| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.5 | Very low | 48 | Very low | 244 Ų | 244 | 153.1 Ų | 153.1 | 100% | 1.202 | 83% | 0.83 | S | S | * | * | 0 | 116.7 | 0 | -88.7 | 171.8 | 165 | 0 | 0 | 108.6 | |||||
| 2 | M | 50.6 | Low | 47.4 | Very low | 180 Ų | 180 | 150.8 Ų | 150.8 | 89% | 0.887 | 82% | 0.816 | S | S | * | * | trans | 55.7 | 96.9 | 155.8 | -58.5 | -100.1 | -159.9 | 0 | 0 | 119.5 | ||||
| 3 | Q | 42 | Very low | 47.4 | Very low | 193 Ų | 193 | 150.2 Ų | 150.2 | 90% | 0.902 | 81% | 0.811 | S | S | * | * | trans | -83.7 | 137.6 | 153.4 | -152.7 | 119.1 | 26.6 | 0 | 0 | 108.3 | ||||
| 4 | V | 60 | Low | 46.9 | Very low | 116 Ų | 116 | 152.1 Ų | 152.1 | 70% | 0.703 | 81% | 0.812 | S | S | * | * | trans | -133.9 | 115.8 | 170.2 | -167.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 5 | P | 51.5 | Low | 46.8 | Very low | 111 Ų | 111 | 147 Ų | 147 | 72% | 0.721 | 79% | 0.793 | S | S | * | * | trans | -93.3 | 137.6 | 165.7 | 33.7 | -25.1 | 0 | 0 | 0 | 110 | ||||
| 6 | F | 56.1 | Low | 46.4 | Very low | 208 Ų | 208 | 147.1 Ų | 147.1 | 91% | 0.912 | 79% | 0.793 | S | S | * | * | trans | -89.3 | 103.8 | 174.3 | -112.8 | -90.8 | 0 | 0 | 0 | 109.7 | ||||
| 7 | E | 41.6 | Very low | 46.4 | Very low | 183 Ų | 183 | 145.6 Ų | 145.6 | 86% | 0.855 | 78% | 0.784 | S | S | * | * | trans | -81.4 | 138.8 | 156.9 | -79 | -81.9 | 153.2 | 0 | 0 | 108.6 | ||||
| 8 | G | 47.8 | Very low | 46.1 | Very low | 59 Ų | 59 | 147.3 Ų | 147.3 | 61% | 0.608 | 79% | 0.786 | S | S | * | * | trans | -158.9 | 91.5 | -174 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 9 | T | 47.2 | Very low | 45.7 | Very low | 139 Ų | 139 | 147.9 Ų | 147.9 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | trans | 78.4 | 96.2 | 147.7 | 63.2 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 10 | S | 41.6 | Very low | 45.7 | Very low | 96 Ų | 96 | 152.2 Ų | 152.2 | 67% | 0.671 | 79% | 0.792 | S | S | * | * | trans | -60.9 | 137.8 | 147.9 | 172.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 11 | L | 46.4 | Very low | 45.5 | Very low | 155 Ų | 155 | 152.2 Ų | 152.2 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | trans | -130.4 | 90.1 | 159.8 | -90.4 | 166.1 | 0 | 0 | 0 | 107.7 | L13 | L11-L13 PolarHBondContact O-N 3.19Š| ||
| 12 | D | 40.1 | Very low | 45.3 | Very low | 125 Ų | 125 | 144.7 Ų | 144.7 | 67% | 0.668 | 77% | 0.77 | S | S | * | * | trans | -66.7 | 114.9 | 158.5 | -84.1 | -45 | 0 | 0 | 0 | 109.2 | ||||
| 13 | L | 47.5 | Very low | 45 | Very low | 144 Ų | 144 | 142.1 Ų | 142.1 | 75% | 0.754 | 77% | 0.768 | S | S | * | * | trans | -110.1 | 86.1 | 156.9 | -110.1 | 82 | 0 | 0 | 0 | 108.8 | L11 S15 | L11-L13 PolarHBondContact O-N 3.19Å; L13-S15 PolarHBondContact O-N 2.72Å | ||
| 14 | H | 40.5 | Very low | 45.3 | Very low | 177 Ų | 177 | 140.7 Ų | 140.7 | 82% | 0.819 | 76% | 0.762 | S | S | * | * | trans | -66.3 | 103.8 | 152.5 | -82.5 | 76.9 | 0 | 0 | 0 | 108.1 | ||||
| 15 | S | 46.3 | Very low | 44.4 | Very low | 75 Ų | 75 | 142.8 Ų | 142.8 | 52% | 0.524 | 77% | 0.768 | S | S | . | * | trans | -153.1 | 109.2 | 158.3 | 63.5 | 0 | 0 | 0 | 0 | 110.3 | L13 | L13-S15 PolarHBondContact O-N 2.72Š| ||
| 16 | N | 40.4 | Very low | 43.7 | Very low | 148 Ų | 148 | 144 Ų | 144 | 79% | 0.791 | 77% | 0.768 | S | S | * | * | trans | 65.5 | 136.8 | 142.5 | -66 | -53.9 | 0 | 0 | 0 | 117.2 | ||||
| 17 | L | 45.2 | Very low | 43.1 | Very low | 122 Ų | 122 | 140.4 Ų | 140.4 | 64% | 0.639 | 76% | 0.763 | S | S | * | * | cis | -178 | 127.6 | -8 | -160.1 | 69.4 | 0 | 0 | 0 | 100.6 | ||||
| 18 | Q | 41 | Very low | 42.9 | Very low | 177 Ų | 177 | 140.3 Ų | 140.3 | 83% | 0.827 | 76% | 0.763 | S | S | * | * | trans | 45.2 | 80.3 | 154.3 | -64 | 168.9 | 0.5 | 0 | 0 | 118.1 | ||||
| 19 | I | 39.9 | Very low | 42.7 | Very low | 158 Ų | 158 | 143.4 Ų | 143.4 | 81% | 0.81 | 77% | 0.77 | S | S | * | * | trans | -132.9 | 65.5 | 153.1 | -47.3 | 176.9 | 0 | 0 | 0 | 108 | ||||
| 20 | R | 44.8 | Very low | 42.2 | Very low | 234 Ų | 234 | 139.8 Ų | 139.8 | 88% | 0.883 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -124 | -0.7 | 171.6 | -97.3 | -174.4 | -178 | 154.5 | 2.2 | 115.3 | ||
| 21 | D | 41.4 | Very low | 41.7 | Very low | 153 Ų | 153 | 138.9 Ų | 138.9 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -126.1 | 20.7 | -176.1 | -64.3 | -37 | 0 | 0 | 0 | 115.5 | ||
| 22 | A | 39.5 | Very low | 41.4 | Very low | 86 Ų | 86 | 140.5 Ų | 140.5 | 71% | 0.711 | 77% | 0.767 | S | S | * | * | trans | -92.7 | 12.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q24 | A22-Q24 VanDerWaalsContact C-N 3.26Å; A22-Q24 PolarHBondContact O-N 3.14Å | ||
| 23 | C | 45 | Very low | 41.7 | Very low | 125 Ų | 125 | 143 Ų | 143 | 85% | 0.845 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -79.7 | 6.9 | 176.4 | -74 | 0 | 0 | 0 | 0 | 114.6 | ||
| 24 | Q | 47.9 | Very low | 41.5 | Very low | 164 Ų | 164 | 143.6 Ų | 143.6 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -129.4 | 0 | -170.8 | -69.6 | -175.5 | 20 | 0 | 0 | 117 | A22 | A22-Q24 VanDerWaalsContact C-N 3.26Å; A22-Q24 PolarHBondContact O-N 3.14Å |
| 25 | L | 40.9 | Very low | 41.9 | Very low | 159 Ų | 159 | 139.6 Ų | 139.6 | 83% | 0.832 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -124.3 | 24.7 | -171.4 | -67 | 179.4 | 0 | 0 | 0 | 116.8 | ||
| 26 | N | 36.1 | Very low | 41.8 | Very low | 138 Ų | 138 | 141.5 Ų | 141.5 | 74% | 0.738 | 76% | 0.763 | S | S | * | * | trans | -125.3 | 23.5 | 165.9 | -143.1 | 4.2 | 0 | 0 | 0 | 114.3 | Q28 | N26-Q28 PolarHBondContact O-N 3.47Š| ||
| 27 | T | 43.8 | Very low | 42.4 | Very low | 131 Ų | 131 | 140.1 Ų | 140.1 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | trans | -83.6 | 35.8 | 169.1 | -45 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 28 | Q | 37.8 | Very low | 42.8 | Very low | 182 Ų | 182 | 138.3 Ų | 138.3 | 85% | 0.85 | 76% | 0.759 | S | S | * | * | trans | -133.2 | 57.2 | 173.9 | -67.7 | -166.1 | 32.7 | 0 | 0 | 110 | N26 | N26-Q28 PolarHBondContact O-N 3.47Š| ||
| 29 | V | 42.6 | Very low | 43.1 | Very low | 123 Ų | 123 | 135.4 Ų | 135.4 | 75% | 0.745 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -105.6 | 120.4 | 156.2 | -177.3 | 0 | 0 | 0 | 0 | 106.2 | ||
| 30 | G | 37 | Very low | 43.5 | Very low | 63 Ų | 63 | 132.8 Ų | 132.8 | 65% | 0.649 | 74% | 0.74 | S | S | * | * | trans | -25.1 | 134.1 | -169.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | F32 | G30-F32 PolarHBondContact O-N 2.9Å; G30-F32 VanDerWaalsContact O-N 3.14Å | ||
| 31 | G | 31.2 | Very low | 43.9 | Very low | 78 Ų | 78 | 122.8 Ų | 122.8 | 80% | 0.804 | 71% | 0.706 | S | S | * | * | trans | -46.9 | 117 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q33 | G31-Q33 PolarHBondContact O-N 3.41Å; G31-Q33 VanDerWaalsContact O-N 3.14Å | ||
| 32 | F | 40 | Very low | 44.4 | Very low | 189 Ų | 189 | 120.8 Ų | 120.8 | 83% | 0.829 | 70% | 0.703 | S | S | * | * | trans | -62.5 | 113.3 | 153.5 | -74.9 | -82.6 | 0 | 0 | 0 | 106.3 | G30 N34 | G30-F32 PolarHBondContact O-N 2.9Å; G30-F32 VanDerWaalsContact O-N 3.14Å; F32-N34 PolarHBondContact O-N 3.08Å; F32-N34 VanDerWaalsContact O-N 3.08Å | ||
| 33 | Q | 47.1 | Very low | 45.2 | Very low | 176 Ų | 176 | 119 Ų | 119 | 82% | 0.822 | 68% | 0.681 | S | S | * | * | trans | -45.5 | 120.2 | 168.1 | -68.7 | -78.3 | 7.8 | 0 | 0 | 107.4 | G31 I35 | G31-Q33 PolarHBondContact O-N 3.41Å; G31-Q33 VanDerWaalsContact O-N 3.14Å; Q33-I35 PolarHBondContact O-N 3.25Å | ||
| 34 | N | 43.4 | Very low | 45.7 | Very low | 158 Ų | 158 | 116.2 Ų | 116.2 | 85% | 0.845 | 65% | 0.653 | S | S | * | * | trans | -50.6 | 114.2 | 172.4 | -79.2 | -67.9 | 0 | 0 | 0 | 107.7 | F32 H36 | F32-N34 PolarHBondContact O-N 3.08Å; F32-N34 VanDerWaalsContact O-N 3.08Å; N34-H36 PolarHBondContact O-N 2.98Å; N34-H36 VanDerWaalsContact O-N 3.1Å | ||
| 35 | I | 49.1 | Very low | 46.2 | Very low | 92 Ų | 92 | 112.1 Ų | 112.1 | 47% | 0.472 | 64% | 0.641 | S | S | . | * | trans | -60.2 | 119.1 | 170.5 | -63.1 | 170.9 | 0 | 0 | 0 | 105.4 | Q33 F39 Y44 | Q33-I35 PolarHBondContact O-N 3.25Å; I35-F39 HydrophobicContact CG2-CB 3.9Å; I35-Y44 HydrophobicContact CD1-CD1 4.17Å; I35-Y44 HydrophobicContact CD1-CE1 3.5Å; I35-Y44 VanDerWaalsContact CD1-CE1 3.5Å; I35-Y44 HydrophobicContact CD1-CE2 4.31Å | ||
| 36 | H | 43.6 | Very low | 47 | Very low | 115 Ų | 115 | 107.9 Ų | 107.9 | 53% | 0.532 | 62% | 0.624 | S | S | . | * | trans | -54.8 | 132.8 | -174.5 | 175.3 | -86.8 | 0 | 0 | 0 | 109.6 | N34 S38 F39 | N34-H36 PolarHBondContact O-N 2.98Å; N34-H36 VanDerWaalsContact O-N 3.1Å; H36-S38 PolarHBondContact CE1-OG 2.87Å; H36-S38 WeakPolarHBondContact ND1-CB 3.49Å; H36-S38 PolarHBondContact ND1-OG 2.74Å; H36-S38 PolarHBondContact O-N 3.1Å; H36-F39 HydrophobicContact CB-CD2 3.77Å; H36-F39 HydrophobicContact CB-CE2 3.98Å; H36-F39 AromaticContact ND1-CD2 3.99Å; H36-F39 AromaticContact ND1-CE2 3.96Å; H36-F39 WeakPolarHBondContact O-CD2 3.37Å; H36-F39 PolarHBondContact O-N 2.89Å | ||
| 37 | P | 52.9 | Low | 48 | Very low | 119 Ų | 119 | 101.8 Ų | 101.8 | 77% | 0.773 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.1 | -12.2 | -166.2 | 21.2 | -32.9 | 0 | 0 | 0 | 114.6 | F39 | P37-F39 VanDerWaalsContact C-N 3.3Š|
| 38 | S | 53 | Low | 48.7 | Very low | 84 Ų | 84 | 101.5 Ų | 101.5 | 59% | 0.587 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | -9.3 | 171.7 | 74.4 | 0 | 0 | 0 | 0 | 114.5 | H36 S40 | H36-S38 PolarHBondContact CE1-OG 2.87Å; H36-S38 WeakPolarHBondContact ND1-CB 3.49Å; H36-S38 PolarHBondContact ND1-OG 2.74Å; H36-S38 PolarHBondContact O-N 3.1Å; S38-S40 VanDerWaalsContact C-N 3.33Å; S38-S40 PolarHBondContact O-N 3.14Å |
| 39 | F | 47.7 | Very low | 49.9 | Very low | 117 Ų | 117 | 100.4 Ų | 100.4 | 51% | 0.513 | 58% | 0.576 | S | S | . | * | trans | -99 | 42.2 | 179.3 | -65.3 | -84.5 | 0 | 0 | 0 | 111.9 | I35 H36 P37 S41 | I35-F39 HydrophobicContact CG2-CB 3.9Å; H36-F39 HydrophobicContact CB-CD2 3.77Å; H36-F39 HydrophobicContact CB-CE2 3.98Å; H36-F39 AromaticContact ND1-CD2 3.99Å; H36-F39 AromaticContact ND1-CE2 3.96Å; H36-F39 WeakPolarHBondContact O-CD2 3.37Å; H36-F39 PolarHBondContact O-N 2.89Å; P37-F39 VanDerWaalsContact C-N 3.3Å; F39-S41 PolarHBondContact O-N 3.47Å | ||
| 40 | S | 48.9 | Very low | 50.6 | Low | 102 Ų | 102 | 96.4 Ų | 96.4 | 71% | 0.713 | 55% | 0.552 | S | S | * | * | trans | -68 | 78.6 | 170.4 | -162.4 | 0 | 0 | 0 | 0 | 109.5 | S38 C42 | S38-S40 VanDerWaalsContact C-N 3.33Å; S38-S40 PolarHBondContact O-N 3.14Å; S40-C42 PolarHBondContact O-N 3.24Å | ||
| 41 | S | 52.5 | Low | 51.8 | Low | 25 Ų | 25 | 96.1 Ų | 96.1 | 18% | 0.175 | 54% | 0.535 | C | S | . | . | trans | -64.3 | 128.4 | 160.4 | 167.3 | 0 | 0 | 0 | 0 | 106.6 | F39 I43 Y44 | F39-S41 PolarHBondContact O-N 3.47Å; S41-I43 PolarHBondContact O-N 3.41Å; S41-I43 WeakPolarHBondContact OG-CB 3.48Å; S41-I43 PolarHBondContact OG-N 3.5Å; S41-Y44 PolarHBondContact O-N 2.9Å | ||
| 42 | C | 53.5 | Low | 53.3 | Low | 111 Ų | 111 | 97.1 Ų | 97.1 | 75% | 0.75 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.6 | -9.5 | 175.4 | 57.5 | 0 | 0 | 0 | 0 | 114 | S40 | S40-C42 PolarHBondContact O-N 3.24Š|
| 43 | I | 56 | Low | 54.5 | Low | 49 Ų | 49 | 90.1 Ų | 90.1 | 25% | 0.251 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.6 | -35.1 | 177 | -53.1 | -178.4 | 0 | 0 | 0 | 111.3 | S41 S46 L47 | S41-I43 PolarHBondContact O-N 3.41Å; S41-I43 WeakPolarHBondContact OG-CB 3.48Å; S41-I43 PolarHBondContact OG-N 3.5Å; I43-S46 PolarHBondContact O-N 3.28Å; I43-S46 VanDerWaalsContact O-N 3.16Å; I43-S46 PolarHBondContact O-OG 3.43Å; I43-S46 VanDerWaalsContact O-OG 3.11Å; I43-L47 HydrophobicContact CG2-CD1 3.96Å; I43-L47 HydrophobicContact CG2-CD2 4.26Å; I43-L47 HydrophobicContact CG2-CG 3.99Å; I43-L47 WeakPolarHBondContact O-CG 3.3Å; I43-L47 PolarHBondContact O-N 3.06Å |
| 44 | Y | 55.7 | Low | 55.1 | Low | 65 Ų | 65 | 82.6 Ų | 82.6 | 26% | 0.255 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -59.9 | -41.6 | -172.4 | -79.2 | -68.2 | 0 | 0 | 0 | 115.1 | I35 S41 S46 L47 E48 | I35-Y44 HydrophobicContact CD1-CD1 4.17Å; I35-Y44 HydrophobicContact CD1-CE1 3.5Å; I35-Y44 VanDerWaalsContact CD1-CE1 3.5Å; I35-Y44 HydrophobicContact CD1-CE2 4.31Å; S41-Y44 PolarHBondContact O-N 2.9Å; Y44-S46 VanDerWaalsContact C-N 3.28Å; Y44-S46 PolarHBondContact O-N 2.98Å; Y44-L47 HydrophobicContact CD1-CD1 4.36Å; Y44-L47 WeakPolarHBondContact O-CB 3.26Å; Y44-L47 PolarHBondContact O-N 3.02Å; Y44-L47 VanDerWaalsContact O-N 3.13Å; Y44-E48 PolarHBondContact O-N 3.4Å; Y44-E48 VanDerWaalsContact O-N 3.09Å |
| 45 | P | 57.6 | Low | 55.8 | Low | 79 Ų | 79 | 79.3 Ų | 79.3 | 51% | 0.513 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -63.1 | -30.8 | 178 | -23.8 | 34.8 | 0 | 0 | 0 | 113.8 | ||
| 46 | S | 57 | Low | 56.3 | Low | 69 Ų | 69 | 78.7 Ų | 78.7 | 48% | 0.483 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -78.3 | -25.9 | 176.5 | 84.6 | 0 | 0 | 0 | 0 | 112.6 | I43 Y44 T50 | I43-S46 PolarHBondContact O-N 3.28Å; I43-S46 VanDerWaalsContact O-N 3.16Å; I43-S46 PolarHBondContact O-OG 3.43Å; I43-S46 VanDerWaalsContact O-OG 3.11Å; Y44-S46 VanDerWaalsContact C-N 3.28Å; Y44-S46 PolarHBondContact O-N 2.98Å; S46-T50 PolarHBondContact O-OG1 2.94Å |
| 47 | L | 56.7 | Low | 56.9 | Low | 10 Ų | 10 | 78.6 Ų | 78.6 | 5% | 0.052 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -72.5 | -36.5 | 174.3 | -61 | -175.6 | 0 | 0 | 0 | 111.8 | I43 Y44 Q49 T50 I51 T238 | I43-L47 HydrophobicContact CG2-CD1 3.96Å; I43-L47 HydrophobicContact CG2-CD2 4.26Å; I43-L47 HydrophobicContact CG2-CG 3.99Å; I43-L47 WeakPolarHBondContact O-CG 3.3Å; I43-L47 PolarHBondContact O-N 3.06Å; Y44-L47 HydrophobicContact CD1-CD1 4.36Å; Y44-L47 WeakPolarHBondContact O-CB 3.26Å; Y44-L47 PolarHBondContact O-N 3.02Å; Y44-L47 VanDerWaalsContact O-N 3.13Å; L47-Q49 VanDerWaalsContact C-N 3.3Å; L47-Q49 PolarHBondContact O-N 2.96Å; L47-T50 CarbonylContact O-C 3.58Å; L47-T50 PolarHBondContact O-N 3.26Å; L47-I51 HydrophobicContact CB-CD1 4.01Å; L47-I51 WeakPolarHBondContact O-CB 3.5Å; L47-I51 WeakPolarHBondContact O-CD1 3.49Å; L47-I51 WeakPolarHBondContact O-CG1 3.3Å; L47-I51 PolarHBondContact O-N 2.94Å; L47-T238 WeakPolarHBondContact CD1-OG1 3.29Å; L47-T238 VanDerWaalsContact CD2-CB 3.49Å; L47-T238 HydrophobicContact CD2-CG2 3.63Å; L47-T238 WeakPolarHBondContact CD2-OG1 3.46Å |
