| 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 | 42 | Very low | 48 | Very low | 249 Ų | 249 | 152.4 Ų | 152.4 | 100% | 1.227 | 84% | 0.843 | S | S | * | * | 0 | 90.6 | 0 | -77.2 | 173.2 | 174.4 | 0 | 0 | 105.1 | |||||
| 2 | D | 44.8 | Very low | 48 | Very low | 153 Ų | 153 | 147.7 Ų | 147.7 | 82% | 0.818 | 83% | 0.829 | S | S | * | * | trans | -92.6 | 133.9 | 174.8 | -103.3 | -84.1 | 0 | 0 | 0 | 107.7 | ||||
| 3 | F | 48.6 | Very low | 47.9 | Very low | 197 Ų | 197 | 142.1 Ų | 142.1 | 86% | 0.864 | 82% | 0.824 | S | S | * | * | trans | -108 | 89.1 | -179.3 | -148.8 | -89.5 | 0 | 0 | 0 | 106.8 | L5 | F3-L5 PolarHBondContact O-N 2.86Å; F3-L5 VanDerWaalsContact O-N 3.13Å | ||
| 4 | D | 43.8 | Very low | 48.1 | Very low | 149 Ų | 149 | 143.6 Ų | 143.6 | 80% | 0.797 | 83% | 0.826 | S | S | * | * | trans | -64.1 | 110.9 | 175.9 | -76.7 | -68.4 | 0 | 0 | 0 | 109.8 | ||||
| 5 | L | 54.2 | Low | 48.1 | Very low | 147 Ų | 147 | 138.3 Ų | 138.3 | 77% | 0.77 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 144.2 | 167.7 | -75.7 | 162.4 | 0 | 0 | 0 | 109.6 | F3 | F3-L5 PolarHBondContact O-N 2.86Å; F3-L5 VanDerWaalsContact O-N 3.13Å |
| 6 | P | 53.8 | Low | 48.3 | Very low | 107 Ų | 107 | 143.3 Ų | 143.3 | 70% | 0.695 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 145.3 | 173.4 | 28.3 | -33.2 | 0 | 0 | 0 | 110.4 | T8 | P6-T8 PolarHBondContact O-N 2.98Š|
| 7 | P | 51.2 | Low | 48.3 | Very low | 114 Ų | 114 | 144.1 Ų | 144.1 | 74% | 0.74 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -63 | 128.5 | 178.1 | 25 | -32.1 | 0 | 0 | 0 | 110.3 | F9 | P7-F9 PolarHBondContact O-N 3.41Š|
| 8 | T | 49.8 | Very low | 48.2 | Very low | 140 Ų | 140 | 147.8 Ų | 147.8 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 117.6 | 167.2 | 21.4 | 0 | 0 | 0 | 0 | 108.8 | P6 | P6-T8 PolarHBondContact O-N 2.98Š|
| 9 | F | 48.7 | Very low | 48.2 | Very low | 200 Ų | 200 | 147.1 Ų | 147.1 | 88% | 0.877 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 128.3 | 173.5 | -73.5 | -87 | 0 | 0 | 0 | 109.8 | P7 A11 | P7-F9 PolarHBondContact O-N 3.41Å; F9-A11 PolarHBondContact O-N 3.23Å |
| 10 | P | 42.5 | Very low | 48.3 | Very low | 108 Ų | 108 | 146.8 Ų | 146.8 | 70% | 0.701 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 130.9 | 166.8 | 26.7 | -30.3 | 0 | 0 | 0 | 109.6 | S12 | P10-S12 PolarHBondContact O-N 2.89Š|
| 11 | A | 48.7 | Very low | 48.2 | Very low | 112 Ų | 112 | 145 Ų | 145 | 93% | 0.926 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -68.9 | 76.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | F9 | F9-A11 PolarHBondContact O-N 3.23Š|
| 12 | S | 48.5 | Very low | 48.5 | Very low | 96 Ų | 96 | 139.1 Ų | 139.1 | 67% | 0.671 | 78% | 0.776 | S | S | * | * | trans | 166.1 | 99 | 169 | 172.3 | 0 | 0 | 0 | 0 | 105 | P10 | P10-S12 PolarHBondContact O-N 2.89Š| ||
| 13 | G | 45.8 | Very low | 48.6 | Very low | 75 Ų | 75 | 140 Ų | 140 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | 81.1 | 72.7 | 57.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 14 | I | 51.5 | Low | 48.4 | Very low | 164 Ų | 164 | 138.6 Ų | 138.6 | 84% | 0.841 | 78% | 0.78 | S | S | * | * | trans | -130 | 130.9 | 163 | -58.6 | -176.5 | 0 | 0 | 0 | 110.2 | ||||
| 15 | A | 48.3 | Very low | 48 | Very low | 64 Ų | 64 | 137.6 Ų | 137.6 | 53% | 0.529 | 78% | 0.782 | S | S | . | * | trans | -78.3 | 161.8 | -162.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | E17 | A15-E17 PolarHBondContact O-N 3.23Š| ||
| 16 | W | 50.1 | Low | 47.1 | Very low | 218 Ų | 218 | 133.9 Ų | 133.9 | 83% | 0.826 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -66.9 | 10.6 | -173.7 | 55.1 | -89 | 0 | 0 | 0 | 115.9 | R18 | W16-R18 VanDerWaalsContact C-N 3.27Å; W16-R18 PolarHBondContact O-N 2.73Å |
| 17 | E | 49.8 | Very low | 46.5 | Very low | 157 Ų | 157 | 137.2 Ų | 137.2 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | 15.4 | -174.8 | -52.9 | -165.3 | 146 | 0 | 0 | 114.3 | A15 | A15-E17 PolarHBondContact O-N 3.23Š|
| 18 | R | 45.8 | Very low | 45.7 | Very low | 210 Ų | 210 | 139.8 Ų | 139.8 | 79% | 0.792 | 80% | 0.798 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.6 | 22.2 | 178.3 | -71.7 | -146.3 | 71.6 | -149.2 | -0.3 | 115.4 | W16 L20 | W16-R18 VanDerWaalsContact C-N 3.27Å; W16-R18 PolarHBondContact O-N 2.73Å; R18-L20 PolarHBondContact O-N 2.78Å |
| 19 | V | 49.1 | Very low | 44.9 | Very low | 135 Ų | 135 | 136.5 Ų | 136.5 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -87.7 | 82.8 | 168.2 | -169.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 20 | L | 48.4 | Very low | 44.7 | Very low | 140 Ų | 140 | 132.5 Ų | 132.5 | 73% | 0.733 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 144.6 | 163 | -69.1 | 175.9 | 0 | 0 | 0 | 109.4 | R18 | R18-L20 PolarHBondContact O-N 2.78Š|
| 21 | P | 47.1 | Very low | 44.3 | Very low | 110 Ų | 110 | 137.4 Ų | 137.4 | 71% | 0.714 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 142.4 | -177.8 | 29.4 | -33.4 | 0 | 0 | 0 | 111.3 | L23 | P21-L23 PolarHBondContact O-N 3.13Š|
| 22 | P | 48.6 | Very low | 43.7 | Very low | 126 Ų | 126 | 134.9 Ų | 134.9 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 124.6 | 174.5 | 27.6 | -30.2 | 0 | 0 | 0 | 111 | ||
| 23 | L | 47.4 | Very low | 43.7 | Very low | 170 Ų | 170 | 138.7 Ų | 138.7 | 89% | 0.89 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 135.8 | 164.2 | -64.5 | 165 | 0 | 0 | 0 | 109.2 | P21 | P21-L23 PolarHBondContact O-N 3.13Š|
| 24 | L | 43.2 | Very low | 43.3 | Very low | 169 Ų | 169 | 144.3 Ų | 144.3 | 89% | 0.885 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -60 | 156.7 | -175.4 | -59.5 | 164.4 | 0 | 0 | 0 | 114.3 | ||
| 25 | P | 36.4 | Very low | 43.2 | Very low | 127 Ų | 127 | 142.3 Ų | 142.3 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -115.8 | 136 | 138.3 | 28.3 | -14.7 | 0 | 0 | 0 | 111.3 | ||||
| 26 | G | 34.9 | Very low | 42.6 | Very low | 70 Ų | 70 | 147.6 Ų | 147.6 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | -86.8 | 173 | -173.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 27 | L | 41 | Very low | 42.2 | Very low | 176 Ų | 176 | 143.2 Ų | 143.2 | 92% | 0.921 | 80% | 0.8 | S | S | * | * | trans | 51.7 | 117.3 | 152.4 | -74 | 158.7 | 0 | 0 | 0 | 119.6 | ||||
| 28 | N | 34.7 | Very low | 41.7 | Very low | 168 Ų | 168 | 139.1 Ų | 139.1 | 90% | 0.898 | 79% | 0.787 | S | S | * | * | 132.5 | 127.6 | 117.8 | -149.9 | 20.5 | 0 | 0 | 0 | 113.9 | |||||
| 29 | G | 32.9 | Very low | 41.6 | Very low | 71 Ų | 71 | 134.7 Ų | 134.7 | 73% | 0.732 | 79% | 0.788 | S | S | * | * | trans | 111.1 | 107.4 | 156.7 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 30 | T | 43.4 | Very low | 41.4 | Very low | 117 Ų | 117 | 136.6 Ų | 136.6 | 72% | 0.718 | 79% | 0.788 | S | S | * | * | trans | -52.5 | 146 | 164.2 | 45.8 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 31 | F | 35.7 | Very low | 41.3 | Very low | 211 Ų | 211 | 136.1 Ų | 136.1 | 93% | 0.925 | 79% | 0.786 | S | S | * | * | -179.9 | 131.3 | 125 | -84.2 | -64.5 | 0 | 0 | 0 | 110.9 | |||||
| 32 | G | 35.8 | Very low | 41.1 | Very low | 58 Ų | 58 | 138.4 Ų | 138.4 | 60% | 0.598 | 79% | 0.791 | S | S | * | * | trans | 95.7 | 85.7 | 139.7 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 33 | L | 47.3 | Very low | 40.6 | Very low | 177 Ų | 177 | 138.1 Ų | 138.1 | 93% | 0.927 | 79% | 0.787 | S | S | * | * | 39.5 | 79 | 129.7 | -142.1 | 80.3 | 0 | 0 | 0 | 119.1 | |||||
| 34 | Y | 38.3 | Very low | 40.2 | Very low | 193 Ų | 193 | 135.3 Ų | 135.3 | 76% | 0.757 | 78% | 0.779 | S | S | * | * | trans | -144.5 | 115.8 | 139.7 | 39.5 | -89.3 | 0 | 0 | 0 | 107.1 | F36 | Y34-F36 PolarHBondContact O-N 3.25Š| ||
