| 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 | 61.2 | Low | 52.4 | Low | 229 Ų | 229 | 161.1 Ų | 161.1 | 100% | 1.128 | 82% | 0.816 | S | S | * | * | 0 | 131.2 | 0 | -78.7 | 82.8 | 175.9 | 0 | 0 | 108.8 | |||||
| 2 | M | 44.4 | Very low | 51.9 | Low | 152 Ų | 152 | 157.9 Ų | 157.9 | 75% | 0.749 | 81% | 0.811 | S | S | * | * | trans | -175.6 | 95.3 | 140.7 | -114.9 | 90.4 | 85 | 0 | 0 | 106.9 | Y4 | M2-Y4 HydrophobicContact CB-CE2 3.96Å; M2-Y4 HydrophobicContact CG-CE2 4.3Å | ||
| 3 | S | 47.3 | Very low | 51.6 | Low | 119 Ų | 119 | 157.5 Ų | 157.5 | 83% | 0.832 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 120.5 | 172.9 | 46.7 | 0 | 0 | 0 | 0 | 109.4 | ||
| 4 | Y | 59.5 | Low | 51.8 | Low | 206 Ų | 206 | 151.6 Ų | 151.6 | 81% | 0.808 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -101.4 | 126.5 | 169.6 | -73.4 | -78.4 | 0 | 0 | 0 | 111.6 | M2 | M2-Y4 HydrophobicContact CB-CE2 3.96Å; M2-Y4 HydrophobicContact CG-CE2 4.3Å |
| 5 | L | 56.9 | Low | 51.7 | Low | 155 Ų | 155 | 152.5 Ų | 152.5 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 128.8 | -169.1 | -168.8 | 65 | 0 | 0 | 0 | 111.2 | Q7 | L5-Q7 PolarHBondContact O-N 3.02Š|
| 6 | K | 49.1 | Very low | 51.3 | Low | 203 Ų | 203 | 149.4 Ų | 149.4 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | trans | -63.9 | 110.5 | 174.1 | -178.7 | 164.7 | 169.8 | 172.1 | 0 | 110.4 | ||||
| 7 | Q | 45.7 | Very low | 51.4 | Low | 139 Ų | 139 | 150.4 Ų | 150.4 | 65% | 0.65 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 132.5 | 166 | -73 | -93.6 | -27.8 | 0 | 0 | 109.2 | L5 | L5-Q7 PolarHBondContact O-N 3.02Š|
| 8 | P | 58.1 | Low | 51.2 | Low | 103 Ų | 103 | 148.3 Ų | 148.3 | 67% | 0.669 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 146.4 | 170.5 | 28.8 | -30.6 | 0 | 0 | 0 | 111 | ||
| 9 | P | 55.7 | Low | 50.9 | Low | 123 Ų | 123 | 146.8 Ų | 146.8 | 80% | 0.799 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 132.3 | -178.6 | 27.8 | -32.9 | 0 | 0 | 0 | 111.4 | ||
| 10 | Y | 43.4 | Very low | 50.7 | Low | 204 Ų | 204 | 145 Ų | 145 | 80% | 0.8 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 139.9 | 169.1 | -72.7 | -92.1 | 0 | 0 | 0 | 111.1 | ||
| 11 | T | 55.7 | Low | 50.8 | Low | 139 Ų | 139 | 141.3 Ų | 141.3 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 121.6 | 175.1 | 49.8 | 0 | 0 | 0 | 0 | 110.1 | ||
| 12 | V | 45.4 | Very low | 50.2 | Low | 123 Ų | 123 | 136.7 Ų | 136.7 | 75% | 0.745 | 77% | 0.771 | S | S | * | * | trans | -115.2 | 127.1 | 162.9 | 151.3 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 13 | N | 48.9 | Very low | 50.2 | Low | 153 Ų | 153 | 136.6 Ų | 136.6 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | S | Bend | trans | 61.9 | 79.5 | 170.1 | -62.3 | 2 | 0 | 0 | 0 | 114.5 | L15 | N13-L15 PolarHBondContact O-N 2.98Å; N13-L15 VanDerWaalsContact O-N 3.08Å |
