| 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 | 43.7 | Very low | 44.8 | Very low | 250 Ų | 250 | 138.8 Ų | 138.8 | 100% | 1.232 | 85% | 0.851 | S | S | * | * | 0 | 119.3 | 0 | -78.2 | -73.1 | -179.7 | 0 | 0 | 108.1 | |||||
| 2 | A | 52.8 | Low | 44 | Very low | 99 Ų | 99 | 133.5 Ų | 133.5 | 82% | 0.818 | 84% | 0.844 | S | S | * | * | trans | -88.3 | 156.1 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 3 | K | 46.1 | Very low | 43.7 | Very low | 199 Ų | 199 | 139.3 Ų | 139.3 | 87% | 0.865 | 85% | 0.849 | S | S | * | * | trans | -178.9 | 105.8 | 139.5 | -86.9 | -113.9 | -179 | 176.5 | 0 | 107.9 | ||||
| 4 | A | 49 | Very low | 43.7 | Very low | 99 Ų | 99 | 143.5 Ų | 143.5 | 82% | 0.818 | 85% | 0.85 | S | S | * | * | 70.2 | 111.7 | 78.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 5 | G | 45.5 | Very low | 43.8 | Very low | 76 Ų | 76 | 141.4 Ų | 141.4 | 78% | 0.784 | 85% | 0.845 | S | S | * | * | trans | -171.1 | 36.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 6 | D | 48.1 | Very low | 44 | Very low | 151 Ų | 151 | 142.9 Ų | 142.9 | 81% | 0.807 | 85% | 0.847 | S | S | * | * | trans | -79.9 | 117.1 | 171.1 | -135.6 | -65.8 | 0 | 0 | 0 | 109.1 | ||||
| 7 | K | 45 | Very low | 44 | Very low | 202 Ų | 202 | 146.7 Ų | 146.7 | 88% | 0.878 | 85% | 0.85 | S | S | * | * | trans | -136.3 | 74.1 | 171.6 | -74.2 | -172.5 | -178 | 167.7 | 0 | 109.4 | ||||
| 8 | S | 45.5 | Very low | 44.1 | Very low | 106 Ų | 106 | 152.4 Ų | 152.4 | 74% | 0.741 | 86% | 0.855 | S | S | * | * | trans | -94 | 102.7 | 159.9 | 57 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 9 | S | 39.7 | Very low | 43.9 | Very low | 115 Ų | 115 | 155.3 Ų | 155.3 | 80% | 0.804 | 86% | 0.857 | S | S | * | * | trans | -81.3 | 118.3 | 178.1 | 43.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 10 | S | 38 | Very low | 43.3 | Very low | 117 Ų | 117 | 152.3 Ų | 152.3 | 82% | 0.818 | 85% | 0.854 | S | S | * | * | trans | -13.9 | 123.7 | 151.3 | 155 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 11 | S | 39.3 | Very low | 42.7 | Very low | 113 Ų | 113 | 150 Ų | 150 | 79% | 0.79 | 86% | 0.855 | S | S | * | * | trans | -141.3 | 110.1 | 141 | 57.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 12 | G | 34.9 | Very low | 42.2 | Very low | 75 Ų | 75 | 142.8 Ų | 142.8 | 77% | 0.773 | 84% | 0.835 | S | S | * | * | trans | -67.8 | 130.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113 | K14 | G12-K14 PolarHBondContact O-N 3.21Š| ||
| 13 | K | 41 | Very low | 41.3 | Very low | 209 Ų | 209 | 146.9 Ų | 146.9 | 91% | 0.909 | 84% | 0.837 | S | S | * | * | trans | -82.4 | 95.5 | 167.1 | -71.1 | 175.7 | -179.5 | 170 | 0 | 108.7 | S15 | K13-S15 PolarHBondContact O-N 3.5Š| ||
| 14 | K | 43.4 | Very low | 40.6 | Very low | 198 Ų | 198 | 144.3 Ų | 144.3 | 86% | 0.861 | 83% | 0.828 | S | S | * | * | trans | -77.5 | 101.7 | 169.6 | -158.5 | 174.9 | -153.3 | 176 | 0 | 108.6 | G12 L16 | G12-K14 PolarHBondContact O-N 3.21Å; K14-L16 PolarHBondContact O-N 3.48Å | ||
| 15 | S | 45.3 | Very low | 39.9 | Very low | 112 Ų | 112 | 145.6 Ų | 145.6 | 78% | 0.783 | 82% | 0.821 | S | S | * | * | trans | -74.7 | 107.4 | 177.2 | 45.7 | 0 | 0 | 0 | 0 | 110.6 | K13 K17 | K13-S15 PolarHBondContact O-N 3.5Å; S15-K17 PolarHBondContact O-N 2.93Å | ||
| 16 | L | 47.5 | Very low | 39.3 | Very low | 166 Ų | 166 | 151.2 Ų | 151.2 | 87% | 0.869 | 83% | 0.826 | S | S | * | * | trans | -75.4 | 109.7 | 168.7 | -77.4 | 151.8 | 0 | 0 | 0 | 108.9 | K14 R18 | K14-L16 PolarHBondContact O-N 3.48Å; L16-R18 PolarHBondContact O-N 3.06Å | ||
| 17 | K | 42.8 | Very low | 38.3 | Very low | 207 Ų | 207 | 152.9 Ų | 152.9 | 90% | 0.9 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 120.9 | 170.3 | -79.4 | 175.4 | 175.5 | 176.7 | 0 | 109.5 | S15 | S15-K17 PolarHBondContact O-N 2.93Š|
| 18 | R | 46.2 | Very low | 37.7 | Very low | 249 Ų | 249 | 148.2 Ų | 148.2 | 94% | 0.94 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 121.7 | 166 | -70.2 | -176.8 | -70.1 | -154.6 | -1.4 | 108.5 | L16 | L16-R18 PolarHBondContact O-N 3.06Š|
| 19 | K | 39.7 | Very low | 36.9 | Very low | 207 Ų | 207 | 148.4 Ų | 148.4 | 90% | 0.9 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -90 | 134.3 | 171.4 | -172.3 | 161.9 | 177.9 | 177.7 | 0 | 108.8 | ||
| 20 | A | 32.5 | Very low | 36.4 | Very low | 95 Ų | 95 | 146.5 Ų | 146.5 | 79% | 0.785 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 149.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 21 | A | 31.5 | Very low | 36 | Very low | 106 Ų | 106 | 146.1 Ų | 146.1 | 88% | 0.876 | 84% | 0.839 | S | S | * | * | trans | -143.2 | 127.3 | 155.3 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 22 | A | 32.8 | Very low | 35.5 | Very low | 98 Ų | 98 | 144.4 Ų | 144.4 | 81% | 0.81 | 84% | 0.839 | S | S | * | * | trans | -100.5 | -178.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 23 | E | 34.1 | Very low | 35.1 | Very low | 184 Ų | 184 | 149 Ų | 149 | 86% | 0.86 | 85% | 0.846 | S | S | * | * | trans | 84.1 | 138.7 | -179.3 | -82.8 | -167.4 | 130.9 | 0 | 0 | 116.5 | ||||
| 24 | E | 31.4 | Very low | 34.5 | Very low | 145 Ų | 145 | 142.1 Ų | 142.1 | 68% | 0.678 | 83% | 0.834 | S | S | * | * | cis | -160 | 168.4 | 3.8 | -134 | -112.8 | 131 | 0 | 0 | 110.1 | ||||
| 25 | L | 33.1 | Very low | 33.8 | Very low | 127 Ų | 127 | 137.5 Ų | 137.5 | 67% | 0.665 | 83% | 0.833 | S | S | * | * | trans | -63.4 | 158.1 | 178.7 | -76.5 | 140.6 | 0 | 0 | 0 | 113.3 | ||||
| 26 | Q | 34.2 | Very low | 33.6 | Very low | 194 Ų | 194 | 138.8 Ų | 138.8 | 91% | 0.907 | 84% | 0.836 | S | S | * | * | trans | -156.3 | 119.5 | 135.5 | -110.8 | 169.2 | 22.5 | 0 | 0 | 110.8 | ||||
| 27 | E | 26.3 | Very low | 32.9 | Very low | 186 Ų | 186 | 139.5 Ų | 139.5 | 87% | 0.869 | 84% | 0.835 | S | S | * | * | trans | -73.9 | 146.9 | 167.4 | -69 | -179.7 | 136.5 | 0 | 0 | 110.5 | ||||