| 35 | S | 49.7 | Very low | 39.8 | Very low | 122 Ų | 122 | 132.6 Ų | 132.6 | 85% | 0.853 | 77% | 0.769 | S | S | * | * | trans | -70.8 | 82.2 | 171.2 | -53.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 36 | F | 35.3 | Very low | 40 | Very low | 174 Ų | 174 | 131.4 Ų | 131.4 | 76% | 0.763 | 76% | 0.76 | S | S | * | * | trans | -111.6 | 103.9 | 153.8 | -87.1 | -93.5 | 0 | 0 | 0 | 105.6 | Y34 P38 | Y34-F36 PolarHBondContact O-N 3.25Å; F36-P38 VanDerWaalsContact C-CD 3.41Å; F36-P38 WeakPolarHBondContact O-CD 2.99Å | ||
| 37 | T | 42.5 | Very low | 40 | Very low | 127 Ų | 127 | 134 Ų | 134 | 78% | 0.779 | 75% | 0.753 | S | S | * | * | trans | -84.5 | 96.4 | 154.2 | 49.7 | 0 | 0 | 0 | 0 | 106.2 | S39 | T37-S39 PolarHBondContact O-N 2.95Š| ||
| 38 | P | 37.4 | Very low | 40.1 | Very low | 71 Ų | 71 | 134 Ų | 134 | 46% | 0.461 | 75% | 0.748 | S | S | . | * | trans | -74.1 | 89.6 | 161 | 33 | -31.3 | 0 | 0 | 0 | 106.1 | F36 E40 L41 | F36-P38 VanDerWaalsContact C-CD 3.41Å; F36-P38 WeakPolarHBondContact O-CD 2.99Å; P38-E40 HydrophobicContact CB-CB 4.29Å; P38-E40 PolarHBondContact O-N 2.8Å; P38-L41 HydrophobicContact CB-CG 4.35Å; P38-L41 HydrophobicContact CG-CD1 4.46Å | ||
| 39 | S | 43.9 | Very low | 40.4 | Very low | 116 Ų | 116 | 129.3 Ų | 129.3 | 81% | 0.811 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | -0 | 144.8 | -53.5 | 0 | 0 | 0 | 0 | 110.9 | T37 | T37-S39 PolarHBondContact O-N 2.95Š|
| 40 | E | 45.4 | Very low | 41.2 | Very low | 175 Ų | 175 | 126.7 Ų | 126.7 | 82% | 0.818 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | 26.7 | 175.9 | -69.7 | -87.1 | 110.4 | 0 | 0 | 113.1 | P38 | P38-E40 HydrophobicContact CB-CB 4.29Å; P38-E40 PolarHBondContact O-N 2.8Å |
| 41 | L | 45.6 | Very low | 41.7 | Very low | 130 Ų | 130 | 125.8 Ų | 125.8 | 68% | 0.681 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -134.7 | 110 | 166 | -76 | 177 | 0 | 0 | 0 | 110.5 | P38 | P38-L41 HydrophobicContact CB-CG 4.35Å; P38-L41 HydrophobicContact CG-CD1 4.46Å |
| 42 | L | 43.8 | Very low | 42.9 | Very low | 158 Ų | 158 | 117.4 Ų | 117.4 | 83% | 0.827 | 67% | 0.667 | S | S | * | * | S | Bend | trans | 87.7 | 52.8 | 161 | -44.2 | 174 | 0 | 0 | 0 | 116.3 | ||
| 43 | T | 39 | Very low | 44.9 | Very low | 121 Ų | 121 | 120.8 Ų | 120.8 | 74% | 0.742 | 67% | 0.667 | S | S | * | * | -101.4 | 131 | 113.1 | 53 | 0 | 0 | 0 | 0 | 106.1 | V45 | T43-V45 PolarHBondContact O-N 2.66Š| |||
| 44 | P | 38.6 | Very low | 46.2 | Very low | 110 Ų | 110 | 116.1 Ų | 116.1 | 71% | 0.714 | 65% | 0.646 | S | S | * | * | trans | -53.8 | 113.3 | 148.9 | 26.1 | -28.6 | 0 | 0 | 0 | 103.2 | T46 | P44-T46 PolarHBondContact O-N 3Š| ||
| 45 | V | 34 | Very low | 47.9 | Very low | 113 Ų | 113 | 109.9 Ų | 109.9 | 69% | 0.685 | 63% | 0.63 | S | S | * | * | trans | -61 | 87.4 | 143.2 | 88.9 | 0 | 0 | 0 | 0 | 101.7 | T43 E47 | T43-V45 PolarHBondContact O-N 2.66Å; V45-E47 HydrophobicContact CG1-CB 4.42Å; V45-E47 HydrophobicContact CG1-CG 3.89Å; V45-E47 HydrophobicContact CG2-CG 4.07Å; V45-E47 PolarHBondContact O-N 3.22Å | ||
| 46 | T | 40.3 | Very low | 48.9 | Very low | 101 Ų | 101 | 107.6 Ų | 107.6 | 62% | 0.62 | 61% | 0.613 | S | S | * | * | -52.2 | 88.7 | 128.3 | -55 | 0 | 0 | 0 | 0 | 100.9 | P44 Q48 | P44-T46 PolarHBondContact O-N 3Å; T46-Q48 HydrophobicContact CG2-CG 4.05Å; T46-Q48 PolarHBondContact O-N 3Å | |||
| 47 | E | 35.7 | Very low | 50.8 | Low | 124 Ų | 124 | 103.9 Ų | 103.9 | 58% | 0.579 | 60% | 0.601 | S | S | * | * | trans | -50.8 | 96.3 | 153.5 | -101 | -144.1 | 134.5 | 0 | 0 | 101.4 | V45 T49 | V45-E47 HydrophobicContact CG1-CB 4.42Å; V45-E47 HydrophobicContact CG1-CG 3.89Å; V45-E47 HydrophobicContact CG2-CG 4.07Å; V45-E47 PolarHBondContact O-N 3.22Å; E47-T49 HydrophobicContact CB-CG2 3.83Å; E47-T49 WeakPolarHBondContact CB-OG1 2.84Å; E47-T49 HydrophobicContact CG-CG2 3.81Å; E47-T49 PolarHBondContact O-N 2.59Å; E47-T49 WeakPolarHBondContact OE1-CG2 3.46Å; E47-T49 PolarHBondContact OE2-OG1 3.26Å | ||
| 48 | Q | 42.5 | Very low | 52.2 | Low | 176 Ų | 176 | 106.7 Ų | 106.7 | 82% | 0.822 | 61% | 0.605 | S | S | * | * | trans | -67.5 | 48.5 | 159.9 | -69.5 | -166.3 | -5.9 | 0 | 0 | 106 | T46 G50 | T46-Q48 HydrophobicContact CG2-CG 4.05Å; T46-Q48 PolarHBondContact O-N 3Å; Q48-G50 PolarHBondContact O-N 3.29Å | ||
| 49 | T | 41.8 | Very low | 54.3 | Low | 70 Ų | 70 | 106.4 Ų | 106.4 | 43% | 0.429 | 61% | 0.605 | S | S | . | * | trans | -86.5 | 59.7 | 176.2 | 49.7 | 0 | 0 | 0 | 0 | 108.5 | E47 R106 | E47-T49 HydrophobicContact CB-CG2 3.83Å; E47-T49 WeakPolarHBondContact CB-OG1 2.84Å; E47-T49 HydrophobicContact CG-CG2 3.81Å; E47-T49 PolarHBondContact O-N 2.59Å; E47-T49 WeakPolarHBondContact OE1-CG2 3.46Å; E47-T49 PolarHBondContact OE2-OG1 3.26Å; T49-R106 PolarHBondContact O-NH2 2.97Å | ||
| 50 | G | 48.5 | Very low | 56.3 | Low | 16 Ų | 16 | 107.4 Ų | 107.4 | 17% | 0.165 | 59% | 0.591 | C | S | . | * | trans | 150.6 | 87.6 | 163.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q48 A52 R106 | Q48-G50 PolarHBondContact O-N 3.29Å; G50-A52 PolarHBondContact O-N 3.38Å; G50-R106 VanDerWaalsContact CA-NH2 3.25Å; G50-R106 VanDerWaalsContact O-CZ 3.26Å; G50-R106 PolarHBondContact O-NH1 3.36Å; G50-R106 PolarHBondContact O-NH2 3.35Å | ||
| 51 | S | 55.1 | Low | 58.4 | Low | 99 Ų | 99 | 99.2 Ų | 99.2 | 69% | 0.692 | 55% | 0.552 | S | S | * | * | trans | -51.1 | 94.2 | 152.1 | 50.9 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 52 | A | 61.1 | Low | 60.5 | Low | 34 Ų | 34 | 94.1 Ų | 94.1 | 28% | 0.281 | 53% | 0.527 | S | S | . | . | trans | -81 | 122.7 | 168 | 0 | 0 | 0 | 0 | 0 | 107.5 | G50 Q64 Y108 | G50-A52 PolarHBondContact O-N 3.38Å; A52-Q64 CarbonylContact C-O 3.49Å; A52-Q64 WeakPolarHBondContact CA-O 3.11Å; A52-Q64 WeakPolarHBondContact CB-O 3.24Å; A52-Y108 HydrophobicContact CB-CE1 3.56Å; A52-Y108 WeakPolarHBondContact CB-OH 3.24Å | ||
| 53 | Q | 77.1 | Confident | 62.8 | Low | 130 Ų | 130 | 86.6 Ų | 86.6 | 61% | 0.607 | 49% | 0.487 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.4 | 123.7 | 174.1 | -67.7 | -170.9 | -28.9 | 0 | 0 | 108.2 | V63 Q64 | Q53-V63 CarbonylContact O-C 3.52Å; Q53-V63 WeakPolarHBondContact O-CA 3.38Å; Q53-Q64 HydrophobicContact CB-CB 4.37Å; Q53-Q64 PolarHBondContact N-O 2.66Å; Q53-Q64 PolarHBondContact O-N 3.03Å |
| 54 | V | 74.7 | Confident | 65.4 | Low | 79 Ų | 79 | 84.3 Ų | 84.3 | 48% | 0.479 | 47% | 0.468 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 117 | 173.8 | -176.3 | 0 | 0 | 0 | 0 | 107.1 | F61 T62 V63 Y108 | V54-F61 HydrophobicContact CG1-CE2 3.95Å; V54-T62 WeakPolarHBondContact CA-O 3.44Å; V54-V63 HydrophobicContact CG1-CG2 4.33Å; V54-V63 HydrophobicContact CG2-CG1 4.41Å; V54-V63 HydrophobicContact CG2-CG2 4.33Å; V54-Y108 HydrophobicContact CG2-CD1 3.91Å; V54-Y108 HydrophobicContact CG2-CE1 4.3Å |
| 55 | C | 75.1 | Confident | 67.9 | Low | 61 Ų | 61 | 79 Ų | 79 | 41% | 0.412 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 127 | 175.1 | -164.6 | 0 | 0 | 0 | 0 | 108.6 | T62 | C55-T62 PolarHBondContact N-O 3.19Å; C55-T62 PolarHBondContact O-N 2.84Å; C55-T62 VanDerWaalsContact O-O 3.09Å |
| 56 | C | 70 | Confident | 70.7 | Confident | 74 Ų | 74 | 75.3 Ų | 75.3 | 50% | 0.5 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.2 | 105.9 | 173 | -53.6 | 0 | 0 | 0 | 0 | 107.4 | F61 | C56-F61 VanDerWaalsContact SG-CD2 3.59Å |
| 57 | D | 75.4 | Confident | 73.2 | Confident | 96 Ų | 96 | 70.6 Ų | 70.6 | 51% | 0.513 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | 166 | 171.5 | -66 | -55.5 | 0 | 0 | 0 | 109.7 | S59 R60 | D57-S59 PolarHBondContact O-N 3.45Å; D57-R60 PolarHBondContact N-O 2.75Å; D57-R60 PolarHBondContact O-N 2.87Å |
| 58 | H | 71.3 | Confident | 75.7 | Confident | 187 Ų | 187 | 70.5 Ų | 70.5 | 87% | 0.866 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -9.2 | 178.4 | -59.6 | -30.6 | 0 | 0 | 0 | 115.2 | M135 | H58-M135 VanDerWaalsContact O-SD 3.41Š|