| 14 | G | 54.3 | Low | 50.6 | Low | 74 Ų | 74 | 138.3 Ų | 138.3 | 76% | 0.763 | 77% | 0.772 | S | S | * | * | trans | -57.4 | 106 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 15 | L | 49.8 | Very low | 50.2 | Low | 165 Ų | 165 | 135.8 Ų | 135.8 | 86% | 0.864 | 77% | 0.772 | S | S | * | * | trans | -146.4 | 77.2 | 142.8 | -75 | 179.5 | 0 | 0 | 0 | 107.5 | N13 L17 | N13-L15 PolarHBondContact O-N 2.98Å; N13-L15 VanDerWaalsContact O-N 3.08Å; L15-L17 PolarHBondContact O-N 3.47Å | ||
| 16 | S | 45.9 | Very low | 49.7 | Very low | 104 Ų | 104 | 135.8 Ų | 135.8 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | trans | -83.7 | 97.6 | 166.7 | -173.6 | 0 | 0 | 0 | 0 | 108.5 | T18 | S16-T18 PolarHBondContact O-N 2.96Š| ||
| 17 | L | 52.5 | Low | 49.9 | Very low | 166 Ų | 166 | 132.1 Ų | 132.1 | 87% | 0.869 | 77% | 0.765 | S | S | * | * | trans | -88.7 | 78.5 | 166.7 | -75.7 | 168.4 | 0 | 0 | 0 | 109.1 | L15 | L15-L17 PolarHBondContact O-N 3.47Š| ||
| 18 | T | 48.8 | Very low | 50.1 | Low | 113 Ų | 113 | 129.6 Ų | 129.6 | 69% | 0.693 | 76% | 0.762 | S | S | * | * | trans | -142.8 | 106.7 | 160.6 | 60.4 | 0 | 0 | 0 | 0 | 108.8 | S16 | S16-T18 PolarHBondContact O-N 2.96Š| ||
| 19 | T | 44 | Very low | 50 | Low | 120 Ų | 120 | 129.4 Ų | 129.4 | 74% | 0.736 | 76% | 0.759 | S | S | * | * | trans | 179.8 | 132 | 137.5 | -176 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 20 | S | 47.1 | Very low | 49.8 | Very low | 110 Ų | 110 | 127.4 Ų | 127.4 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | trans | -72.9 | 131.2 | 171.7 | 179.6 | 0 | 0 | 0 | 0 | 109.5 | M22 | S20-M22 WeakPolarHBondContact O-CE 3.4Š| ||
| 21 | G | 52.6 | Low | 50.3 | Low | 68 Ų | 68 | 127 Ų | 127 | 70% | 0.701 | 76% | 0.759 | S | S | * | * | trans | 40.8 | 107.3 | 151.5 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 22 | M | 49.7 | Very low | 50.3 | Low | 132 Ų | 132 | 126 Ų | 126 | 65% | 0.65 | 76% | 0.755 | S | S | * | * | trans | -163.7 | 121.4 | 149.5 | 44.6 | -65.8 | -79.6 | 0 | 0 | 111 | S20 | S20-M22 WeakPolarHBondContact O-CE 3.4Š| ||
| 23 | D | 43.8 | Very low | 51.1 | Low | 150 Ų | 150 | 124.4 Ų | 124.4 | 80% | 0.802 | 76% | 0.755 | S | S | * | * | trans | 76.1 | 111.5 | 147.7 | -72.3 | -75.4 | 0 | 0 | 0 | 123.7 | ||||
| 24 | L | 55 | Low | 51.9 | Low | 154 Ų | 154 | 122.8 Ų | 122.8 | 81% | 0.806 | 75% | 0.75 | S | S | * | * | trans | -26.8 | 155.2 | 136.7 | -80.5 | 129.3 | 0 | 0 | 0 | 115.2 | ||||
| 25 | L | 52.6 | Low | 52.4 | Low | 153 Ų | 153 | 125.2 Ų | 125.2 | 80% | 0.801 | 75% | 0.753 | S | S | * | * | trans | 103.1 | 77.5 | 160.2 | -49.5 | -175.6 | 0 | 0 | 0 | 116.7 | ||||
| 26 | H | 45.2 | Very low | 53.1 | Low | 155 Ų | 155 | 128.8 Ų | 128.8 | 72% | 0.718 | 76% | 0.755 | S | S | * | * | trans | -153.5 | 94.1 | 143.6 | -148.8 | -109.8 | 0 | 0 | 0 | 112.7 | S28 | H26-S28 PolarHBondContact CE1-OG 3.28Å; H26-S28 PolarHBondContact ND1-OG 3.05Å | ||
| 27 | P | 52.7 | Low | 54.1 | Low | 127 Ų | 127 | 133.7 Ų | 133.7 | 83% | 0.825 | 76% | 0.763 | S | S | * | * | trans | -102.3 | 80.2 | 170 | 35.1 | -24 | 0 | 0 | 0 | 110.1 | ||||
| 28 | S | 51.8 | Low | 55.3 | Low | 86 Ų | 86 | 133.6 Ų | 133.6 | 60% | 0.601 | 76% | 0.758 | S | S | * | * | trans | -157.3 | 7.3 | 172.9 | 59.4 | 0 | 0 | 0 | 0 | 117.7 | H26 | H26-S28 PolarHBondContact CE1-OG 3.28Å; H26-S28 PolarHBondContact ND1-OG 3.05Å | ||
