| 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 | 49 | Very low | 45.7 | Very low | 224 Ų | 224 | 163.5 Ų | 163.5 | 100% | 1.103 | 84% | 0.837 | S | S | * | * | 0 | 87.9 | 0 | -81 | -77.1 | -178.6 | 0 | 0 | 105.7 | |||||
| 2 | D | 43.3 | Very low | 44.9 | Very low | 172 Ų | 172 | 161.2 Ų | 161.2 | 92% | 0.92 | 83% | 0.828 | S | S | * | * | trans | -136 | 123.3 | 166.1 | -79.8 | -66.6 | 0 | 0 | 0 | 106.8 | ||||
| 3 | V | 45 | Very low | 44.5 | Very low | 111 Ų | 111 | 165.8 Ų | 165.8 | 67% | 0.673 | 83% | 0.828 | S | S | * | * | trans | -116.2 | 124.7 | -153.7 | 157.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 4 | F | 39.1 | Very low | 44.6 | Very low | 185 Ų | 185 | 159.5 Ų | 159.5 | 81% | 0.811 | 82% | 0.815 | S | S | * | * | trans | 56 | 118.9 | 152.6 | -72.9 | -110.3 | 0 | 0 | 0 | 120.3 | ||||
| 5 | S | 45.2 | Very low | 44.4 | Very low | 121 Ų | 121 | 157 Ų | 157 | 85% | 0.846 | 82% | 0.815 | S | S | * | * | -155.7 | 137.7 | 112.1 | -102.9 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 6 | P | 48.3 | Very low | 43.9 | Very low | 109 Ų | 109 | 153.7 Ų | 153.7 | 71% | 0.708 | 82% | 0.818 | S | S | * | * | trans | -100 | 136.2 | -174.2 | 37 | -28.1 | 0 | 0 | 0 | 112.2 | ||||
| 7 | S | 47.8 | Very low | 43.4 | Very low | 123 Ų | 123 | 151.8 Ų | 151.8 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | trans | -129.5 | 69.2 | 163.5 | 35.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 8 | Q | 50 | Low | 43 | Very low | 178 Ų | 178 | 150.1 Ų | 150.1 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | trans | -108.6 | 94.9 | 160.4 | -82.9 | -81.3 | 11 | 0 | 0 | 106.3 | ||||
| 9 | L | 46.7 | Very low | 43.5 | Very low | 149 Ų | 149 | 147.7 Ų | 147.7 | 78% | 0.78 | 81% | 0.814 | S | S | * | * | trans | -138.5 | 113.5 | 164.3 | -75 | -179.7 | 0 | 0 | 0 | 110.5 | ||||
| 10 | Y | 46.9 | Very low | 43.1 | Very low | 200 Ų | 200 | 148.7 Ų | 148.7 | 78% | 0.784 | 82% | 0.818 | S | S | * | * | trans | 69.2 | 89.8 | 139.3 | -88.7 | -102.6 | 0 | 0 | 0 | 118.4 | ||||
| 11 | Y | 41.2 | Very low | 43 | Very low | 226 Ų | 226 | 146.5 Ų | 146.5 | 89% | 0.886 | 81% | 0.813 | S | S | * | * | -152 | 75.4 | 119.4 | -108.5 | -77.4 | 0 | 0 | 0 | 109.1 | |||||
| 12 | D | 36.5 | Very low | 42.7 | Very low | 136 Ų | 136 | 143.9 Ų | 143.9 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | trans | -86.5 | 114.1 | 156.2 | -168.5 | -10.4 | 0 | 0 | 0 | 106.9 | A14 | D12-A14 PolarHBondContact OD1-N 3.38Å; D12-A14 VanDerWaalsContact OD1-N 3.13Å | ||
| 13 | R | 39.2 | Very low | 42.8 | Very low | 222 Ų | 222 | 144.2 Ų | 144.2 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | trans | -124.9 | 60 | 168.8 | -169.8 | 103.1 | -166.4 | -167.8 | 5.5 | 108.9 | ||||
| 14 | A | 46.3 | Very low | 42.5 | Very low | 77 Ų | 77 | 148.6 Ų | 148.6 | 64% | 0.636 | 81% | 0.809 | S | S | * | * | trans | -103.3 | 100.6 | 153.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | D12 | D12-A14 PolarHBondContact OD1-N 3.38Å; D12-A14 VanDerWaalsContact OD1-N 3.13Å | ||
| 15 | C | 41.8 | Very low | 42.2 | Very low | 122 Ų | 122 | 142.4 Ų | 142.4 | 82% | 0.824 | 80% | 0.798 | S | S | * | * | trans | -173.1 | 101.7 | 154.4 | -101.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 16 | A | 36.2 | Very low | 41.8 | Very low | 104 Ų | 104 | 143.3 Ų | 143.3 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | -168.5 | 95 | 130.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 17 | S | 35.3 | Very low | 41.7 | Very low | 122 Ų | 122 | 143.5 Ų | 143.5 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -82.3 | 131.9 | 156 | -57.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 18 | S | 36.6 | Very low | 41.5 | Very low | 120 Ų | 120 | 145.5 Ų | 145.5 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | 178.4 | 160.5 | 124.1 | -116 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 19 | P | 51.8 | Low | 41 | Very low | 105 Ų | 105 | 146.1 Ų | 146.1 | 68% | 0.682 | 80% | 0.803 | S | S | * | * | trans | -93.8 | 160.9 | -151 | 38.6 | -36 | 0 | 0 | 0 | 113 | ||||
| 20 | D | 34.8 | Very low | 40.7 | Very low | 168 Ų | 168 | 145.9 Ų | 145.9 | 90% | 0.898 | 80% | 0.801 | S | S | * | * | trans | -146.8 | 124.6 | 143.1 | -100.2 | -34 | 0 | 0 | 0 | 111.6 | ||||
| 21 | S | 43 | Very low | 40.4 | Very low | 103 Ų | 103 | 142.9 Ų | 142.9 | 72% | 0.72 | 80% | 0.804 | S | S | * | * | trans | -79.7 | 120.8 | 169.7 | 166.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 22 | L | 41.6 | Very low | 40 | Very low | 169 Ų | 169 | 135.6 Ų | 135.6 | 89% | 0.885 | 80% | 0.798 | S | S | * | * | trans | -137.2 | 100.3 | 157.4 | -92.9 | 172.4 | 0 | 0 | 0 | 109.9 | ||||
| 23 | E | 46.2 | Very low | 40.2 | Very low | 178 Ų | 178 | 134.1 Ų | 134.1 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | trans | -64.8 | 122 | 148.9 | -74.9 | -156.9 | 144.9 | 0 | 0 | 109.5 | ||||
| 24 | F | 37.8 | Very low | 40 | Very low | 204 Ų | 204 | 132.4 Ų | 132.4 | 90% | 0.895 | 80% | 0.799 | S | S | * | * | trans | -162.3 | 108.9 | 146.6 | -140.9 | -99 | 0 | 0 | 0 | 104.2 | ||||
| 25 | G | 33.8 | Very low | 39.7 | Very low | 55 Ų | 55 | 136.8 Ų | 136.8 | 57% | 0.567 | 81% | 0.807 | S | S | * | * | 96.2 | 99.8 | 69.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 26 | T | 36.5 | Very low | 39.5 | Very low | 140 Ų | 140 | 136 Ų | 136 | 86% | 0.859 | 80% | 0.795 | S | S | * | * | trans | 77.4 | 115.7 | 143.1 | -45.2 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 27 | S | 45.8 | Very low | 40 | Very low | 112 Ų | 112 | 139.3 Ų | 139.3 | 78% | 0.783 | 79% | 0.792 | S | S | * | * | trans | 63.1 | 98.7 | 137.4 | -170.3 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 28 | M | 43.7 | Very low | 40.3 | Very low | 166 Ų | 166 | 139.4 Ų | 139.4 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -151.4 | 77.4 | 139.2 | -156.5 | 158.8 | 169.1 | 0 | 0 | 109.2 | L30 | M28-L30 PolarHBondContact O-N 3.39Š| ||
| 29 | E | 39.4 | Very low | 40.6 | Very low | 190 Ų | 190 | 139.9 Ų | 139.9 | 89% | 0.888 | 78% | 0.777 | S | S | * | * | trans | -62.3 | 103.8 | 159.2 | -94.1 | -105.2 | 125.6 | 0 | 0 | 106.8 | T31 | E29-T31 PolarHBondContact O-N 2.72Š| ||
| 30 | L | 40.3 | Very low | 40.5 | Very low | 144 Ų | 144 | 145.8 Ų | 145.8 | 75% | 0.754 | 79% | 0.785 | S | S | * | * | trans | -63.6 | 114.7 | 170.9 | -125.5 | 94.4 | 0 | 0 | 0 | 107.6 | M28 G32 | M28-L30 PolarHBondContact O-N 3.39Å; L30-G32 VanDerWaalsContact C-N 3.31Å; L30-G32 PolarHBondContact O-N 2.92Å | ||
| 31 | T | 40.3 | Very low | 40.5 | Very low | 137 Ų | 137 | 143.7 Ų | 143.7 | 84% | 0.84 | 78% | 0.778 | S | S | * | * | trans | -60.8 | 89.5 | 168.2 | 51.4 | 0 | 0 | 0 | 0 | 109.8 | E29 S33 | E29-T31 PolarHBondContact O-N 2.72Å; T31-S33 PolarHBondContact O-N 3.08Å | ||
| 32 | G | 32.1 | Very low | 40.5 | Very low | 73 Ų | 73 | 144.7 Ų | 144.7 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | trans | -87.6 | 81.1 | 165.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | L30 E34 | L30-G32 VanDerWaalsContact C-N 3.31Å; L30-G32 PolarHBondContact O-N 2.92Å; G32-E34 PolarHBondContact O-N 2.71Å | ||
| 33 | S | 41.6 | Very low | 40.9 | Very low | 105 Ų | 105 | 140.4 Ų | 140.4 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | trans | -68.7 | 105.1 | 164.6 | 179.8 | 0 | 0 | 0 | 0 | 108.8 | T31 | T31-S33 PolarHBondContact O-N 3.08Š| ||
| 34 | E | 34.6 | Very low | 41.1 | Very low | 186 Ų | 186 | 136.2 Ų | 136.2 | 87% | 0.869 | 77% | 0.774 | S | S | * | * | trans | -131.5 | 97 | 150.5 | 61.7 | -179.5 | 162.8 | 0 | 0 | 108.5 | G32 D36 | G32-E34 PolarHBondContact O-N 2.71Å; E34-D36 PolarHBondContact O-N 2.92Å | ||
| 35 | E | 40.4 | Very low | 42.1 | Very low | 169 Ų | 169 | 131.1 Ų | 131.1 | 79% | 0.79 | 76% | 0.762 | S | S | * | * | trans | -61 | 103.6 | 162.6 | 59.7 | -155 | 142 | 0 | 0 | 109.4 | ||||
| 36 | D | 38.6 | Very low | 43.4 | Very low | 106 Ų | 106 | 132.8 Ų | 132.8 | 57% | 0.567 | 76% | 0.755 | S | S | * | * | trans | -110.4 | 79.3 | 157.3 | -172.2 | 57.1 | 0 | 0 | 0 | 106 | E34 H38 | E34-D36 PolarHBondContact O-N 2.92Å; D36-H38 VanDerWaalsContact C-N 3.28Å; D36-H38 PolarHBondContact O-N 3.46Å; D36-H38 IonicContact OD1-CE1 3.02Å; D36-H38 PolarHBondContact OD1-CE1 2.8Å; D36-H38 IonicContact OD1-ND1 3.4Å; D36-H38 PolarHBondContact OD1-ND1 3.33Å; D36-H38 IonicContact OD2-CE1 2.99Å; D36-H38 PolarHBondContact OD2-CE1 3.44Å; D36-H38 IonicContact OD2-ND1 2.69Å; D36-H38 PolarHBondContact OD2-ND1 2.62Å | ||
| 37 | E | 45.2 | Very low | 44.6 | Very low | 174 Ų | 174 | 131.2 Ų | 131.2 | 81% | 0.813 | 74% | 0.738 | S | S | * | * | trans | -64.4 | 86.6 | 175.4 | -166.1 | -175.8 | 134.9 | 0 | 0 | 109.2 | ||||
| 38 | H | 42 | Very low | 45.1 | Very low | 124 Ų | 124 | 131.3 Ų | 131.3 | 57% | 0.574 | 74% | 0.736 | S | S | * | * | trans | -108.6 | 108.6 | 160.6 | -67.6 | 110.6 | 0 | 0 | 0 | 107.9 | D36 R40 | D36-H38 VanDerWaalsContact C-N 3.28Å; D36-H38 PolarHBondContact O-N 3.46Å; D36-H38 IonicContact OD1-CE1 3.02Å; D36-H38 PolarHBondContact OD1-CE1 2.8Å; D36-H38 IonicContact OD1-ND1 3.4Å; D36-H38 PolarHBondContact OD1-ND1 3.33Å; D36-H38 IonicContact OD2-CE1 2.99Å; D36-H38 PolarHBondContact OD2-CE1 3.44Å; D36-H38 IonicContact OD2-ND1 2.69Å; D36-H38 PolarHBondContact OD2-ND1 2.62Å; H38-R40 PolarHBondContact O-N 3.11Å | ||
| 39 | V | 43.3 | Very low | 46.2 | Very low | 130 Ų | 130 | 127 Ų | 127 | 79% | 0.788 | 73% | 0.733 | S | S | * | * | trans | -22.1 | 101.9 | 174.7 | -178.5 | 0 | 0 | 0 | 0 | 112.1 | V41 | V39-V41 PolarHBondContact O-N 3.06Š| ||
| 40 | R | 49.5 | Very low | 47.9 | Very low | 228 Ų | 228 | 125.8 Ų | 125.8 | 86% | 0.86 | 73% | 0.727 | S | S | * | * | trans | -77 | 112 | 163.7 | -71.8 | -159.2 | 177.5 | 102.7 | 1.4 | 107.2 | H38 P42 | H38-R40 PolarHBondContact O-N 3.11Å; R40-P42 VanDerWaalsContact O-CD 3.32Å; R40-P42 WeakPolarHBondContact O-CD 3.14Å | ||
| 41 | V | 35.4 | Very low | 50 | Low | 125 Ų | 125 | 120.8 Ų | 120.8 | 76% | 0.758 | 70% | 0.704 | S | S | * | * | trans | -56.8 | 123.3 | 165.1 | 177.5 | 0 | 0 | 0 | 0 | 107.7 | V39 G43 | V39-V41 PolarHBondContact O-N 3.06Å; V41-G43 PolarHBondContact O-N 2.7Å | ||
| 42 | P | 41.6 | Very low | 51.9 | Low | 124 Ų | 124 | 119.3 Ų | 119.3 | 81% | 0.805 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.1 | 124.7 | 175.1 | -23.3 | 34.4 | 0 | 0 | 0 | 110.8 | R40 | R40-P42 VanDerWaalsContact O-CD 3.32Å; R40-P42 WeakPolarHBondContact O-CD 3.14Å |
| 43 | G | 49.9 | Very low | 53.9 | Low | 78 Ų | 78 | 122.7 Ų | 122.7 | 80% | 0.804 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108 | 18.2 | 149.3 | 0 | 0 | 0 | 0 | 0 | 120.7 | V41 | V41-G43 PolarHBondContact O-N 2.7Š|
| 44 | A | 51.7 | Low | 55.8 | Low | 90 Ų | 90 | 126.8 Ų | 126.8 | 74% | 0.744 | 69% | 0.686 | S | S | * | * | trans | -116.2 | 107.3 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | H46 | A44-H46 PolarHBondContact O-N 3.37Š| ||
| 45 | P | 58.8 | Low | 58 | Low | 97 Ų | 97 | 120.9 Ų | 120.9 | 63% | 0.63 | 67% | 0.669 | S | S | * | * | trans | -55.1 | 127.7 | 163.9 | -17.4 | 29 | 0 | 0 | 0 | 107.7 | Q47 | P45-Q47 PolarHBondContact O-N 2.84Š| ||
| 46 | H | 61.1 | Low | 60.1 | Low | 90 Ų | 90 | 114.4 Ų | 114.4 | 42% | 0.417 | 64% | 0.642 | S | S | . | * | trans | -58.5 | 103.5 | 170.4 | 167.3 | -72 | 0 | 0 | 0 | 108 | A44 C51 C59 | A44-H46 PolarHBondContact O-N 3.37Å; H46-C51 PolarHBondContact CD2-SG 2.95Å; H46-C51 PolarHBondContact NE2-SG 3.5Å; H46-C59 PolarHBondContact CD2-SG 3.47Å; H46-C59 PolarHBondContact CE1-SG 3.4Å; H46-C59 VanDerWaalsContact CG-SG 3.54Å; H46-C59 PolarHBondContact NE2-SG 3.03Å | ||