| 48 | E | 59.9 | Low | 57 | Low | 125 Ų | 125 | 76.2 Ų | 76.2 | 58% | 0.584 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -59.6 | -42.5 | -177.8 | -151.1 | 167.8 | -163.8 | 0 | 0 | 111.4 | Y44 T50 I51 N52 | Y44-E48 PolarHBondContact O-N 3.4Å; Y44-E48 VanDerWaalsContact O-N 3.09Å; E48-T50 VanDerWaalsContact C-N 3.33Å; E48-T50 PolarHBondContact O-N 3.28Å; E48-I51 PolarHBondContact O-N 3.2Å; E48-N52 WeakPolarHBondContact O-CB 3.38Å; E48-N52 PolarHBondContact O-N 2.96Å; E48-N52 PolarHBondContact O-ND2 3.48Å |
| 49 | Q | 62.2 | Low | 57 | Low | 160 Ų | 160 | 74.1 Ų | 74.1 | 75% | 0.748 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -64.7 | -36.7 | 175.5 | -162.9 | 168.5 | 29.9 | 0 | 0 | 112.7 | L47 S53 | L47-Q49 VanDerWaalsContact C-N 3.3Å; L47-Q49 PolarHBondContact O-N 2.96Å; Q49-S53 WeakPolarHBondContact O-CB 3.29Å; Q49-S53 PolarHBondContact O-N 3.32Å |
| 50 | T | 58.6 | Low | 57.5 | Low | 38 Ų | 38 | 74.9 Ų | 74.9 | 23% | 0.233 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -73 | -44.8 | 178.5 | -54 | 0 | 0 | 0 | 0 | 111.3 | S46 L47 E48 N52 S53 V54 L234 V235 | S46-T50 PolarHBondContact O-OG1 2.94Å; L47-T50 CarbonylContact O-C 3.58Å; L47-T50 PolarHBondContact O-N 3.26Å; E48-T50 VanDerWaalsContact C-N 3.33Å; E48-T50 PolarHBondContact O-N 3.28Å; T50-N52 VanDerWaalsContact C-N 3.33Å; T50-N52 PolarHBondContact O-N 2.83Å; T50-S53 WeakPolarHBondContact O-CB 3.5Å; T50-S53 PolarHBondContact O-N 3.46Å; T50-S53 VanDerWaalsContact O-N 3.1Å; T50-V54 VanDerWaalsContact O-CG2 3.3Å; T50-V54 WeakPolarHBondContact O-CG2 3.39Å; T50-V54 PolarHBondContact O-N 2.86Å; T50-L234 HydrophobicContact CG2-CD2 4.42Å; T50-V235 HydrophobicContact CG2-CG2 3.76Å |
| 51 | I | 60.7 | Low | 57.9 | Low | 57 Ų | 57 | 77.7 Ų | 77.7 | 29% | 0.292 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.7 | -45.5 | 175.4 | -68.8 | 163.9 | 0 | 0 | 0 | 109.9 | L47 E48 S53 V54 N55 V235 | L47-I51 HydrophobicContact CB-CD1 4.01Å; L47-I51 WeakPolarHBondContact O-CB 3.5Å; L47-I51 WeakPolarHBondContact O-CD1 3.49Å; L47-I51 WeakPolarHBondContact O-CG1 3.3Å; L47-I51 PolarHBondContact O-N 2.94Å; E48-I51 PolarHBondContact O-N 3.2Å; I51-S53 VanDerWaalsContact C-N 3.29Å; I51-S53 PolarHBondContact O-N 3.35Å; I51-V54 PolarHBondContact O-N 3.38Å; I51-N55 PolarHBondContact O-N 3.28Å; I51-N55 PolarHBondContact O-ND2 3.26Å; I51-N55 VanDerWaalsContact O-ND2 3.16Å; I51-V235 HydrophobicContact CD1-CG1 4.26Å; I51-V235 HydrophobicContact CG1-CG1 3.75Å; I51-V235 HydrophobicContact CG1-CG2 3.87Å |
| 52 | N | 63.5 | Low | 58.1 | Low | 100 Ų | 100 | 80.3 Ų | 80.3 | 54% | 0.535 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.1 | -33.4 | 176.1 | -66.9 | -22.4 | 0 | 0 | 0 | 111.8 | E48 T50 N55 | E48-N52 WeakPolarHBondContact O-CB 3.38Å; E48-N52 PolarHBondContact O-N 2.96Å; E48-N52 PolarHBondContact O-ND2 3.48Å; T50-N52 VanDerWaalsContact C-N 3.33Å; T50-N52 PolarHBondContact O-N 2.83Å; N52-N55 PolarHBondContact O-N 3.48Å |
| 53 | S | 64.2 | Low | 58.4 | Low | 42 Ų | 42 | 80.3 Ų | 80.3 | 29% | 0.294 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -70.1 | -36.6 | 174.5 | -172 | 0 | 0 | 0 | 0 | 113.3 | Q49 T50 I51 N55 T56 K231 | Q49-S53 WeakPolarHBondContact O-CB 3.29Å; Q49-S53 PolarHBondContact O-N 3.32Å; T50-S53 WeakPolarHBondContact O-CB 3.5Å; T50-S53 PolarHBondContact O-N 3.46Å; T50-S53 VanDerWaalsContact O-N 3.1Å; I51-S53 VanDerWaalsContact C-N 3.29Å; I51-S53 PolarHBondContact O-N 3.35Å; S53-N55 PolarHBondContact O-N 3.44Å; S53-T56 PolarHBondContact O-N 2.93Å; S53-T56 PolarHBondContact O-OG1 3.42Å; S53-K231 PolarHBondContact OG-NZ 2.88Å |
| 54 | V | 60.7 | Low | 58.6 | Low | 17 Ų | 17 | 81.8 Ų | 81.8 | 10% | 0.103 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -63.9 | -31.3 | 176 | 173.9 | 0 | 0 | 0 | 0 | 111.3 | T50 I51 T56 Y228 K231 S232 V235 | T50-V54 VanDerWaalsContact O-CG2 3.3Å; T50-V54 WeakPolarHBondContact O-CG2 3.39Å; T50-V54 PolarHBondContact O-N 2.86Å; I51-V54 PolarHBondContact O-N 3.38Å; V54-T56 VanDerWaalsContact C-N 3.33Å; V54-T56 PolarHBondContact O-N 3.41Å; V54-Y228 HydrophobicContact CG1-CD2 4.06Å; V54-Y228 HydrophobicContact CG1-CE2 3.45Å; V54-Y228 VanDerWaalsContact CG1-CE2 3.45Å; V54-K231 HydrophobicContact CG2-CB 3.47Å; V54-K231 VanDerWaalsContact CG2-CB 3.47Å; V54-K231 HydrophobicContact CG2-CD 4.38Å; V54-S232 WeakPolarHBondContact CG1-OG 3.44Å; V54-V235 HydrophobicContact CG2-CG2 4.48Å |
| 55 | N | 57.6 | Low | 58.8 | Low | 90 Ų | 90 | 85.8 Ų | 85.8 | 48% | 0.481 | 44% | 0.443 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | 7.4 | -176.2 | -72.3 | -35.7 | 0 | 0 | 0 | 115.1 | I51 N52 S53 D57 | I51-N55 PolarHBondContact O-N 3.28Å; I51-N55 PolarHBondContact O-ND2 3.26Å; I51-N55 VanDerWaalsContact O-ND2 3.16Å; N52-N55 PolarHBondContact O-N 3.48Å; S53-N55 PolarHBondContact O-N 3.44Å; N55-D57 PolarHBondContact O-N 2.95Å |
| 56 | T | 60.3 | Low | 58.9 | Low | 79 Ų | 79 | 82.7 Ų | 82.7 | 49% | 0.485 | 42% | 0.423 | S | S | . | . | trans | -65.2 | 123.8 | 179.9 | 50.8 | 0 | 0 | 0 | 0 | 111.8 | S53 V54 A58 F59 | S53-T56 PolarHBondContact O-N 2.93Å; S53-T56 PolarHBondContact O-OG1 3.42Å; V54-T56 VanDerWaalsContact C-N 3.33Å; V54-T56 PolarHBondContact O-N 3.41Å; T56-A58 PolarHBondContact O-N 3.26Å; T56-F59 PolarHBondContact O-N 3.16Å | ||
| 57 | D | 55 | Low | 59.2 | Low | 112 Ų | 112 | 81.6 Ų | 81.6 | 60% | 0.599 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -54.3 | -15.8 | -172.2 | -72.5 | -44.3 | 0 | 0 | 0 | 115.9 | N55 F59 K60 K61 | N55-D57 PolarHBondContact O-N 2.95Å; D57-F59 VanDerWaalsContact C-N 3.31Å; D57-F59 PolarHBondContact O-N 3.4Å; D57-K60 PolarHBondContact O-N 2.99Å; D57-K61 PolarHBondContact O-N 3.16Å |
| 58 | A | 55.3 | Low | 59.3 | Low | 69 Ų | 69 | 84.6 Ų | 84.6 | 57% | 0.57 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -59.1 | -42.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | T56 K61 E62 | T56-A58 PolarHBondContact O-N 3.26Å; A58-K61 PolarHBondContact O-N 3.02Å; A58-E62 PolarHBondContact O-N 3.48Å; A58-E62 VanDerWaalsContact O-N 3.15Å |
| 59 | F | 53.7 | Low | 59.3 | Low | 41 Ų | 41 | 81 Ų | 81 | 18% | 0.18 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -68.1 | -40.2 | -177.7 | -170 | -101.8 | 0 | 0 | 0 | 112.4 | T56 D57 Y63 R225 Y228 | T56-F59 PolarHBondContact O-N 3.16Å; D57-F59 VanDerWaalsContact C-N 3.31Å; D57-F59 PolarHBondContact O-N 3.4Å; F59-Y63 HydrophobicContact CZ-CD2 4.45Å; F59-Y63 WeakPolarHBondContact O-CB 3.28Å; F59-Y63 PolarHBondContact O-N 2.87Å; F59-R225 HydrophobicContact CE2-CB 4.41Å; F59-Y228 HydrophobicContact CD1-CD1 4.22Å; F59-Y228 AromaticContact CD1-CD2 3.59Å; F59-Y228 HydrophobicContact CD1-CD2 3.59Å; F59-Y228 HydrophobicContact CD1-CE1 4.49Å; F59-Y228 AromaticContact CD1-CE2 3.89Å; F59-Y228 HydrophobicContact CD1-CE2 3.89Å; F59-Y228 AromaticContact CD1-CG 3.77Å; F59-Y228 HydrophobicContact CD1-CG 3.77Å; F59-Y228 HydrophobicContact CD2-CD2 4.34Å; F59-Y228 HydrophobicContact CD2-CG 4.16Å; F59-Y228 AromaticContact CE1-CD1 3.56Å; F59-Y228 HydrophobicContact CE1-CD1 3.56Å; F59-Y228 AromaticContact CE1-CD2 3.82Å; F59-Y228 HydrophobicContact CE1-CD2 3.82Å; F59-Y228 AromaticContact CE1-CE1 3.91Å; F59-Y228 HydrophobicContact CE1-CE1 3.91Å; F59-Y228 HydrophobicContact CE1-CE2 4.14Å; F59-Y228 AromaticContact CE1-CG 3.51Å; F59-Y228 HydrophobicContact CE1-CG 3.51Å; F59-Y228 HydrophobicContact CE2-CD1 4.46Å; F59-Y228 AromaticContact CE2-CG 3.95Å; F59-Y228 HydrophobicContact CE2-CG 3.95Å; F59-Y228 AromaticContact CG-CD2 3.88Å; F59-Y228 HydrophobicContact CG-CD2 3.88Å; F59-Y228 HydrophobicContact CG-CG 4.09Å; F59-Y228 AromaticContact CZ-CD1 3.7Å; F59-Y228 HydrophobicContact CZ-CD1 3.7Å; F59-Y228 HydrophobicContact CZ-CD2 4.3Å; F59-Y228 HydrophobicContact CZ-CE1 4.46Å; F59-Y228 AromaticContact CZ-CG 3.61Å; F59-Y228 HydrophobicContact CZ-CG 3.61Å |
| 60 | K | 57.5 | Low | 59.2 | Low | 132 Ų | 132 | 78.5 Ų | 78.5 | 57% | 0.574 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -66.6 | -41 | 179.3 | -74.6 | -178.5 | -179.4 | 173.7 | 0 | 111.7 | D57 T64 | D57-K60 PolarHBondContact O-N 2.99Å; K60-T64 VanDerWaalsContact O-CB 3.28Å; K60-T64 WeakPolarHBondContact O-CB 3.47Å; K60-T64 PolarHBondContact O-N 3.34Å; K60-T64 VanDerWaalsContact O-N 3.13Å; K60-T64 PolarHBondContact O-OG1 3.41Å |
| 61 | K | 57.9 | Low | 59.2 | Low | 161 Ų | 161 | 83.5 Ų | 83.5 | 70% | 0.7 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -69.5 | -42.6 | -178.9 | -70.5 | -175.7 | -178.3 | 178.9 | 0 | 112.3 | D57 A58 Y65 | D57-K61 PolarHBondContact O-N 3.16Å; A58-K61 PolarHBondContact O-N 3.02Å; K61-Y65 PolarHBondContact O-N 2.76Å; K61-Y65 VanDerWaalsContact O-N 3.1Å |
| 62 | E | 57.3 | Low | 58.9 | Low | 80 Ų | 80 | 88 Ų | 88 | 37% | 0.374 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -75.9 | -39.3 | -176.8 | -161.4 | 164.8 | -172 | 0 | 0 | 112.2 | A58 T64 Y65 D66 L224 | A58-E62 PolarHBondContact O-N 3.48Å; A58-E62 VanDerWaalsContact O-N 3.15Å; E62-T64 VanDerWaalsContact C-N 3.33Å; E62-T64 PolarHBondContact O-N 3.47Å; E62-Y65 PolarHBondContact O-N 3.05Å; E62-D66 PolarHBondContact O-N 3.09Å; E62-L224 WeakPolarHBondContact OE2-CD1 3.31Å |
| 63 | Y | 58.9 | Low | 58.5 | Low | 111 Ų | 111 | 89 Ų | 89 | 44% | 0.435 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.5 | -37.8 | 172.9 | -171.6 | -97.5 | 0 | 0 | 0 | 112.3 | F59 T67 | F59-Y63 HydrophobicContact CZ-CD2 4.45Å; F59-Y63 WeakPolarHBondContact O-CB 3.28Å; F59-Y63 PolarHBondContact O-N 2.87Å; Y63-T67 WeakPolarHBondContact CE1-OG1 3.5Å; Y63-T67 VanDerWaalsContact O-CB 3.22Å; Y63-T67 WeakPolarHBondContact O-CB 3.16Å; Y63-T67 PolarHBondContact O-N 3.3Å; Y63-T67 PolarHBondContact O-OG1 3.44Å |
| 64 | T | 59.6 | Low | 57.5 | Low | 81 Ų | 81 | 92 Ų | 92 | 50% | 0.497 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -66 | -41.1 | 175.9 | -56.4 | 0 | 0 | 0 | 0 | 111 | K60 E62 E68 | K60-T64 VanDerWaalsContact O-CB 3.28Å; K60-T64 WeakPolarHBondContact O-CB 3.47Å; K60-T64 PolarHBondContact O-N 3.34Å; K60-T64 VanDerWaalsContact O-N 3.13Å; K60-T64 PolarHBondContact O-OG1 3.41Å; E62-T64 VanDerWaalsContact C-N 3.33Å; E62-T64 PolarHBondContact O-N 3.47Å; T64-E68 HydrophobicContact CG2-CG 4.36Å; T64-E68 WeakPolarHBondContact O-CB 3.35Å; T64-E68 VanDerWaalsContact O-CG 3.26Å; T64-E68 WeakPolarHBondContact O-CG 3.44Å; T64-E68 PolarHBondContact O-N 2.86Å |
| 65 | Y | 60.2 | Low | 56.7 | Low | 148 Ų | 148 | 96.7 Ų | 96.7 | 58% | 0.58 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65.3 | -45.5 | 178.4 | -174.6 | -93.3 | 0 | 0 | 0 | 112.5 | K61 E62 E68 L69 | K61-Y65 PolarHBondContact O-N 2.76Å; K61-Y65 VanDerWaalsContact O-N 3.1Å; E62-Y65 PolarHBondContact O-N 3.05Å; Y65-E68 PolarHBondContact O-N 2.85Å; Y65-L69 HydrophobicContact CE1-CD2 4.42Å; Y65-L69 VanDerWaalsContact O-CB 3.29Å; Y65-L69 WeakPolarHBondContact O-CB 3.4Å; Y65-L69 PolarHBondContact O-N 3.38Å |
| 66 | D | 59.4 | Low | 56.1 | Low | 14 Ų | 14 | 96.3 Ų | 96.3 | 8% | 0.075 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -69.7 | -38 | 178.3 | -87.8 | -17.5 | 0 | 0 | 0 | 112.3 | E62 L69 Q70 T221 | E62-D66 PolarHBondContact O-N 3.09Å; D66-L69 PolarHBondContact O-N 3.4Å; D66-Q70 WeakPolarHBondContact O-CB 3.5Å; D66-Q70 PolarHBondContact O-N 3.2Å; D66-Q70 PolarHBondContact O-OE1 3.13Å; D66-Q70 VanDerWaalsContact O-OE1 3.05Å; D66-T221 WeakPolarHBondContact OD2-CB 3.45Å; D66-T221 WeakPolarHBondContact OD2-CG2 3.47Å; D66-T221 PolarHBondContact OD2-OG1 3.24Å |
| 67 | T | 64.7 | Low | 55 | Low | 47 Ų | 47 | 100.4 Ų | 100.4 | 29% | 0.288 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 175.3 | -57.1 | 0 | 0 | 0 | 0 | 111.3 | Y63 Q70 R71 | Y63-T67 WeakPolarHBondContact CE1-OG1 3.5Å; Y63-T67 VanDerWaalsContact O-CB 3.22Å; Y63-T67 WeakPolarHBondContact O-CB 3.16Å; Y63-T67 PolarHBondContact O-N 3.3Å; Y63-T67 PolarHBondContact O-OG1 3.44Å; T67-Q70 PolarHBondContact O-N 3.16Å; T67-R71 WeakPolarHBondContact O-CB 3.22Å; T67-R71 WeakPolarHBondContact O-CG 3.32Å; T67-R71 PolarHBondContact O-N 3.11Å |
| 68 | E | 57.8 | Low | 54.5 | Low | 73 Ų | 73 | 99.5 Ų | 99.5 | 34% | 0.341 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -70.2 | -36.4 | 176.8 | -72 | -63.5 | 125.2 | 0 | 0 | 111.9 | T64 Y65 R71 Q72 | T64-E68 HydrophobicContact CG2-CG 4.36Å; T64-E68 WeakPolarHBondContact O-CB 3.35Å; T64-E68 VanDerWaalsContact O-CG 3.26Å; T64-E68 WeakPolarHBondContact O-CG 3.44Å; T64-E68 PolarHBondContact O-N 2.86Å; Y65-E68 PolarHBondContact O-N 2.85Å; E68-R71 WeakPolarHBondContact O-CB 3.43Å; E68-R71 PolarHBondContact O-N 3.28Å; E68-R71 IonicContact OE1-CZ 3.55Å; E68-R71 IonicContact OE1-NH1 2.78Å; E68-R71 PolarHBondContact OE1-NH1 2.85Å; E68-R71 IonicContact OE1-NH2 3.77Å; E68-R71 IonicContact OE2-NH2 3.87Å; E68-Q72 VanDerWaalsContact O-CG 3.32Å; E68-Q72 WeakPolarHBondContact O-CG 3.42Å; E68-Q72 PolarHBondContact O-N 2.9Å |
| 69 | L | 60.1 | Low | 53.7 | Low | 50 Ų | 50 | 103.4 Ų | 103.4 | 26% | 0.262 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.8 | -39.5 | 173.1 | -167.3 | 71.8 | 0 | 0 | 0 | 111.5 | Y65 D66 Q72 I73 | Y65-L69 HydrophobicContact CE1-CD2 4.42Å; Y65-L69 VanDerWaalsContact O-CB 3.29Å; Y65-L69 WeakPolarHBondContact O-CB 3.4Å; Y65-L69 PolarHBondContact O-N 3.38Å; D66-L69 PolarHBondContact O-N 3.4Å; L69-Q72 PolarHBondContact O-N 3.05Å; L69-I73 HydrophobicContact CG-CD1 4.05Å; L69-I73 WeakPolarHBondContact O-CB 3.39Å; L69-I73 WeakPolarHBondContact O-CD1 3.49Å; L69-I73 VanDerWaalsContact O-CG1 3.23Å; L69-I73 WeakPolarHBondContact O-CG1 3.19Å; L69-I73 PolarHBondContact O-N 3.47Å; L69-I73 VanDerWaalsContact O-N 3.09Å |
| 70 | Q | 59.6 | Low | 53.1 | Low | 106 Ų | 106 | 107.5 Ų | 107.5 | 50% | 0.495 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 171.5 | -103 | 96 | 60.1 | 0 | 0 | 111.8 | D66 T67 Q72 I73 L74 | D66-Q70 WeakPolarHBondContact O-CB 3.5Å; D66-Q70 PolarHBondContact O-N 3.2Å; D66-Q70 PolarHBondContact O-OE1 3.13Å; D66-Q70 VanDerWaalsContact O-OE1 3.05Å; T67-Q70 PolarHBondContact O-N 3.16Å; Q70-Q72 VanDerWaalsContact C-N 3.31Å; Q70-Q72 PolarHBondContact O-N 3.43Å; Q70-I73 PolarHBondContact O-N 3.01Å; Q70-L74 WeakPolarHBondContact O-CB 3.4Å; Q70-L74 PolarHBondContact O-N 2.92Å |
