| 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 | I | 39.9 | Very low | 46.6 | Very low | 223 Ų | 223 | 164.2 Ų | 164.2 | 100% | 1.144 | 85% | 0.846 | S | S | * | * | 0 | 118.7 | 0 | -92.6 | 155.8 | 0 | 0 | 0 | 108.7 | |||||
| 2 | R | 40.1 | Very low | 47 | Very low | 239 Ų | 239 | 164.3 Ų | 164.3 | 90% | 0.902 | 85% | 0.846 | S | S | * | * | trans | 64.6 | 100.2 | 157.4 | -159.5 | 169.3 | -96 | -121.1 | 2.9 | 117.4 | ||||
| 3 | A | 40.5 | Very low | 46.6 | Very low | 99 Ų | 99 | 160.3 Ų | 160.3 | 82% | 0.818 | 84% | 0.842 | S | S | * | * | 97.7 | 140.9 | 84.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 4 | G | 47.2 | Very low | 46.5 | Very low | 67 Ų | 67 | 154.4 Ų | 154.4 | 69% | 0.691 | 83% | 0.828 | S | S | * | * | cis | 166.4 | 116.6 | 4.9 | 0 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 5 | S | 51.5 | Low | 46.3 | Very low | 120 Ų | 120 | 151.3 Ų | 151.3 | 84% | 0.839 | 82% | 0.823 | S | S | * | * | trans | -166.4 | 98.7 | 173.8 | -83.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 6 | R | 47.7 | Very low | 46.2 | Very low | 236 Ų | 236 | 150.5 Ų | 150.5 | 89% | 0.891 | 82% | 0.824 | S | S | * | * | trans | -162.1 | 110.5 | 142.2 | -74.2 | -139.1 | -177.1 | -133.3 | -0 | 109.4 | ||||
| 7 | V | 54.3 | Low | 45.8 | Very low | 130 Ų | 130 | 153 Ų | 153 | 79% | 0.788 | 83% | 0.825 | S | S | * | * | 41.9 | 92.3 | 126.8 | -172.4 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 8 | L | 48.3 | Very low | 45.2 | Very low | 184 Ų | 184 | 150.4 Ų | 150.4 | 96% | 0.963 | 82% | 0.82 | S | S | * | * | trans | -106.9 | 81.3 | 156.5 | -97 | 159.1 | 0 | 0 | 0 | 107.9 | ||||
| 9 | Y | 43.3 | Very low | 44.5 | Very low | 188 Ų | 188 | 154.8 Ų | 154.8 | 74% | 0.737 | 82% | 0.824 | S | S | * | * | trans | -98.9 | 128.2 | 160.3 | -168.9 | -111.8 | 0 | 0 | 0 | 106.6 | ||||
| 10 | R | 51.5 | Low | 44.4 | Very low | 200 Ų | 200 | 153.4 Ų | 153.4 | 76% | 0.755 | 82% | 0.823 | S | S | * | * | trans | 128.2 | 111.7 | 146.6 | -63.2 | -160.4 | 113.7 | 174.2 | -0.5 | 114.8 | ||||
| 11 | P | 48.3 | Very low | 43.9 | Very low | 120 Ų | 120 | 155.4 Ų | 155.4 | 78% | 0.779 | 83% | 0.828 | S | S | * | * | trans | -70.2 | 138.6 | 167.1 | 29.8 | -31.3 | 0 | 0 | 0 | 110 | S13 | P11-S13 PolarHBondContact O-N 2.95Š| ||
| 12 | I | 51.4 | Low | 43.8 | Very low | 165 Ų | 165 | 151.2 Ų | 151.2 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | trans | -70.2 | 92.9 | 178.5 | -64.5 | 171.6 | 0 | 0 | 0 | 108.3 | A14 | I12-A14 HydrophobicContact CG2-CB 4.07Å; I12-A14 PolarHBondContact O-N 3Å | ||
| 13 | S | 42.2 | Very low | 43.3 | Very low | 113 Ų | 113 | 151.4 Ų | 151.4 | 79% | 0.79 | 81% | 0.813 | S | S | * | * | trans | -81.4 | 92.6 | 153.4 | -70.4 | 0 | 0 | 0 | 0 | 107.4 | P11 S15 | P11-S13 PolarHBondContact O-N 2.95Å; S13-S15 PolarHBondContact O-N 3.2Å | ||
| 14 | A | 45.4 | Very low | 43 | Very low | 78 Ų | 78 | 153.4 Ų | 153.4 | 65% | 0.645 | 82% | 0.815 | S | S | * | * | trans | -92 | 85.8 | 163.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | I12 V16 | I12-A14 HydrophobicContact CG2-CB 4.07Å; I12-A14 PolarHBondContact O-N 3Å; A14-V16 VanDerWaalsContact C-N 3.32Å; A14-V16 PolarHBondContact O-N 3.13Å; A14-V16 VanDerWaalsContact O-N 3.1Å | ||
| 15 | S | 43.8 | Very low | 42.3 | Very low | 108 Ų | 108 | 153.6 Ų | 153.6 | 76% | 0.755 | 82% | 0.817 | S | S | * | * | trans | -68.2 | 93.9 | 158.3 | 41.2 | 0 | 0 | 0 | 0 | 107.9 | S13 F17 | S13-S15 PolarHBondContact O-N 3.2Å; S15-F17 VanDerWaalsContact C-N 3.28Å; S15-F17 PolarHBondContact O-N 3.47Å | ||
| 16 | V | 44.5 | Very low | 41.4 | Very low | 138 Ų | 138 | 157.7 Ų | 157.7 | 84% | 0.836 | 82% | 0.823 | S | S | * | * | trans | -72.5 | 92.3 | 166.7 | 175.2 | 0 | 0 | 0 | 0 | 107.2 | A14 | A14-V16 VanDerWaalsContact C-N 3.32Å; A14-V16 PolarHBondContact O-N 3.13Å; A14-V16 VanDerWaalsContact O-N 3.1Å | ||
| 17 | F | 39.8 | Very low | 40.6 | Very low | 193 Ų | 193 | 150 Ų | 150 | 85% | 0.846 | 82% | 0.818 | S | S | * | * | trans | -104.8 | 112.8 | 167.5 | -178.5 | -94.8 | 0 | 0 | 0 | 108.2 | S15 | S15-F17 VanDerWaalsContact C-N 3.28Å; S15-F17 PolarHBondContact O-N 3.47Å | ||
| 18 | S | 34.1 | Very low | 39.8 | Very low | 106 Ų | 106 | 152.2 Ų | 152.2 | 74% | 0.741 | 83% | 0.825 | S | S | * | * | trans | 173.4 | 130.6 | 162.5 | -79.9 | 0 | 0 | 0 | 0 | 106 | ||||
| 19 | R | 32.4 | Very low | 39.2 | Very low | 235 Ų | 235 | 148.7 Ų | 148.7 | 89% | 0.887 | 82% | 0.816 | S | S | * | * | cis | -170.6 | 151.6 | 11.9 | -153.5 | 177.1 | -176.3 | -168.2 | 0.9 | 105 | ||||
| 20 | P | 41.6 | Very low | 39.2 | Very low | 125 Ų | 125 | 146 Ų | 146 | 81% | 0.812 | 82% | 0.819 | S | S | * | * | trans | -82.9 | 126.2 | 177.7 | 32.1 | -29.1 | 0 | 0 | 0 | 110.2 | ||||
| 21 | E | 34.3 | Very low | 38.6 | Very low | 197 Ų | 197 | 144.2 Ų | 144.2 | 92% | 0.921 | 82% | 0.824 | S | S | * | * | trans | -117.5 | 127.6 | 165.9 | -109.9 | -153.7 | 140.6 | 0 | 0 | 110.5 | ||||
| 22 | V | 38.2 | Very low | 38.1 | Very low | 135 Ų | 135 | 146 Ų | 146 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -97 | 123.1 | 173.6 | 168.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 23 | R | 29.6 | Very low | 37.5 | Very low | 242 Ų | 242 | 141.3 Ų | 141.3 | 91% | 0.913 | 82% | 0.819 | S | S | * | * | trans | -168.3 | 132.1 | 144.7 | -121.3 | 172 | 176.7 | 177.3 | -2.3 | 114.6 | ||||
| 24 | T | 33.2 | Very low | 37.5 | Very low | 142 Ų | 142 | 140.8 Ų | 140.8 | 87% | 0.871 | 82% | 0.822 | S | S | * | * | trans | -34.7 | 146.7 | 162.9 | -44.7 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 25 | G | 32.6 | Very low | 37.1 | Very low | 71 Ų | 71 | 145 Ų | 145 | 73% | 0.732 | 83% | 0.828 | S | S | * | * | trans | 139.1 | 127.7 | 148.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 26 | E | 33.9 | Very low | 36.9 | Very low | 206 Ų | 206 | 146.4 Ų | 146.4 | 96% | 0.963 | 83% | 0.827 | S | S | * | * | trans | -65.7 | 159.2 | -178.3 | -59.8 | 158 | 116.5 | 0 | 0 | 114.4 | ||||
| 27 | G | 30.2 | Very low | 36.9 | Very low | 75 Ų | 75 | 145.8 Ų | 145.8 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | trans | 160.4 | 100.1 | 162.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 28 | N | 37.7 | Very low | 37.1 | Very low | 175 Ų | 175 | 142.4 Ų | 142.4 | 94% | 0.936 | 82% | 0.819 | S | S | * | * | trans | -58.5 | 131.3 | 166.5 | -82 | -7 | 0 | 0 | 0 | 112 | ||||
| 29 | S | 34.8 | Very low | 37.6 | Very low | 111 Ų | 111 | 140.9 Ų | 140.9 | 78% | 0.776 | 81% | 0.808 | S | S | * | * | trans | -154.9 | 109.9 | 144.5 | 58.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 30 | T | 44 | Very low | 38.1 | Very low | 131 Ų | 131 | 137.6 Ų | 137.6 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -39.5 | 132.8 | 157.6 | 47.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 31 | L | 37.8 | Very low | 38.5 | Very low | 163 Ų | 163 | 137.9 Ų | 137.9 | 85% | 0.853 | 80% | 0.797 | S | S | * | * | trans | 167.3 | 100.8 | 145.7 | -89 | 156.7 | 0 | 0 | 0 | 108.5 | ||||
| 32 | N | 38.2 | Very low | 39.3 | Very low | 156 Ų | 156 | 132.7 Ų | 132.7 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | trans | 175.1 | 94.2 | 136.1 | -90.6 | -8.4 | 0 | 0 | 0 | 109.6 | ||||
| 33 | G | 38.8 | Very low | 39.7 | Very low | 68 Ų | 68 | 133.4 Ų | 133.4 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -65.2 | 159.4 | 157.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 34 | A | 41.8 | Very low | 40.7 | Very low | 102 Ų | 102 | 132.1 Ų | 132.1 | 84% | 0.843 | 78% | 0.781 | S | S | * | * | S | Bend | trans | 79.8 | 38.3 | 154 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||
