| 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 | 53.3 | Low | 58.6 | Low | 226 Ų | 226 | 146.7 Ų | 146.7 | 100% | 1.113 | 83% | 0.833 | S | S | * | * | 0 | 108.5 | 0 | -71.5 | 171 | 155.7 | 0 | 0 | 104.9 | |||||
| 2 | D | 49.6 | Very low | 58.5 | Low | 142 Ų | 142 | 142.5 Ų | 142.5 | 76% | 0.759 | 82% | 0.82 | S | S | * | * | cis | -161.6 | 147.1 | 19.8 | -66.9 | -52.1 | 0 | 0 | 0 | 108.6 | ||||
| 3 | S | 57.7 | Low | 58.1 | Low | 130 Ų | 130 | 139.8 Ų | 139.8 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | trans | -157.2 | 86.1 | 145.3 | -86.3 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 4 | A | 55.5 | Low | 57.1 | Low | 99 Ų | 99 | 141.9 Ų | 141.9 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | -75.9 | 135 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 5 | G | 60.9 | Low | 57.3 | Low | 62 Ų | 62 | 146.2 Ų | 146.2 | 64% | 0.639 | 82% | 0.822 | S | S | * | * | trans | 73.6 | 120.4 | 139.1 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 6 | Q | 62 | Low | 56.9 | Low | 191 Ų | 191 | 141.1 Ų | 141.1 | 89% | 0.893 | 81% | 0.812 | S | S | * | * | -158.6 | 98.4 | 126.8 | -106.7 | 162.5 | 18.9 | 0 | 0 | 110.3 | |||||
| 7 | D | 62.9 | Low | 56.5 | Low | 160 Ų | 160 | 141.4 Ų | 141.4 | 86% | 0.856 | 81% | 0.809 | S | S | * | * | trans | -60 | 125.4 | 157 | -70.8 | -78.6 | 0 | 0 | 0 | 110.3 | ||||
| 8 | I | 64.3 | Low | 56.2 | Low | 156 Ų | 156 | 141.8 Ų | 141.8 | 80% | 0.8 | 81% | 0.808 | S | S | * | * | trans | -143.5 | 90.4 | 160 | 46.6 | 171.2 | 0 | 0 | 0 | 108.6 | ||||
| 9 | N | 57.4 | Low | 56 | Low | 133 Ų | 133 | 140.5 Ų | 140.5 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | 87.9 | 95.1 | 92 | -162.8 | -55.7 | 0 | 0 | 0 | 112.7 | N11 | N9-N11 WeakPolarHBondContact OD1-CB 3.36Å; N9-N11 PolarHBondContact OD1-N 3.07Å | |||
| 10 | L | 66.5 | Low | 55.6 | Low | 177 Ų | 177 | 140.7 Ų | 140.7 | 93% | 0.927 | 81% | 0.807 | S | S | * | * | trans | -97.9 | 41.3 | 173.1 | -65.7 | 176.4 | 0 | 0 | 0 | 111.8 | S12 | L10-S12 PolarHBondContact O-N 3.49Š| ||
| 11 | N | 54.5 | Low | 55 | Low | 138 Ų | 138 | 139.2 Ų | 139.2 | 74% | 0.738 | 80% | 0.804 | S | S | * | * | trans | -84.7 | 103 | 174.7 | -166.3 | 47 | 0 | 0 | 0 | 111.2 | N9 | N9-N11 WeakPolarHBondContact OD1-CB 3.36Å; N9-N11 PolarHBondContact OD1-N 3.07Å | ||
| 12 | S | 56.9 | Low | 54.7 | Low | 96 Ų | 96 | 136.6 Ų | 136.6 | 67% | 0.671 | 79% | 0.792 | S | S | * | * | trans | -56 | 153.6 | 166.5 | -59.7 | 0 | 0 | 0 | 0 | 111.1 | L10 | L10-S12 PolarHBondContact O-N 3.49Š| ||
| 13 | P | 53.1 | Low | 54.9 | Low | 107 Ų | 107 | 135.2 Ų | 135.2 | 70% | 0.695 | 79% | 0.788 | S | S | * | * | -159.3 | 134.8 | 80.3 | 36.8 | -15.2 | 0 | 0 | 0 | 115.3 | |||||
| 14 | N | 45.3 | Very low | 54.6 | Low | 170 Ų | 170 | 135.9 Ų | 135.9 | 91% | 0.909 | 78% | 0.782 | S | S | * | * | trans | -148 | 89 | 149.2 | -93.5 | -41.5 | 0 | 0 | 0 | 111.4 | ||||
| 15 | K | 59.5 | Low | 54.5 | Low | 206 Ų | 206 | 136.7 Ų | 136.7 | 90% | 0.896 | 78% | 0.776 | S | S | * | * | trans | -84.5 | 101.7 | 140 | -83 | -139.6 | -179.3 | -156.7 | 0 | 107.6 | ||||
| 16 | G | 50.4 | Low | 54.6 | Low | 64 Ų | 64 | 138.8 Ų | 138.8 | 66% | 0.66 | 78% | 0.779 | S | S | * | * | trans | -113.1 | 101.4 | 150 | 0 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 17 | L | 50.8 | Low | 54.3 | Low | 146 Ų | 146 | 136.3 Ų | 136.3 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | 40.5 | 101.5 | 79.1 | -85.4 | 166.3 | 0 | 0 | 0 | 112.1 | |||||
| 18 | L | 51.8 | Low | 53.5 | Low | 150 Ų | 150 | 135.3 Ų | 135.3 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | trans | 41.8 | 121.6 | 131.2 | -52.9 | 177.3 | 0 | 0 | 0 | 117.4 | ||||
| 19 | S | 51.2 | Low | 52.5 | Low | 116 Ų | 116 | 134.6 Ų | 134.6 | 81% | 0.811 | 77% | 0.774 | S | S | * | * | trans | 134.3 | 112.2 | 136.9 | -57.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 20 | D | 48.8 | Very low | 52 | Low | 145 Ų | 145 | 131.1 Ų | 131.1 | 78% | 0.775 | 77% | 0.77 | S | S | * | * | 165.1 | 89.5 | 88.3 | -152.1 | 13.8 | 0 | 0 | 0 | 108.6 | |||||
| 21 | S | 42.7 | Very low | 51 | Low | 109 Ų | 109 | 129.9 Ų | 129.9 | 76% | 0.762 | 77% | 0.769 | S | S | * | * | trans | -147.3 | 74.2 | 155.3 | -162.9 | 0 | 0 | 0 | 0 | 106.7 | T23 | S21-T23 VanDerWaalsContact C-N 3.25Å; S21-T23 PolarHBondContact O-N 3.37Å | ||
| 22 | M | 47.1 | Very low | 50.6 | Low | 172 Ų | 172 | 127.6 Ų | 127.6 | 85% | 0.847 | 77% | 0.769 | S | S | * | * | trans | -58.6 | 100.6 | 152 | -70.6 | -179.8 | -179.6 | 0 | 0 | 105.9 | D24 | M22-D24 PolarHBondContact O-N 3.46Š| ||
| 23 | T | 52.9 | Low | 49.7 | Very low | 112 Ų | 112 | 127.4 Ų | 127.4 | 69% | 0.687 | 77% | 0.774 | S | S | * | * | trans | -62.9 | 101.7 | 155.8 | 54.8 | 0 | 0 | 0 | 0 | 105.2 | S21 V25 | S21-T23 VanDerWaalsContact C-N 3.25Å; S21-T23 PolarHBondContact O-N 3.37Å; T23-V25 VanDerWaalsContact C-N 3.28Å; T23-V25 PolarHBondContact O-N 2.66Å | ||
| 24 | D | 52.3 | Low | 49.5 | Very low | 144 Ų | 144 | 134 Ų | 134 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | -50.1 | 97.9 | 160.9 | -176.1 | 62.1 | 0 | 0 | 0 | 107 | M22 P26 | M22-D24 PolarHBondContact O-N 3.46Å; D24-P26 VanDerWaalsContact O-CD 3.29Å; D24-P26 WeakPolarHBondContact O-CD 3.49Å | ||
| 25 | V | 54.1 | Low | 49.1 | Very low | 116 Ų | 116 | 131.6 Ų | 131.6 | 70% | 0.703 | 78% | 0.777 | S | S | * | * | trans | -92.1 | 107.1 | 169.1 | 177.6 | 0 | 0 | 0 | 0 | 104.8 | T23 V27 | T23-V25 VanDerWaalsContact C-N 3.28Å; T23-V25 PolarHBondContact O-N 2.66Å; V25-V27 PolarHBondContact O-N 2.78Å | ||
| 26 | P | 62.7 | Low | 48.3 | Very low | 106 Ų | 106 | 126.9 Ų | 126.9 | 69% | 0.688 | 77% | 0.767 | S | S | * | * | trans | -60.3 | 128.1 | 175.1 | 23.2 | -31.1 | 0 | 0 | 0 | 108.8 | D24 | D24-P26 VanDerWaalsContact O-CD 3.29Å; D24-P26 WeakPolarHBondContact O-CD 3.49Å | ||
| 27 | V | 56 | Low | 48 | Very low | 139 Ų | 139 | 127.6 Ų | 127.6 | 84% | 0.842 | 77% | 0.767 | S | S | * | * | trans | -70.9 | 129.2 | 174.9 | 92.9 | 0 | 0 | 0 | 0 | 109 | V25 | V25-V27 PolarHBondContact O-N 2.78Š| ||
| 28 | D | 45.1 | Very low | 48.1 | Very low | 139 Ų | 139 | 127.2 Ų | 127.2 | 74% | 0.743 | 77% | 0.77 | S | S | * | * | trans | 63 | 115.1 | 151.7 | -151.3 | 50.8 | 0 | 0 | 0 | 119 | ||||
| 29 | T | 44.6 | Very low | 47.9 | Very low | 141 Ų | 141 | 128.6 Ų | 128.6 | 87% | 0.865 | 77% | 0.773 | S | S | * | * | -165.9 | 121.5 | 117.3 | -59.1 | 0 | 0 | 0 | 0 | 107.7 | |||||
| 30 | G | 45.4 | Very low | 48.2 | Very low | 61 Ų | 61 | 125.6 Ų | 125.6 | 63% | 0.629 | 76% | 0.761 | S | S | * | * | trans | -74.5 | -179.5 | -163.3 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 31 | V | 46.5 | Very low | 48.7 | Very low | 150 Ų | 150 | 123.9 Ų | 123.9 | 91% | 0.909 | 75% | 0.751 | S | S | * | * | trans | 106.8 | 118.4 | 162.9 | -177.4 | 0 | 0 | 0 | 0 | 116 | ||||
| 32 | A | 44.8 | Very low | 50.3 | Low | 90 Ų | 90 | 122.6 Ų | 122.6 | 74% | 0.744 | 74% | 0.738 | S | S | * | * | trans | 91.7 | 108.2 | 156 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 33 | A | 39.5 | Very low | 52 | Low | 93 Ų | 93 | 122.3 Ų | 122.3 | 77% | 0.769 | 74% | 0.735 | S | S | * | * | trans | 61.3 | 93.3 | 143 | 0 | 0 | 0 | 0 | 0 | 117.8 | T35 | A33-T35 PolarHBondContact O-N 2.87Š| ||
| 34 | R | 48.7 | Very low | 53.4 | Low | 244 Ų | 244 | 120.2 Ų | 120.2 | 92% | 0.921 | 73% | 0.729 | S | S | * | * | trans | -46.7 | 109.2 | 146.8 | -80.3 | 173.2 | 144.6 | -169.6 | -6 | 110.6 | ||||
| 35 | T | 35.9 | Very low | 55.2 | Low | 120 Ų | 120 | 117.6 Ų | 117.6 | 74% | 0.736 | 71% | 0.712 | S | S | * | * | trans | -155.7 | 103.2 | 131.2 | 43.6 | 0 | 0 | 0 | 0 | 106.6 | A33 A37 | A33-T35 PolarHBondContact O-N 2.87Å; T35-A37 VanDerWaalsContact C-N 3.31Å; T35-A37 PolarHBondContact O-N 3.06Å | ||
