | 177 | 127.2 Ų | 127.2 | 83% | 0.827 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 144.5 | 177 | -168.6 | 171.7 | -171.2 | 0 | 0 | 111.5 | S181 | E179-S181 PolarHBondContact O-N 3.16Š|
| 180 | K | 81.7 | Confident | 77.4 | Confident | 136 Ų | 136 | 128.2 Ų | 128.2 | 59% | 0.591 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 126.6 | 179.7 | -69.4 | -179.6 | -179.5 | 178 | 0 | 109.9 | M184 N185 | K180-M184 HydrophobicContact CB-CB 4.27Å; K180-N185 WeakPolarHBondContact CB-OD1 3.16Å; K180-N185 VanDerWaalsContact CD-OD1 3.31Å; K180-N185 WeakPolarHBondContact CD-OD1 3.27Å; K180-N185 PolarHBondContact O-ND2 3.33Å |
| 181 | S | 83.9 | Confident | 77.4 | Confident | 64 Ų | 64 | 128.1 Ų | 128.1 | 45% | 0.448 | 66% | 0.662 | S | S | . | * | P | Polyproline II helix | trans | -61.8 | 156.7 | 176.1 | 71.9 | 0 | 0 | 0 | 0 | 111.7 | E179 Y183 M184 N185 | E179-S181 PolarHBondContact O-N 3.16Å; S181-Y183 PolarHBondContact O-N 2.84Å; S181-Y183 VanDerWaalsContact O-N 3.09Å; S181-M184 WeakPolarHBondContact O-CA 3.44Å; S181-M184 PolarHBondContact O-N 2.9Å; S181-M184 PolarHBondContact OG-N 3.28Å; S181-N185 PolarHBondContact O-N 3.27Å |
| 182 | T | 81.9 | Confident | 77.2 | Confident | 121 Ų | 121 | 132.1 Ų | 132.1 | 74% | 0.742 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -53.7 | -32.5 | 176.7 | -39 | 0 | 0 | 0 | 0 | 112.4 | S186 | T182-S186 WeakPolarHBondContact O-CB 3.48Å; T182-S186 PolarHBondContact O-N 3.38Å; T182-S186 PolarHBondContact O-OG 2.83Å |
| 183 | Y | 82.1 | Confident | 76.9 | Confident | 159 Ų | 159 | 135.6 Ų | 135.6 | 62% | 0.624 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -66.3 | -48.4 | 172.4 | -178.5 | -94.7 | 0 | 0 | 0 | 111.8 | S181 N185 S186 Y187 | S181-Y183 PolarHBondContact O-N 2.84Å; S181-Y183 VanDerWaalsContact O-N 3.09Å; Y183-N185 VanDerWaalsContact C-N 3.25Å; Y183-N185 PolarHBondContact O-N 3.47Å; Y183-S186 WeakPolarHBondContact CA-OG 3.31Å; Y183-S186 PolarHBondContact O-N 2.77Å; Y183-S186 PolarHBondContact O-OG 2.99Å; Y183-Y187 HydrophobicContact CD1-CD2 4.42Å; Y183-Y187 AromaticContact CD2-CD2 3.62Å; Y183-Y187 HydrophobicContact CD2-CD2 3.62Å; Y183-Y187 AromaticContact CD2-CE2 3.54Å; Y183-Y187 HydrophobicContact CD2-CE2 3.54Å; Y183-Y187 HydrophobicContact CE1-CD2 4.31Å; Y183-Y187 AromaticContact CE2-CD2 3.48Å; Y183-Y187 HydrophobicContact CE2-CD2 3.48Å; Y183-Y187 VanDerWaalsContact CE2-CD2 3.48Å; Y183-Y187 AromaticContact CE2-CE2 3.36Å; Y183-Y187 HydrophobicContact CE2-CE2 3.36Å; Y183-Y187 HydrophobicContact CG-CD2 4.1Å; Y183-Y187 HydrophobicContact CG-CE2 4.43Å; Y183-Y187 AromaticContact CZ-CD2 3.84Å; Y183-Y187 WeakPolarHBondContact O-CD2 3.48Å; Y183-Y187 PolarHBondContact O-N 3.41Å; Y183-Y187 VanDerWaalsContact O-N 3.1Å |
| 184 | M | 82.3 | Confident | 77 | Confident | 119 Ų | 119 | 136.9 Ų | 136.9 | 59% | 0.586 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -64.1 | -29.4 | 177.6 | -68 | -138.1 | 74.8 | 0 | 0 | 113.4 | K180 S181 S188 | K180-M184 HydrophobicContact CB-CB 4.27Å; S181-M184 WeakPolarHBondContact O-CA 3.44Å; S181-M184 PolarHBondContact O-N 2.9Å; S181-M184 PolarHBondContact OG-N 3.28Å; M184-S188 VanDerWaalsContact O-CB 3.29Å; M184-S188 WeakPolarHBondContact O-CB 3.48Å; M184-S188 PolarHBondContact O-N 3.34Å; M184-S188 VanDerWaalsContact O-N 3.07Å; M184-S188 PolarHBondContact O-OG 3.4Å |