| 71 | R | 59.3 | Low | 52.2 | Low | 143 Ų | 143 | 108.3 Ų | 108.3 | 54% | 0.54 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.5 | -31.3 | 174.6 | -78.1 | -100.9 | -55.1 | -62.6 | -15.1 | 113.2 | T67 E68 | T67-R71 WeakPolarHBondContact O-CB 3.22Å; T67-R71 WeakPolarHBondContact O-CG 3.32Å; T67-R71 PolarHBondContact O-N 3.11Å; E68-R71 WeakPolarHBondContact O-CB 3.43Å; E68-R71 PolarHBondContact O-N 3.28Å; E68-R71 IonicContact OE1-CZ 3.55Å; E68-R71 IonicContact OE1-NH1 2.78Å; E68-R71 PolarHBondContact OE1-NH1 2.85Å; E68-R71 IonicContact OE1-NH2 3.77Å; E68-R71 IonicContact OE2-NH2 3.87Å |
| 72 | Q | 54.7 | Low | 51.3 | Low | 152 Ų | 152 | 110.6 Ų | 110.6 | 71% | 0.71 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -78.5 | -26.2 | 175.2 | -73.6 | 174.7 | 15.2 | 0 | 0 | 112.7 | E68 L69 Q70 | E68-Q72 VanDerWaalsContact O-CG 3.32Å; E68-Q72 WeakPolarHBondContact O-CG 3.42Å; E68-Q72 PolarHBondContact O-N 2.9Å; L69-Q72 PolarHBondContact O-N 3.05Å; Q70-Q72 VanDerWaalsContact C-N 3.31Å; Q70-Q72 PolarHBondContact O-N 3.43Å |
| 73 | I | 55 | Low | 50.2 | Low | 120 Ų | 120 | 109.5 Ų | 109.5 | 62% | 0.615 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -89.8 | -28 | 179.6 | -66.4 | 167.4 | 0 | 0 | 0 | 112 | L69 Q70 | L69-I73 HydrophobicContact CG-CD1 4.05Å; L69-I73 WeakPolarHBondContact O-CB 3.39Å; L69-I73 WeakPolarHBondContact O-CD1 3.49Å; L69-I73 VanDerWaalsContact O-CG1 3.23Å; L69-I73 WeakPolarHBondContact O-CG1 3.19Å; L69-I73 PolarHBondContact O-N 3.47Å; L69-I73 VanDerWaalsContact O-N 3.09Å; Q70-I73 PolarHBondContact O-N 3.01Å |
| 74 | L | 42.5 | Very low | 49.3 | Very low | 105 Ų | 105 | 111 Ų | 111 | 55% | 0.55 | 58% | 0.583 | S | S | . | * | S | Bend | trans | -106.1 | 116.3 | 177.2 | -63.7 | 172.2 | 0 | 0 | 0 | 109.5 | Q70 S76 | Q70-L74 WeakPolarHBondContact O-CB 3.4Å; Q70-L74 PolarHBondContact O-N 2.92Å; L74-S76 PolarHBondContact O-N 3.46Å; L74-S76 VanDerWaalsContact O-N 3.08Å |
| 75 | P | 45.2 | Very low | 48.3 | Very low | 116 Ų | 116 | 113.8 Ų | 113.8 | 75% | 0.753 | 59% | 0.59 | S | S | * | * | trans | -54.2 | 122.3 | 166.6 | -17.6 | 29 | 0 | 0 | 0 | 107.8 | L77 | P75-L77 PolarHBondContact O-N 3.01Š| ||
| 76 | S | 43.2 | Very low | 47.4 | Very low | 83 Ų | 83 | 114.4 Ų | 114.4 | 58% | 0.58 | 60% | 0.598 | S | S | * | * | trans | -54 | 107.2 | 179.2 | 44.3 | 0 | 0 | 0 | 0 | 109.6 | L74 T78 | L74-S76 PolarHBondContact O-N 3.46Å; L74-S76 VanDerWaalsContact O-N 3.08Å; S76-T78 PolarHBondContact O-N 2.87Å | ||
| 77 | L | 38.5 | Very low | 46.3 | Very low | 164 Ų | 164 | 119.3 Ų | 119.3 | 86% | 0.859 | 63% | 0.633 | S | S | * | * | trans | -69.6 | 78.2 | 161 | -63 | 179.8 | 0 | 0 | 0 | 106.8 | P75 L79 | P75-L77 PolarHBondContact O-N 3.01Å; L77-L79 PolarHBondContact O-N 3.24Å; L77-L79 VanDerWaalsContact O-N 3.07Å | ||
| 78 | T | 43.9 | Very low | 45.1 | Very low | 93 Ų | 93 | 122.1 Ų | 122.1 | 57% | 0.571 | 66% | 0.661 | S | S | * | * | trans | -66.8 | 105.4 | 166.5 | 52 | 0 | 0 | 0 | 0 | 106.6 | S76 N80 | S76-T78 PolarHBondContact O-N 2.87Å; T78-N80 PolarHBondContact O-N 3.25Å | ||
| 79 | L | 39.6 | Very low | 44.3 | Very low | 151 Ų | 151 | 123.9 Ų | 123.9 | 79% | 0.791 | 68% | 0.681 | S | S | * | * | trans | -64.7 | 72.1 | 159.7 | -92 | 113.5 | 0 | 0 | 0 | 108.4 | L77 | L77-L79 PolarHBondContact O-N 3.24Å; L77-L79 VanDerWaalsContact O-N 3.07Å | ||
| 80 | N | 40 | Very low | 43.5 | Very low | 127 Ų | 127 | 127.3 Ų | 127.3 | 68% | 0.679 | 71% | 0.709 | S | S | * | * | trans | -114 | 109.5 | 166 | -75.1 | -4.2 | 0 | 0 | 0 | 105.8 | T78 | T78-N80 PolarHBondContact O-N 3.25Š| ||
| 81 | N | 38.2 | Very low | 42.8 | Very low | 150 Ų | 150 | 128 Ų | 128 | 80% | 0.802 | 72% | 0.723 | S | S | * | * | trans | 136.9 | 56.8 | 157.6 | -71.2 | 23.8 | 0 | 0 | 0 | 112.6 | ||||
| 82 | F | 39 | Very low | 42.2 | Very low | 209 Ų | 209 | 129 Ų | 129 | 92% | 0.917 | 74% | 0.738 | S | S | * | * | trans | -103.7 | 110.1 | 143.9 | -80.1 | -79.3 | 0 | 0 | 0 | 107.2 | ||||
| 83 | G | 35.7 | Very low | 41.9 | Very low | 56 Ų | 56 | 128.8 Ų | 128.8 | 58% | 0.577 | 74% | 0.742 | S | S | * | * | trans | 149 | 76.7 | -172.5 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 84 | L | 40 | Very low | 41.7 | Very low | 144 Ų | 144 | 129.2 Ų | 129.2 | 75% | 0.754 | 75% | 0.752 | S | S | * | * | 51.4 | 130.1 | 101.7 | -75.4 | 162 | 0 | 0 | 0 | 112 | |||||
| 85 | H | 38.4 | Very low | 42.4 | Very low | 139 Ų | 139 | 132.5 Ų | 132.5 | 64% | 0.644 | 77% | 0.767 | S | S | * | * | trans | 114.3 | 108.3 | 146.6 | -56.1 | -66.2 | 0 | 0 | 0 | 118.4 | ||||
| 86 | H | 41.4 | Very low | 43.5 | Very low | 161 Ų | 161 | 131.4 Ų | 131.4 | 75% | 0.745 | 76% | 0.76 | S | S | * | * | trans | 87.7 | 89 | 144.4 | -36.1 | -50.5 | 0 | 0 | 0 | 120.9 | ||||
| 87 | S | 35.5 | Very low | 44.4 | Very low | 117 Ų | 117 | 133.2 Ų | 133.2 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | 21.6 | 114.5 | 128.7 | 50.8 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 88 | A | 39.5 | Very low | 44.9 | Very low | 106 Ų | 106 | 132.1 Ų | 132.1 | 88% | 0.876 | 76% | 0.763 | S | S | * | * | trans | -166.3 | 138.7 | 132.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 89 | S | 41.4 | Very low | 45.2 | Very low | 109 Ų | 109 | 133.6 Ų | 133.6 | 76% | 0.762 | 77% | 0.772 | S | S | * | * | trans | -70.8 | 144.2 | -167.6 | 49.2 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 90 | S | 43.4 | Very low | 45.7 | Very low | 122 Ų | 122 | 136.1 Ų | 136.1 | 85% | 0.853 | 77% | 0.773 | S | S | * | * | trans | -164.5 | 124.9 | 139.1 | -80.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 91 | P | 43.5 | Very low | 46.3 | Very low | 120 Ų | 120 | 134.8 Ų | 134.8 | 78% | 0.779 | 77% | 0.774 | S | S | * | * | trans | -107.9 | 130.8 | -173.3 | 36 | -25.5 | 0 | 0 | 0 | 112.6 | ||||
| 92 | L | 46.9 | Very low | 47.1 | Very low | 164 Ų | 164 | 133.8 Ų | 133.8 | 86% | 0.859 | 78% | 0.775 | S | S | * | * | trans | -147.3 | 111.5 | 157.4 | -76.5 | 179.7 | 0 | 0 | 0 | 111.4 | ||||
| 93 | N | 48.2 | Very low | 47.3 | Very low | 148 Ų | 148 | 127.3 Ų | 127.3 | 79% | 0.791 | 77% | 0.767 | S | S | * | * | trans | 59.2 | 112.9 | 155.3 | -59.7 | -21.9 | 0 | 0 | 0 | 121.2 | ||||
| 94 | P | 51.5 | Low | 47.8 | Very low | 129 Ų | 129 | 131.5 Ų | 131.5 | 84% | 0.838 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -89 | 124.7 | 160 | 26.5 | -13.8 | 0 | 0 | 0 | 111.3 | ||
| 95 | M | 56.6 | Low | 47.9 | Very low | 175 Ų | 175 | 129.8 Ų | 129.8 | 86% | 0.862 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 143.1 | 163.3 | -106.7 | -90 | 111.8 | 0 | 0 | 109.7 | ||
| 96 | P | 68.8 | Low | 48.5 | Very low | 93 Ų | 93 | 128.5 Ų | 128.5 | 60% | 0.604 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -77 | 150.7 | 177.2 | 32.8 | -32.2 | 0 | 0 | 0 | 111 | I98 | P96-I98 PolarHBondContact O-N 3.27Š|
| 97 | P | 62.3 | Low | 48.8 | Very low | 121 Ų | 121 | 128.6 Ų | 128.6 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 129.5 | 175.4 | 28.9 | -31.4 | 0 | 0 | 0 | 110.3 | T99 | P97-T99 PolarHBondContact O-N 3.29Š|
| 98 | I | 49.6 | Very low | 50 | Low | 141 Ų | 141 | 128.8 Ų | 128.8 | 72% | 0.723 | 79% | 0.786 | S | S | * | * | trans | -70.9 | 110.4 | 171.2 | -59.3 | 173.2 | 0 | 0 | 0 | 108.1 | P96 Y100 | P96-I98 PolarHBondContact O-N 3.27Å; I98-Y100 HydrophobicContact CG2-CD2 3.64Å; I98-Y100 HydrophobicContact CG2-CE2 3.49Å; I98-Y100 VanDerWaalsContact CG2-CE2 3.49Å; I98-Y100 PolarHBondContact O-N 3.39Å | ||
| 99 | T | 49.8 | Very low | 50.1 | Low | 123 Ų | 123 | 134 Ų | 134 | 76% | 0.755 | 78% | 0.784 | S | S | * | * | trans | -70.7 | 111.2 | 166.9 | -57.6 | 0 | 0 | 0 | 0 | 109.3 | P97 | P97-T99 PolarHBondContact O-N 3.29Š| ||
| 100 | Y | 49.3 | Very low | 50.3 | Low | 204 Ų | 204 | 136.6 Ų | 136.6 | 80% | 0.8 | 79% | 0.789 | S | S | * | * | trans | -95.3 | 111.6 | 163.2 | -89.8 | -89.2 | 0 | 0 | 0 | 109.2 | I98 | I98-Y100 HydrophobicContact CG2-CD2 3.64Å; I98-Y100 HydrophobicContact CG2-CE2 3.49Å; I98-Y100 VanDerWaalsContact CG2-CE2 3.49Å; I98-Y100 PolarHBondContact O-N 3.39Å | ||
| 101 | S | 53.6 | Low | 50.2 | Low | 100 Ų | 100 | 137.8 Ų | 137.8 | 70% | 0.699 | 78% | 0.781 | S | S | * | * | trans | -65.6 | 137.9 | 166.5 | -64.4 | 0 | 0 | 0 | 0 | 110.2 | G103 | S101-G103 PolarHBondContact O-N 3.44Š| ||
| 102 | P | 55.1 | Low | 50.1 | Low | 129 Ų | 129 | 139.4 Ų | 139.4 | 84% | 0.838 | 78% | 0.778 | S | S | * | * | trans | -74.1 | 100.4 | 177.6 | 28.9 | -29.9 | 0 | 0 | 0 | 109.6 | V104 | P102-V104 PolarHBondContact O-N 3.42Š| ||
| 103 | G | 42.9 | Very low | 49.5 | Very low | 72 Ų | 72 | 136.1 Ų | 136.1 | 74% | 0.742 | 77% | 0.765 | S | S | * | * | trans | -68 | 115.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | S101 C105 | S101-G103 PolarHBondContact O-N 3.44Å; G103-C105 PolarHBondContact O-N 3.27Å | ||
| 104 | V | 45.8 | Very low | 49.3 | Very low | 145 Ų | 145 | 136.8 Ų | 136.8 | 88% | 0.879 | 76% | 0.761 | S | S | * | * | trans | -53.3 | 111.3 | 169.2 | -76.4 | 0 | 0 | 0 | 0 | 110.8 | P102 | P102-V104 PolarHBondContact O-N 3.42Š| ||
| 105 | C | 43.6 | Very low | 48.9 | Very low | 107 Ų | 107 | 135.3 Ų | 135.3 | 72% | 0.723 | 75% | 0.754 | S | S | * | * | trans | -104.5 | 112.6 | 166.3 | -155.6 | 0 | 0 | 0 | 0 | 108.2 | G103 H107 | G103-C105 PolarHBondContact O-N 3.27Å; C105-H107 PolarHBondContact O-N 3.41Å | ||
| 106 | S | 49.3 | Very low | 47.9 | Very low | 113 Ų | 113 | 135.2 Ų | 135.2 | 79% | 0.79 | 76% | 0.757 | S | S | * | * | trans | -66.2 | 109.6 | 174.7 | -53.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 107 | H | 48.2 | Very low | 46.6 | Very low | 162 Ų | 162 | 135.5 Ų | 135.5 | 75% | 0.75 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 124.1 | 164.6 | -80.8 | -67.8 | 0 | 0 | 0 | 109.4 | C105 Y109 | C105-H107 PolarHBondContact O-N 3.41Å; H107-Y109 PolarHBondContact O-N 3.25Å |
| 108 | P | 61.5 | Low | 45.7 | Very low | 122 Ų | 122 | 137.3 Ų | 137.3 | 79% | 0.792 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 116.4 | 166 | 27.7 | -28.5 | 0 | 0 | 0 | 109.4 | L110 | P108-L110 PolarHBondContact O-N 3.08Š|
| 109 | Y | 40.8 | Very low | 45.2 | Very low | 215 Ų | 215 | 136.3 Ų | 136.3 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 121.1 | 163.5 | -95.7 | -104.7 | 0 | 0 | 0 | 109.7 | H107 | H107-Y109 PolarHBondContact O-N 3.25Š|
| 110 | L | 46.2 | Very low | 45.2 | Very low | 164 Ų | 164 | 136.5 Ų | 136.5 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | trans | -123.6 | 95.7 | 151.6 | -97.5 | 172.6 | 0 | 0 | 0 | 108.5 | P108 | P108-L110 PolarHBondContact O-N 3.08Š| ||
| 111 | H | 40.6 | Very low | 44.5 | Very low | 147 Ų | 147 | 132.7 Ų | 132.7 | 68% | 0.681 | 78% | 0.776 | S | S | * | * | trans | -73.3 | 113.5 | 165.7 | -168.3 | -102.8 | 0 | 0 | 0 | 107.4 | ||||
| 112 | Q | 40.9 | Very low | 44.1 | Very low | 153 Ų | 153 | 132.2 Ų | 132.2 | 72% | 0.715 | 78% | 0.778 | S | S | * | * | trans | -136 | 89.3 | 168.2 | -150.3 | 161.8 | 62 | 0 | 0 | 110.4 | F114 | Q112-F114 HydrophobicContact CG-CD2 3.63Å; Q112-F114 HydrophobicContact CG-CE2 3.35Å; Q112-F114 HydrophobicContact CG-CZ 4.43Å | ||
| 113 | T | 35.5 | Very low | 43.3 | Very low | 96 Ų | 96 | 130.6 Ų | 130.6 | 59% | 0.589 | 77% | 0.769 | S | S | * | * | trans | -61.7 | 120.5 | 158.8 | 45.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 114 | F | 44.3 | Very low | 43.8 | Very low | 162 Ų | 162 | 134.6 Ų | 134.6 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | trans | -146.2 | 99.5 | 153.4 | -74.6 | -62.4 | 0 | 0 | 0 | 110.5 | Q112 | Q112-F114 HydrophobicContact CG-CD2 3.63Å; Q112-F114 HydrophobicContact CG-CE2 3.35Å; Q112-F114 HydrophobicContact CG-CZ 4.43Å | ||
| 115 | S | 43 | Very low | 43.6 | Very low | 98 Ų | 98 | 134.7 Ų | 134.7 | 69% | 0.685 | 77% | 0.769 | S | S | * | * | 20.9 | 123.6 | 129.7 | 40.8 | 0 | 0 | 0 | 0 | 119 | |||||
| 116 | N | 34.3 | Very low | 44.1 | Very low | 173 Ų | 173 | 135.7 Ų | 135.7 | 93% | 0.925 | 77% | 0.772 | S | S | * | * | trans | -52.4 | 126.3 | 158.2 | -58.6 | -46.1 | 0 | 0 | 0 | 111.1 | ||||
| 117 | S | 43.1 | Very low | 43.7 | Very low | 98 Ų | 98 | 137.6 Ų | 137.6 | 69% | 0.685 | 77% | 0.768 | S | S | * | * | trans | -162.3 | 121.3 | 156.3 | 54.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 118 | D | 42.7 | Very low | 43.5 | Very low | 160 Ų | 160 | 137 Ų | 137 | 86% | 0.856 | 77% | 0.771 | S | S | * | * | trans | 67.9 | 123.3 | 145.3 | -60.7 | -31.6 | 0 | 0 | 0 | 122.3 | ||||
| 119 | S | 39.5 | Very low | 42.5 | Very low | 120 Ų | 120 | 137.5 Ų | 137.5 | 84% | 0.839 | 76% | 0.762 | S | S | * | * | trans | -75.2 | 148.2 | 164.6 | -54 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 120 | P | 48.4 | Very low | 43.1 | Very low | 127 Ų | 127 | 135.8 Ų | 135.8 | 83% | 0.825 | 76% | 0.764 | S | S | * | * | trans | -114.4 | 129.8 | 149.4 | 30.1 | -17.6 | 0 | 0 | 0 | 111.4 | ||||
| 121 | S | 34.7 | Very low | 42.9 | Very low | 123 Ų | 123 | 135.5 Ų | 135.5 | 86% | 0.86 | 76% | 0.762 | S | S | * | * | trans | -71.2 | 130.4 | 166.9 | -172.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 122 | A | 46.6 | Very low | 43.4 | Very low | 90 Ų | 90 | 134.1 Ų | 134.1 | 74% | 0.744 | 77% | 0.767 | S | S | * | * | trans | -160.1 | 97.3 | 159.4 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 123 | S | 38.2 | Very low | 43.8 | Very low | 95 Ų | 95 | 132.6 Ų | 132.6 | 66% | 0.664 | 77% | 0.771 | S | S | * | * | 47 | 98.2 | 80.4 | -166.6 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 124 | N | 52.4 | Low | 43.9 | Very low | 156 Ų | 156 | 134.7 Ų | 134.7 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | trans | -160.5 | 103.6 | 144.2 | -85.8 | -34.7 | 0 | 0 | 0 | 108.2 | ||||
| 125 | D | 41.4 | Very low | 44.2 | Very low | 147 Ų | 147 | 134.9 Ų | 134.9 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | trans | -55.9 | 126.4 | 160.8 | -72.7 | -69.4 | 0 | 0 | 0 | 110 | ||||
| 126 | V | 54.5 | Low | 44.4 | Very low | 129 Ų | 129 | 138.8 Ų | 138.8 | 78% | 0.782 | 79% | 0.79 | S | S | * | * | trans | -134.6 | 104.1 | 155.4 | -177.4 | 0 | 0 | 0 | 0 | 106.4 | D128 | V126-D128 PolarHBondContact O-N 3.46Š| ||
| 127 | Q | 40.4 | Very low | 45 | Very low | 152 Ų | 152 | 142.2 Ų | 142.2 | 71% | 0.71 | 79% | 0.79 | S | S | * | * | trans | -54.4 | 126 | 162.2 | -85.4 | 118.5 | -17.6 | 0 | 0 | 109.1 | ||||
| 128 | D | 45.1 | Very low | 45.4 | Very low | 149 Ų | 149 | 149.5 Ų | 149.5 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | trans | -144 | 132.8 | 150.2 | -130.8 | -14 | 0 | 0 | 0 | 110.8 | V126 | V126-D128 PolarHBondContact O-N 3.46Š| ||
| 129 | H | 40.9 | Very low | 45.3 | Very low | 134 Ų | 134 | 148.1 Ų | 148.1 | 62% | 0.62 | 80% | 0.795 | S | S | * | * | trans | -99.5 | 117 | -161 | -34.3 | -81 | 0 | 0 | 0 | 107.3 | ||||