| 59 | S | 80.7 | Confident | 77.9 | Confident | 65 Ų | 65 | 66.2 Ų | 66.2 | 46% | 0.455 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116 | -25.1 | -177.7 | -177.2 | 0 | 0 | 0 | 0 | 112.9 | D57 M135 | D57-S59 PolarHBondContact O-N 3.45Å; S59-M135 PolarHBondContact O-N 3.47Å |
| 60 | R | 86.2 | Confident | 80.1 | Confident | 137 Ų | 137 | 64.3 Ų | 64.3 | 52% | 0.517 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.4 | 139.7 | -167.7 | -165.7 | 176.9 | -66.3 | -171.7 | -0.9 | 112.6 | D57 A133 | D57-R60 PolarHBondContact N-O 2.75Å; D57-R60 PolarHBondContact O-N 2.87Å; R60-A133 WeakPolarHBondContact CA-O 3.47Å; R60-A133 VanDerWaalsContact CG-O 3.25Å; R60-A133 WeakPolarHBondContact CG-O 3.45Å |
| 61 | F | 89.6 | Confident | 81.9 | Confident | 2 Ų | 2 | 66.7 Ų | 66.7 | 1% | 0.009 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.5 | 132 | 165.6 | 171.3 | -107.7 | 0 | 0 | 0 | 109.7 | V54 C56 V63 V84 P111 V114 S132 A133 | V54-F61 HydrophobicContact CG1-CE2 3.95Å; C56-F61 VanDerWaalsContact SG-CD2 3.59Å; F61-V63 HydrophobicContact CE1-CG2 3.66Å; F61-V63 HydrophobicContact CE2-CG2 3.96Å; F61-V63 HydrophobicContact CZ-CG2 3.27Å; F61-V84 HydrophobicContact CE1-CG2 4.47Å; F61-P111 HydrophobicContact CD2-CG 4Å; F61-P111 HydrophobicContact CE2-CG 4.21Å; F61-V114 HydrophobicContact CB-CB 4.47Å; F61-V114 HydrophobicContact CB-CG1 3.88Å; F61-V114 HydrophobicContact CB-CG2 3.66Å; F61-V114 HydrophobicContact CD1-CG1 4.33Å; F61-V114 HydrophobicContact CG-CG1 4.34Å; F61-V114 HydrophobicContact CG-CG2 4.23Å; F61-S132 CarbonylContact O-C 3.53Å; F61-S132 WeakPolarHBondContact O-CA 3.36Å; F61-S132 WeakPolarHBondContact O-CB 3.34Å; F61-A133 PolarHBondContact N-O 3.3Å; F61-A133 PolarHBondContact O-N 3.26Å |
| 62 | T | 90.9 | Very high | 83.4 | Confident | 23 Ų | 23 | 66.3 Ų | 66.3 | 14% | 0.141 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.1 | 133.9 | 178.4 | -53.1 | 0 | 0 | 0 | 0 | 111.4 | V54 C55 Q64 I130 I131 | V54-T62 WeakPolarHBondContact CA-O 3.44Å; C55-T62 PolarHBondContact N-O 3.19Å; C55-T62 PolarHBondContact O-N 2.84Å; C55-T62 VanDerWaalsContact O-O 3.09Å; T62-Q64 HydrophobicContact CG2-CG 4.42Å; T62-I130 HydrophobicContact CG2-CG2 3.96Å; T62-I131 CarbonylContact C-O 3.54Å; T62-I131 VanDerWaalsContact CA-O 3.29Å; T62-I131 WeakPolarHBondContact CA-O 3.25Å |
| 63 | V | 91.6 | Very high | 84.8 | Confident | 0 Ų | 0 | 73.9 Ų | 73.9 | 0% | 0 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 130.7 | 172 | -178.7 | 0 | 0 | 0 | 0 | 108.7 | Q53 V54 F61 V65 Y108 I130 I131 | Q53-V63 CarbonylContact O-C 3.52Å; Q53-V63 WeakPolarHBondContact O-CA 3.38Å; V54-V63 HydrophobicContact CG1-CG2 4.33Å; V54-V63 HydrophobicContact CG2-CG1 4.41Å; V54-V63 HydrophobicContact CG2-CG2 4.33Å; F61-V63 HydrophobicContact CE1-CG2 3.66Å; F61-V63 HydrophobicContact CE2-CG2 3.96Å; F61-V63 HydrophobicContact CZ-CG2 3.27Å; V63-V65 HydrophobicContact CG1-CG2 3.88Å; V63-Y108 HydrophobicContact CG1-CD1 3.92Å; V63-Y108 HydrophobicContact CG1-CD2 3.75Å; V63-Y108 HydrophobicContact CG1-CE1 3.86Å; V63-Y108 HydrophobicContact CG1-CE2 3.67Å; V63-Y108 HydrophobicContact CG1-CG 3.86Å; V63-Y108 HydrophobicContact CG2-CG 4.23Å; V63-I130 CarbonylContact O-C 3.4Å; V63-I130 WeakPolarHBondContact O-CA 3.21Å; V63-I131 HydrophobicContact CB-CB 4.34Å; V63-I131 PolarHBondContact N-O 2.86Å; V63-I131 PolarHBondContact O-N 2.85Å |
| 64 | Q | 92.4 | Very high | 85.4 | Confident | 73 Ų | 73 | 69.8 Ų | 69.8 | 34% | 0.341 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 134.7 | 173.7 | -59.8 | -172.9 | -1.5 | 0 | 0 | 109.8 | A52 Q53 T62 I128 L129 I130 | A52-Q64 CarbonylContact C-O 3.49Å; A52-Q64 WeakPolarHBondContact CA-O 3.11Å; A52-Q64 WeakPolarHBondContact CB-O 3.24Å; Q53-Q64 HydrophobicContact CB-CB 4.37Å; Q53-Q64 PolarHBondContact N-O 2.66Å; Q53-Q64 PolarHBondContact O-N 3.03Å; T62-Q64 HydrophobicContact CG2-CG 4.42Å; Q64-I128 HydrophobicContact CB-CG2 4.01Å; Q64-L129 CarbonylContact C-O 3.6Å; Q64-L129 WeakPolarHBondContact CA-O 3.41Å; Q64-I130 HydrophobicContact CG-CG1 4.38Å |
| 65 | V | 92.6 | Very high | 86.2 | Confident | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.6 | 123 | -175.7 | -167.8 | 0 | 0 | 0 | 0 | 109.3 | V63 V67 F104 R106 Y108 L129 | V63-V65 HydrophobicContact CG1-CG2 3.88Å; V65-V67 HydrophobicContact CB-CG1 4.42Å; V65-V67 HydrophobicContact CG1-CG1 4.16Å; V65-V67 PolarHBondContact O-N 3Å; V65-F104 HydrophobicContact CG1-CE2 4.41Å; V65-R106 VanDerWaalsContact CG1-NH1 3.28Å; V65-Y108 HydrophobicContact CG2-CE2 3.94Å; V65-Y108 VanDerWaalsContact CG2-OH 3.3Å; V65-Y108 WeakPolarHBondContact CG2-OH 3.38Å; V65-L129 HydrophobicContact CB-CB 4.28Å; V65-L129 PolarHBondContact N-O 2.9Å; V65-L129 PolarHBondContact O-N 2.84Å |
| 66 | D | 91.8 | Very high | 87.2 | Confident | 34 Ų | 34 | 67.8 Ų | 67.8 | 18% | 0.182 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.4 | 120.2 | 170.2 | -173.6 | -46.8 | 0 | 0 | 0 | 109.7 | K68 I128 | D66-K68 WeakPolarHBondContact OD1-CD 3.43Å; D66-K68 WeakPolarHBondContact OD1-CE 3.02Å; D66-K68 VanDerWaalsContact OD1-CG 3.27Å; D66-K68 WeakPolarHBondContact OD1-CG 3.38Å; D66-K68 PolarHBondContact OD1-N 2.83Å; D66-K68 IonicContact OD1-NZ 3.77Å; D66-K68 WeakPolarHBondContact OD2-CE 3.01Å; D66-K68 IonicContact OD2-NZ 2.75Å; D66-K68 PolarHBondContact OD2-NZ 2.82Å; D66-I128 HydrophobicContact CB-CD1 4.19Å |
| 67 | V | 92.3 | Very high | 88.3 | Confident | 3 Ų | 3 | 66.4 Ų | 66.4 | 2% | 0.018 | 33% | 0.329 | C | S | . | . | trans | -130.6 | 18.7 | -179.3 | -63.1 | 0 | 0 | 0 | 0 | 112.1 | V65 H69 F70 L75 F104 V123 G127 L129 | V65-V67 HydrophobicContact CB-CG1 4.42Å; V65-V67 HydrophobicContact CG1-CG1 4.16Å; V65-V67 PolarHBondContact O-N 3Å; V67-H69 PolarHBondContact O-N 3.15Å; V67-F70 PolarHBondContact O-N 3.37Å; V67-L75 HydrophobicContact CB-CD1 3.87Å; V67-L75 HydrophobicContact CB-CD2 4.13Å; V67-L75 HydrophobicContact CG1-CD1 4.07Å; V67-L75 HydrophobicContact CG1-CD2 3.91Å; V67-L75 HydrophobicContact CG2-CD1 3.8Å; V67-F104 HydrophobicContact CG1-CE1 4.3Å; V67-F104 HydrophobicContact CG1-CZ 3.88Å; V67-V123 HydrophobicContact CG2-CG1 4.13Å; V67-G127 CarbonylContact C-O 3.6Å; V67-G127 VanDerWaalsContact CG2-O 3.24Å; V67-G127 WeakPolarHBondContact CG2-O 3.3Å; V67-G127 PolarHBondContact N-O 2.94Å; V67-L129 HydrophobicContact CG1-CB 3.91Å; V67-L129 HydrophobicContact CG1-CD2 4.48Å; V67-L129 HydrophobicContact CG2-CB 3.88Å | ||
| 68 | K | 90 | Very high | 89.2 | Confident | 121 Ų | 121 | 66.2 Ų | 66.2 | 53% | 0.526 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.8 | -16.2 | -173.7 | 73.1 | -161.1 | 164 | -153.2 | 0 | 115.2 | D66 G127 | D66-K68 WeakPolarHBondContact OD1-CD 3.43Å; D66-K68 WeakPolarHBondContact OD1-CE 3.02Å; D66-K68 VanDerWaalsContact OD1-CG 3.27Å; D66-K68 WeakPolarHBondContact OD1-CG 3.38Å; D66-K68 PolarHBondContact OD1-N 2.83Å; D66-K68 IonicContact OD1-NZ 3.77Å; D66-K68 WeakPolarHBondContact OD2-CE 3.01Å; D66-K68 IonicContact OD2-NZ 2.75Å; D66-K68 PolarHBondContact OD2-NZ 2.82Å; K68-G127 PolarHBondContact N-O 3.03Å |
| 69 | H | 87.2 | Confident | 90.2 | Very high | 86 Ų | 86 | 60.1 Ų | 60.1 | 40% | 0.398 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.6 | 5.7 | 178.2 | -59.2 | -56.6 | 0 | 0 | 0 | 113.7 | V67 | V67-H69 PolarHBondContact O-N 3.15Š|