| 28 | A | 32.2 | Very low | 32.9 | Very low | 104 Ų | 104 | 137.5 Ų | 137.5 | 86% | 0.86 | 83% | 0.834 | S | S | * | * | trans | -145 | 116.4 | 150.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 29 | A | 30.4 | Very low | 32.4 | Very low | 109 Ų | 109 | 128.4 Ų | 128.4 | 90% | 0.901 | 82% | 0.818 | S | S | * | * | trans | -75 | 153.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 30 | G | 27.3 | Very low | 32.5 | Very low | 75 Ų | 75 | 125.4 Ų | 125.4 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | trans | -169.9 | 112.2 | 165.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 31 | A | 30.1 | Very low | 33.1 | Very low | 110 Ų | 110 | 129.1 Ų | 129.1 | 91% | 0.909 | 82% | 0.818 | S | S | * | * | trans | -45.5 | 145.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 32 | G | 28.5 | Very low | 33.9 | Very low | 77 Ų | 77 | 129.2 Ų | 129.2 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | cis | 122.9 | 106.1 | 32.6 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 33 | D | 26.7 | Very low | 34.9 | Very low | 171 Ų | 171 | 130.5 Ų | 130.5 | 91% | 0.914 | 81% | 0.81 | S | S | * | * | trans | -166.5 | 137.5 | 152.2 | -160.6 | -158.1 | 0 | 0 | 0 | 109.6 | ||||
| 34 | G | 28.9 | Very low | 36.1 | Very low | 65 Ų | 65 | 131.1 Ų | 131.1 | 67% | 0.67 | 81% | 0.81 | S | S | * | * | trans | -90.7 | 147.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 35 | A | 29.1 | Very low | 37.1 | Very low | 100 Ų | 100 | 128.6 Ų | 128.6 | 83% | 0.826 | 81% | 0.814 | S | S | * | * | trans | -171.5 | 128.8 | 144.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | E37 | A35-E37 PolarHBondContact O-N 3.22Š| ||
| 36 | T | 40 | Very low | 38.4 | Very low | 139 Ų | 139 | 126.2 Ų | 126.2 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | trans | -66.1 | 122.1 | 172.5 | -40.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 37 | E | 32.6 | Very low | 39.9 | Very low | 182 Ų | 182 | 120 Ų | 120 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | trans | -146.8 | 131.5 | 150.9 | 61.7 | -175.8 | 151.9 | 0 | 0 | 112.8 | A35 G39 | A35-E37 PolarHBondContact O-N 3.22Å; E37-G39 PolarHBondContact O-N 3.03Å | ||
| 38 | N | 43.7 | Very low | 41.8 | Very low | 164 Ų | 164 | 113 Ų | 113 | 88% | 0.877 | 76% | 0.761 | S | S | * | * | trans | -64.8 | 96.2 | 177.6 | -71.9 | -80.1 | 0 | 0 | 0 | 109.8 | ||||
| 39 | G | 35.7 | Very low | 43.9 | Very low | 59 Ų | 59 | 112.1 Ų | 112.1 | 61% | 0.608 | 75% | 0.746 | S | S | * | * | trans | -110.5 | 95.5 | 168.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | E37 Q41 | E37-G39 PolarHBondContact O-N 3.03Å; G39-Q41 VanDerWaalsContact C-N 3.34Å; G39-Q41 PolarHBondContact O-N 3.02Å | ||
| 40 | V | 41.1 | Very low | 46.1 | Very low | 143 Ų | 143 | 113.4 Ų | 113.4 | 87% | 0.867 | 75% | 0.745 | S | S | * | * | trans | -50.8 | 103.7 | 162.7 | 171.7 | 0 | 0 | 0 | 0 | 106.7 | P42 | V40-P42 WeakPolarHBondContact O-CD 3.36Å; V40-P42 VanDerWaalsContact O-N 3.14Å | ||
| 41 | Q | 44.7 | Very low | 48.5 | Very low | 174 Ų | 174 | 113.5 Ų | 113.5 | 81% | 0.813 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -57 | 124.7 | 177.6 | -70.3 | -170.9 | 24.9 | 0 | 0 | 107.4 | G39 | G39-Q41 VanDerWaalsContact C-N 3.34Å; G39-Q41 PolarHBondContact O-N 3.02Å |
| 42 | P | 49.9 | Very low | 50.9 | Low | 108 Ų | 108 | 112.1 Ų | 112.1 | 70% | 0.701 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 141.6 | 175.9 | 23.9 | -32.4 | 0 | 0 | 0 | 108.3 | V40 K44 | V40-P42 WeakPolarHBondContact O-CD 3.36Å; V40-P42 VanDerWaalsContact O-N 3.14Å; P42-K44 PolarHBondContact O-N 2.98Å |
| 43 | P | 53.7 | Low | 53.6 | Low | 124 Ų | 124 | 110.7 Ų | 110.7 | 81% | 0.805 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 121.3 | -177.6 | 23.1 | -32.9 | 0 | 0 | 0 | 108.8 | A45 | P43-A45 PolarHBondContact O-N 3.44Š|
| 44 | K | 58.2 | Low | 56.4 | Low | 198 Ų | 198 | 103.4 Ų | 103.4 | 86% | 0.861 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -31.5 | 119.8 | 175 | -172.1 | 169.7 | -173.4 | 155.4 | 0 | 110.1 | P42 A46 | P42-K44 PolarHBondContact O-N 2.98Å; K44-A46 PolarHBondContact O-N 3.15Å |
| 45 | A | 53.8 | Low | 59.1 | Low | 92 Ų | 92 | 104.6 Ų | 104.6 | 76% | 0.76 | 66% | 0.657 | S | S | * | * | trans | -21.2 | 115.4 | -173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | P43 A47 | P43-A45 PolarHBondContact O-N 3.44Å; A45-A47 PolarHBondContact O-N 3.23Å | ||
| 46 | A | 59.5 | Low | 62 | Low | 76 Ų | 76 | 104.8 Ų | 104.8 | 63% | 0.628 | 64% | 0.641 | S | S | * | * | trans | -45 | 138.3 | 174 | 0 | 0 | 0 | 0 | 0 | 109.3 | K44 F48 | K44-A46 PolarHBondContact O-N 3.15Å; A46-F48 CarbonylContact C-O 3.54Å; A46-F48 VanDerWaalsContact CB-O 3.31Å; A46-F48 WeakPolarHBondContact CB-O 3.1Å; A46-F48 PolarHBondContact O-N 3Å; A46-F48 VanDerWaalsContact O-O 3.09Å | ||
| 47 | A | 64.7 | Low | 64.5 | Low | 65 Ų | 65 | 99.1 Ų | 99.1 | 54% | 0.537 | 61% | 0.605 | S | S | . | * | S | Bend | trans | -58.9 | -3.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | A45 | A45-A47 PolarHBondContact O-N 3.23Š|
| 48 | F | 67.4 | Low | 67.5 | Low | 37 Ų | 37 | 99.8 Ų | 99.8 | 16% | 0.162 | 61% | 0.605 | C | S | . | * | S | Bend | trans | -130.6 | 147.5 | 179.2 | -61.9 | -64.8 | 0 | 0 | 0 | 109 | A46 F52 I54 W70 | A46-F48 CarbonylContact C-O 3.54Å; A46-F48 VanDerWaalsContact CB-O 3.31Å; A46-F48 WeakPolarHBondContact CB-O 3.1Å; A46-F48 PolarHBondContact O-N 3Å; A46-F48 VanDerWaalsContact O-O 3.09Å; F48-F52 HydrophobicContact CB-CD1 3.96Å; F48-F52 AromaticContact CD1-CD1 3.6Å; F48-F52 HydrophobicContact CD1-CD1 3.6Å; F48-F52 AromaticContact CD1-CE1 3.7Å; F48-F52 HydrophobicContact CD1-CE1 3.7Å; F48-F52 HydrophobicContact CE1-CD1 4.5Å; F48-F52 HydrophobicContact CE1-CE1 4.2Å; F48-F52 HydrophobicContact CG-CD1 4.03Å; F48-I54 HydrophobicContact CD2-CD1 4.46Å; F48-I54 HydrophobicContact CD2-CG1 4.16Å; F48-I54 HydrophobicContact CE1-CD1 4.41Å; F48-I54 HydrophobicContact CE1-CG1 3.91Å; F48-I54 HydrophobicContact CE2-CD1 3.42Å; F48-I54 VanDerWaalsContact CE2-CD1 3.42Å; F48-I54 HydrophobicContact CE2-CG1 3.46Å; F48-I54 VanDerWaalsContact CE2-CG1 3.46Å; F48-I54 HydrophobicContact CZ-CD1 3.39Å; F48-I54 HydrophobicContact CZ-CG1 3.32Å; F48-W70 HydrophobicContact CE2-CB 3.82Å; F48-W70 AromaticContact CE2-CD1 3.49Å; F48-W70 VanDerWaalsContact CE2-CD1 3.49Å; F48-W70 AromaticContact CE2-CG 3.69Å; F48-W70 HydrophobicContact CE2-CG 3.69Å; F48-W70 HydrophobicContact CZ-CB 3.93Å; F48-W70 HydrophobicContact CZ-CG 4.3Å |
| 49 | P | 75.9 | Confident | 70 | Confident | 86 Ų | 86 | 95.6 Ų | 95.6 | 56% | 0.558 | 58% | 0.583 | S | S | * | * | trans | -59.2 | 151.4 | 174.8 | 24.6 | -30.7 | 0 | 0 | 0 | 110.3 | G51 F52 | P49-G51 PolarHBondContact O-N 3.06Å; P49-F52 HydrophobicContact CG-CB 3.68Å; P49-F52 HydrophobicContact CG-CG 4.33Å; P49-F52 PolarHBondContact O-N 3.02Å | ||
| 50 | P | 75.6 | Confident | 72.8 | Confident | 136 Ų | 136 | 100.4 Ų | 100.4 | 88% | 0.883 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.9 | 127.8 | 174.8 | -22.6 | 32.2 | 0 | 0 | 0 | 110.4 | ||