| 130 | M | 52.4 | Low | 45.5 | Very low | 179 Ų | 179 | 153.4 Ų | 153.4 | 88% | 0.882 | 80% | 0.796 | S | S | * | * | trans | -140.6 | 121.1 | 161.9 | -88.2 | -64.8 | 101.1 | 0 | 0 | 111.2 | ||||
| 131 | I | 42.9 | Very low | 45.1 | Very low | 158 Ų | 158 | 150.8 Ų | 150.8 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | trans | -73 | 128.8 | -177.4 | -66.9 | 157.2 | 0 | 0 | 0 | 108.5 | ||||
| 132 | C | 50.7 | Low | 45.5 | Very low | 118 Ų | 118 | 157.1 Ų | 157.1 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | trans | -137.5 | 138.1 | 161.2 | -82.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 133 | P | 48.1 | Very low | 45.3 | Very low | 121 Ų | 121 | 158.7 Ų | 158.7 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | trans | -80.3 | 150.6 | -159.1 | 32.1 | -34.4 | 0 | 0 | 0 | 113.8 | ||||
| 134 | D | 38.8 | Very low | 45.6 | Very low | 139 Ų | 139 | 158.9 Ų | 158.9 | 74% | 0.743 | 80% | 0.804 | S | S | * | * | trans | -47.1 | 123.3 | 179.6 | -80.1 | -55.5 | 0 | 0 | 0 | 115.5 | ||||
| 135 | I | 50.8 | Low | 45 | Very low | 166 Ų | 166 | 162.8 Ų | 162.8 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | trans | -123.6 | 100.4 | 143.8 | -59 | 179.5 | 0 | 0 | 0 | 108.1 | R137 | I135-R137 PolarHBondContact O-N 2.92Š| ||
| 136 | K | 46.8 | Very low | 45.5 | Very low | 180 Ų | 180 | 162.7 Ų | 162.7 | 78% | 0.783 | 81% | 0.806 | S | S | * | * | trans | -58.7 | 110.5 | -178 | -64.6 | 169.8 | 179.4 | 174.4 | 0 | 111.7 | ||||
| 137 | R | 47.1 | Very low | 44.6 | Very low | 246 Ų | 246 | 163.9 Ų | 163.9 | 93% | 0.928 | 81% | 0.808 | S | S | * | * | trans | -122.6 | 129.7 | 150.3 | -83.1 | -172.6 | 161.9 | 165.7 | -4.3 | 110.2 | I135 N139 | I135-R137 PolarHBondContact O-N 2.92Å; R137-N139 PolarHBondContact O-N 2.95Å | ||
| 138 | R | 50.4 | Low | 44.8 | Very low | 251 Ų | 251 | 165.7 Ų | 165.7 | 95% | 0.947 | 81% | 0.814 | S | S | * | * | trans | -62.6 | 118.6 | -160.3 | -74.4 | 160.7 | 74.3 | 136.9 | -5.1 | 114.3 | ||||
| 139 | N | 42.1 | Very low | 44.3 | Very low | 130 Ų | 130 | 165 Ų | 165 | 70% | 0.695 | 82% | 0.815 | S | S | * | * | trans | 5.3 | 129.1 | 132.3 | -97.3 | -18.2 | 0 | 0 | 0 | 121.3 | R137 | R137-N139 PolarHBondContact O-N 2.95Š| ||
| 140 | R | 43 | Very low | 44.6 | Very low | 231 Ų | 231 | 163.8 Ų | 163.8 | 87% | 0.872 | 82% | 0.822 | S | S | * | * | 114 | 125.5 | 121.4 | -78.4 | 166.3 | -172.1 | 166.3 | 0.5 | 118.7 | |||||
| 141 | G | 40 | Very low | 44.1 | Very low | 73 Ų | 73 | 160.4 Ų | 160.4 | 75% | 0.753 | 82% | 0.816 | S | S | * | * | trans | 143.7 | 65.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 142 | R | 42.3 | Very low | 44.2 | Very low | 256 Ų | 256 | 158.3 Ų | 158.3 | 97% | 0.966 | 82% | 0.815 | S | S | * | * | 49.8 | 83.3 | 101.1 | -156.7 | 179.9 | -166 | -167.4 | 3.5 | 113.3 | |||||
| 143 | S | 42.5 | Very low | 43.9 | Very low | 123 Ų | 123 | 158.6 Ų | 158.6 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | trans | -88.8 | 111.2 | 171.1 | -144.9 | 0 | 0 | 0 | 0 | 110 | ||||
| 144 | S | 46 | Very low | 43.4 | Very low | 98 Ų | 98 | 156.4 Ų | 156.4 | 69% | 0.685 | 82% | 0.815 | S | S | * | * | trans | -68.7 | 130.3 | 167.6 | 47.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 145 | R | 38 | Very low | 44.1 | Very low | 239 Ų | 239 | 156.5 Ų | 156.5 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | trans | -68.3 | 124.3 | 168.9 | -63 | 173.8 | -178.7 | 166.1 | -1.3 | 108.4 | ||||
| 146 | L | 52.9 | Low | 44.1 | Very low | 145 Ų | 145 | 156 Ų | 156 | 76% | 0.759 | 81% | 0.813 | S | S | * | * | trans | -133.1 | 113.4 | 161.5 | -72.9 | 176.2 | 0 | 0 | 0 | 108.5 | ||||
| 147 | N | 36.4 | Very low | 44.4 | Very low | 153 Ų | 153 | 154 Ų | 154 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | trans | -67.6 | 132.2 | 163.9 | -71 | -20.2 | 0 | 0 | 0 | 108.2 | ||||
| 148 | F | 42.7 | Very low | 45.2 | Very low | 190 Ų | 190 | 151.1 Ų | 151.1 | 83% | 0.833 | 81% | 0.805 | S | S | * | * | trans | -130.4 | 113.5 | 157 | -102.2 | -85 | 0 | 0 | 0 | 109.2 | ||||
| 149 | T | 35.5 | Very low | 45.9 | Very low | 134 Ų | 134 | 144.3 Ų | 144.3 | 82% | 0.822 | 79% | 0.794 | S | S | * | * | trans | -80 | 125.9 | 165 | 48.8 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 150 | S | 46.9 | Very low | 46.5 | Very low | 109 Ų | 109 | 143.9 Ų | 143.9 | 76% | 0.762 | 80% | 0.795 | S | S | * | * | trans | -152.7 | 109.2 | 157.9 | 58.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 151 | S | 42.4 | Very low | 47 | Very low | 109 Ų | 109 | 138 Ų | 138 | 76% | 0.762 | 79% | 0.79 | S | S | * | * | trans | -26.8 | 127.8 | 162.1 | 40.8 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 152 | S | 44.3 | Very low | 47.5 | Very low | 114 Ų | 114 | 141.8 Ų | 141.8 | 80% | 0.797 | 79% | 0.792 | S | S | * | * | trans | 60.8 | 157.3 | 133.1 | -63.8 | 0 | 0 | 0 | 0 | 122 | ||||
| 153 | P | 45.8 | Very low | 47.9 | Very low | 123 Ų | 123 | 134 Ų | 134 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | cis | -137 | 157.6 | -21.9 | 33.2 | -13.3 | 0 | 0 | 0 | 115.6 | ||||
| 154 | G | 36.2 | Very low | 48.6 | Very low | 75 Ų | 75 | 134.7 Ų | 134.7 | 77% | 0.773 | 78% | 0.776 | S | S | * | * | trans | 71.8 | 82.6 | 138.3 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 155 | I | 54.3 | Low | 48.8 | Very low | 141 Ų | 141 | 138.3 Ų | 138.3 | 72% | 0.723 | 78% | 0.779 | S | S | * | * | trans | -137.6 | 112 | 149.9 | -56.3 | 178.1 | 0 | 0 | 0 | 107.6 | D157 | I155-D157 WeakPolarHBondContact CG2-OD2 3.44Å; I155-D157 PolarHBondContact O-N 3.1Å | ||
| 156 | D | 49.9 | Very low | 49.1 | Very low | 157 Ų | 157 | 133.8 Ų | 133.8 | 84% | 0.84 | 77% | 0.773 | S | S | * | * | trans | -73.5 | 70 | 176.5 | -71.6 | -59.6 | 0 | 0 | 0 | 111.3 | K158 | D156-K158 VanDerWaalsContact C-N 3.34Å; D156-K158 PolarHBondContact O-N 2.99Å; D156-K158 VanDerWaalsContact O-N 3.08Å | ||
| 157 | D | 53.3 | Low | 49.2 | Very low | 138 Ų | 138 | 131.6 Ų | 131.6 | 74% | 0.738 | 77% | 0.77 | S | S | * | * | trans | -83.9 | 80.8 | 171.1 | -73 | -37.6 | 0 | 0 | 0 | 110 | I155 | I155-D157 WeakPolarHBondContact CG2-OD2 3.44Å; I155-D157 PolarHBondContact O-N 3.1Å | ||
| 158 | K | 65.3 | Low | 49.5 | Very low | 185 Ų | 185 | 133.4 Ų | 133.4 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | -61 | 123.2 | 166 | -100.5 | 152.1 | 178.4 | 159.1 | 0 | 108.8 | D156 V160 | D156-K158 VanDerWaalsContact C-N 3.34Å; D156-K158 PolarHBondContact O-N 2.99Å; D156-K158 VanDerWaalsContact O-N 3.08Å; K158-V160 PolarHBondContact O-N 3.17Å; K158-V160 VanDerWaalsContact O-N 3.14Å | ||
| 159 | P | 64.1 | Low | 50 | Low | 108 Ų | 108 | 131.3 Ų | 131.3 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | trans | -63.4 | 122.2 | 173.7 | 26.4 | -32.4 | 0 | 0 | 0 | 108.3 | S161 | P159-S161 VanDerWaalsContact C-N 3.33Å; P159-S161 PolarHBondContact O-N 3.07Å | ||
| 160 | V | 55.9 | Low | 50.3 | Low | 120 Ų | 120 | 130.6 Ų | 130.6 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | trans | -55 | 100.6 | 167 | 140.3 | 0 | 0 | 0 | 0 | 107.4 | K158 L162 | K158-V160 PolarHBondContact O-N 3.17Å; K158-V160 VanDerWaalsContact O-N 3.14Å; V160-L162 VanDerWaalsContact C-N 3.34Å; V160-L162 HydrophobicContact CG1-CD1 4.4Å; V160-L162 HydrophobicContact CG1-CD2 3.7Å; V160-L162 HydrophobicContact CG1-CG 3.65Å; V160-L162 PolarHBondContact O-N 3.43Å | ||
| 161 | S | 51.5 | Low | 50.4 | Low | 108 Ų | 108 | 130.8 Ų | 130.8 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | trans | -73.5 | 92.1 | 171.6 | -79.2 | 0 | 0 | 0 | 0 | 107.5 | P159 S163 | P159-S161 VanDerWaalsContact C-N 3.33Å; P159-S161 PolarHBondContact O-N 3.07Å; S161-S163 PolarHBondContact O-N 3.11Å | ||
| 162 | L | 50.8 | Low | 50.6 | Low | 152 Ų | 152 | 130.3 Ų | 130.3 | 80% | 0.796 | 77% | 0.768 | S | S | * | * | trans | -71.2 | 73.2 | 165.7 | -64.1 | 175.3 | 0 | 0 | 0 | 108.7 | V160 T164 | V160-L162 VanDerWaalsContact C-N 3.34Å; V160-L162 HydrophobicContact CG1-CD1 4.4Å; V160-L162 HydrophobicContact CG1-CD2 3.7Å; V160-L162 HydrophobicContact CG1-CG 3.65Å; V160-L162 PolarHBondContact O-N 3.43Å; L162-T164 PolarHBondContact O-N 3.05Å | ||
| 163 | S | 50.6 | Low | 50.4 | Low | 94 Ų | 94 | 132.2 Ų | 132.2 | 66% | 0.657 | 77% | 0.769 | S | S | * | * | trans | -77.5 | 94.2 | 164.9 | -177.4 | 0 | 0 | 0 | 0 | 107.2 | S161 K165 | S161-S163 PolarHBondContact O-N 3.11Å; S163-K165 PolarHBondContact O-N 3.23Å | ||
| 164 | T | 58.2 | Low | 50.3 | Low | 136 Ų | 136 | 131.9 Ų | 131.9 | 83% | 0.834 | 77% | 0.768 | S | S | * | * | trans | -69.1 | 80.4 | 157.9 | 35.8 | 0 | 0 | 0 | 0 | 107.7 | L162 D166 | L162-T164 PolarHBondContact O-N 3.05Å; T164-D166 VanDerWaalsContact C-N 3.32Å; T164-D166 PolarHBondContact O-N 2.97Å | ||
| 165 | K | 50.1 | Low | 50.8 | Low | 175 Ų | 175 | 136.6 Ų | 136.6 | 76% | 0.761 | 78% | 0.776 | S | S | * | * | trans | -84.6 | 80.5 | 166.6 | -173.4 | -179.3 | -173.8 | -178.1 | 0 | 105.9 | S163 | S163-K165 PolarHBondContact O-N 3.23Š| ||
| 166 | D | 43.9 | Very low | 50.7 | Low | 143 Ų | 143 | 134.9 Ų | 134.9 | 77% | 0.765 | 78% | 0.777 | S | S | * | * | trans | -175.6 | 106.1 | 161 | -89.5 | -30.3 | 0 | 0 | 0 | 110.2 | T164 | T164-D166 VanDerWaalsContact C-N 3.32Å; T164-D166 PolarHBondContact O-N 2.97Å | ||
| 167 | S | 54.8 | Low | 50.4 | Low | 100 Ų | 100 | 134.7 Ų | 134.7 | 70% | 0.699 | 78% | 0.775 | S | S | * | * | trans | -178.6 | 67.5 | 150.9 | -75.7 | 0 | 0 | 0 | 0 | 106.8 | I169 | S167-I169 PolarHBondContact O-N 3.24Š| ||
| 168 | Q | 44 | Very low | 49.7 | Very low | 191 Ų | 191 | 134.4 Ų | 134.4 | 89% | 0.893 | 78% | 0.783 | S | S | * | * | trans | -72.9 | 82.7 | 161.5 | -56.1 | -174.6 | 17.4 | 0 | 0 | 106.4 | ||||
| 169 | I | 53.3 | Low | 49.2 | Very low | 146 Ų | 146 | 130.1 Ų | 130.1 | 75% | 0.749 | 78% | 0.776 | S | S | * | * | trans | -103.7 | 108.8 | 167.5 | 10.2 | 170.4 | 0 | 0 | 0 | 106.6 | S167 S171 | S167-I169 PolarHBondContact O-N 3.24Å; I169-S171 PolarHBondContact O-N 2.78Å | ||
| 170 | S | 40.6 | Very low | 48.6 | Very low | 118 Ų | 118 | 130.1 Ų | 130.1 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | trans | -46.8 | 113.9 | 176.5 | -53.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 171 | S | 49.7 | Very low | 48.2 | Very low | 113 Ų | 113 | 131.4 Ų | 131.4 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | -120.7 | 79.2 | 147.8 | 54.5 | 0 | 0 | 0 | 0 | 107.8 | I169 D173 | I169-S171 PolarHBondContact O-N 2.78Å; S171-D173 PolarHBondContact O-N 3.04Å | ||
| 172 | S | 45.7 | Very low | 48.2 | Very low | 99 Ų | 99 | 132.2 Ų | 132.2 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | trans | -57.9 | 113.5 | 158.5 | 48 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 173 | D | 40.7 | Very low | 48 | Very low | 154 Ų | 154 | 137.3 Ų | 137.3 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | 165.4 | 76.4 | 145.9 | -78.2 | -20.8 | 0 | 0 | 0 | 109.4 | S171 | S171-D173 PolarHBondContact O-N 3.04Š| ||
| 174 | C | 44.7 | Very low | 48.1 | Very low | 117 Ų | 117 | 137.6 Ų | 137.6 | 79% | 0.791 | 79% | 0.793 | S | S | * | * | trans | -143.8 | 68.3 | 160.4 | 59.8 | 0 | 0 | 0 | 0 | 110.5 | S176 | C174-S176 VanDerWaalsContact C-N 3.33Å; C174-S176 PolarHBondContact O-N 2.94Å | ||
| 175 | N | 45.5 | Very low | 47.8 | Very low | 173 Ų | 173 | 137.1 Ų | 137.1 | 93% | 0.925 | 80% | 0.796 | S | S | * | * | trans | -68.8 | 95.3 | 157.7 | -69.7 | -38.1 | 0 | 0 | 0 | 107.7 | ||||
| 176 | S | 52.4 | Low | 48.1 | Very low | 106 Ų | 106 | 137 Ų | 137 | 74% | 0.741 | 80% | 0.798 | S | S | * | * | trans | -143.9 | 99.9 | 163.5 | -178.7 | 0 | 0 | 0 | 0 | 107.3 | C174 C178 | C174-S176 VanDerWaalsContact C-N 3.33Å; C174-S176 PolarHBondContact O-N 2.94Å; S176-C178 PolarHBondContact O-N 3.11Å | ||
| 177 | D | 44.3 | Very low | 48.4 | Very low | 152 Ų | 152 | 140.4 Ų | 140.4 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | trans | -22.1 | 109.9 | 174.2 | -64.9 | -48 | 0 | 0 | 0 | 114.3 | S179 | D177-S179 PolarHBondContact O-N 3.13Š| ||
| 178 | C | 39.1 | Very low | 48.4 | Very low | 133 Ų | 133 | 142.4 Ų | 142.4 | 90% | 0.899 | 81% | 0.806 | S | S | * | * | trans | -89.3 | 79.8 | 166.7 | -178.7 | 0 | 0 | 0 | 0 | 108.1 | S176 T180 | S176-C178 PolarHBondContact O-N 3.11Å; C178-T180 PolarHBondContact O-N 2.63Å | ||
| 179 | S | 53.4 | Low | 49.2 | Very low | 95 Ų | 95 | 141.3 Ų | 141.3 | 66% | 0.664 | 80% | 0.798 | S | S | * | * | trans | -84.5 | 103.6 | 169.6 | -13.1 | 0 | 0 | 0 | 0 | 108.8 | D177 | D177-S179 PolarHBondContact O-N 3.13Š| ||
| 180 | T | 52.4 | Low | 49.5 | Very low | 107 Ų | 107 | 140.8 Ų | 140.8 | 66% | 0.656 | 80% | 0.804 | S | S | * | * | trans | 47 | 101.1 | 135.2 | 54.7 | 0 | 0 | 0 | 0 | 117.9 | C178 T182 | C178-T180 PolarHBondContact O-N 2.63Å; T180-T182 PolarHBondContact O-N 3.43Å | ||
| 181 | V | 47.5 | Very low | 50.4 | Low | 148 Ų | 148 | 139.8 Ų | 139.8 | 90% | 0.897 | 80% | 0.797 | S | S | * | * | trans | -16.2 | 109.4 | 136.9 | -86.3 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 182 | T | 51.9 | Low | 51 | Low | 124 Ų | 124 | 139.3 Ų | 139.3 | 76% | 0.761 | 79% | 0.786 | S | S | * | * | trans | -136.8 | 114.4 | 149.6 | 52.8 | 0 | 0 | 0 | 0 | 109.8 | T180 S184 | T180-T182 PolarHBondContact O-N 3.43Å; T182-S184 PolarHBondContact O-N 2.79Å | ||
| 183 | R | 45.1 | Very low | 52.4 | Low | 259 Ų | 259 | 140.9 Ų | 140.9 | 98% | 0.977 | 78% | 0.78 | S | S | * | * | trans | -52.4 | 118.2 | 166.3 | -74.9 | 161.2 | 135.4 | -179.2 | -5.7 | 110.1 | ||||
| 184 | S | 54 | Low | 54.5 | Low | 100 Ų | 100 | 138.5 Ų | 138.5 | 70% | 0.699 | 77% | 0.768 | S | S | * | * | trans | -146.9 | 103.9 | 151.3 | 50.2 | 0 | 0 | 0 | 0 | 109.3 | T182 E186 | T182-S184 PolarHBondContact O-N 2.79Å; S184-E186 PolarHBondContact O-N 2.8Å; S184-E186 VanDerWaalsContact O-N 3.1Å | ||
| 185 | S | 50.8 | Low | 56.7 | Low | 127 Ų | 127 | 138.9 Ų | 138.9 | 89% | 0.888 | 76% | 0.762 | S | S | * | * | trans | -72.4 | 86.8 | 172.8 | 52.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 186 | E | 56.6 | Low | 58.8 | Low | 173 Ų | 173 | 140.9 Ų | 140.9 | 81% | 0.808 | 76% | 0.756 | S | S | * | * | trans | -113.9 | 131.7 | 163.6 | -82.9 | -177.5 | 165.3 | 0 | 0 | 109.8 | S184 M188 | S184-E186 PolarHBondContact O-N 2.8Å; S184-E186 VanDerWaalsContact O-N 3.1Å; E186-M188 PolarHBondContact O-N 3.36Å | ||