| 47 | Q | 60.4 | Low | 62 | Low | 108 Ų | 108 | 115.3 Ų | 115.3 | 51% | 0.505 | 64% | 0.641 | S | S | . | * | trans | -78 | 130.7 | 174.1 | -68.2 | -61.6 | -19.4 | 0 | 0 | 108.8 | P45 G49 H50 | P45-Q47 PolarHBondContact O-N 2.84Å; Q47-G49 PolarHBondContact O-N 3.43Å; Q47-G49 VanDerWaalsContact O-N 3.07Å; Q47-H50 VanDerWaalsContact CB-CD2 3.49Å; Q47-H50 WeakPolarHBondContact CB-CD2 3.09Å; Q47-H50 PolarHBondContact O-N 2.84Å | ||
| 48 | P | 57.1 | Low | 63.7 | Low | 114 Ų | 114 | 110.2 Ų | 110.2 | 74% | 0.74 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.3 | 117.2 | 173.6 | -22.5 | 32.4 | 0 | 0 | 0 | 110.2 | ||
| 49 | G | 66.8 | Low | 65.4 | Low | 74 Ų | 74 | 105 Ų | 105 | 76% | 0.763 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 112.5 | -15.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | Q47 | Q47-G49 PolarHBondContact O-N 3.43Å; Q47-G49 VanDerWaalsContact O-N 3.07Å |
| 50 | H | 74.8 | Confident | 67 | Low | 165 Ų | 165 | 103.9 Ų | 103.9 | 76% | 0.764 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -94.8 | 0.3 | -176.8 | -69.9 | -87.4 | 0 | 0 | 0 | 115 | Q47 | Q47-H50 VanDerWaalsContact CB-CD2 3.49Å; Q47-H50 WeakPolarHBondContact CB-CD2 3.09Å; Q47-H50 PolarHBondContact O-N 2.84Å |
| 51 | C | 85.2 | Confident | 68 | Low | 40 Ų | 40 | 102 Ų | 102 | 27% | 0.27 | 58% | 0.584 | S | S | . | * | S | Bend | trans | -140.4 | 152.7 | 169.9 | 87.5 | 0 | 0 | 0 | 0 | 111.7 | H46 Q53 C56 C59 | H46-C51 PolarHBondContact CD2-SG 2.95Å; H46-C51 PolarHBondContact NE2-SG 3.5Å; C51-Q53 PolarHBondContact O-N 3.11Å; C51-C56 HydrophobicContact CB-CB 4.03Å; C51-C56 WeakPolarHBondContact SG-CB 3.44Å; C51-C59 VanDerWaalsContact SG-SG 3.68Å |
| 52 | L | 80 | Confident | 69.8 | Low | 105 Ų | 105 | 105.1 Ų | 105.1 | 55% | 0.55 | 59% | 0.587 | S | S | . | * | trans | -75.6 | 115 | 175.1 | -62.8 | 176 | 0 | 0 | 0 | 109.2 | W54 A55 C56 | L52-W54 HydrophobicContact CB-CD2 4.42Å; L52-W54 HydrophobicContact CB-CG 4.42Å; L52-W54 HydrophobicContact CB-CZ2 4.41Å; L52-W54 HydrophobicContact CD1-CH2 4.46Å; L52-W54 HydrophobicContact CD1-CZ2 3.47Å; L52-W54 VanDerWaalsContact CD1-CZ2 3.47Å; L52-W54 PolarHBondContact O-N 3.29Å; L52-A55 HydrophobicContact CB-CB 4.12Å; L52-A55 PolarHBondContact O-N 2.98Å; L52-C56 PolarHBondContact O-N 3.47Å | ||
| 53 | Q | 74.8 | Confident | 71.4 | Confident | 144 Ų | 144 | 101.5 Ų | 101.5 | 67% | 0.673 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.5 | -25.6 | -178.2 | -68.1 | -176.1 | -40.4 | 0 | 0 | 113.7 | C51 | C51-Q53 PolarHBondContact O-N 3.11Š|
| 54 | W | 80.4 | Confident | 73.1 | Confident | 192 Ų | 192 | 100.1 Ų | 100.1 | 73% | 0.727 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -26.1 | 177.1 | 63.2 | -99.6 | 0 | 0 | 0 | 113.5 | L52 | L52-W54 HydrophobicContact CB-CD2 4.42Å; L52-W54 HydrophobicContact CB-CG 4.42Å; L52-W54 HydrophobicContact CB-CZ2 4.41Å; L52-W54 HydrophobicContact CD1-CH2 4.46Å; L52-W54 HydrophobicContact CD1-CZ2 3.47Å; L52-W54 VanDerWaalsContact CD1-CZ2 3.47Å; L52-W54 PolarHBondContact O-N 3.29Å |
| 55 | A | 81.7 | Confident | 74.8 | Confident | 62 Ų | 62 | 102.2 Ų | 102.2 | 51% | 0.512 | 54% | 0.535 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.1 | -32.9 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | L52 K57 | L52-A55 HydrophobicContact CB-CB 4.12Å; L52-A55 PolarHBondContact O-N 2.98Å; A55-K57 PolarHBondContact O-N 3.33Å |
| 56 | C | 84.1 | Confident | 76.3 | Confident | 33 Ų | 33 | 101 Ų | 101 | 22% | 0.223 | 53% | 0.526 | C | S | . | . | trans | -78 | 120 | -177.9 | 176.7 | 0 | 0 | 0 | 0 | 112.1 | C51 L52 A58 C59 K60 | C51-C56 HydrophobicContact CB-CB 4.03Å; C51-C56 WeakPolarHBondContact SG-CB 3.44Å; L52-C56 PolarHBondContact O-N 3.47Å; C56-A58 VanDerWaalsContact C-N 3.34Å; C56-A58 PolarHBondContact O-N 3.24Å; C56-C59 HydrophobicContact CB-CB 4.12Å; C56-C59 PolarHBondContact O-N 2.99Å; C56-K60 WeakPolarHBondContact O-CB 3.43Å; C56-K60 PolarHBondContact O-N 3.08Å | ||
| 57 | K | 78.5 | Confident | 77.7 | Confident | 125 Ų | 125 | 101 Ų | 101 | 54% | 0.543 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.6 | -38.5 | -178.2 | -166.7 | -179.1 | -77.4 | -174.2 | 0 | 112.6 | A55 R61 | A55-K57 PolarHBondContact O-N 3.33Å; K57-R61 WeakPolarHBondContact O-CG 3.23Å; K57-R61 PolarHBondContact O-N 3.13Å |
| 58 | A | 79.6 | Confident | 79.1 | Confident | 67 Ų | 67 | 101.6 Ų | 101.6 | 55% | 0.554 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67.3 | -44 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | C56 R61 K62 | C56-A58 VanDerWaalsContact C-N 3.34Å; C56-A58 PolarHBondContact O-N 3.24Å; A58-R61 PolarHBondContact O-N 2.69Å; A58-K62 PolarHBondContact O-N 3.05Å |
| 59 | C | 78.9 | Confident | 80.9 | Confident | 14 Ų | 14 | 103.2 Ų | 103.2 | 10% | 0.095 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -79.3 | -31.9 | -177.1 | -61.4 | 0 | 0 | 0 | 0 | 112.9 | H46 C51 C56 R61 K62 S63 | H46-C59 PolarHBondContact CD2-SG 3.47Å; H46-C59 PolarHBondContact CE1-SG 3.4Å; H46-C59 VanDerWaalsContact CG-SG 3.54Å; H46-C59 PolarHBondContact NE2-SG 3.03Å; C51-C59 VanDerWaalsContact SG-SG 3.68Å; C56-C59 HydrophobicContact CB-CB 4.12Å; C56-C59 PolarHBondContact O-N 2.99Å; C59-R61 VanDerWaalsContact C-N 3.27Å; C59-R61 PolarHBondContact O-N 3.01Å; C59-K62 PolarHBondContact O-N 3.07Å; C59-K62 VanDerWaalsContact O-N 3.14Å; C59-S63 PolarHBondContact O-N 3.34Å |
| 60 | K | 77.3 | Confident | 82.2 | Confident | 106 Ų | 106 | 107.9 Ų | 107.9 | 46% | 0.461 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.2 | -35.8 | 171.7 | -174 | 176.5 | -179 | -179.3 | 0 | 111.8 | C56 R68 | C56-K60 WeakPolarHBondContact O-CB 3.43Å; C56-K60 PolarHBondContact O-N 3.08Å; K60-R68 PolarHBondContact O-NH2 3.16Å |
| 61 | R | 70.8 | Confident | 83.2 | Confident | 190 Ų | 190 | 102.5 Ų | 102.5 | 72% | 0.717 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -74 | -30.1 | 173.7 | -73.5 | -171.4 | -165.2 | 148.2 | -1.3 | 113 | K57 A58 C59 | K57-R61 WeakPolarHBondContact O-CG 3.23Å; K57-R61 PolarHBondContact O-N 3.13Å; A58-R61 PolarHBondContact O-N 2.69Å; C59-R61 VanDerWaalsContact C-N 3.27Å; C59-R61 PolarHBondContact O-N 3.01Å |
| 62 | K | 71.6 | Confident | 83.7 | Confident | 189 Ų | 189 | 102.7 Ų | 102.7 | 82% | 0.822 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -80.5 | -19 | 180 | -164.2 | 145.9 | -177.3 | -176 | 0 | 114.1 | A58 C59 S64 | A58-K62 PolarHBondContact O-N 3.05Å; C59-K62 PolarHBondContact O-N 3.07Å; C59-K62 VanDerWaalsContact O-N 3.14Å; K62-S64 PolarHBondContact O-N 2.9Å |
| 63 | S | 76.6 | Confident | 84.5 | Confident | 49 Ų | 49 | 101.5 Ų | 101.5 | 34% | 0.343 | 50% | 0.498 | S | S | . | . | S | Bend | trans | -62.8 | 125.5 | 168.1 | 174.4 | 0 | 0 | 0 | 0 | 110.2 | C59 F65 | C59-S63 PolarHBondContact O-N 3.34Å; S63-F65 PolarHBondContact O-N 2.96Å |
| 64 | S | 85.3 | Confident | 85.6 | Confident | 48 Ų | 48 | 99 Ų | 99 | 34% | 0.336 | 49% | 0.488 | S | S | . | . | trans | -60.9 | 137.8 | -177.1 | 87.5 | 0 | 0 | 0 | 0 | 110.7 | K62 V66 D67 R68 | K62-S64 PolarHBondContact O-N 2.9Å; S64-V66 PolarHBondContact O-N 3.05Å; S64-D67 WeakPolarHBondContact CB-OD2 3.39Å; S64-D67 PolarHBondContact O-N 3.14Å; S64-D67 WeakPolarHBondContact OG-CB 3.23Å; S64-D67 PolarHBondContact OG-N 3.45Å; S64-D67 PolarHBondContact OG-OD2 3.01Å; S64-R68 PolarHBondContact O-N 3.36Å; S64-R68 VanDerWaalsContact O-N 3.11Å | ||
| 65 | F | 87.1 | Confident | 86.5 | Confident | 134 Ų | 134 | 97.8 Ų | 97.8 | 59% | 0.588 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -56 | -33.7 | 175.2 | 172.4 | -104.6 | 0 | 0 | 0 | 111.7 | S63 R68 R69 | S63-F65 PolarHBondContact O-N 2.96Å; F65-R68 PolarHBondContact O-N 3.42Å; F65-R69 WeakPolarHBondContact O-CB 3.46Å; F65-R69 PolarHBondContact O-N 3.4Å |
| 66 | V | 89.8 | Confident | 87.3 | Confident | 73 Ų | 73 | 98.5 Ų | 98.5 | 44% | 0.442 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.2 | -45.1 | 175.6 | 179.5 | 0 | 0 | 0 | 0 | 111.4 | S64 R69 R70 | S64-V66 PolarHBondContact O-N 3.05Å; V66-R69 WeakPolarHBondContact O-CB 3.37Å; V66-R69 PolarHBondContact O-N 3.39Å; V66-R70 HydrophobicContact CG1-CG 4.5Å; V66-R70 WeakPolarHBondContact O-CG 3.5Å; V66-R70 PolarHBondContact O-N 2.95Å |
| 67 | D | 90.6 | Very high | 88 | Confident | 90 Ų | 90 | 103.8 Ų | 103.8 | 48% | 0.481 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.3 | -40.6 | 178.8 | -67.2 | -37.8 | 0 | 0 | 0 | 111.7 | S64 R69 R70 A71 | S64-D67 WeakPolarHBondContact CB-OD2 3.39Å; S64-D67 PolarHBondContact O-N 3.14Å; S64-D67 WeakPolarHBondContact OG-CB 3.23Å; S64-D67 PolarHBondContact OG-N 3.45Å; S64-D67 PolarHBondContact OG-OD2 3.01Å; D67-R69 VanDerWaalsContact C-N 3.31Å; D67-R69 PolarHBondContact O-N 3.28Å; D67-R70 PolarHBondContact O-N 3.37Å; D67-A71 WeakPolarHBondContact O-CB 3.22Å; D67-A71 PolarHBondContact O-N 3.13Å |
| 68 | R | 89.6 | Confident | 88.9 | Confident | 119 Ų | 119 | 105.6 Ų | 105.6 | 45% | 0.449 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.7 | -43.1 | 174.9 | -169.1 | -178.5 | -59.5 | 177.7 | 5.6 | 111.5 | K60 S64 F65 A71 A72 | K60-R68 PolarHBondContact O-NH2 3.16Å; S64-R68 PolarHBondContact O-N 3.36Å; S64-R68 VanDerWaalsContact O-N 3.11Å; F65-R68 PolarHBondContact O-N 3.42Å; R68-A71 PolarHBondContact O-N 3.48Å; R68-A72 WeakPolarHBondContact O-CB 3.48Å; R68-A72 PolarHBondContact O-N 3.31Å |
| 69 | R | 94.9 | Very high | 89.8 | Confident | 149 Ų | 149 | 108.5 Ų | 108.5 | 56% | 0.562 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.4 | -48.7 | 175.9 | -177.9 | -178.8 | -75.3 | 171.5 | -12.7 | 111 | F65 V66 D67 A71 A72 T73 | F65-R69 WeakPolarHBondContact O-CB 3.46Å; F65-R69 PolarHBondContact O-N 3.4Å; V66-R69 WeakPolarHBondContact O-CB 3.37Å; V66-R69 PolarHBondContact O-N 3.39Å; D67-R69 VanDerWaalsContact C-N 3.31Å; D67-R69 PolarHBondContact O-N 3.28Å; R69-A71 VanDerWaalsContact C-N 3.34Å; R69-A71 PolarHBondContact O-N 2.97Å; R69-A72 PolarHBondContact O-N 3.44Å; R69-T73 PolarHBondContact O-N 3.44Å; R69-T73 PolarHBondContact O-OG1 3.29Å; R69-T73 VanDerWaalsContact O-OG1 3.13Å |
| 70 | R | 95.4 | Very high | 90.8 | Very high | 172 Ų | 172 | 111.1 Ų | 111.1 | 65% | 0.649 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -58.5 | -44.4 | 177.2 | -72.3 | 176 | -178.2 | -148.4 | 1.8 | 111.7 | V66 D67 T73 M74 | V66-R70 HydrophobicContact CG1-CG 4.5Å; V66-R70 WeakPolarHBondContact O-CG 3.5Å; V66-R70 PolarHBondContact O-N 2.95Å; D67-R70 PolarHBondContact O-N 3.37Å; R70-T73 PolarHBondContact O-N 2.99Å; R70-M74 WeakPolarHBondContact O-CG 3.48Å; R70-M74 PolarHBondContact O-N 3.08Å |
| 71 | A | 94.5 | Very high | 91.8 | Very high | 52 Ų | 52 | 112.7 Ų | 112.7 | 43% | 0.43 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.4 | -42.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | D67 R68 R69 M74 R75 | D67-A71 WeakPolarHBondContact O-CB 3.22Å; D67-A71 PolarHBondContact O-N 3.13Å; R68-A71 PolarHBondContact O-N 3.48Å; R69-A71 VanDerWaalsContact C-N 3.34Å; R69-A71 PolarHBondContact O-N 2.97Å; A71-M74 PolarHBondContact O-N 2.91Å; A71-R75 WeakPolarHBondContact O-CG 3.27Å; A71-R75 PolarHBondContact O-N 3.11Å |
| 72 | A | 95.8 | Very high | 93.1 | Very high | 44 Ų | 44 | 111.4 Ų | 111.4 | 36% | 0.364 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.3 | -47.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | R68 R69 M74 R75 E76 | R68-A72 WeakPolarHBondContact O-CB 3.48Å; R68-A72 PolarHBondContact O-N 3.31Å; R69-A72 PolarHBondContact O-N 3.44Å; A72-M74 VanDerWaalsContact C-N 3.3Å; A72-M74 PolarHBondContact O-N 3.02Å; A72-R75 PolarHBondContact O-N 3.24Å; A72-R75 VanDerWaalsContact O-N 3.16Å; A72-E76 PolarHBondContact O-N 3.25Å |
| 73 | T | 97.7 | Very high | 94.4 | Very high | 79 Ų | 79 | 104.7 Ų | 104.7 | 49% | 0.485 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -58.4 | -40.9 | 175.9 | -58.3 | 0 | 0 | 0 | 0 | 112 | R69 R70 E76 R77 | R69-T73 PolarHBondContact O-N 3.44Å; R69-T73 PolarHBondContact O-OG1 3.29Å; R69-T73 VanDerWaalsContact O-OG1 3.13Å; R70-T73 PolarHBondContact O-N 2.99Å; T73-E76 PolarHBondContact O-N 3.47Å; T73-R77 WeakPolarHBondContact O-CB 3.49Å; T73-R77 PolarHBondContact O-N 2.9Å |