| 51 | G | 78.7 | Confident | 75.4 | Confident | 78 Ų | 78 | 101.2 Ų | 101.2 | 80% | 0.804 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 87.6 | -5.1 | -179 | 0 | 0 | 0 | 0 | 0 | 116.3 | P49 | P49-G51 PolarHBondContact O-N 3.06Š|
| 52 | F | 81.3 | Confident | 77.8 | Confident | 81 Ų | 81 | 100.5 Ų | 100.5 | 36% | 0.355 | 57% | 0.571 | S | S | . | * | trans | -98.2 | 116.2 | 173.8 | -180 | -105 | 0 | 0 | 0 | 111.5 | F48 P49 I57 | F48-F52 HydrophobicContact CB-CD1 3.96Å; F48-F52 AromaticContact CD1-CD1 3.6Å; F48-F52 HydrophobicContact CD1-CD1 3.6Å; F48-F52 AromaticContact CD1-CE1 3.7Å; F48-F52 HydrophobicContact CD1-CE1 3.7Å; F48-F52 HydrophobicContact CE1-CD1 4.5Å; F48-F52 HydrophobicContact CE1-CE1 4.2Å; F48-F52 HydrophobicContact CG-CD1 4.03Å; P49-F52 HydrophobicContact CG-CB 3.68Å; P49-F52 HydrophobicContact CG-CG 4.33Å; P49-F52 PolarHBondContact O-N 3.02Å; F52-I57 HydrophobicContact CE1-CD1 4.09Å; F52-I57 HydrophobicContact CE1-CG1 4.28Å; F52-I57 HydrophobicContact CE2-CG1 4.06Å; F52-I57 HydrophobicContact CZ-CD1 3.65Å; F52-I57 HydrophobicContact CZ-CG1 3.43Å; F52-I57 VanDerWaalsContact CZ-CG1 3.43Å | ||
| 53 | S | 84.9 | Confident | 80 | Confident | 47 Ų | 47 | 99.4 Ų | 99.4 | 33% | 0.329 | 55% | 0.553 | S | S | . | * | trans | -100.4 | 144.3 | 170.3 | 79 | 0 | 0 | 0 | 0 | 111.4 | S55 E56 | S53-S55 PolarHBondContact O-N 3.33Å; S53-E56 VanDerWaalsContact CB-OE1 3.23Å; S53-E56 WeakPolarHBondContact CB-OE1 3.32Å; S53-E56 VanDerWaalsContact N-CD 3.33Å; S53-E56 PolarHBondContact N-OE1 3.48Å; S53-E56 VanDerWaalsContact N-OE1 3.1Å; S53-E56 PolarHBondContact N-OE2 3.11Å; S53-E56 VanDerWaalsContact N-OE2 3.1Å; S53-E56 WeakPolarHBondContact O-CB 3.4Å; S53-E56 PolarHBondContact O-N 3.03Å; S53-E56 WeakPolarHBondContact OG-CG 3.23Å; S53-E56 PolarHBondContact OG-OE1 3.21Å | ||
| 54 | I | 86 | Confident | 81.9 | Confident | 18 Ų | 18 | 99.1 Ų | 99.1 | 9% | 0.092 | 54% | 0.541 | C | S | . | . | G | 310 helix | trans | -55.3 | -31.3 | 175.8 | -55.3 | 174.8 | 0 | 0 | 0 | 110.7 | F48 E56 I57 R63 M66 F67 W70 | F48-I54 HydrophobicContact CD2-CD1 4.46Å; F48-I54 HydrophobicContact CD2-CG1 4.16Å; F48-I54 HydrophobicContact CE1-CD1 4.41Å; F48-I54 HydrophobicContact CE1-CG1 3.91Å; F48-I54 HydrophobicContact CE2-CD1 3.42Å; F48-I54 VanDerWaalsContact CE2-CD1 3.42Å; F48-I54 HydrophobicContact CE2-CG1 3.46Å; F48-I54 VanDerWaalsContact CE2-CG1 3.46Å; F48-I54 HydrophobicContact CZ-CD1 3.39Å; F48-I54 HydrophobicContact CZ-CG1 3.32Å; I54-E56 PolarHBondContact O-N 2.8Å; I54-I57 HydrophobicContact CG2-CD1 4.31Å; I54-I57 WeakPolarHBondContact O-CB 3.41Å; I54-I57 WeakPolarHBondContact O-CG1 3.38Å; I54-I57 PolarHBondContact O-N 3.16Å; I54-R63 HydrophobicContact CG2-CG 3.97Å; I54-R63 WeakPolarHBondContact CG2-O 3.46Å; I54-R63 WeakPolarHBondContact O-CG 3.43Å; I54-M66 HydrophobicContact CG2-CB 4.21Å; I54-F67 HydrophobicContact CD1-CB 4.49Å; I54-F67 HydrophobicContact CD1-CD2 4.45Å; I54-F67 HydrophobicContact CG2-CB 4.14Å; I54-W70 HydrophobicContact CD1-CB 3.7Å; I54-W70 HydrophobicContact CD1-CD2 3.99Å; I54-W70 HydrophobicContact CD1-CE3 4.05Å; I54-W70 HydrophobicContact CD1-CG 3.86Å |
| 55 | S | 84.8 | Confident | 83.7 | Confident | 90 Ų | 90 | 95.2 Ų | 95.2 | 63% | 0.629 | 53% | 0.529 | S | S | * | . | G | 310 helix | trans | -64.5 | -23.5 | -179.8 | -60.6 | 0 | 0 | 0 | 0 | 113.8 | S53 I57 R63 | S53-S55 PolarHBondContact O-N 3.33Å; S55-I57 VanDerWaalsContact C-N 3.29Å; S55-I57 PolarHBondContact O-N 3.32Å; S55-R63 PolarHBondContact O-NH1 3.23Å |
| 56 | E | 90.4 | Very high | 85.5 | Confident | 103 Ų | 103 | 93.8 Ų | 93.8 | 48% | 0.481 | 51% | 0.507 | S | S | . | . | G | 310 helix | trans | -73.5 | -19.1 | 176.8 | -70.6 | 145.1 | -142.7 | 0 | 0 | 113 | S53 I54 K58 | S53-E56 VanDerWaalsContact CB-OE1 3.23Å; S53-E56 WeakPolarHBondContact CB-OE1 3.32Å; S53-E56 VanDerWaalsContact N-CD 3.33Å; S53-E56 PolarHBondContact N-OE1 3.48Å; S53-E56 VanDerWaalsContact N-OE1 3.1Å; S53-E56 PolarHBondContact N-OE2 3.11Å; S53-E56 VanDerWaalsContact N-OE2 3.1Å; S53-E56 WeakPolarHBondContact O-CB 3.4Å; S53-E56 PolarHBondContact O-N 3.03Å; S53-E56 WeakPolarHBondContact OG-CG 3.23Å; S53-E56 PolarHBondContact OG-OE1 3.21Å; I54-E56 PolarHBondContact O-N 2.8Å; E56-K58 PolarHBondContact O-N 3.01Å |
| 57 | I | 91.6 | Very high | 87.1 | Confident | 21 Ų | 21 | 94.1 Ų | 94.1 | 11% | 0.108 | 49% | 0.494 | C | S | . | . | trans | -69 | 99 | -178.2 | -57.1 | 172.7 | 0 | 0 | 0 | 110 | F52 I54 S55 N59 R62 R63 M66 | F52-I57 HydrophobicContact CE1-CD1 4.09Å; F52-I57 HydrophobicContact CE1-CG1 4.28Å; F52-I57 HydrophobicContact CE2-CG1 4.06Å; F52-I57 HydrophobicContact CZ-CD1 3.65Å; F52-I57 HydrophobicContact CZ-CG1 3.43Å; F52-I57 VanDerWaalsContact CZ-CG1 3.43Å; I54-I57 HydrophobicContact CG2-CD1 4.31Å; I54-I57 WeakPolarHBondContact O-CB 3.41Å; I54-I57 WeakPolarHBondContact O-CG1 3.38Å; I54-I57 PolarHBondContact O-N 3.16Å; S55-I57 VanDerWaalsContact C-N 3.29Å; S55-I57 PolarHBondContact O-N 3.32Å; I57-N59 VanDerWaalsContact C-N 3.27Å; I57-N59 PolarHBondContact O-N 2.83Å; I57-N59 VanDerWaalsContact O-N 3.14Å; I57-R62 HydrophobicContact CG2-CB 3.93Å; I57-R63 HydrophobicContact CB-CB 4.13Å; I57-R63 HydrophobicContact CB-CG 4.4Å; I57-R63 HydrophobicContact CG2-CB 4.23Å; I57-R63 PolarHBondContact O-NE 3.01Å; I57-R63 PolarHBondContact O-NH2 2.94Å; I57-M66 HydrophobicContact CD1-CB 4.19Å; I57-M66 HydrophobicContact CD1-CG 4.11Å | ||
| 58 | K | 95.1 | Very high | 88.5 | Confident | 196 Ų | 196 | 93.6 Ų | 93.6 | 85% | 0.852 | 49% | 0.485 | S | S | * | . | trans | -51.6 | -42 | -178.4 | -64.6 | -177.2 | 179.1 | 178.5 | 0 | 113.4 | E56 K60 R63 | E56-K58 PolarHBondContact O-N 3.01Å; K58-K60 PolarHBondContact O-N 3.39Å; K58-R63 PolarHBondContact O-NH2 2.79Å | ||
| 59 | N | 96.1 | Very high | 89.7 | Confident | 76 Ų | 76 | 99.9 Ų | 99.9 | 41% | 0.406 | 51% | 0.507 | S | S | . | . | trans | -69 | 121.4 | -179.2 | -178.1 | -67.1 | 0 | 0 | 0 | 113.1 | I57 Q61 R62 R63 | I57-N59 VanDerWaalsContact C-N 3.27Å; I57-N59 PolarHBondContact O-N 2.83Å; I57-N59 VanDerWaalsContact O-N 3.14Å; N59-Q61 PolarHBondContact O-N 3.49Å; N59-Q61 PolarHBondContact OD1-N 3.5Å; N59-R62 HydrophobicContact CB-CB 4.18Å; N59-R62 HydrophobicContact CB-CG 4.32Å; N59-R62 PolarHBondContact OD1-N 3.16Å; N59-R63 WeakPolarHBondContact O-CB 3.49Å; N59-R63 PolarHBondContact O-N 2.93Å | ||
| 60 | K | 94.9 | Very high | 90.4 | Very high | 160 Ų | 160 | 100 Ų | 100 | 70% | 0.696 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.6 | -45.3 | -177.7 | 179.3 | 66.4 | 175.3 | -128.3 | 0 | 113.9 | K58 R63 H64 | K58-K60 PolarHBondContact O-N 3.39Å; K60-R63 PolarHBondContact O-N 2.99Å; K60-H64 VanDerWaalsContact O-CB 3.32Å; K60-H64 WeakPolarHBondContact O-CB 3.15Å; K60-H64 PolarHBondContact O-N 3.49Å |