| 35 | Q | 38.1 | Very low | 41.7 | Very low | 165 Ų | 165 | 128.1 Ų | 128.1 | 77% | 0.771 | 77% | 0.768 | S | S | * | * | trans | -135.4 | 1.2 | 167.9 | -70.2 | -165.9 | -29.3 | 0 | 0 | 118 | ||||
| 36 | N | 39.8 | Very low | 42.7 | Very low | 139 Ų | 139 | 133.1 Ų | 133.1 | 74% | 0.743 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | 17.1 | -173.6 | -88.8 | -15.4 | 0 | 0 | 0 | 117 | ||
| 37 | T | 43.9 | Very low | 43.5 | Very low | 125 Ų | 125 | 131.8 Ų | 131.8 | 77% | 0.767 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.3 | -12.1 | 177.3 | -25.5 | 0 | 0 | 0 | 0 | 114.1 | ||
| 38 | V | 43.1 | Very low | 44.8 | Very low | 122 Ų | 122 | 130.8 Ų | 130.8 | 74% | 0.739 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -106 | -23 | -177.7 | -178.2 | 0 | 0 | 0 | 0 | 112.5 | Q40 | V38-Q40 VanDerWaalsContact C-N 3.28Å; V38-Q40 PolarHBondContact O-N 3.38Å |
| 39 | S | 45.7 | Very low | 45.6 | Very low | 73 Ų | 73 | 126.6 Ų | 126.6 | 51% | 0.51 | 73% | 0.727 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.8 | -15.6 | -179.6 | -41.7 | 0 | 0 | 0 | 0 | 113.9 | ||
| 40 | Q | 43.6 | Very low | 46.7 | Very low | 166 Ų | 166 | 124.6 Ų | 124.6 | 78% | 0.776 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -13.1 | -176.8 | -165.5 | 168 | -36.7 | 0 | 0 | 113.6 | V38 | V38-Q40 VanDerWaalsContact C-N 3.28Å; V38-Q40 PolarHBondContact O-N 3.38Å |
| 41 | L | 49 | Very low | 47.5 | Very low | 132 Ų | 132 | 122.2 Ų | 122.2 | 69% | 0.691 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -86.9 | -15.9 | 178.6 | -80.9 | 157.9 | 0 | 0 | 0 | 113.9 | ||
| 42 | A | 50.7 | Low | 49 | Very low | 87 Ų | 87 | 117.4 Ų | 117.4 | 72% | 0.719 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -97.6 | -6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 43 | L | 47.7 | Very low | 50.7 | Low | 150 Ų | 150 | 119.1 Ų | 119.1 | 79% | 0.785 | 67% | 0.673 | S | S | * | * | trans | -111.2 | 41.3 | 171.9 | -64.3 | 178.5 | 0 | 0 | 0 | 111.1 | G45 | L43-G45 PolarHBondContact O-N 3.4Š| ||
| 44 | R | 51.3 | Low | 53 | Low | 215 Ų | 215 | 121.4 Ų | 121.4 | 81% | 0.811 | 67% | 0.67 | S | S | * | * | trans | -65.8 | 83.4 | 147.8 | -77.6 | -170.6 | 176 | 173 | 0.3 | 105.6 | F46 | R44-F46 PolarHBondContact O-N 3.38Š| ||
| 45 | G | 52.5 | Low | 55.2 | Low | 58 Ų | 58 | 121.3 Ų | 121.3 | 60% | 0.598 | 65% | 0.654 | S | S | * | * | trans | -45.2 | 118.1 | 165 | 0 | 0 | 0 | 0 | 0 | 105.4 | L43 Q47 | L43-G45 PolarHBondContact O-N 3.4Å; G45-Q47 PolarHBondContact O-N 3.22Å | ||
| 46 | F | 53.6 | Low | 57.6 | Low | 176 Ų | 176 | 118.1 Ų | 118.1 | 77% | 0.772 | 64% | 0.642 | S | S | * | * | trans | -58 | 95.7 | 169.9 | -143.2 | -109.5 | 0 | 0 | 0 | 103.3 | R44 T48 I51 | R44-F46 PolarHBondContact O-N 3.38Å; F46-T48 HydrophobicContact CB-CG2 4.17Å; F46-T48 HydrophobicContact CD1-CG2 3.38Å; F46-T48 HydrophobicContact CE1-CG2 4.22Å; F46-T48 HydrophobicContact CG-CG2 4.23Å; F46-T48 PolarHBondContact O-N 2.84Å; F46-I51 HydrophobicContact CE1-CD1 4.12Å | ||
| 47 | Q | 50.8 | Low | 60 | Low | 178 Ų | 178 | 114.5 Ų | 114.5 | 83% | 0.832 | 63% | 0.625 | S | S | * | * | trans | -69.9 | 81.2 | 177.7 | -84.3 | -166.8 | -68.8 | 0 | 0 | 105.6 | G45 S49 | G45-Q47 PolarHBondContact O-N 3.22Å; Q47-S49 PolarHBondContact O-N 2.91Å; Q47-S49 VanDerWaalsContact O-N 3.16Å | ||
| 48 | T | 57.6 | Low | 62.3 | Low | 55 Ų | 55 | 111 Ų | 111 | 34% | 0.337 | 61% | 0.609 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.1 | 19.3 | -179.3 | 52.6 | 0 | 0 | 0 | 0 | 112.9 | F46 A50 I51 S52 | F46-T48 HydrophobicContact CB-CG2 4.17Å; F46-T48 HydrophobicContact CD1-CG2 3.38Å; F46-T48 HydrophobicContact CE1-CG2 4.22Å; F46-T48 HydrophobicContact CG-CG2 4.23Å; F46-T48 PolarHBondContact O-N 2.84Å; T48-A50 PolarHBondContact O-N 3.33Å; T48-A50 VanDerWaalsContact O-N 3.08Å; T48-I51 HydrophobicContact CG2-CD1 4.04Å; T48-I51 PolarHBondContact O-N 2.85Å; T48-S52 PolarHBondContact O-N 3.41Å |
| 49 | S | 54.9 | Low | 64.8 | Low | 87 Ų | 87 | 107.9 Ų | 107.9 | 61% | 0.608 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -57.6 | -25.9 | 177.5 | 49.3 | 0 | 0 | 0 | 0 | 112.2 | Q47 | Q47-S49 PolarHBondContact O-N 2.91Å; Q47-S49 VanDerWaalsContact O-N 3.16Å |
| 50 | A | 57.8 | Low | 67.1 | Low | 68 Ų | 68 | 107.6 Ų | 107.6 | 56% | 0.562 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -72 | -45.2 | 169.5 | 0 | 0 | 0 | 0 | 0 | 113 | T48 R53 D54 | T48-A50 PolarHBondContact O-N 3.33Å; T48-A50 VanDerWaalsContact O-N 3.08Å; A50-R53 PolarHBondContact O-N 3.29Å; A50-D54 PolarHBondContact O-N 3.26Å |
| 51 | I | 61.9 | Low | 69.5 | Low | 82 Ų | 82 | 105.6 Ų | 105.6 | 42% | 0.421 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -67.2 | -39.1 | -176.6 | -68.5 | 174.3 | 0 | 0 | 0 | 112.2 | F46 T48 R53 D54 I55 | F46-I51 HydrophobicContact CE1-CD1 4.12Å; T48-I51 HydrophobicContact CG2-CD1 4.04Å; T48-I51 PolarHBondContact O-N 2.85Å; I51-R53 VanDerWaalsContact C-N 3.3Å; I51-R53 PolarHBondContact O-N 3.47Å; I51-D54 PolarHBondContact O-N 3.22Å; I51-I55 HydrophobicContact CG2-CD1 3.73Å; I51-I55 HydrophobicContact CG2-CG1 4.33Å; I51-I55 WeakPolarHBondContact O-CG1 3.36Å; I51-I55 PolarHBondContact O-N 3.47Å; I51-I55 VanDerWaalsContact O-N 3.09Å |
| 52 | S | 67.9 | Low | 71.8 | Confident | 62 Ų | 62 | 105.4 Ų | 105.4 | 43% | 0.434 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.8 | -36.8 | -179.9 | -70.8 | 0 | 0 | 0 | 0 | 112.4 | T48 I55 D56 | T48-S52 PolarHBondContact O-N 3.41Å; S52-I55 PolarHBondContact O-N 2.79Å; S52-D56 VanDerWaalsContact O-CG 3.31Å; S52-D56 PolarHBondContact O-N 3.15Å |
| 53 | R | 74.6 | Confident | 73.9 | Confident | 191 Ų | 191 | 102.6 Ų | 102.6 | 72% | 0.721 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -69 | -35.5 | 177.8 | -70.8 | -163.3 | 167.6 | 149.5 | 0.1 | 113.1 | A50 I51 I55 D56 T57 | A50-R53 PolarHBondContact O-N 3.29Å; I51-R53 VanDerWaalsContact C-N 3.3Å; I51-R53 PolarHBondContact O-N 3.47Å; R53-I55 VanDerWaalsContact C-N 3.35Å; R53-D56 PolarHBondContact O-N 2.89Å; R53-T57 WeakPolarHBondContact O-CB 3.43Å; R53-T57 PolarHBondContact O-N 3.05Å; R53-T57 PolarHBondContact O-OG1 3.2Å |
| 54 | D | 86.2 | Confident | 76.2 | Confident | 116 Ų | 116 | 95.8 Ų | 95.8 | 62% | 0.62 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -68 | -37.5 | 175.7 | -72.5 | -3.5 | 0 | 0 | 0 | 111.3 | A50 I51 T57 A58 | A50-D54 PolarHBondContact O-N 3.26Å; I51-D54 PolarHBondContact O-N 3.22Å; D54-T57 PolarHBondContact O-N 3.36Å; D54-A58 VanDerWaalsContact O-CB 3.31Å; D54-A58 WeakPolarHBondContact O-CB 3.33Å; D54-A58 PolarHBondContact O-N 2.91Å |
| 55 | I | 88.4 | Confident | 78.3 | Confident | 101 Ų | 101 | 87.5 Ų | 87.5 | 52% | 0.518 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.6 | -44.9 | 175.7 | -66.4 | 167.2 | 0 | 0 | 0 | 110.9 | I51 S52 R53 T57 A58 A59 | I51-I55 HydrophobicContact CG2-CD1 3.73Å; I51-I55 HydrophobicContact CG2-CG1 4.33Å; I51-I55 WeakPolarHBondContact O-CG1 3.36Å; I51-I55 PolarHBondContact O-N 3.47Å; I51-I55 VanDerWaalsContact O-N 3.09Å; S52-I55 PolarHBondContact O-N 2.79Å; R53-I55 VanDerWaalsContact C-N 3.35Å; I55-T57 VanDerWaalsContact C-N 3.29Å; I55-T57 PolarHBondContact O-N 3.03Å; I55-A58 PolarHBondContact O-N 3.32Å; I55-A59 VanDerWaalsContact O-CB 3.28Å; I55-A59 WeakPolarHBondContact O-CB 3.46Å; I55-A59 PolarHBondContact O-N 3.43Å |