| 70 | F | 88.7 | Confident | 90.7 | Very high | 31 Ų | 31 | 60.7 Ų | 60.7 | 14% | 0.136 | 30% | 0.301 | C | S | . | . | S | Bend | trans | -126.9 | 144.4 | -177.1 | -63 | -90.5 | 0 | 0 | 0 | 110.5 | V67 L75 H90 R102 F104 | V67-F70 PolarHBondContact O-N 3.37Å; F70-L75 HydrophobicContact CB-CD2 3.75Å; F70-L75 HydrophobicContact CB-CG 4.16Å; F70-L75 HydrophobicContact CG-CD2 4.09Å; F70-H90 HydrophobicContact CD1-CB 3.85Å; F70-H90 HydrophobicContact CE1-CB 3.81Å; F70-R102 HydrophobicContact CE1-CB 4.09Å; F70-R102 HydrophobicContact CZ-CB 3.75Å; F70-F104 HydrophobicContact CD1-CE1 4.38Å; F70-F104 HydrophobicContact CD2-CD1 4.07Å; F70-F104 AromaticContact CD2-CE1 3.69Å; F70-F104 HydrophobicContact CD2-CE1 3.69Å; F70-F104 HydrophobicContact CE1-CD1 4.03Å; F70-F104 HydrophobicContact CE1-CE1 4.25Å; F70-F104 AromaticContact CE2-CD1 3.43Å; F70-F104 HydrophobicContact CE2-CD1 3.43Å; F70-F104 VanDerWaalsContact CE2-CD1 3.43Å; F70-F104 AromaticContact CE2-CE1 3.55Å; F70-F104 HydrophobicContact CE2-CE1 3.55Å; F70-F104 HydrophobicContact CG-CE1 4.13Å; F70-F104 AromaticContact CZ-CD1 3.42Å; F70-F104 HydrophobicContact CZ-CD1 3.42Å; F70-F104 VanDerWaalsContact CZ-CD1 3.42Å; F70-F104 AromaticContact CZ-CE1 3.87Å; F70-F104 HydrophobicContact CZ-CE1 3.87Å |
| 71 | N | 86.7 | Confident | 90.9 | Very high | 66 Ų | 66 | 57.1 Ų | 57.1 | 35% | 0.353 | 31% | 0.306 | S | S | . | . | trans | -78.2 | 151.5 | 168.3 | -58.6 | -61.4 | 0 | 0 | 0 | 109.5 | E73 E74 | N71-E73 PolarHBondContact O-N 2.82Å; N71-E73 VanDerWaalsContact O-N 3.11Å; N71-E74 HydrophobicContact CB-CG 4.19Å; N71-E74 PolarHBondContact N-OE2 3.29Å; N71-E74 PolarHBondContact ND2-OE1 3.07Å; N71-E74 WeakPolarHBondContact O-CB 3.42Å; N71-E74 PolarHBondContact O-N 2.92Å | ||
| 72 | P | 86.3 | Confident | 91 | Very high | 90 Ų | 90 | 62.1 Ų | 62.1 | 58% | 0.584 | 33% | 0.333 | S | S | * | . | G | 310 helix | trans | -53.4 | -34.3 | 176.8 | -27.1 | 34.8 | 0 | 0 | 0 | 113.6 | E74 L75 | P72-E74 PolarHBondContact O-N 3.02Å; P72-L75 PolarHBondContact O-N 2.82Å |
| 73 | E | 89.4 | Confident | 91.1 | Very high | 194 Ų | 194 | 63.9 Ų | 63.9 | 91% | 0.907 | 34% | 0.339 | S | S | * | . | G | 310 helix | trans | -69 | -18.7 | 178.4 | -58.7 | 177.9 | -168 | 0 | 0 | 113.9 | N71 | N71-E73 PolarHBondContact O-N 2.82Å; N71-E73 VanDerWaalsContact O-N 3.11Å |
| 74 | E | 90.1 | Very high | 91.2 | Very high | 44 Ų | 44 | 63.9 Ų | 63.9 | 21% | 0.206 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -92.9 | -6.2 | 179.7 | -64.6 | 167.8 | 179.1 | 0 | 0 | 112.5 | N71 P72 G88 K89 H90 | N71-E74 HydrophobicContact CB-CG 4.19Å; N71-E74 PolarHBondContact N-OE2 3.29Å; N71-E74 PolarHBondContact ND2-OE1 3.07Å; N71-E74 WeakPolarHBondContact O-CB 3.42Å; N71-E74 PolarHBondContact O-N 2.92Å; P72-E74 PolarHBondContact O-N 3.02Å; E74-G88 WeakPolarHBondContact O-CA 3.07Å; E74-K89 WeakPolarHBondContact CB-O 3.32Å; E74-K89 PolarHBondContact O-N 2.82Å; E74-H90 IonicContact OE1-CE1 3.94Å; E74-H90 IonicContact OE1-CG 3.99Å; E74-H90 IonicContact OE1-ND1 2.92Å; E74-H90 PolarHBondContact OE1-ND1 3.29Å; E74-H90 IonicContact OE2-CE1 3.52Å; E74-H90 IonicContact OE2-CG 3.57Å; E74-H90 IonicContact OE2-ND1 2.82Å; E74-H90 PolarHBondContact OE2-ND1 2.9Å |
| 75 | L | 92.9 | Very high | 91.3 | Very high | 28 Ų | 28 | 62 Ų | 62 | 15% | 0.147 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 143.5 | -178.9 | -62.1 | 175 | 0 | 0 | 0 | 110.8 | V67 F70 P72 Q87 F104 V123 | V67-L75 HydrophobicContact CB-CD1 3.87Å; V67-L75 HydrophobicContact CB-CD2 4.13Å; V67-L75 HydrophobicContact CG1-CD1 4.07Å; V67-L75 HydrophobicContact CG1-CD2 3.91Å; V67-L75 HydrophobicContact CG2-CD1 3.8Å; F70-L75 HydrophobicContact CB-CD2 3.75Å; F70-L75 HydrophobicContact CB-CG 4.16Å; F70-L75 HydrophobicContact CG-CD2 4.09Å; P72-L75 PolarHBondContact O-N 2.82Å; L75-Q87 CarbonylContact C-O 3.47Å; L75-Q87 WeakPolarHBondContact CA-O 3.25Å; L75-F104 HydrophobicContact CD2-CE1 3.89Å; L75-F104 HydrophobicContact CD2-CZ 3.86Å; L75-V123 HydrophobicContact CD1-CG2 4.18Å |
| 76 | M | 94.3 | Very high | 91.4 | Very high | 70 Ų | 70 | 62 Ų | 62 | 35% | 0.345 | 33% | 0.33 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.9 | 119.5 | 178.3 | -178.7 | 168.1 | 60.1 | 0 | 0 | 109.5 | K78 V86 Q87 | M76-K78 HydrophobicContact CG-CD 4.29Å; M76-K78 HydrophobicContact CG-CG 4.13Å; M76-K78 HydrophobicContact SD-CD 4.28Å; M76-K78 WeakPolarHBondContact SD-CE 3.36Å; M76-K78 PolarHBondContact SD-NZ 3.22Å; M76-V86 WeakPolarHBondContact O-CA 3.48Å; M76-Q87 HydrophobicContact CB-CB 4.37Å; M76-Q87 HydrophobicContact CE-CB 4.14Å; M76-Q87 HydrophobicContact CE-CG 4.21Å; M76-Q87 PolarHBondContact N-O 2.77Å; M76-Q87 PolarHBondContact O-N 2.84Å |
| 77 | V | 94.3 | Very high | 91.5 | Very high | 45 Ų | 45 | 61.9 Ų | 61.9 | 27% | 0.273 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.6 | 131.9 | 175.1 | -176.5 | 0 | 0 | 0 | 0 | 108.5 | V84 E85 V86 L129 I131 | V77-V84 HydrophobicContact CG1-CG1 3.88Å; V77-E85 CarbonylContact C-O 3.49Å; V77-E85 WeakPolarHBondContact CA-O 3.44Å; V77-V86 HydrophobicContact CG2-CG1 4.49Å; V77-V86 HydrophobicContact CG2-CG2 4.49Å; V77-L129 HydrophobicContact CG2-CD1 4.45Å; V77-L129 HydrophobicContact CG2-CD2 3.86Å; V77-I131 HydrophobicContact CG1-CD1 3.87Å; V77-I131 HydrophobicContact CG2-CD1 4.2Å |
| 78 | K | 93.4 | Very high | 91.5 | Very high | 92 Ų | 92 | 61.8 Ų | 61.8 | 40% | 0.4 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.2 | 147.7 | 179.9 | -69.6 | -179.7 | 172.7 | 167.8 | 0 | 110.6 | M76 V84 E85 | M76-K78 HydrophobicContact CG-CD 4.29Å; M76-K78 HydrophobicContact CG-CG 4.13Å; M76-K78 HydrophobicContact SD-CD 4.28Å; M76-K78 WeakPolarHBondContact SD-CE 3.36Å; M76-K78 PolarHBondContact SD-NZ 3.22Å; K78-V84 CarbonylContact O-C 3.56Å; K78-V84 WeakPolarHBondContact O-CA 3.45Å; K78-E85 HydrophobicContact CB-CB 4.48Å; K78-E85 PolarHBondContact N-O 2.78Å; K78-E85 PolarHBondContact O-N 2.82Å |
| 79 | V | 93.3 | Very high | 91.6 | Very high | 59 Ų | 59 | 61 Ų | 61 | 36% | 0.358 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | 123.6 | 168 | -177 | 0 | 0 | 0 | 0 | 108 | F83 I110 L119 | V79-F83 WeakPolarHBondContact CA-O 3.27Å; V79-I110 HydrophobicContact CG1-CD1 3.97Å; V79-L119 HydrophobicContact CG2-CD2 3.74Å |
| 80 | T | 91.5 | Very high | 91.5 | Very high | 77 Ų | 77 | 57.7 Ų | 57.7 | 47% | 0.472 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 103.7 | 179.1 | -53.5 | 0 | 0 | 0 | 0 | 108.5 | D82 F83 | T80-D82 PolarHBondContact O-N 2.94Å; T80-F83 PolarHBondContact N-O 2.91Å; T80-F83 PolarHBondContact O-N 3.2Å |
| 81 | G | 90.3 | Very high | 90.7 | Very high | 62 Ų | 62 | 64.6 Ų | 64.6 | 64% | 0.639 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.3 | -125.2 | -172.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | F83 | G81-F83 VanDerWaalsContact C-N 3.28Å; G81-F83 PolarHBondContact O-N 2.83Å |
| 82 | D | 91.5 | Very high | 89.8 | Confident | 107 Ų | 107 | 67.4 Ų | 67.4 | 57% | 0.572 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.1 | 25 | -179.8 | -48.6 | -51.8 | 0 | 0 | 0 | 113 | T80 R109 I110 | T80-D82 PolarHBondContact O-N 2.94Å; D82-R109 CarbonylContact O-C 3.49Å; D82-R109 WeakPolarHBondContact O-CA 3.41Å; D82-I110 PolarHBondContact O-N 3.31Å |
| 83 | F | 92.4 | Very high | 88.7 | Confident | 59 Ų | 59 | 68.1 Ų | 68.1 | 26% | 0.259 | 34% | 0.344 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 140.1 | -177.2 | -64.6 | -87.3 | 0 | 0 | 0 | 112.8 | V79 T80 G81 R107 Y108 R109 | V79-F83 WeakPolarHBondContact CA-O 3.27Å; T80-F83 PolarHBondContact N-O 2.91Å; T80-F83 PolarHBondContact O-N 3.2Å; G81-F83 VanDerWaalsContact C-N 3.28Å; G81-F83 PolarHBondContact O-N 2.83Å; F83-R107 HydrophobicContact CB-CG 3.57Å; F83-R107 HydrophobicContact CD1-CG 3.6Å; F83-R107 HydrophobicContact CG-CG 3.8Å; F83-Y108 CarbonylContact C-O 3.57Å; F83-Y108 VanDerWaalsContact CA-O 3.25Å; F83-Y108 WeakPolarHBondContact CA-O 3.33Å; F83-R109 HydrophobicContact CD1-CB 3.99Å; F83-R109 HydrophobicContact CD1-CG 4.41Å; F83-R109 HydrophobicContact CE1-CB 3.74Å; F83-R109 HydrophobicContact CE1-CG 4.01Å; F83-R109 HydrophobicContact CZ-CG 4.37Å |