| 74 | M | 98.3 | Very high | 95.4 | Very high | 93 Ų | 93 | 105.7 Ų | 105.7 | 46% | 0.458 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66.4 | -38.1 | 177.5 | -74.6 | -60.5 | -72.7 | 0 | 0 | 112.7 | R70 A71 A72 R78 | R70-M74 WeakPolarHBondContact O-CG 3.48Å; R70-M74 PolarHBondContact O-N 3.08Å; A71-M74 PolarHBondContact O-N 2.91Å; A72-M74 VanDerWaalsContact C-N 3.3Å; A72-M74 PolarHBondContact O-N 3.02Å; M74-R78 WeakPolarHBondContact O-CG 3.29Å; M74-R78 PolarHBondContact O-N 3.28Å; M74-R78 VanDerWaalsContact O-N 3.09Å |
| 75 | R | 98.4 | Very high | 95.9 | Very high | 166 Ų | 166 | 109.4 Ų | 109.4 | 63% | 0.626 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.9 | -45.1 | 173.4 | -72.1 | -171.2 | -65 | -162.1 | 1.9 | 111.5 | A71 A72 R77 R78 R79 | A71-R75 WeakPolarHBondContact O-CG 3.27Å; A71-R75 PolarHBondContact O-N 3.11Å; A72-R75 PolarHBondContact O-N 3.24Å; A72-R75 VanDerWaalsContact O-N 3.16Å; R75-R77 VanDerWaalsContact C-N 3.35Å; R75-R77 PolarHBondContact O-N 3.34Å; R75-R78 WeakPolarHBondContact O-CB 3.45Å; R75-R78 PolarHBondContact O-N 2.79Å; R75-R78 VanDerWaalsContact O-N 3.13Å; R75-R79 PolarHBondContact O-N 3.28Å |
| 76 | E | 98.4 | Very high | 96.4 | Very high | 77 Ų | 77 | 106 Ų | 106 | 36% | 0.36 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.8 | -40.3 | 178.8 | -178.2 | 55.2 | -162.8 | 0 | 0 | 111.8 | A72 T73 R78 R79 L80 | A72-E76 PolarHBondContact O-N 3.25Å; T73-E76 PolarHBondContact O-N 3.47Å; E76-R78 VanDerWaalsContact C-N 3.3Å; E76-R78 PolarHBondContact O-N 2.85Å; E76-R79 WeakPolarHBondContact O-CB 3.5Å; E76-R79 PolarHBondContact O-N 3.15Å; E76-R79 VanDerWaalsContact O-N 3.16Å; E76-R79 IonicContact OE1-CZ 3.37Å; E76-R79 IonicContact OE1-NE 3.19Å; E76-R79 PolarHBondContact OE1-NE 3.47Å; E76-R79 IonicContact OE1-NH2 2.7Å; E76-R79 PolarHBondContact OE1-NH2 3.09Å; E76-R79 IonicContact OE2-CZ 3.74Å; E76-R79 IonicContact OE2-NE 2.81Å; E76-R79 PolarHBondContact OE2-NE 2.92Å; E76-R79 IonicContact OE2-NH2 3.8Å; E76-L80 HydrophobicContact CG-CD1 4.19Å; E76-L80 HydrophobicContact CG-CG 4.48Å; E76-L80 WeakPolarHBondContact O-CG 3.47Å; E76-L80 PolarHBondContact O-N 3.43Å; E76-L80 WeakPolarHBondContact OE1-CG 3.43Å |
| 77 | R | 98.6 | Very high | 96.8 | Very high | 143 Ų | 143 | 104.4 Ų | 104.4 | 54% | 0.54 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -56.2 | -44 | 171.6 | -177.3 | -176.2 | -66.5 | -82.7 | 2.6 | 111.7 | T73 R75 K81 | T73-R77 WeakPolarHBondContact O-CB 3.49Å; T73-R77 PolarHBondContact O-N 2.9Å; R75-R77 VanDerWaalsContact C-N 3.35Å; R75-R77 PolarHBondContact O-N 3.34Å; R77-K81 WeakPolarHBondContact O-CG 3.48Å; R77-K81 PolarHBondContact O-N 3.14Å |
| 78 | R | 98.6 | Very high | 97 | Very high | 163 Ų | 163 | 104.4 Ų | 104.4 | 62% | 0.615 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -65.6 | -40.5 | 177.6 | -70.4 | 172.1 | -173.2 | 174.4 | 1.9 | 111.7 | M74 R75 E76 K81 K82 | M74-R78 WeakPolarHBondContact O-CG 3.29Å; M74-R78 PolarHBondContact O-N 3.28Å; M74-R78 VanDerWaalsContact O-N 3.09Å; R75-R78 WeakPolarHBondContact O-CB 3.45Å; R75-R78 PolarHBondContact O-N 2.79Å; R75-R78 VanDerWaalsContact O-N 3.13Å; E76-R78 VanDerWaalsContact C-N 3.3Å; E76-R78 PolarHBondContact O-N 2.85Å; R78-K81 PolarHBondContact O-N 3.31Å; R78-K82 PolarHBondContact O-N 2.87Å |
| 79 | R | 98.6 | Very high | 97.3 | Very high | 129 Ų | 129 | 100.3 Ų | 100.3 | 49% | 0.487 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.7 | -50 | 175.7 | -166.3 | -168.1 | 71.9 | 85.2 | 0.9 | 111.1 | R75 E76 K81 K82 V83 | R75-R79 PolarHBondContact O-N 3.28Å; E76-R79 WeakPolarHBondContact O-CB 3.5Å; E76-R79 PolarHBondContact O-N 3.15Å; E76-R79 VanDerWaalsContact O-N 3.16Å; E76-R79 IonicContact OE1-CZ 3.37Å; E76-R79 IonicContact OE1-NE 3.19Å; E76-R79 PolarHBondContact OE1-NE 3.47Å; E76-R79 IonicContact OE1-NH2 2.7Å; E76-R79 PolarHBondContact OE1-NH2 3.09Å; E76-R79 IonicContact OE2-CZ 3.74Å; E76-R79 IonicContact OE2-NE 2.81Å; E76-R79 PolarHBondContact OE2-NE 2.92Å; E76-R79 IonicContact OE2-NH2 3.8Å; R79-K81 VanDerWaalsContact C-N 3.33Å; R79-K81 PolarHBondContact O-N 2.87Å; R79-K82 WeakPolarHBondContact O-CB 3.49Å; R79-K82 PolarHBondContact O-N 3.47Å; R79-K82 VanDerWaalsContact O-N 3.13Å; R79-V83 PolarHBondContact O-N 2.99Å; R79-V83 VanDerWaalsContact O-N 3.09Å |
| 80 | L | 98.3 | Very high | 97.3 | Very high | 68 Ų | 68 | 96 Ų | 96 | 36% | 0.356 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.3 | -34.2 | 178.6 | -70.1 | 174.4 | 0 | 0 | 0 | 112.8 | E76 K82 V83 N84 | E76-L80 HydrophobicContact CG-CD1 4.19Å; E76-L80 HydrophobicContact CG-CG 4.48Å; E76-L80 WeakPolarHBondContact O-CG 3.47Å; E76-L80 PolarHBondContact O-N 3.43Å; E76-L80 WeakPolarHBondContact OE1-CG 3.43Å; L80-K82 VanDerWaalsContact C-N 3.33Å; L80-K82 PolarHBondContact O-N 3.06Å; L80-V83 PolarHBondContact O-N 3.49Å; L80-N84 WeakPolarHBondContact O-CB 3.43Å; L80-N84 PolarHBondContact O-N 3.04Å; L80-N84 PolarHBondContact O-ND2 3.44Å |
| 81 | K | 98.3 | Very high | 97.3 | Very high | 139 Ų | 139 | 88.2 Ų | 88.2 | 60% | 0.604 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -57.8 | -44.5 | 171.7 | -80.4 | -178.9 | 178.4 | -169 | 0 | 111.8 | R77 R78 R79 N84 H85 | R77-K81 WeakPolarHBondContact O-CG 3.48Å; R77-K81 PolarHBondContact O-N 3.14Å; R78-K81 PolarHBondContact O-N 3.31Å; R79-K81 VanDerWaalsContact C-N 3.33Å; R79-K81 PolarHBondContact O-N 2.87Å; K81-N84 PolarHBondContact O-N 3.49Å; K81-H85 WeakPolarHBondContact O-CB 3.29Å; K81-H85 PolarHBondContact O-N 3.19Å |
| 82 | K | 98.4 | Very high | 97.3 | Very high | 163 Ų | 163 | 92 Ų | 92 | 71% | 0.709 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -64.7 | -45.3 | 177.3 | -66.1 | -178.2 | 179.2 | -172 | 0 | 111.7 | R78 R79 L80 N84 H85 A86 | R78-K82 PolarHBondContact O-N 2.87Å; R79-K82 WeakPolarHBondContact O-CB 3.49Å; R79-K82 PolarHBondContact O-N 3.47Å; R79-K82 VanDerWaalsContact O-N 3.13Å; L80-K82 VanDerWaalsContact C-N 3.33Å; L80-K82 PolarHBondContact O-N 3.06Å; K82-N84 VanDerWaalsContact C-N 3.34Å; K82-N84 PolarHBondContact O-N 3.11Å; K82-H85 WeakPolarHBondContact O-CB 3.49Å; K82-H85 PolarHBondContact O-N 3.22Å; K82-A86 PolarHBondContact O-N 3.19Å |
| 83 | V | 98.2 | Very high | 97.2 | Very high | 48 Ų | 48 | 93 Ų | 93 | 29% | 0.291 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.3 | -46.1 | 176.2 | 173.2 | 0 | 0 | 0 | 0 | 110.8 | R79 L80 H85 A86 F87 | R79-V83 PolarHBondContact O-N 2.99Å; R79-V83 VanDerWaalsContact O-N 3.09Å; L80-V83 PolarHBondContact O-N 3.49Å; V83-H85 VanDerWaalsContact C-N 3.33Å; V83-H85 PolarHBondContact O-N 3Å; V83-A86 WeakPolarHBondContact O-CB 3.2Å; V83-A86 PolarHBondContact O-N 2.7Å; V83-F87 HydrophobicContact CG1-CD2 3.92Å; V83-F87 HydrophobicContact CG1-CE2 4.04Å; V83-F87 WeakPolarHBondContact O-CD2 3.4Å; V83-F87 PolarHBondContact O-N 2.95Å |
| 84 | N | 97.8 | Very high | 97 | Very high | 70 Ų | 70 | 90.1 Ų | 90.1 | 37% | 0.374 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -64.3 | -38.7 | 178.3 | -70.3 | -13.9 | 0 | 0 | 0 | 111.7 | L80 K81 K82 A86 F87 E88 K104 | L80-N84 WeakPolarHBondContact O-CB 3.43Å; L80-N84 PolarHBondContact O-N 3.04Å; L80-N84 PolarHBondContact O-ND2 3.44Å; K81-N84 PolarHBondContact O-N 3.49Å; K82-N84 VanDerWaalsContact C-N 3.34Å; K82-N84 PolarHBondContact O-N 3.11Å; N84-A86 VanDerWaalsContact C-N 3.32Å; N84-A86 PolarHBondContact O-N 2.85Å; N84-F87 WeakPolarHBondContact O-CB 3.47Å; N84-F87 PolarHBondContact O-N 3.29Å; N84-E88 WeakPolarHBondContact O-CG 3.42Å; N84-E88 PolarHBondContact O-N 3.04Å; N84-K104 WeakPolarHBondContact OD1-CE 3.4Å; N84-K104 PolarHBondContact OD1-NZ 3.33Å |
| 85 | H | 97.3 | Very high | 96.5 | Very high | 127 Ų | 127 | 86.5 Ų | 86.5 | 59% | 0.588 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -61.2 | -41.4 | 174.5 | -172.1 | 85.2 | 0 | 0 | 0 | 112.2 | K81 K82 V83 E88 A89 | K81-H85 WeakPolarHBondContact O-CB 3.29Å; K81-H85 PolarHBondContact O-N 3.19Å; K82-H85 WeakPolarHBondContact O-CB 3.49Å; K82-H85 PolarHBondContact O-N 3.22Å; V83-H85 VanDerWaalsContact C-N 3.33Å; V83-H85 PolarHBondContact O-N 3Å; H85-E88 PolarHBondContact O-N 3.34Å; H85-A89 PolarHBondContact O-N 3.06Å |
| 86 | A | 97.6 | Very high | 95.7 | Very high | 61 Ų | 61 | 83.3 Ų | 83.3 | 50% | 0.504 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | K82 V83 N84 E88 A89 L90 | K82-A86 PolarHBondContact O-N 3.19Å; V83-A86 WeakPolarHBondContact O-CB 3.2Å; V83-A86 PolarHBondContact O-N 2.7Å; N84-A86 VanDerWaalsContact C-N 3.32Å; N84-A86 PolarHBondContact O-N 2.85Å; A86-E88 PolarHBondContact O-N 3.11Å; A86-A89 PolarHBondContact O-N 2.82Å; A86-L90 WeakPolarHBondContact O-CB 3.42Å; A86-L90 PolarHBondContact O-N 3.37Å |
| 87 | F | 97.1 | Very high | 95.1 | Very high | 40 Ų | 40 | 84.1 Ų | 84.1 | 18% | 0.175 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -61.5 | -41.3 | 173.7 | -96.9 | -82.7 | 0 | 0 | 0 | 112.6 | V83 N84 A89 L90 R91 K104 I107 L108 | V83-F87 HydrophobicContact CG1-CD2 3.92Å; V83-F87 HydrophobicContact CG1-CE2 4.04Å; V83-F87 WeakPolarHBondContact O-CD2 3.4Å; V83-F87 PolarHBondContact O-N 2.95Å; N84-F87 WeakPolarHBondContact O-CB 3.47Å; N84-F87 PolarHBondContact O-N 3.29Å; F87-A89 VanDerWaalsContact C-N 3.33Å; F87-L90 PolarHBondContact O-N 3.23Å; F87-R91 WeakPolarHBondContact O-CB 3.5Å; F87-R91 PolarHBondContact O-N 3.41Å; F87-K104 HydrophobicContact CD1-CB 4.25Å; F87-K104 HydrophobicContact CD1-CG 4.07Å; F87-K104 HydrophobicContact CE1-CB 3.77Å; F87-K104 HydrophobicContact CE1-CD 4.46Å; F87-K104 HydrophobicContact CE1-CG 4.02Å; F87-K104 HydrophobicContact CE2-CD 4.34Å; F87-K104 HydrophobicContact CG-CG 4.45Å; F87-K104 HydrophobicContact CZ-CB 4.16Å; F87-K104 HydrophobicContact CZ-CD 4.31Å; F87-K104 HydrophobicContact CZ-CG 4.36Å; F87-I107 HydrophobicContact CD1-CB 4.26Å; F87-I107 HydrophobicContact CD1-CD1 4.1Å; F87-I107 HydrophobicContact CD1-CG2 4.07Å; F87-L108 HydrophobicContact CE1-CD2 3.97Å; F87-L108 HydrophobicContact CE1-CG 4.02Å; F87-L108 HydrophobicContact CZ-CD1 4.41Å; F87-L108 HydrophobicContact CZ-CD2 4.11Å; F87-L108 HydrophobicContact CZ-CG 4.31Å |
| 88 | E | 95.4 | Very high | 94.1 | Very high | 91 Ų | 91 | 81 Ų | 81 | 43% | 0.425 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -66.5 | -35.6 | 175.6 | -69.8 | -57.1 | 144.4 | 0 | 0 | 112.2 | N84 H85 A86 R91 R92 | N84-E88 WeakPolarHBondContact O-CG 3.42Å; N84-E88 PolarHBondContact O-N 3.04Å; H85-E88 PolarHBondContact O-N 3.34Å; A86-E88 PolarHBondContact O-N 3.11Å; E88-R91 WeakPolarHBondContact OE2-CD 3.32Å; E88-R91 IonicContact OE2-NE 3.47Å; E88-R91 PolarHBondContact OE2-NE 3.25Å; E88-R92 WeakPolarHBondContact O-CG 3.5Å; E88-R92 PolarHBondContact O-N 3.23Å; E88-R92 VanDerWaalsContact O-N 3.12Å; E88-R92 PolarHBondContact O-NE 2.89Å |
| 89 | A | 95.1 | Very high | 93.2 | Very high | 32 Ų | 32 | 78.4 Ų | 78.4 | 26% | 0.264 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -66.4 | -49.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | H85 A86 F87 R91 R92 C93 | H85-A89 PolarHBondContact O-N 3.06Å; A86-A89 PolarHBondContact O-N 2.82Å; F87-A89 VanDerWaalsContact C-N 3.33Å; A89-R91 VanDerWaalsContact C-N 3.33Å; A89-R91 PolarHBondContact O-N 2.69Å; A89-R92 WeakPolarHBondContact O-CB 3.43Å; A89-R92 PolarHBondContact O-N 3.47Å; A89-R92 VanDerWaalsContact O-N 3.12Å; A89-C93 PolarHBondContact O-N 3.16Å; A89-C93 PolarHBondContact O-SG 3.28Å |