| 56 | D | 88.7 | Confident | 80.3 | Confident | 97 Ų | 97 | 87.7 Ų | 87.7 | 52% | 0.519 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.3 | -41.7 | 177.3 | -66.3 | -26.7 | 0 | 0 | 0 | 111 | S52 R53 A59 K60 | S52-D56 VanDerWaalsContact O-CG 3.31Å; S52-D56 PolarHBondContact O-N 3.15Å; R53-D56 PolarHBondContact O-N 2.89Å; D56-A59 PolarHBondContact O-N 3.31Å; D56-K60 VanDerWaalsContact O-CG 3.31Å; D56-K60 WeakPolarHBondContact O-CG 3.48Å; D56-K60 PolarHBondContact O-N 3.35Å |
| 57 | T | 90.5 | Very high | 82.3 | Confident | 64 Ų | 64 | 80.5 Ų | 80.5 | 39% | 0.393 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -66.6 | -43.3 | 177.8 | -53.1 | 0 | 0 | 0 | 0 | 111.5 | R53 D54 I55 A59 K60 F61 | R53-T57 WeakPolarHBondContact O-CB 3.43Å; R53-T57 PolarHBondContact O-N 3.05Å; R53-T57 PolarHBondContact O-OG1 3.2Å; D54-T57 PolarHBondContact O-N 3.36Å; I55-T57 VanDerWaalsContact C-N 3.29Å; I55-T57 PolarHBondContact O-N 3.03Å; T57-A59 PolarHBondContact O-N 3.37Å; T57-K60 PolarHBondContact O-N 3.02Å; T57-F61 HydrophobicContact CG2-CD2 4.21Å; T57-F61 HydrophobicContact CG2-CE2 3.58Å; T57-F61 HydrophobicContact CG2-CZ 4.16Å; T57-F61 VanDerWaalsContact O-CD2 3.23Å; T57-F61 WeakPolarHBondContact O-CD2 3.44Å; T57-F61 PolarHBondContact O-N 3.21Å |
| 58 | A | 92.9 | Very high | 84.5 | Confident | 50 Ų | 50 | 74.9 Ų | 74.9 | 41% | 0.413 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.8 | -41.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | D54 I55 K60 F61 I62 | D54-A58 VanDerWaalsContact O-CB 3.31Å; D54-A58 WeakPolarHBondContact O-CB 3.33Å; D54-A58 PolarHBondContact O-N 2.91Å; I55-A58 PolarHBondContact O-N 3.32Å; A58-K60 VanDerWaalsContact C-N 3.35Å; A58-K60 PolarHBondContact O-N 3.47Å; A58-F61 PolarHBondContact O-N 3.05Å; A58-I62 WeakPolarHBondContact O-CG1 3.49Å; A58-I62 PolarHBondContact O-N 3.46Å |
| 59 | A | 93.8 | Very high | 86.3 | Confident | 57 Ų | 57 | 77.1 Ų | 77.1 | 47% | 0.471 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.6 | -38.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | I55 D56 T57 I62 G63 | I55-A59 VanDerWaalsContact O-CB 3.28Å; I55-A59 WeakPolarHBondContact O-CB 3.46Å; I55-A59 PolarHBondContact O-N 3.43Å; D56-A59 PolarHBondContact O-N 3.31Å; T57-A59 PolarHBondContact O-N 3.37Å; A59-I62 PolarHBondContact O-N 2.87Å; A59-G63 PolarHBondContact O-N 2.72Å |
| 60 | K | 94.6 | Very high | 88.2 | Confident | 68 Ų | 68 | 74.9 Ų | 74.9 | 30% | 0.296 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 173.7 | -73.9 | 174.6 | -170.9 | -165.5 | 0 | 112.3 | D56 T57 A58 G63 A64 M128 | D56-K60 VanDerWaalsContact O-CG 3.31Å; D56-K60 WeakPolarHBondContact O-CG 3.48Å; D56-K60 PolarHBondContact O-N 3.35Å; T57-K60 PolarHBondContact O-N 3.02Å; A58-K60 VanDerWaalsContact C-N 3.35Å; A58-K60 PolarHBondContact O-N 3.47Å; K60-G63 PolarHBondContact O-N 2.89Å; K60-A64 WeakPolarHBondContact O-CB 3.35Å; K60-A64 PolarHBondContact O-N 2.94Å; K60-M128 WeakPolarHBondContact CD-OXT 3.23Å; K60-M128 WeakPolarHBondContact CE-O 3.31Å; K60-M128 WeakPolarHBondContact CE-OXT 3.35Å; K60-M128 PolarHBondContact NZ-O 2.71Å; K60-M128 PolarHBondContact NZ-OXT 3.34Å |
| 61 | F | 94.8 | Very high | 90 | Very high | 124 Ų | 124 | 74.1 Ų | 74.1 | 54% | 0.544 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 179 | -66.9 | -48.4 | 0 | 0 | 0 | 112.7 | T57 A58 G65 L125 | T57-F61 HydrophobicContact CG2-CD2 4.21Å; T57-F61 HydrophobicContact CG2-CE2 3.58Å; T57-F61 HydrophobicContact CG2-CZ 4.16Å; T57-F61 VanDerWaalsContact O-CD2 3.23Å; T57-F61 WeakPolarHBondContact O-CD2 3.44Å; T57-F61 PolarHBondContact O-N 3.21Å; A58-F61 PolarHBondContact O-N 3.05Å; F61-G65 PolarHBondContact O-N 3.11Å; F61-L125 HydrophobicContact CD1-CD2 4.49Å; F61-L125 HydrophobicContact CD1-CG 4.49Å; F61-L125 HydrophobicContact CE1-CD2 3.99Å; F61-L125 HydrophobicContact CE1-CG 4.47Å |
| 62 | I | 96.1 | Very high | 91.7 | Very high | 128 Ų | 128 | 73.5 Ų | 73.5 | 66% | 0.656 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -66.7 | -44.9 | 175.7 | -66.3 | -175.9 | 0 | 0 | 0 | 110.7 | A58 A59 G65 A66 | A58-I62 WeakPolarHBondContact O-CG1 3.49Å; A58-I62 PolarHBondContact O-N 3.46Å; A59-I62 PolarHBondContact O-N 2.87Å; I62-G65 PolarHBondContact O-N 2.93Å; I62-A66 WeakPolarHBondContact O-CB 3.17Å; I62-A66 PolarHBondContact O-N 3.4Å |
| 63 | G | 95 | Very high | 93 | Very high | 28 Ų | 28 | 72.9 Ų | 72.9 | 29% | 0.289 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.5 | -45.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A59 K60 A66 A67 | A59-G63 PolarHBondContact O-N 2.72Å; K60-G63 PolarHBondContact O-N 2.89Å; G63-A66 PolarHBondContact O-N 2.98Å; G63-A67 WeakPolarHBondContact O-CB 3.39Å; G63-A67 PolarHBondContact O-N 3.26Å |
| 64 | A | 95.7 | Very high | 94 | Very high | 7 Ų | 7 | 64.2 Ų | 64.2 | 6% | 0.058 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -62.3 | -43.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | K60 A67 T68 I124 L125 | K60-A64 WeakPolarHBondContact O-CB 3.35Å; K60-A64 PolarHBondContact O-N 2.94Å; A64-A67 PolarHBondContact O-N 2.94Å; A64-T68 WeakPolarHBondContact O-CG2 3.36Å; A64-T68 PolarHBondContact O-N 3.41Å; A64-I124 HydrophobicContact CB-CB 4.32Å; A64-I124 HydrophobicContact CB-CG2 4.08Å; A64-L125 HydrophobicContact CB-CB 4.19Å; A64-L125 HydrophobicContact CB-CD1 4.47Å; A64-L125 HydrophobicContact CB-CG 4.32Å |
| 65 | G | 95.1 | Very high | 94.5 | Very high | 40 Ų | 40 | 60.8 Ų | 60.8 | 41% | 0.412 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -63.1 | -40.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | F61 I62 A67 T68 | F61-G65 PolarHBondContact O-N 3.11Å; I62-G65 PolarHBondContact O-N 2.93Å; G65-A67 VanDerWaalsContact C-N 3.34Å; G65-T68 PolarHBondContact O-N 2.96Å; G65-T68 PolarHBondContact O-OG1 3.5Å |
| 66 | A | 96.1 | Very high | 95 | Very high | 63 Ų | 63 | 58.9 Ų | 58.9 | 52% | 0.521 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -66.7 | -37.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | I62 G63 T68 V69 | I62-A66 WeakPolarHBondContact O-CB 3.17Å; I62-A66 PolarHBondContact O-N 3.4Å; G63-A66 PolarHBondContact O-N 2.98Å; A66-T68 VanDerWaalsContact C-N 3.31Å; A66-T68 PolarHBondContact O-N 3.28Å; A66-V69 WeakPolarHBondContact O-CB 3.44Å; A66-V69 WeakPolarHBondContact O-CG2 3.46Å; A66-V69 PolarHBondContact O-N 3.5Å |
| 67 | A | 95.6 | Very high | 95.3 | Very high | 24 Ų | 24 | 55.2 Ų | 55.2 | 20% | 0.198 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -65.7 | -29.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | G63 A64 G65 V69 C117 A121 I124 | G63-A67 WeakPolarHBondContact O-CB 3.39Å; G63-A67 PolarHBondContact O-N 3.26Å; A64-A67 PolarHBondContact O-N 2.94Å; G65-A67 VanDerWaalsContact C-N 3.34Å; A67-V69 VanDerWaalsContact C-N 3.27Å; A67-V69 PolarHBondContact O-N 3.2Å; A67-C117 PolarHBondContact O-SG 3.19Å; A67-A121 HydrophobicContact CB-CB 4.01Å; A67-I124 HydrophobicContact CB-CD1 4Å |
| 68 | T | 95.7 | Very high | 95.6 | Very high | 60 Ų | 60 | 53.5 Ų | 53.5 | 37% | 0.368 | 38% | 0.382 | S | S | . | . | G | 310 helix | trans | -73.8 | -14.2 | 179.3 | 62.3 | 0 | 0 | 0 | 0 | 114.2 | A64 G65 A66 G70 V71 L118 A121 | A64-T68 WeakPolarHBondContact O-CG2 3.36Å; A64-T68 PolarHBondContact O-N 3.41Å; G65-T68 PolarHBondContact O-N 2.96Å; G65-T68 PolarHBondContact O-OG1 3.5Å; A66-T68 VanDerWaalsContact C-N 3.31Å; A66-T68 PolarHBondContact O-N 3.28Å; T68-G70 PolarHBondContact O-N 2.88Å; T68-G70 VanDerWaalsContact O-N 3.11Å; T68-V71 WeakPolarHBondContact O-CB 3.36Å; T68-V71 WeakPolarHBondContact O-CG2 3.31Å; T68-V71 PolarHBondContact O-N 3.02Å; T68-L118 HydrophobicContact CG2-CD2 3.96Å; T68-A121 HydrophobicContact CG2-CB 3.65Å |