| 84 | V | 93.6 | Very high | 87.3 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93 | 121.7 | 161.8 | -178.5 | 0 | 0 | 0 | 0 | 108.6 | F61 V77 K78 V86 R107 Y108 I110 L119 I131 | F61-V84 HydrophobicContact CE1-CG2 4.47Å; V77-V84 HydrophobicContact CG1-CG1 3.88Å; K78-V84 CarbonylContact O-C 3.56Å; K78-V84 WeakPolarHBondContact O-CA 3.45Å; V84-V86 HydrophobicContact CG1-CG2 4.38Å; V84-R107 CarbonylContact O-C 3.53Å; V84-R107 WeakPolarHBondContact O-CA 3.49Å; V84-Y108 PolarHBondContact N-O 3.19Å; V84-Y108 PolarHBondContact O-N 3.38Å; V84-I110 HydrophobicContact CG2-CD1 3.68Å; V84-I110 HydrophobicContact CG2-CG1 3.69Å; V84-L119 HydrophobicContact CG2-CD1 4Å; V84-L119 HydrophobicContact CG2-CD2 4.28Å; V84-I131 HydrophobicContact CG1-CD1 3.77Å; V84-I131 HydrophobicContact CG1-CG2 4.25Å |
| 85 | E | 94.1 | Very high | 85.7 | Confident | 34 Ų | 34 | 71.3 Ų | 71.3 | 16% | 0.159 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.4 | 128.5 | 173 | -71.4 | -176.2 | -163.9 | 0 | 0 | 110.8 | V77 K78 R106 R107 | V77-E85 CarbonylContact C-O 3.49Å; V77-E85 WeakPolarHBondContact CA-O 3.44Å; K78-E85 HydrophobicContact CB-CB 4.48Å; K78-E85 PolarHBondContact N-O 2.78Å; K78-E85 PolarHBondContact O-N 2.82Å; E85-R106 CarbonylContact C-O 3.57Å; E85-R106 WeakPolarHBondContact CA-O 3.44Å; E85-R107 HydrophobicContact CG-CB 4.18Å; E85-R107 HydrophobicContact CG-CG 3.68Å |
| 86 | V | 94.9 | Very high | 84.3 | Confident | 0 Ų | 0 | 74.6 Ų | 74.6 | 0% | 0 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.3 | 121.1 | 174.6 | -172.1 | 0 | 0 | 0 | 0 | 108.3 | M76 V77 V84 F104 N105 R106 Y108 L129 I131 | M76-V86 WeakPolarHBondContact O-CA 3.48Å; V77-V86 HydrophobicContact CG2-CG1 4.49Å; V77-V86 HydrophobicContact CG2-CG2 4.49Å; V84-V86 HydrophobicContact CG1-CG2 4.38Å; V86-F104 HydrophobicContact CB-CE2 4.09Å; V86-F104 HydrophobicContact CG1-CE2 3.59Å; V86-F104 HydrophobicContact CG1-CZ 3.81Å; V86-N105 CarbonylContact O-C 3.58Å; V86-N105 WeakPolarHBondContact O-CA 3.44Å; V86-R106 PolarHBondContact N-O 2.68Å; V86-R106 PolarHBondContact O-N 3.4Å; V86-Y108 HydrophobicContact CG2-CD2 4.38Å; V86-Y108 HydrophobicContact CG2-CE2 3.94Å; V86-L129 HydrophobicContact CG1-CD2 3.48Å; V86-L129 VanDerWaalsContact CG1-CD2 3.48Å; V86-L129 HydrophobicContact CG2-CD2 4.28Å; V86-I131 HydrophobicContact CG2-CD1 3.45Å; V86-I131 VanDerWaalsContact CG2-CD1 3.45Å |
| 87 | Q | 94.1 | Very high | 82.7 | Confident | 32 Ų | 32 | 77.3 Ų | 77.3 | 15% | 0.15 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 132.5 | 178.3 | -47.8 | -169.7 | 3.3 | 0 | 0 | 109.1 | L75 M76 F104 N105 | L75-Q87 CarbonylContact C-O 3.47Å; L75-Q87 WeakPolarHBondContact CA-O 3.25Å; M76-Q87 HydrophobicContact CB-CB 4.37Å; M76-Q87 HydrophobicContact CE-CB 4.14Å; M76-Q87 HydrophobicContact CE-CG 4.21Å; M76-Q87 PolarHBondContact N-O 2.77Å; M76-Q87 PolarHBondContact O-N 2.84Å; Q87-F104 WeakPolarHBondContact CA-O 3.36Å; Q87-N105 WeakPolarHBondContact CG-ND2 3.39Å; Q87-N105 PolarHBondContact NE2-ND2 2.82Å |
| 88 | G | 93.5 | Very high | 81.3 | Confident | 0 Ų | 0 | 77.1 Ų | 77.1 | 0% | 0 | 43% | 0.433 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 132 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | E74 Q103 F104 | E74-G88 WeakPolarHBondContact O-CA 3.07Å; G88-Q103 CarbonylContact O-C 3.52Å; G88-Q103 VanDerWaalsContact O-CA 3.24Å; G88-Q103 WeakPolarHBondContact O-CA 3.48Å; G88-F104 VanDerWaalsContact CA-CE1 3.47Å; G88-F104 PolarHBondContact N-O 2.82Å; G88-F104 PolarHBondContact O-N 2.8Å |
| 89 | K | 90.4 | Very high | 80 | Confident | 105 Ų | 105 | 77.1 Ų | 77.1 | 46% | 0.457 | 44% | 0.437 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 96.8 | 178.7 | -70.8 | -179.2 | -179.1 | 177.8 | 0 | 110.4 | E74 Q103 | E74-K89 WeakPolarHBondContact CB-O 3.32Å; E74-K89 PolarHBondContact O-N 2.82Å; K89-Q103 HydrophobicContact CG-CG 3.97Å |
| 90 | H | 86.1 | Confident | 79 | Confident | 17 Ų | 17 | 76.9 Ų | 76.9 | 8% | 0.079 | 44% | 0.436 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.9 | 109.3 | 172.3 | -170.8 | 71.8 | 0 | 0 | 0 | 109.1 | F70 E74 R102 | F70-H90 HydrophobicContact CD1-CB 3.85Å; F70-H90 HydrophobicContact CE1-CB 3.81Å; E74-H90 IonicContact OE1-CE1 3.94Å; E74-H90 IonicContact OE1-CG 3.99Å; E74-H90 IonicContact OE1-ND1 2.92Å; E74-H90 PolarHBondContact OE1-ND1 3.29Å; E74-H90 IonicContact OE2-CE1 3.52Å; E74-H90 IonicContact OE2-CG 3.57Å; E74-H90 IonicContact OE2-ND1 2.82Å; E74-H90 PolarHBondContact OE2-ND1 2.9Å; H90-R102 HydrophobicContact CB-CB 4.16Å; H90-R102 PolarHBondContact N-O 2.82Å; H90-R102 PolarHBondContact O-N 2.8Å; H90-R102 VanDerWaalsContact O-N 3.15Å |
| 91 | K | 72.6 | Confident | 78.5 | Confident | 176 Ų | 176 | 77.4 Ų | 77.4 | 77% | 0.765 | 44% | 0.439 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.4 | 140.6 | 172.8 | -72.8 | -173.3 | 176.9 | -175.8 | 0 | 109.7 | K93 | K91-K93 PolarHBondContact O-N 2.92Å |
| 92 | E | 66.1 | Low | 78.3 | Confident | 124 Ų | 124 | 79.6 Ų | 79.6 | 58% | 0.579 | 43% | 0.428 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -1.9 | 97.1 | 164.2 | -69.8 | -166.2 | 178.9 | 0 | 0 | 116.4 | L99 | E92-L99 HydrophobicContact CB-CD1 3.72Å; E92-L99 HydrophobicContact CB-CG 4.26Å; E92-L99 HydrophobicContact CG-CD1 3.41Å; E92-L99 VanDerWaalsContact CG-CD1 3.41Å; E92-L99 HydrophobicContact CG-CD2 3.62Å; E92-L99 HydrophobicContact CG-CG 3.53Å; E92-L99 WeakPolarHBondContact OE1-CD2 3.35Å; E92-L99 WeakPolarHBondContact OE2-CD1 3.34Å |
| 93 | K | 65.1 | Low | 78.2 | Confident | 105 Ų | 105 | 81 Ų | 81 | 46% | 0.457 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 129.4 | 152.8 | -80.2 | -172.6 | 178.7 | 179.1 | 0 | 108.9 | K91 D95 | K91-K93 PolarHBondContact O-N 2.92Å; K93-D95 VanDerWaalsContact C-N 3.3Å; K93-D95 PolarHBondContact O-N 3.34Å |
| 94 | K | 58.1 | Low | 78.1 | Confident | 193 Ų | 193 | 79.5 Ų | 79.5 | 84% | 0.839 | 42% | 0.424 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73.9 | 87.5 | 168.3 | -82.4 | -173.7 | 175.6 | -179.5 | 0 | 108.3 | ||
| 95 | D | 57.9 | Low | 78.1 | Confident | 112 Ų | 112 | 83.7 Ų | 83.7 | 60% | 0.599 | 45% | 0.447 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.3 | 108.2 | 164.4 | -75.6 | -23.3 | 0 | 0 | 0 | 107.5 | K93 S97 G98 | K93-D95 VanDerWaalsContact C-N 3.3Å; K93-D95 PolarHBondContact O-N 3.34Å; D95-S97 PolarHBondContact O-N 3.11Å; D95-G98 PolarHBondContact O-N 2.83Å |
| 96 | G | 63.2 | Low | 77.9 | Confident | 97 Ų | 97 | 84.4 Ų | 84.4 | 100% | 1 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 32.5 | -45 | 164.4 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||
| 97 | S | 61.6 | Low | 77.8 | Confident | 127 Ų | 127 | 91.5 Ų | 91.5 | 89% | 0.888 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -125.5 | 1.2 | -173.9 | 59.4 | 0 | 0 | 0 | 0 | 115 | D95 | D95-S97 PolarHBondContact O-N 3.11Š|
| 98 | G | 63 | Low | 77.7 | Confident | 41 Ų | 41 | 91.1 Ų | 91.1 | 42% | 0.423 | 47% | 0.472 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -179.1 | 179.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | D95 | D95-G98 PolarHBondContact O-N 2.83Å |
| 99 | L | 67.1 | Low | 77.6 | Confident | 93 Ų | 93 | 99.2 Ų | 99.2 | 49% | 0.487 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.5 | 114.5 | 178.5 | -169.7 | 86.4 | 0 | 0 | 0 | 109 | E92 | E92-L99 HydrophobicContact CB-CD1 3.72Å; E92-L99 HydrophobicContact CB-CG 4.26Å; E92-L99 HydrophobicContact CG-CD1 3.41Å; E92-L99 VanDerWaalsContact CG-CD1 3.41Å; E92-L99 HydrophobicContact CG-CD2 3.62Å; E92-L99 HydrophobicContact CG-CG 3.53Å; E92-L99 WeakPolarHBondContact OE1-CD2 3.35Å; E92-L99 WeakPolarHBondContact OE2-CD1 3.34Å |
| 100 | V | 72 | Confident | 77.6 | Confident | 54 Ų | 54 | 94.8 Ų | 94.8 | 33% | 0.327 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 119.4 | 177.2 | -178.7 | 0 | 0 | 0 | 0 | 109.4 | R102 | V100-R102 HydrophobicContact CG1-CG 3.94Å |