| 36 | P | 44.3 | Very low | 56.8 | Low | 107 Ų | 107 | 116 Ų | 116 | 70% | 0.695 | 70% | 0.697 | S | S | * | * | trans | -65.7 | 107.9 | 154.5 | 28.9 | -25.9 | 0 | 0 | 0 | 104.3 | V38 | P36-V38 PolarHBondContact O-N 3.09Š| ||
| 37 | A | 42.7 | Very low | 58.1 | Low | 80 Ų | 80 | 117.6 Ų | 117.6 | 66% | 0.661 | 70% | 0.695 | S | S | * | * | trans | -47.6 | 126.4 | 158 | 0 | 0 | 0 | 0 | 0 | 105.7 | T35 E39 | T35-A37 VanDerWaalsContact C-N 3.31Å; T35-A37 PolarHBondContact O-N 3.06Å; A37-E39 PolarHBondContact O-N 2.91Å | ||
| 38 | V | 53.2 | Low | 59.8 | Low | 137 Ų | 137 | 117.5 Ų | 117.5 | 83% | 0.83 | 69% | 0.685 | S | S | * | * | trans | -31 | 103.7 | 169.1 | 175.9 | 0 | 0 | 0 | 0 | 108 | P36 G40 | P36-V38 PolarHBondContact O-N 3.09Å; V38-G40 PolarHBondContact O-N 3.02Å | ||
| 39 | E | 47.7 | Very low | 62.2 | Low | 179 Ų | 179 | 115 Ų | 115 | 84% | 0.836 | 67% | 0.671 | S | S | * | * | trans | -61.8 | 93.9 | 165.5 | -93.2 | 127.4 | 175.9 | 0 | 0 | 104.4 | A37 | A37-E39 PolarHBondContact O-N 2.91Š| ||
| 40 | G | 57.6 | Low | 64.7 | Low | 54 Ų | 54 | 114.8 Ų | 114.8 | 56% | 0.557 | 66% | 0.655 | S | S | * | * | trans | -58.5 | 138.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 108 | V38 T42 | V38-G40 PolarHBondContact O-N 3.02Å; G40-T42 PolarHBondContact O-N 3.31Å | ||
| 41 | L | 58.6 | Low | 67.2 | Low | 109 Ų | 109 | 114.9 Ų | 114.9 | 57% | 0.571 | 65% | 0.649 | S | S | * | * | trans | -38.3 | 132.2 | 167.5 | -72.7 | 154.2 | 0 | 0 | 0 | 109 | E45 L49 | L41-E45 HydrophobicContact CD2-CB 4.27Å; L41-L49 HydrophobicContact CD1-CD1 4.06Å; L41-L49 HydrophobicContact CD2-CD1 4.4Å | ||
| 42 | T | 77.6 | Confident | 69.6 | Low | 81 Ų | 81 | 113.3 Ų | 113.3 | 50% | 0.497 | 63% | 0.632 | S | S | . | * | trans | -59.4 | 147.1 | 177.1 | 61.9 | 0 | 0 | 0 | 0 | 108.7 | G40 A44 E45 E46 | G40-T42 PolarHBondContact O-N 3.31Å; T42-A44 PolarHBondContact O-N 2.81Å; T42-E45 WeakPolarHBondContact CB-OE2 3.48Å; T42-E45 PolarHBondContact N-OE2 2.89Å; T42-E45 PolarHBondContact O-N 2.98Å; T42-E45 VanDerWaalsContact OG1-CG 3.24Å; T42-E45 WeakPolarHBondContact OG1-CG 3.48Å; T42-E45 PolarHBondContact OG1-OE2 3.5Å; T42-E46 PolarHBondContact O-N 3.15Å; T42-E46 VanDerWaalsContact O-N 3.09Å | ||
| 43 | E | 81.8 | Confident | 72.1 | Confident | 167 Ų | 167 | 113.9 Ų | 113.9 | 78% | 0.78 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -51.6 | -34.7 | -174.8 | -174.3 | 175.8 | -168.3 | 0 | 0 | 112.7 | E46 E47 | E43-E46 PolarHBondContact O-N 3.43Å; E43-E47 PolarHBondContact O-N 2.96Å |
| 44 | A | 83.4 | Confident | 74.9 | Confident | 67 Ų | 67 | 112.8 Ų | 112.8 | 55% | 0.554 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -68.1 | -41.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | T42 E46 E47 E48 | T42-A44 PolarHBondContact O-N 2.81Å; A44-E46 VanDerWaalsContact C-N 3.32Å; A44-E47 PolarHBondContact O-N 2.73Å; A44-E48 PolarHBondContact O-N 3.07Å |
| 45 | E | 88.8 | Confident | 77.3 | Confident | 90 Ų | 90 | 107 Ų | 107 | 42% | 0.421 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -67.3 | -36.4 | 176.6 | -69.4 | 165.5 | 143.5 | 0 | 0 | 110.9 | L41 T42 E48 L49 | L41-E45 HydrophobicContact CD2-CB 4.27Å; T42-E45 WeakPolarHBondContact CB-OE2 3.48Å; T42-E45 PolarHBondContact N-OE2 2.89Å; T42-E45 PolarHBondContact O-N 2.98Å; T42-E45 VanDerWaalsContact OG1-CG 3.24Å; T42-E45 WeakPolarHBondContact OG1-CG 3.48Å; T42-E45 PolarHBondContact OG1-OE2 3.5Å; E45-E48 PolarHBondContact O-N 2.81Å; E45-L49 WeakPolarHBondContact O-CB 3.5Å; E45-L49 VanDerWaalsContact O-CG 3.29Å; E45-L49 WeakPolarHBondContact O-CG 3.29Å; E45-L49 PolarHBondContact O-N 3.23Å |
| 46 | E | 88.3 | Confident | 80.3 | Confident | 82 Ų | 82 | 104.2 Ų | 104.2 | 38% | 0.383 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66.7 | -38.9 | 175.2 | -159.5 | -165.3 | -172.2 | 0 | 0 | 111.7 | T42 E43 A44 R50 | T42-E46 PolarHBondContact O-N 3.15Å; T42-E46 VanDerWaalsContact O-N 3.09Å; E43-E46 PolarHBondContact O-N 3.43Å; A44-E46 VanDerWaalsContact C-N 3.32Å; E46-R50 WeakPolarHBondContact O-CG 3.44Å; E46-R50 PolarHBondContact O-N 3.35Å; E46-R50 IonicContact OE1-CZ 2.74Å; E46-R50 IonicContact OE1-NH1 3.36Å; E46-R50 PolarHBondContact OE1-NH1 2.98Å; E46-R50 IonicContact OE1-NH2 2.66Å; E46-R50 PolarHBondContact OE1-NH2 3.24Å; E46-R50 IonicContact OE2-CZ 3.33Å; E46-R50 IonicContact OE2-NH1 3.46Å; E46-R50 PolarHBondContact OE2-NH1 3.5Å; E46-R50 IonicContact OE2-NH2 3.37Å; E46-R50 PolarHBondContact OE2-NH2 3.3Å |
| 47 | E | 89.3 | Confident | 82.9 | Confident | 139 Ų | 139 | 104.3 Ų | 104.3 | 65% | 0.65 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65 | -42.7 | 173.9 | -172.1 | 175.6 | -166.8 | 0 | 0 | 112 | E43 A44 L49 R50 A51 | E43-E47 PolarHBondContact O-N 2.96Å; A44-E47 PolarHBondContact O-N 2.73Å; E47-L49 PolarHBondContact O-N 3.18Å; E47-R50 WeakPolarHBondContact O-CB 3.24Å; E47-R50 PolarHBondContact O-N 3.04Å; E47-A51 PolarHBondContact O-N 3.4Å |
| 48 | E | 91.8 | Very high | 85.5 | Confident | 137 Ų | 137 | 106.4 Ų | 106.4 | 64% | 0.64 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.4 | -44.7 | 175.7 | -173.8 | 173.6 | -171.1 | 0 | 0 | 111.6 | A44 E45 R50 A51 E52 | A44-E48 PolarHBondContact O-N 3.07Å; E45-E48 PolarHBondContact O-N 2.81Å; E48-R50 VanDerWaalsContact C-N 3.31Å; E48-R50 PolarHBondContact O-N 3.05Å; E48-A51 WeakPolarHBondContact O-CB 3.5Å; E48-A51 PolarHBondContact O-N 3.21Å; E48-A51 VanDerWaalsContact O-N 3.15Å; E48-E52 PolarHBondContact O-N 2.99Å |
| 49 | L | 96.3 | Very high | 87.7 | Confident | 86 Ų | 86 | 104.5 Ų | 104.5 | 45% | 0.45 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.1 | -37.1 | 175.8 | -73.8 | 170.8 | 0 | 0 | 0 | 112.3 | L41 E45 E47 L53 | L41-L49 HydrophobicContact CD1-CD1 4.06Å; L41-L49 HydrophobicContact CD2-CD1 4.4Å; E45-L49 WeakPolarHBondContact O-CB 3.5Å; E45-L49 VanDerWaalsContact O-CG 3.29Å; E45-L49 WeakPolarHBondContact O-CG 3.29Å; E45-L49 PolarHBondContact O-N 3.23Å; E47-L49 PolarHBondContact O-N 3.18Å; L49-L53 VanDerWaalsContact O-CB 3.26Å; L49-L53 WeakPolarHBondContact O-CB 3.26Å; L49-L53 PolarHBondContact O-N 3.35Å |
| 50 | R | 96 | Very high | 90.1 | Very high | 138 Ų | 138 | 99.2 Ų | 99.2 | 52% | 0.521 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.5 | -40.4 | 174 | -75.7 | 178 | 178 | 112.1 | 5.2 | 111.8 | E46 E47 E48 T54 | E46-R50 WeakPolarHBondContact O-CG 3.44Å; E46-R50 PolarHBondContact O-N 3.35Å; E46-R50 IonicContact OE1-CZ 2.74Å; E46-R50 IonicContact OE1-NH1 3.36Å; E46-R50 PolarHBondContact OE1-NH1 2.98Å; E46-R50 IonicContact OE1-NH2 2.66Å; E46-R50 PolarHBondContact OE1-NH2 3.24Å; E46-R50 IonicContact OE2-CZ 3.33Å; E46-R50 IonicContact OE2-NH1 3.46Å; E46-R50 PolarHBondContact OE2-NH1 3.5Å; E46-R50 IonicContact OE2-NH2 3.37Å; E46-R50 PolarHBondContact OE2-NH2 3.3Å; E47-R50 WeakPolarHBondContact O-CB 3.24Å; E47-R50 PolarHBondContact O-N 3.04Å; E48-R50 VanDerWaalsContact C-N 3.31Å; E48-R50 PolarHBondContact O-N 3.05Å; R50-T54 WeakPolarHBondContact O-CB 3.36Å; R50-T54 PolarHBondContact O-N 2.91Å; R50-T54 PolarHBondContact O-OG1 3.39Å |
| 51 | A | 97.6 | Very high | 92.1 | Very high | 62 Ų | 62 | 100 Ų | 100 | 51% | 0.512 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.7 | -44 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | E47 E48 T54 K55 | E47-A51 PolarHBondContact O-N 3.4Å; E48-A51 WeakPolarHBondContact O-CB 3.5Å; E48-A51 PolarHBondContact O-N 3.21Å; E48-A51 VanDerWaalsContact O-N 3.15Å; A51-T54 PolarHBondContact O-N 2.91Å; A51-K55 PolarHBondContact O-N 2.95Å |