| 61 | Q | 96.5 | Very high | 91.2 | Very high | 159 Ų | 159 | 98.1 Ų | 98.1 | 74% | 0.743 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -67.5 | -47.8 | -176.7 | -67.4 | 172.5 | -19.1 | 0 | 0 | 110.7 | N59 R63 H64 L65 | N59-Q61 PolarHBondContact O-N 3.49Å; N59-Q61 PolarHBondContact OD1-N 3.5Å; Q61-R63 PolarHBondContact O-N 3.26Å; Q61-H64 PolarHBondContact O-N 3.02Å; Q61-L65 WeakPolarHBondContact O-CB 3.15Å; Q61-L65 PolarHBondContact O-N 2.75Å |
| 62 | R | 94.8 | Very high | 92 | Very high | 159 Ų | 159 | 99.1 Ų | 99.1 | 60% | 0.6 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -61.7 | -43.7 | 176.1 | -67.9 | -169.5 | 67.4 | -168.2 | -1.1 | 111.5 | I57 N59 L65 M66 | I57-R62 HydrophobicContact CG2-CB 3.93Å; N59-R62 HydrophobicContact CB-CB 4.18Å; N59-R62 HydrophobicContact CB-CG 4.32Å; N59-R62 PolarHBondContact OD1-N 3.16Å; R62-L65 PolarHBondContact O-N 2.92Å; R62-M66 WeakPolarHBondContact O-CB 3.38Å; R62-M66 WeakPolarHBondContact O-CG 3.5Å; R62-M66 PolarHBondContact O-N 3.46Å |
| 63 | R | 95.3 | Very high | 92.4 | Very high | 86 Ų | 86 | 98.5 Ų | 98.5 | 33% | 0.325 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -58.1 | -48.5 | 176 | -169.6 | -175.1 | -38.7 | -147 | 12 | 111.7 | I54 S55 I57 K58 N59 K60 Q61 M66 F67 | I54-R63 HydrophobicContact CG2-CG 3.97Å; I54-R63 WeakPolarHBondContact CG2-O 3.46Å; I54-R63 WeakPolarHBondContact O-CG 3.43Å; S55-R63 PolarHBondContact O-NH1 3.23Å; I57-R63 HydrophobicContact CB-CB 4.13Å; I57-R63 HydrophobicContact CB-CG 4.4Å; I57-R63 HydrophobicContact CG2-CB 4.23Å; I57-R63 PolarHBondContact O-NE 3.01Å; I57-R63 PolarHBondContact O-NH2 2.94Å; K58-R63 PolarHBondContact O-NH2 2.79Å; N59-R63 WeakPolarHBondContact O-CB 3.49Å; N59-R63 PolarHBondContact O-N 2.93Å; K60-R63 PolarHBondContact O-N 2.99Å; Q61-R63 PolarHBondContact O-N 3.26Å; R63-M66 PolarHBondContact O-N 3.41Å; R63-F67 WeakPolarHBondContact O-CB 3.44Å; R63-F67 PolarHBondContact O-N 3.47Å |
| 64 | H | 94.9 | Very high | 92.7 | Very high | 117 Ų | 117 | 99.3 Ų | 99.3 | 54% | 0.542 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.7 | -45 | -179.6 | -178 | 69.2 | 0 | 0 | 0 | 112.3 | K60 Q61 M66 F67 T68 | K60-H64 VanDerWaalsContact O-CB 3.32Å; K60-H64 WeakPolarHBondContact O-CB 3.15Å; K60-H64 PolarHBondContact O-N 3.49Å; Q61-H64 PolarHBondContact O-N 3.02Å; H64-M66 PolarHBondContact O-N 2.94Å; H64-F67 PolarHBondContact O-N 3.25Å; H64-T68 PolarHBondContact O-N 3.19Å; H64-T68 PolarHBondContact O-OG1 2.76Å |
| 65 | L | 94.7 | Very high | 93.1 | Very high | 117 Ų | 117 | 106.3 Ų | 106.3 | 61% | 0.613 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -58.6 | -47.7 | 176.8 | 178.6 | 64.6 | 0 | 0 | 0 | 111.4 | Q61 R62 T68 R69 | Q61-L65 WeakPolarHBondContact O-CB 3.15Å; Q61-L65 PolarHBondContact O-N 2.75Å; R62-L65 PolarHBondContact O-N 2.92Å; L65-T68 PolarHBondContact O-N 3.17Å; L65-R69 WeakPolarHBondContact O-CB 3.28Å; L65-R69 PolarHBondContact O-N 3.34Å |
| 66 | M | 92.8 | Very high | 93.5 | Very high | 61 Ų | 61 | 107.9 Ų | 107.9 | 30% | 0.3 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.4 | -41.2 | 179.1 | -71 | -58.4 | 179.5 | 0 | 0 | 112 | I54 I57 R62 R63 H64 T68 R69 W70 | I54-M66 HydrophobicContact CG2-CB 4.21Å; I57-M66 HydrophobicContact CD1-CB 4.19Å; I57-M66 HydrophobicContact CD1-CG 4.11Å; R62-M66 WeakPolarHBondContact O-CB 3.38Å; R62-M66 WeakPolarHBondContact O-CG 3.5Å; R62-M66 PolarHBondContact O-N 3.46Å; R63-M66 PolarHBondContact O-N 3.41Å; H64-M66 PolarHBondContact O-N 2.94Å; M66-T68 PolarHBondContact O-N 3.2Å; M66-R69 PolarHBondContact O-N 3.28Å; M66-W70 VanDerWaalsContact O-CB 3.31Å; M66-W70 WeakPolarHBondContact O-CB 3.5Å; M66-W70 PolarHBondContact O-N 2.94Å |
| 67 | F | 93.1 | Very high | 93.5 | Very high | 83 Ų | 83 | 107.6 Ų | 107.6 | 36% | 0.364 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -59.2 | -46.2 | 174.5 | 179.7 | -101.6 | 0 | 0 | 0 | 112.1 | I54 R63 H64 W70 K71 | I54-F67 HydrophobicContact CD1-CB 4.49Å; I54-F67 HydrophobicContact CD1-CD2 4.45Å; I54-F67 HydrophobicContact CG2-CB 4.14Å; R63-F67 WeakPolarHBondContact O-CB 3.44Å; R63-F67 PolarHBondContact O-N 3.47Å; H64-F67 PolarHBondContact O-N 3.25Å; F67-W70 HydrophobicContact CD2-CE3 4.08Å; F67-W70 HydrophobicContact CD2-CZ3 4.27Å; F67-W70 HydrophobicContact CE2-CE3 4.13Å; F67-W70 AromaticContact CE2-CZ3 3.89Å; F67-W70 HydrophobicContact CE2-CZ3 3.89Å; F67-W70 PolarHBondContact O-N 2.95Å; F67-K71 HydrophobicContact CE1-CD 4.05Å; F67-K71 HydrophobicContact CZ-CD 4.29Å; F67-K71 VanDerWaalsContact O-CB 3.29Å; F67-K71 WeakPolarHBondContact O-CB 3.39Å; F67-K71 PolarHBondContact O-N 3.19Å |
| 68 | T | 93.9 | Very high | 93.5 | Very high | 55 Ų | 55 | 113.4 Ų | 113.4 | 34% | 0.337 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66 | -41.1 | 179.2 | -64.1 | 0 | 0 | 0 | 0 | 111.6 | H64 L65 M66 Q72 | H64-T68 PolarHBondContact O-N 3.19Å; H64-T68 PolarHBondContact O-OG1 2.76Å; L65-T68 PolarHBondContact O-N 3.17Å; M66-T68 PolarHBondContact O-N 3.2Å; T68-Q72 VanDerWaalsContact O-CG 3.27Å; T68-Q72 WeakPolarHBondContact O-CG 3.41Å; T68-Q72 PolarHBondContact O-N 3.05Å; T68-Q72 PolarHBondContact O-NE2 3.19Å |
| 69 | R | 92.6 | Very high | 93.3 | Very high | 168 Ų | 168 | 108.7 Ų | 108.7 | 63% | 0.634 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.9 | -48.8 | 174 | -177.1 | 175.2 | 177.3 | 159.2 | -1.8 | 111.2 | L65 M66 K71 Q72 Q73 | L65-R69 WeakPolarHBondContact O-CB 3.28Å; L65-R69 PolarHBondContact O-N 3.34Å; M66-R69 PolarHBondContact O-N 3.28Å; R69-K71 PolarHBondContact O-N 3.45Å; R69-Q72 WeakPolarHBondContact O-CB 3.47Å; R69-Q72 PolarHBondContact O-N 2.96Å; R69-Q73 WeakPolarHBondContact O-CG 3.34Å; R69-Q73 PolarHBondContact O-N 3.18Å |