| 101 | T | 81.1 | Confident | 77.7 | Confident | 88 Ų | 88 | 96.3 Ų | 96.3 | 54% | 0.54 | 50% | 0.495 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 129.4 | 168.4 | -63.8 | 0 | 0 | 0 | 0 | 107.7 | ||
| 102 | R | 85.4 | Confident | 78.4 | Confident | 108 Ų | 108 | 96.7 Ų | 96.7 | 41% | 0.408 | 50% | 0.5 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 136 | 176 | -62.8 | -179.9 | 179.4 | 117 | -0.2 | 109.3 | F70 H90 V100 | F70-R102 HydrophobicContact CE1-CB 4.09Å; F70-R102 HydrophobicContact CZ-CB 3.75Å; H90-R102 HydrophobicContact CB-CB 4.16Å; H90-R102 PolarHBondContact N-O 2.82Å; H90-R102 PolarHBondContact O-N 2.8Å; H90-R102 VanDerWaalsContact O-N 3.15Å; V100-R102 HydrophobicContact CG1-CG 3.94Å |
| 103 | Q | 89.8 | Confident | 79.4 | Confident | 135 Ų | 135 | 92.3 Ų | 92.3 | 63% | 0.631 | 49% | 0.488 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -142.4 | 137.8 | 174.2 | 175.3 | 173.9 | -24.8 | 0 | 0 | 109.8 | G88 K89 | G88-Q103 CarbonylContact O-C 3.52Å; G88-Q103 VanDerWaalsContact O-CA 3.24Å; G88-Q103 WeakPolarHBondContact O-CA 3.48Å; K89-Q103 HydrophobicContact CG-CG 3.97Å |
| 104 | F | 91.2 | Very high | 80.7 | Confident | 29 Ų | 29 | 87.9 Ų | 87.9 | 13% | 0.127 | 47% | 0.47 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.9 | 154.2 | 168.1 | 76.9 | -90.1 | 0 | 0 | 0 | 111.6 | V65 V67 F70 L75 V86 Q87 G88 R106 | V65-F104 HydrophobicContact CG1-CE2 4.41Å; V67-F104 HydrophobicContact CG1-CE1 4.3Å; V67-F104 HydrophobicContact CG1-CZ 3.88Å; F70-F104 HydrophobicContact CD1-CE1 4.38Å; F70-F104 HydrophobicContact CD2-CD1 4.07Å; F70-F104 AromaticContact CD2-CE1 3.69Å; F70-F104 HydrophobicContact CD2-CE1 3.69Å; F70-F104 HydrophobicContact CE1-CD1 4.03Å; F70-F104 HydrophobicContact CE1-CE1 4.25Å; F70-F104 AromaticContact CE2-CD1 3.43Å; F70-F104 HydrophobicContact CE2-CD1 3.43Å; F70-F104 VanDerWaalsContact CE2-CD1 3.43Å; F70-F104 AromaticContact CE2-CE1 3.55Å; F70-F104 HydrophobicContact CE2-CE1 3.55Å; F70-F104 HydrophobicContact CG-CE1 4.13Å; F70-F104 AromaticContact CZ-CD1 3.42Å; F70-F104 HydrophobicContact CZ-CD1 3.42Å; F70-F104 VanDerWaalsContact CZ-CD1 3.42Å; F70-F104 AromaticContact CZ-CE1 3.87Å; F70-F104 HydrophobicContact CZ-CE1 3.87Å; L75-F104 HydrophobicContact CD2-CE1 3.89Å; L75-F104 HydrophobicContact CD2-CZ 3.86Å; V86-F104 HydrophobicContact CB-CE2 4.09Å; V86-F104 HydrophobicContact CG1-CE2 3.59Å; V86-F104 HydrophobicContact CG1-CZ 3.81Å; Q87-F104 WeakPolarHBondContact CA-O 3.36Å; G88-F104 VanDerWaalsContact CA-CE1 3.47Å; G88-F104 PolarHBondContact N-O 2.82Å; G88-F104 PolarHBondContact O-N 2.8Å; F104-R106 HydrophobicContact CD2-CG 4.1Å |
| 105 | N | 92.3 | Very high | 82.2 | Confident | 88 Ų | 88 | 81 Ų | 81 | 47% | 0.471 | 44% | 0.442 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.4 | 122.5 | 166.3 | -179.5 | -67.9 | 0 | 0 | 0 | 107 | V86 Q87 | V86-N105 CarbonylContact O-C 3.58Å; V86-N105 WeakPolarHBondContact O-CA 3.44Å; Q87-N105 WeakPolarHBondContact CG-ND2 3.39Å; Q87-N105 PolarHBondContact NE2-ND2 2.82Å |
| 106 | R | 91 | Very high | 83.7 | Confident | 48 Ų | 48 | 77.7 Ų | 77.7 | 18% | 0.181 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.6 | 142.2 | 174.8 | -73.1 | -168.5 | -179.6 | 130.8 | 15.1 | 109.9 | T49 G50 V65 E85 V86 F104 Y108 | T49-R106 PolarHBondContact O-NH2 2.97Å; G50-R106 VanDerWaalsContact CA-NH2 3.25Å; G50-R106 VanDerWaalsContact O-CZ 3.26Å; G50-R106 PolarHBondContact O-NH1 3.36Å; G50-R106 PolarHBondContact O-NH2 3.35Å; V65-R106 VanDerWaalsContact CG1-NH1 3.28Å; E85-R106 CarbonylContact C-O 3.57Å; E85-R106 WeakPolarHBondContact CA-O 3.44Å; V86-R106 PolarHBondContact N-O 2.68Å; V86-R106 PolarHBondContact O-N 3.4Å; F104-R106 HydrophobicContact CD2-CG 4.1Å; R106-Y108 HydrophobicContact CB-CE2 3.88Å; R106-Y108 WeakPolarHBondContact CD-OH 3.23Å |
| 107 | R | 92.7 | Very high | 84.9 | Confident | 149 Ų | 149 | 80.8 Ų | 80.8 | 56% | 0.562 | 42% | 0.418 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 128.1 | -179.9 | -166.9 | 172.1 | 74.3 | -174.5 | 2.6 | 110.1 | F83 V84 E85 | F83-R107 HydrophobicContact CB-CG 3.57Å; F83-R107 HydrophobicContact CD1-CG 3.6Å; F83-R107 HydrophobicContact CG-CG 3.8Å; V84-R107 CarbonylContact O-C 3.53Å; V84-R107 WeakPolarHBondContact O-CA 3.49Å; E85-R107 HydrophobicContact CG-CB 4.18Å; E85-R107 HydrophobicContact CG-CG 3.68Å |
| 108 | Y | 91.1 | Very high | 86.3 | Confident | 24 Ų | 24 | 76.5 Ų | 76.5 | 9% | 0.094 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.9 | 129.3 | -179.6 | -52.8 | -80.3 | 0 | 0 | 0 | 109.3 | A52 V54 V63 V65 F83 V84 V86 R106 | A52-Y108 HydrophobicContact CB-CE1 3.56Å; A52-Y108 WeakPolarHBondContact CB-OH 3.24Å; V54-Y108 HydrophobicContact CG2-CD1 3.91Å; V54-Y108 HydrophobicContact CG2-CE1 4.3Å; V63-Y108 HydrophobicContact CG1-CD1 3.92Å; V63-Y108 HydrophobicContact CG1-CD2 3.75Å; V63-Y108 HydrophobicContact CG1-CE1 3.86Å; V63-Y108 HydrophobicContact CG1-CE2 3.67Å; V63-Y108 HydrophobicContact CG1-CG 3.86Å; V63-Y108 HydrophobicContact CG2-CG 4.23Å; V65-Y108 HydrophobicContact CG2-CE2 3.94Å; V65-Y108 VanDerWaalsContact CG2-OH 3.3Å; V65-Y108 WeakPolarHBondContact CG2-OH 3.38Å; F83-Y108 CarbonylContact C-O 3.57Å; F83-Y108 VanDerWaalsContact CA-O 3.25Å; F83-Y108 WeakPolarHBondContact CA-O 3.33Å; V84-Y108 PolarHBondContact N-O 3.19Å; V84-Y108 PolarHBondContact O-N 3.38Å; V86-Y108 HydrophobicContact CG2-CD2 4.38Å; V86-Y108 HydrophobicContact CG2-CE2 3.94Å; R106-Y108 HydrophobicContact CB-CE2 3.88Å; R106-Y108 WeakPolarHBondContact CD-OH 3.23Å |
| 109 | R | 91.4 | Very high | 87.7 | Confident | 170 Ų | 170 | 76.3 Ų | 76.3 | 64% | 0.642 | 38% | 0.379 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -72.6 | 130.8 | 175.9 | -169.4 | 174.2 | -179.3 | 171.5 | -0.7 | 109.2 | D82 F83 P111 | D82-R109 CarbonylContact O-C 3.49Å; D82-R109 WeakPolarHBondContact O-CA 3.41Å; F83-R109 HydrophobicContact CD1-CB 3.99Å; F83-R109 HydrophobicContact CD1-CG 4.41Å; F83-R109 HydrophobicContact CE1-CB 3.74Å; F83-R109 HydrophobicContact CE1-CG 4.01Å; F83-R109 HydrophobicContact CZ-CG 4.37Å; R109-P111 WeakPolarHBondContact O-CD 3.29Å |
| 110 | I | 90.5 | Very high | 88.9 | Confident | 13 Ų | 13 | 78.5 Ų | 78.5 | 7% | 0.067 | 39% | 0.387 | C | S | . | . | P | Polyproline II helix | trans | -81 | 121.1 | 171.6 | -57.9 | 173.3 | 0 | 0 | 0 | 106.7 | V79 D82 V84 V114 | V79-I110 HydrophobicContact CG1-CD1 3.97Å; D82-I110 PolarHBondContact O-N 3.31Å; V84-I110 HydrophobicContact CG2-CD1 3.68Å; V84-I110 HydrophobicContact CG2-CG1 3.69Å; I110-V114 HydrophobicContact CG2-CB 3.63Å; I110-V114 HydrophobicContact CG2-CG1 3.83Å; I110-V114 HydrophobicContact CG2-CG2 4.25Å |
| 111 | P | 89 | Confident | 89.9 | Confident | 48 Ų | 48 | 79.2 Ų | 79.2 | 31% | 0.312 | 40% | 0.395 | S | S | . | . | P | Polyproline II helix | trans | -60.9 | 153.7 | 172.8 | -21.8 | 32.1 | 0 | 0 | 0 | 112.1 | F61 R109 V114 | F61-P111 HydrophobicContact CD2-CG 4Å; F61-P111 HydrophobicContact CE2-CG 4.21Å; R109-P111 WeakPolarHBondContact O-CD 3.29Å; P111-V114 HydrophobicContact CB-CG2 4.21Å; P111-V114 HydrophobicContact CG-CG2 4.38Å; P111-V114 PolarHBondContact O-N 2.89Å |
| 112 | E | 87.4 | Confident | 90.4 | Very high | 184 Ų | 184 | 78 Ų | 78 | 86% | 0.86 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | 143 | 169.6 | -67.5 | -179.3 | -172.4 | 0 | 0 | 110.5 | ||
| 113 | G | 87.3 | Confident | 90.7 | Very high | 33 Ų | 33 | 75.9 Ų | 75.9 | 34% | 0.34 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 80.4 | 13.5 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | M135 L136 | G113-M135 CarbonylContact O-C 3.54Å; G113-M135 WeakPolarHBondContact O-CA 3.39Å; G113-L136 PolarHBondContact O-N 3.23Å |