| 90 | L | 96.4 | Very high | 92.6 | Very high | 60 Ų | 60 | 77.4 Ų | 77.4 | 31% | 0.314 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -55.8 | -49.9 | 177 | 179.6 | 59.5 | 0 | 0 | 0 | 111.2 | A86 F87 R92 C93 T94 I107 L108 A111 | A86-L90 WeakPolarHBondContact O-CB 3.42Å; A86-L90 PolarHBondContact O-N 3.37Å; F87-L90 PolarHBondContact O-N 3.23Å; L90-R92 VanDerWaalsContact C-N 3.28Å; L90-R92 PolarHBondContact O-N 2.91Å; L90-C93 WeakPolarHBondContact O-CB 3.29Å; L90-C93 PolarHBondContact O-N 2.99Å; L90-T94 HydrophobicContact CD1-CG2 3.77Å; L90-T94 HydrophobicContact CG-CG2 4.35Å; L90-T94 WeakPolarHBondContact O-CG2 3.22Å; L90-T94 PolarHBondContact O-N 3.02Å; L90-T94 PolarHBondContact O-OG1 3Å; L90-I107 HydrophobicContact CB-CG2 4.23Å; L90-I107 HydrophobicContact CD2-CG2 3.84Å; L90-I107 HydrophobicContact CG-CG2 3.86Å; L90-L108 HydrophobicContact CD2-CD2 4.27Å; L90-A111 HydrophobicContact CD1-CB 3.82Å; L90-A111 HydrophobicContact CD2-CB 4.05Å; L90-A111 HydrophobicContact CG-CB 4.17Å |
| 91 | R | 95.4 | Very high | 92.2 | Very high | 7 Ų | 7 | 85.2 Ų | 85.2 | 3% | 0.026 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -54.2 | -40.8 | 176 | 171.1 | -165.4 | 154.7 | 69.4 | 13.5 | 113.2 | F87 E88 A89 C93 S95 P98 Q100 L102 I107 | F87-R91 WeakPolarHBondContact O-CB 3.5Å; F87-R91 PolarHBondContact O-N 3.41Å; E88-R91 WeakPolarHBondContact OE2-CD 3.32Å; E88-R91 IonicContact OE2-NE 3.47Å; E88-R91 PolarHBondContact OE2-NE 3.25Å; A89-R91 VanDerWaalsContact C-N 3.33Å; A89-R91 PolarHBondContact O-N 2.69Å; R91-C93 VanDerWaalsContact C-N 3.27Å; R91-C93 PolarHBondContact O-N 3.4Å; R91-S95 WeakPolarHBondContact O-CB 3.34Å; R91-S95 PolarHBondContact O-N 3.26Å; R91-P98 PolarHBondContact NH2-O 2.92Å; R91-Q100 PolarHBondContact NH1-O 3Å; R91-Q100 PolarHBondContact NH2-O 3.35Å; R91-L102 VanDerWaalsContact NH1-CG 3.35Å; R91-I107 HydrophobicContact CB-CD1 3.93Å; R91-I107 HydrophobicContact CB-CG1 4.06Å; R91-I107 HydrophobicContact CB-CG2 4.05Å; R91-I107 HydrophobicContact CG-CD1 4.22Å; R91-I107 HydrophobicContact CG-CG1 4.29Å |
| 92 | R | 94.2 | Very high | 91.8 | Very high | 132 Ų | 132 | 80.4 Ų | 80.4 | 50% | 0.498 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -66.3 | -29.7 | 177.6 | -83.2 | -179 | -96.9 | 113.4 | -4.4 | 112.7 | E88 A89 L90 P98 | E88-R92 WeakPolarHBondContact O-CG 3.5Å; E88-R92 PolarHBondContact O-N 3.23Å; E88-R92 VanDerWaalsContact O-N 3.12Å; E88-R92 PolarHBondContact O-NE 2.89Å; A89-R92 WeakPolarHBondContact O-CB 3.43Å; A89-R92 PolarHBondContact O-N 3.47Å; A89-R92 VanDerWaalsContact O-N 3.12Å; L90-R92 VanDerWaalsContact C-N 3.28Å; L90-R92 PolarHBondContact O-N 2.91Å; R92-P98 HydrophobicContact CG-CB 4.4Å |
| 93 | C | 92.5 | Very high | 91.7 | Very high | 65 Ų | 65 | 76.4 Ų | 76.4 | 44% | 0.439 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -82.5 | -33.7 | 178.2 | -61.2 | 0 | 0 | 0 | 0 | 112.7 | A89 L90 R91 | A89-C93 PolarHBondContact O-N 3.16Å; A89-C93 PolarHBondContact O-SG 3.28Å; L90-C93 WeakPolarHBondContact O-CB 3.29Å; L90-C93 PolarHBondContact O-N 2.99Å; R91-C93 VanDerWaalsContact C-N 3.27Å; R91-C93 PolarHBondContact O-N 3.4Å |
| 94 | T | 93.2 | Very high | 91.6 | Very high | 18 Ų | 18 | 79 Ų | 79 | 11% | 0.11 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -102.7 | -18.7 | -169.4 | 65.2 | 0 | 0 | 0 | 0 | 113.6 | L90 A111 Y114 | L90-T94 HydrophobicContact CD1-CG2 3.77Å; L90-T94 HydrophobicContact CG-CG2 4.35Å; L90-T94 WeakPolarHBondContact O-CG2 3.22Å; L90-T94 PolarHBondContact O-N 3.02Å; L90-T94 PolarHBondContact O-OG1 3Å; T94-A111 HydrophobicContact CG2-CB 3.88Å; T94-Y114 HydrophobicContact CG2-CD1 4.17Å; T94-Y114 HydrophobicContact CG2-CG 4.41Å |
| 95 | S | 88.8 | Confident | 91.6 | Very high | 18 Ų | 18 | 79.3 Ų | 79.3 | 13% | 0.126 | 43% | 0.431 | C | S | . | . | trans | -94.2 | 131.2 | 178.5 | -176.3 | 0 | 0 | 0 | 0 | 111 | R91 N97 | R91-S95 WeakPolarHBondContact O-CB 3.34Å; R91-S95 PolarHBondContact O-N 3.26Å; S95-N97 PolarHBondContact O-N 3Å; S95-N97 PolarHBondContact OG-N 3.35Å; S95-N97 PolarHBondContact OG-O 3.43Å | ||
| 96 | A | 81.9 | Confident | 91.6 | Very high | 98 Ų | 98 | 76.2 Ų | 76.2 | 81% | 0.81 | 42% | 0.417 | S | S | * | . | S | Bend | trans | -62.5 | -27.1 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 97 | N | 85.2 | Confident | 91.5 | Very high | 94 Ų | 94 | 73.5 Ų | 73.5 | 50% | 0.503 | 39% | 0.393 | S | S | . | . | trans | -116 | 99.2 | 178.5 | -69.5 | -61.7 | 0 | 0 | 0 | 110.4 | S95 S99 Q100 | S95-N97 PolarHBondContact O-N 3Å; S95-N97 PolarHBondContact OG-N 3.35Å; S95-N97 PolarHBondContact OG-O 3.43Å; N97-S99 PolarHBondContact O-N 3.26Å; N97-Q100 HydrophobicContact CB-CB 4.21Å; N97-Q100 PolarHBondContact O-N 3.05Å | ||
| 98 | P | 77.1 | Confident | 91.5 | Very high | 79 Ų | 79 | 75.6 Ų | 75.6 | 51% | 0.513 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.9 | -18.6 | -176.6 | 26.4 | -34 | 0 | 0 | 0 | 113.3 | R91 R92 | R91-P98 PolarHBondContact NH2-O 2.92Å; R92-P98 HydrophobicContact CG-CB 4.4Å |
| 99 | S | 80.3 | Confident | 91.6 | Very high | 107 Ų | 107 | 78 Ų | 78 | 75% | 0.748 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.4 | -24.7 | -179.3 | 54.2 | 0 | 0 | 0 | 0 | 114.6 | N97 R101 | N97-S99 PolarHBondContact O-N 3.26Å; S99-R101 PolarHBondContact O-N 3.06Å |
| 100 | Q | 86.3 | Confident | 91.7 | Very high | 108 Ų | 108 | 78.5 Ų | 78.5 | 51% | 0.505 | 41% | 0.409 | S | S | . | . | S | Bend | trans | -83.3 | 105.3 | -172.8 | 177.9 | -162 | -1.2 | 0 | 0 | 112.2 | R91 N97 L102 | R91-Q100 PolarHBondContact NH1-O 3Å; R91-Q100 PolarHBondContact NH2-O 3.35Å; N97-Q100 HydrophobicContact CB-CB 4.21Å; N97-Q100 PolarHBondContact O-N 3.05Å; Q100-L102 PolarHBondContact O-N 2.84Å |
| 101 | R | 90.4 | Very high | 91.8 | Very high | 233 Ų | 233 | 76.1 Ų | 76.1 | 88% | 0.879 | 40% | 0.399 | S | S | * | . | trans | -54.2 | 131.2 | -178.7 | -66 | 179.6 | 70.7 | -166.9 | 0.9 | 112.5 | S99 | S99-R101 PolarHBondContact O-N 3.06Š| ||
| 102 | L | 90.4 | Very high | 91.9 | Very high | 38 Ų | 38 | 80.5 Ų | 80.5 | 20% | 0.199 | 42% | 0.421 | C | S | . | . | trans | -120.3 | 145 | -177.5 | -69.7 | 173.5 | 0 | 0 | 0 | 109.8 | R91 Q100 I107 | R91-L102 VanDerWaalsContact NH1-CG 3.35Å; Q100-L102 PolarHBondContact O-N 2.84Å; L102-I107 HydrophobicContact CB-CD1 4.32Å; L102-I107 HydrophobicContact CB-CG1 3.79Å; L102-I107 HydrophobicContact CD1-CG1 4.47Å | ||
| 103 | P | 95.8 | Very high | 92 | Very high | 79 Ų | 79 | 80.4 Ų | 80.4 | 51% | 0.513 | 43% | 0.427 | S | S | . | . | trans | -70.4 | 152.1 | 174.1 | 27.4 | -29.6 | 0 | 0 | 0 | 111 | V105 E106 I107 | P103-V105 VanDerWaalsContact C-N 3.28Å; P103-V105 PolarHBondContact O-N 3.49Å; P103-E106 HydrophobicContact CG-CB 3.63Å; P103-E106 WeakPolarHBondContact O-CB 3.5Å; P103-E106 PolarHBondContact O-N 3.45Å; P103-I107 PolarHBondContact O-N 2.85Å | ||
| 104 | K | 96.5 | Very high | 92.2 | Very high | 102 Ų | 102 | 82 Ų | 82 | 44% | 0.443 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -55.7 | -41.5 | -175.5 | -71 | -173.8 | 174.8 | -173.5 | 0 | 113.1 | N84 F87 E106 I107 L108 | N84-K104 WeakPolarHBondContact OD1-CE 3.4Å; N84-K104 PolarHBondContact OD1-NZ 3.33Å; F87-K104 HydrophobicContact CD1-CB 4.25Å; F87-K104 HydrophobicContact CD1-CG 4.07Å; F87-K104 HydrophobicContact CE1-CB 3.77Å; F87-K104 HydrophobicContact CE1-CD 4.46Å; F87-K104 HydrophobicContact CE1-CG 4.02Å; F87-K104 HydrophobicContact CE2-CD 4.34Å; F87-K104 HydrophobicContact CG-CG 4.45Å; F87-K104 HydrophobicContact CZ-CB 4.16Å; F87-K104 HydrophobicContact CZ-CD 4.31Å; F87-K104 HydrophobicContact CZ-CG 4.36Å; K104-E106 VanDerWaalsContact C-N 3.26Å; K104-E106 PolarHBondContact O-N 2.85Å; K104-I107 PolarHBondContact O-N 3.03Å; K104-L108 WeakPolarHBondContact O-CG 3.45Å; K104-L108 PolarHBondContact O-N 3.19Å |
| 105 | V | 97.6 | Very high | 92.4 | Very high | 76 Ų | 76 | 85.7 Ų | 85.7 | 46% | 0.461 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62 | -37.1 | 178.4 | 68.8 | 0 | 0 | 0 | 0 | 111.8 | P103 L108 R109 | P103-V105 VanDerWaalsContact C-N 3.28Å; P103-V105 PolarHBondContact O-N 3.49Å; V105-L108 WeakPolarHBondContact O-CB 3.41Å; V105-L108 PolarHBondContact O-N 3.23Å; V105-R109 PolarHBondContact O-N 2.98Å; V105-R109 VanDerWaalsContact O-N 3.11Å |
| 106 | E | 96.3 | Very high | 92.8 | Very high | 63 Ų | 63 | 90 Ų | 90 | 29% | 0.294 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -77 | -34.9 | -177.6 | -165.6 | 57.3 | -149.3 | 0 | 0 | 111.8 | P103 K104 L108 R109 N110 | P103-E106 HydrophobicContact CG-CB 3.63Å; P103-E106 WeakPolarHBondContact O-CB 3.5Å; P103-E106 PolarHBondContact O-N 3.45Å; K104-E106 VanDerWaalsContact C-N 3.26Å; K104-E106 PolarHBondContact O-N 2.85Å; E106-L108 PolarHBondContact O-N 3.23Å; E106-R109 PolarHBondContact O-N 3.39Å; E106-R109 IonicContact OE2-CZ 3.88Å; E106-R109 IonicContact OE2-NH1 2.85Å; E106-R109 PolarHBondContact OE2-NH1 2.81Å; E106-N110 PolarHBondContact O-N 3.19Å; E106-N110 PolarHBondContact O-ND2 2.95Å; E106-N110 PolarHBondContact OE1-ND2 3.25Å |
| 107 | I | 95.9 | Very high | 93.5 | Very high | 3 Ų | 3 | 88.4 Ų | 88.4 | 2% | 0.015 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -57.2 | -41.1 | 169.9 | -64.3 | 166.1 | 0 | 0 | 0 | 110.2 | F87 L90 R91 L102 P103 K104 A111 | F87-I107 HydrophobicContact CD1-CB 4.26Å; F87-I107 HydrophobicContact CD1-CD1 4.1Å; F87-I107 HydrophobicContact CD1-CG2 4.07Å; L90-I107 HydrophobicContact CB-CG2 4.23Å; L90-I107 HydrophobicContact CD2-CG2 3.84Å; L90-I107 HydrophobicContact CG-CG2 3.86Å; R91-I107 HydrophobicContact CB-CD1 3.93Å; R91-I107 HydrophobicContact CB-CG1 4.06Å; R91-I107 HydrophobicContact CB-CG2 4.05Å; R91-I107 HydrophobicContact CG-CD1 4.22Å; R91-I107 HydrophobicContact CG-CG1 4.29Å; L102-I107 HydrophobicContact CB-CD1 4.32Å; L102-I107 HydrophobicContact CB-CG1 3.79Å; L102-I107 HydrophobicContact CD1-CG1 4.47Å; P103-I107 PolarHBondContact O-N 2.85Å; K104-I107 PolarHBondContact O-N 3.03Å; I107-A111 WeakPolarHBondContact O-CB 3.19Å; I107-A111 PolarHBondContact O-N 3.41Å |
| 108 | L | 97.9 | Very high | 94 | Very high | 84 Ų | 84 | 87 Ų | 87 | 44% | 0.44 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -67.5 | -41.9 | 177.9 | -63.2 | 175 | 0 | 0 | 0 | 112.4 | F87 L90 K104 V105 E106 A111 I112 | F87-L108 HydrophobicContact CE1-CD2 3.97Å; F87-L108 HydrophobicContact CE1-CG 4.02Å; F87-L108 HydrophobicContact CZ-CD1 4.41Å; F87-L108 HydrophobicContact CZ-CD2 4.11Å; F87-L108 HydrophobicContact CZ-CG 4.31Å; L90-L108 HydrophobicContact CD2-CD2 4.27Å; K104-L108 WeakPolarHBondContact O-CG 3.45Å; K104-L108 PolarHBondContact O-N 3.19Å; V105-L108 WeakPolarHBondContact O-CB 3.41Å; V105-L108 PolarHBondContact O-N 3.23Å; E106-L108 PolarHBondContact O-N 3.23Å; L108-A111 WeakPolarHBondContact O-CB 3.49Å; L108-A111 PolarHBondContact O-N 3.05Å; L108-I112 WeakPolarHBondContact O-CG1 3.4Å; L108-I112 PolarHBondContact O-N 3.45Å; L108-I112 VanDerWaalsContact O-N 3.09Å |
| 109 | R | 97.4 | Very high | 94.9 | Very high | 142 Ų | 142 | 88.9 Ų | 88.9 | 54% | 0.536 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.2 | -45.8 | 175.9 | -69 | 179.4 | -170.9 | 138.4 | -5.6 | 112 | V105 E106 A111 I112 Q113 | V105-R109 PolarHBondContact O-N 2.98Å; V105-R109 VanDerWaalsContact O-N 3.11Å; E106-R109 PolarHBondContact O-N 3.39Å; E106-R109 IonicContact OE2-CZ 3.88Å; E106-R109 IonicContact OE2-NH1 2.85Å; E106-R109 PolarHBondContact OE2-NH1 2.81Å; R109-A111 VanDerWaalsContact C-N 3.27Å; R109-A111 PolarHBondContact O-N 3.32Å; R109-I112 PolarHBondContact O-N 3.47Å; R109-Q113 PolarHBondContact O-N 2.7Å |
| 110 | N | 96.4 | Very high | 95.6 | Very high | 42 Ų | 42 | 87.5 Ų | 87.5 | 23% | 0.225 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -61 | -37.3 | 175.6 | -79.2 | -80.3 | 0 | 0 | 0 | 111.7 | E106 Q113 Y114 | E106-N110 PolarHBondContact O-N 3.19Å; E106-N110 PolarHBondContact O-ND2 2.95Å; E106-N110 PolarHBondContact OE1-ND2 3.25Å; N110-Q113 PolarHBondContact O-N 3.09Å; N110-Y114 WeakPolarHBondContact O-CB 3.44Å; N110-Y114 PolarHBondContact O-N 3.4Å |