| 187 | K | 50 | Low | 60.8 | Low | 213 Ų | 213 | 141.4 Ų | 141.4 | 93% | 0.926 | 74% | 0.743 | S | S | * | * | trans | -64.8 | 87.2 | -169.9 | -59.2 | 169.7 | -177.1 | 176.6 | 0 | 109.5 | K189 | K187-K189 PolarHBondContact O-N 3.31Š| ||
| 188 | M | 55.8 | Low | 63 | Low | 143 Ų | 143 | 137.6 Ų | 137.6 | 70% | 0.704 | 72% | 0.721 | S | S | * | * | trans | -65.6 | 120.2 | 171.6 | -80.3 | -179.1 | 88.8 | 0 | 0 | 109.2 | E186 | E186-M188 PolarHBondContact O-N 3.36Š| ||
| 189 | K | 60.6 | Low | 65.7 | Low | 167 Ų | 167 | 136.7 Ų | 136.7 | 73% | 0.726 | 70% | 0.704 | S | S | * | * | trans | -51.3 | 148 | 173.1 | -69.7 | 173.4 | 178.4 | 176.7 | 0 | 110.4 | K187 S191 | K187-K189 PolarHBondContact O-N 3.31Å; K189-S191 PolarHBondContact O-N 3.44Å | ||
| 190 | P | 59.1 | Low | 67.7 | Low | 136 Ų | 136 | 141.4 Ų | 141.4 | 88% | 0.883 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.5 | 5.8 | -171.6 | 25.7 | -33.7 | 0 | 0 | 0 | 116.2 | ||
| 191 | S | 59.8 | Low | 69.8 | Low | 97 Ų | 97 | 142 Ų | 142 | 68% | 0.678 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.5 | -33.3 | -171.4 | 169.7 | 0 | 0 | 0 | 0 | 114.6 | K189 K193 | K189-S191 PolarHBondContact O-N 3.44Å; S191-K193 PolarHBondContact O-N 2.7Å |
| 192 | D | 61.5 | Low | 72.2 | Confident | 102 Ų | 102 | 140.1 Ų | 140.1 | 55% | 0.545 | 68% | 0.682 | S | S | . | * | trans | -109 | 60.5 | -162 | -55.5 | -22.4 | 0 | 0 | 0 | 111 | D194 | D192-D194 PolarHBondContact O-N 3.46Š| ||
| 193 | K | 74.9 | Confident | 74.3 | Confident | 132 Ų | 132 | 141.5 Ų | 141.5 | 57% | 0.574 | 68% | 0.677 | S | S | * | * | trans | -73.2 | 113.1 | 165.2 | -75.2 | 171.6 | -179.5 | 164.8 | 0 | 107.5 | S191 Y197 I198 | S191-K193 PolarHBondContact O-N 2.7Å; K193-Y197 HydrophobicContact CB-CD1 4.05Å; K193-Y197 HydrophobicContact CD-CD1 4.06Å; K193-Y197 HydrophobicContact CD-CE1 3.84Å; K193-Y197 HydrophobicContact CG-CD1 4.07Å; K193-Y197 HydrophobicContact CG-CE1 4.23Å; K193-I198 HydrophobicContact CB-CD1 4.26Å; K193-I198 HydrophobicContact CB-CG1 4.06Å; K193-I198 WeakPolarHBondContact O-CD1 3.42Å | ||
| 194 | D | 84.9 | Confident | 76.8 | Confident | 105 Ų | 105 | 133.2 Ų | 133.2 | 56% | 0.561 | 65% | 0.653 | S | S | * | * | trans | -48.8 | 140.4 | 174.2 | -62.4 | -26.7 | 0 | 0 | 0 | 111.7 | D192 R196 Y197 I198 | D192-D194 PolarHBondContact O-N 3.46Å; D194-R196 PolarHBondContact O-N 3.21Å; D194-Y197 WeakPolarHBondContact O-CA 3.08Å; D194-Y197 WeakPolarHBondContact O-CB 3.26Å; D194-Y197 PolarHBondContact O-N 3.44Å; D194-I198 PolarHBondContact O-N 3.46Å; D194-I198 VanDerWaalsContact O-N 3.14Å | ||
| 195 | D | 90.5 | Very high | 78.9 | Confident | 124 Ų | 124 | 132.2 Ų | 132.2 | 66% | 0.663 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -51 | -35.3 | 175.9 | -72.8 | -29.7 | 0 | 0 | 0 | 112.4 | Y197 I198 Q199 | D195-Y197 VanDerWaalsContact C-N 3.34Å; D195-Y197 PolarHBondContact O-N 3.43Å; D195-I198 PolarHBondContact O-N 3.15Å; D195-Q199 VanDerWaalsContact O-CG 3.3Å; D195-Q199 WeakPolarHBondContact O-CG 3.37Å; D195-Q199 PolarHBondContact O-N 3.47Å |
| 196 | R | 89.5 | Confident | 81.2 | Confident | 215 Ų | 215 | 132 Ų | 132 | 81% | 0.811 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -60.4 | -41.2 | 175.6 | -65.8 | -174 | -176.8 | -146.7 | 1.5 | 112.3 | D194 R200 | D194-R196 PolarHBondContact O-N 3.21Å; R196-R200 WeakPolarHBondContact O-CB 3.3Å; R196-R200 PolarHBondContact O-N 2.93Å |
| 197 | Y | 95.2 | Very high | 83.1 | Confident | 118 Ų | 118 | 126.5 Ų | 126.5 | 46% | 0.463 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -67.6 | -45.6 | 176.3 | 172.5 | -91.9 | 0 | 0 | 0 | 110.8 | K193 D194 D195 Q199 R200 R201 | K193-Y197 HydrophobicContact CB-CD1 4.05Å; K193-Y197 HydrophobicContact CD-CD1 4.06Å; K193-Y197 HydrophobicContact CD-CE1 3.84Å; K193-Y197 HydrophobicContact CG-CD1 4.07Å; K193-Y197 HydrophobicContact CG-CE1 4.23Å; D194-Y197 WeakPolarHBondContact O-CA 3.08Å; D194-Y197 WeakPolarHBondContact O-CB 3.26Å; D194-Y197 PolarHBondContact O-N 3.44Å; D195-Y197 VanDerWaalsContact C-N 3.34Å; D195-Y197 PolarHBondContact O-N 3.43Å; Y197-Q199 PolarHBondContact O-N 3.23Å; Y197-R200 PolarHBondContact O-N 3.46Å; Y197-R201 HydrophobicContact CE1-CB 4.47Å; Y197-R201 WeakPolarHBondContact O-CB 3.39Å; Y197-R201 PolarHBondContact O-N 2.91Å |
| 198 | I | 91.5 | Very high | 85.3 | Confident | 71 Ų | 71 | 118.2 Ų | 118.2 | 36% | 0.364 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -59.2 | -49.7 | -179 | -63.3 | 174.4 | 0 | 0 | 0 | 110.3 | K193 D194 D195 R200 R201 L202 | K193-I198 HydrophobicContact CB-CD1 4.26Å; K193-I198 HydrophobicContact CB-CG1 4.06Å; K193-I198 WeakPolarHBondContact O-CD1 3.42Å; D194-I198 PolarHBondContact O-N 3.46Å; D194-I198 VanDerWaalsContact O-N 3.14Å; D195-I198 PolarHBondContact O-N 3.15Å; I198-R200 PolarHBondContact O-N 2.91Å; I198-R201 PolarHBondContact O-N 3.05Å; I198-R201 VanDerWaalsContact O-N 3.14Å; I198-L202 HydrophobicContact CG2-CD1 4.04Å; I198-L202 HydrophobicContact CG2-CG 4.4Å; I198-L202 WeakPolarHBondContact O-CG 3.46Å; I198-L202 PolarHBondContact O-N 3.07Å |
| 199 | Q | 93.9 | Very high | 87.3 | Confident | 114 Ų | 114 | 117.8 Ų | 117.8 | 53% | 0.533 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -60 | -42.7 | 178.4 | -70 | 176.5 | 14.9 | 0 | 0 | 112.5 | D195 Y197 R201 L202 K203 | D195-Q199 VanDerWaalsContact O-CG 3.3Å; D195-Q199 WeakPolarHBondContact O-CG 3.37Å; D195-Q199 PolarHBondContact O-N 3.47Å; Y197-Q199 PolarHBondContact O-N 3.23Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-R201 PolarHBondContact O-N 3.49Å; Q199-L202 PolarHBondContact O-N 3.37Å; Q199-K203 WeakPolarHBondContact O-CG 3.48Å; Q199-K203 PolarHBondContact O-N 3.05Å |
| 200 | R | 95.7 | Very high | 89 | Confident | 194 Ų | 194 | 119.3 Ų | 119.3 | 73% | 0.732 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -62 | -42.1 | 175.5 | -172.9 | -175.2 | -60.3 | -104.3 | 1.2 | 111.3 | R196 Y197 I198 K203 N204 | R196-R200 WeakPolarHBondContact O-CB 3.3Å; R196-R200 PolarHBondContact O-N 2.93Å; Y197-R200 PolarHBondContact O-N 3.46Å; I198-R200 PolarHBondContact O-N 2.91Å; R200-K203 PolarHBondContact O-N 3.42Å; R200-N204 PolarHBondContact O-N 3.35Å |
| 201 | R | 97.5 | Very high | 90.8 | Very high | 120 Ų | 120 | 116.2 Ų | 116.2 | 45% | 0.453 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.9 | -41.6 | 179.6 | -165.9 | 64.7 | 176.8 | 138.2 | -5.5 | 111.7 | Y197 I198 Q199 N204 N205 | Y197-R201 HydrophobicContact CE1-CB 4.47Å; Y197-R201 WeakPolarHBondContact O-CB 3.39Å; Y197-R201 PolarHBondContact O-N 2.91Å; I198-R201 PolarHBondContact O-N 3.05Å; I198-R201 VanDerWaalsContact O-N 3.14Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-R201 PolarHBondContact O-N 3.49Å; R201-N204 PolarHBondContact NH1-OD1 2.85Å; R201-N204 PolarHBondContact O-N 2.89Å; R201-N205 WeakPolarHBondContact O-CB 3.26Å; R201-N205 PolarHBondContact O-N 2.8Å; R201-N205 PolarHBondContact O-ND2 3.41Å |
| 202 | L | 96.4 | Very high | 92.7 | Very high | 108 Ų | 108 | 120.7 Ų | 120.7 | 57% | 0.565 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -61.1 | -46.8 | 173.8 | -69.2 | 173.4 | 0 | 0 | 0 | 111.7 | I198 Q199 N204 N205 L206 | I198-L202 HydrophobicContact CG2-CD1 4.04Å; I198-L202 HydrophobicContact CG2-CG 4.4Å; I198-L202 WeakPolarHBondContact O-CG 3.46Å; I198-L202 PolarHBondContact O-N 3.07Å; Q199-L202 PolarHBondContact O-N 3.37Å; L202-N204 PolarHBondContact O-N 3.48Å; L202-N205 PolarHBondContact O-N 2.84Å; L202-L206 WeakPolarHBondContact O-CB 3.12Å; L202-L206 PolarHBondContact O-N 3.43Å |
| 203 | K | 97.2 | Very high | 94.3 | Very high | 153 Ų | 153 | 119.3 Ų | 119.3 | 67% | 0.665 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -59.5 | -44.4 | 175.9 | -73.6 | 178.9 | -179 | -178 | 0 | 112.4 | Q199 R200 L206 A207 | Q199-K203 WeakPolarHBondContact O-CG 3.48Å; Q199-K203 PolarHBondContact O-N 3.05Å; R200-K203 PolarHBondContact O-N 3.42Å; K203-L206 PolarHBondContact O-N 2.91Å; K203-A207 WeakPolarHBondContact O-CB 3.28Å; K203-A207 PolarHBondContact O-N 3.3Å |
| 204 | N | 98.2 | Very high | 95.2 | Very high | 86 Ų | 86 | 116.7 Ų | 116.7 | 46% | 0.46 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 177.3 | 178.3 | -103.6 | 0 | 0 | 0 | 112.3 | R200 R201 L202 L206 A207 A208 | R200-N204 PolarHBondContact O-N 3.35Å; R201-N204 PolarHBondContact NH1-OD1 2.85Å; R201-N204 PolarHBondContact O-N 2.89Å; L202-N204 PolarHBondContact O-N 3.48Å; N204-L206 VanDerWaalsContact C-N 3.34Å; N204-L206 PolarHBondContact O-N 2.96Å; N204-A207 PolarHBondContact O-N 3.38Å; N204-A208 VanDerWaalsContact O-CB 3.24Å; N204-A208 WeakPolarHBondContact O-CB 3.32Å; N204-A208 PolarHBondContact O-N 2.94Å |
| 205 | N | 98.1 | Very high | 95.8 | Very high | 78 Ų | 78 | 119.3 Ų | 119.3 | 42% | 0.417 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.1 | -42.5 | 175.4 | -72.7 | -16.2 | 0 | 0 | 0 | 111.5 | R201 L202 A208 K209 | R201-N205 WeakPolarHBondContact O-CB 3.26Å; R201-N205 PolarHBondContact O-N 2.8Å; R201-N205 PolarHBondContact O-ND2 3.41Å; L202-N205 PolarHBondContact O-N 2.84Å; N205-A208 PolarHBondContact O-N 3.03Å; N205-K209 WeakPolarHBondContact O-CB 3.46Å; N205-K209 PolarHBondContact O-N 3.26Å |
| 206 | L | 97.2 | Very high | 96 | Very high | 124 Ų | 124 | 119.3 Ų | 119.3 | 65% | 0.649 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.3 | -46.2 | 175.4 | -176.3 | 64.8 | 0 | 0 | 0 | 111.5 | L202 K203 N204 A208 K209 R210 | L202-L206 WeakPolarHBondContact O-CB 3.12Å; L202-L206 PolarHBondContact O-N 3.43Å; K203-L206 PolarHBondContact O-N 2.91Å; N204-L206 VanDerWaalsContact C-N 3.34Å; N204-L206 PolarHBondContact O-N 2.96Å; L206-A208 PolarHBondContact O-N 3.1Å; L206-K209 PolarHBondContact O-N 2.68Å; L206-R210 WeakPolarHBondContact O-CB 3.37Å; L206-R210 PolarHBondContact O-N 3.03Å |
| 207 | A | 96.6 | Very high | 96 | Very high | 57 Ų | 57 | 113.8 Ų | 113.8 | 47% | 0.471 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.7 | -40.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | K203 N204 R210 S211 | K203-A207 WeakPolarHBondContact O-CB 3.28Å; K203-A207 PolarHBondContact O-N 3.3Å; N204-A207 PolarHBondContact O-N 3.38Å; A207-R210 PolarHBondContact O-N 2.99Å; A207-S211 VanDerWaalsContact O-CB 3.31Å; A207-S211 WeakPolarHBondContact O-CB 3.33Å; A207-S211 PolarHBondContact O-N 3.17Å |
| 208 | A | 97.9 | Very high | 95.7 | Very high | 39 Ų | 39 | 115.6 Ų | 115.6 | 32% | 0.322 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.4 | -42.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | N204 N205 L206 S211 R212 | N204-A208 VanDerWaalsContact O-CB 3.24Å; N204-A208 WeakPolarHBondContact O-CB 3.32Å; N204-A208 PolarHBondContact O-N 2.94Å; N205-A208 PolarHBondContact O-N 3.03Å; L206-A208 PolarHBondContact O-N 3.1Å; A208-S211 PolarHBondContact O-N 3.41Å; A208-R212 WeakPolarHBondContact O-CG 3.5Å; A208-R212 PolarHBondContact O-N 3.32Å |
| 209 | K | 97.7 | Very high | 95.8 | Very high | 134 Ų | 134 | 117.4 Ų | 117.4 | 58% | 0.583 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -59.7 | -50.6 | 172.8 | -174.3 | -179.9 | 178 | -174 | 0 | 110.6 | N205 L206 S211 R212 D213 | N205-K209 WeakPolarHBondContact O-CB 3.46Å; N205-K209 PolarHBondContact O-N 3.26Å; L206-K209 PolarHBondContact O-N 2.68Å; K209-S211 VanDerWaalsContact C-N 3.3Å; K209-S211 PolarHBondContact O-N 3.41Å; K209-R212 WeakPolarHBondContact O-CB 3.21Å; K209-R212 PolarHBondContact O-N 2.94Å; K209-R212 VanDerWaalsContact O-N 3.17Å; K209-D213 VanDerWaalsContact O-CG 3.3Å; K209-D213 PolarHBondContact O-N 3.35Å |
| 210 | R | 95.6 | Very high | 95.5 | Very high | 198 Ų | 198 | 115.5 Ų | 115.5 | 75% | 0.747 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -58.5 | -40.5 | 177.5 | -166.6 | 178.4 | -161.3 | 178.6 | 5.3 | 112.5 | L206 A207 D213 N214 | L206-R210 WeakPolarHBondContact O-CB 3.37Å; L206-R210 PolarHBondContact O-N 3.03Å; A207-R210 PolarHBondContact O-N 2.99Å; R210-D213 PolarHBondContact O-N 3.37Å; R210-N214 VanDerWaalsContact O-CB 3.27Å; R210-N214 WeakPolarHBondContact O-CB 3.32Å; R210-N214 PolarHBondContact O-N 2.88Å |
| 211 | S | 97.7 | Very high | 95 | Very high | 71 Ų | 71 | 107.7 Ų | 107.7 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.7 | -43.2 | 177.2 | -178.7 | 0 | 0 | 0 | 0 | 111.9 | A207 A208 K209 N214 R215 | A207-S211 VanDerWaalsContact O-CB 3.31Å; A207-S211 WeakPolarHBondContact O-CB 3.33Å; A207-S211 PolarHBondContact O-N 3.17Å; A208-S211 PolarHBondContact O-N 3.41Å; K209-S211 VanDerWaalsContact C-N 3.3Å; K209-S211 PolarHBondContact O-N 3.41Å; S211-N214 PolarHBondContact O-N 3.08Å; S211-R215 PolarHBondContact O-N 2.91Å |
| 212 | R | 98 | Very high | 94.4 | Very high | 191 Ų | 191 | 107 Ų | 107 | 72% | 0.721 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62 | -47.9 | 173.4 | -72.2 | 175 | 178.5 | -179 | -0.9 | 111.6 | A208 K209 N214 R215 K216 | A208-R212 WeakPolarHBondContact O-CG 3.5Å; A208-R212 PolarHBondContact O-N 3.32Å; K209-R212 WeakPolarHBondContact O-CB 3.21Å; K209-R212 PolarHBondContact O-N 2.94Å; K209-R212 VanDerWaalsContact O-N 3.17Å; R212-N214 VanDerWaalsContact C-N 3.31Å; R212-N214 PolarHBondContact O-N 2.92Å; R212-R215 PolarHBondContact O-N 2.86Å; R212-K216 WeakPolarHBondContact O-CB 3.49Å; R212-K216 PolarHBondContact O-N 3.26Å |
| 213 | D | 96.1 | Very high | 93.9 | Very high | 74 Ų | 74 | 104.8 Ų | 104.8 | 40% | 0.396 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.1 | -38.4 | 179.6 | -65.6 | -17.4 | 0 | 0 | 0 | 111.5 | K209 R210 K216 R217 | K209-D213 VanDerWaalsContact O-CG 3.3Å; K209-D213 PolarHBondContact O-N 3.35Å; R210-D213 PolarHBondContact O-N 3.37Å; D213-K216 PolarHBondContact O-N 3Å; D213-R217 WeakPolarHBondContact O-CB 3.32Å; D213-R217 PolarHBondContact O-N 3.49Å |
| 214 | N | 94.6 | Very high | 93.2 | Very high | 77 Ų | 77 | 101 Ų | 101 | 41% | 0.412 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.6 | -41.6 | 175.8 | -173.6 | 70 | 0 | 0 | 0 | 112.7 | R210 S211 R212 R218 | R210-N214 VanDerWaalsContact O-CB 3.27Å; R210-N214 WeakPolarHBondContact O-CB 3.32Å; R210-N214 PolarHBondContact O-N 2.88Å; S211-N214 PolarHBondContact O-N 3.08Å; R212-N214 VanDerWaalsContact C-N 3.31Å; R212-N214 PolarHBondContact O-N 2.92Å; N214-R218 PolarHBondContact O-N 2.59Å; N214-R218 VanDerWaalsContact O-N 3.09Å |