| 114 | V | 91 | Very high | 90.7 | Very high | 12 Ų | 12 | 70.7 Ų | 70.7 | 7% | 0.073 | 37% | 0.371 | C | S | . | . | B | Isolated β-bridge | trans | -94 | 137 | 165.8 | 176.2 | 0 | 0 | 0 | 0 | 109.6 | F61 I110 P111 S116 A133 | F61-V114 HydrophobicContact CB-CB 4.47Å; F61-V114 HydrophobicContact CB-CG1 3.88Å; F61-V114 HydrophobicContact CB-CG2 3.66Å; F61-V114 HydrophobicContact CD1-CG1 4.33Å; F61-V114 HydrophobicContact CG-CG1 4.34Å; F61-V114 HydrophobicContact CG-CG2 4.23Å; I110-V114 HydrophobicContact CG2-CB 3.63Å; I110-V114 HydrophobicContact CG2-CG1 3.83Å; I110-V114 HydrophobicContact CG2-CG2 4.25Å; P111-V114 HydrophobicContact CB-CG2 4.21Å; P111-V114 HydrophobicContact CG-CG2 4.38Å; P111-V114 PolarHBondContact O-N 2.89Å; V114-S116 PolarHBondContact O-N 3.4Å; V114-S116 VanDerWaalsContact O-N 3.15Å; V114-A133 HydrophobicContact CG1-CB 3.42Å; V114-A133 VanDerWaalsContact CG1-CB 3.42Å |
| 115 | D | 90.4 | Very high | 90.6 | Very high | 49 Ų | 49 | 75.6 Ų | 75.6 | 26% | 0.262 | 41% | 0.406 | S | S | . | . | trans | -79.6 | 95.1 | 173.4 | -172 | -9.5 | 0 | 0 | 0 | 109.8 | M117 A118 A133 P134 L136 | D115-M117 PolarHBondContact O-N 2.8Å; D115-M117 WeakPolarHBondContact OD1-CB 3.22Å; D115-M117 PolarHBondContact OD1-N 2.78Å; D115-A118 HydrophobicContact CB-CB 4.1Å; D115-A118 PolarHBondContact O-N 2.77Å; D115-A118 PolarHBondContact OD1-N 2.95Å; D115-A118 WeakPolarHBondContact OD2-CB 3.12Å; D115-A133 WeakPolarHBondContact O-CB 3.44Å; D115-P134 HydrophobicContact CB-CG 4.12Å; D115-P134 PolarHBondContact N-O 3.28Å; D115-L136 HydrophobicContact CB-CD2 3.57Å; D115-L136 HydrophobicContact CB-CG 3.89Å | ||
| 116 | S | 89.3 | Confident | 90.5 | Very high | 42 Ų | 42 | 78 Ų | 78 | 29% | 0.294 | 41% | 0.414 | S | S | . | . | S | Bend | trans | -68 | -17.5 | 179.4 | 59.6 | 0 | 0 | 0 | 0 | 113.5 | V114 L119 | V114-S116 PolarHBondContact O-N 3.4Å; V114-S116 VanDerWaalsContact O-N 3.15Å; S116-L119 WeakPolarHBondContact O-CB 3.36Å |
| 117 | M | 89.4 | Confident | 90.4 | Very high | 161 Ų | 161 | 76.2 Ų | 76.2 | 79% | 0.793 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.4 | -26.7 | 176.9 | -63.7 | -72.3 | 74.8 | 0 | 0 | 112.5 | D115 L119 | D115-M117 PolarHBondContact O-N 2.8Å; D115-M117 WeakPolarHBondContact OD1-CB 3.22Å; D115-M117 PolarHBondContact OD1-N 2.78Å; M117-L119 VanDerWaalsContact C-N 3.26Å; M117-L119 PolarHBondContact O-N 2.96Å |
| 118 | A | 90.1 | Very high | 90.4 | Very high | 37 Ų | 37 | 71.2 Ų | 71.2 | 31% | 0.306 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.8 | 22.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | D115 E120 P134 | D115-A118 HydrophobicContact CB-CB 4.1Å; D115-A118 PolarHBondContact O-N 2.77Å; D115-A118 PolarHBondContact OD1-N 2.95Å; D115-A118 WeakPolarHBondContact OD2-CB 3.12Å; A118-E120 PolarHBondContact O-N 2.82Å; A118-P134 HydrophobicContact CB-CG 3.67Å; A118-P134 WeakPolarHBondContact O-CD 3.48Å |
| 119 | L | 91.4 | Very high | 90.5 | Very high | 37 Ų | 37 | 70.3 Ų | 70.3 | 19% | 0.194 | 39% | 0.391 | C | S | . | . | trans | -73.3 | 126.7 | 176.7 | -168 | 104.3 | 0 | 0 | 0 | 110.7 | V79 V84 S116 M117 I131 S132 A133 | V79-L119 HydrophobicContact CG2-CD2 3.74Å; V84-L119 HydrophobicContact CG2-CD1 4Å; V84-L119 HydrophobicContact CG2-CD2 4.28Å; S116-L119 WeakPolarHBondContact O-CB 3.36Å; M117-L119 VanDerWaalsContact C-N 3.26Å; M117-L119 PolarHBondContact O-N 2.96Å; L119-I131 HydrophobicContact CD1-CG2 3.72Å; L119-I131 HydrophobicContact CD2-CG2 3.73Å; L119-I131 HydrophobicContact CG-CG2 3.79Å; L119-S132 WeakPolarHBondContact CA-O 3.4Å; L119-A133 HydrophobicContact CB-CB 4.3Å; L119-A133 HydrophobicContact CD1-CB 3.84Å | ||
| 120 | E | 92.7 | Very high | 90.5 | Very high | 140 Ų | 140 | 65 Ų | 65 | 65% | 0.654 | 38% | 0.376 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -120 | 153.1 | 177.3 | -63.4 | -178.3 | 160.5 | 0 | 0 | 110.4 | A118 I131 S132 | A118-E120 PolarHBondContact O-N 2.82Å; E120-I131 CarbonylContact O-C 3.57Å; E120-I131 WeakPolarHBondContact O-CA 3.49Å; E120-S132 PolarHBondContact N-O 2.87Å; E120-S132 PolarHBondContact O-N 3Å |
| 121 | S | 92.7 | Very high | 90.7 | Very high | 69 Ų | 69 | 64.4 Ų | 64.4 | 48% | 0.483 | 37% | 0.372 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.7 | 140 | 176.1 | 67.1 | 0 | 0 | 0 | 0 | 112.1 | I130 | S121-I130 CarbonylContact C-O 3.55Å; S121-I130 WeakPolarHBondContact CA-O 3.33Å |
| 122 | A | 92.8 | Very high | 90.9 | Very high | 62 Ų | 62 | 63.2 Ų | 63.2 | 51% | 0.512 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.1 | 148.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | I130 | A122-I130 PolarHBondContact N-O 2.91Å; A122-I130 PolarHBondContact O-N 3.23Å |
| 123 | V | 92.1 | Very high | 91.1 | Very high | 63 Ų | 63 | 54.5 Ų | 54.5 | 38% | 0.382 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 126.4 | 173.9 | -178.6 | 0 | 0 | 0 | 0 | 108.7 | V67 L75 I128 L129 | V67-V123 HydrophobicContact CG2-CG1 4.13Å; L75-V123 HydrophobicContact CD1-CG2 4.18Å; V123-I128 CarbonylContact C-O 3.53Å; V123-I128 WeakPolarHBondContact CA-O 3.46Å; V123-L129 HydrophobicContact CG2-CB 4.31Å; V123-L129 HydrophobicContact CG2-CD1 3.73Å |
| 124 | S | 89.4 | Confident | 91.2 | Very high | 27 Ų | 27 | 55.5 Ų | 55.5 | 19% | 0.189 | 33% | 0.325 | C | S | . | . | trans | -77.3 | 157.4 | 176.4 | 89.7 | 0 | 0 | 0 | 0 | 111.4 | E126 G127 I128 | S124-E126 WeakPolarHBondContact CB-OE2 3.19Å; S124-E126 PolarHBondContact O-N 2.77Å; S124-E126 VanDerWaalsContact O-N 3.13Å; S124-E126 PolarHBondContact OG-N 3.13Å; S124-E126 PolarHBondContact OG-OE2 3.15Å; S124-G127 PolarHBondContact O-N 2.71Å; S124-I128 PolarHBondContact N-O 3.5Å; S124-I128 PolarHBondContact OG-N 3.3Å | ||
| 125 | P | 89.1 | Confident | 91.2 | Very high | 131 Ų | 131 | 57.8 Ų | 57.8 | 85% | 0.851 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.7 | -26 | 175.4 | -25.1 | 35.1 | 0 | 0 | 0 | 114.2 | G127 | P125-G127 PolarHBondContact O-N 2.88Š|
| 126 | E | 89.3 | Confident | 90.9 | Very high | 139 Ų | 139 | 60.5 Ų | 60.5 | 65% | 0.65 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.8 | 0.6 | 178.1 | -55 | 71.7 | -153.9 | 0 | 0 | 113 | S124 | S124-E126 WeakPolarHBondContact CB-OE2 3.19Å; S124-E126 PolarHBondContact O-N 2.77Å; S124-E126 VanDerWaalsContact O-N 3.13Å; S124-E126 PolarHBondContact OG-N 3.13Å; S124-E126 PolarHBondContact OG-OE2 3.15Å |
| 127 | G | 89.6 | Confident | 89.9 | Confident | 11 Ų | 11 | 66 Ų | 66 | 11% | 0.113 | 37% | 0.37 | C | S | . | . | S | Bend | trans | 80.8 | 31.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | V67 K68 S124 P125 | V67-G127 CarbonylContact C-O 3.6Å; V67-G127 VanDerWaalsContact CG2-O 3.24Å; V67-G127 WeakPolarHBondContact CG2-O 3.3Å; V67-G127 PolarHBondContact N-O 2.94Å; K68-G127 PolarHBondContact N-O 3.03Å; S124-G127 PolarHBondContact O-N 2.71Å; P125-G127 PolarHBondContact O-N 2.88Å |
| 128 | I | 92.4 | Very high | 88.3 | Confident | 43 Ų | 43 | 61.7 Ų | 61.7 | 22% | 0.221 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108 | 118.2 | 175.7 | -52.6 | -58.4 | 0 | 0 | 0 | 109.6 | Q64 D66 V123 S124 I130 | Q64-I128 HydrophobicContact CB-CG2 4.01Å; D66-I128 HydrophobicContact CB-CD1 4.19Å; V123-I128 CarbonylContact C-O 3.53Å; V123-I128 WeakPolarHBondContact CA-O 3.46Å; S124-I128 PolarHBondContact N-O 3.5Å; S124-I128 PolarHBondContact OG-N 3.3Å; I128-I130 HydrophobicContact CG2-CG1 4.28Å |
| 129 | L | 92.6 | Very high | 86.5 | Confident | 5 Ų | 5 | 69.3 Ų | 69.3 | 3% | 0.026 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 121 | 170 | 172.8 | 68 | 0 | 0 | 0 | 109 | Q64 V65 V67 V77 V86 V123 I131 | Q64-L129 CarbonylContact C-O 3.6Å; Q64-L129 WeakPolarHBondContact CA-O 3.41Å; V65-L129 HydrophobicContact CB-CB 4.28Å; V65-L129 PolarHBondContact N-O 2.9Å; V65-L129 PolarHBondContact O-N 2.84Å; V67-L129 HydrophobicContact CG1-CB 3.91Å; V67-L129 HydrophobicContact CG1-CD2 4.48Å; V67-L129 HydrophobicContact CG2-CB 3.88Å; V77-L129 HydrophobicContact CG2-CD1 4.45Å; V77-L129 HydrophobicContact CG2-CD2 3.86Å; V86-L129 HydrophobicContact CG1-CD2 3.48Å; V86-L129 VanDerWaalsContact CG1-CD2 3.48Å; V86-L129 HydrophobicContact CG2-CD2 4.28Å; V123-L129 HydrophobicContact CG2-CB 4.31Å; V123-L129 HydrophobicContact CG2-CD1 3.73Å; L129-I131 HydrophobicContact CD1-CG1 4.44Å; L129-I131 HydrophobicContact CD2-CD1 4.13Å; L129-I131 HydrophobicContact CD2-CG1 4.38Å; L129-I131 HydrophobicContact CG-CD1 4.4Å; L129-I131 HydrophobicContact CG-CG1 4.13Å |