| 69 | V | 96 | Very high | 95.8 | Very high | 103 Ų | 103 | 53.3 Ų | 53.3 | 62% | 0.624 | 39% | 0.385 | S | S | * | . | G | 310 helix | trans | -58.1 | -29.3 | 179.5 | 179.2 | 0 | 0 | 0 | 0 | 111.8 | A66 A67 V71 A72 | A66-V69 WeakPolarHBondContact O-CB 3.44Å; A66-V69 WeakPolarHBondContact O-CG2 3.46Å; A66-V69 PolarHBondContact O-N 3.5Å; A67-V69 VanDerWaalsContact C-N 3.27Å; A67-V69 PolarHBondContact O-N 3.2Å; V69-V71 PolarHBondContact O-N 3.5Å; V69-A72 VanDerWaalsContact O-CB 3.26Å; V69-A72 WeakPolarHBondContact O-CB 3.38Å; V69-A72 PolarHBondContact O-N 3.39Å; V69-A72 VanDerWaalsContact O-N 3.07Å |
| 70 | G | 94.3 | Very high | 96 | Very high | 40 Ų | 40 | 55 Ų | 55 | 41% | 0.412 | 39% | 0.389 | S | S | . | . | G | 310 helix | trans | -63.4 | -19.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | T68 A72 G73 C117 | T68-G70 PolarHBondContact O-N 2.88Å; T68-G70 VanDerWaalsContact O-N 3.11Å; G70-A72 PolarHBondContact O-N 3.22Å; G70-G73 PolarHBondContact O-N 3.18Å; G70-C117 WeakPolarHBondContact CA-SG 3.31Å |
| 71 | V | 96.1 | Very high | 96.1 | Very high | 51 Ų | 51 | 53.4 Ų | 53.4 | 31% | 0.309 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.4 | -29 | 173.4 | -178.9 | 0 | 0 | 0 | 0 | 111.6 | T68 V69 G73 S74 G75 C117 L118 | T68-V71 WeakPolarHBondContact O-CB 3.36Å; T68-V71 WeakPolarHBondContact O-CG2 3.31Å; T68-V71 PolarHBondContact O-N 3.02Å; V69-V71 PolarHBondContact O-N 3.5Å; V71-G73 PolarHBondContact O-N 2.97Å; V71-S74 WeakPolarHBondContact O-CB 3.32Å; V71-S74 PolarHBondContact O-N 3.44Å; V71-G75 PolarHBondContact O-N 3.28Å; V71-C117 HydrophobicContact CG2-CB 4.28Å; V71-L118 HydrophobicContact CG2-CD1 4.45Å; V71-L118 HydrophobicContact CG2-CD2 3.66Å; V71-L118 HydrophobicContact CG2-CG 3.67Å |
| 72 | A | 96.9 | Very high | 96.2 | Very high | 69 Ų | 69 | 50.8 Ų | 50.8 | 57% | 0.57 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -59.2 | -33.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | V69 G70 G75 A76 | V69-A72 VanDerWaalsContact O-CB 3.26Å; V69-A72 WeakPolarHBondContact O-CB 3.38Å; V69-A72 PolarHBondContact O-N 3.39Å; V69-A72 VanDerWaalsContact O-N 3.07Å; G70-A72 PolarHBondContact O-N 3.22Å; A72-G75 PolarHBondContact O-N 3.23Å; A72-A76 WeakPolarHBondContact O-CB 3.39Å; A72-A76 PolarHBondContact O-N 2.84Å |
| 73 | G | 95.7 | Very high | 96.2 | Very high | 50 Ų | 50 | 46.1 Ų | 46.1 | 52% | 0.515 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -64.7 | -41.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G70 V71 A76 G77 | G70-G73 PolarHBondContact O-N 3.18Å; V71-G73 PolarHBondContact O-N 2.97Å; G73-A76 PolarHBondContact O-N 3.42Å; G73-G77 PolarHBondContact O-N 3.37Å |
| 74 | S | 96.8 | Very high | 96.2 | Very high | 8 Ų | 8 | 48.6 Ų | 48.6 | 6% | 0.056 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63.3 | -46.5 | 173 | 178.2 | 0 | 0 | 0 | 0 | 111.2 | V71 A76 G77 I78 S110 | V71-S74 WeakPolarHBondContact O-CB 3.32Å; V71-S74 PolarHBondContact O-N 3.44Å; S74-A76 VanDerWaalsContact C-N 3.33Å; S74-A76 PolarHBondContact O-N 2.88Å; S74-G77 WeakPolarHBondContact O-CA 3.36Å; S74-G77 PolarHBondContact O-N 2.8Å; S74-G77 VanDerWaalsContact O-N 3.11Å; S74-I78 WeakPolarHBondContact O-CD1 3.46Å; S74-I78 VanDerWaalsContact O-CG1 3.23Å; S74-I78 WeakPolarHBondContact O-CG1 3.48Å; S74-I78 PolarHBondContact O-N 3.04Å; S74-S110 WeakPolarHBondContact CB-O 3.49Å; S74-S110 PolarHBondContact O-OG 3.5Å; S74-S110 VanDerWaalsContact O-OG 3.04Å; S74-S110 PolarHBondContact OG-O 2.97Å; S74-S110 PolarHBondContact OG-OG 2.9Å |
| 75 | G | 96.4 | Very high | 96.2 | Very high | 44 Ų | 44 | 49.4 Ų | 49.4 | 45% | 0.454 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -58.7 | -43.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | V71 A72 G79 | V71-G75 PolarHBondContact O-N 3.28Å; A72-G75 PolarHBondContact O-N 3.23Å; G75-G79 PolarHBondContact O-N 2.88Å; G75-G79 VanDerWaalsContact O-N 3.08Å |
| 76 | A | 97.5 | Very high | 96.2 | Very high | 62 Ų | 62 | 53.2 Ų | 53.2 | 51% | 0.512 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62 | -46.7 | 173 | 0 | 0 | 0 | 0 | 0 | 111.6 | A72 G73 S74 I78 G79 T80 | A72-A76 WeakPolarHBondContact O-CB 3.39Å; A72-A76 PolarHBondContact O-N 2.84Å; G73-A76 PolarHBondContact O-N 3.42Å; S74-A76 VanDerWaalsContact C-N 3.33Å; S74-A76 PolarHBondContact O-N 2.88Å; A76-I78 PolarHBondContact O-N 2.92Å; A76-G79 PolarHBondContact O-N 3.42Å; A76-T80 WeakPolarHBondContact O-CG2 3.46Å; A76-T80 PolarHBondContact O-N 3.07Å |
| 77 | G | 96.3 | Very high | 96.2 | Very high | 20 Ų | 20 | 55.4 Ų | 55.4 | 21% | 0.206 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -55 | -50.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | G73 S74 G79 T80 V81 | G73-G77 PolarHBondContact O-N 3.37Å; S74-G77 WeakPolarHBondContact O-CA 3.36Å; S74-G77 PolarHBondContact O-N 2.8Å; S74-G77 VanDerWaalsContact O-N 3.11Å; G77-G79 VanDerWaalsContact C-N 3.33Å; G77-G79 PolarHBondContact O-N 3.47Å; G77-T80 PolarHBondContact O-N 2.9Å; G77-T80 VanDerWaalsContact O-N 3.11Å; G77-T80 PolarHBondContact O-OG1 3.04Å; G77-V81 WeakPolarHBondContact O-CG2 3.46Å; G77-V81 PolarHBondContact O-N 3.38Å |
| 78 | I | 97.3 | Very high | 96.1 | Very high | 28 Ų | 28 | 55.2 Ų | 55.2 | 14% | 0.144 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -57.9 | -45.4 | 177.1 | -63.9 | 161.8 | 0 | 0 | 0 | 111.1 | S74 A76 T80 V81 F82 F107 E111 | S74-I78 WeakPolarHBondContact O-CD1 3.46Å; S74-I78 VanDerWaalsContact O-CG1 3.23Å; S74-I78 WeakPolarHBondContact O-CG1 3.48Å; S74-I78 PolarHBondContact O-N 3.04Å; A76-I78 PolarHBondContact O-N 2.92Å; I78-T80 VanDerWaalsContact C-N 3.32Å; I78-T80 PolarHBondContact O-N 3.48Å; I78-V81 PolarHBondContact O-N 2.93Å; I78-F82 HydrophobicContact CG2-CD2 3.54Å; I78-F82 HydrophobicContact CG2-CE2 3.62Å; I78-F82 WeakPolarHBondContact O-CD2 3.42Å; I78-F82 PolarHBondContact O-N 3.38Å; I78-F107 HydrophobicContact CB-CD2 4.5Å; I78-F107 HydrophobicContact CD1-CD2 4.22Å; I78-F107 HydrophobicContact CD1-CE2 4.04Å; I78-F107 HydrophobicContact CG1-CD2 3.89Å; I78-F107 HydrophobicContact CG1-CE2 4.22Å; I78-F107 HydrophobicContact CG2-CD2 3.86Å; I78-F107 HydrophobicContact CG2-CE2 4.18Å; I78-E111 HydrophobicContact CD1-CG 4.07Å; I78-E111 WeakPolarHBondContact CD1-OE1 3.45Å |
| 79 | G | 96.6 | Very high | 96 | Very high | 46 Ų | 46 | 57.5 Ų | 57.5 | 47% | 0.474 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -58.2 | -42.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | G75 A76 G77 G83 | G75-G79 PolarHBondContact O-N 2.88Å; G75-G79 VanDerWaalsContact O-N 3.08Å; A76-G79 PolarHBondContact O-N 3.42Å; G77-G79 VanDerWaalsContact C-N 3.33Å; G77-G79 PolarHBondContact O-N 3.47Å; G79-G83 PolarHBondContact O-N 3.2Å |
| 80 | T | 97.1 | Very high | 96 | Very high | 91 Ų | 91 | 56.6 Ų | 56.6 | 56% | 0.558 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -68.8 | -37.7 | 177 | 66.1 | 0 | 0 | 0 | 0 | 113.3 | A76 G77 I78 S84 | A76-T80 WeakPolarHBondContact O-CG2 3.46Å; A76-T80 PolarHBondContact O-N 3.07Å; G77-T80 PolarHBondContact O-N 2.9Å; G77-T80 VanDerWaalsContact O-N 3.11Å; G77-T80 PolarHBondContact O-OG1 3.04Å; I78-T80 VanDerWaalsContact C-N 3.32Å; I78-T80 PolarHBondContact O-N 3.48Å; T80-S84 WeakPolarHBondContact O-CB 3.23Å; T80-S84 PolarHBondContact O-N 3.26Å; T80-S84 PolarHBondContact O-OG 3.07Å |