| 70 | W | 91.4 | Very high | 93.1 | Very high | 90 Ų | 90 | 107.2 Ų | 107.2 | 34% | 0.341 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.2 | -47.2 | 177.7 | 172.4 | 70.7 | 0 | 0 | 0 | 112.1 | F48 I54 M66 F67 Q72 Q73 Q74 | F48-W70 HydrophobicContact CE2-CB 3.82Å; F48-W70 AromaticContact CE2-CD1 3.49Å; F48-W70 VanDerWaalsContact CE2-CD1 3.49Å; F48-W70 AromaticContact CE2-CG 3.69Å; F48-W70 HydrophobicContact CE2-CG 3.69Å; F48-W70 HydrophobicContact CZ-CB 3.93Å; F48-W70 HydrophobicContact CZ-CG 4.3Å; I54-W70 HydrophobicContact CD1-CB 3.7Å; I54-W70 HydrophobicContact CD1-CD2 3.99Å; I54-W70 HydrophobicContact CD1-CE3 4.05Å; I54-W70 HydrophobicContact CD1-CG 3.86Å; M66-W70 VanDerWaalsContact O-CB 3.31Å; M66-W70 WeakPolarHBondContact O-CB 3.5Å; M66-W70 PolarHBondContact O-N 2.94Å; F67-W70 HydrophobicContact CD2-CE3 4.08Å; F67-W70 HydrophobicContact CD2-CZ3 4.27Å; F67-W70 HydrophobicContact CE2-CE3 4.13Å; F67-W70 AromaticContact CE2-CZ3 3.89Å; F67-W70 HydrophobicContact CE2-CZ3 3.89Å; F67-W70 PolarHBondContact O-N 2.95Å; W70-Q72 VanDerWaalsContact C-N 3.25Å; W70-Q72 PolarHBondContact O-N 2.91Å; W70-Q73 PolarHBondContact O-N 3.28Å; W70-Q74 HydrophobicContact CD2-CG 4.14Å; W70-Q74 HydrophobicContact CZ2-CG 3.89Å; W70-Q74 WeakPolarHBondContact O-CG 3.44Å; W70-Q74 PolarHBondContact O-N 3.03Å |
| 71 | K | 92.6 | Very high | 92.7 | Very high | 96 Ų | 96 | 102.3 Ų | 102.3 | 42% | 0.417 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -59.1 | -36.5 | 177.3 | -167.5 | 172.1 | -171.3 | 172.9 | 0 | 112.3 | F67 R69 R75 | F67-K71 HydrophobicContact CE1-CD 4.05Å; F67-K71 HydrophobicContact CZ-CD 4.29Å; F67-K71 VanDerWaalsContact O-CB 3.29Å; F67-K71 WeakPolarHBondContact O-CB 3.39Å; F67-K71 PolarHBondContact O-N 3.19Å; R69-K71 PolarHBondContact O-N 3.45Å; K71-R75 WeakPolarHBondContact O-CG 3.45Å; K71-R75 PolarHBondContact O-N 3.08Å; K71-R75 VanDerWaalsContact O-N 3.12Å |
| 72 | Q | 93.9 | Very high | 92.3 | Very high | 98 Ų | 98 | 102.1 Ų | 102.1 | 46% | 0.458 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.2 | -41.3 | 173.7 | -72.5 | 174.8 | 94.6 | 0 | 0 | 112.3 | T68 R69 W70 R75 K76 | T68-Q72 VanDerWaalsContact O-CG 3.27Å; T68-Q72 WeakPolarHBondContact O-CG 3.41Å; T68-Q72 PolarHBondContact O-N 3.05Å; T68-Q72 PolarHBondContact O-NE2 3.19Å; R69-Q72 WeakPolarHBondContact O-CB 3.47Å; R69-Q72 PolarHBondContact O-N 2.96Å; W70-Q72 VanDerWaalsContact C-N 3.25Å; W70-Q72 PolarHBondContact O-N 2.91Å; Q72-R75 PolarHBondContact O-N 3.41Å; Q72-K76 WeakPolarHBondContact O-CG 3.45Å; Q72-K76 PolarHBondContact O-N 3.21Å |
| 73 | Q | 90.8 | Very high | 92 | Very high | 69 Ų | 69 | 100.6 Ų | 100.6 | 32% | 0.322 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -63.5 | -46.9 | 176.3 | -64.8 | -60 | 103.1 | 0 | 0 | 111.3 | R69 W70 R75 K76 E77 | R69-Q73 WeakPolarHBondContact O-CG 3.34Å; R69-Q73 PolarHBondContact O-N 3.18Å; W70-Q73 PolarHBondContact O-N 3.28Å; Q73-R75 VanDerWaalsContact C-N 3.27Å; Q73-R75 PolarHBondContact O-N 2.84Å; Q73-K76 WeakPolarHBondContact O-CB 3.47Å; Q73-K76 PolarHBondContact O-N 3.16Å; Q73-K76 VanDerWaalsContact OE1-NZ 3.12Å; Q73-E77 WeakPolarHBondContact O-CG 3.48Å; Q73-E77 PolarHBondContact O-N 3.36Å |
| 74 | Q | 91 | Very high | 91.5 | Very high | 64 Ų | 64 | 103 Ų | 103 | 30% | 0.299 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -56.4 | -39.6 | 174.3 | -66.6 | -57.3 | 100.1 | 0 | 0 | 112.3 | W70 E77 K78 | W70-Q74 HydrophobicContact CD2-CG 4.14Å; W70-Q74 HydrophobicContact CZ2-CG 3.89Å; W70-Q74 WeakPolarHBondContact O-CG 3.44Å; W70-Q74 PolarHBondContact O-N 3.03Å; Q74-E77 PolarHBondContact OE1-OE2 2.93Å; Q74-K78 WeakPolarHBondContact O-CB 3.34Å; Q74-K78 VanDerWaalsContact O-CG 3.28Å; Q74-K78 WeakPolarHBondContact O-CG 3.34Å; Q74-K78 PolarHBondContact O-N 3.23Å |
| 75 | R | 93.2 | Very high | 90.9 | Very high | 164 Ų | 164 | 102.1 Ų | 102.1 | 62% | 0.619 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -64.7 | -43.9 | 176 | -77 | 174.3 | 176.9 | -178.2 | -2 | 111.8 | K71 Q72 Q73 L79 | K71-R75 WeakPolarHBondContact O-CG 3.45Å; K71-R75 PolarHBondContact O-N 3.08Å; K71-R75 VanDerWaalsContact O-N 3.12Å; Q72-R75 PolarHBondContact O-N 3.41Å; Q73-R75 VanDerWaalsContact C-N 3.27Å; Q73-R75 PolarHBondContact O-N 2.84Å; R75-L79 WeakPolarHBondContact O-CB 3.31Å; R75-L79 PolarHBondContact O-N 3.24Å |
| 76 | K | 94.1 | Very high | 90.3 | Very high | 123 Ų | 123 | 103.6 Ų | 103.6 | 54% | 0.535 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.3 | -42.7 | 177.5 | -70.6 | 173.5 | -174.2 | 171.3 | 0 | 111.5 | Q72 Q73 L79 A80 | Q72-K76 WeakPolarHBondContact O-CG 3.45Å; Q72-K76 PolarHBondContact O-N 3.21Å; Q73-K76 WeakPolarHBondContact O-CB 3.47Å; Q73-K76 PolarHBondContact O-N 3.16Å; Q73-K76 VanDerWaalsContact OE1-NZ 3.12Å; K76-L79 PolarHBondContact O-N 2.8Å; K76-A80 WeakPolarHBondContact O-CB 3.28Å; K76-A80 PolarHBondContact O-N 3.37Å |
| 77 | E | 91.2 | Very high | 89.8 | Confident | 98 Ų | 98 | 107.8 Ų | 107.8 | 46% | 0.458 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.3 | -46.9 | 177.6 | -72.5 | 169.6 | -164.1 | 0 | 0 | 111.9 | Q73 Q74 L79 A80 A81 | Q73-E77 WeakPolarHBondContact O-CG 3.48Å; Q73-E77 PolarHBondContact O-N 3.36Å; Q74-E77 PolarHBondContact OE1-OE2 2.93Å; E77-L79 VanDerWaalsContact C-N 3.29Å; E77-L79 PolarHBondContact O-N 2.97Å; E77-A80 PolarHBondContact O-N 3.41Å; E77-A80 VanDerWaalsContact O-N 3.16Å; E77-A81 WeakPolarHBondContact O-CB 3.43Å; E77-A81 PolarHBondContact O-N 3.35Å |
| 78 | K | 90.5 | Very high | 89 | Confident | 143 Ų | 143 | 109.4 Ų | 109.4 | 62% | 0.622 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -58.3 | -41.6 | 173.8 | -74.3 | 177.9 | -179.1 | -172.5 | 0 | 112 | Q74 K82 | Q74-K78 WeakPolarHBondContact O-CB 3.34Å; Q74-K78 VanDerWaalsContact O-CG 3.28Å; Q74-K78 WeakPolarHBondContact O-CG 3.34Å; Q74-K78 PolarHBondContact O-N 3.23Å; K78-K82 WeakPolarHBondContact O-CG 3.47Å; K78-K82 PolarHBondContact O-N 3.04Å |
| 79 | L | 91.7 | Very high | 88.2 | Confident | 96 Ų | 96 | 111.4 Ų | 111.4 | 50% | 0.503 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.3 | -42.6 | 176.5 | -165.8 | 87.1 | 0 | 0 | 0 | 111.4 | R75 K76 E77 K82 K83 | R75-L79 WeakPolarHBondContact O-CB 3.31Å; R75-L79 PolarHBondContact O-N 3.24Å; K76-L79 PolarHBondContact O-N 2.8Å; E77-L79 VanDerWaalsContact C-N 3.29Å; E77-L79 PolarHBondContact O-N 2.97Å; L79-K82 PolarHBondContact O-N 3.05Å; L79-K83 WeakPolarHBondContact O-CG 3.45Å; L79-K83 PolarHBondContact O-N 2.91Å |
| 80 | A | 91.1 | Very high | 87.2 | Confident | 45 Ų | 45 | 110.8 Ų | 110.8 | 37% | 0.372 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.8 | -43.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | K76 E77 K83 K84 | K76-A80 WeakPolarHBondContact O-CB 3.28Å; K76-A80 PolarHBondContact O-N 3.37Å; E77-A80 PolarHBondContact O-N 3.41Å; E77-A80 VanDerWaalsContact O-N 3.16Å; A80-K83 PolarHBondContact O-N 3.24Å; A80-K84 WeakPolarHBondContact O-CG 3.31Å; A80-K84 PolarHBondContact O-N 3.32Å |