| 52 | E | 98 | Very high | 94 | Very high | 117 Ų | 117 | 98.4 Ų | 98.4 | 55% | 0.547 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.6 | -44 | 176.4 | -172.6 | 175.2 | -168.9 | 0 | 0 | 111.5 | E48 T54 K55 V56 | E48-E52 PolarHBondContact O-N 2.99Å; E52-T54 VanDerWaalsContact C-N 3.33Å; E52-T54 PolarHBondContact O-N 2.87Å; E52-K55 PolarHBondContact O-N 3.25Å; E52-V56 HydrophobicContact CG-CG2 4.38Å; E52-V56 WeakPolarHBondContact O-CG2 3.5Å; E52-V56 PolarHBondContact O-N 3.41Å |
| 53 | L | 97.9 | Very high | 95 | Very high | 102 Ų | 102 | 100 Ų | 100 | 53% | 0.534 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -56.7 | -48.6 | 175.5 | -177.9 | 65.7 | 0 | 0 | 0 | 111 | L49 K55 V56 E57 | L49-L53 VanDerWaalsContact O-CB 3.26Å; L49-L53 WeakPolarHBondContact O-CB 3.26Å; L49-L53 PolarHBondContact O-N 3.35Å; L53-K55 VanDerWaalsContact C-N 3.32Å; L53-K55 PolarHBondContact O-N 3.3Å; L53-V56 PolarHBondContact O-N 3.04Å; L53-E57 WeakPolarHBondContact O-CG 3.32Å; L53-E57 PolarHBondContact O-N 3.25Å |
| 54 | T | 98.3 | Very high | 95.8 | Very high | 71 Ų | 71 | 100.2 Ų | 100.2 | 44% | 0.436 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.2 | -45.7 | 178.3 | -56.6 | 0 | 0 | 0 | 0 | 111 | R50 A51 E52 E57 E58 | R50-T54 WeakPolarHBondContact O-CB 3.36Å; R50-T54 PolarHBondContact O-N 2.91Å; R50-T54 PolarHBondContact O-OG1 3.39Å; A51-T54 PolarHBondContact O-N 2.91Å; E52-T54 VanDerWaalsContact C-N 3.33Å; E52-T54 PolarHBondContact O-N 2.87Å; T54-E57 WeakPolarHBondContact O-CB 3.46Å; T54-E57 PolarHBondContact O-N 2.87Å; T54-E58 WeakPolarHBondContact O-CG 3.5Å; T54-E58 PolarHBondContact O-N 3.28Å |
| 55 | K | 98.6 | Very high | 96.6 | Very high | 123 Ų | 123 | 102.8 Ų | 102.8 | 54% | 0.535 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.5 | -44.7 | 178 | -177.4 | -175.7 | 173.4 | -168.3 | 0 | 112.2 | A51 E52 L53 E57 E58 E59 | A51-K55 PolarHBondContact O-N 2.95Å; E52-K55 PolarHBondContact O-N 3.25Å; L53-K55 VanDerWaalsContact C-N 3.32Å; L53-K55 PolarHBondContact O-N 3.3Å; K55-E57 VanDerWaalsContact C-N 3.3Å; K55-E57 PolarHBondContact O-N 3.45Å; K55-E58 WeakPolarHBondContact O-CB 3.36Å; K55-E58 PolarHBondContact O-N 2.99Å; K55-E59 VanDerWaalsContact CE-OE1 3.3Å; K55-E59 WeakPolarHBondContact CE-OE1 3.42Å; K55-E59 WeakPolarHBondContact O-CG 3.29Å; K55-E59 PolarHBondContact O-N 3.5Å |
| 56 | V | 98.7 | Very high | 97 | Very high | 60 Ų | 60 | 101.8 Ų | 101.8 | 36% | 0.364 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.7 | -38.5 | 177.8 | 170.8 | 0 | 0 | 0 | 0 | 110.8 | E52 L53 E58 E59 I60 | E52-V56 HydrophobicContact CG-CG2 4.38Å; E52-V56 WeakPolarHBondContact O-CG2 3.5Å; E52-V56 PolarHBondContact O-N 3.41Å; L53-V56 PolarHBondContact O-N 3.04Å; V56-E58 PolarHBondContact O-N 3.34Å; V56-E59 PolarHBondContact O-N 3.04Å; V56-I60 HydrophobicContact CG1-CD1 3.93Å; V56-I60 HydrophobicContact CG1-CG1 4.43Å; V56-I60 VanDerWaalsContact O-CG1 3.25Å; V56-I60 WeakPolarHBondContact O-CG1 3.48Å; V56-I60 PolarHBondContact O-N 3.45Å |
| 57 | E | 98.6 | Very high | 97.5 | Very high | 109 Ų | 109 | 102.4 Ų | 102.4 | 51% | 0.509 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.3 | -42.7 | 174.5 | -73.3 | 179.5 | 156.9 | 0 | 0 | 111.9 | L53 T54 K55 I60 V61 | L53-E57 WeakPolarHBondContact O-CG 3.32Å; L53-E57 PolarHBondContact O-N 3.25Å; T54-E57 WeakPolarHBondContact O-CB 3.46Å; T54-E57 PolarHBondContact O-N 2.87Å; K55-E57 VanDerWaalsContact C-N 3.3Å; K55-E57 PolarHBondContact O-N 3.45Å; E57-I60 PolarHBondContact O-N 3.33Å; E57-V61 WeakPolarHBondContact O-CG2 3.41Å; E57-V61 PolarHBondContact O-N 3.22Å |
| 58 | E | 98.6 | Very high | 98 | Very high | 125 Ų | 125 | 97.6 Ų | 97.6 | 58% | 0.584 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.6 | -42.4 | 174.4 | -70.3 | 177.8 | 173.3 | 0 | 0 | 112.6 | T54 K55 V56 V61 T62 | T54-E58 WeakPolarHBondContact O-CG 3.5Å; T54-E58 PolarHBondContact O-N 3.28Å; K55-E58 WeakPolarHBondContact O-CB 3.36Å; K55-E58 PolarHBondContact O-N 2.99Å; V56-E58 PolarHBondContact O-N 3.34Å; E58-V61 PolarHBondContact O-N 2.91Å; E58-T62 WeakPolarHBondContact O-CB 3.3Å; E58-T62 PolarHBondContact O-N 2.97Å; E58-T62 PolarHBondContact O-OG1 3.49Å |
| 59 | E | 98.6 | Very high | 98.3 | Very high | 97 Ų | 97 | 92.9 Ų | 92.9 | 45% | 0.453 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.9 | -42.9 | 174.7 | -73.2 | -179.9 | -166.5 | 0 | 0 | 111.1 | K55 V56 V61 T62 L63 | K55-E59 VanDerWaalsContact CE-OE1 3.3Å; K55-E59 WeakPolarHBondContact CE-OE1 3.42Å; K55-E59 WeakPolarHBondContact O-CG 3.29Å; K55-E59 PolarHBondContact O-N 3.5Å; V56-E59 PolarHBondContact O-N 3.04Å; E59-V61 VanDerWaalsContact C-N 3.34Å; E59-V61 PolarHBondContact O-N 2.8Å; E59-T62 PolarHBondContact O-N 3.39Å; E59-L63 WeakPolarHBondContact O-CB 3.36Å; E59-L63 VanDerWaalsContact O-CG 3.27Å; E59-L63 WeakPolarHBondContact O-CG 3.25Å; E59-L63 PolarHBondContact O-N 2.89Å |
| 60 | I | 98.7 | Very high | 98.4 | Very high | 67 Ų | 67 | 95.5 Ų | 95.5 | 34% | 0.344 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.5 | -45.4 | 175 | -72.6 | 166 | 0 | 0 | 0 | 110.8 | V56 E57 T62 L63 R64 | V56-I60 HydrophobicContact CG1-CD1 3.93Å; V56-I60 HydrophobicContact CG1-CG1 4.43Å; V56-I60 VanDerWaalsContact O-CG1 3.25Å; V56-I60 WeakPolarHBondContact O-CG1 3.48Å; V56-I60 PolarHBondContact O-N 3.45Å; E57-I60 PolarHBondContact O-N 3.33Å; I60-T62 VanDerWaalsContact C-N 3.33Å; I60-T62 PolarHBondContact O-N 2.93Å; I60-L63 PolarHBondContact O-N 2.89Å; I60-R64 VanDerWaalsContact CG2-CZ 3.46Å; I60-R64 VanDerWaalsContact O-CG 3.31Å; I60-R64 WeakPolarHBondContact O-CG 3.45Å; I60-R64 PolarHBondContact O-N 2.92Å |
| 61 | V | 98.8 | Very high | 98.4 | Very high | 70 Ų | 70 | 94.7 Ų | 94.7 | 42% | 0.424 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.2 | -46.3 | 176.9 | 170.3 | 0 | 0 | 0 | 0 | 110.3 | E57 E58 E59 L63 R64 Q65 | E57-V61 WeakPolarHBondContact O-CG2 3.41Å; E57-V61 PolarHBondContact O-N 3.22Å; E58-V61 PolarHBondContact O-N 2.91Å; E59-V61 VanDerWaalsContact C-N 3.34Å; E59-V61 PolarHBondContact O-N 2.8Å; V61-L63 PolarHBondContact O-N 3.03Å; V61-R64 WeakPolarHBondContact O-CB 3.48Å; V61-R64 PolarHBondContact O-N 2.92Å; V61-Q65 WeakPolarHBondContact O-CG 3.27Å; V61-Q65 PolarHBondContact O-N 3.41Å |
| 62 | T | 98.6 | Very high | 98.4 | Very high | 76 Ų | 76 | 99.7 Ų | 99.7 | 47% | 0.466 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.5 | -46.1 | 178.3 | -58.5 | 0 | 0 | 0 | 0 | 111.5 | E58 E59 I60 R64 Q65 V66 | E58-T62 WeakPolarHBondContact O-CB 3.3Å; E58-T62 PolarHBondContact O-N 2.97Å; E58-T62 PolarHBondContact O-OG1 3.49Å; E59-T62 PolarHBondContact O-N 3.39Å; I60-T62 VanDerWaalsContact C-N 3.33Å; I60-T62 PolarHBondContact O-N 2.93Å; T62-R64 VanDerWaalsContact C-N 3.32Å; T62-R64 PolarHBondContact O-N 3.24Å; T62-Q65 WeakPolarHBondContact O-CB 3.42Å; T62-Q65 PolarHBondContact O-N 2.83Å; T62-Q65 VanDerWaalsContact O-N 3.13Å; T62-V66 HydrophobicContact CG2-CG2 4.5Å; T62-V66 WeakPolarHBondContact O-CG2 3.4Å; T62-V66 PolarHBondContact O-N 2.89Å |
| 63 | L | 98.8 | Very high | 98.4 | Very high | 115 Ų | 115 | 99.9 Ų | 99.9 | 60% | 0.602 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.9 | -39.6 | 178.1 | -73 | 174.5 | 0 | 0 | 0 | 111.9 | E59 I60 V61 Q65 V66 L67 | E59-L63 WeakPolarHBondContact O-CB 3.36Å; E59-L63 VanDerWaalsContact O-CG 3.27Å; E59-L63 WeakPolarHBondContact O-CG 3.25Å; E59-L63 PolarHBondContact O-N 2.89Å; I60-L63 PolarHBondContact O-N 2.89Å; V61-L63 PolarHBondContact O-N 3.03Å; L63-Q65 VanDerWaalsContact C-N 3.34Å; L63-Q65 PolarHBondContact O-N 2.9Å; L63-V66 PolarHBondContact O-N 3.39Å; L63-L67 WeakPolarHBondContact O-CB 3.31Å; L63-L67 PolarHBondContact O-N 3.13Å |