| 81 | V | 97.1 | Very high | 96 | Very high | 35 Ų | 35 | 64 Ų | 64 | 21% | 0.212 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -64.5 | -51.3 | 178.2 | 170.4 | 0 | 0 | 0 | 0 | 110.2 | G77 I78 S84 L85 A103 | G77-V81 WeakPolarHBondContact O-CG2 3.46Å; G77-V81 PolarHBondContact O-N 3.38Å; I78-V81 PolarHBondContact O-N 2.93Å; V81-S84 PolarHBondContact O-N 3.45Å; V81-L85 WeakPolarHBondContact O-CB 3.37Å; V81-L85 PolarHBondContact O-N 2.87Å; V81-A103 HydrophobicContact CG1-CB 4.08Å; V81-A103 WeakPolarHBondContact CG1-O 3.37Å |
| 82 | F | 96.2 | Very high | 95.7 | Very high | 69 Ų | 69 | 66 Ų | 66 | 30% | 0.303 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -69.6 | -34.9 | 178.5 | -76 | -66.5 | 0 | 0 | 0 | 112.6 | I78 S84 L85 I86 F107 | I78-F82 HydrophobicContact CG2-CD2 3.54Å; I78-F82 HydrophobicContact CG2-CE2 3.62Å; I78-F82 WeakPolarHBondContact O-CD2 3.42Å; I78-F82 PolarHBondContact O-N 3.38Å; F82-S84 PolarHBondContact O-N 3.47Å; F82-L85 HydrophobicContact CD1-CD2 4Å; F82-L85 HydrophobicContact CE1-CD2 4.37Å; F82-L85 WeakPolarHBondContact O-CB 3.45Å; F82-L85 PolarHBondContact O-N 3.17Å; F82-I86 WeakPolarHBondContact O-CG1 3.3Å; F82-I86 PolarHBondContact O-N 3.11Å; F82-F107 HydrophobicContact CE2-CB 4.36Å; F82-F107 AromaticContact CE2-CD2 3.81Å; F82-F107 HydrophobicContact CE2-CD2 3.81Å; F82-F107 HydrophobicContact CE2-CE2 4.49Å; F82-F107 HydrophobicContact CE2-CG 4.26Å; F82-F107 HydrophobicContact CZ-CB 4.37Å; F82-F107 HydrophobicContact CZ-CD2 4.3Å; F82-F107 HydrophobicContact CZ-CG 4.35Å |
| 83 | G | 96.4 | Very high | 95.4 | Very high | 31 Ų | 31 | 66.2 Ų | 66.2 | 32% | 0.32 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -60.1 | -46 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G79 L85 I86 I87 | G79-G83 PolarHBondContact O-N 3.2Å; G83-L85 VanDerWaalsContact C-N 3.34Å; G83-L85 PolarHBondContact O-N 3.3Å; G83-I86 PolarHBondContact O-N 3.38Å; G83-I87 WeakPolarHBondContact O-CG1 3.47Å; G83-I87 PolarHBondContact O-N 3.08Å |
| 84 | S | 95.3 | Very high | 95.2 | Very high | 79 Ų | 79 | 68.9 Ų | 68.9 | 55% | 0.552 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -67.7 | -34.2 | 176.6 | -57.7 | 0 | 0 | 0 | 0 | 112.4 | T80 V81 F82 G88 | T80-S84 WeakPolarHBondContact O-CB 3.23Å; T80-S84 PolarHBondContact O-N 3.26Å; T80-S84 PolarHBondContact O-OG 3.07Å; V81-S84 PolarHBondContact O-N 3.45Å; F82-S84 PolarHBondContact O-N 3.47Å; S84-G88 PolarHBondContact O-N 3.18Å |
| 85 | L | 95.8 | Very high | 94.9 | Very high | 25 Ų | 25 | 72.4 Ų | 72.4 | 13% | 0.131 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -61.8 | -47.1 | 174.2 | 176.4 | 66.8 | 0 | 0 | 0 | 111.5 | V81 F82 G83 I87 G88 Y89 L99 F100 A103 | V81-L85 WeakPolarHBondContact O-CB 3.37Å; V81-L85 PolarHBondContact O-N 2.87Å; F82-L85 HydrophobicContact CD1-CD2 4Å; F82-L85 HydrophobicContact CE1-CD2 4.37Å; F82-L85 WeakPolarHBondContact O-CB 3.45Å; F82-L85 PolarHBondContact O-N 3.17Å; G83-L85 VanDerWaalsContact C-N 3.34Å; G83-L85 PolarHBondContact O-N 3.3Å; L85-I87 PolarHBondContact O-N 3.48Å; L85-G88 PolarHBondContact O-N 2.79Å; L85-Y89 VanDerWaalsContact O-CB 3.31Å; L85-Y89 WeakPolarHBondContact O-CB 3.4Å; L85-Y89 PolarHBondContact O-N 2.92Å; L85-L99 HydrophobicContact CD1-CB 3.9Å; L85-L99 HydrophobicContact CD1-CD2 4.38Å; L85-L99 HydrophobicContact CD1-CG 4.33Å; L85-F100 HydrophobicContact CD2-CD2 4.21Å; L85-A103 HydrophobicContact CB-CB 4.11Å; L85-A103 HydrophobicContact CD1-CB 3.88Å; L85-A103 HydrophobicContact CD2-CB 3.67Å; L85-A103 HydrophobicContact CG-CB 4.08Å |
| 86 | I | 95.6 | Very high | 94.5 | Very high | 120 Ų | 120 | 75.6 Ų | 75.6 | 62% | 0.615 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62.6 | -45.5 | -179.7 | -66.2 | 168.4 | 0 | 0 | 0 | 110.3 | F82 G83 G88 Y89 A90 | F82-I86 WeakPolarHBondContact O-CG1 3.3Å; F82-I86 PolarHBondContact O-N 3.11Å; G83-I86 PolarHBondContact O-N 3.38Å; I86-G88 VanDerWaalsContact C-N 3.33Å; I86-G88 PolarHBondContact O-N 3.07Å; I86-Y89 PolarHBondContact O-N 3.35Å; I86-A90 WeakPolarHBondContact O-CB 3.5Å; I86-A90 PolarHBondContact O-N 2.97Å |
| 87 | I | 95.7 | Very high | 94.2 | Very high | 108 Ų | 108 | 79.3 Ų | 79.3 | 55% | 0.554 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -62 | -43.4 | 176.7 | -64 | 165.3 | 0 | 0 | 0 | 110.4 | G83 L85 A90 R91 | G83-I87 WeakPolarHBondContact O-CG1 3.47Å; G83-I87 PolarHBondContact O-N 3.08Å; L85-I87 PolarHBondContact O-N 3.48Å; I87-A90 PolarHBondContact O-N 3.1Å; I87-R91 WeakPolarHBondContact O-CG 3.23Å; I87-R91 PolarHBondContact O-N 2.89Å |
| 88 | G | 93.9 | Very high | 94.1 | Very high | 21 Ų | 21 | 83 Ų | 83 | 22% | 0.216 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.9 | S84 L85 I86 R91 N92 | S84-G88 PolarHBondContact O-N 3.18Å; L85-G88 PolarHBondContact O-N 2.79Å; I86-G88 VanDerWaalsContact C-N 3.33Å; I86-G88 PolarHBondContact O-N 3.07Å; G88-R91 PolarHBondContact O-N 3.03Å; G88-N92 PolarHBondContact O-N 3.48Å; G88-N92 VanDerWaalsContact O-N 3.15Å |
| 89 | Y | 94.3 | Very high | 93.8 | Very high | 108 Ų | 108 | 84.2 Ų | 84.2 | 42% | 0.424 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.3 | -42.6 | 176.9 | -167.8 | -79.6 | 0 | 0 | 0 | 111.6 | L85 I86 R91 N92 P93 K96 | L85-Y89 VanDerWaalsContact O-CB 3.31Å; L85-Y89 WeakPolarHBondContact O-CB 3.4Å; L85-Y89 PolarHBondContact O-N 2.92Å; I86-Y89 PolarHBondContact O-N 3.35Å; Y89-R91 PolarHBondContact O-N 3.47Å; Y89-N92 CarbonylContact O-C 3.55Å; Y89-N92 PolarHBondContact O-N 3.41Å; Y89-P93 HydrophobicContact CE1-CB 4.22Å; Y89-K96 HydrophobicContact CD2-CB 3.78Å; Y89-K96 HydrophobicContact CE2-CB 3.26Å; Y89-K96 HydrophobicContact CE2-CD 4.08Å; Y89-K96 HydrophobicContact CE2-CG 4.3Å |
| 90 | A | 94.6 | Very high | 93.7 | Very high | 83 Ų | 83 | 86.9 Ų | 86.9 | 69% | 0.686 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.3 | -29.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | I86 I87 | I86-A90 WeakPolarHBondContact O-CB 3.5Å; I86-A90 PolarHBondContact O-N 2.97Å; I87-A90 PolarHBondContact O-N 3.1Å |
| 91 | R | 94.8 | Very high | 93.6 | Very high | 195 Ų | 195 | 86 Ų | 86 | 74% | 0.736 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -80.3 | -43.2 | 178.4 | -68.4 | 179.1 | 78.1 | 166.6 | 5.6 | 112.8 | I87 G88 Y89 | I87-R91 WeakPolarHBondContact O-CG 3.23Å; I87-R91 PolarHBondContact O-N 2.89Å; G88-R91 PolarHBondContact O-N 3.03Å; Y89-R91 PolarHBondContact O-N 3.47Å |
| 92 | N | 90.4 | Very high | 93.6 | Very high | 93 Ų | 93 | 90.9 Ų | 90.9 | 50% | 0.497 | 48% | 0.479 | S | S | . | . | trans | -143.7 | 86.8 | -175.4 | -70.5 | -56.1 | 0 | 0 | 0 | 111.6 | G88 Y89 S94 L95 | G88-N92 PolarHBondContact O-N 3.48Å; G88-N92 VanDerWaalsContact O-N 3.15Å; Y89-N92 CarbonylContact O-C 3.55Å; Y89-N92 PolarHBondContact O-N 3.41Å; N92-S94 PolarHBondContact O-N 3.35Å; N92-L95 PolarHBondContact O-N 3.18Å | ||
| 93 | P | 89.4 | Confident | 93.5 | Very high | 75 Ų | 75 | 88 Ų | 88 | 49% | 0.487 | 47% | 0.468 | S | S | . | . | G | 310 helix | trans | -69.7 | -16.5 | -175.3 | 26.5 | -34.5 | 0 | 0 | 0 | 114 | Y89 L95 K96 | Y89-P93 HydrophobicContact CE1-CB 4.22Å; P93-L95 VanDerWaalsContact C-N 3.28Å; P93-L95 PolarHBondContact O-N 2.97Å; P93-K96 WeakPolarHBondContact O-CB 3.45Å; P93-K96 PolarHBondContact O-N 3.31Å |
| 94 | S | 92.8 | Very high | 93.5 | Very high | 105 Ų | 105 | 89.7 Ų | 89.7 | 73% | 0.734 | 47% | 0.469 | S | S | * | . | G | 310 helix | trans | -65.3 | -28.9 | 177.6 | 54.5 | 0 | 0 | 0 | 0 | 113.3 | N92 K96 | N92-S94 PolarHBondContact O-N 3.35Å; S94-K96 VanDerWaalsContact C-N 3.31Å; S94-K96 PolarHBondContact O-N 3Å |