| 81 | A | 87.6 | Confident | 86.3 | Confident | 58 Ų | 58 | 111 Ų | 111 | 48% | 0.479 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.3 | -45.2 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | E77 K83 K84 L85 | E77-A81 WeakPolarHBondContact O-CB 3.43Å; E77-A81 PolarHBondContact O-N 3.35Å; A81-K83 VanDerWaalsContact C-N 3.32Å; A81-K83 PolarHBondContact O-N 3Å; A81-K84 PolarHBondContact O-N 2.98Å; A81-L85 PolarHBondContact O-N 2.59Å |
| 82 | K | 86.6 | Confident | 85.2 | Confident | 155 Ų | 155 | 111 Ų | 111 | 67% | 0.674 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -60.6 | -40.3 | 174.4 | -73.8 | -179.2 | 179.5 | -168.5 | 0 | 112.6 | K78 L79 K86 | K78-K82 WeakPolarHBondContact O-CG 3.47Å; K78-K82 PolarHBondContact O-N 3.04Å; L79-K82 PolarHBondContact O-N 3.05Å; K82-K86 WeakPolarHBondContact O-CB 3.42Å; K82-K86 PolarHBondContact O-N 3.01Å |
| 83 | K | 88.8 | Confident | 83.9 | Confident | 127 Ų | 127 | 108.3 Ų | 108.3 | 55% | 0.552 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.5 | -40.3 | 176.5 | -74.5 | 177.6 | 178.9 | -173.4 | 0 | 111.8 | L79 A80 A81 K86 K87 | L79-K83 WeakPolarHBondContact O-CG 3.45Å; L79-K83 PolarHBondContact O-N 2.91Å; A80-K83 PolarHBondContact O-N 3.24Å; A81-K83 VanDerWaalsContact C-N 3.32Å; A81-K83 PolarHBondContact O-N 3Å; K83-K86 PolarHBondContact O-N 2.91Å; K83-K87 WeakPolarHBondContact O-CG 3.23Å; K83-K87 PolarHBondContact O-N 2.86Å; K83-K87 VanDerWaalsContact O-N 3.08Å |
| 84 | K | 86 | Confident | 82.5 | Confident | 136 Ų | 136 | 113.3 Ų | 113.3 | 59% | 0.591 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62.2 | -50.6 | 174.7 | -70.6 | 178.9 | 177.2 | -166.3 | 0 | 111.3 | A80 A81 K86 K87 E88 | A80-K84 WeakPolarHBondContact O-CG 3.31Å; A80-K84 PolarHBondContact O-N 3.32Å; A81-K84 PolarHBondContact O-N 2.98Å; K84-K86 VanDerWaalsContact C-N 3.29Å; K84-K86 PolarHBondContact O-N 3.03Å; K84-K87 WeakPolarHBondContact O-CB 3.43Å; K84-K87 PolarHBondContact O-N 3.1Å; K84-E88 WeakPolarHBondContact O-CG 3.33Å; K84-E88 PolarHBondContact O-N 3.1Å |
| 85 | L | 82.3 | Confident | 81.2 | Confident | 98 Ų | 98 | 118.6 Ų | 118.6 | 51% | 0.513 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -57.8 | -40.1 | 176.6 | -171.8 | 75.3 | 0 | 0 | 0 | 112.5 | A81 R89 | A81-L85 PolarHBondContact O-N 2.59Å; L85-R89 VanDerWaalsContact O-CB 3.28Å; L85-R89 WeakPolarHBondContact O-CB 3.42Å; L85-R89 PolarHBondContact O-N 3.06Å |
| 86 | K | 81.9 | Confident | 79.9 | Confident | 149 Ų | 149 | 111.5 Ų | 111.5 | 65% | 0.648 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.6 | -43 | 176.3 | -171.4 | -177.5 | 176.5 | -171.6 | 0 | 111.6 | K82 K83 K84 R89 E90 | K82-K86 WeakPolarHBondContact O-CB 3.42Å; K82-K86 PolarHBondContact O-N 3.01Å; K83-K86 PolarHBondContact O-N 2.91Å; K84-K86 VanDerWaalsContact C-N 3.29Å; K84-K86 PolarHBondContact O-N 3.03Å; K86-R89 PolarHBondContact O-N 3.03Å; K86-E90 WeakPolarHBondContact O-CB 3.43Å; K86-E90 PolarHBondContact O-N 3.2Å |
| 87 | K | 80.9 | Confident | 78.7 | Confident | 149 Ų | 149 | 109.5 Ų | 109.5 | 65% | 0.648 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -65.7 | -44.1 | 177.7 | -72.2 | 177.5 | 175.9 | -164.6 | 0 | 112 | K83 K84 R89 E90 A91 | K83-K87 WeakPolarHBondContact O-CG 3.23Å; K83-K87 PolarHBondContact O-N 2.86Å; K83-K87 VanDerWaalsContact O-N 3.08Å; K84-K87 WeakPolarHBondContact O-CB 3.43Å; K84-K87 PolarHBondContact O-N 3.1Å; K87-R89 VanDerWaalsContact C-N 3.31Å; K87-R89 PolarHBondContact O-N 3.26Å; K87-E90 PolarHBondContact O-N 3.47Å; K87-A91 WeakPolarHBondContact O-CB 3.4Å; K87-A91 PolarHBondContact O-N 3.12Å |
| 88 | E | 77.3 | Confident | 77.9 | Confident | 116 Ų | 116 | 110.2 Ų | 110.2 | 54% | 0.542 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62 | -40.3 | 175.9 | -70.8 | 161.6 | -159.4 | 0 | 0 | 111.2 | K84 A91 L92 | K84-E88 WeakPolarHBondContact O-CG 3.33Å; K84-E88 PolarHBondContact O-N 3.1Å; E88-A91 PolarHBondContact O-N 3.3Å; E88-L92 WeakPolarHBondContact O-CB 3.45Å; E88-L92 PolarHBondContact O-N 3.07Å |
| 89 | R | 76.1 | Confident | 77.1 | Confident | 98 Ų | 98 | 110.9 Ų | 110.9 | 37% | 0.37 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.6 | -38.9 | 174.5 | 177.1 | 169.2 | -159.3 | 111.1 | 8.9 | 113.2 | L85 K86 K87 G93 A96 P97 | L85-R89 VanDerWaalsContact O-CB 3.28Å; L85-R89 WeakPolarHBondContact O-CB 3.42Å; L85-R89 PolarHBondContact O-N 3.06Å; K86-R89 PolarHBondContact O-N 3.03Å; K87-R89 VanDerWaalsContact C-N 3.31Å; K87-R89 PolarHBondContact O-N 3.26Å; R89-G93 PolarHBondContact O-N 3.2Å; R89-A96 HydrophobicContact CB-CB 4.05Å; R89-A96 HydrophobicContact CG-CB 3.63Å; R89-P97 PolarHBondContact NH1-O 2.79Å |
| 90 | E | 72.4 | Confident | 76.4 | Confident | 155 Ų | 155 | 111.7 Ų | 111.7 | 72% | 0.724 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -70.6 | -39.2 | 177.8 | -173 | 172.1 | -175.9 | 0 | 0 | 111.6 | K86 K87 | K86-E90 WeakPolarHBondContact O-CB 3.43Å; K86-E90 PolarHBondContact O-N 3.2Å; K87-E90 PolarHBondContact O-N 3.47Å |
| 91 | A | 73 | Confident | 75.9 | Confident | 94 Ų | 94 | 114.9 Ų | 114.9 | 78% | 0.777 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -71.6 | -35.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | K87 E88 | K87-A91 WeakPolarHBondContact O-CB 3.4Å; K87-A91 PolarHBondContact O-N 3.12Å; E88-A91 PolarHBondContact O-N 3.3Å |
| 92 | L | 68.4 | Low | 75.9 | Confident | 96 Ų | 96 | 116.4 Ų | 116.4 | 50% | 0.503 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -92.5 | -10.4 | -176.5 | -165.7 | 59.6 | 0 | 0 | 0 | 113.4 | E88 D94 K95 | E88-L92 WeakPolarHBondContact O-CB 3.45Å; E88-L92 PolarHBondContact O-N 3.07Å; L92-D94 PolarHBondContact O-N 3.03Å; L92-K95 HydrophobicContact CD1-CB 4.06Å; L92-K95 HydrophobicContact CD2-CB 4.42Å; L92-K95 HydrophobicContact CG-CB 3.86Å; L92-K95 PolarHBondContact O-N 3.46Å; L92-K95 VanDerWaalsContact O-N 3.11Å |
| 93 | G | 67 | Low | 76 | Confident | 42 Ų | 42 | 117.9 Ų | 117.9 | 43% | 0.433 | 61% | 0.612 | S | S | . | * | G | 310 helix | trans | 52.6 | -119.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | R89 K95 A96 | R89-G93 PolarHBondContact O-N 3.2Å; G93-K95 VanDerWaalsContact C-N 3.27Å; G93-K95 PolarHBondContact O-N 2.93Å; G93-A96 WeakPolarHBondContact O-CB 3.46Å; G93-A96 PolarHBondContact O-N 3.3Å; G93-A96 VanDerWaalsContact O-N 3.16Å |
| 94 | D | 60.6 | Low | 76.1 | Confident | 173 Ų | 173 | 115 Ų | 115 | 93% | 0.925 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -72.4 | -11.6 | -176.2 | -66 | -34.5 | 0 | 0 | 0 | 114.9 | L92 | L92-D94 PolarHBondContact O-N 3.03Š|