| 64 | R | 98.8 | Very high | 98.3 | Very high | 172 Ų | 172 | 97.8 Ų | 97.8 | 65% | 0.649 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.7 | -42 | 173.5 | -74.2 | 170.6 | 176 | 157.6 | 1.1 | 111.7 | I60 V61 T62 L67 A68 | I60-R64 VanDerWaalsContact CG2-CZ 3.46Å; I60-R64 VanDerWaalsContact O-CG 3.31Å; I60-R64 WeakPolarHBondContact O-CG 3.45Å; I60-R64 PolarHBondContact O-N 2.92Å; V61-R64 WeakPolarHBondContact O-CB 3.48Å; V61-R64 PolarHBondContact O-N 2.92Å; T62-R64 VanDerWaalsContact C-N 3.32Å; T62-R64 PolarHBondContact O-N 3.24Å; R64-L67 PolarHBondContact O-N 3.25Å; R64-A68 WeakPolarHBondContact O-CB 3.47Å; R64-A68 PolarHBondContact O-N 2.89Å |
| 65 | Q | 98.8 | Very high | 98 | Very high | 120 Ų | 120 | 95.5 Ų | 95.5 | 56% | 0.561 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -64.4 | -43.5 | 176.2 | -68.2 | 171.1 | 2.7 | 0 | 0 | 111.8 | V61 T62 L63 A68 A69 | V61-Q65 WeakPolarHBondContact O-CG 3.27Å; V61-Q65 PolarHBondContact O-N 3.41Å; T62-Q65 WeakPolarHBondContact O-CB 3.42Å; T62-Q65 PolarHBondContact O-N 2.83Å; T62-Q65 VanDerWaalsContact O-N 3.13Å; L63-Q65 VanDerWaalsContact C-N 3.34Å; L63-Q65 PolarHBondContact O-N 2.9Å; Q65-A68 PolarHBondContact O-N 3.34Å; Q65-A69 WeakPolarHBondContact O-CB 3.49Å; Q65-A69 PolarHBondContact O-N 3.4Å |
| 66 | V | 98.8 | Very high | 97.8 | Very high | 69 Ų | 69 | 92.3 Ų | 92.3 | 42% | 0.418 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.8 | -43.2 | 176.2 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | T62 L63 A69 K70 | T62-V66 HydrophobicContact CG2-CG2 4.5Å; T62-V66 WeakPolarHBondContact O-CG2 3.4Å; T62-V66 PolarHBondContact O-N 2.89Å; L63-V66 PolarHBondContact O-N 3.39Å; V66-A69 WeakPolarHBondContact O-CB 3.39Å; V66-A69 PolarHBondContact O-N 2.61Å; V66-K70 HydrophobicContact CG1-CD 4.45Å; V66-K70 WeakPolarHBondContact O-CG 3.49Å; V66-K70 PolarHBondContact O-N 3.49Å |
| 67 | L | 98.7 | Very high | 97.7 | Very high | 96 Ų | 96 | 93.6 Ų | 93.6 | 50% | 0.503 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60.6 | -50.7 | 175.8 | -178.6 | 62.9 | 0 | 0 | 0 | 110.7 | L63 R64 A69 K70 E71 | L63-L67 WeakPolarHBondContact O-CB 3.31Å; L63-L67 PolarHBondContact O-N 3.13Å; R64-L67 PolarHBondContact O-N 3.25Å; L67-A69 PolarHBondContact O-N 2.93Å; L67-K70 CarbonylContact O-C 3.57Å; L67-K70 WeakPolarHBondContact O-CA 3.35Å; L67-K70 WeakPolarHBondContact O-CB 3.39Å; L67-K70 PolarHBondContact O-N 3.26Å; L67-E71 HydrophobicContact CD1-CG 4.47Å; L67-E71 HydrophobicContact CG-CG 4.46Å; L67-E71 WeakPolarHBondContact O-CG 3.48Å; L67-E71 PolarHBondContact O-N 2.82Å |
| 68 | A | 98.3 | Very high | 97.4 | Very high | 37 Ų | 37 | 93.6 Ų | 93.6 | 31% | 0.306 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -58.3 | -35.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R64 Q65 R72 | R64-A68 WeakPolarHBondContact O-CB 3.47Å; R64-A68 PolarHBondContact O-N 2.89Å; Q65-A68 PolarHBondContact O-N 3.34Å; A68-R72 WeakPolarHBondContact O-CB 3.48Å; A68-R72 WeakPolarHBondContact O-CG 3.2Å; A68-R72 PolarHBondContact O-N 3Å |
| 69 | A | 98.4 | Very high | 97 | Very high | 38 Ų | 38 | 94.3 Ų | 94.3 | 31% | 0.314 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65.7 | -43.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q65 V66 L67 R72 H73 | Q65-A69 WeakPolarHBondContact O-CB 3.49Å; Q65-A69 PolarHBondContact O-N 3.4Å; V66-A69 WeakPolarHBondContact O-CB 3.39Å; V66-A69 PolarHBondContact O-N 2.61Å; L67-A69 PolarHBondContact O-N 2.93Å; A69-R72 PolarHBondContact O-N 2.74Å; A69-H73 PolarHBondContact O-N 3.02Å |
| 70 | K | 98.1 | Very high | 96.6 | Very high | 142 Ų | 142 | 98.8 Ų | 98.8 | 62% | 0.617 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -66.2 | -39.1 | 175.4 | -74.4 | -179.3 | -176.2 | -77.2 | 0 | 112.3 | V66 L67 H73 C74 | V66-K70 HydrophobicContact CG1-CD 4.45Å; V66-K70 WeakPolarHBondContact O-CG 3.49Å; V66-K70 PolarHBondContact O-N 3.49Å; L67-K70 CarbonylContact O-C 3.57Å; L67-K70 WeakPolarHBondContact O-CA 3.35Å; L67-K70 WeakPolarHBondContact O-CB 3.39Å; L67-K70 PolarHBondContact O-N 3.26Å; K70-H73 PolarHBondContact O-N 3.03Å; K70-C74 WeakPolarHBondContact O-CB 3.46Å; K70-C74 PolarHBondContact O-N 3.44Å |
| 71 | E | 97.2 | Very high | 96.1 | Very high | 121 Ų | 121 | 101.2 Ų | 101.2 | 57% | 0.565 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.5 | -44.6 | 175.2 | -71.9 | 175.4 | 156.3 | 0 | 0 | 111.3 | L67 H73 C74 G75 | L67-E71 HydrophobicContact CD1-CG 4.47Å; L67-E71 HydrophobicContact CG-CG 4.46Å; L67-E71 WeakPolarHBondContact O-CG 3.48Å; L67-E71 PolarHBondContact O-N 2.82Å; E71-H73 VanDerWaalsContact C-N 3.34Å; E71-H73 PolarHBondContact O-N 2.83Å; E71-C74 PolarHBondContact O-N 3.24Å; E71-G75 PolarHBondContact O-N 3.28Å |
| 72 | R | 97.3 | Very high | 95.5 | Very high | 167 Ų | 167 | 99.6 Ų | 99.6 | 63% | 0.63 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -59.1 | -44.1 | 172 | -81.6 | -174 | -81.1 | 101.1 | -5.7 | 112.1 | A68 A69 G75 E76 | A68-R72 WeakPolarHBondContact O-CB 3.48Å; A68-R72 WeakPolarHBondContact O-CG 3.2Å; A68-R72 PolarHBondContact O-N 3Å; A69-R72 PolarHBondContact O-N 2.74Å; R72-G75 PolarHBondContact O-N 3.07Å; R72-E76 PolarHBondContact O-N 2.98Å |
| 73 | H | 97.6 | Very high | 94.8 | Very high | 121 Ų | 121 | 100.3 Ų | 100.3 | 56% | 0.56 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.1 | -41.9 | 177.7 | -177.5 | -115.8 | 0 | 0 | 0 | 112.1 | A69 K70 E71 G75 E76 L77 | A69-H73 PolarHBondContact O-N 3.02Å; K70-H73 PolarHBondContact O-N 3.03Å; E71-H73 VanDerWaalsContact C-N 3.34Å; E71-H73 PolarHBondContact O-N 2.83Å; H73-G75 VanDerWaalsContact C-N 3.33Å; H73-G75 PolarHBondContact O-N 3.46Å; H73-E76 PolarHBondContact O-N 2.89Å; H73-L77 WeakPolarHBondContact O-CB 3.43Å; H73-L77 PolarHBondContact O-N 3.46Å |
| 74 | C | 95.8 | Very high | 93.5 | Very high | 57 Ų | 57 | 97 Ų | 97 | 39% | 0.385 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.3 | -43.6 | 173.2 | -177 | 0 | 0 | 0 | 0 | 111.5 | K70 E71 E76 L77 K78 | K70-C74 WeakPolarHBondContact O-CB 3.46Å; K70-C74 PolarHBondContact O-N 3.44Å; E71-C74 PolarHBondContact O-N 3.24Å; C74-E76 PolarHBondContact O-N 3.3Å; C74-L77 PolarHBondContact O-N 3.29Å; C74-K78 WeakPolarHBondContact O-CG 3.42Å; C74-K78 PolarHBondContact O-N 3.49Å |
| 75 | G | 93.1 | Very high | 91.9 | Very high | 23 Ų | 23 | 93.2 Ų | 93.2 | 24% | 0.237 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -59.9 | -43.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | E71 R72 H73 K78 R79 | E71-G75 PolarHBondContact O-N 3.28Å; R72-G75 PolarHBondContact O-N 3.07Å; H73-G75 VanDerWaalsContact C-N 3.33Å; H73-G75 PolarHBondContact O-N 3.46Å; G75-K78 PolarHBondContact O-N 3.06Å; G75-R79 PolarHBondContact O-N 3.47Å |
| 76 | E | 94.6 | Very high | 90.5 | Very high | 56 Ų | 56 | 92.2 Ų | 92.2 | 26% | 0.262 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 174.6 | 175.7 | 60.5 | -168 | 0 | 0 | 112.1 | R72 H73 C74 K78 R79 R80 | R72-E76 PolarHBondContact O-N 2.98Å; H73-E76 PolarHBondContact O-N 2.89Å; C74-E76 PolarHBondContact O-N 3.3Å; E76-K78 PolarHBondContact O-N 3.46Å; E76-R79 WeakPolarHBondContact O-CB 3.49Å; E76-R79 PolarHBondContact O-N 2.94Å; E76-R79 IonicContact OE2-CZ 2.87Å; E76-R79 IonicContact OE2-NE 2.61Å; E76-R79 PolarHBondContact OE2-NE 2.93Å; E76-R79 IonicContact OE2-NH2 3.54Å; E76-R79 PolarHBondContact OE2-NH2 3.38Å; E76-R80 WeakPolarHBondContact O-CG 3.39Å; E76-R80 PolarHBondContact O-N 3.4Å; E76-R80 IonicContact OE1-CZ 3.18Å; E76-R80 IonicContact OE1-NE 3.07Å; E76-R80 PolarHBondContact OE1-NE 3.3Å; E76-R80 IonicContact OE1-NH2 3.02Å; E76-R80 PolarHBondContact OE1-NH2 3.18Å |