| 95 | L | 89.1 | Confident | 93.6 | Very high | 83 Ų | 83 | 91.1 Ų | 91.1 | 44% | 0.435 | 47% | 0.47 | S | S | . | . | G | 310 helix | trans | -91.4 | 13 | -178.2 | -63.6 | 173.5 | 0 | 0 | 0 | 113.3 | N92 P93 Q97 Q98 L99 | N92-L95 PolarHBondContact O-N 3.18Å; P93-L95 VanDerWaalsContact C-N 3.28Å; P93-L95 PolarHBondContact O-N 2.97Å; L95-Q97 VanDerWaalsContact C-N 3.28Å; L95-Q97 PolarHBondContact O-N 3.11Å; L95-Q97 VanDerWaalsContact O-N 3.13Å; L95-Q98 PolarHBondContact O-N 3.07Å; L95-L99 PolarHBondContact O-N 2.97Å |
| 96 | K | 88.6 | Confident | 93.6 | Very high | 110 Ų | 110 | 90.9 Ų | 90.9 | 48% | 0.478 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -51 | -42 | -171.7 | 63.8 | 176.9 | -169 | 177.3 | 0 | 115.1 | Y89 P93 S94 F100 | Y89-K96 HydrophobicContact CD2-CB 3.78Å; Y89-K96 HydrophobicContact CE2-CB 3.26Å; Y89-K96 HydrophobicContact CE2-CD 4.08Å; Y89-K96 HydrophobicContact CE2-CG 4.3Å; P93-K96 WeakPolarHBondContact O-CB 3.45Å; P93-K96 PolarHBondContact O-N 3.31Å; S94-K96 VanDerWaalsContact C-N 3.31Å; S94-K96 PolarHBondContact O-N 3Å; K96-F100 WeakPolarHBondContact O-CB 3.45Å; K96-F100 PolarHBondContact O-N 3.08Å |
| 97 | Q | 91.4 | Very high | 93.7 | Very high | 141 Ų | 141 | 88.3 Ų | 88.3 | 66% | 0.659 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -70.4 | -40.6 | -172.8 | -172.2 | 64 | 19.2 | 0 | 0 | 110.9 | L95 S101 | L95-Q97 VanDerWaalsContact C-N 3.28Å; L95-Q97 PolarHBondContact O-N 3.11Å; L95-Q97 VanDerWaalsContact O-N 3.13Å; Q97-S101 WeakPolarHBondContact O-CB 3.47Å; Q97-S101 PolarHBondContact O-N 3.21Å |
| 98 | Q | 92.8 | Very high | 93.8 | Very high | 98 Ų | 98 | 85.7 Ų | 85.7 | 46% | 0.458 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -71.4 | -44.4 | 177.9 | -172.5 | 177.6 | -3.7 | 0 | 0 | 110.9 | L95 F100 S101 Y102 | L95-Q98 PolarHBondContact O-N 3.07Å; Q98-F100 VanDerWaalsContact C-N 3.34Å; Q98-F100 PolarHBondContact O-N 3.2Å; Q98-S101 PolarHBondContact O-N 3.4Å; Q98-Y102 HydrophobicContact CG-CD2 4.24Å; Q98-Y102 HydrophobicContact CG-CE2 3.59Å; Q98-Y102 PolarHBondContact NE2-OH 3.44Å; Q98-Y102 WeakPolarHBondContact O-CD2 3.08Å; Q98-Y102 PolarHBondContact O-N 3.34Å |
| 99 | L | 92.9 | Very high | 93.9 | Very high | 52 Ų | 52 | 90 Ų | 90 | 27% | 0.272 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62 | -41.4 | 176.4 | -119.6 | 69.1 | 0 | 0 | 0 | 112.1 | L85 L95 Y102 A103 | L85-L99 HydrophobicContact CD1-CB 3.9Å; L85-L99 HydrophobicContact CD1-CD2 4.38Å; L85-L99 HydrophobicContact CD1-CG 4.33Å; L95-L99 PolarHBondContact O-N 2.97Å; L99-Y102 PolarHBondContact O-N 3.43Å; L99-A103 WeakPolarHBondContact O-CB 3.4Å; L99-A103 PolarHBondContact O-N 2.79Å |
| 100 | F | 93.7 | Very high | 94 | Very high | 102 Ų | 102 | 85.8 Ų | 85.8 | 45% | 0.447 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.8 | -41.7 | 175.1 | -174.8 | -109.4 | 0 | 0 | 0 | 111.4 | L85 K96 Q98 Y102 A103 I104 | L85-F100 HydrophobicContact CD2-CD2 4.21Å; K96-F100 WeakPolarHBondContact O-CB 3.45Å; K96-F100 PolarHBondContact O-N 3.08Å; Q98-F100 VanDerWaalsContact C-N 3.34Å; Q98-F100 PolarHBondContact O-N 3.2Å; F100-Y102 VanDerWaalsContact C-N 3.34Å; F100-Y102 PolarHBondContact O-N 3.38Å; F100-A103 PolarHBondContact O-N 2.88Å; F100-I104 HydrophobicContact CD1-CG1 4.18Å; F100-I104 HydrophobicContact CD2-CG1 4.41Å; F100-I104 HydrophobicContact CE1-CD1 4.3Å; F100-I104 HydrophobicContact CE1-CG1 3.8Å; F100-I104 HydrophobicContact CE2-CD1 3.94Å; F100-I104 HydrophobicContact CE2-CG1 4.06Å; F100-I104 HydrophobicContact CG-CG1 4.47Å; F100-I104 HydrophobicContact CZ-CD1 3.73Å; F100-I104 HydrophobicContact CZ-CG1 3.74Å; F100-I104 WeakPolarHBondContact O-CG1 3.23Å; F100-I104 PolarHBondContact O-N 3.03Å |
| 101 | S | 95.7 | Very high | 94.1 | Very high | 74 Ų | 74 | 84.9 Ų | 84.9 | 52% | 0.517 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.4 | -41.5 | 176.6 | -161.8 | 0 | 0 | 0 | 0 | 112.3 | Q97 Q98 I104 L105 | Q97-S101 WeakPolarHBondContact O-CB 3.47Å; Q97-S101 PolarHBondContact O-N 3.21Å; Q98-S101 PolarHBondContact O-N 3.4Å; S101-I104 PolarHBondContact O-N 2.94Å; S101-L105 WeakPolarHBondContact O-CB 3.47Å; S101-L105 PolarHBondContact O-N 3.03Å |
| 102 | Y | 95.2 | Very high | 94.2 | Very high | 137 Ų | 137 | 78.2 Ų | 78.2 | 54% | 0.537 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -67.6 | -37.2 | 173.7 | -63.8 | -31.8 | 0 | 0 | 0 | 113.3 | Q98 L99 F100 L105 G106 | Q98-Y102 HydrophobicContact CG-CD2 4.24Å; Q98-Y102 HydrophobicContact CG-CE2 3.59Å; Q98-Y102 PolarHBondContact NE2-OH 3.44Å; Q98-Y102 WeakPolarHBondContact O-CD2 3.08Å; Q98-Y102 PolarHBondContact O-N 3.34Å; L99-Y102 PolarHBondContact O-N 3.43Å; F100-Y102 VanDerWaalsContact C-N 3.34Å; F100-Y102 PolarHBondContact O-N 3.38Å; Y102-L105 PolarHBondContact O-N 3.27Å; Y102-G106 PolarHBondContact O-N 2.79Å |
| 103 | A | 96 | Very high | 94.5 | Very high | 8 Ų | 8 | 79.9 Ų | 79.9 | 7% | 0.066 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -66.8 | -39.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | V81 L85 L99 F100 L105 G106 F107 | V81-A103 HydrophobicContact CG1-CB 4.08Å; V81-A103 WeakPolarHBondContact CG1-O 3.37Å; L85-A103 HydrophobicContact CB-CB 4.11Å; L85-A103 HydrophobicContact CD1-CB 3.88Å; L85-A103 HydrophobicContact CD2-CB 3.67Å; L85-A103 HydrophobicContact CG-CB 4.08Å; L99-A103 WeakPolarHBondContact O-CB 3.4Å; L99-A103 PolarHBondContact O-N 2.79Å; F100-A103 PolarHBondContact O-N 2.88Å; A103-L105 VanDerWaalsContact C-N 3.34Å; A103-G106 PolarHBondContact O-N 2.88Å; A103-F107 VanDerWaalsContact O-CB 3.3Å; A103-F107 WeakPolarHBondContact O-CB 3.48Å; A103-F107 PolarHBondContact O-N 3.34Å |
| 104 | I | 96.5 | Very high | 94.8 | Very high | 67 Ų | 67 | 76.5 Ų | 76.5 | 34% | 0.344 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -66.6 | -37.5 | 174.8 | -64.7 | -56.9 | 0 | 0 | 0 | 111.2 | F100 S101 F107 A108 | F100-I104 HydrophobicContact CD1-CG1 4.18Å; F100-I104 HydrophobicContact CD2-CG1 4.41Å; F100-I104 HydrophobicContact CE1-CD1 4.3Å; F100-I104 HydrophobicContact CE1-CG1 3.8Å; F100-I104 HydrophobicContact CE2-CD1 3.94Å; F100-I104 HydrophobicContact CE2-CG1 4.06Å; F100-I104 HydrophobicContact CG-CG1 4.47Å; F100-I104 HydrophobicContact CZ-CD1 3.73Å; F100-I104 HydrophobicContact CZ-CG1 3.74Å; F100-I104 WeakPolarHBondContact O-CG1 3.23Å; F100-I104 PolarHBondContact O-N 3.03Å; S101-I104 PolarHBondContact O-N 2.94Å; I104-F107 PolarHBondContact O-N 2.81Å; I104-A108 WeakPolarHBondContact O-CB 3.37Å; I104-A108 PolarHBondContact O-N 3.37Å |
| 105 | L | 96.8 | Very high | 95 | Very high | 108 Ų | 108 | 76.6 Ų | 76.6 | 57% | 0.565 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -62 | -46.4 | 172.3 | -176.2 | 145.8 | 0 | 0 | 0 | 111.3 | S101 Y102 A103 A108 L109 | S101-L105 WeakPolarHBondContact O-CB 3.47Å; S101-L105 PolarHBondContact O-N 3.03Å; Y102-L105 PolarHBondContact O-N 3.27Å; A103-L105 VanDerWaalsContact C-N 3.34Å; L105-A108 PolarHBondContact O-N 3.27Å; L105-L109 HydrophobicContact CD2-CD1 3.73Å; L105-L109 HydrophobicContact CD2-CG 4.49Å; L105-L109 WeakPolarHBondContact O-CG 3.4Å; L105-L109 PolarHBondContact O-N 3.2Å |
| 106 | G | 96.1 | Very high | 95.4 | Very high | 20 Ų | 20 | 78.2 Ų | 78.2 | 21% | 0.206 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.1 | -40.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y102 A103 L109 S110 | Y102-G106 PolarHBondContact O-N 2.79Å; A103-G106 PolarHBondContact O-N 2.88Å; G106-L109 PolarHBondContact O-N 2.93Å; G106-S110 WeakPolarHBondContact O-CB 3.4Å; G106-S110 PolarHBondContact O-N 2.62Å |