| 95 | K | 64.8 | Low | 76.2 | Confident | 176 Ų | 176 | 115.1 Ų | 115.1 | 77% | 0.765 | 61% | 0.611 | S | S | * | * | G | 310 helix | trans | -94 | 4.5 | 172.1 | -62.9 | -60.7 | -176.6 | -172.6 | 0 | 112.8 | L92 G93 | L92-K95 HydrophobicContact CD1-CB 4.06Å; L92-K95 HydrophobicContact CD2-CB 4.42Å; L92-K95 HydrophobicContact CG-CB 3.86Å; L92-K95 PolarHBondContact O-N 3.46Å; L92-K95 VanDerWaalsContact O-N 3.11Å; G93-K95 VanDerWaalsContact C-N 3.27Å; G93-K95 PolarHBondContact O-N 2.93Å |
| 96 | A | 65.7 | Low | 76.6 | Confident | 15 Ų | 15 | 116.2 Ų | 116.2 | 12% | 0.124 | 62% | 0.618 | C | S | . | * | S | Bend | trans | -66.2 | 141.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | R89 G93 | R89-A96 HydrophobicContact CB-CB 4.05Å; R89-A96 HydrophobicContact CG-CB 3.63Å; G93-A96 WeakPolarHBondContact O-CB 3.46Å; G93-A96 PolarHBondContact O-N 3.3Å; G93-A96 VanDerWaalsContact O-N 3.16Å |
| 97 | P | 68.7 | Low | 76.8 | Confident | 80 Ų | 80 | 113.4 Ų | 113.4 | 52% | 0.519 | 61% | 0.61 | S | S | . | * | P | Polyproline II helix | trans | -53.3 | 131.8 | 177.9 | -27.8 | 34.5 | 0 | 0 | 0 | 111.8 | R89 | R89-P97 PolarHBondContact NH1-O 2.79Š|
| 98 | P | 74.1 | Confident | 77.2 | Confident | 114 Ų | 114 | 112.2 Ų | 112.2 | 74% | 0.74 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -57 | 146.8 | 178.9 | 21.9 | -31.2 | 0 | 0 | 0 | 110.3 | ||
| 99 | K | 73.4 | Confident | 77.9 | Confident | 157 Ų | 157 | 114.3 Ų | 114.3 | 68% | 0.683 | 61% | 0.609 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 130.5 | 177.9 | -68 | 175 | -176.3 | 168.6 | 0 | 107.5 | V101 | K99-V101 PolarHBondContact O-N 2.91Å; K99-V101 VanDerWaalsContact O-N 3.16Å |
| 100 | P | 78.3 | Confident | 78.5 | Confident | 112 Ų | 112 | 115.5 Ų | 115.5 | 73% | 0.727 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 123.9 | 176.9 | 24.8 | -32.5 | 0 | 0 | 0 | 108.6 | P102 | P100-P102 WeakPolarHBondContact O-CD 3.45Š|
| 101 | V | 80.5 | Confident | 79.1 | Confident | 113 Ų | 113 | 116.4 Ų | 116.4 | 69% | 0.685 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 126 | 176.2 | 179.8 | 0 | 0 | 0 | 0 | 107.9 | K99 K103 N107 | K99-V101 PolarHBondContact O-N 2.91Å; K99-V101 VanDerWaalsContact O-N 3.16Å; V101-K103 PolarHBondContact O-N 3.45Å; V101-N107 WeakPolarHBondContact CG1-ND2 3.34Å |
| 102 | P | 87.1 | Confident | 79.6 | Confident | 89 Ų | 89 | 117.3 Ų | 117.3 | 58% | 0.578 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 138.6 | 177.6 | -25.3 | 35.5 | 0 | 0 | 0 | 111.6 | P100 T104 N107 | P100-P102 WeakPolarHBondContact O-CD 3.45Å; P102-T104 HydrophobicContact CB-CG2 4.06Å; P102-T104 PolarHBondContact O-N 3.39Å; P102-N107 PolarHBondContact O-ND2 2.85Å |
| 103 | K | 87.8 | Confident | 80.2 | Confident | 187 Ų | 187 | 121.4 Ų | 121.4 | 81% | 0.813 | 63% | 0.633 | S | S | * | * | trans | -81.2 | 70.8 | 171.1 | -63.2 | -173.2 | 179.6 | -171.4 | 0 | 110 | V101 Q108 | V101-K103 PolarHBondContact O-N 3.45Å; K103-Q108 PolarHBondContact O-NE2 3.33Å | ||
| 104 | T | 92.1 | Very high | 80.9 | Confident | 66 Ų | 66 | 124.3 Ų | 124.3 | 41% | 0.405 | 64% | 0.643 | S | S | . | * | trans | -83.1 | 160.2 | 173.2 | 51.9 | 0 | 0 | 0 | 0 | 110.8 | P102 D106 N107 Q108 | P102-T104 HydrophobicContact CB-CG2 4.06Å; P102-T104 PolarHBondContact O-N 3.39Å; T104-D106 PolarHBondContact O-N 3.36Å; T104-N107 PolarHBondContact O-N 2.95Å; T104-N107 PolarHBondContact OG1-ND2 3.47Å; T104-Q108 PolarHBondContact O-N 3.46Å; T104-Q108 PolarHBondContact O-NE2 3.19Å | ||
| 105 | I | 88.6 | Confident | 81.7 | Confident | 139 Ų | 139 | 121.3 Ų | 121.3 | 71% | 0.713 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | -38.3 | 179.1 | -68.7 | 166.8 | 0 | 0 | 0 | 111.1 | Q108 R109 | I105-Q108 CarbonylContact O-C 3.52Å; I105-Q108 PolarHBondContact O-N 3.36Å; I105-R109 WeakPolarHBondContact O-CB 3.4Å; I105-R109 PolarHBondContact O-N 2.89Å |
| 106 | D | 88.8 | Confident | 82.3 | Confident | 121 Ų | 121 | 117.7 Ų | 117.7 | 65% | 0.647 | 62% | 0.623 | S | S | * | * | G | 310 helix | trans | -60.7 | -47.1 | 176 | -164.6 | 60.4 | 0 | 0 | 0 | 112.2 | T104 Q108 R109 | T104-D106 PolarHBondContact O-N 3.36Å; D106-Q108 PolarHBondContact O-N 2.95Å; D106-R109 WeakPolarHBondContact O-CB 3.48Å; D106-R109 PolarHBondContact O-N 2.87Å |
| 107 | N | 87.6 | Confident | 83 | Confident | 90 Ų | 90 | 121.4 Ų | 121.4 | 48% | 0.481 | 64% | 0.641 | S | S | . | * | G | 310 helix | trans | -68.3 | -16.9 | 178 | -68.2 | -8.7 | 0 | 0 | 0 | 114 | V101 P102 T104 | V101-N107 WeakPolarHBondContact CG1-ND2 3.34Å; P102-N107 PolarHBondContact O-ND2 2.85Å; T104-N107 PolarHBondContact O-N 2.95Å; T104-N107 PolarHBondContact OG1-ND2 3.47Å |
| 108 | Q | 89.8 | Confident | 83.4 | Confident | 123 Ų | 123 | 122 Ų | 122 | 58% | 0.575 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -106.1 | -2 | 178.4 | -77.7 | 155.9 | 97.6 | 0 | 0 | 112.4 | K103 T104 I105 D106 V110 | K103-Q108 PolarHBondContact O-NE2 3.33Å; T104-Q108 PolarHBondContact O-N 3.46Å; T104-Q108 PolarHBondContact O-NE2 3.19Å; I105-Q108 CarbonylContact O-C 3.52Å; I105-Q108 PolarHBondContact O-N 3.36Å; D106-Q108 PolarHBondContact O-N 2.95Å; Q108-V110 PolarHBondContact O-N 2.86Å |
| 109 | R | 91.1 | Very high | 83.6 | Confident | 161 Ų | 161 | 122.3 Ų | 122.3 | 61% | 0.608 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 131.7 | 178.8 | -178.1 | -178 | -69.6 | -90.1 | 1.6 | 108.4 | I105 D106 Y111 | I105-R109 WeakPolarHBondContact O-CB 3.4Å; I105-R109 PolarHBondContact O-N 2.89Å; D106-R109 WeakPolarHBondContact O-CB 3.48Å; D106-R109 PolarHBondContact O-N 2.87Å; R109-Y111 PolarHBondContact O-N 3.37Å |
| 110 | V | 88.6 | Confident | 84 | Confident | 123 Ų | 123 | 118.2 Ų | 118.2 | 75% | 0.745 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 127.1 | 166.9 | -178 | 0 | 0 | 0 | 0 | 106.9 | Q108 D112 | Q108-V110 PolarHBondContact O-N 2.86Å; V110-D112 PolarHBondContact O-N 2.74Å |
| 111 | Y | 85.3 | Confident | 83.9 | Confident | 174 Ų | 174 | 119.9 Ų | 119.9 | 68% | 0.682 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 128.9 | 178.6 | -175.7 | -105.6 | 0 | 0 | 0 | 109.1 | R109 T114 | R109-Y111 PolarHBondContact O-N 3.37Å; Y111-T114 PolarHBondContact OH-OG1 3.14Å |
| 112 | D | 83.4 | Confident | 83.5 | Confident | 112 Ų | 112 | 121.9 Ų | 121.9 | 60% | 0.599 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 129 | 171.4 | -61.2 | -39.8 | 0 | 0 | 0 | 107.5 | V110 T114 | V110-D112 PolarHBondContact O-N 2.74Å; D112-T114 HydrophobicContact CB-CG2 4.18Å; D112-T114 PolarHBondContact O-N 3.45Å |