| 215 | R | 96 | Very high | 92.6 | Very high | 159 Ų | 159 | 103.3 Ų | 103.3 | 60% | 0.6 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.8 | -49.4 | 174.2 | -176.5 | -173.7 | -59.8 | -171.5 | -2.2 | 110.6 | S211 R212 R217 R218 E219 | S211-R215 PolarHBondContact O-N 2.91Å; R212-R215 PolarHBondContact O-N 2.86Å; R215-R217 PolarHBondContact O-N 3.36Å; R215-R218 WeakPolarHBondContact O-CB 3.34Å; R215-R218 PolarHBondContact O-N 2.95Å; R215-R218 VanDerWaalsContact O-N 3.14Å; R215-E219 WeakPolarHBondContact CD-OE1 3.17Å; R215-E219 VanDerWaalsContact CG-OE1 3.23Å; R215-E219 WeakPolarHBondContact CG-OE1 3.29Å; R215-E219 WeakPolarHBondContact O-CG 3.22Å; R215-E219 PolarHBondContact O-N 2.92Å |
| 216 | K | 94.9 | Very high | 92.1 | Very high | 125 Ų | 125 | 101.5 Ų | 101.5 | 54% | 0.543 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -57 | -48.8 | 178.9 | -176.4 | 178.1 | 177.4 | -174.9 | 0 | 111.5 | R212 D213 R218 E219 D220 | R212-K216 WeakPolarHBondContact O-CB 3.49Å; R212-K216 PolarHBondContact O-N 3.26Å; D213-K216 PolarHBondContact O-N 3Å; K216-R218 VanDerWaalsContact C-N 3.31Å; K216-R218 PolarHBondContact O-N 3.47Å; K216-E219 PolarHBondContact O-N 3.47Å; K216-E219 VanDerWaalsContact O-N 3.14Å; K216-D220 VanDerWaalsContact O-CG 3.28Å; K216-D220 PolarHBondContact O-N 3.09Å |
| 217 | R | 90.4 | Very high | 91.3 | Very high | 99 Ų | 99 | 97.8 Ų | 97.8 | 37% | 0.374 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -55.6 | -46.2 | 176 | -172.6 | -174.1 | -57.8 | 97.6 | 7.1 | 111.8 | D213 R215 E219 D220 T221 | D213-R217 WeakPolarHBondContact O-CB 3.32Å; D213-R217 PolarHBondContact O-N 3.49Å; R215-R217 PolarHBondContact O-N 3.36Å; R217-E219 VanDerWaalsContact C-N 3.34Å; R217-E219 PolarHBondContact O-N 2.8Å; R217-D220 PolarHBondContact O-N 3.05Å; R217-T221 PolarHBondContact O-N 3.29Å; R217-T221 PolarHBondContact O-OG1 3.5Å |
| 218 | R | 88.7 | Confident | 90.7 | Very high | 156 Ų | 156 | 98.8 Ų | 98.8 | 59% | 0.589 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -59.8 | -43.9 | 178 | -177 | -172.7 | -67.5 | -177.5 | -4.6 | 111.9 | N214 R215 K216 T221 I222 | N214-R218 PolarHBondContact O-N 2.59Å; N214-R218 VanDerWaalsContact O-N 3.09Å; R215-R218 WeakPolarHBondContact O-CB 3.34Å; R215-R218 PolarHBondContact O-N 2.95Å; R215-R218 VanDerWaalsContact O-N 3.14Å; K216-R218 VanDerWaalsContact C-N 3.31Å; K216-R218 PolarHBondContact O-N 3.47Å; R218-T221 PolarHBondContact O-N 3.02Å; R218-I222 HydrophobicContact CG-CD1 3.99Å; R218-I222 VanDerWaalsContact O-CG1 3.24Å; R218-I222 WeakPolarHBondContact O-CG1 3.07Å; R218-I222 PolarHBondContact O-N 2.89Å |
| 219 | E | 92.5 | Very high | 90.1 | Very high | 108 Ų | 108 | 101.3 Ų | 101.3 | 51% | 0.505 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.8 | -44.4 | 177.1 | -69.8 | 165.5 | -175.5 | 0 | 0 | 111.1 | R215 K216 R217 I222 A223 | R215-E219 WeakPolarHBondContact CD-OE1 3.17Å; R215-E219 VanDerWaalsContact CG-OE1 3.23Å; R215-E219 WeakPolarHBondContact CG-OE1 3.29Å; R215-E219 WeakPolarHBondContact O-CG 3.22Å; R215-E219 PolarHBondContact O-N 2.92Å; K216-E219 PolarHBondContact O-N 3.47Å; K216-E219 VanDerWaalsContact O-N 3.14Å; R217-E219 VanDerWaalsContact C-N 3.34Å; R217-E219 PolarHBondContact O-N 2.8Å; E219-I222 PolarHBondContact O-N 3.26Å; E219-A223 WeakPolarHBondContact O-CB 3.3Å; E219-A223 PolarHBondContact O-N 2.87Å |
| 220 | D | 88.9 | Confident | 89.5 | Confident | 75 Ų | 75 | 101.3 Ų | 101.3 | 40% | 0.401 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 176.6 | -66.2 | -21.3 | 0 | 0 | 0 | 111.3 | K216 R217 I222 A223 L224 | K216-D220 VanDerWaalsContact O-CG 3.28Å; K216-D220 PolarHBondContact O-N 3.09Å; R217-D220 PolarHBondContact O-N 3.05Å; D220-I222 PolarHBondContact O-N 3.42Å; D220-A223 PolarHBondContact O-N 3.44Å; D220-L224 WeakPolarHBondContact O-CG 3.3Å; D220-L224 PolarHBondContact O-N 2.92Å |
| 221 | T | 84.4 | Confident | 88.9 | Confident | 29 Ų | 29 | 95.3 Ų | 95.3 | 18% | 0.178 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -60.2 | -43.2 | 175.3 | -53 | 0 | 0 | 0 | 0 | 112 | D66 R217 R218 L224 R225 | D66-T221 WeakPolarHBondContact OD2-CB 3.45Å; D66-T221 WeakPolarHBondContact OD2-CG2 3.47Å; D66-T221 PolarHBondContact OD2-OG1 3.24Å; R217-T221 PolarHBondContact O-N 3.29Å; R217-T221 PolarHBondContact O-OG1 3.5Å; R218-T221 PolarHBondContact O-N 3.02Å; T221-L224 PolarHBondContact O-N 3.27Å; T221-R225 WeakPolarHBondContact O-CB 3.36Å; T221-R225 PolarHBondContact O-N 3.3Å |
| 222 | I | 84.7 | Confident | 88.2 | Confident | 107 Ų | 107 | 93 Ų | 93 | 55% | 0.549 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.6 | -44.7 | 177.6 | -70.4 | 166.6 | 0 | 0 | 0 | 110.2 | R218 E219 D220 R225 A226 | R218-I222 HydrophobicContact CG-CD1 3.99Å; R218-I222 VanDerWaalsContact O-CG1 3.24Å; R218-I222 WeakPolarHBondContact O-CG1 3.07Å; R218-I222 PolarHBondContact O-N 2.89Å; E219-I222 PolarHBondContact O-N 3.26Å; D220-I222 PolarHBondContact O-N 3.42Å; I222-R225 PolarHBondContact O-N 3.34Å; I222-A226 WeakPolarHBondContact O-CB 3.43Å; I222-A226 PolarHBondContact O-N 3.49Å |
| 223 | A | 86.8 | Confident | 87.8 | Confident | 60 Ų | 60 | 88 Ų | 88 | 50% | 0.496 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -61.9 | -44.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E219 D220 A226 S227 | E219-A223 WeakPolarHBondContact O-CB 3.3Å; E219-A223 PolarHBondContact O-N 2.87Å; D220-A223 PolarHBondContact O-N 3.44Å; A223-A226 PolarHBondContact O-N 2.93Å; A223-S227 PolarHBondContact O-N 3.34Å |
| 224 | L | 82.8 | Confident | 87.2 | Confident | 74 Ų | 74 | 88.5 Ų | 88.5 | 39% | 0.387 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -63 | -44.8 | 175.5 | -74 | 170.2 | 0 | 0 | 0 | 112 | E62 D220 T221 S227 Y228 | E62-L224 WeakPolarHBondContact OE2-CD1 3.31Å; D220-L224 WeakPolarHBondContact O-CG 3.3Å; D220-L224 PolarHBondContact O-N 2.92Å; T221-L224 PolarHBondContact O-N 3.27Å; L224-S227 PolarHBondContact O-N 3.09Å; L224-Y228 WeakPolarHBondContact O-CB 3.5Å; L224-Y228 PolarHBondContact O-N 3.14Å |
| 225 | R | 84.6 | Confident | 86.7 | Confident | 134 Ų | 134 | 85.5 Ų | 85.5 | 51% | 0.506 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 176.8 | -174 | 178.2 | -178.5 | -173.2 | 0.2 | 112 | F59 T221 I222 Y228 L229 | F59-R225 HydrophobicContact CE2-CB 4.41Å; T221-R225 WeakPolarHBondContact O-CB 3.36Å; T221-R225 PolarHBondContact O-N 3.3Å; I222-R225 PolarHBondContact O-N 3.34Å; R225-Y228 PolarHBondContact O-N 3.14Å; R225-L229 HydrophobicContact CG-CD1 4.07Å; R225-L229 HydrophobicContact CG-CG 4.47Å; R225-L229 WeakPolarHBondContact O-CB 3.39Å; R225-L229 VanDerWaalsContact O-CG 3.3Å; R225-L229 WeakPolarHBondContact O-CG 3.39Å; R225-L229 PolarHBondContact O-N 2.89Å |
| 226 | A | 87.2 | Confident | 86.3 | Confident | 41 Ų | 41 | 82.4 Ų | 82.4 | 34% | 0.339 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -59.6 | -50.2 | 176 | 0 | 0 | 0 | 0 | 0 | 110.8 | I222 A223 Y228 L229 E230 | I222-A226 WeakPolarHBondContact O-CB 3.43Å; I222-A226 PolarHBondContact O-N 3.49Å; A223-A226 PolarHBondContact O-N 2.93Å; A226-Y228 VanDerWaalsContact C-N 3.34Å; A226-Y228 PolarHBondContact O-N 3.26Å; A226-L229 PolarHBondContact O-N 3.14Å; A226-E230 VanDerWaalsContact O-CG 3.3Å; A226-E230 WeakPolarHBondContact O-CG 3.39Å; A226-E230 PolarHBondContact O-N 3.01Å |
| 227 | S | 81.3 | Confident | 85.9 | Confident | 45 Ų | 45 | 81.9 Ų | 81.9 | 32% | 0.315 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -59.4 | -41.6 | 178.1 | -173.4 | 0 | 0 | 0 | 0 | 112.9 | A223 L224 E230 K231 | A223-S227 PolarHBondContact O-N 3.34Å; L224-S227 PolarHBondContact O-N 3.09Å; S227-E230 PolarHBondContact O-N 3.33Å; S227-K231 VanDerWaalsContact O-CG 3.31Å; S227-K231 WeakPolarHBondContact O-CG 3.23Å; S227-K231 PolarHBondContact O-N 2.92Å |
| 228 | Y | 83.6 | Confident | 85.7 | Confident | 79 Ų | 79 | 78.4 Ų | 78.4 | 31% | 0.31 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -62.5 | -46.1 | 175.8 | 174 | -94.4 | 0 | 0 | 0 | 112.1 | V54 F59 L224 R225 A226 K231 S232 | V54-Y228 HydrophobicContact CG1-CD2 4.06Å; V54-Y228 HydrophobicContact CG1-CE2 3.45Å; V54-Y228 VanDerWaalsContact CG1-CE2 3.45Å; F59-Y228 HydrophobicContact CD1-CD1 4.22Å; F59-Y228 AromaticContact CD1-CD2 3.59Å; F59-Y228 HydrophobicContact CD1-CD2 3.59Å; F59-Y228 HydrophobicContact CD1-CE1 4.49Å; F59-Y228 AromaticContact CD1-CE2 3.89Å; F59-Y228 HydrophobicContact CD1-CE2 3.89Å; F59-Y228 AromaticContact CD1-CG 3.77Å; F59-Y228 HydrophobicContact CD1-CG 3.77Å; F59-Y228 HydrophobicContact CD2-CD2 4.34Å; F59-Y228 HydrophobicContact CD2-CG 4.16Å; F59-Y228 AromaticContact CE1-CD1 3.56Å; F59-Y228 HydrophobicContact CE1-CD1 3.56Å; F59-Y228 AromaticContact CE1-CD2 3.82Å; F59-Y228 HydrophobicContact CE1-CD2 3.82Å; F59-Y228 AromaticContact CE1-CE1 3.91Å; F59-Y228 HydrophobicContact CE1-CE1 3.91Å; F59-Y228 HydrophobicContact CE1-CE2 4.14Å; F59-Y228 AromaticContact CE1-CG 3.51Å; F59-Y228 HydrophobicContact CE1-CG 3.51Å; F59-Y228 HydrophobicContact CE2-CD1 4.46Å; F59-Y228 AromaticContact CE2-CG 3.95Å; F59-Y228 HydrophobicContact CE2-CG 3.95Å; F59-Y228 AromaticContact CG-CD2 3.88Å; F59-Y228 HydrophobicContact CG-CD2 3.88Å; F59-Y228 HydrophobicContact CG-CG 4.09Å; F59-Y228 AromaticContact CZ-CD1 3.7Å; F59-Y228 HydrophobicContact CZ-CD1 3.7Å; F59-Y228 HydrophobicContact CZ-CD2 4.3Å; F59-Y228 HydrophobicContact CZ-CE1 4.46Å; F59-Y228 AromaticContact CZ-CG 3.61Å; F59-Y228 HydrophobicContact CZ-CG 3.61Å; L224-Y228 WeakPolarHBondContact O-CB 3.5Å; L224-Y228 PolarHBondContact O-N 3.14Å; R225-Y228 PolarHBondContact O-N 3.14Å; A226-Y228 VanDerWaalsContact C-N 3.34Å; A226-Y228 PolarHBondContact O-N 3.26Å; Y228-K231 PolarHBondContact O-N 3.43Å; Y228-S232 WeakPolarHBondContact O-CB 3.46Å; Y228-S232 PolarHBondContact O-N 3.44Å; Y228-S232 PolarHBondContact O-OG 2.89Å |
| 229 | L | 85.3 | Confident | 85.6 | Confident | 92 Ų | 92 | 74.6 Ų | 74.6 | 48% | 0.482 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.6 | -39.8 | 179.3 | -71.7 | 173.6 | 0 | 0 | 0 | 111.6 | R225 A226 S232 N233 | R225-L229 HydrophobicContact CG-CD1 4.07Å; R225-L229 HydrophobicContact CG-CG 4.47Å; R225-L229 WeakPolarHBondContact O-CB 3.39Å; R225-L229 VanDerWaalsContact O-CG 3.3Å; R225-L229 WeakPolarHBondContact O-CG 3.39Å; R225-L229 PolarHBondContact O-N 2.89Å; A226-L229 PolarHBondContact O-N 3.14Å; L229-S232 PolarHBondContact O-N 2.98Å; L229-N233 WeakPolarHBondContact O-CB 3.11Å; L229-N233 PolarHBondContact O-N 2.98Å |
| 230 | E | 85.6 | Confident | 85.4 | Confident | 134 Ų | 134 | 73.8 Ų | 73.8 | 63% | 0.626 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -60.1 | -50.2 | 175 | -74.3 | 168.1 | -179.3 | 0 | 0 | 111.6 | A226 S227 S232 N233 L234 | A226-E230 VanDerWaalsContact O-CG 3.3Å; A226-E230 WeakPolarHBondContact O-CG 3.39Å; A226-E230 PolarHBondContact O-N 3.01Å; S227-E230 PolarHBondContact O-N 3.33Å; E230-S232 PolarHBondContact O-N 3.41Å; E230-N233 PolarHBondContact O-N 3.38Å; E230-L234 WeakPolarHBondContact O-CB 3.38Å; E230-L234 PolarHBondContact O-N 3.39Å |
| 231 | K | 83.2 | Confident | 85.4 | Confident | 72 Ų | 72 | 73 Ų | 73 | 31% | 0.313 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.6 | -43.8 | 177.7 | -67.8 | 176.7 | -177.2 | -173.4 | 0 | 111.8 | S53 V54 S227 Y228 L234 V235 | S53-K231 PolarHBondContact OG-NZ 2.88Å; V54-K231 HydrophobicContact CG2-CB 3.47Å; V54-K231 VanDerWaalsContact CG2-CB 3.47Å; V54-K231 HydrophobicContact CG2-CD 4.38Å; S227-K231 VanDerWaalsContact O-CG 3.31Å; S227-K231 WeakPolarHBondContact O-CG 3.23Å; S227-K231 PolarHBondContact O-N 2.92Å; Y228-K231 PolarHBondContact O-N 3.43Å; K231-L234 PolarHBondContact O-N 3.45Å; K231-V235 WeakPolarHBondContact O-CG2 3.49Å; K231-V235 PolarHBondContact O-N 2.9Å; K231-V235 VanDerWaalsContact O-N 3.08Å |
| 232 | S | 83.4 | Confident | 85.5 | Confident | 22 Ų | 22 | 72.1 Ų | 72.1 | 15% | 0.154 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.9 | -41.3 | 178.2 | -57.7 | 0 | 0 | 0 | 0 | 111.7 | V54 Y228 L229 E230 V235 L236 | V54-S232 WeakPolarHBondContact CG1-OG 3.44Å; Y228-S232 WeakPolarHBondContact O-CB 3.46Å; Y228-S232 PolarHBondContact O-N 3.44Å; Y228-S232 PolarHBondContact O-OG 2.89Å; L229-S232 PolarHBondContact O-N 2.98Å; E230-S232 PolarHBondContact O-N 3.41Å; S232-V235 PolarHBondContact O-N 3.45Å; S232-L236 WeakPolarHBondContact O-CG 3.27Å; S232-L236 PolarHBondContact O-N 3.24Å |
| 233 | N | 88.2 | Confident | 85.8 | Confident | 85 Ų | 85 | 71.9 Ų | 71.9 | 46% | 0.455 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63.3 | -42.6 | 176.6 | -171 | -76.4 | 0 | 0 | 0 | 111.1 | L229 E230 V235 L236 Q237 | L229-N233 WeakPolarHBondContact O-CB 3.11Å; L229-N233 PolarHBondContact O-N 2.98Å; E230-N233 PolarHBondContact O-N 3.38Å; N233-V235 PolarHBondContact O-N 3.33Å; N233-L236 PolarHBondContact O-N 3.24Å; N233-Q237 WeakPolarHBondContact O-CG 3.24Å; N233-Q237 PolarHBondContact O-N 2.82Å; N233-Q237 PolarHBondContact OD1-NE2 2.84Å |
| 234 | L | 84.3 | Confident | 85.8 | Confident | 85 Ų | 85 | 72 Ų | 72 | 45% | 0.445 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -57.9 | -46.6 | 174.3 | -179.7 | 63 | 0 | 0 | 0 | 111.8 | T50 E230 K231 L236 Q237 T238 | T50-L234 HydrophobicContact CG2-CD2 4.42Å; E230-L234 WeakPolarHBondContact O-CB 3.38Å; E230-L234 PolarHBondContact O-N 3.39Å; K231-L234 PolarHBondContact O-N 3.45Å; L234-L236 VanDerWaalsContact C-N 3.33Å; L234-L236 PolarHBondContact O-N 2.86Å; L234-Q237 PolarHBondContact O-N 3.14Å; L234-T238 HydrophobicContact CD1-CG2 4.33Å; L234-T238 VanDerWaalsContact O-CG2 3.26Å; L234-T238 WeakPolarHBondContact O-CG2 3.44Å; L234-T238 PolarHBondContact O-N 3.39Å; L234-T238 PolarHBondContact O-OG1 3.49Å |
| 235 | V | 83.1 | Confident | 86.1 | Confident | 15 Ų | 15 | 74 Ų | 74 | 9% | 0.091 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -59.5 | -42.5 | 175.8 | 171.1 | 0 | 0 | 0 | 0 | 111.7 | T50 I51 V54 K231 S232 N233 T238 Q239 | T50-V235 HydrophobicContact CG2-CG2 3.76Å; I51-V235 HydrophobicContact CD1-CG1 4.26Å; I51-V235 HydrophobicContact CG1-CG1 3.75Å; I51-V235 HydrophobicContact CG1-CG2 3.87Å; V54-V235 HydrophobicContact CG2-CG2 4.48Å; K231-V235 WeakPolarHBondContact O-CG2 3.49Å; K231-V235 PolarHBondContact O-N 2.9Å; K231-V235 VanDerWaalsContact O-N 3.08Å; S232-V235 PolarHBondContact O-N 3.45Å; N233-V235 PolarHBondContact O-N 3.33Å; V235-T238 PolarHBondContact O-N 3.25Å; V235-T238 PolarHBondContact O-OG1 3.47Å; V235-Q239 WeakPolarHBondContact O-CB 3.49Å; V235-Q239 VanDerWaalsContact O-CG 3.28Å; V235-Q239 WeakPolarHBondContact O-CG 3.49Å; V235-Q239 PolarHBondContact O-N 3.24Å |