| 107 | F | 96.6 | Very high | 95.7 | Very high | 66 Ų | 66 | 74.2 Ų | 74.2 | 29% | 0.289 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59.4 | -50 | 173.2 | 167.2 | -105.4 | 0 | 0 | 0 | 111.2 | I78 F82 A103 I104 L109 S110 E111 | I78-F107 HydrophobicContact CB-CD2 4.5Å; I78-F107 HydrophobicContact CD1-CD2 4.22Å; I78-F107 HydrophobicContact CD1-CE2 4.04Å; I78-F107 HydrophobicContact CG1-CD2 3.89Å; I78-F107 HydrophobicContact CG1-CE2 4.22Å; I78-F107 HydrophobicContact CG2-CD2 3.86Å; I78-F107 HydrophobicContact CG2-CE2 4.18Å; F82-F107 HydrophobicContact CE2-CB 4.36Å; F82-F107 AromaticContact CE2-CD2 3.81Å; F82-F107 HydrophobicContact CE2-CD2 3.81Å; F82-F107 HydrophobicContact CE2-CE2 4.49Å; F82-F107 HydrophobicContact CE2-CG 4.26Å; F82-F107 HydrophobicContact CZ-CB 4.37Å; F82-F107 HydrophobicContact CZ-CD2 4.3Å; F82-F107 HydrophobicContact CZ-CG 4.35Å; A103-F107 VanDerWaalsContact O-CB 3.3Å; A103-F107 WeakPolarHBondContact O-CB 3.48Å; A103-F107 PolarHBondContact O-N 3.34Å; I104-F107 PolarHBondContact O-N 2.81Å; F107-L109 VanDerWaalsContact C-N 3.32Å; F107-L109 PolarHBondContact O-N 3.42Å; F107-S110 PolarHBondContact O-N 2.88Å; F107-E111 HydrophobicContact CD2-CG 3.98Å; F107-E111 HydrophobicContact CE1-CG 4.06Å; F107-E111 HydrophobicContact CE2-CG 3.45Å; F107-E111 VanDerWaalsContact CE2-CG 3.45Å; F107-E111 WeakPolarHBondContact CE2-OE1 3.34Å; F107-E111 HydrophobicContact CG-CG 4.48Å; F107-E111 HydrophobicContact CZ-CG 3.5Å; F107-E111 VanDerWaalsContact CZ-CG 3.5Å; F107-E111 WeakPolarHBondContact O-CB 3.26Å; F107-E111 WeakPolarHBondContact O-CG 3.33Å; F107-E111 PolarHBondContact O-N 3.27Å |
| 108 | A | 97.7 | Very high | 95.9 | Very high | 53 Ų | 53 | 69.9 Ų | 69.9 | 44% | 0.438 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.5 | -39 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | I104 L105 A112 | I104-A108 WeakPolarHBondContact O-CB 3.37Å; I104-A108 PolarHBondContact O-N 3.37Å; L105-A108 PolarHBondContact O-N 3.27Å; A108-A112 WeakPolarHBondContact O-CB 3.38Å; A108-A112 PolarHBondContact O-N 2.86Å |
| 109 | L | 96.9 | Very high | 96.2 | Very high | 111 Ų | 111 | 69.5 Ų | 69.5 | 58% | 0.581 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -67.8 | -40.9 | 175.4 | -68.8 | 175.9 | 0 | 0 | 0 | 112.2 | L105 G106 F107 A112 M113 | L105-L109 HydrophobicContact CD2-CD1 3.73Å; L105-L109 HydrophobicContact CD2-CG 4.49Å; L105-L109 WeakPolarHBondContact O-CG 3.4Å; L105-L109 PolarHBondContact O-N 3.2Å; G106-L109 PolarHBondContact O-N 2.93Å; F107-L109 VanDerWaalsContact C-N 3.32Å; F107-L109 PolarHBondContact O-N 3.42Å; L109-A112 PolarHBondContact O-N 2.68Å; L109-M113 WeakPolarHBondContact O-CG 3.38Å; L109-M113 PolarHBondContact O-N 3.48Å |
| 110 | S | 96 | Very high | 96.3 | Very high | 20 Ų | 20 | 69.6 Ų | 69.6 | 14% | 0.14 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -63.2 | -46.5 | 175.5 | -165.9 | 0 | 0 | 0 | 0 | 111.1 | S74 G106 F107 A112 M113 G114 | S74-S110 WeakPolarHBondContact CB-O 3.49Å; S74-S110 PolarHBondContact O-OG 3.5Å; S74-S110 VanDerWaalsContact O-OG 3.04Å; S74-S110 PolarHBondContact OG-O 2.97Å; S74-S110 PolarHBondContact OG-OG 2.9Å; G106-S110 WeakPolarHBondContact O-CB 3.4Å; G106-S110 PolarHBondContact O-N 2.62Å; F107-S110 PolarHBondContact O-N 2.88Å; S110-A112 PolarHBondContact O-N 3.08Å; S110-M113 PolarHBondContact O-N 3.34Å; S110-G114 PolarHBondContact O-N 2.95Å |
| 111 | E | 97 | Very high | 96.5 | Very high | 65 Ų | 65 | 64.9 Ų | 64.9 | 30% | 0.304 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.2 | -42 | 175.6 | -77.2 | -66 | 172.3 | 0 | 0 | 112.3 | I78 F107 M113 G114 L115 | I78-E111 HydrophobicContact CD1-CG 4.07Å; I78-E111 WeakPolarHBondContact CD1-OE1 3.45Å; F107-E111 HydrophobicContact CD2-CG 3.98Å; F107-E111 HydrophobicContact CE1-CG 4.06Å; F107-E111 HydrophobicContact CE2-CG 3.45Å; F107-E111 VanDerWaalsContact CE2-CG 3.45Å; F107-E111 WeakPolarHBondContact CE2-OE1 3.34Å; F107-E111 HydrophobicContact CG-CG 4.48Å; F107-E111 HydrophobicContact CZ-CG 3.5Å; F107-E111 VanDerWaalsContact CZ-CG 3.5Å; F107-E111 WeakPolarHBondContact O-CB 3.26Å; F107-E111 WeakPolarHBondContact O-CG 3.33Å; F107-E111 PolarHBondContact O-N 3.27Å; E111-M113 VanDerWaalsContact C-N 3.25Å; E111-M113 PolarHBondContact O-N 3.38Å; E111-G114 PolarHBondContact O-N 3.4Å; E111-G114 VanDerWaalsContact O-N 3.07Å; E111-L115 WeakPolarHBondContact O-CB 3.42Å; E111-L115 WeakPolarHBondContact O-CG 3.33Å; E111-L115 PolarHBondContact O-N 3.34Å |
| 112 | A | 97.4 | Very high | 96.5 | Very high | 54 Ų | 54 | 66.8 Ų | 66.8 | 45% | 0.446 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -57.5 | -40.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A108 L109 S110 F116 | A108-A112 WeakPolarHBondContact O-CB 3.38Å; A108-A112 PolarHBondContact O-N 2.86Å; L109-A112 PolarHBondContact O-N 2.68Å; S110-A112 PolarHBondContact O-N 3.08Å; A112-F116 VanDerWaalsContact O-CB 3.23Å; A112-F116 WeakPolarHBondContact O-CB 3.18Å; A112-F116 PolarHBondContact O-N 3.48Å |
| 113 | M | 96 | Very high | 96.5 | Very high | 129 Ų | 129 | 64.5 Ų | 64.5 | 64% | 0.635 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -69.9 | -37.3 | 175.4 | -65.6 | -57 | -61.3 | 0 | 0 | 112.6 | L109 S110 E111 F116 C117 | L109-M113 WeakPolarHBondContact O-CG 3.38Å; L109-M113 PolarHBondContact O-N 3.48Å; S110-M113 PolarHBondContact O-N 3.34Å; E111-M113 VanDerWaalsContact C-N 3.25Å; E111-M113 PolarHBondContact O-N 3.38Å; M113-F116 PolarHBondContact O-N 2.82Å; M113-C117 PolarHBondContact O-N 3.46Å; M113-C117 VanDerWaalsContact O-N 3.07Å |
| 114 | G | 96.3 | Very high | 96.4 | Very high | 4 Ų | 4 | 66 Ų | 66 | 4% | 0.041 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.5 | -46.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | S110 E111 F116 C117 L118 | S110-G114 PolarHBondContact O-N 2.95Å; E111-G114 PolarHBondContact O-N 3.4Å; E111-G114 VanDerWaalsContact O-N 3.07Å; G114-F116 VanDerWaalsContact C-N 3.33Å; G114-C117 VanDerWaalsContact O-CB 3.23Å; G114-C117 WeakPolarHBondContact O-CB 3.46Å; G114-C117 PolarHBondContact O-N 3.06Å; G114-L118 PolarHBondContact O-N 2.98Å |
| 115 | L | 96.4 | Very high | 96.2 | Very high | 106 Ų | 106 | 65.7 Ų | 65.7 | 56% | 0.555 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -66.9 | -34.8 | 176.1 | -68.8 | -178.5 | 0 | 0 | 0 | 112 | E111 C117 L118 M119 | E111-L115 WeakPolarHBondContact O-CB 3.42Å; E111-L115 WeakPolarHBondContact O-CG 3.33Å; E111-L115 PolarHBondContact O-N 3.34Å; L115-C117 VanDerWaalsContact C-N 3.3Å; L115-C117 PolarHBondContact O-N 3.32Å; L115-L118 HydrophobicContact CD2-CD1 4.44Å; L115-L118 PolarHBondContact O-N 3.43Å; L115-M119 WeakPolarHBondContact O-CB 3.28Å; L115-M119 PolarHBondContact O-N 3.36Å |
| 116 | F | 96.4 | Very high | 96 | Very high | 118 Ų | 118 | 67.9 Ų | 67.9 | 52% | 0.518 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -60.4 | -42.2 | 171.5 | 178.1 | -105.6 | 0 | 0 | 0 | 111.4 | A112 M113 G114 M119 V120 | A112-F116 VanDerWaalsContact O-CB 3.23Å; A112-F116 WeakPolarHBondContact O-CB 3.18Å; A112-F116 PolarHBondContact O-N 3.48Å; M113-F116 PolarHBondContact O-N 2.82Å; G114-F116 VanDerWaalsContact C-N 3.33Å; F116-M119 HydrophobicContact CD2-CE 4.23Å; F116-M119 HydrophobicContact CE2-CE 4.01Å; F116-M119 WeakPolarHBondContact O-CB 3.04Å; F116-M119 PolarHBondContact O-N 3.5Å; F116-V120 HydrophobicContact CZ-CG2 4.42Å; F116-V120 PolarHBondContact O-N 3.32Å |