| 113 | E | 81.5 | Confident | 82.9 | Confident | 183 Ų | 183 | 119.4 Ų | 119.4 | 86% | 0.855 | 61% | 0.609 | S | S | * | * | trans | -70.1 | 82.6 | 176.2 | -65.8 | 175.2 | -177.6 | 0 | 0 | 109.1 | T115 | E113-T115 PolarHBondContact O-N 3Š| ||
| 114 | T | 80.8 | Confident | 82.4 | Confident | 103 Ų | 103 | 115.4 Ų | 115.4 | 63% | 0.632 | 60% | 0.595 | S | S | * | * | trans | -82.7 | 8.3 | -178.6 | 59.1 | 0 | 0 | 0 | 0 | 113.3 | Y111 D112 | Y111-T114 PolarHBondContact OH-OG1 3.14Å; D112-T114 HydrophobicContact CB-CG2 4.18Å; D112-T114 PolarHBondContact O-N 3.45Å | ||
| 115 | T | 78.2 | Confident | 81.6 | Confident | 110 Ų | 110 | 117.5 Ų | 117.5 | 68% | 0.675 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -127 | 129 | -178 | -54.7 | 0 | 0 | 0 | 0 | 108.5 | E113 | E113-T115 PolarHBondContact O-N 3Š|
| 116 | V | 77.2 | Confident | 80.9 | Confident | 99 Ų | 99 | 117.9 Ų | 117.9 | 60% | 0.6 | 60% | 0.602 | S | S | * | * | trans | -67.7 | 133.5 | 176.3 | -167.3 | 0 | 0 | 0 | 0 | 108.6 | P118 V123 | V116-P118 WeakPolarHBondContact O-CD 3.35Å; V116-V123 HydrophobicContact CB-CG2 4.38Å; V116-V123 HydrophobicContact CG1-CG2 3.37Å | ||
| 117 | D | 80.1 | Confident | 80.1 | Confident | 93 Ų | 93 | 117.8 Ų | 117.8 | 50% | 0.497 | 61% | 0.605 | S | S | . | * | trans | -62.6 | 121.5 | 176.7 | -174.3 | -12.9 | 0 | 0 | 0 | 109 | N119 D120 | D117-N119 PolarHBondContact O-N 3.32Å; D117-N119 VanDerWaalsContact O-N 3.15Å; D117-N119 PolarHBondContact OD1-N 2.91Å; D117-D120 HydrophobicContact CB-CB 4.41Å; D117-D120 VanDerWaalsContact O-CB 3.23Å; D117-D120 WeakPolarHBondContact O-CB 3.49Å; D117-D120 PolarHBondContact O-N 2.92Å | ||
| 118 | P | 77.6 | Confident | 79.2 | Confident | 94 Ų | 94 | 120.8 Ų | 120.8 | 61% | 0.61 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | -14 | 179.8 | 26.2 | -35.6 | 0 | 0 | 0 | 114.1 | V116 | V116-P118 WeakPolarHBondContact O-CD 3.35Š|
| 119 | N | 77.7 | Confident | 77.4 | Confident | 120 Ų | 120 | 124.4 Ų | 124.4 | 64% | 0.642 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | 4.7 | 173.8 | -60.6 | -57.2 | 0 | 0 | 0 | 113.4 | D117 E121 | D117-N119 PolarHBondContact O-N 3.32Å; D117-N119 VanDerWaalsContact O-N 3.15Å; D117-N119 PolarHBondContact OD1-N 2.91Å; N119-E121 PolarHBondContact O-N 2.95Å |
| 120 | D | 81.4 | Confident | 76.7 | Confident | 71 Ų | 71 | 122.6 Ų | 122.6 | 38% | 0.38 | 65% | 0.646 | S | S | . | * | trans | -62.9 | 134.7 | 174.7 | -162.3 | -18.6 | 0 | 0 | 0 | 109.9 | D117 E122 V123 M124 | D117-D120 HydrophobicContact CB-CB 4.41Å; D117-D120 VanDerWaalsContact O-CB 3.23Å; D117-D120 WeakPolarHBondContact O-CB 3.49Å; D117-D120 PolarHBondContact O-N 2.92Å; D120-E122 PolarHBondContact O-N 3.47Å; D120-V123 HydrophobicContact CB-CB 4.42Å; D120-V123 HydrophobicContact CB-CG2 4.14Å; D120-V123 PolarHBondContact O-N 3.49Å; D120-M124 PolarHBondContact O-N 2.92Å | ||
| 121 | E | 76.5 | Confident | 76.1 | Confident | 146 Ų | 146 | 122.6 Ų | 122.6 | 68% | 0.682 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -59.3 | -34.6 | -175 | -65.6 | -173.5 | 174.3 | 0 | 0 | 110.9 | N119 L125 | N119-E121 PolarHBondContact O-N 2.95Å; E121-L125 WeakPolarHBondContact O-CB 3.29Å; E121-L125 WeakPolarHBondContact O-CD1 3.32Å; E121-L125 WeakPolarHBondContact O-CG 3.44Å; E121-L125 PolarHBondContact O-N 3.47Å |
| 122 | E | 72.6 | Confident | 75.6 | Confident | 155 Ų | 155 | 119.7 Ų | 119.7 | 72% | 0.724 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -67.9 | -38.6 | 177.5 | -62.2 | -168.6 | 172.1 | 0 | 0 | 112.3 | D120 E126 | D120-E122 PolarHBondContact O-N 3.47Å; E122-E126 PolarHBondContact O-N 3.17Å |
| 123 | V | 75 | Confident | 75.1 | Confident | 38 Ų | 38 | 120.2 Ų | 120.2 | 23% | 0.23 | 64% | 0.64 | C | S | . | * | H | α-helix | trans | -73.4 | -40.7 | 177.9 | 178.3 | 0 | 0 | 0 | 0 | 111.1 | V116 D120 L125 E126 V127 | V116-V123 HydrophobicContact CB-CG2 4.38Å; V116-V123 HydrophobicContact CG1-CG2 3.37Å; D120-V123 HydrophobicContact CB-CB 4.42Å; D120-V123 HydrophobicContact CB-CG2 4.14Å; D120-V123 PolarHBondContact O-N 3.49Å; V123-L125 VanDerWaalsContact C-N 3.29Å; V123-L125 PolarHBondContact O-N 3.31Å; V123-E126 PolarHBondContact O-N 3.39Å; V123-V127 HydrophobicContact CG1-CG2 4.44Å; V123-V127 WeakPolarHBondContact O-CG2 3.27Å; V123-V127 PolarHBondContact O-N 3.33Å |
| 124 | M | 76.3 | Confident | 74.7 | Confident | 103 Ų | 103 | 116.3 Ų | 116.3 | 51% | 0.507 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -63.6 | -38.2 | 176.6 | -69.8 | -150.6 | -53.9 | 0 | 0 | 111.9 | D120 L128 | D120-M124 PolarHBondContact O-N 2.92Å; M124-L128 WeakPolarHBondContact O-CB 3.17Å; M124-L128 PolarHBondContact O-N 2.99Å |
| 125 | L | 75.9 | Confident | 74.3 | Confident | 110 Ų | 110 | 117.1 Ų | 117.1 | 58% | 0.576 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -70.5 | -31 | 175.8 | -70.2 | 169.8 | 0 | 0 | 0 | 112.4 | E121 V123 N129 | E121-L125 WeakPolarHBondContact O-CB 3.29Å; E121-L125 WeakPolarHBondContact O-CD1 3.32Å; E121-L125 WeakPolarHBondContact O-CG 3.44Å; E121-L125 PolarHBondContact O-N 3.47Å; V123-L125 VanDerWaalsContact C-N 3.29Å; V123-L125 PolarHBondContact O-N 3.31Å; L125-N129 PolarHBondContact O-ND2 3.3Å |
| 126 | E | 73.1 | Confident | 74 | Confident | 147 Ų | 147 | 117.6 Ų | 117.6 | 69% | 0.687 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -70.1 | -40.4 | 173.8 | -172 | 177.5 | -172.1 | 0 | 0 | 112.2 | E122 V123 L128 | E122-E126 PolarHBondContact O-N 3.17Å; V123-E126 PolarHBondContact O-N 3.39Å; E126-L128 VanDerWaalsContact C-N 3.35Å; E126-L128 PolarHBondContact O-N 3.28Å |
| 127 | V | 72.6 | Confident | 73.8 | Confident | 119 Ų | 119 | 119.1 Ų | 119.1 | 72% | 0.721 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -75.5 | -20.9 | -179 | 174.5 | 0 | 0 | 0 | 0 | 113.2 | V123 | V123-V127 HydrophobicContact CG1-CG2 4.44Å; V123-V127 WeakPolarHBondContact O-CG2 3.27Å; V123-V127 PolarHBondContact O-N 3.33Å |
| 128 | L | 68.4 | Low | 73.2 | Confident | 153 Ų | 153 | 121.3 Ų | 121.3 | 80% | 0.801 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.7 | -4.5 | -179.4 | -158.8 | 72.2 | 0 | 0 | 0 | 114.1 | M124 E126 | M124-L128 WeakPolarHBondContact O-CB 3.17Å; M124-L128 PolarHBondContact O-N 2.99Å; E126-L128 VanDerWaalsContact C-N 3.35Å; E126-L128 PolarHBondContact O-N 3.28Å |
| 129 | N | 51.8 | Low | 72.8 | Confident | 199 Ų | 199 | 123.7 Ų | 123.7 | 100% | 1.064 | 64% | 0.638 | S | S | * | * | trans | -99.9 | 0 | 174.7 | -77.1 | -42.3 | 0 | 0 | 0 | 112.1 | L125 | L125-N129 PolarHBondContact O-ND2 3.3Š|
Retrieved 129 of 129 residues in 67.9 ms
(Link to these results)