| 185 | N | 80.4 | Confident | 77.2 | Confident | 82 Ų | 82 | 130.8 Ų | 130.8 | 44% | 0.439 | 68% | 0.681 | S | S | . | * | H | α-helix | trans | -79.9 | -31.5 | 175.7 | -67 | -26 | 0 | 0 | 0 | 113.4 | K180 S181 Y183 S188 | K180-N185 WeakPolarHBondContact CB-OD1 3.16Å; K180-N185 VanDerWaalsContact CD-OD1 3.31Å; K180-N185 WeakPolarHBondContact CD-OD1 3.27Å; K180-N185 PolarHBondContact O-ND2 3.33Å; S181-N185 PolarHBondContact O-N 3.27Å; Y183-N185 VanDerWaalsContact C-N 3.25Å; Y183-N185 PolarHBondContact O-N 3.47Å; N185-S188 PolarHBondContact O-OG 3.46Å; N185-S188 VanDerWaalsContact O-OG 3.11Å |
| 186 | S | 82.4 | Confident | 77.6 | Confident | 82 Ų | 82 | 127.1 Ų | 127.1 | 57% | 0.573 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -81 | -20.4 | 178.2 | 45.9 | 0 | 0 | 0 | 0 | 113.6 | T182 Y183 | T182-S186 WeakPolarHBondContact O-CB 3.48Å; T182-S186 PolarHBondContact O-N 3.38Å; T182-S186 PolarHBondContact O-OG 2.83Å; Y183-S186 WeakPolarHBondContact CA-OG 3.31Å; Y183-S186 PolarHBondContact O-N 2.77Å; Y183-S186 PolarHBondContact O-OG 2.99Å |
| 187 | Y | 78.6 | Confident | 77.6 | Confident | 168 Ų | 168 | 129.8 Ų | 129.8 | 66% | 0.659 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -113.7 | 5.2 | 175.9 | -62.4 | -75 | 0 | 0 | 0 | 114.6 | Y183 K189 | Y183-Y187 HydrophobicContact CD1-CD2 4.42Å; Y183-Y187 AromaticContact CD2-CD2 3.62Å; Y183-Y187 HydrophobicContact CD2-CD2 3.62Å; Y183-Y187 AromaticContact CD2-CE2 3.54Å; Y183-Y187 HydrophobicContact CD2-CE2 3.54Å; Y183-Y187 HydrophobicContact CE1-CD2 4.31Å; Y183-Y187 AromaticContact CE2-CD2 3.48Å; Y183-Y187 HydrophobicContact CE2-CD2 3.48Å; Y183-Y187 VanDerWaalsContact CE2-CD2 3.48Å; Y183-Y187 AromaticContact CE2-CE2 3.36Å; Y183-Y187 HydrophobicContact CE2-CE2 3.36Å; Y183-Y187 HydrophobicContact CG-CD2 4.1Å; Y183-Y187 HydrophobicContact CG-CE2 4.43Å; Y183-Y187 AromaticContact CZ-CD2 3.84Å; Y183-Y187 WeakPolarHBondContact O-CD2 3.48Å; Y183-Y187 PolarHBondContact O-N 3.41Å; Y183-Y187 VanDerWaalsContact O-N 3.1Å; Y187-K189 PolarHBondContact O-N 2.93Å |
| 188 | S | 73.9 | Confident | 77.8 | Confident | 67 Ų | 67 | 129.5 Ų | 129.5 | 47% | 0.469 | 68% | 0.683 | S | S | . | * | S | Bend | trans | -66.6 | 116.3 | 165 | 53.9 | 0 | 0 | 0 | 0 | 109 | M184 N185 | M184-S188 VanDerWaalsContact O-CB 3.29Å; M184-S188 WeakPolarHBondContact O-CB 3.48Å; M184-S188 PolarHBondContact O-N 3.34Å; M184-S188 VanDerWaalsContact O-N 3.07Å; M184-S188 PolarHBondContact O-OG 3.4Å; N185-S188 PolarHBondContact O-OG 3.46Å; N185-S188 VanDerWaalsContact O-OG 3.11Å |
| 189 | K | 69.6 | Low | 78.2 | Confident | 200 Ų | 200 | 130 Ų | 130 | 87% | 0.87 | 68% | 0.677 | S | S | * | * | trans | -54.6 | 141.8 | -178.9 | -66.8 | 176 | 175.6 | 178.6 | 0 | 111.7 | Y187 | Y187-K189 PolarHBondContact O-N 2.93Š| ||
| 190 | S | 61.4 | Low | 78 | Confident | 185 Ų | 185 | 125.7 Ų | 125.7 | 100% | 1.294 | 66% | 0.663 | S | S | * | * | trans | -65.7 | 0 | 158.9 | -179.7 | 0 | 0 | 0 | 0 | 111.6 |
Retrieved 190 of 190 residues in 178.9 ms
(Link to these results)