| 117 | C | 96.1 | Very high | 95.7 | Very high | 25 Ų | 25 | 70.5 Ų | 70.5 | 17% | 0.169 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.2 | -44.6 | 174.6 | -156.8 | 0 | 0 | 0 | 0 | 112 | A67 G70 V71 M113 G114 L115 V120 A121 | A67-C117 PolarHBondContact O-SG 3.19Å; G70-C117 WeakPolarHBondContact CA-SG 3.31Å; V71-C117 HydrophobicContact CG2-CB 4.28Å; M113-C117 PolarHBondContact O-N 3.46Å; M113-C117 VanDerWaalsContact O-N 3.07Å; G114-C117 VanDerWaalsContact O-CB 3.23Å; G114-C117 WeakPolarHBondContact O-CB 3.46Å; G114-C117 PolarHBondContact O-N 3.06Å; L115-C117 VanDerWaalsContact C-N 3.3Å; L115-C117 PolarHBondContact O-N 3.32Å; C117-V120 PolarHBondContact O-N 3.04Å; C117-A121 PolarHBondContact O-N 2.86Å; C117-A121 VanDerWaalsContact O-N 3.08Å |
| 118 | L | 96.2 | Very high | 94.9 | Very high | 50 Ų | 50 | 75.4 Ų | 75.4 | 26% | 0.262 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -66 | -36.4 | 175.7 | -74.3 | -175.2 | 0 | 0 | 0 | 113 | T68 V71 G114 L115 V120 A121 F122 | T68-L118 HydrophobicContact CG2-CD2 3.96Å; V71-L118 HydrophobicContact CG2-CD1 4.45Å; V71-L118 HydrophobicContact CG2-CD2 3.66Å; V71-L118 HydrophobicContact CG2-CG 3.67Å; G114-L118 PolarHBondContact O-N 2.98Å; L115-L118 HydrophobicContact CD2-CD1 4.44Å; L115-L118 PolarHBondContact O-N 3.43Å; L118-V120 VanDerWaalsContact C-N 3.31Å; L118-V120 PolarHBondContact O-N 3.41Å; L118-A121 PolarHBondContact O-N 3.08Å; L118-F122 WeakPolarHBondContact O-CG 3.18Å; L118-F122 PolarHBondContact O-N 3.37Å |
| 119 | M | 97.4 | Very high | 94.8 | Very high | 91 Ų | 91 | 76.5 Ų | 76.5 | 45% | 0.448 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -57.5 | -46.9 | 175.5 | -176.5 | -151.7 | 79.6 | 0 | 0 | 110.5 | L115 F116 F122 L123 | L115-M119 WeakPolarHBondContact O-CB 3.28Å; L115-M119 PolarHBondContact O-N 3.36Å; F116-M119 HydrophobicContact CD2-CE 4.23Å; F116-M119 HydrophobicContact CE2-CE 4.01Å; F116-M119 WeakPolarHBondContact O-CB 3.04Å; F116-M119 PolarHBondContact O-N 3.5Å; M119-F122 PolarHBondContact O-N 3.07Å; M119-L123 HydrophobicContact CE-CD1 3.9Å; M119-L123 PolarHBondContact O-N 2.76Å |
| 120 | V | 96.9 | Very high | 94.7 | Very high | 54 Ų | 54 | 74.7 Ų | 74.7 | 33% | 0.327 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 176.8 | 177.8 | 0 | 0 | 0 | 0 | 111.1 | F116 C117 L118 F122 L123 I124 | F116-V120 HydrophobicContact CZ-CG2 4.42Å; F116-V120 PolarHBondContact O-N 3.32Å; C117-V120 PolarHBondContact O-N 3.04Å; L118-V120 VanDerWaalsContact C-N 3.31Å; L118-V120 PolarHBondContact O-N 3.41Å; V120-F122 VanDerWaalsContact C-N 3.32Å; V120-F122 PolarHBondContact O-N 3.42Å; V120-L123 PolarHBondContact O-N 3.5Å; V120-I124 HydrophobicContact CG1-CD1 4.09Å; V120-I124 WeakPolarHBondContact O-CG1 3.45Å; V120-I124 PolarHBondContact O-N 3.09Å |
| 121 | A | 96.5 | Very high | 94.6 | Very high | 2 Ų | 2 | 77.7 Ų | 77.7 | 2% | 0.017 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -59.7 | -41.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A67 T68 C117 L118 I124 L125 | A67-A121 HydrophobicContact CB-CB 4.01Å; T68-A121 HydrophobicContact CG2-CB 3.65Å; C117-A121 PolarHBondContact O-N 2.86Å; C117-A121 VanDerWaalsContact O-N 3.08Å; L118-A121 PolarHBondContact O-N 3.08Å; A121-I124 PolarHBondContact O-N 2.91Å; A121-L125 PolarHBondContact O-N 3.43Å; A121-L125 VanDerWaalsContact O-N 3.08Å |
| 122 | F | 95.5 | Very high | 94.5 | Very high | 115 Ų | 115 | 78.5 Ų | 78.5 | 50% | 0.504 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -71.2 | -33 | 175.8 | -69.4 | -28.2 | 0 | 0 | 0 | 113.5 | L118 M119 V120 I124 L125 F126 | L118-F122 WeakPolarHBondContact O-CG 3.18Å; L118-F122 PolarHBondContact O-N 3.37Å; M119-F122 PolarHBondContact O-N 3.07Å; V120-F122 VanDerWaalsContact C-N 3.32Å; V120-F122 PolarHBondContact O-N 3.42Å; F122-I124 VanDerWaalsContact C-N 3.3Å; F122-I124 PolarHBondContact O-N 3.05Å; F122-L125 PolarHBondContact O-N 3.29Å; F122-F126 HydrophobicContact CB-CD2 4.26Å; F122-F126 HydrophobicContact CD1-CD2 4.4Å; F122-F126 HydrophobicContact CD1-CE2 4Å; F122-F126 PolarHBondContact O-N 2.97Å |
| 123 | L | 95.5 | Very high | 94.3 | Very high | 88 Ų | 88 | 80 Ų | 80 | 46% | 0.461 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.2 | -40.7 | 170.7 | -80.5 | 171.9 | 0 | 0 | 0 | 111.4 | M119 V120 L125 A127 M128 | M119-L123 HydrophobicContact CE-CD1 3.9Å; M119-L123 PolarHBondContact O-N 2.76Å; V120-L123 PolarHBondContact O-N 3.5Å; L123-L125 VanDerWaalsContact C-N 3.33Å; L123-L125 PolarHBondContact O-N 3.16Å; L123-A127 HydrophobicContact CD2-CB 3.66Å; L123-A127 CarbonylContact O-C 3.59Å; L123-A127 WeakPolarHBondContact O-CA 3.44Å; L123-A127 WeakPolarHBondContact O-CB 3.36Å; L123-A127 PolarHBondContact O-N 2.79Å; L123-M128 PolarHBondContact O-N 2.77Å |
| 124 | I | 94.4 | Very high | 94.2 | Very high | 40 Ų | 40 | 76.7 Ų | 76.7 | 21% | 0.205 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -67.3 | -35.1 | 177 | -64.2 | 165.4 | 0 | 0 | 0 | 111.5 | A64 A67 V120 A121 F122 | A64-I124 HydrophobicContact CB-CB 4.32Å; A64-I124 HydrophobicContact CB-CG2 4.08Å; A67-I124 HydrophobicContact CB-CD1 4Å; V120-I124 HydrophobicContact CG1-CD1 4.09Å; V120-I124 WeakPolarHBondContact O-CG1 3.45Å; V120-I124 PolarHBondContact O-N 3.09Å; A121-I124 PolarHBondContact O-N 2.91Å; F122-I124 VanDerWaalsContact C-N 3.3Å; F122-I124 PolarHBondContact O-N 3.05Å |
| 125 | L | 92.9 | Very high | 94 | Very high | 61 Ų | 61 | 81.9 Ų | 81.9 | 32% | 0.319 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -80.3 | -38.4 | -176.1 | -147.4 | 172.7 | 0 | 0 | 0 | 112.5 | F61 A64 A121 F122 L123 | F61-L125 HydrophobicContact CD1-CD2 4.49Å; F61-L125 HydrophobicContact CD1-CG 4.49Å; F61-L125 HydrophobicContact CE1-CD2 3.99Å; F61-L125 HydrophobicContact CE1-CG 4.47Å; A64-L125 HydrophobicContact CB-CB 4.19Å; A64-L125 HydrophobicContact CB-CD1 4.47Å; A64-L125 HydrophobicContact CB-CG 4.32Å; A121-L125 PolarHBondContact O-N 3.43Å; A121-L125 VanDerWaalsContact O-N 3.08Å; F122-L125 PolarHBondContact O-N 3.29Å; L123-L125 VanDerWaalsContact C-N 3.33Å; L123-L125 PolarHBondContact O-N 3.16Å |
| 126 | F | 92.1 | Very high | 93.9 | Very high | 154 Ų | 154 | 80.1 Ų | 80.1 | 68% | 0.675 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -118.9 | -18.2 | -168.7 | -60.7 | -63.3 | 0 | 0 | 0 | 115.5 | F122 | F122-F126 HydrophobicContact CB-CD2 4.26Å; F122-F126 HydrophobicContact CD1-CD2 4.4Å; F122-F126 HydrophobicContact CD1-CE2 4Å; F122-F126 PolarHBondContact O-N 2.97Å |
| 127 | A | 89.5 | Confident | 93.7 | Very high | 74 Ų | 74 | 76.9 Ų | 76.9 | 61% | 0.612 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.4 | -40 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | L123 | L123-A127 HydrophobicContact CD2-CB 3.66Å; L123-A127 CarbonylContact O-C 3.59Å; L123-A127 WeakPolarHBondContact O-CA 3.44Å; L123-A127 WeakPolarHBondContact O-CB 3.36Å; L123-A127 PolarHBondContact O-N 2.79Å |
| 128 | M | 80.8 | Confident | 93.4 | Very high | 169 Ų | 169 | 81.6 Ų | 81.6 | 83% | 0.833 | 42% | 0.424 | S | S | * | . | trans | -79.1 | 0 | 166.6 | -94.9 | -168.7 | 160.3 | 0 | 0 | 110.1 | K60 L123 | K60-M128 WeakPolarHBondContact CD-OXT 3.23Å; K60-M128 WeakPolarHBondContact CE-O 3.31Å; K60-M128 WeakPolarHBondContact CE-OXT 3.35Å; K60-M128 PolarHBondContact NZ-O 2.71Å; K60-M128 PolarHBondContact NZ-OXT 3.34Å; L123-M128 PolarHBondContact O-N 2.77Å |
Retrieved 128 of 128 residues in 212 ms
(Link to these results)