| 111 | A | 97.7 | Very high | 96 | Very high | 11 Ų | 11 | 87.3 Ų | 87.3 | 9% | 0.091 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.2 | -43.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L90 T94 I107 L108 R109 Y114 I115 | L90-A111 HydrophobicContact CD1-CB 3.82Å; L90-A111 HydrophobicContact CD2-CB 4.05Å; L90-A111 HydrophobicContact CG-CB 4.17Å; T94-A111 HydrophobicContact CG2-CB 3.88Å; I107-A111 WeakPolarHBondContact O-CB 3.19Å; I107-A111 PolarHBondContact O-N 3.41Å; L108-A111 WeakPolarHBondContact O-CB 3.49Å; L108-A111 PolarHBondContact O-N 3.05Å; R109-A111 VanDerWaalsContact C-N 3.27Å; R109-A111 PolarHBondContact O-N 3.32Å; A111-Y114 PolarHBondContact O-N 2.82Å; A111-I115 VanDerWaalsContact O-CG1 3.32Å; A111-I115 WeakPolarHBondContact O-CG1 3.47Å; A111-I115 PolarHBondContact O-N 3.01Å |
| 112 | I | 97.3 | Very high | 96.2 | Very high | 98 Ų | 98 | 79.2 Ų | 79.2 | 50% | 0.503 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.6 | -52.5 | 176.6 | -66 | 164 | 0 | 0 | 0 | 109.6 | L108 R109 Y114 I115 E116 | L108-I112 WeakPolarHBondContact O-CG1 3.4Å; L108-I112 PolarHBondContact O-N 3.45Å; L108-I112 VanDerWaalsContact O-N 3.09Å; R109-I112 PolarHBondContact O-N 3.47Å; I112-Y114 VanDerWaalsContact C-N 3.29Å; I112-Y114 PolarHBondContact O-N 3.13Å; I112-I115 PolarHBondContact O-N 3.45Å; I112-I115 VanDerWaalsContact O-N 3.14Å; I112-E116 HydrophobicContact CG2-CG 4.46Å; I112-E116 WeakPolarHBondContact CG2-OE1 3.26Å; I112-E116 WeakPolarHBondContact O-CG 3.32Å; I112-E116 PolarHBondContact O-N 3.45Å |
| 113 | Q | 97.1 | Very high | 96.2 | Very high | 130 Ų | 130 | 82.9 Ų | 82.9 | 61% | 0.607 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -64.3 | -32.7 | -178.6 | -170.8 | 160 | 47.5 | 0 | 0 | 113.2 | R109 N110 S117 | R109-Q113 PolarHBondContact O-N 2.7Å; N110-Q113 PolarHBondContact O-N 3.09Å; Q113-S117 WeakPolarHBondContact O-CB 3.48Å; Q113-S117 PolarHBondContact O-N 3.23Å; Q113-S117 PolarHBondContact O-OG 3.35Å |
| 114 | Y | 96.9 | Very high | 95.8 | Very high | 100 Ų | 100 | 84.6 Ų | 84.6 | 39% | 0.392 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -67.7 | -41.6 | 175 | -174.9 | -112.2 | 0 | 0 | 0 | 111.7 | T94 N110 A111 I112 S117 L118 | T94-Y114 HydrophobicContact CG2-CD1 4.17Å; T94-Y114 HydrophobicContact CG2-CG 4.41Å; N110-Y114 WeakPolarHBondContact O-CB 3.44Å; N110-Y114 PolarHBondContact O-N 3.4Å; A111-Y114 PolarHBondContact O-N 2.82Å; I112-Y114 VanDerWaalsContact C-N 3.29Å; I112-Y114 PolarHBondContact O-N 3.13Å; Y114-S117 PolarHBondContact O-OG 3.45Å; Y114-L118 HydrophobicContact CD1-CD1 3.91Å; Y114-L118 HydrophobicContact CE1-CD1 3.45Å; Y114-L118 VanDerWaalsContact CE1-CD1 3.45Å; Y114-L118 HydrophobicContact CE1-CG 4.36Å; Y114-L118 HydrophobicContact CE2-CD1 4.27Å; Y114-L118 HydrophobicContact CE2-CG 4.37Å; Y114-L118 VanDerWaalsContact O-CG 3.29Å; Y114-L118 WeakPolarHBondContact O-CG 3.48Å; Y114-L118 PolarHBondContact O-N 2.97Å; Y114-L118 VanDerWaalsContact O-N 3.11Å |
| 115 | I | 96.9 | Very high | 95.3 | Very high | 95 Ų | 95 | 85.9 Ų | 85.9 | 49% | 0.487 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -65.4 | -46.2 | 175.8 | -66.9 | 165.4 | 0 | 0 | 0 | 110.5 | A111 I112 S117 L118 Q119 | A111-I115 VanDerWaalsContact O-CG1 3.32Å; A111-I115 WeakPolarHBondContact O-CG1 3.47Å; A111-I115 PolarHBondContact O-N 3.01Å; I112-I115 PolarHBondContact O-N 3.45Å; I112-I115 VanDerWaalsContact O-N 3.14Å; I115-S117 PolarHBondContact O-N 2.93Å; I115-L118 PolarHBondContact O-N 3.21Å; I115-Q119 HydrophobicContact CG2-CG 4.31Å; I115-Q119 WeakPolarHBondContact O-CB 3.46Å; I115-Q119 VanDerWaalsContact O-CG 3.27Å; I115-Q119 WeakPolarHBondContact O-CG 3.47Å; I115-Q119 PolarHBondContact O-N 3.43Å |
| 116 | E | 97.6 | Very high | 94.6 | Very high | 109 Ų | 109 | 85 Ų | 85 | 51% | 0.509 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -59.9 | -43.5 | 179.2 | -71.1 | 171.3 | 168.9 | 0 | 0 | 111.9 | I112 Q119 E120 | I112-E116 HydrophobicContact CG2-CG 4.46Å; I112-E116 WeakPolarHBondContact CG2-OE1 3.26Å; I112-E116 WeakPolarHBondContact O-CG 3.32Å; I112-E116 PolarHBondContact O-N 3.45Å; E116-Q119 WeakPolarHBondContact O-CB 3.46Å; E116-Q119 PolarHBondContact O-N 2.84Å; E116-E120 PolarHBondContact O-N 3.49Å |
| 117 | S | 96.1 | Very high | 93.8 | Very high | 64 Ų | 64 | 86.4 Ų | 86.4 | 45% | 0.448 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -67.4 | -38.6 | 178.6 | 58.5 | 0 | 0 | 0 | 0 | 112.9 | Q113 Y114 I115 Q119 E120 L121 | Q113-S117 WeakPolarHBondContact O-CB 3.48Å; Q113-S117 PolarHBondContact O-N 3.23Å; Q113-S117 PolarHBondContact O-OG 3.35Å; Y114-S117 PolarHBondContact O-OG 3.45Å; I115-S117 PolarHBondContact O-N 2.93Å; S117-Q119 VanDerWaalsContact C-N 3.35Å; S117-E120 PolarHBondContact O-N 3.32Å; S117-L121 PolarHBondContact O-N 2.97Å; S117-L121 VanDerWaalsContact O-N 3.08Å |
| 118 | L | 96.4 | Very high | 93 | Very high | 63 Ų | 63 | 90.2 Ų | 90.2 | 33% | 0.33 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.8 | -37.7 | 173.1 | -71.1 | 177.4 | 0 | 0 | 0 | 112.3 | Y114 I115 L122 | Y114-L118 HydrophobicContact CD1-CD1 3.91Å; Y114-L118 HydrophobicContact CE1-CD1 3.45Å; Y114-L118 VanDerWaalsContact CE1-CD1 3.45Å; Y114-L118 HydrophobicContact CE1-CG 4.36Å; Y114-L118 HydrophobicContact CE2-CD1 4.27Å; Y114-L118 HydrophobicContact CE2-CG 4.37Å; Y114-L118 VanDerWaalsContact O-CG 3.29Å; Y114-L118 WeakPolarHBondContact O-CG 3.48Å; Y114-L118 PolarHBondContact O-N 2.97Å; Y114-L118 VanDerWaalsContact O-N 3.11Å; I115-L118 PolarHBondContact O-N 3.21Å; L118-L122 WeakPolarHBondContact O-CB 3.14Å; L118-L122 VanDerWaalsContact O-CG 3.29Å; L118-L122 WeakPolarHBondContact O-CG 3.09Å; L118-L122 PolarHBondContact O-N 3.4Å |
| 119 | Q | 95.8 | Very high | 92 | Very high | 120 Ų | 120 | 93.3 Ų | 93.3 | 56% | 0.561 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -62.8 | -43.8 | 175.8 | -76.2 | 173 | -25.6 | 0 | 0 | 111.5 | I115 E116 S117 L122 R123 | I115-Q119 HydrophobicContact CG2-CG 4.31Å; I115-Q119 WeakPolarHBondContact O-CB 3.46Å; I115-Q119 VanDerWaalsContact O-CG 3.27Å; I115-Q119 WeakPolarHBondContact O-CG 3.47Å; I115-Q119 PolarHBondContact O-N 3.43Å; E116-Q119 WeakPolarHBondContact O-CB 3.46Å; E116-Q119 PolarHBondContact O-N 2.84Å; S117-Q119 VanDerWaalsContact C-N 3.35Å; Q119-L122 PolarHBondContact O-N 2.93Å; Q119-R123 WeakPolarHBondContact O-CB 3.32Å; Q119-R123 PolarHBondContact O-N 3.3Å |
| 120 | E | 94.9 | Very high | 90.6 | Very high | 78 Ų | 78 | 94.4 Ų | 94.4 | 36% | 0.364 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.8 | -44.5 | 178.1 | -171.3 | 62.4 | -172.8 | 0 | 0 | 111.6 | E116 S117 L122 R123 E124 | E116-E120 PolarHBondContact O-N 3.49Å; S117-E120 PolarHBondContact O-N 3.32Å; E120-L122 VanDerWaalsContact C-N 3.3Å; E120-L122 PolarHBondContact O-N 2.95Å; E120-R123 VanDerWaalsContact CD-NH2 3.32Å; E120-R123 WeakPolarHBondContact O-CB 3.23Å; E120-R123 PolarHBondContact O-N 3.25Å; E120-R123 IonicContact OE1-CZ 3.61Å; E120-R123 IonicContact OE1-NE 3.8Å; E120-R123 IonicContact OE1-NH2 2.69Å; E120-R123 PolarHBondContact OE1-NH2 2.92Å; E120-R123 IonicContact OE2-CZ 3.51Å; E120-R123 IonicContact OE2-NE 3.01Å; E120-R123 PolarHBondContact OE2-NE 3.3Å; E120-R123 IonicContact OE2-NH2 3.13Å; E120-R123 PolarHBondContact OE2-NH2 3.04Å; E120-R123 VanDerWaalsContact OE2-NH2 3.13Å; E120-E124 WeakPolarHBondContact O-CG 3.44Å; E120-E124 PolarHBondContact O-N 3.46Å |
| 121 | L | 95.4 | Very high | 89.2 | Confident | 104 Ų | 104 | 96.9 Ų | 96.9 | 55% | 0.545 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.9 | -39 | 177.6 | -173.1 | 142.8 | 0 | 0 | 0 | 112.5 | S117 Q125 | S117-L121 PolarHBondContact O-N 2.97Å; S117-L121 VanDerWaalsContact O-N 3.08Å; L121-Q125 WeakPolarHBondContact O-CB 3.48Å; L121-Q125 PolarHBondContact O-N 3.26Å; L121-Q125 VanDerWaalsContact O-N 3.14Å |
| 122 | L | 93.8 | Very high | 87 | Confident | 62 Ų | 62 | 102.6 Ų | 102.6 | 33% | 0.325 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.8 | -37.3 | 174.6 | -71.7 | 172.8 | 0 | 0 | 0 | 111.9 | L118 Q119 E120 Q125 V126 W159 | L118-L122 WeakPolarHBondContact O-CB 3.14Å; L118-L122 VanDerWaalsContact O-CG 3.29Å; L118-L122 WeakPolarHBondContact O-CG 3.09Å; L118-L122 PolarHBondContact O-N 3.4Å; Q119-L122 PolarHBondContact O-N 2.93Å; E120-L122 VanDerWaalsContact C-N 3.3Å; E120-L122 PolarHBondContact O-N 2.95Å; L122-Q125 PolarHBondContact O-N 3.24Å; L122-V126 WeakPolarHBondContact O-CB 3.48Å; L122-V126 VanDerWaalsContact O-CG2 3.23Å; L122-V126 WeakPolarHBondContact O-CG2 3.49Å; L122-V126 PolarHBondContact O-N 3Å; L122-W159 HydrophobicContact CD1-CH2 4.28Å; L122-W159 HydrophobicContact CD1-CZ3 4.37Å |
| 123 | R | 91.3 | Very high | 84.9 | Confident | 116 Ų | 116 | 104 Ų | 104 | 44% | 0.438 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.8 | -44.9 | 178 | -167.3 | 175.7 | 70.4 | 89.5 | -2.7 | 111.4 | Q119 E120 Q125 V126 E127 | Q119-R123 WeakPolarHBondContact O-CB 3.32Å; Q119-R123 PolarHBondContact O-N 3.3Å; E120-R123 VanDerWaalsContact CD-NH2 3.32Å; E120-R123 WeakPolarHBondContact O-CB 3.23Å; E120-R123 PolarHBondContact O-N 3.25Å; E120-R123 IonicContact OE1-CZ 3.61Å; E120-R123 IonicContact OE1-NE 3.8Å; E120-R123 IonicContact OE1-NH2 2.69Å; E120-R123 PolarHBondContact OE1-NH2 2.92Å; E120-R123 IonicContact OE2-CZ 3.51Å; E120-R123 IonicContact OE2-NE 3.01Å; E120-R123 PolarHBondContact OE2-NE 3.3Å; E120-R123 IonicContact OE2-NH2 3.13Å; E120-R123 PolarHBondContact OE2-NH2 3.04Å; E120-R123 VanDerWaalsContact OE2-NH2 3.13Å; R123-Q125 VanDerWaalsContact C-N 3.35Å; R123-Q125 PolarHBondContact O-N 3.29Å; R123-V126 PolarHBondContact O-N 3.22Å; R123-E127 IonicContact CZ-OE1 3.69Å; R123-E127 IonicContact NH1-OE1 2.7Å; R123-E127 PolarHBondContact NH1-OE1 2.9Å; R123-E127 IonicContact NH1-OE2 3.81Å; R123-E127 WeakPolarHBondContact O-CB 3.38Å; R123-E127 WeakPolarHBondContact O-CG 3.41Å; R123-E127 PolarHBondContact O-N 3.12Å |
| 124 | E | 87.4 | Confident | 82.7 | Confident | 115 Ų | 115 | 101 Ų | 101 | 54% | 0.537 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60 | -43 | 174.2 | -71.9 | 178.7 | -179.5 | 0 | 0 | 112 | E120 V126 E127 S128 | E120-E124 WeakPolarHBondContact O-CG 3.44Å; E120-E124 PolarHBondContact O-N 3.46Å; E124-V126 PolarHBondContact O-N 2.94Å; E124-E127 PolarHBondContact O-N 3.12Å; E124-S128 VanDerWaalsContact O-CB 3.23Å; E124-S128 WeakPolarHBondContact O-CB 3.5Å; E124-S128 PolarHBondContact O-N 3.38Å |
| 125 | Q | 85.3 | Confident | 80.4 | Confident | 128 Ų | 128 | 104.6 Ų | 104.6 | 60% | 0.598 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.4 | -39.9 | 178.2 | -174.6 | 174.1 | 56.2 | 0 | 0 | 112 | L121 L122 R123 F129 | L121-Q125 WeakPolarHBondContact O-CB 3.48Å; L121-Q125 PolarHBondContact O-N 3.26Å; L121-Q125 VanDerWaalsContact O-N 3.14Å; L122-Q125 PolarHBondContact O-N 3.24Å; R123-Q125 VanDerWaalsContact C-N 3.35Å; R123-Q125 PolarHBondContact O-N 3.29Å; Q125-F129 WeakPolarHBondContact O-CB 3.48Å; Q125-F129 PolarHBondContact O-N 2.84Å |
| 126 | V | 83.8 | Confident | 77.8 | Confident | 59 Ų | 59 | 106 Ų | 106 | 36% | 0.358 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64 | -51.5 | 174.7 | 164 | 0 | 0 | 0 | 0 | 110.2 | L122 R123 E124 S128 F129 Y130 | L122-V126 WeakPolarHBondContact O-CB 3.48Å; L122-V126 VanDerWaalsContact O-CG2 3.23Å; L122-V126 WeakPolarHBondContact O-CG2 3.49Å; L122-V126 PolarHBondContact O-N 3Å; R123-V126 PolarHBondContact O-N 3.22Å; E124-V126 PolarHBondContact O-N 2.94Å; V126-S128 VanDerWaalsContact C-N 3.31Å; V126-S128 PolarHBondContact O-N 2.86Å; V126-F129 WeakPolarHBondContact O-CB 3.43Å; V126-F129 PolarHBondContact O-N 2.98Å; V126-F129 VanDerWaalsContact O-N 3.11Å; V126-Y130 HydrophobicContact CG1-CD2 3.67Å; V126-Y130 HydrophobicContact CG1-CE2 3.74Å; V126-Y130 WeakPolarHBondContact O-CD2 3.46Å; V126-Y130 PolarHBondContact O-N 3.3Å |