| 77 | L | 95.2 | Very high | 89.2 | Confident | 87 Ų | 87 | 90.7 Ų | 90.7 | 46% | 0.455 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.3 | -40.7 | 178.2 | -157.6 | 69.9 | 0 | 0 | 0 | 111.5 | H73 C74 R79 R80 L81 | H73-L77 WeakPolarHBondContact O-CB 3.43Å; H73-L77 PolarHBondContact O-N 3.46Å; C74-L77 PolarHBondContact O-N 3.29Å; L77-R79 VanDerWaalsContact C-N 3.33Å; L77-R79 PolarHBondContact O-N 2.89Å; L77-R80 PolarHBondContact O-N 3.41Å; L77-L81 HydrophobicContact CG-CD1 4.3Å; L77-L81 WeakPolarHBondContact O-CB 3.25Å; L77-L81 VanDerWaalsContact O-CG 3.25Å; L77-L81 WeakPolarHBondContact O-CG 3.16Å; L77-L81 PolarHBondContact O-N 3.26Å |
| 78 | K | 92.5 | Very high | 87.9 | Confident | 109 Ų | 109 | 92.8 Ų | 92.8 | 47% | 0.474 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.4 | -38.5 | 172.9 | -75 | 175.8 | 179.7 | 174.1 | 0 | 112.5 | C74 G75 E76 G82 L83 S84 | C74-K78 WeakPolarHBondContact O-CG 3.42Å; C74-K78 PolarHBondContact O-N 3.49Å; G75-K78 PolarHBondContact O-N 3.06Å; E76-K78 PolarHBondContact O-N 3.46Å; K78-G82 PolarHBondContact O-N 3.39Å; K78-L83 HydrophobicContact CB-CB 4.33Å; K78-L83 HydrophobicContact CG-CD1 4.5Å; K78-L83 PolarHBondContact O-N 3.36Å; K78-S84 PolarHBondContact O-N 3.46Å |
| 79 | R | 89.9 | Confident | 86.9 | Confident | 141 Ų | 141 | 95.5 Ų | 95.5 | 53% | 0.532 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.6 | -48.4 | 173.5 | -77.2 | -169.2 | -63.5 | -93.7 | 8.9 | 111.6 | G75 E76 L77 L81 G82 S84 | G75-R79 PolarHBondContact O-N 3.47Å; E76-R79 WeakPolarHBondContact O-CB 3.49Å; E76-R79 PolarHBondContact O-N 2.94Å; E76-R79 IonicContact OE2-CZ 2.87Å; E76-R79 IonicContact OE2-NE 2.61Å; E76-R79 PolarHBondContact OE2-NE 2.93Å; E76-R79 IonicContact OE2-NH2 3.54Å; E76-R79 PolarHBondContact OE2-NH2 3.38Å; L77-R79 VanDerWaalsContact C-N 3.33Å; L77-R79 PolarHBondContact O-N 2.89Å; R79-L81 VanDerWaalsContact C-N 3.26Å; R79-L81 PolarHBondContact O-N 2.88Å; R79-G82 PolarHBondContact O-N 2.95Å; R79-S84 WeakPolarHBondContact CG-OG 3.41Å; R79-S84 PolarHBondContact N-OG 3.04Å |
| 80 | R | 89.9 | Confident | 86 | Confident | 191 Ų | 191 | 101.1 Ų | 101.1 | 72% | 0.721 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.2 | -35.6 | 178.2 | -70.7 | -179.7 | -176.4 | -141.6 | -2.6 | 112.8 | E76 L77 G82 | E76-R80 WeakPolarHBondContact O-CG 3.39Å; E76-R80 PolarHBondContact O-N 3.4Å; E76-R80 IonicContact OE1-CZ 3.18Å; E76-R80 IonicContact OE1-NE 3.07Å; E76-R80 PolarHBondContact OE1-NE 3.3Å; E76-R80 IonicContact OE1-NH2 3.02Å; E76-R80 PolarHBondContact OE1-NH2 3.18Å; L77-R80 PolarHBondContact O-N 3.41Å; R80-G82 PolarHBondContact O-N 3.27Å |
| 81 | L | 89.6 | Confident | 85.3 | Confident | 118 Ų | 118 | 99.9 Ų | 99.9 | 62% | 0.618 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | 1 | 174.8 | -67.3 | 172.4 | 0 | 0 | 0 | 113.5 | L77 R79 L83 | L77-L81 HydrophobicContact CG-CD1 4.3Å; L77-L81 WeakPolarHBondContact O-CB 3.25Å; L77-L81 VanDerWaalsContact O-CG 3.25Å; L77-L81 WeakPolarHBondContact O-CG 3.16Å; L77-L81 PolarHBondContact O-N 3.26Å; R79-L81 VanDerWaalsContact C-N 3.26Å; R79-L81 PolarHBondContact O-N 2.88Å; L81-L83 HydrophobicContact CB-CD1 4.2Å; L81-L83 HydrophobicContact CB-CG 4.08Å; L81-L83 HydrophobicContact CD1-CD1 4.44Å; L81-L83 PolarHBondContact O-N 2.91Å |
| 82 | G | 86 | Confident | 84.6 | Confident | 35 Ų | 35 | 98.3 Ų | 98.3 | 36% | 0.361 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.9 | 13.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | K78 R79 R80 T85 | K78-G82 PolarHBondContact O-N 3.39Å; R79-G82 PolarHBondContact O-N 2.95Å; R80-G82 PolarHBondContact O-N 3.27Å; G82-T85 PolarHBondContact O-OG1 3.41Å |
| 83 | L | 82.8 | Confident | 83.8 | Confident | 91 Ų | 91 | 95.2 Ų | 95.2 | 48% | 0.476 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -79.5 | -24.1 | 179.6 | -61.2 | 176 | 0 | 0 | 0 | 112.2 | K78 L81 L86 G87 | K78-L83 HydrophobicContact CB-CB 4.33Å; K78-L83 HydrophobicContact CG-CD1 4.5Å; K78-L83 PolarHBondContact O-N 3.36Å; L81-L83 HydrophobicContact CB-CD1 4.2Å; L81-L83 HydrophobicContact CB-CG 4.08Å; L81-L83 HydrophobicContact CD1-CD1 4.44Å; L81-L83 PolarHBondContact O-N 2.91Å; L83-L86 PolarHBondContact O-N 3.36Å; L83-G87 PolarHBondContact O-N 3.4Å |
| 84 | S | 71.4 | Confident | 83.1 | Confident | 46 Ų | 46 | 92.8 Ų | 92.8 | 32% | 0.322 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.6 | -40.4 | 176.6 | -66.9 | 0 | 0 | 0 | 0 | 112.6 | K78 R79 G87 | K78-S84 PolarHBondContact O-N 3.46Å; R79-S84 WeakPolarHBondContact CG-OG 3.41Å; R79-S84 PolarHBondContact N-OG 3.04Å; S84-G87 PolarHBondContact O-N 3.3Å |
| 85 | T | 66.4 | Low | 82.6 | Confident | 92 Ų | 92 | 97.1 Ų | 97.1 | 56% | 0.564 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -71.8 | -31.9 | 176.2 | 52.3 | 0 | 0 | 0 | 0 | 112.1 | G82 G87 E88 L89 | G82-T85 PolarHBondContact O-OG1 3.41Å; T85-G87 VanDerWaalsContact C-N 3.28Å; T85-G87 PolarHBondContact O-N 2.86Å; T85-E88 PolarHBondContact O-N 3.2Å; T85-L89 PolarHBondContact O-N 3.41Å |
| 86 | L | 68.7 | Low | 82.1 | Confident | 100 Ų | 100 | 99 Ų | 99 | 52% | 0.524 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.7 | -30.9 | 174.8 | -160.1 | 71.3 | 0 | 0 | 0 | 112.3 | L83 L89 K90 | L83-L86 PolarHBondContact O-N 3.36Å; L86-L89 HydrophobicContact CD1-CD2 4.35Å; L86-K90 WeakPolarHBondContact O-CB 3.34Å; L86-K90 PolarHBondContact O-N 3.04Å |
| 87 | G | 71 | Confident | 81.6 | Confident | 37 Ų | 37 | 105.4 Ų | 105.4 | 38% | 0.381 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.4 | -44.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L83 S84 T85 K90 Q91 | L83-G87 PolarHBondContact O-N 3.4Å; S84-G87 PolarHBondContact O-N 3.3Å; T85-G87 VanDerWaalsContact C-N 3.28Å; T85-G87 PolarHBondContact O-N 2.86Å; G87-K90 PolarHBondContact O-N 3.01Å; G87-Q91 WeakPolarHBondContact O-CG 3.46Å; G87-Q91 PolarHBondContact O-N 3.42Å |
| 88 | E | 72.3 | Confident | 81 | Confident | 139 Ų | 139 | 106.6 Ų | 106.6 | 65% | 0.65 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.8 | -40.3 | 175.5 | -72.6 | 166.1 | -174.4 | 0 | 0 | 111.8 | T85 Q91 N92 | T85-E88 PolarHBondContact O-N 3.2Å; E88-Q91 PolarHBondContact O-N 3.34Å; E88-N92 WeakPolarHBondContact O-CB 3.37Å; E88-N92 PolarHBondContact O-N 2.99Å |
| 89 | L | 77.3 | Confident | 80.4 | Confident | 95 Ų | 95 | 106.9 Ų | 106.9 | 50% | 0.497 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.2 | -45.7 | 173.7 | -175.9 | 64.4 | 0 | 0 | 0 | 111.5 | T85 L86 Q91 N92 L93 | T85-L89 PolarHBondContact O-N 3.41Å; L86-L89 HydrophobicContact CD1-CD2 4.35Å; L89-Q91 VanDerWaalsContact C-N 3.31Å; L89-Q91 PolarHBondContact O-N 3.23Å; L89-N92 PolarHBondContact O-N 3.46Å; L89-L93 HydrophobicContact CD1-CD1 3.58Å; L89-L93 HydrophobicContact CG-CD1 3.99Å; L89-L93 WeakPolarHBondContact O-CB 3.36Å; L89-L93 WeakPolarHBondContact O-CD1 3.28Å; L89-L93 PolarHBondContact O-N 3.45Å |
| 90 | K | 79.9 | Confident | 79.5 | Confident | 156 Ų | 156 | 104.6 Ų | 104.6 | 68% | 0.678 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.3 | -39.6 | 176.9 | -175.2 | -179.8 | 178.7 | -175.9 | 0 | 112.1 | L86 G87 S94 | L86-K90 WeakPolarHBondContact O-CB 3.34Å; L86-K90 PolarHBondContact O-N 3.04Å; G87-K90 PolarHBondContact O-N 3.01Å; K90-S94 WeakPolarHBondContact O-CB 3.37Å; K90-S94 PolarHBondContact O-N 2.94Å; K90-S94 PolarHBondContact O-OG 2.86Å |
| 91 | Q | 83.1 | Confident | 78.7 | Confident | 116 Ų | 116 | 100.9 Ų | 100.9 | 54% | 0.542 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.5 | -38.6 | 175.2 | -74.3 | -145.7 | -13.9 | 0 | 0 | 112.7 | G87 E88 L89 S94 R95 | G87-Q91 WeakPolarHBondContact O-CG 3.46Å; G87-Q91 PolarHBondContact O-N 3.42Å; E88-Q91 PolarHBondContact O-N 3.34Å; L89-Q91 VanDerWaalsContact C-N 3.31Å; L89-Q91 PolarHBondContact O-N 3.23Å; Q91-S94 PolarHBondContact O-N 2.92Å; Q91-R95 PolarHBondContact O-N 3.2Å |