| 236 | L | 87.7 | Confident | 86.4 | Confident | 94 Ų | 94 | 71.1 Ų | 71.1 | 49% | 0.492 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -66.6 | -42.8 | 177.3 | -70.1 | 171.8 | 0 | 0 | 0 | 111.8 | S232 N233 L234 T238 Q239 I240 | S232-L236 WeakPolarHBondContact O-CG 3.27Å; S232-L236 PolarHBondContact O-N 3.24Å; N233-L236 PolarHBondContact O-N 3.24Å; L234-L236 VanDerWaalsContact C-N 3.33Å; L234-L236 PolarHBondContact O-N 2.86Å; L236-T238 VanDerWaalsContact C-N 3.3Å; L236-T238 PolarHBondContact O-N 3.24Å; L236-Q239 PolarHBondContact O-N 2.83Å; L236-I240 WeakPolarHBondContact O-CB 3.46Å; L236-I240 WeakPolarHBondContact O-CD1 3.31Å; L236-I240 VanDerWaalsContact O-CG1 3.22Å; L236-I240 WeakPolarHBondContact O-CG1 3.37Å; L236-I240 PolarHBondContact O-N 3.03Å |
| 237 | Q | 87.4 | Confident | 86.5 | Confident | 114 Ų | 114 | 72 Ų | 72 | 53% | 0.533 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -59.7 | -41.5 | 177.5 | -73.8 | -175.3 | 18.4 | 0 | 0 | 111.7 | N233 L234 I240 L241 | N233-Q237 WeakPolarHBondContact O-CG 3.24Å; N233-Q237 PolarHBondContact O-N 2.82Å; N233-Q237 PolarHBondContact OD1-NE2 2.84Å; L234-Q237 PolarHBondContact O-N 3.14Å; Q237-I240 PolarHBondContact O-N 3.43Å; Q237-L241 WeakPolarHBondContact O-CB 3.38Å; Q237-L241 PolarHBondContact O-N 3.33Å |
| 238 | T | 85.6 | Confident | 86.9 | Confident | 26 Ų | 26 | 70.7 Ų | 70.7 | 16% | 0.16 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -72.1 | -39.1 | -179.7 | 59.1 | 0 | 0 | 0 | 0 | 112.1 | L47 L234 V235 L236 L241 A242 | L47-T238 WeakPolarHBondContact CD1-OG1 3.29Å; L47-T238 VanDerWaalsContact CD2-CB 3.49Å; L47-T238 HydrophobicContact CD2-CG2 3.63Å; L47-T238 WeakPolarHBondContact CD2-OG1 3.46Å; L234-T238 HydrophobicContact CD1-CG2 4.33Å; L234-T238 VanDerWaalsContact O-CG2 3.26Å; L234-T238 WeakPolarHBondContact O-CG2 3.44Å; L234-T238 PolarHBondContact O-N 3.39Å; L234-T238 PolarHBondContact O-OG1 3.49Å; V235-T238 PolarHBondContact O-N 3.25Å; V235-T238 PolarHBondContact O-OG1 3.47Å; L236-T238 VanDerWaalsContact C-N 3.3Å; L236-T238 PolarHBondContact O-N 3.24Å; T238-L241 WeakPolarHBondContact O-CB 3.23Å; T238-L241 PolarHBondContact O-N 2.9Å; T238-A242 PolarHBondContact O-N 3.33Å |
| 239 | Q | 88.1 | Confident | 87.3 | Confident | 75 Ų | 75 | 73 Ų | 73 | 35% | 0.35 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -60.3 | -46.2 | 171 | -73.5 | 173.8 | -2.2 | 0 | 0 | 111.5 | V235 L236 L241 A242 L243 | V235-Q239 WeakPolarHBondContact O-CB 3.49Å; V235-Q239 VanDerWaalsContact O-CG 3.28Å; V235-Q239 WeakPolarHBondContact O-CG 3.49Å; V235-Q239 PolarHBondContact O-N 3.24Å; L236-Q239 PolarHBondContact O-N 2.83Å; Q239-L241 VanDerWaalsContact C-N 3.29Å; Q239-L241 PolarHBondContact O-N 2.79Å; Q239-A242 PolarHBondContact O-N 2.97Å; Q239-L243 WeakPolarHBondContact O-CG 3.34Å; Q239-L243 PolarHBondContact O-N 3.17Å |
| 240 | I | 88.3 | Confident | 87.6 | Confident | 91 Ų | 91 | 76 Ų | 76 | 47% | 0.467 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -58.8 | -43.2 | 175.2 | -71.3 | 165.7 | 0 | 0 | 0 | 110.5 | L236 Q237 L243 K244 | L236-I240 WeakPolarHBondContact O-CB 3.46Å; L236-I240 WeakPolarHBondContact O-CD1 3.31Å; L236-I240 VanDerWaalsContact O-CG1 3.22Å; L236-I240 WeakPolarHBondContact O-CG1 3.37Å; L236-I240 PolarHBondContact O-N 3.03Å; Q237-I240 PolarHBondContact O-N 3.43Å; I240-L243 PolarHBondContact O-N 2.92Å; I240-K244 HydrophobicContact CG2-CD 4.18Å; I240-K244 HydrophobicContact CG2-CG 4.33Å; I240-K244 WeakPolarHBondContact O-CB 3.49Å; I240-K244 VanDerWaalsContact O-CG 3.29Å; I240-K244 WeakPolarHBondContact O-CG 3.3Å; I240-K244 PolarHBondContact O-N 3.08Å |
| 241 | L | 88.2 | Confident | 88 | Confident | 60 Ų | 60 | 78.2 Ų | 78.2 | 31% | 0.314 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63 | -43.3 | 178.6 | -165.7 | 74 | 0 | 0 | 0 | 111.9 | Q237 T238 Q239 K244 R245 F255 P257 | Q237-L241 WeakPolarHBondContact O-CB 3.38Å; Q237-L241 PolarHBondContact O-N 3.33Å; T238-L241 WeakPolarHBondContact O-CB 3.23Å; T238-L241 PolarHBondContact O-N 2.9Å; Q239-L241 VanDerWaalsContact C-N 3.29Å; Q239-L241 PolarHBondContact O-N 2.79Å; L241-K244 PolarHBondContact O-N 2.95Å; L241-R245 PolarHBondContact O-N 2.97Å; L241-F255 HydrophobicContact CD1-CE2 4.39Å; L241-F255 HydrophobicContact CD1-CZ 3.61Å; L241-F255 HydrophobicContact CG-CZ 3.99Å; L241-P257 HydrophobicContact CD1-CB 3.97Å |
| 242 | A | 87.3 | Confident | 88.3 | Confident | 10 Ų | 10 | 78.1 Ų | 78.1 | 8% | 0.083 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -61.4 | -48.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | T238 Q239 K244 R245 E246 | T238-A242 PolarHBondContact O-N 3.33Å; Q239-A242 PolarHBondContact O-N 2.97Å; A242-K244 PolarHBondContact O-N 3.48Å; A242-R245 WeakPolarHBondContact O-CB 3.38Å; A242-R245 PolarHBondContact O-N 3.46Å; A242-R245 VanDerWaalsContact O-N 3.16Å; A242-E246 PolarHBondContact O-N 3.4Å |
| 243 | L | 89.5 | Confident | 88.7 | Confident | 101 Ų | 101 | 81.1 Ų | 81.1 | 53% | 0.529 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 176.9 | -69.6 | 173.3 | 0 | 0 | 0 | 112.3 | Q239 I240 R245 E246 V247 | Q239-L243 WeakPolarHBondContact O-CG 3.34Å; Q239-L243 PolarHBondContact O-N 3.17Å; I240-L243 PolarHBondContact O-N 2.92Å; L243-R245 VanDerWaalsContact C-N 3.29Å; L243-R245 PolarHBondContact O-N 2.95Å; L243-E246 PolarHBondContact O-N 3.35Å; L243-V247 VanDerWaalsContact O-CG2 3.3Å; L243-V247 WeakPolarHBondContact O-CG2 3.24Å; L243-V247 PolarHBondContact O-N 3.49Å |
| 244 | K | 88.2 | Confident | 88.7 | Confident | 64 Ų | 64 | 82.9 Ų | 82.9 | 28% | 0.278 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -58.7 | -42.9 | 174 | -78.8 | -178.1 | 177.5 | -171 | 0 | 111.4 | I240 L241 A242 V247 C248 F255 Y259 | I240-K244 HydrophobicContact CG2-CD 4.18Å; I240-K244 HydrophobicContact CG2-CG 4.33Å; I240-K244 WeakPolarHBondContact O-CB 3.49Å; I240-K244 VanDerWaalsContact O-CG 3.29Å; I240-K244 WeakPolarHBondContact O-CG 3.3Å; I240-K244 PolarHBondContact O-N 3.08Å; L241-K244 PolarHBondContact O-N 2.95Å; A242-K244 PolarHBondContact O-N 3.48Å; K244-V247 PolarHBondContact O-N 3.3Å; K244-C248 WeakPolarHBondContact O-CB 3.48Å; K244-C248 PolarHBondContact O-N 3.42Å; K244-C248 PolarHBondContact O-SG 3.42Å; K244-C248 VanDerWaalsContact O-SG 3.32Å; K244-F255 HydrophobicContact CB-CE2 3.92Å; K244-Y259 PolarHBondContact NZ-O 2.99Å |
| 245 | R | 89.1 | Confident | 89 | Confident | 116 Ų | 116 | 82.3 Ų | 82.3 | 44% | 0.438 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -62.6 | -46.2 | 176.9 | -173.2 | -178.5 | -176.9 | -179.1 | 1.6 | 111.3 | L241 A242 L243 V247 C248 L249 F255 | L241-R245 PolarHBondContact O-N 2.97Å; A242-R245 WeakPolarHBondContact O-CB 3.38Å; A242-R245 PolarHBondContact O-N 3.46Å; A242-R245 VanDerWaalsContact O-N 3.16Å; L243-R245 VanDerWaalsContact C-N 3.29Å; L243-R245 PolarHBondContact O-N 2.95Å; R245-V247 PolarHBondContact O-N 2.91Å; R245-C248 PolarHBondContact O-N 2.94Å; R245-L249 HydrophobicContact CG-CD1 4.33Å; R245-L249 VanDerWaalsContact O-CG 3.3Å; R245-L249 WeakPolarHBondContact O-CG 3.35Å; R245-L249 PolarHBondContact O-N 3.03Å; R245-F255 HydrophobicContact CB-CD2 3.93Å; R245-F255 HydrophobicContact CB-CE2 3.9Å; R245-F255 HydrophobicContact CB-CG 4.38Å; R245-F255 HydrophobicContact CB-CZ 4.33Å; R245-F255 HydrophobicContact CG-CD2 4.35Å; R245-F255 HydrophobicContact CG-CG 4.32Å |
| 246 | E | 89.9 | Confident | 89.2 | Confident | 72 Ų | 72 | 85.4 Ų | 85.4 | 34% | 0.336 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 176 | -72.2 | 175.4 | -164 | 0 | 0 | 111.9 | A242 L243 C248 L249 L250 | A242-E246 PolarHBondContact O-N 3.4Å; L243-E246 PolarHBondContact O-N 3.35Å; E246-C248 VanDerWaalsContact C-N 3.34Å; E246-C248 PolarHBondContact O-N 3.38Å; E246-L249 PolarHBondContact O-N 3.19Å; E246-L250 WeakPolarHBondContact O-CG 3.45Å; E246-L250 PolarHBondContact O-N 3.26Å |
| 247 | V | 89.6 | Confident | 88.9 | Confident | 60 Ų | 60 | 84 Ų | 84 | 36% | 0.364 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -61 | -42.1 | 176.3 | 170.5 | 0 | 0 | 0 | 0 | 111.5 | L243 K244 R245 L250 R251 | L243-V247 VanDerWaalsContact O-CG2 3.3Å; L243-V247 WeakPolarHBondContact O-CG2 3.24Å; L243-V247 PolarHBondContact O-N 3.49Å; K244-V247 PolarHBondContact O-N 3.3Å; R245-V247 PolarHBondContact O-N 2.91Å; V247-L250 PolarHBondContact O-N 3.23Å; V247-R251 HydrophobicContact CG1-CG 4.4Å; V247-R251 VanDerWaalsContact O-CB 3.29Å; V247-R251 WeakPolarHBondContact O-CB 3.48Å; V247-R251 VanDerWaalsContact O-CG 3.26Å; V247-R251 WeakPolarHBondContact O-CG 3.45Å; V247-R251 PolarHBondContact O-N 3.39Å |
| 248 | C | 89.6 | Confident | 88.7 | Confident | 18 Ų | 18 | 85 Ų | 85 | 12% | 0.122 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -62.3 | -45.3 | 175.7 | -74.8 | 0 | 0 | 0 | 0 | 111.8 | K244 R245 E246 R251 G252 I253 F255 | K244-C248 WeakPolarHBondContact O-CB 3.48Å; K244-C248 PolarHBondContact O-N 3.42Å; K244-C248 PolarHBondContact O-SG 3.42Å; K244-C248 VanDerWaalsContact O-SG 3.32Å; R245-C248 PolarHBondContact O-N 2.94Å; E246-C248 VanDerWaalsContact C-N 3.34Å; E246-C248 PolarHBondContact O-N 3.38Å; C248-R251 CarbonylContact O-C 3.6Å; C248-R251 PolarHBondContact O-N 3.46Å; C248-G252 PolarHBondContact O-N 3.25Å; C248-I253 HydrophobicContact CB-CG1 3.96Å; C248-I253 WeakPolarHBondContact CB-O 3.49Å; C248-I253 PolarHBondContact O-N 3.47Å; C248-F255 HydrophobicContact CB-CB 4.02Å; C248-F255 HydrophobicContact CB-CD2 4.34Å |
| 249 | L | 90.9 | Very high | 88.1 | Confident | 127 Ų | 127 | 90.6 Ų | 90.6 | 67% | 0.665 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -59.8 | -47.2 | 176.8 | -70.5 | 172.3 | 0 | 0 | 0 | 111.7 | R245 E246 R251 G252 | R245-L249 HydrophobicContact CG-CD1 4.33Å; R245-L249 VanDerWaalsContact O-CG 3.3Å; R245-L249 WeakPolarHBondContact O-CG 3.35Å; R245-L249 PolarHBondContact O-N 3.03Å; E246-L249 PolarHBondContact O-N 3.19Å; L249-R251 VanDerWaalsContact C-N 3.3Å; L249-R251 PolarHBondContact O-N 3.05Å; L249-G252 PolarHBondContact O-N 3.04Å |
| 250 | L | 93.1 | Very high | 87.1 | Confident | 155 Ų | 155 | 95.6 Ų | 95.6 | 81% | 0.812 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.9 | -29.6 | 178.8 | -69.7 | 174.7 | 0 | 0 | 0 | 113.1 | E246 V247 | E246-L250 WeakPolarHBondContact O-CG 3.45Å; E246-L250 PolarHBondContact O-N 3.26Å; V247-L250 PolarHBondContact O-N 3.23Å |
| 251 | R | 92.4 | Very high | 85.8 | Confident | 181 Ų | 181 | 95.3 Ų | 95.3 | 68% | 0.683 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -87.7 | -5.1 | 177.4 | -70.8 | 178.9 | 179.1 | 174.2 | 0.7 | 113.6 | V247 C248 L249 I253 | V247-R251 HydrophobicContact CG1-CG 4.4Å; V247-R251 VanDerWaalsContact O-CB 3.29Å; V247-R251 WeakPolarHBondContact O-CB 3.48Å; V247-R251 VanDerWaalsContact O-CG 3.26Å; V247-R251 WeakPolarHBondContact O-CG 3.45Å; V247-R251 PolarHBondContact O-N 3.39Å; C248-R251 CarbonylContact O-C 3.6Å; C248-R251 PolarHBondContact O-N 3.46Å; L249-R251 VanDerWaalsContact C-N 3.3Å; L249-R251 PolarHBondContact O-N 3.05Å; R251-I253 HydrophobicContact CB-CD1 4.2Å; R251-I253 HydrophobicContact CB-CG1 3.99Å; R251-I253 HydrophobicContact CB-CG2 4.39Å; R251-I253 PolarHBondContact O-N 2.91Å |
| 252 | G | 91.4 | Very high | 84.6 | Confident | 69 Ų | 69 | 102.8 Ų | 102.8 | 71% | 0.711 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64 | 21.9 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114 | C248 L249 | C248-G252 PolarHBondContact O-N 3.25Å; L249-G252 PolarHBondContact O-N 3.04Å |
| 253 | I | 90.4 | Very high | 82.8 | Confident | 85 Ų | 85 | 107.5 Ų | 107.5 | 44% | 0.436 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -100.8 | 145.5 | 178.3 | 61 | 179 | 0 | 0 | 0 | 110.3 | C248 R251 F255 | C248-I253 HydrophobicContact CB-CG1 3.96Å; C248-I253 WeakPolarHBondContact CB-O 3.49Å; C248-I253 PolarHBondContact O-N 3.47Å; R251-I253 HydrophobicContact CB-CD1 4.2Å; R251-I253 HydrophobicContact CB-CG1 3.99Å; R251-I253 HydrophobicContact CB-CG2 4.39Å; R251-I253 PolarHBondContact O-N 2.91Å; I253-F255 PolarHBondContact O-N 2.84Å |
| 254 | P | 89.1 | Confident | 81 | Confident | 123 Ų | 123 | 110.2 Ų | 110.2 | 80% | 0.799 | 55% | 0.55 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 135.1 | 172.7 | -24.2 | 34.2 | 0 | 0 | 0 | 111.2 | D256 | P254-D256 PolarHBondContact O-N 3.45Š|
| 255 | F | 89.7 | Confident | 79.1 | Confident | 73 Ų | 73 | 112.5 Ų | 112.5 | 32% | 0.32 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -76.2 | 122.5 | 174.5 | 172.4 | -106.2 | 0 | 0 | 0 | 110.2 | L241 K244 R245 C248 I253 P257 | L241-F255 HydrophobicContact CD1-CE2 4.39Å; L241-F255 HydrophobicContact CD1-CZ 3.61Å; L241-F255 HydrophobicContact CG-CZ 3.99Å; K244-F255 HydrophobicContact CB-CE2 3.92Å; R245-F255 HydrophobicContact CB-CD2 3.93Å; R245-F255 HydrophobicContact CB-CE2 3.9Å; R245-F255 HydrophobicContact CB-CG 4.38Å; R245-F255 HydrophobicContact CB-CZ 4.33Å; R245-F255 HydrophobicContact CG-CD2 4.35Å; R245-F255 HydrophobicContact CG-CG 4.32Å; C248-F255 HydrophobicContact CB-CB 4.02Å; C248-F255 HydrophobicContact CB-CD2 4.34Å; I253-F255 PolarHBondContact O-N 2.84Å; F255-P257 HydrophobicContact CE1-CB 3.79Å; F255-P257 HydrophobicContact CE1-CG 4.22Å; F255-P257 HydrophobicContact CZ-CB 3.88Å |
| 256 | D | 86.9 | Confident | 77.4 | Confident | 79 Ų | 79 | 112.4 Ų | 112.4 | 42% | 0.422 | 57% | 0.574 | S | S | . | * | trans | -114.3 | 111.8 | 168 | 177.9 | 5 | 0 | 0 | 0 | 109.4 | P254 N258 Y259 | P254-D256 PolarHBondContact O-N 3.45Å; D256-N258 PolarHBondContact O-N 3.14Å; D256-N258 WeakPolarHBondContact OD1-CB 3.36Å; D256-N258 PolarHBondContact OD1-N 2.95Å; D256-Y259 WeakPolarHBondContact O-CB 3.46Å; D256-Y259 PolarHBondContact O-N 3.29Å; D256-Y259 VanDerWaalsContact O-N 3.11Å | ||
| 257 | P | 83 | Confident | 75.8 | Confident | 66 Ų | 66 | 116.3 Ų | 116.3 | 43% | 0.429 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -63.5 | -24 | 179.2 | 26.6 | -34.1 | 0 | 0 | 0 | 112.9 | L241 F255 Y259 | L241-P257 HydrophobicContact CD1-CB 3.97Å; F255-P257 HydrophobicContact CE1-CB 3.79Å; F255-P257 HydrophobicContact CE1-CG 4.22Å; F255-P257 HydrophobicContact CZ-CB 3.88Å; P257-Y259 VanDerWaalsContact C-N 3.33Å |
| 258 | N | 82.4 | Confident | 74 | Confident | 133 Ų | 133 | 122.8 Ų | 122.8 | 71% | 0.711 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.7 | -1.5 | 179.5 | -62.8 | -57.6 | 0 | 0 | 0 | 112.8 | D256 K260 | D256-N258 PolarHBondContact O-N 3.14Å; D256-N258 WeakPolarHBondContact OD1-CB 3.36Å; D256-N258 PolarHBondContact OD1-N 2.95Å; N258-K260 PolarHBondContact O-N 3.14Å |