| 127 | E | 79.1 | Confident | 75.4 | Confident | 91 Ų | 91 | 105.1 Ų | 105.1 | 43% | 0.425 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -59 | -42 | 177.9 | -75.5 | 175.2 | -165.5 | 0 | 0 | 111.4 | R123 E124 F129 Y130 S131 | R123-E127 IonicContact CZ-OE1 3.69Å; R123-E127 IonicContact NH1-OE1 2.7Å; R123-E127 PolarHBondContact NH1-OE1 2.9Å; R123-E127 IonicContact NH1-OE2 3.81Å; R123-E127 WeakPolarHBondContact O-CB 3.38Å; R123-E127 WeakPolarHBondContact O-CG 3.41Å; R123-E127 PolarHBondContact O-N 3.12Å; E124-E127 PolarHBondContact O-N 3.12Å; E127-F129 PolarHBondContact O-N 3.37Å; E127-Y130 CarbonylContact O-C 3.59Å; E127-Y130 PolarHBondContact O-N 3.33Å; E127-S131 WeakPolarHBondContact O-CB 3.04Å; E127-S131 PolarHBondContact O-N 3.23Å; E127-S131 PolarHBondContact O-OG 3.33Å |
| 128 | S | 78.3 | Confident | 73 | Confident | 83 Ų | 83 | 107.2 Ų | 107.2 | 58% | 0.58 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -61.4 | -41 | 174.5 | -176.2 | 0 | 0 | 0 | 0 | 112.7 | E124 V126 S131 | E124-S128 VanDerWaalsContact O-CB 3.23Å; E124-S128 WeakPolarHBondContact O-CB 3.5Å; E124-S128 PolarHBondContact O-N 3.38Å; V126-S128 VanDerWaalsContact C-N 3.31Å; V126-S128 PolarHBondContact O-N 2.86Å; S128-S131 PolarHBondContact O-N 3.35Å |
| 129 | F | 76.4 | Confident | 70.8 | Confident | 150 Ų | 150 | 112.3 Ų | 112.3 | 66% | 0.658 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67.5 | -37.5 | 177.4 | -173.2 | -97 | 0 | 0 | 0 | 112.7 | Q125 V126 E127 | Q125-F129 WeakPolarHBondContact O-CB 3.48Å; Q125-F129 PolarHBondContact O-N 2.84Å; V126-F129 WeakPolarHBondContact O-CB 3.43Å; V126-F129 PolarHBondContact O-N 2.98Å; V126-F129 VanDerWaalsContact O-N 3.11Å; E127-F129 PolarHBondContact O-N 3.37Å |
| 130 | Y | 69.4 | Low | 69.1 | Low | 165 Ų | 165 | 112.7 Ų | 112.7 | 65% | 0.647 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -86.3 | -12.7 | 177.2 | -70.6 | -74 | 0 | 0 | 0 | 114 | V126 E127 | V126-Y130 HydrophobicContact CG1-CD2 3.67Å; V126-Y130 HydrophobicContact CG1-CE2 3.74Å; V126-Y130 WeakPolarHBondContact O-CD2 3.46Å; V126-Y130 PolarHBondContact O-N 3.3Å; E127-Y130 CarbonylContact O-C 3.59Å; E127-Y130 PolarHBondContact O-N 3.33Å |
| 131 | S | 65.5 | Low | 66.5 | Low | 93 Ų | 93 | 112.1 Ų | 112.1 | 65% | 0.65 | 64% | 0.636 | S | S | * | * | trans | -93.1 | 3.9 | 178.5 | -58.7 | 0 | 0 | 0 | 0 | 113.9 | E127 S128 P133 | E127-S131 WeakPolarHBondContact O-CB 3.04Å; E127-S131 PolarHBondContact O-N 3.23Å; E127-S131 PolarHBondContact O-OG 3.33Å; S128-S131 PolarHBondContact O-N 3.35Å; S131-P133 WeakPolarHBondContact O-CD 3.46Å | ||
| 132 | L | 52.8 | Low | 63.9 | Low | 131 Ų | 131 | 112.7 Ų | 112.7 | 69% | 0.686 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -62.7 | 123.2 | 169.3 | -98.9 | 153.1 | 0 | 0 | 0 | 109.6 | G134 | L132-G134 PolarHBondContact O-N 3.45Š|
| 133 | P | 52.3 | Low | 62.5 | Low | 128 Ų | 128 | 115 Ų | 115 | 83% | 0.831 | 67% | 0.667 | S | S | * | * | trans | -77.3 | 86.6 | -176.6 | 28.3 | -29.6 | 0 | 0 | 0 | 110.6 | S131 | S131-P133 WeakPolarHBondContact O-CD 3.46Š| ||
| 134 | G | 50.7 | Low | 60.5 | Low | 67 Ų | 67 | 117.1 Ų | 117.1 | 69% | 0.691 | 69% | 0.686 | S | S | * | * | trans | -95 | 94.4 | 161.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | L132 | L132-G134 PolarHBondContact O-N 3.45Š| ||
| 135 | E | 49.4 | Very low | 58.9 | Low | 175 Ų | 175 | 117.1 Ų | 117.1 | 82% | 0.818 | 70% | 0.699 | S | S | * | * | trans | 53.9 | 96 | 161.7 | -69.3 | -179.3 | 96.8 | 0 | 0 | 118.2 | ||||
| 136 | S | 41.5 | Very low | 56.9 | Low | 126 Ų | 126 | 116.5 Ų | 116.5 | 88% | 0.881 | 71% | 0.709 | S | S | * | * | trans | -130.9 | 75.4 | 138.5 | -91.6 | 0 | 0 | 0 | 0 | 108.6 | S138 | S136-S138 PolarHBondContact O-N 3.29Š| ||
| 137 | S | 47.7 | Very low | 55.8 | Low | 89 Ų | 89 | 119.7 Ų | 119.7 | 62% | 0.622 | 73% | 0.733 | S | S | * | * | trans | -61.5 | 114.5 | 143.9 | 39.3 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 138 | S | 45.4 | Very low | 54.2 | Low | 109 Ų | 109 | 120.6 Ų | 120.6 | 76% | 0.762 | 75% | 0.749 | S | S | * | * | trans | 50.3 | 105.8 | 152.1 | 44.5 | 0 | 0 | 0 | 0 | 118.2 | S136 | S136-S138 PolarHBondContact O-N 3.29Š| ||
| 139 | E | 51.1 | Low | 53.2 | Low | 169 Ų | 169 | 123.9 Ų | 123.9 | 79% | 0.79 | 76% | 0.76 | S | S | * | * | trans | -43.4 | 151.6 | 147.8 | -94.7 | -131 | 95.1 | 0 | 0 | 111.5 | ||||
| 140 | P | 59.3 | Low | 51.8 | Low | 129 Ų | 129 | 121.6 Ų | 121.6 | 84% | 0.838 | 76% | 0.763 | S | S | * | * | -152.4 | 161.8 | 56.4 | 37.3 | -15.6 | 0 | 0 | 0 | 118.2 | |||||
| 141 | G | 40.5 | Very low | 51.1 | Low | 65 Ų | 65 | 122.7 Ų | 122.7 | 67% | 0.67 | 78% | 0.776 | S | S | * | * | trans | 122.9 | 98.3 | 145.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 142 | S | 40.9 | Very low | 50.3 | Low | 116 Ų | 116 | 122.2 Ų | 122.2 | 81% | 0.811 | 78% | 0.778 | S | S | * | * | trans | -64.6 | 166 | 153 | -64.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 143 | P | 63.5 | Low | 50.1 | Low | 110 Ų | 110 | 118.8 Ų | 118.8 | 71% | 0.714 | 77% | 0.774 | S | S | * | * | cis | -150 | 175.8 | 26.5 | 40.1 | -17.3 | 0 | 0 | 0 | 118.5 | ||||
| 144 | L | 51.3 | Low | 49.8 | Very low | 161 Ų | 161 | 118.6 Ų | 118.6 | 84% | 0.843 | 78% | 0.776 | S | S | * | * | trans | 80.5 | 130.8 | 152.2 | -103 | 88.3 | 0 | 0 | 0 | 123.4 | ||||
| 145 | S | 52.3 | Low | 49.7 | Very low | 116 Ų | 116 | 120.8 Ų | 120.8 | 81% | 0.811 | 77% | 0.771 | S | S | * | * | trans | 86.4 | 116 | 147.1 | 81.7 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 146 | S | 43.5 | Very low | 49.9 | Very low | 115 Ų | 115 | 114.4 Ų | 114.4 | 80% | 0.804 | 75% | 0.746 | S | S | * | * | 171.8 | 138.1 | 104.9 | -167.5 | 0 | 0 | 0 | 0 | 110 | |||||
| 147 | C | 61.2 | Low | 50.7 | Low | 126 Ų | 126 | 113.2 Ų | 113.2 | 85% | 0.851 | 74% | 0.735 | S | S | * | * | trans | -73.7 | 134.2 | -177 | -26.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 148 | S | 45.5 | Very low | 51.3 | Low | 109 Ų | 109 | 113 Ų | 113 | 76% | 0.762 | 73% | 0.73 | S | S | * | * | trans | -154.6 | 109.4 | 145 | 61 | 0 | 0 | 0 | 0 | 111.6 | S150 | S148-S150 PolarHBondContact O-N 3.41Š| ||
| 149 | D | 57.4 | Low | 51.6 | Low | 153 Ų | 153 | 114.5 Ų | 114.5 | 82% | 0.818 | 72% | 0.719 | S | S | * | * | trans | -27.2 | 116.6 | 149 | -166 | 13.7 | 0 | 0 | 0 | 112.9 | ||||
| 150 | S | 47 | Very low | 51.9 | Low | 102 Ų | 102 | 111.9 Ų | 111.9 | 71% | 0.713 | 71% | 0.707 | S | S | * | * | trans | -158.7 | 116.3 | 161.7 | -84.6 | 0 | 0 | 0 | 0 | 108.3 | S148 A152 | S148-S150 PolarHBondContact O-N 3.41Å; S150-A152 PolarHBondContact O-N 3.26Å | ||
| 151 | M | 54.3 | Low | 51.8 | Low | 187 Ų | 187 | 112.1 Ų | 112.1 | 92% | 0.921 | 70% | 0.697 | S | S | * | * | trans | -58.2 | 77.4 | 162.2 | -67.5 | -77.1 | -179.7 | 0 | 0 | 108.8 | G153 | M151-G153 PolarHBondContact O-N 2.85Š| ||
| 152 | A | 49.3 | Very low | 52.5 | Low | 84 Ų | 84 | 113 Ų | 113 | 69% | 0.694 | 69% | 0.686 | S | S | * | * | trans | -73.3 | 90.1 | 169.1 | 0 | 0 | 0 | 0 | 0 | 106.4 | S150 S154 | S150-A152 PolarHBondContact O-N 3.26Å; A152-S154 PolarHBondContact O-N 2.82Å; A152-S154 VanDerWaalsContact O-N 3.08Å | ||
| 153 | G | 48.8 | Very low | 53.1 | Low | 59 Ų | 59 | 113 Ų | 113 | 61% | 0.608 | 68% | 0.676 | S | S | * | * | trans | -44.9 | 120.7 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108 | M151 N155 | M151-G153 PolarHBondContact O-N 2.85Å; G153-N155 PolarHBondContact O-N 3.36Å | ||
| 154 | S | 44.8 | Very low | 52.7 | Low | 124 Ų | 124 | 110.5 Ų | 110.5 | 87% | 0.867 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -69.5 | 59.6 | 177.6 | -43 | 0 | 0 | 0 | 0 | 109.9 | A152 | A152-S154 PolarHBondContact O-N 2.82Å; A152-S154 VanDerWaalsContact O-N 3.08Å |
| 155 | N | 49.6 | Very low | 52.9 | Low | 112 Ų | 112 | 108.5 Ų | 108.5 | 60% | 0.599 | 66% | 0.655 | S | S | * | * | trans | -119 | 79.7 | 176.8 | -69.8 | -48.3 | 0 | 0 | 0 | 106.7 | G153 | G153-N155 PolarHBondContact O-N 3.36Š| ||
| 156 | S | 53.2 | Low | 52.8 | Low | 42 Ų | 42 | 110.8 Ų | 110.8 | 29% | 0.294 | 65% | 0.647 | S | S | . | * | trans | -56.4 | 129.7 | 170.4 | 144 | 0 | 0 | 0 | 0 | 108.7 | V158 W159 | S156-V158 PolarHBondContact O-N 2.96Å; S156-V158 VanDerWaalsContact O-N 3.11Å; S156-W159 PolarHBondContact O-N 3.21Å | ||
| 157 | P | 58.8 | Low | 53 | Low | 100 Ų | 100 | 114.8 Ų | 114.8 | 65% | 0.649 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -61.4 | -23.6 | -173.5 | 22 | -31.9 | 0 | 0 | 0 | 112.5 | Q160 H161 | P157-Q160 PolarHBondContact O-N 3.38Å; P157-H161 PolarHBondContact O-N 3.34Å |
| 158 | V | 59.5 | Low | 52.2 | Low | 84 Ų | 84 | 115.1 Ų | 115.1 | 51% | 0.509 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -64.4 | -42.1 | 176.2 | -171.3 | 0 | 0 | 0 | 0 | 111.2 | S156 Q160 H161 L162 | S156-V158 PolarHBondContact O-N 2.96Å; S156-V158 VanDerWaalsContact O-N 3.11Å; V158-Q160 VanDerWaalsContact C-N 3.34Å; V158-Q160 PolarHBondContact O-N 3.16Å; V158-H161 PolarHBondContact O-N 2.94Å; V158-L162 HydrophobicContact CG1-CD1 4Å; V158-L162 PolarHBondContact O-N 3.46Å; V158-L162 VanDerWaalsContact O-N 3.08Å |
| 159 | W | 51.1 | Low | 52.2 | Low | 142 Ų | 142 | 113.2 Ų | 113.2 | 54% | 0.538 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -67.7 | -34.8 | 179.1 | -73 | 107.3 | 0 | 0 | 0 | 112.4 | L122 S156 N163 | L122-W159 HydrophobicContact CD1-CH2 4.28Å; L122-W159 HydrophobicContact CD1-CZ3 4.37Å; S156-W159 PolarHBondContact O-N 3.21Å; W159-N163 WeakPolarHBondContact O-CB 3.44Å; W159-N163 PolarHBondContact O-N 2.98Å |
| 160 | Q | 57.6 | Low | 51.8 | Low | 113 Ų | 113 | 113.5 Ų | 113.5 | 53% | 0.528 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -65.5 | -40.6 | 176.1 | -62.6 | -175 | 38.2 | 0 | 0 | 111.6 | P157 V158 A164 | P157-Q160 PolarHBondContact O-N 3.38Å; V158-Q160 VanDerWaalsContact C-N 3.34Å; V158-Q160 PolarHBondContact O-N 3.16Å; Q160-A164 WeakPolarHBondContact O-CB 3.14Å; Q160-A164 PolarHBondContact O-N 3.04Å |
| 161 | H | 57.4 | Low | 51.6 | Low | 134 Ų | 134 | 113 Ų | 113 | 62% | 0.62 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -69.7 | -41 | 179.6 | -163.8 | -108.5 | 0 | 0 | 0 | 112.5 | P157 V158 A164 N165 | P157-H161 PolarHBondContact O-N 3.34Å; V158-H161 PolarHBondContact O-N 2.94Å; H161-A164 PolarHBondContact O-N 3.13Å; H161-N165 PolarHBondContact O-N 3.09Å |
| 162 | L | 56 | Low | 51 | Low | 84 Ų | 84 | 112.4 Ų | 112.4 | 44% | 0.44 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -65.2 | -40.1 | 174.8 | -77.2 | 160.1 | 0 | 0 | 0 | 112.5 | V158 N165 Y166 | V158-L162 HydrophobicContact CG1-CD1 4Å; V158-L162 PolarHBondContact O-N 3.46Å; V158-L162 VanDerWaalsContact O-N 3.08Å; L162-N165 PolarHBondContact O-N 3.35Å; L162-Y166 PolarHBondContact O-N 3.35Å; L162-Y166 VanDerWaalsContact O-N 3.16Å |
| 163 | N | 52.7 | Low | 50.7 | Low | 116 Ų | 116 | 112.1 Ų | 112.1 | 62% | 0.62 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -67.5 | -37.2 | 178 | -167.9 | 7.8 | 0 | 0 | 0 | 112.2 | W159 N165 Y166 R167 | W159-N163 WeakPolarHBondContact O-CB 3.44Å; W159-N163 PolarHBondContact O-N 2.98Å; N163-N165 PolarHBondContact O-N 3.16Å; N163-Y166 PolarHBondContact O-N 2.94Å; N163-R167 WeakPolarHBondContact O-CB 3.45Å; N163-R167 PolarHBondContact O-N 3.34Å |
| 164 | A | 55.5 | Low | 50.2 | Low | 58 Ų | 58 | 116.5 Ų | 116.5 | 48% | 0.479 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -62 | -40.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q160 H161 | Q160-A164 WeakPolarHBondContact O-CB 3.14Å; Q160-A164 PolarHBondContact O-N 3.04Å; H161-A164 PolarHBondContact O-N 3.13Å |