| 92 | N | 81.5 | Confident | 77.7 | Confident | 87 Ų | 87 | 99.2 Ų | 99.2 | 47% | 0.465 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65 | -41.8 | 175.4 | -168.7 | -67.2 | 0 | 0 | 0 | 111.5 | E88 L89 R95 S96 | E88-N92 WeakPolarHBondContact O-CB 3.37Å; E88-N92 PolarHBondContact O-N 2.99Å; L89-N92 PolarHBondContact O-N 3.46Å; N92-R95 PolarHBondContact O-N 3.45Å; N92-S96 WeakPolarHBondContact O-CB 3.44Å; N92-S96 PolarHBondContact O-N 2.97Å; N92-S96 PolarHBondContact O-OG 2.96Å; N92-S96 PolarHBondContact OD1-OG 2.93Å |
| 93 | L | 81.5 | Confident | 76.6 | Confident | 102 Ų | 102 | 100.8 Ų | 100.8 | 53% | 0.534 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.7 | -40.9 | 174.1 | -95.4 | 66.9 | 0 | 0 | 0 | 112.2 | L89 R95 S96 W97 | L89-L93 HydrophobicContact CD1-CD1 3.58Å; L89-L93 HydrophobicContact CG-CD1 3.99Å; L89-L93 WeakPolarHBondContact O-CB 3.36Å; L89-L93 WeakPolarHBondContact O-CD1 3.28Å; L89-L93 PolarHBondContact O-N 3.45Å; L93-R95 VanDerWaalsContact C-N 3.35Å; L93-R95 PolarHBondContact O-N 3.49Å; L93-S96 PolarHBondContact O-N 2.84Å; L93-W97 WeakPolarHBondContact O-CB 3.33Å; L93-W97 PolarHBondContact O-N 2.78Å |
| 94 | S | 83.5 | Confident | 75.4 | Confident | 70 Ų | 70 | 98.2 Ų | 98.2 | 49% | 0.49 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.8 | -40.7 | 176.3 | -64.6 | 0 | 0 | 0 | 0 | 111.9 | K90 Q91 H98 | K90-S94 WeakPolarHBondContact O-CB 3.37Å; K90-S94 PolarHBondContact O-N 2.94Å; K90-S94 PolarHBondContact O-OG 2.86Å; Q91-S94 PolarHBondContact O-N 2.92Å; S94-H98 VanDerWaalsContact O-CB 3.28Å; S94-H98 WeakPolarHBondContact O-CB 3.48Å; S94-H98 PolarHBondContact O-N 3.41Å |
| 95 | R | 84.2 | Confident | 74.7 | Confident | 149 Ų | 149 | 100 Ų | 100 | 56% | 0.562 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -66.2 | -47.1 | 174.4 | -81.1 | -172.8 | -74.2 | -94.6 | -0 | 112 | Q91 N92 L93 W97 H98 D99 | Q91-R95 PolarHBondContact O-N 3.2Å; N92-R95 PolarHBondContact O-N 3.45Å; L93-R95 VanDerWaalsContact C-N 3.35Å; L93-R95 PolarHBondContact O-N 3.49Å; R95-W97 VanDerWaalsContact C-N 3.33Å; R95-W97 PolarHBondContact O-N 3.41Å; R95-H98 PolarHBondContact O-N 2.99Å; R95-D99 WeakPolarHBondContact O-CB 3.25Å; R95-D99 PolarHBondContact O-N 3.44Å |
| 96 | S | 82.9 | Confident | 74.2 | Confident | 61 Ų | 61 | 103.2 Ų | 103.2 | 43% | 0.427 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.6 | -38.9 | 178.8 | -61.5 | 0 | 0 | 0 | 0 | 112.1 | N92 L93 D99 V100 | N92-S96 WeakPolarHBondContact O-CB 3.44Å; N92-S96 PolarHBondContact O-N 2.97Å; N92-S96 PolarHBondContact O-OG 2.96Å; N92-S96 PolarHBondContact OD1-OG 2.93Å; L93-S96 PolarHBondContact O-N 2.84Å; S96-D99 PolarHBondContact O-N 2.83Å; S96-V100 VanDerWaalsContact O-CG2 3.3Å; S96-V100 WeakPolarHBondContact O-CG2 3.41Å; S96-V100 PolarHBondContact O-N 3.18Å |
| 97 | W | 83.3 | Confident | 73.7 | Confident | 192 Ų | 192 | 100.2 Ų | 100.2 | 73% | 0.727 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64.3 | -43.6 | 173.2 | -178.6 | -91.1 | 0 | 0 | 0 | 111.8 | L93 R95 D99 V100 Q101 | L93-W97 WeakPolarHBondContact O-CB 3.33Å; L93-W97 PolarHBondContact O-N 2.78Å; R95-W97 VanDerWaalsContact C-N 3.33Å; R95-W97 PolarHBondContact O-N 3.41Å; W97-D99 VanDerWaalsContact C-N 3.33Å; W97-V100 PolarHBondContact O-N 2.87Å; W97-Q101 WeakPolarHBondContact O-CB 2.98Å; W97-Q101 PolarHBondContact O-N 3.33Å |
| 98 | H | 83.1 | Confident | 73.2 | Confident | 112 Ų | 112 | 102.3 Ų | 102.3 | 52% | 0.519 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.7 | -40.7 | 175.8 | -170.7 | 50.5 | 0 | 0 | 0 | 111.6 | S94 R95 V100 Q101 V102 | S94-H98 VanDerWaalsContact O-CB 3.28Å; S94-H98 WeakPolarHBondContact O-CB 3.48Å; S94-H98 PolarHBondContact O-N 3.41Å; R95-H98 PolarHBondContact O-N 2.99Å; H98-V100 VanDerWaalsContact C-N 3.34Å; H98-V100 PolarHBondContact O-N 3.48Å; H98-Q101 WeakPolarHBondContact O-CB 3.48Å; H98-Q101 PolarHBondContact O-N 2.94Å; H98-V102 WeakPolarHBondContact O-CB 3.49Å; H98-V102 VanDerWaalsContact O-CG2 3.25Å; H98-V102 WeakPolarHBondContact O-CG2 3.45Å; H98-V102 PolarHBondContact O-N 3.4Å |
| 99 | D | 79.7 | Confident | 72.6 | Confident | 114 Ų | 114 | 100.9 Ų | 100.9 | 61% | 0.61 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.6 | -39.7 | 176.4 | -163 | 46.6 | 0 | 0 | 0 | 111.4 | R95 S96 W97 S103 | R95-D99 WeakPolarHBondContact O-CB 3.25Å; R95-D99 PolarHBondContact O-N 3.44Å; S96-D99 PolarHBondContact O-N 2.83Å; W97-D99 VanDerWaalsContact C-N 3.33Å; D99-S103 WeakPolarHBondContact O-CA 3.3Å; D99-S103 WeakPolarHBondContact O-CB 3.19Å; D99-S103 PolarHBondContact O-N 2.82Å |
| 100 | V | 72.2 | Confident | 72 | Confident | 93 Ų | 93 | 101.5 Ų | 101.5 | 56% | 0.564 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67 | -39.1 | 172.2 | 170.9 | 0 | 0 | 0 | 0 | 111.8 | S96 W97 H98 S104 | S96-V100 VanDerWaalsContact O-CG2 3.3Å; S96-V100 WeakPolarHBondContact O-CG2 3.41Å; S96-V100 PolarHBondContact O-N 3.18Å; W97-V100 PolarHBondContact O-N 2.87Å; H98-V100 VanDerWaalsContact C-N 3.34Å; H98-V100 PolarHBondContact O-N 3.48Å; V100-S104 WeakPolarHBondContact O-CA 3.34Å; V100-S104 WeakPolarHBondContact O-CB 3.07Å; V100-S104 PolarHBondContact O-N 2.93Å; V100-S104 PolarHBondContact O-OG 3.35Å |
| 101 | Q | 71.9 | Confident | 71.3 | Confident | 113 Ų | 113 | 100.8 Ų | 100.8 | 53% | 0.528 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65 | -46.4 | 176.7 | -173.5 | -179.3 | 5.9 | 0 | 0 | 111.2 | W97 H98 S104 A105 | W97-Q101 WeakPolarHBondContact O-CB 2.98Å; W97-Q101 PolarHBondContact O-N 3.33Å; H98-Q101 WeakPolarHBondContact O-CB 3.48Å; H98-Q101 PolarHBondContact O-N 2.94Å; Q101-S104 PolarHBondContact O-N 3.27Å; Q101-S104 PolarHBondContact O-OG 3.4Å; Q101-A105 PolarHBondContact O-N 3.17Å |
| 102 | V | 69 | Low | 70.7 | Confident | 83 Ų | 83 | 98.1 Ų | 98.1 | 50% | 0.503 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68 | -38.5 | 178.3 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | H98 A105 | H98-V102 WeakPolarHBondContact O-CB 3.49Å; H98-V102 VanDerWaalsContact O-CG2 3.25Å; H98-V102 WeakPolarHBondContact O-CG2 3.45Å; H98-V102 PolarHBondContact O-N 3.4Å; V102-A105 PolarHBondContact O-N 2.8Å |
| 103 | S | 62.4 | Low | 70.5 | Confident | 69 Ų | 69 | 99.8 Ų | 99.8 | 48% | 0.483 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -70.4 | -37.2 | 174.9 | -175.5 | 0 | 0 | 0 | 0 | 112.3 | D99 A105 N106 S107 | D99-S103 WeakPolarHBondContact O-CA 3.3Å; D99-S103 WeakPolarHBondContact O-CB 3.19Å; D99-S103 PolarHBondContact O-N 2.82Å; S103-A105 VanDerWaalsContact C-N 3.26Å; S103-A105 PolarHBondContact O-N 3.14Å; S103-N106 PolarHBondContact O-N 3.24Å; S103-S107 WeakPolarHBondContact O-CB 3.15Å; S103-S107 PolarHBondContact O-N 3.17Å |
| 104 | S | 57.3 | Low | 70.3 | Confident | 37 Ų | 37 | 100.8 Ų | 100.8 | 26% | 0.259 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67.1 | -25.4 | 175.4 | 71.5 | 0 | 0 | 0 | 0 | 113.3 | V100 Q101 N106 F110 | V100-S104 WeakPolarHBondContact O-CA 3.34Å; V100-S104 WeakPolarHBondContact O-CB 3.07Å; V100-S104 PolarHBondContact O-N 2.93Å; V100-S104 PolarHBondContact O-OG 3.35Å; Q101-S104 PolarHBondContact O-N 3.27Å; Q101-S104 PolarHBondContact O-OG 3.4Å; S104-N106 VanDerWaalsContact C-N 3.27Å; S104-N106 PolarHBondContact O-N 2.79Å; S104-F110 VanDerWaalsContact O-CB 3.32Å; S104-F110 WeakPolarHBondContact O-CB 3.32Å |
| 105 | A | 57.8 | Low | 70.1 | Confident | 82 Ų | 82 | 102 Ų | 102 | 68% | 0.678 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73 | -16.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q101 V102 S103 | Q101-A105 PolarHBondContact O-N 3.17Å; V102-A105 PolarHBondContact O-N 2.8Å; S103-A105 VanDerWaalsContact C-N 3.26Å; S103-A105 PolarHBondContact O-N 3.14Å |