| 130 | I | 93.1 | Very high | 84.6 | Confident | 60 Ų | 60 | 74.5 Ų | 74.5 | 31% | 0.308 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 126.8 | 176.9 | -55.1 | 170.7 | 0 | 0 | 0 | 107.5 | T62 V63 Q64 S121 A122 I128 | T62-I130 HydrophobicContact CG2-CG2 3.96Å; V63-I130 CarbonylContact O-C 3.4Å; V63-I130 WeakPolarHBondContact O-CA 3.21Å; Q64-I130 HydrophobicContact CG-CG1 4.38Å; S121-I130 CarbonylContact C-O 3.55Å; S121-I130 WeakPolarHBondContact CA-O 3.33Å; A122-I130 PolarHBondContact N-O 2.91Å; A122-I130 PolarHBondContact O-N 3.23Å; I128-I130 HydrophobicContact CG2-CG1 4.28Å |
| 131 | I | 94 | Very high | 82.6 | Confident | 0 Ų | 0 | 72.6 Ų | 72.6 | 0% | 0 | 43% | 0.427 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 128.4 | 175.4 | -56.1 | 170.3 | 0 | 0 | 0 | 106.9 | T62 V63 V77 V84 V86 L119 E120 L129 | T62-I131 CarbonylContact C-O 3.54Å; T62-I131 VanDerWaalsContact CA-O 3.29Å; T62-I131 WeakPolarHBondContact CA-O 3.25Å; V63-I131 HydrophobicContact CB-CB 4.34Å; V63-I131 PolarHBondContact N-O 2.86Å; V63-I131 PolarHBondContact O-N 2.85Å; V77-I131 HydrophobicContact CG1-CD1 3.87Å; V77-I131 HydrophobicContact CG2-CD1 4.2Å; V84-I131 HydrophobicContact CG1-CD1 3.77Å; V84-I131 HydrophobicContact CG1-CG2 4.25Å; V86-I131 HydrophobicContact CG2-CD1 3.45Å; V86-I131 VanDerWaalsContact CG2-CD1 3.45Å; L119-I131 HydrophobicContact CD1-CG2 3.72Å; L119-I131 HydrophobicContact CD2-CG2 3.73Å; L119-I131 HydrophobicContact CG-CG2 3.79Å; E120-I131 CarbonylContact O-C 3.57Å; E120-I131 WeakPolarHBondContact O-CA 3.49Å; L129-I131 HydrophobicContact CD1-CG1 4.44Å; L129-I131 HydrophobicContact CD2-CD1 4.13Å; L129-I131 HydrophobicContact CD2-CG1 4.38Å; L129-I131 HydrophobicContact CG-CD1 4.4Å; L129-I131 HydrophobicContact CG-CG1 4.13Å |
| 132 | S | 92.1 | Very high | 80.8 | Confident | 22 Ų | 22 | 81 Ų | 81 | 15% | 0.154 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144 | 149.5 | -179.6 | 63.8 | 0 | 0 | 0 | 0 | 113.6 | F61 L119 E120 | F61-S132 CarbonylContact O-C 3.53Å; F61-S132 WeakPolarHBondContact O-CA 3.36Å; F61-S132 WeakPolarHBondContact O-CB 3.34Å; L119-S132 WeakPolarHBondContact CA-O 3.4Å; E120-S132 PolarHBondContact N-O 2.87Å; E120-S132 PolarHBondContact O-N 3Å |
| 133 | A | 91.6 | Very high | 78.8 | Confident | 1 Ų | 1 | 86.3 Ų | 86.3 | 1% | 0.008 | 46% | 0.462 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.5 | 145.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | R60 F61 V114 D115 L119 | R60-A133 WeakPolarHBondContact CA-O 3.47Å; R60-A133 VanDerWaalsContact CG-O 3.25Å; R60-A133 WeakPolarHBondContact CG-O 3.45Å; F61-A133 PolarHBondContact N-O 3.3Å; F61-A133 PolarHBondContact O-N 3.26Å; V114-A133 HydrophobicContact CG1-CB 3.42Å; V114-A133 VanDerWaalsContact CG1-CB 3.42Å; D115-A133 WeakPolarHBondContact O-CB 3.44Å; L119-A133 HydrophobicContact CB-CB 4.3Å; L119-A133 HydrophobicContact CD1-CB 3.84Å |
| 134 | P | 91 | Very high | 77.3 | Confident | 55 Ų | 55 | 90 Ų | 90 | 36% | 0.357 | 48% | 0.479 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.7 | 151.4 | 172.5 | 29.2 | -31.5 | 0 | 0 | 0 | 110.6 | D115 A118 | D115-P134 HydrophobicContact CB-CG 4.12Å; D115-P134 PolarHBondContact N-O 3.28Å; A118-P134 HydrophobicContact CB-CG 3.67Å; A118-P134 WeakPolarHBondContact O-CD 3.48Å |
| 135 | M | 89.3 | Confident | 75.8 | Confident | 60 Ų | 60 | 95 Ų | 95 | 30% | 0.296 | 51% | 0.51 | S | S | . | . | B | Isolated β-bridge | trans | -72.1 | 136.7 | 163.4 | -66.7 | -165.6 | 78.9 | 0 | 0 | 109.1 | H58 S59 G113 Q137 | H58-M135 VanDerWaalsContact O-SD 3.41Å; S59-M135 PolarHBondContact O-N 3.47Å; G113-M135 CarbonylContact O-C 3.54Å; G113-M135 WeakPolarHBondContact O-CA 3.39Å; M135-Q137 PolarHBondContact O-N 2.98Å |
| 136 | L | 85.2 | Confident | 74 | Confident | 106 Ų | 106 | 96 Ų | 96 | 56% | 0.555 | 50% | 0.503 | S | S | * | . | trans | -60.5 | 86.7 | 163.2 | -64.8 | 168.1 | 0 | 0 | 0 | 106.6 | G113 D115 G138 | G113-L136 PolarHBondContact O-N 3.23Å; D115-L136 HydrophobicContact CB-CD2 3.57Å; D115-L136 HydrophobicContact CB-CG 3.89Å; L136-G138 PolarHBondContact O-N 2.8Å | ||
| 137 | Q | 68.8 | Low | 72.7 | Confident | 156 Ų | 156 | 95.1 Ų | 95.1 | 73% | 0.729 | 51% | 0.513 | S | S | * | . | trans | -56.9 | 116.1 | 172.4 | -72.3 | -173.3 | 35.9 | 0 | 0 | 106.5 | M135 E139 | M135-Q137 PolarHBondContact O-N 2.98Å; Q137-E139 PolarHBondContact O-N 2.72Å | ||
| 138 | G | 56.2 | Low | 71.1 | Confident | 71 Ų | 71 | 103 Ų | 103 | 73% | 0.732 | 55% | 0.547 | S | S | * | . | trans | -55.6 | 111.3 | 163 | 0 | 0 | 0 | 0 | 0 | 106.7 | L136 N140 | L136-G138 PolarHBondContact O-N 2.8Å; G138-N140 PolarHBondContact O-N 2.95Å | ||
| 139 | E | 51.5 | Low | 69.5 | Low | 198 Ų | 198 | 110.5 Ų | 110.5 | 93% | 0.925 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -62.3 | 71.5 | 168.5 | -174.7 | 167 | 86.7 | 0 | 0 | 108.7 | Q137 | Q137-E139 PolarHBondContact O-N 2.72Š|
| 140 | N | 50.8 | Low | 68.3 | Low | 146 Ų | 146 | 115.8 Ų | 115.8 | 78% | 0.781 | 63% | 0.631 | S | S | * | * | trans | -163.5 | 74.5 | 169.3 | -149.7 | 7.1 | 0 | 0 | 0 | 113.9 | G138 | G138-N140 PolarHBondContact O-N 2.95Š| ||
| 141 | S | 51.7 | Low | 67 | Low | 99 Ų | 99 | 118.7 Ų | 118.7 | 69% | 0.692 | 65% | 0.648 | S | S | * | * | trans | -172.8 | 73.5 | 144.8 | -91.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 142 | R | 55.6 | Low | 65.5 | Low | 247 Ų | 247 | 125.3 Ų | 125.3 | 93% | 0.932 | 68% | 0.684 | S | S | * | * | trans | -130.7 | 89 | 137.2 | -72 | -170.3 | -177.8 | 155 | 2.1 | 107.2 | L144 | R142-L144 PolarHBondContact O-N 2.97Š| ||
| 143 | H | 49.2 | Very low | 64 | Low | 173 Ų | 173 | 131.4 Ų | 131.4 | 80% | 0.801 | 72% | 0.716 | S | S | * | * | trans | -36.4 | 126.1 | 161.9 | -92.2 | -105.5 | 0 | 0 | 0 | 110.6 | P145 | H143-P145 WeakPolarHBondContact O-CD 3.49Š| ||
| 144 | L | 60.9 | Low | 62.2 | Low | 141 Ų | 141 | 139.5 Ų | 139.5 | 74% | 0.738 | 76% | 0.76 | S | S | * | * | trans | -58.9 | 128.6 | 157.3 | -76 | 110.8 | 0 | 0 | 0 | 108.3 | R142 H146 | R142-L144 PolarHBondContact O-N 2.97Å; L144-H146 PolarHBondContact O-N 3.34Å | ||
| 145 | P | 58.3 | Low | 60.3 | Low | 130 Ų | 130 | 145.1 Ų | 145.1 | 84% | 0.844 | 79% | 0.787 | S | S | * | * | trans | -72.2 | 90.4 | 157.4 | 29.5 | -29 | 0 | 0 | 0 | 107.6 | H143 S147 | H143-P145 WeakPolarHBondContact O-CD 3.49Å; P145-S147 PolarHBondContact O-N 3.4Å | ||
| 146 | H | 51.1 | Low | 58.3 | Low | 153 Ų | 153 | 151.2 Ų | 151.2 | 71% | 0.708 | 82% | 0.822 | S | S | * | * | trans | -74.6 | 107.4 | 152.6 | -106.7 | -83.7 | 0 | 0 | 0 | 107 | L144 | L144-H146 PolarHBondContact O-N 3.34Š| ||
| 147 | S | 61.3 | Low | 56.2 | Low | 121 Ų | 121 | 154.7 Ų | 154.7 | 85% | 0.846 | 84% | 0.842 | S | S | * | * | trans | -150.3 | 95.5 | 152.3 | -73.8 | 0 | 0 | 0 | 0 | 107.7 | P145 | P145-S147 PolarHBondContact O-N 3.4Š| ||
| 148 | E | 56 | Low | 55.1 | Low | 177 Ų | 177 | 154.6 Ų | 154.6 | 83% | 0.827 | 85% | 0.852 | S | S | * | * | trans | -76 | 122.3 | 161.8 | -165.2 | 179.7 | 112.3 | 0 | 0 | 107.1 | ||||
| 149 | S | 59.2 | Low | 55 | Low | 199 Ų | 199 | 162.2 Ų | 162.2 | 100% | 1.392 | 86% | 0.862 | S | S | * | * | trans | 175.6 | 0 | 148.7 | -75.7 | 0 | 0 | 0 | 0 | 110.1 |
Retrieved 149 of 149 residues in 336.3 ms
(Link to these results)