| 259 | Y | 72.7 | Confident | 72.1 | Confident | 145 Ų | 145 | 129 Ų | 129 | 57% | 0.569 | 65% | 0.647 | S | S | * | * | trans | -66 | 104.2 | 177 | -174.6 | -109.8 | 0 | 0 | 0 | 110.6 | K244 D256 P257 V261 | K244-Y259 PolarHBondContact NZ-O 2.99Å; D256-Y259 WeakPolarHBondContact O-CB 3.46Å; D256-Y259 PolarHBondContact O-N 3.29Å; D256-Y259 VanDerWaalsContact O-N 3.11Å; P257-Y259 VanDerWaalsContact C-N 3.33Å; Y259-V261 HydrophobicContact CD1-CG2 3.95Å; Y259-V261 HydrophobicContact CE1-CB 4.48Å; Y259-V261 HydrophobicContact CE1-CG2 3.59Å; Y259-V261 PolarHBondContact O-N 3.32Å | ||
| 260 | K | 67.7 | Low | 70 | Confident | 180 Ų | 180 | 128.3 Ų | 128.3 | 78% | 0.783 | 65% | 0.653 | S | S | * | * | trans | -84.5 | 103.7 | 169.1 | -66.7 | -176.9 | -179.3 | -179.1 | 0 | 107.5 | N258 R262 | N258-K260 PolarHBondContact O-N 3.14Å; K260-R262 PolarHBondContact O-N 3.2Å | ||
| 261 | V | 60 | Low | 68 | Low | 85 Ų | 85 | 125.9 Ų | 125.9 | 52% | 0.515 | 65% | 0.65 | S | S | . | * | trans | -56.7 | 114.7 | 162.8 | 177.6 | 0 | 0 | 0 | 0 | 106.2 | Y259 V263 | Y259-V261 HydrophobicContact CD1-CG2 3.95Å; Y259-V261 HydrophobicContact CE1-CB 4.48Å; Y259-V261 HydrophobicContact CE1-CG2 3.59Å; Y259-V261 PolarHBondContact O-N 3.32Å; V261-V263 VanDerWaalsContact C-N 3.3Å; V261-V263 HydrophobicContact CG1-CG2 4.12Å; V261-V263 PolarHBondContact O-N 3.22Å | ||
| 262 | R | 62.7 | Low | 65.7 | Low | 217 Ų | 217 | 122.3 Ų | 122.3 | 82% | 0.819 | 65% | 0.651 | S | S | * | * | trans | -68.4 | 96.4 | 166.3 | -74.2 | -166.3 | -91.6 | -124.9 | 1.2 | 106.5 | K260 F264 | K260-R262 PolarHBondContact O-N 3.2Å; R262-F264 PolarHBondContact O-N 3.28Å | ||
| 263 | V | 51.6 | Low | 63.4 | Low | 108 Ų | 108 | 127 Ų | 127 | 66% | 0.655 | 66% | 0.655 | S | S | * | * | trans | -75.1 | 105 | 166.6 | -173.6 | 0 | 0 | 0 | 0 | 105.4 | V261 N265 | V261-V263 VanDerWaalsContact C-N 3.3Å; V261-V263 HydrophobicContact CG1-CG2 4.12Å; V261-V263 PolarHBondContact O-N 3.22Å; V263-N265 PolarHBondContact O-N 3.36Å | ||
| 264 | F | 50.7 | Low | 61.3 | Low | 158 Ų | 158 | 129.7 Ų | 129.7 | 69% | 0.693 | 68% | 0.675 | S | S | * | * | trans | -65.1 | 103.3 | 166.8 | -78.9 | -87 | 0 | 0 | 0 | 107.1 | R262 D266 | R262-F264 PolarHBondContact O-N 3.28Å; F264-D266 PolarHBondContact O-N 3.21Å; F264-D266 VanDerWaalsContact O-N 3.11Å | ||
| 265 | N | 48.4 | Very low | 58.9 | Low | 112 Ų | 112 | 129.6 Ų | 129.6 | 60% | 0.599 | 67% | 0.672 | S | S | * | * | trans | -81.9 | 75 | 169.4 | -98.1 | 2.4 | 0 | 0 | 0 | 108 | V263 N267 Y268 | V263-N265 PolarHBondContact O-N 3.36Å; N265-N267 PolarHBondContact O-N 3.35Å; N265-N267 VanDerWaalsContact O-N 3.07Å; N265-Y268 PolarHBondContact O-N 3.39Å | ||
| 266 | D | 53.5 | Low | 56.7 | Low | 115 Ų | 115 | 131.5 Ų | 131.5 | 62% | 0.615 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -64.6 | -12.6 | 178.6 | -63.9 | -31.4 | 0 | 0 | 0 | 112.3 | F264 | F264-D266 PolarHBondContact O-N 3.21Å; F264-D266 VanDerWaalsContact O-N 3.11Å |
| 267 | N | 55.2 | Low | 54.4 | Low | 154 Ų | 154 | 136.6 Ų | 136.6 | 82% | 0.824 | 71% | 0.714 | S | S | * | * | H | α-helix | trans | -89.2 | -5.4 | -176.4 | -68.8 | -11.9 | 0 | 0 | 0 | 115.6 | N265 | N265-N267 PolarHBondContact O-N 3.35Å; N265-N267 VanDerWaalsContact O-N 3.07Å |
| 268 | Y | 53.7 | Low | 52.6 | Low | 196 Ų | 196 | 139.3 Ų | 139.3 | 77% | 0.769 | 73% | 0.734 | S | S | * | * | H | α-helix | trans | -103.2 | -16.9 | 178.6 | -106.5 | -89.2 | 0 | 0 | 0 | 114.5 | N265 | N265-Y268 PolarHBondContact O-N 3.39Å |
| 269 | L | 49.3 | Very low | 50.8 | Low | 147 Ų | 147 | 139 Ų | 139 | 77% | 0.77 | 74% | 0.737 | S | S | * | * | H | α-helix | trans | -93.2 | -15.9 | -177 | -148.1 | 67.5 | 0 | 0 | 0 | 113.4 | S271 | L269-S271 VanDerWaalsContact C-N 3.33Å; L269-S271 PolarHBondContact O-N 2.87Å |
| 270 | S | 46.5 | Very low | 49.2 | Very low | 113 Ų | 113 | 138.6 Ų | 138.6 | 79% | 0.79 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | -11 | -179 | -117 | 0 | 0 | 0 | 0 | 115 | ||
| 271 | S | 50.4 | Low | 47.9 | Very low | 105 Ų | 105 | 140 Ų | 140 | 73% | 0.734 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.7 | 1.4 | -174.5 | -167.8 | 0 | 0 | 0 | 0 | 114.9 | L269 | L269-S271 VanDerWaalsContact C-N 3.33Å; L269-S271 PolarHBondContact O-N 2.87Å |
| 272 | C | 44.6 | Very low | 47 | Very low | 106 Ų | 106 | 140.6 Ų | 140.6 | 72% | 0.716 | 76% | 0.759 | S | S | * | * | trans | -122.5 | 52.2 | -175 | -55.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 273 | Q | 43.6 | Very low | 46.1 | Very low | 168 Ų | 168 | 137.2 Ų | 137.2 | 79% | 0.785 | 76% | 0.757 | S | S | * | * | trans | -130.7 | 84.9 | 164.5 | -71.9 | -173.1 | 15 | 0 | 0 | 109.2 | ||||
| 274 | T | 45.4 | Very low | 45.6 | Very low | 141 Ų | 141 | 140.7 Ų | 140.7 | 87% | 0.865 | 77% | 0.767 | S | S | * | * | trans | -95.9 | 92.9 | 160.3 | 51.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 275 | T | 39 | Very low | 45.1 | Very low | 120 Ų | 120 | 139 Ų | 139 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | trans | -87.6 | 140.2 | 167 | -16.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 276 | P | 42.6 | Very low | 44.9 | Very low | 114 Ų | 114 | 139.4 Ų | 139.4 | 74% | 0.74 | 78% | 0.781 | S | S | * | * | -135.3 | 126.5 | 125.3 | 31.4 | -17.2 | 0 | 0 | 0 | 112.9 | |||||
| 277 | Q | 40.4 | Very low | 44.5 | Very low | 186 Ų | 186 | 141.9 Ų | 141.9 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | trans | 55.2 | 105.1 | 139.9 | -63 | -176.1 | 4.1 | 0 | 0 | 119.1 | ||||
| 278 | S | 45 | Very low | 44.1 | Very low | 123 Ų | 123 | 140.3 Ų | 140.3 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -133.8 | 123.2 | 144.6 | 56.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 279 | T | 43 | Very low | 43.7 | Very low | 125 Ų | 125 | 138.4 Ų | 138.4 | 77% | 0.767 | 80% | 0.795 | S | S | * | * | trans | -68.6 | 143.1 | -178.6 | 42.8 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 280 | D | 40.7 | Very low | 43.2 | Very low | 138 Ų | 138 | 140.9 Ų | 140.9 | 74% | 0.738 | 80% | 0.8 | S | S | * | * | trans | 53.1 | 115.7 | 149.8 | -62.4 | -28.4 | 0 | 0 | 0 | 120.4 | ||||
| 281 | F | 40.5 | Very low | 43.5 | Very low | 208 Ų | 208 | 140.8 Ų | 140.8 | 91% | 0.912 | 80% | 0.799 | S | S | * | * | -172.9 | 136.4 | 101.7 | -95.9 | -73.7 | 0 | 0 | 0 | 110.7 | |||||
| 282 | S | 40.2 | Very low | 43.4 | Very low | 98 Ų | 98 | 142 Ų | 142 | 69% | 0.685 | 80% | 0.804 | S | S | * | * | trans | -61.3 | 147.4 | -172.8 | -44.2 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 283 | N | 44.3 | Very low | 43.6 | Very low | 146 Ų | 146 | 145.1 Ų | 145.1 | 78% | 0.781 | 81% | 0.813 | S | S | * | * | 171.3 | 118.7 | 116.9 | -81.2 | -26.2 | 0 | 0 | 0 | 112.5 | |||||
| 284 | E | 40.7 | Very low | 43.9 | Very low | 182 Ų | 182 | 141.3 Ų | 141.3 | 85% | 0.85 | 81% | 0.809 | S | S | * | * | trans | 62.4 | 113.4 | 138.2 | -54.2 | -78.5 | 104.4 | 0 | 0 | 120.7 | ||||
| 285 | C | 39.6 | Very low | 43.5 | Very low | 123 Ų | 123 | 140.4 Ų | 140.4 | 83% | 0.831 | 81% | 0.808 | S | S | * | * | trans | -71.8 | -171.3 | 164.2 | -57.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 286 | P | 45 | Very low | 43.9 | Very low | 119 Ų | 119 | 139.9 Ų | 139.9 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | cis | -133.4 | 173 | -12.5 | 16.4 | 10.4 | 0 | 0 | 0 | 115 | ||||
| 287 | L | 45.4 | Very low | 43.8 | Very low | 168 Ų | 168 | 141.7 Ų | 141.7 | 88% | 0.88 | 81% | 0.812 | S | S | * | * | trans | -29.4 | 157.8 | 169.9 | -59.5 | 165 | 0 | 0 | 0 | 117.2 | ||||
| 288 | P | 46.2 | Very low | 44.1 | Very low | 120 Ų | 120 | 140.7 Ų | 140.7 | 78% | 0.779 | 81% | 0.808 | S | S | * | * | -148.5 | 151.2 | 109 | 37.1 | -19.9 | 0 | 0 | 0 | 117.5 | |||||
| 289 | D | 44.6 | Very low | 43.9 | Very low | 157 Ų | 157 | 141.2 Ų | 141.2 | 84% | 0.84 | 81% | 0.806 | S | S | * | * | trans | 59.1 | 131 | 139.9 | -96.8 | -31.3 | 0 | 0 | 0 | 125.1 | ||||
| 290 | F | 38.7 | Very low | 44.3 | Very low | 199 Ų | 199 | 142 Ų | 142 | 87% | 0.873 | 81% | 0.805 | S | S | * | * | trans | -68 | 147 | 167.1 | -86.1 | -101.6 | 0 | 0 | 0 | 111.9 | ||||
| 291 | S | 54.4 | Low | 44.5 | Very low | 110 Ų | 110 | 142.1 Ų | 142.1 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | -139.7 | 124.2 | 155.7 | -69.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 292 | P | 47.1 | Very low | 44.6 | Very low | 130 Ų | 130 | 136.6 Ų | 136.6 | 84% | 0.844 | 79% | 0.793 | S | S | * | * | trans | -79.4 | 125.5 | 178.1 | 30.2 | -29.4 | 0 | 0 | 0 | 110.2 | A294 | P292-A294 PolarHBondContact O-N 3.32Š| ||
| 293 | I | 48.8 | Very low | 44.7 | Very low | 173 Ų | 173 | 139.1 Ų | 139.1 | 89% | 0.887 | 80% | 0.798 | S | S | * | * | trans | -69.5 | 114.6 | 174.4 | -65.6 | 172.4 | 0 | 0 | 0 | 108.9 | ||||
| 294 | A | 50.6 | Low | 45.4 | Very low | 87 Ų | 87 | 138.3 Ų | 138.3 | 72% | 0.719 | 80% | 0.799 | S | S | * | * | trans | -70.1 | 140.8 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | P292 S296 | P292-A294 PolarHBondContact O-N 3.32Å; A294-S296 PolarHBondContact O-N 3.39Å | ||
| 295 | C | 36.9 | Very low | 46.4 | Very low | 122 Ų | 122 | 135.2 Ų | 135.2 | 82% | 0.824 | 79% | 0.794 | S | S | * | * | trans | -56.4 | 125.9 | 175.3 | -69.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 296 | S | 47.3 | Very low | 47.3 | Very low | 109 Ų | 109 | 139.7 Ų | 139.7 | 76% | 0.762 | 80% | 0.795 | S | S | * | * | trans | -96.7 | 107.9 | 155.6 | -83.2 | 0 | 0 | 0 | 0 | 109.1 | A294 Q298 | A294-S296 PolarHBondContact O-N 3.39Å; S296-Q298 PolarHBondContact O-N 3.22Å | ||
| 297 | N | 39.5 | Very low | 48.4 | Very low | 153 Ų | 153 | 139.2 Ų | 139.2 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -69.9 | 114.1 | 162.8 | -70.9 | -34.5 | 0 | 0 | 0 | 108.3 | ||||
| 298 | Q | 47.4 | Very low | 49.3 | Very low | 165 Ų | 165 | 136.9 Ų | 136.9 | 77% | 0.771 | 79% | 0.787 | S | S | * | * | trans | -120 | 101.4 | 158.3 | -69.9 | -167.3 | 35.7 | 0 | 0 | 108.5 | S296 L300 | S296-Q298 PolarHBondContact O-N 3.22Å; Q298-L300 PolarHBondContact O-N 3.34Å | ||
| 299 | T | 41.7 | Very low | 50 | Low | 134 Ų | 134 | 139.1 Ų | 139.1 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | trans | -63 | 111.8 | 161.8 | 41.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 300 | L | 50.7 | Low | 50.8 | Low | 141 Ų | 141 | 137 Ų | 137 | 74% | 0.738 | 78% | 0.783 | S | S | * | * | trans | -142.1 | 109 | 159.5 | -75.7 | 178.1 | 0 | 0 | 0 | 111.1 | Q298 | Q298-L300 PolarHBondContact O-N 3.34Š| ||
| 301 | N | 44.7 | Very low | 51.2 | Low | 140 Ų | 140 | 135.8 Ų | 135.8 | 75% | 0.749 | 78% | 0.781 | S | S | * | * | trans | 59.5 | 101 | 139 | -69.4 | -15.1 | 0 | 0 | 0 | 121.7 | ||||
| 302 | S | 42.3 | Very low | 51.1 | Low | 93 Ų | 93 | 139.8 Ų | 139.8 | 65% | 0.65 | 78% | 0.784 | S | S | * | * | 25.6 | 138.3 | 117.3 | 56.3 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 303 | N | 42.5 | Very low | 51.2 | Low | 150 Ų | 150 | 139 Ų | 139 | 80% | 0.802 | 78% | 0.782 | S | S | * | * | trans | 87.9 | 86.1 | 154.6 | -61.4 | -26 | 0 | 0 | 0 | 118.4 | ||||
| 304 | V | 58.6 | Low | 51.4 | Low | 130 Ų | 130 | 133.8 Ų | 133.8 | 79% | 0.788 | 77% | 0.771 | S | S | * | * | trans | -129.2 | 111.1 | 145.3 | -176.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 305 | P | 62 | Low | 51.3 | Low | 117 Ų | 117 | 137.8 Ų | 137.8 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 126.2 | 173.5 | -5.5 | 22.7 | 0 | 0 | 0 | 110.3 | ||
| 306 | Y | 58.5 | Low | 52.1 | Low | 217 Ų | 217 | 137.7 Ų | 137.7 | 85% | 0.851 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 140.3 | 165.4 | -80.3 | -87.8 | 0 | 0 | 0 | 110.1 | ||
| 307 | P | 69.3 | Low | 52.4 | Low | 109 Ų | 109 | 139.9 Ų | 139.9 | 71% | 0.708 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 148.3 | 175.4 | 30.1 | -33.5 | 0 | 0 | 0 | 111.5 | ||
| 308 | P | 64.1 | Low | 53.1 | Low | 118 Ų | 118 | 139.3 Ų | 139.3 | 77% | 0.766 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 138.8 | -179.1 | 29.6 | -32.7 | 0 | 0 | 0 | 111.4 | T310 | P308-T310 PolarHBondContact O-N 2.83Š|
| 309 | I | 60.2 | Low | 53.4 | Low | 168 Ų | 168 | 137.9 Ų | 137.9 | 86% | 0.862 | 82% | 0.822 | S | S | * | * | trans | -78.3 | 106.6 | 173.8 | -43.1 | 171.2 | 0 | 0 | 0 | 106.9 | E311 | I309-E311 PolarHBondContact O-N 3.1Š| ||
| 310 | T | 60.8 | Low | 54 | Low | 112 Ų | 112 | 138.1 Ų | 138.1 | 69% | 0.687 | 82% | 0.822 | S | S | * | * | trans | -74.1 | 114.3 | 174.7 | -47.1 | 0 | 0 | 0 | 0 | 109.4 | P308 F312 | P308-T310 PolarHBondContact O-N 2.83Å; T310-F312 PolarHBondContact O-N 3.25Å | ||
| 311 | E | 48.7 | Very low | 54.2 | Low | 174 Ų | 174 | 137.9 Ų | 137.9 | 81% | 0.813 | 83% | 0.827 | S | S | * | * | trans | -65.6 | 112.1 | 168.7 | -63.6 | -174.7 | 174.5 | 0 | 0 | 109.9 | I309 | I309-E311 PolarHBondContact O-N 3.1Š| ||
| 312 | F | 51.6 | Low | 54.8 | Low | 194 Ų | 194 | 137.8 Ų | 137.8 | 85% | 0.851 | 83% | 0.832 | S | S | * | * | trans | -92.9 | 95.9 | 164.2 | -114.4 | -88.2 | 0 | 0 | 0 | 108.7 | T310 G314 | T310-F312 PolarHBondContact O-N 3.25Å; F312-G314 PolarHBondContact O-N 3.41Å; F312-G314 VanDerWaalsContact O-N 3.14Å | ||
| 313 | S | 49.5 | Very low | 55.6 | Low | 114 Ų | 114 | 140.8 Ų | 140.8 | 80% | 0.797 | 84% | 0.844 | S | S | * | * | trans | -66.1 | 101.8 | 160.7 | -76.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 314 | G | 52.9 | Low | 56.6 | Low | 63 Ų | 63 | 140.1 Ų | 140.1 | 65% | 0.649 | 85% | 0.847 | S | S | * | * | trans | -108.1 | 83 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | F312 | F312-G314 PolarHBondContact O-N 3.41Å; F312-G314 VanDerWaalsContact O-N 3.14Å | ||
| 315 | N | 47.7 | Very low | 56.4 | Low | 171 Ų | 171 | 140.9 Ų | 140.9 | 91% | 0.914 | 85% | 0.851 | S | S | * | * | trans | -64.9 | 125.1 | 166.1 | -131.3 | 16.1 | 0 | 0 | 0 | 108.1 | ||||
| 316 | C | 53.9 | Low | 56 | Low | 120 Ų | 120 | 142.9 Ų | 142.9 | 81% | 0.811 | 86% | 0.859 | S | S | * | * | trans | -130.7 | 106.7 | 172.9 | -51.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 317 | G | 54.5 | Low | 55.7 | Low | 155 Ų | 155 | 136.2 Ų | 136.2 | 100% | 1.598 | 86% | 0.86 | S | S | * | * | trans | -89.5 | 0 | 152.7 | 0 | 0 | 0 | 0 | 0 | 111.2 |
Retrieved 317 of 317 residues in 325 ms
(Link to these results)