| 106 | N | 54.9 | Low | 70.1 | Confident | 161 Ų | 161 | 102.5 Ų | 102.5 | 86% | 0.861 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -130.1 | 1 | -179.6 | -107.5 | -35.4 | 0 | 0 | 0 | 114.5 | S103 S104 | S103-N106 PolarHBondContact O-N 3.24Å; S104-N106 VanDerWaalsContact C-N 3.27Å; S104-N106 PolarHBondContact O-N 2.79Å |
| 107 | S | 58.1 | Low | 70.1 | Confident | 36 Ų | 36 | 103.1 Ų | 103.1 | 25% | 0.252 | 55% | 0.548 | S | S | . | . | trans | -86.2 | 128.7 | -177.2 | 170.9 | 0 | 0 | 0 | 0 | 112.2 | S103 T109 F110 K111 | S103-S107 WeakPolarHBondContact O-CB 3.15Å; S103-S107 PolarHBondContact O-N 3.17Å; S107-T109 PolarHBondContact O-N 2.96Å; S107-T109 WeakPolarHBondContact OG-CB 3.5Å; S107-T109 PolarHBondContact OG-N 3.41Å; S107-T109 VanDerWaalsContact OG-N 3.14Å; S107-T109 PolarHBondContact OG-OG1 2.74Å; S107-F110 PolarHBondContact O-N 3.43Å; S107-K111 PolarHBondContact O-N 3.05Å | ||
| 108 | A | 60.6 | Low | 69.8 | Low | 82 Ų | 82 | 95.9 Ų | 95.9 | 68% | 0.678 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -53.8 | -22.7 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113 | S112 | A108-S112 VanDerWaalsContact O-CB 3.29Å; A108-S112 WeakPolarHBondContact O-CB 3.29Å; A108-S112 PolarHBondContact O-N 3.02Å |
| 109 | T | 61 | Low | 69.5 | Low | 109 Ų | 109 | 93.9 Ų | 93.9 | 67% | 0.669 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -70.5 | -37.4 | 177.5 | -46.1 | 0 | 0 | 0 | 0 | 112.6 | S107 F113 | S107-T109 PolarHBondContact O-N 2.96Å; S107-T109 WeakPolarHBondContact OG-CB 3.5Å; S107-T109 PolarHBondContact OG-N 3.41Å; S107-T109 VanDerWaalsContact OG-N 3.14Å; S107-T109 PolarHBondContact OG-OG1 2.74Å; T109-F113 WeakPolarHBondContact O-CB 3.42Å; T109-F113 PolarHBondContact O-N 3.32Å; T109-F113 VanDerWaalsContact O-N 3.15Å |
| 110 | F | 65.1 | Low | 69.5 | Low | 107 Ų | 107 | 93.1 Ų | 93.1 | 47% | 0.469 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -73 | -41.8 | 176.8 | -172.5 | -101.4 | 0 | 0 | 0 | 110.9 | S104 S107 S112 F113 E114 | S104-F110 VanDerWaalsContact O-CB 3.32Å; S104-F110 WeakPolarHBondContact O-CB 3.32Å; S107-F110 PolarHBondContact O-N 3.43Å; F110-S112 PolarHBondContact O-N 2.94Å; F110-F113 WeakPolarHBondContact O-CB 3.45Å; F110-F113 PolarHBondContact O-N 3.14Å; F110-F113 VanDerWaalsContact O-N 3.14Å; F110-E114 PolarHBondContact O-N 3.49Å |
| 111 | K | 64.4 | Low | 69.4 | Low | 141 Ų | 141 | 96 Ų | 96 | 61% | 0.613 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -60.7 | -45.2 | 175.2 | -166.3 | 171.6 | 179.1 | 173.5 | 0 | 112.4 | S107 F113 E114 D115 | S107-K111 PolarHBondContact O-N 3.05Å; K111-F113 VanDerWaalsContact C-N 3.28Å; K111-F113 PolarHBondContact O-N 3.37Å; K111-E114 PolarHBondContact O-N 3.06Å; K111-D115 WeakPolarHBondContact O-CB 3.22Å; K111-D115 VanDerWaalsContact O-CG 3.25Å; K111-D115 PolarHBondContact O-N 3.27Å |
| 112 | S | 70 | Confident | 69 | Low | 61 Ų | 61 | 94.2 Ų | 94.2 | 43% | 0.427 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.5 | -31.8 | 175 | -176.3 | 0 | 0 | 0 | 0 | 112.9 | A108 F110 R116 | A108-S112 VanDerWaalsContact O-CB 3.29Å; A108-S112 WeakPolarHBondContact O-CB 3.29Å; A108-S112 PolarHBondContact O-N 3.02Å; F110-S112 PolarHBondContact O-N 2.94Å; S112-R116 WeakPolarHBondContact O-CB 3.45Å; S112-R116 PolarHBondContact O-N 2.9Å |
| 113 | F | 77.1 | Confident | 68.7 | Low | 121 Ų | 121 | 97 Ų | 97 | 53% | 0.531 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -69.9 | -45.1 | 175.2 | -179.2 | -99.2 | 0 | 0 | 0 | 111.9 | T109 F110 K111 R116 V117 | T109-F113 WeakPolarHBondContact O-CB 3.42Å; T109-F113 PolarHBondContact O-N 3.32Å; T109-F113 VanDerWaalsContact O-N 3.15Å; F110-F113 WeakPolarHBondContact O-CB 3.45Å; F110-F113 PolarHBondContact O-N 3.14Å; F110-F113 VanDerWaalsContact O-N 3.14Å; K111-F113 VanDerWaalsContact C-N 3.28Å; K111-F113 PolarHBondContact O-N 3.37Å; F113-R116 PolarHBondContact O-N 3.28Å; F113-V117 HydrophobicContact CD1-CG2 4.39Å; F113-V117 HydrophobicContact CE1-CG2 3.98Å; F113-V117 HydrophobicContact CE2-CG2 4.27Å; F113-V117 HydrophobicContact CZ-CG2 3.91Å; F113-V117 WeakPolarHBondContact O-CG2 3.43Å; F113-V117 PolarHBondContact O-N 3.15Å |
| 114 | E | 78.4 | Confident | 68.7 | Low | 124 Ų | 124 | 99.9 Ų | 99.9 | 58% | 0.579 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61 | -46.2 | 174.3 | -174.5 | 172.9 | -162.8 | 0 | 0 | 111.7 | F110 K111 R116 V117 G118 | F110-E114 PolarHBondContact O-N 3.49Å; K111-E114 PolarHBondContact O-N 3.06Å; E114-R116 VanDerWaalsContact C-N 3.27Å; E114-R116 PolarHBondContact O-N 2.8Å; E114-V117 PolarHBondContact O-N 2.92Å; E114-G118 PolarHBondContact O-N 3.32Å |
| 115 | D | 79.6 | Confident | 68.8 | Low | 96 Ų | 96 | 103.9 Ų | 103.9 | 51% | 0.513 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -58 | -41.4 | 175.4 | -73.1 | -22.8 | 0 | 0 | 0 | 111.3 | K111 T119 | K111-D115 WeakPolarHBondContact O-CB 3.22Å; K111-D115 VanDerWaalsContact O-CG 3.25Å; K111-D115 PolarHBondContact O-N 3.27Å; D115-T119 WeakPolarHBondContact O-CB 3.16Å; D115-T119 PolarHBondContact O-N 2.67Å; D115-T119 PolarHBondContact O-OG1 2.88Å |
| 116 | R | 83.6 | Confident | 68.8 | Low | 159 Ų | 159 | 102 Ų | 102 | 60% | 0.6 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -73.1 | -36.8 | -178.3 | -158.7 | 155.5 | 63.2 | -171.6 | 2.6 | 112.2 | S112 F113 E114 I120 | S112-R116 WeakPolarHBondContact O-CB 3.45Å; S112-R116 PolarHBondContact O-N 2.9Å; F113-R116 PolarHBondContact O-N 3.28Å; E114-R116 VanDerWaalsContact C-N 3.27Å; E114-R116 PolarHBondContact O-N 2.8Å; R116-I120 WeakPolarHBondContact O-CD1 3.25Å; R116-I120 VanDerWaalsContact O-CG1 3.25Å; R116-I120 WeakPolarHBondContact O-CG1 3.42Å; R116-I120 PolarHBondContact O-N 3.05Å |
| 117 | V | 81.7 | Confident | 68.7 | Low | 73 Ų | 73 | 101.6 Ų | 101.6 | 44% | 0.442 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -70.5 | -42.6 | 173.4 | 167.3 | 0 | 0 | 0 | 0 | 111.5 | F113 E114 T119 I120 K121 | F113-V117 HydrophobicContact CD1-CG2 4.39Å; F113-V117 HydrophobicContact CE1-CG2 3.98Å; F113-V117 HydrophobicContact CE2-CG2 4.27Å; F113-V117 HydrophobicContact CZ-CG2 3.91Å; F113-V117 WeakPolarHBondContact O-CG2 3.43Å; F113-V117 PolarHBondContact O-N 3.15Å; E114-V117 PolarHBondContact O-N 2.92Å; V117-T119 VanDerWaalsContact C-N 3.29Å; V117-T119 PolarHBondContact O-N 3.45Å; V117-I120 PolarHBondContact O-N 2.93Å; V117-K121 PolarHBondContact O-N 3.21Å |
| 118 | G | 77.4 | Confident | 68.5 | Low | 41 Ų | 41 | 111.7 Ų | 111.7 | 42% | 0.423 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -60.7 | -41.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | E114 I120 K121 S122 | E114-G118 PolarHBondContact O-N 3.32Å; G118-I120 PolarHBondContact O-N 3.24Å; G118-K121 PolarHBondContact O-N 3.38Å; G118-S122 PolarHBondContact O-N 3.49Å |
| 119 | T | 78.1 | Confident | 68.3 | Low | 69 Ų | 69 | 116.8 Ų | 116.8 | 42% | 0.423 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -60.6 | -45.1 | 173.9 | -65.6 | 0 | 0 | 0 | 0 | 111.6 | D115 V117 S122 K123 | D115-T119 WeakPolarHBondContact O-CB 3.16Å; D115-T119 PolarHBondContact O-N 2.67Å; D115-T119 PolarHBondContact O-OG1 2.88Å; V117-T119 VanDerWaalsContact C-N 3.29Å; V117-T119 PolarHBondContact O-N 3.45Å; T119-S122 PolarHBondContact O-N 2.95Å; T119-K123 WeakPolarHBondContact O-CE 3.21Å; T119-K123 WeakPolarHBondContact O-CG 3.39Å; T119-K123 PolarHBondContact O-N 3.44Å |
| 120 | I | 78.7 | Confident | 67.5 | Low | 99 Ų | 99 | 118.5 Ų | 118.5 | 51% | 0.508 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -65.1 | -42 | 177.4 | -69.1 | 161.8 | 0 | 0 | 0 | 111.7 | R116 V117 G118 S122 K123 V124 | R116-I120 WeakPolarHBondContact O-CD1 3.25Å; R116-I120 VanDerWaalsContact O-CG1 3.25Å; R116-I120 WeakPolarHBondContact O-CG1 3.42Å; R116-I120 PolarHBondContact O-N 3.05Å; V117-I120 PolarHBondContact O-N 2.93Å; G118-I120 PolarHBondContact O-N 3.24Å; I120-S122 VanDerWaalsContact C-N 3.31Å; I120-S122 PolarHBondContact O-N 3.19Å; I120-K123 PolarHBondContact O-N 3.25Å; I120-V124 PolarHBondContact O-N 3.34Å |