| 165 | N | 54.8 | Low | 50.2 | Low | 118 Ų | 118 | 117.6 Ų | 117.6 | 63% | 0.631 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -68 | -38.1 | 176.4 | -95.3 | 27.3 | 0 | 0 | 0 | 113 | H161 L162 N163 N168 | H161-N165 PolarHBondContact O-N 3.09Å; L162-N165 PolarHBondContact O-N 3.35Å; N163-N165 PolarHBondContact O-N 3.16Å; N165-N168 PolarHBondContact O-N 2.96Å |
| 166 | Y | 50.9 | Low | 50 | Low | 164 Ų | 164 | 118.8 Ų | 118.8 | 64% | 0.643 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -70.3 | -34.8 | 177.7 | -108 | -90.9 | 0 | 0 | 0 | 113.1 | L162 N163 N168 G169 | L162-Y166 PolarHBondContact O-N 3.35Å; L162-Y166 VanDerWaalsContact O-N 3.16Å; N163-Y166 PolarHBondContact O-N 2.94Å; Y166-N168 PolarHBondContact O-N 3.47Å; Y166-G169 PolarHBondContact O-N 2.9Å |
| 167 | R | 46.8 | Very low | 49.1 | Very low | 200 Ų | 200 | 120 Ų | 120 | 76% | 0.755 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -61.8 | -27.6 | 177.1 | -170.4 | 174.8 | 178.2 | -179.2 | -1.1 | 112.5 | N163 G169 | N163-R167 WeakPolarHBondContact O-CB 3.45Å; N163-R167 PolarHBondContact O-N 3.34Å; R167-G169 VanDerWaalsContact C-N 3.33Å; R167-G169 PolarHBondContact O-N 2.89Å |
| 168 | N | 45.8 | Very low | 48.4 | Very low | 133 Ų | 133 | 123.6 Ų | 123.6 | 71% | 0.711 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | -21.6 | -178.7 | -148.3 | 43.9 | 0 | 0 | 0 | 113.5 | N165 Y166 | N165-N168 PolarHBondContact O-N 2.96Å; Y166-N168 PolarHBondContact O-N 3.47Å |
| 169 | G | 45.7 | Very low | 47.7 | Very low | 68 Ų | 68 | 126.7 Ų | 126.7 | 70% | 0.701 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | -18.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | Y166 R167 | Y166-G169 PolarHBondContact O-N 2.9Å; R167-G169 VanDerWaalsContact C-N 3.33Å; R167-G169 PolarHBondContact O-N 2.89Å |
| 170 | F | 48.8 | Very low | 47.4 | Very low | 160 Ų | 160 | 126.9 Ų | 126.9 | 70% | 0.702 | 68% | 0.676 | S | S | * | * | trans | -110.3 | 40.6 | 178.8 | -82 | -85.6 | 0 | 0 | 0 | 112 | F172 | F170-F172 VanDerWaalsContact C-N 3.31Å; F170-F172 PolarHBondContact O-N 3.39Å | ||
| 171 | S | 42.4 | Very low | 47.2 | Very low | 92 Ų | 92 | 129.7 Ų | 129.7 | 64% | 0.643 | 69% | 0.686 | S | S | * | * | trans | -72.3 | 89.8 | 166.5 | -71.3 | 0 | 0 | 0 | 0 | 109.1 | A173 | S171-A173 PolarHBondContact O-N 3.48Š| ||
| 172 | F | 42.6 | Very low | 46.5 | Very low | 174 Ų | 174 | 127.2 Ų | 127.2 | 76% | 0.763 | 69% | 0.689 | S | S | * | * | trans | -53.3 | 113 | 156.6 | 169.6 | -94.2 | 0 | 0 | 0 | 106.4 | F170 K174 | F170-F172 VanDerWaalsContact C-N 3.31Å; F170-F172 PolarHBondContact O-N 3.39Å; F172-K174 HydrophobicContact CD1-CB 3.88Å; F172-K174 HydrophobicContact CE1-CB 3.91Å; F172-K174 HydrophobicContact CE1-CG 4.35Å; F172-K174 PolarHBondContact O-N 3.46Å | ||
| 173 | A | 42.5 | Very low | 46.4 | Very low | 77 Ų | 77 | 130.7 Ų | 130.7 | 64% | 0.636 | 71% | 0.707 | S | S | * | * | trans | -61.6 | 83.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109 | S171 N175 | S171-A173 PolarHBondContact O-N 3.48Å; A173-N175 PolarHBondContact O-N 3.47Å | ||
| 174 | K | 38.1 | Very low | 46.5 | Very low | 152 Ų | 152 | 128.7 Ų | 128.7 | 66% | 0.661 | 71% | 0.714 | S | S | * | * | trans | -75.4 | 85.1 | 164.6 | -170.4 | 175.5 | 177.6 | -175.7 | 0 | 106.1 | F172 D176 | F172-K174 HydrophobicContact CD1-CB 3.88Å; F172-K174 HydrophobicContact CE1-CB 3.91Å; F172-K174 HydrophobicContact CE1-CG 4.35Å; F172-K174 PolarHBondContact O-N 3.46Å; K174-D176 HydrophobicContact CG-CB 4.37Å; K174-D176 PolarHBondContact O-N 2.8Å | ||
| 175 | N | 44.7 | Very low | 46.5 | Very low | 147 Ų | 147 | 128.3 Ų | 128.3 | 79% | 0.786 | 71% | 0.71 | S | S | * | * | trans | -75.7 | 79.7 | 161.5 | -71.1 | -69.2 | 0 | 0 | 0 | 107.6 | A173 | A173-N175 PolarHBondContact O-N 3.47Š| ||
| 176 | D | 45.2 | Very low | 47.3 | Very low | 137 Ų | 137 | 125.6 Ų | 125.6 | 73% | 0.733 | 70% | 0.701 | S | S | * | * | trans | -135.2 | 100.5 | 157.2 | -87.6 | -59.5 | 0 | 0 | 0 | 105.4 | K174 | K174-D176 HydrophobicContact CG-CB 4.37Å; K174-D176 PolarHBondContact O-N 2.8Å | ||
| 177 | G | 35.2 | Very low | 48.5 | Very low | 68 Ų | 68 | 122.1 Ų | 122.1 | 70% | 0.701 | 70% | 0.7 | S | S | * | * | trans | -166 | 66.7 | -175.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 178 | M | 43.8 | Very low | 50 | Low | 175 Ų | 175 | 118.3 Ų | 118.3 | 86% | 0.862 | 69% | 0.694 | S | S | * | * | trans | -106.3 | 77.5 | 139.5 | -165.6 | 78.2 | 88 | 0 | 0 | 105.3 | D180 | M178-D180 PolarHBondContact O-N 2.64Š| ||
| 179 | D | 43.7 | Very low | 51.6 | Low | 148 Ų | 148 | 117.4 Ų | 117.4 | 79% | 0.791 | 69% | 0.686 | S | S | * | * | trans | -73.8 | 92 | 167 | -111.2 | -73.6 | 0 | 0 | 0 | 106.8 | ||||
| 180 | D | 45.3 | Very low | 53.3 | Low | 146 Ų | 146 | 117.1 Ų | 117.1 | 78% | 0.781 | 67% | 0.673 | S | S | * | * | trans | -88 | 103.7 | 155 | -101.1 | -51.4 | 0 | 0 | 0 | 107.9 | M178 A182 | M178-D180 PolarHBondContact O-N 2.64Å; D180-A182 VanDerWaalsContact C-N 3.34Å; D180-A182 PolarHBondContact O-N 2.61Å | ||
| 181 | K | 53.7 | Low | 55.2 | Low | 173 Ų | 173 | 114.4 Ų | 114.4 | 75% | 0.752 | 67% | 0.665 | S | S | * | * | trans | -64.9 | 85.4 | 178.2 | -173.3 | 179.2 | -180 | 167.7 | 0 | 110.2 | L183 | K181-L183 HydrophobicContact CG-CD1 4.46Å; K181-L183 HydrophobicContact CG-CG 4.47Å | ||
| 182 | A | 43.4 | Very low | 57.1 | Low | 82 Ų | 82 | 113.4 Ų | 113.4 | 68% | 0.678 | 66% | 0.658 | S | S | * | * | trans | -101 | 85.1 | 162.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | D180 G184 | D180-A182 VanDerWaalsContact C-N 3.34Å; D180-A182 PolarHBondContact O-N 2.61Å; A182-G184 PolarHBondContact O-N 3.49Å; A182-G184 VanDerWaalsContact O-N 3.13Å | ||
| 183 | L | 52.7 | Low | 59.1 | Low | 157 Ų | 157 | 107.5 Ų | 107.5 | 82% | 0.822 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.1 | 110.9 | 163.7 | -78.1 | 158.7 | 0 | 0 | 0 | 108.5 | K181 | K181-L183 HydrophobicContact CG-CD1 4.46Å; K181-L183 HydrophobicContact CG-CG 4.47Å |
| 184 | G | 54.7 | Low | 61.3 | Low | 73 Ų | 73 | 107.6 Ų | 107.6 | 75% | 0.753 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 100.3 | 24.6 | 157.4 | 0 | 0 | 0 | 0 | 0 | 118.5 | A182 S186 | A182-G184 PolarHBondContact O-N 3.49Å; A182-G184 VanDerWaalsContact O-N 3.13Å; G184-S186 PolarHBondContact O-N 3.27Å |
| 185 | A | 55.7 | Low | 63.7 | Low | 50 Ų | 50 | 104.3 Ų | 104.3 | 41% | 0.413 | 62% | 0.619 | S | S | . | * | trans | -76.3 | 116.3 | 164.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | E189 | A185-E189 HydrophobicContact CB-CB 4.16Š| ||
| 186 | S | 70.8 | Confident | 65.4 | Low | 61 Ų | 61 | 102.2 Ų | 102.2 | 43% | 0.427 | 61% | 0.608 | S | S | . | * | trans | -55.1 | 149.5 | 171 | 175.6 | 0 | 0 | 0 | 0 | 109.3 | G184 L188 E189 C190 | G184-S186 PolarHBondContact O-N 3.27Å; S186-L188 PolarHBondContact O-N 3.48Å; S186-E189 WeakPolarHBondContact CB-OE2 3.34Å; S186-E189 PolarHBondContact N-OE2 3.24Å; S186-E189 WeakPolarHBondContact O-CA 3.46Å; S186-E189 WeakPolarHBondContact O-CB 3.47Å; S186-E189 PolarHBondContact O-N 2.83Å; S186-C190 PolarHBondContact O-N 3.07Å; S186-C190 VanDerWaalsContact O-N 3.15Å | ||
| 187 | S | 77.7 | Confident | 67.2 | Low | 91 Ų | 91 | 102.8 Ų | 102.8 | 64% | 0.636 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -52.9 | -25.5 | 179.4 | 57 | 0 | 0 | 0 | 0 | 112.9 | L191 | S187-L191 VanDerWaalsContact O-CG 3.29Å; S187-L191 WeakPolarHBondContact O-CG 3.36Å; S187-L191 PolarHBondContact O-N 2.99Å |
| 188 | L | 78.7 | Confident | 69.1 | Low | 120 Ų | 120 | 105.3 Ų | 105.3 | 63% | 0.628 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -74.9 | -35.8 | 173.7 | -69.1 | 174.1 | 0 | 0 | 0 | 113.5 | S186 L191 S192 | S186-L188 PolarHBondContact O-N 3.48Å; L188-L191 PolarHBondContact O-N 3.04Å; L188-S192 PolarHBondContact O-N 3.25Å; L188-S192 PolarHBondContact O-OG 3.45Å |
| 189 | E | 79.1 | Confident | 70.6 | Confident | 114 Ų | 114 | 99.7 Ų | 99.7 | 53% | 0.533 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -69.5 | -34.7 | 174.5 | -81.7 | 160.7 | 141.6 | 0 | 0 | 112 | A185 S186 L191 S192 S193 | A185-E189 HydrophobicContact CB-CB 4.16Å; S186-E189 WeakPolarHBondContact CB-OE2 3.34Å; S186-E189 PolarHBondContact N-OE2 3.24Å; S186-E189 WeakPolarHBondContact O-CA 3.46Å; S186-E189 WeakPolarHBondContact O-CB 3.47Å; S186-E189 PolarHBondContact O-N 2.83Å; E189-L191 VanDerWaalsContact C-N 3.31Å; E189-L191 PolarHBondContact O-N 2.94Å; E189-S192 PolarHBondContact O-N 3.28Å; E189-S193 WeakPolarHBondContact O-CB 3.36Å; E189-S193 PolarHBondContact O-N 3.31Å |
| 190 | C | 80.9 | Confident | 71.3 | Confident | 63 Ų | 63 | 96.5 Ų | 96.5 | 43% | 0.426 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.6 | -41.5 | 171.6 | -65.2 | 0 | 0 | 0 | 0 | 111.5 | S186 I194 | S186-C190 PolarHBondContact O-N 3.07Å; S186-C190 VanDerWaalsContact O-N 3.15Å; C190-I194 WeakPolarHBondContact O-CD1 3.37Å; C190-I194 VanDerWaalsContact O-CG1 3.22Å; C190-I194 WeakPolarHBondContact O-CG1 3.34Å; C190-I194 PolarHBondContact O-N 3.37Å |
| 191 | L | 87.4 | Confident | 71.8 | Confident | 103 Ų | 103 | 93.2 Ų | 93.2 | 54% | 0.539 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -71.7 | -42.8 | 177.9 | -67.9 | 173 | 0 | 0 | 0 | 111.8 | S187 L188 E189 S193 I194 V195 | S187-L191 VanDerWaalsContact O-CG 3.29Å; S187-L191 WeakPolarHBondContact O-CG 3.36Å; S187-L191 PolarHBondContact O-N 2.99Å; L188-L191 PolarHBondContact O-N 3.04Å; E189-L191 VanDerWaalsContact C-N 3.31Å; E189-L191 PolarHBondContact O-N 2.94Å; L191-S193 PolarHBondContact O-N 3.13Å; L191-I194 WeakPolarHBondContact O-CB 3.34Å; L191-I194 PolarHBondContact O-N 3.05Å; L191-V195 WeakPolarHBondContact O-CG2 3.49Å; L191-V195 PolarHBondContact O-N 3.2Å |
| 192 | S | 82.6 | Confident | 71.8 | Confident | 70 Ų | 70 | 92.4 Ų | 92.4 | 49% | 0.49 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.5 | -42.9 | 174.7 | -70 | 0 | 0 | 0 | 0 | 112.1 | L188 E189 I194 V195 D196 | L188-S192 PolarHBondContact O-N 3.25Å; L188-S192 PolarHBondContact O-OG 3.45Å; E189-S192 PolarHBondContact O-N 3.28Å; S192-I194 VanDerWaalsContact C-N 3.25Å; S192-I194 PolarHBondContact O-N 3.19Å; S192-V195 PolarHBondContact O-N 3.47Å; S192-V195 VanDerWaalsContact O-N 3.11Å; S192-D196 PolarHBondContact O-N 3Å |
| 193 | S | 84.6 | Confident | 72.4 | Confident | 50 Ų | 50 | 93.2 Ų | 93.2 | 35% | 0.35 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -61.3 | -32.8 | 175.8 | -175.8 | 0 | 0 | 0 | 0 | 112.9 | E189 L191 R197 | E189-S193 WeakPolarHBondContact O-CB 3.36Å; E189-S193 PolarHBondContact O-N 3.31Å; L191-S193 PolarHBondContact O-N 3.13Å; S193-R197 WeakPolarHBondContact O-CG 3.42Å; S193-R197 PolarHBondContact O-N 3.14Å; S193-R197 PolarHBondContact O-NH1 3.42Å; S193-R197 PolarHBondContact OG-NH1 3.29Å |
| 194 | I | 89.8 | Confident | 72 | Confident | 80 Ų | 80 | 88.7 Ų | 88.7 | 41% | 0.41 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.5 | -44.4 | 173.8 | -68.1 | 162 | 0 | 0 | 0 | 110.6 | C190 L191 S192 R197 L198 | C190-I194 WeakPolarHBondContact O-CD1 3.37Å; C190-I194 VanDerWaalsContact O-CG1 3.22Å; C190-I194 WeakPolarHBondContact O-CG1 3.34Å; C190-I194 PolarHBondContact O-N 3.37Å; L191-I194 WeakPolarHBondContact O-CB 3.34Å; L191-I194 PolarHBondContact O-N 3.05Å; S192-I194 VanDerWaalsContact C-N 3.25Å; S192-I194 PolarHBondContact O-N 3.19Å; I194-R197 VanDerWaalsContact CG1-NH2 3.3Å; I194-R197 PolarHBondContact O-N 3.07Å; I194-L198 HydrophobicContact CG2-CD1 4.09Å; I194-L198 WeakPolarHBondContact O-CG 3.5Å; I194-L198 PolarHBondContact O-N 3.11Å |