| 121 | K | 71.2 | Confident | 66.6 | Low | 154 Ų | 154 | 117.6 Ų | 117.6 | 67% | 0.67 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -62.6 | -39.5 | 177.2 | -165.5 | -179.2 | -177.2 | -173.3 | 0 | 111.3 | V117 G118 K123 V124 V125 | V117-K121 PolarHBondContact O-N 3.21Å; G118-K121 PolarHBondContact O-N 3.38Å; K121-K123 PolarHBondContact O-N 3.47Å; K121-V124 PolarHBondContact O-N 2.79Å; K121-V125 WeakPolarHBondContact O-CB 3.42Å; K121-V125 PolarHBondContact O-N 3.36Å |
| 122 | S | 63.5 | Low | 66.3 | Low | 75 Ų | 75 | 114.3 Ų | 114.3 | 52% | 0.524 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -64.7 | -35.8 | 176.7 | -165 | 0 | 0 | 0 | 0 | 112.7 | G118 T119 I120 G126 | G118-S122 PolarHBondContact O-N 3.49Å; T119-S122 PolarHBondContact O-N 2.95Å; I120-S122 VanDerWaalsContact C-N 3.31Å; I120-S122 PolarHBondContact O-N 3.19Å; S122-G126 WeakPolarHBondContact O-CA 2.9Å; S122-G126 PolarHBondContact O-N 3Å |
| 123 | K | 62.5 | Low | 65.4 | Low | 142 Ų | 142 | 118.7 Ų | 118.7 | 62% | 0.617 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -76.3 | -26.3 | 178.9 | -19 | -162.7 | 179.7 | -146.1 | 0 | 113 | T119 I120 K121 | T119-K123 WeakPolarHBondContact O-CE 3.21Å; T119-K123 WeakPolarHBondContact O-CG 3.39Å; T119-K123 PolarHBondContact O-N 3.44Å; I120-K123 PolarHBondContact O-N 3.25Å; K121-K123 PolarHBondContact O-N 3.47Å |
| 124 | V | 61 | Low | 63.8 | Low | 128 Ų | 128 | 120.5 Ų | 120.5 | 78% | 0.776 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -84.9 | -25.4 | 177.8 | 162.5 | 0 | 0 | 0 | 0 | 112 | I120 K121 | I120-V124 PolarHBondContact O-N 3.34Å; K121-V124 PolarHBondContact O-N 2.79Å |
| 125 | V | 59.8 | Low | 62.3 | Low | 122 Ų | 122 | 122.2 Ų | 122.2 | 74% | 0.739 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -109.6 | -20 | -177.6 | 117.1 | 0 | 0 | 0 | 0 | 114.4 | K121 | K121-V125 WeakPolarHBondContact O-CB 3.42Å; K121-V125 PolarHBondContact O-N 3.36Å |
| 126 | G | 58.4 | Low | 60.7 | Low | 41 Ų | 41 | 123.5 Ų | 123.5 | 42% | 0.423 | 68% | 0.68 | S | S | . | * | S | Bend | trans | -120.8 | 57.4 | -165.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | S122 | S122-G126 WeakPolarHBondContact O-CA 2.9Å; S122-G126 PolarHBondContact O-N 3Å |
| 127 | D | 52.1 | Low | 58.5 | Low | 153 Ų | 153 | 121.4 Ų | 121.4 | 82% | 0.818 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -147.3 | 43 | 164.5 | -103.9 | -47 | 0 | 0 | 0 | 112.4 | ||
| 128 | R | 53.6 | Low | 56.5 | Low | 248 Ų | 248 | 123.3 Ų | 123.3 | 94% | 0.936 | 71% | 0.706 | S | S | * | * | trans | -149.3 | 54.9 | 163.8 | -149.7 | -179.6 | -179.4 | 85.4 | 0.2 | 114.4 | ||||
| 129 | E | 56.3 | Low | 54.7 | Low | 190 Ų | 190 | 126.2 Ų | 126.2 | 89% | 0.888 | 73% | 0.726 | S | S | * | * | trans | -130.2 | 142.4 | 152 | 65.9 | -173.2 | 116.5 | 0 | 0 | 111.1 | ||||
| 130 | N | 44.3 | Very low | 52.7 | Low | 145 Ų | 145 | 126.5 Ų | 126.5 | 78% | 0.775 | 74% | 0.742 | S | S | * | * | trans | 94.2 | 55.3 | 167.6 | -133.5 | 48.6 | 0 | 0 | 0 | 118.9 | ||||
| 131 | G | 47.8 | Very low | 51 | Low | 87 Ų | 87 | 128.1 Ų | 128.1 | 90% | 0.897 | 76% | 0.762 | S | S | * | * | trans | -100.5 | 73.3 | 155.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 132 | S | 57 | Low | 49.8 | Very low | 73 Ų | 73 | 123.6 Ų | 123.6 | 51% | 0.51 | 76% | 0.76 | S | S | . | * | trans | -158.1 | 98.1 | 161.1 | 56 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 133 | D | 51.8 | Low | 48.9 | Very low | 152 Ų | 152 | 127.9 Ų | 127.9 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | 165.2 | 136.6 | 120.8 | -76 | -24.3 | 0 | 0 | 0 | 111.8 | |||||
| 134 | N | 43.3 | Very low | 48.6 | Very low | 159 Ų | 159 | 130.5 Ų | 130.5 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | trans | 74.4 | 106.5 | 163.9 | -83.6 | -18.5 | 0 | 0 | 0 | 120.4 | ||||
| 135 | L | 46.7 | Very low | 48.5 | Very low | 160 Ų | 160 | 129.7 Ų | 129.7 | 84% | 0.838 | 79% | 0.786 | S | S | * | * | trans | -44.2 | 145.6 | 154.5 | -56.9 | 167.6 | 0 | 0 | 0 | 112.6 | ||||
| 136 | P | 45.3 | Very low | 48 | Very low | 124 Ų | 124 | 132 Ų | 132 | 81% | 0.805 | 79% | 0.793 | S | S | * | * | trans | -111.9 | 126.8 | 140.4 | 31.8 | -23.4 | 0 | 0 | 0 | 110.3 | ||||
| 137 | S | 37.8 | Very low | 47.9 | Very low | 114 Ų | 114 | 135 Ų | 135 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | -68.3 | 140.5 | 174.9 | -67.6 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 138 | S | 40.1 | Very low | 47.8 | Very low | 114 Ų | 114 | 135.5 Ų | 135.5 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | 39.9 | 127.7 | 132.4 | -153.5 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 139 | A | 39.9 | Very low | 48.3 | Very low | 102 Ų | 102 | 128.9 Ų | 128.9 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | trans | 85.2 | 133.2 | 139.2 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 140 | G | 36.4 | Very low | 48 | Very low | 74 Ų | 74 | 124.5 Ų | 124.5 | 76% | 0.763 | 80% | 0.795 | S | S | * | * | trans | 129.8 | 82.3 | 164.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 141 | S | 42.4 | Very low | 49.2 | Very low | 133 Ų | 133 | 122.6 Ų | 122.6 | 93% | 0.93 | 79% | 0.791 | S | S | * | * | 67.5 | 118.8 | 87.7 | -171.1 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 142 | G | 45.1 | Very low | 49.4 | Very low | 60 Ų | 60 | 132.3 Ų | 132.3 | 62% | 0.619 | 81% | 0.809 | S | S | * | * | trans | 105.1 | 102.9 | 141.2 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 143 | D | 46.2 | Very low | 49 | Very low | 164 Ų | 164 | 135.3 Ų | 135.3 | 88% | 0.877 | 82% | 0.824 | S | S | * | * | trans | 65.9 | 115.9 | 133 | -60.4 | -38.4 | 0 | 0 | 0 | 122.4 | ||||
| 144 | K | 56.2 | Low | 48.8 | Very low | 197 Ų | 197 | 134.4 Ų | 134.4 | 86% | 0.857 | 83% | 0.825 | S | S | * | * | 118.8 | 128.5 | 119.4 | -155.2 | 164.7 | -174.3 | 168.2 | 0 | 116.2 | |||||
| 145 | P | 58.8 | Low | 49.1 | Very low | 112 Ų | 112 | 133 Ų | 133 | 73% | 0.727 | 82% | 0.823 | S | S | * | * | trans | -96.6 | 129.6 | 175.8 | 35.8 | -27.8 | 0 | 0 | 0 | 111.5 | ||||
| 146 | L | 49.6 | Very low | 49.3 | Very low | 170 Ų | 170 | 131.4 Ų | 131.4 | 89% | 0.89 | 82% | 0.822 | S | S | * | * | trans | 164.1 | 141.6 | 158.6 | -122.8 | 61.3 | 0 | 0 | 0 | 106.6 | ||||
| 147 | S | 55 | Low | 49.5 | Very low | 104 Ų | 104 | 131.9 Ų | 131.9 | 73% | 0.727 | 82% | 0.823 | S | S | * | * | cis | -157.6 | 159.8 | 28.2 | -68.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 148 | D | 50.2 | Low | 50.3 | Low | 163 Ų | 163 | 133.1 Ų | 133.1 | 87% | 0.872 | 83% | 0.825 | S | S | * | * | trans | -43.8 | 172.4 | 172.1 | -119.5 | -0.6 | 0 | 0 | 0 | 118.3 | ||||
| 149 | P | 64.9 | Low | 51 | Low | 109 Ų | 109 | 134.4 Ų | 134.4 | 71% | 0.708 | 83% | 0.827 | S | S | * | * | trans | -94 | 167.6 | -161.7 | 40.6 | -38.6 | 0 | 0 | 0 | 113.9 | ||||
| 150 | A | 49.6 | Very low | 51.9 | Low | 98 Ų | 98 | 136.9 Ų | 136.9 | 81% | 0.81 | 83% | 0.826 | S | S | * | * | trans | -171 | 157.1 | 143.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 151 | P | 69.4 | Low | 53.2 | Low | 105 Ų | 105 | 142.2 Ų | 142.2 | 68% | 0.682 | 83% | 0.831 | S | S | * | * | trans | -103.9 | 161 | -161.9 | 39.3 | -30.3 | 0 | 0 | 0 | 113.3 | ||||
| 152 | F | 50.9 | Low | 54.2 | Low | 291 Ų | 291 | 143 Ų | 143 | 100% | 1.276 | 82% | 0.822 | S | S | * | * | trans | -154.8 | 0 | 135.8 | -80.7 | -67.6 | 0 | 0 | 0 | 109.1 |
Retrieved 152 of 152 residues in 24.4 ms
(Link to these results)