| 195 | V | 87.5 | Confident | 71.1 | Confident | 82 Ų | 82 | 91.5 Ų | 91.5 | 50% | 0.497 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65 | -44.5 | 179.4 | 175.1 | 0 | 0 | 0 | 0 | 111.1 | L191 S192 R197 L198 S199 | L191-V195 WeakPolarHBondContact O-CG2 3.49Å; L191-V195 PolarHBondContact O-N 3.2Å; S192-V195 PolarHBondContact O-N 3.47Å; S192-V195 VanDerWaalsContact O-N 3.11Å; V195-R197 VanDerWaalsContact C-N 3.31Å; V195-R197 PolarHBondContact O-N 3.06Å; V195-L198 PolarHBondContact O-N 2.96Å; V195-S199 PolarHBondContact O-N 3.42Å; V195-S199 PolarHBondContact O-OG 2.85Å |
| 196 | D | 80.4 | Confident | 70.7 | Confident | 103 Ų | 103 | 91.9 Ų | 91.9 | 55% | 0.551 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62.5 | -35.1 | 178.9 | -77.6 | -24.6 | 0 | 0 | 0 | 113 | S192 L198 S200 | S192-D196 PolarHBondContact O-N 3Å; D196-L198 VanDerWaalsContact C-N 3.35Å; D196-S200 VanDerWaalsContact O-CB 3.26Å; D196-S200 WeakPolarHBondContact O-CB 3.35Å; D196-S200 PolarHBondContact O-N 3.29Å; D196-S200 PolarHBondContact O-OG 2.89Å |
| 197 | R | 82.7 | Confident | 69.5 | Low | 150 Ų | 150 | 95.5 Ų | 95.5 | 57% | 0.566 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -67.8 | -34.8 | 173.1 | -77.2 | -168.7 | -62.7 | -89.9 | -3.3 | 112.5 | S193 I194 V195 A201 | S193-R197 WeakPolarHBondContact O-CG 3.42Å; S193-R197 PolarHBondContact O-N 3.14Å; S193-R197 PolarHBondContact O-NH1 3.42Å; S193-R197 PolarHBondContact OG-NH1 3.29Å; I194-R197 VanDerWaalsContact CG1-NH2 3.3Å; I194-R197 PolarHBondContact O-N 3.07Å; V195-R197 VanDerWaalsContact C-N 3.31Å; V195-R197 PolarHBondContact O-N 3.06Å; R197-A201 WeakPolarHBondContact O-CB 3.41Å; R197-A201 PolarHBondContact O-N 2.95Å |
| 198 | L | 76.6 | Confident | 67.5 | Low | 120 Ų | 120 | 95.7 Ų | 95.7 | 63% | 0.628 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -75.8 | -37.7 | 178 | -66.3 | 170.6 | 0 | 0 | 0 | 111.4 | I194 V195 D196 A201 | I194-L198 HydrophobicContact CG2-CD1 4.09Å; I194-L198 WeakPolarHBondContact O-CG 3.5Å; I194-L198 PolarHBondContact O-N 3.11Å; V195-L198 PolarHBondContact O-N 2.96Å; D196-L198 VanDerWaalsContact C-N 3.35Å; L198-A201 PolarHBondContact O-N 3.37Å |
| 199 | S | 74.5 | Confident | 65.6 | Low | 57 Ų | 57 | 94.7 Ų | 94.7 | 40% | 0.399 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -75.8 | -24.9 | 174.6 | -68.4 | 0 | 0 | 0 | 0 | 113.8 | V195 E202 | V195-S199 PolarHBondContact O-N 3.42Å; V195-S199 PolarHBondContact O-OG 2.85Å; S199-E202 WeakPolarHBondContact CA-OE1 3.49Å; S199-E202 WeakPolarHBondContact O-CG 3.39Å |
| 200 | S | 57.6 | Low | 63.9 | Low | 81 Ų | 81 | 97.2 Ų | 97.2 | 57% | 0.566 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -76.1 | -24.4 | 168.5 | -67.4 | 0 | 0 | 0 | 0 | 112.7 | D196 E202 S203 | D196-S200 VanDerWaalsContact O-CB 3.26Å; D196-S200 WeakPolarHBondContact O-CB 3.35Å; D196-S200 PolarHBondContact O-N 3.29Å; D196-S200 PolarHBondContact O-OG 2.89Å; S200-E202 PolarHBondContact O-N 3.29Å; S200-S203 PolarHBondContact O-N 2.61Å |
| 201 | A | 56 | Low | 62.2 | Low | 77 Ų | 77 | 104.6 Ų | 104.6 | 64% | 0.636 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.2 | -13.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | R197 L198 | R197-A201 WeakPolarHBondContact O-CB 3.41Å; R197-A201 PolarHBondContact O-N 2.95Å; L198-A201 PolarHBondContact O-N 3.37Å |
| 202 | E | 54.5 | Low | 59.6 | Low | 156 Ų | 156 | 107.2 Ų | 107.2 | 73% | 0.729 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | -5.6 | 174.6 | 49.4 | -176.4 | 155.2 | 0 | 0 | 113.7 | S199 S200 | S199-E202 WeakPolarHBondContact CA-OE1 3.49Å; S199-E202 WeakPolarHBondContact O-CG 3.39Å; S200-E202 PolarHBondContact O-N 3.29Å |
| 203 | S | 56.4 | Low | 57.9 | Low | 99 Ų | 99 | 111.3 Ų | 111.3 | 69% | 0.692 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -132.4 | 65.8 | 176.3 | 67.8 | 0 | 0 | 0 | 0 | 112.5 | S200 | S200-S203 PolarHBondContact O-N 2.61Š|
| 204 | G | 44.3 | Very low | 56.2 | Low | 62 Ų | 62 | 114.6 Ų | 114.6 | 64% | 0.639 | 68% | 0.681 | S | S | * | * | S | Bend | trans | 170 | 99.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 117 | ||
| 205 | C | 36.4 | Very low | 53.8 | Low | 132 Ų | 132 | 115.1 Ų | 115.1 | 89% | 0.892 | 69% | 0.688 | S | S | * | * | trans | 70 | 109.7 | 147.1 | -142.9 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 206 | G | 45.6 | Very low | 51.2 | Low | 58 Ų | 58 | 120.6 Ų | 120.6 | 60% | 0.598 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 164.4 | 163.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A208 | G206-A208 PolarHBondContact O-N 3.37Š|
| 207 | P | 45.8 | Very low | 49.1 | Very low | 137 Ų | 137 | 121.1 Ų | 121.1 | 89% | 0.89 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 126.7 | -174.6 | 26.7 | -31.8 | 0 | 0 | 0 | 111 | S209 | P207-S209 PolarHBondContact O-N 3.47Š|
| 208 | A | 35.3 | Very low | 47.9 | Very low | 96 Ų | 96 | 120.2 Ų | 120.2 | 79% | 0.793 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 127.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112 | G206 L210 | G206-A208 PolarHBondContact O-N 3.37Å; A208-L210 PolarHBondContact O-N 3.14Å |
| 209 | S | 40.6 | Very low | 45.7 | Very low | 99 Ų | 99 | 118.1 Ų | 118.1 | 69% | 0.692 | 74% | 0.739 | S | S | * | * | trans | -67.3 | 113.5 | 163.5 | 178 | 0 | 0 | 0 | 0 | 108.8 | P207 R211 | P207-S209 PolarHBondContact O-N 3.47Å; S209-R211 PolarHBondContact O-N 3.13Å; S209-R211 VanDerWaalsContact O-N 3.14Å | ||
| 210 | L | 41.4 | Very low | 43.9 | Very low | 166 Ų | 166 | 121.2 Ų | 121.2 | 87% | 0.869 | 76% | 0.76 | S | S | * | * | trans | -72.5 | 100.7 | 163.3 | -81.3 | 173.9 | 0 | 0 | 0 | 108.4 | A208 | A208-L210 PolarHBondContact O-N 3.14Š| ||
| 211 | R | 46 | Very low | 42.8 | Very low | 219 Ų | 219 | 122.6 Ų | 122.6 | 83% | 0.826 | 77% | 0.77 | S | S | * | * | trans | -94.2 | 114.4 | 158.7 | -74.9 | -87.9 | -173 | 169.1 | 0.7 | 106.4 | S209 | S209-R211 PolarHBondContact O-N 3.13Å; S209-R211 VanDerWaalsContact O-N 3.14Å | ||
| 212 | D | 33.5 | Very low | 41.9 | Very low | 157 Ų | 157 | 127.5 Ų | 127.5 | 84% | 0.84 | 78% | 0.78 | S | S | * | * | trans | -130.9 | 121.5 | 154.8 | -92.3 | -34.5 | 0 | 0 | 0 | 108.7 | ||||
| 213 | L | 46.3 | Very low | 41 | Very low | 156 Ų | 156 | 125.9 Ų | 125.9 | 82% | 0.817 | 79% | 0.786 | S | S | * | * | trans | -131.8 | 143.7 | 171.3 | -152.3 | 87.6 | 0 | 0 | 0 | 105.9 | ||||
| 214 | P | 49 | Very low | 40.2 | Very low | 119 Ų | 119 | 129.8 Ų | 129.8 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | -137.4 | 129.4 | 120.8 | 25.6 | -7.5 | 0 | 0 | 0 | 113.8 | |||||
| 215 | T | 40.5 | Very low | 40.9 | Very low | 91 Ų | 91 | 131.4 Ų | 131.4 | 56% | 0.558 | 79% | 0.792 | S | S | * | * | trans | 36.4 | 119 | 130.2 | -36.7 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 216 | F | 32 | Very low | 40.7 | Very low | 198 Ų | 198 | 131.3 Ų | 131.3 | 87% | 0.868 | 79% | 0.791 | S | S | * | * | 171.1 | 151.2 | 108.6 | -81.9 | -68 | 0 | 0 | 0 | 110.9 | |||||
| 217 | S | 36 | Very low | 40.7 | Very low | 113 Ų | 113 | 134.5 Ų | 134.5 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | trans | -85.2 | -152.9 | -152.9 | -52.1 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 218 | P | 58.4 | Low | 40.9 | Very low | 131 Ų | 131 | 133.6 Ų | 133.6 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | -119.4 | 168.8 | -101.2 | 36.8 | -17.5 | 0 | 0 | 0 | 114.7 | |||||
| 219 | G | 28.8 | Very low | 40.9 | Very low | 77 Ų | 77 | 138.2 Ų | 138.2 | 79% | 0.794 | 80% | 0.799 | S | S | * | * | trans | -159.4 | 113.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 220 | S | 38 | Very low | 41 | Very low | 121 Ų | 121 | 138.6 Ų | 138.6 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | trans | -63.2 | 155.5 | -180 | -55 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 221 | S | 34 | Very low | 41.4 | Very low | 110 Ų | 110 | 136.8 Ų | 136.8 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | 178.7 | 105.4 | 131.8 | -85.2 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 222 | E | 36.9 | Very low | 41.2 | Very low | 181 Ų | 181 | 129.5 Ų | 129.5 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | 42.3 | 113.9 | 101.1 | -78.7 | -175.5 | 90.5 | 0 | 0 | 112.5 | |||||
| 223 | S | 35.6 | Very low | 41.7 | Very low | 122 Ų | 122 | 127.7 Ų | 127.7 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | -178.8 | 152 | 60.8 | 35.9 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 224 | Q | 40.6 | Very low | 42 | Very low | 180 Ų | 180 | 131.2 Ų | 131.2 | 84% | 0.841 | 80% | 0.795 | S | S | * | * | trans | -104.7 | -167.9 | 174.1 | -140.9 | -160.7 | -39 | 0 | 0 | 108.2 | ||||
| 225 | P | 57.7 | Low | 42.5 | Very low | 97 Ų | 97 | 131.8 Ų | 131.8 | 63% | 0.63 | 80% | 0.798 | S | S | * | * | -117.9 | 177.4 | -67.6 | 23.8 | -3 | 0 | 0 | 0 | 112.2 | |||||
| 226 | C | 32.3 | Very low | 42.8 | Very low | 129 Ų | 129 | 131.1 Ų | 131.1 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | 177.8 | 132.5 | 128.6 | -108.7 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 227 | T | 45.6 | Very low | 43.3 | Very low | 125 Ų | 125 | 131.2 Ų | 131.2 | 77% | 0.767 | 79% | 0.79 | S | S | * | * | trans | -70.4 | 161.7 | 157.8 | 51.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 228 | P | 51.1 | Low | 43.9 | Very low | 118 Ų | 118 | 135.4 Ų | 135.4 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | -152 | 161.6 | 81.9 | 35.1 | -13.1 | 0 | 0 | 0 | 117.3 | |||||
| 229 | E | 35.2 | Very low | 43.2 | Very low | 193 Ų | 193 | 134.8 Ų | 134.8 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | 22.1 | 146.6 | 145.8 | -59.1 | -155.4 | 102.8 | 0 | 0 | 125.3 | ||||
| 230 | S | 41.3 | Very low | 44.2 | Very low | 108 Ų | 108 | 142.8 Ų | 142.8 | 76% | 0.755 | 81% | 0.814 | S | S | * | * | trans | -64.4 | 162.5 | 167.9 | -137.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 231 | P | 50.7 | Low | 44.5 | Very low | 127 Ų | 127 | 143.9 Ų | 143.9 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | -146.7 | 165.5 | 87.7 | 34 | -14.2 | 0 | 0 | 0 | 114.9 | |||||
| 232 | G | 41.4 | Very low | 45 | Very low | 66 Ų | 66 | 145.6 Ų | 145.6 | 68% | 0.68 | 81% | 0.814 | S | S | * | * | trans | -73.4 | 169.9 | -172.3 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 233 | S | 43.8 | Very low | 45.5 | Very low | 120 Ų | 120 | 143.7 Ų | 143.7 | 84% | 0.839 | 81% | 0.812 | S | S | * | * | trans | -168.5 | 114.9 | 150.6 | -82.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 234 | R | 53 | Low | 46.1 | Very low | 230 Ų | 230 | 144.9 Ų | 144.9 | 87% | 0.868 | 81% | 0.81 | S | S | * | * | trans | -73 | 144.4 | 156.5 | -72.7 | 176.8 | 158.3 | -169.4 | -5.8 | 108.1 | ||||
| 235 | P | 58.9 | Low | 46.4 | Very low | 130 Ų | 130 | 142.8 Ų | 142.8 | 84% | 0.844 | 81% | 0.808 | S | S | * | * | trans | -117.3 | 135.5 | 144.8 | 31.9 | -21.4 | 0 | 0 | 0 | 109.8 | ||||
| 236 | V | 48.3 | Very low | 45.6 | Very low | 78 Ų | 78 | 145.8 Ų | 145.8 | 47% | 0.473 | 82% | 0.82 | S | S | . | * | trans | -116.3 | 146 | 175.8 | -157.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 237 | Y | 42.3 | Very low | 46.6 | Very low | 200 Ų | 200 | 147 Ų | 147 | 78% | 0.784 | 82% | 0.816 | S | S | * | * | trans | 76.9 | 120.4 | 164.8 | -33.1 | -76.1 | 0 | 0 | 0 | 118.4 | ||||
| 238 | H | 47 | Very low | 46.7 | Very low | 200 Ų | 200 | 148.7 Ų | 148.7 | 93% | 0.926 | 82% | 0.82 | S | S | * | * | -133.1 | 130.5 | 124 | -110 | -78.5 | 0 | 0 | 0 | 110 | |||||
| 239 | V | 44.2 | Very low | 46.3 | Very low | 119 Ų | 119 | 151.3 Ų | 151.3 | 72% | 0.721 | 83% | 0.825 | S | S | * | * | trans | -75.4 | 139.4 | 177.8 | 164.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 240 | L | 49.6 | Very low | 47.3 | Very low | 244 Ų | 244 | 147.5 Ų | 147.5 | 100% | 1.277 | 82% | 0.818 | S | S | * | * | trans | -141.3 | 0 | 136.9 | -85.5 | 172.2 | 0 | 0 | 0 | 107.8 |
Retrieved 240 of 240 residues in 287.7 ms
(Link to these results)