| 29 | V | 54.9 | Low | 57 | Low | 99 Ų | 99 | 137.7 Ų | 137.7 | 60% | 0.6 | 76% | 0.761 | S | S | * | * | trans | -122.4 | 88.2 | 172.5 | -159.8 | 0 | 0 | 0 | 0 | 109.6 | Y31 | V29-Y31 HydrophobicContact CB-CE2 4.49Å; V29-Y31 HydrophobicContact CG1-CD2 3.88Å; V29-Y31 HydrophobicContact CG1-CE2 3.61Å; V29-Y31 PolarHBondContact O-N 3.48Å | ||
| 30 | G | 50.9 | Low | 58.8 | Low | 80 Ų | 80 | 142.4 Ų | 142.4 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | trans | -67.1 | 77.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 31 | Y | 54.8 | Low | 60.9 | Low | 196 Ų | 196 | 144.2 Ų | 144.2 | 77% | 0.769 | 76% | 0.761 | S | S | * | * | trans | -68.4 | 127.5 | 153 | -77 | -84.7 | 0 | 0 | 0 | 107 | V29 A33 | V29-Y31 HydrophobicContact CB-CE2 4.49Å; V29-Y31 HydrophobicContact CG1-CD2 3.88Å; V29-Y31 HydrophobicContact CG1-CE2 3.61Å; V29-Y31 PolarHBondContact O-N 3.48Å; Y31-A33 VanDerWaalsContact C-N 3.31Å; Y31-A33 PolarHBondContact O-N 3.49Å | ||
| 32 | P | 56.2 | Low | 62.8 | Low | 118 Ų | 118 | 150.8 Ų | 150.8 | 77% | 0.766 | 77% | 0.765 | S | S | * | * | trans | -61.9 | 102.3 | 170.2 | 25.8 | -31.2 | 0 | 0 | 0 | 106.6 | T34 | P32-T34 PolarHBondContact O-N 2.94Š| ||
| 33 | A | 62.5 | Low | 64.9 | Low | 90 Ų | 90 | 146 Ų | 146 | 74% | 0.744 | 74% | 0.743 | S | S | * | * | trans | -52.7 | 111.8 | 168.9 | 0 | 0 | 0 | 0 | 0 | 105.8 | Y31 P35 | Y31-A33 VanDerWaalsContact C-N 3.31Å; Y31-A33 PolarHBondContact O-N 3.49Å; A33-P35 VanDerWaalsContact O-N 3.11Å | ||
| 34 | T | 64.9 | Low | 67.4 | Low | 119 Ų | 119 | 144.7 Ų | 144.7 | 73% | 0.73 | 74% | 0.741 | S | S | * | * | trans | -47.3 | 124.1 | 176.2 | 48.5 | 0 | 0 | 0 | 0 | 107.2 | P32 R36 | P32-T34 PolarHBondContact O-N 2.94Å; T34-R36 PolarHBondContact O-N 3.18Å | ||
| 35 | P | 63.7 | Low | 69.4 | Low | 125 Ų | 125 | 139.9 Ų | 139.9 | 81% | 0.812 | 71% | 0.714 | S | S | * | * | trans | -60.1 | 110.6 | -173.7 | 21.2 | -30.8 | 0 | 0 | 0 | 107.2 | A33 K37 | A33-P35 VanDerWaalsContact O-N 3.11Å; P35-K37 PolarHBondContact O-N 3.44Å | ||
| 36 | R | 65.4 | Low | 71.6 | Confident | 240 Ų | 240 | 136.4 Ų | 136.4 | 91% | 0.906 | 70% | 0.699 | S | S | * | * | trans | -53.9 | 115.1 | 176.5 | -65.5 | -167.7 | -157.4 | 112.4 | 0.5 | 106.1 | T34 Q38 | T34-R36 PolarHBondContact O-N 3.18Å; R36-Q38 PolarHBondContact O-N 3.03Å | ||
| 37 | K | 67.6 | Low | 74.1 | Confident | 207 Ų | 207 | 136.9 Ų | 136.9 | 90% | 0.9 | 69% | 0.694 | S | S | * | * | trans | -43.5 | 104.8 | -173.4 | -136.3 | 161.3 | -178.1 | 174 | 0 | 109.3 | P35 R39 | P35-K37 PolarHBondContact O-N 3.44Å; K37-R39 PolarHBondContact O-N 3.42Å | ||
| 38 | Q | 77.2 | Confident | 76.3 | Confident | 164 Ų | 164 | 134 Ų | 134 | 77% | 0.766 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 116.9 | 178.4 | -176 | 75 | 22 | 0 | 0 | 107.2 | R36 R40 | R36-Q38 PolarHBondContact O-N 3.03Å; Q38-R40 PolarHBondContact O-N 2.89Å |
| 39 | R | 84.2 | Confident | 78.5 | Confident | 198 Ų | 198 | 131.3 Ų | 131.3 | 75% | 0.747 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 124.7 | 179.4 | -179.7 | 171.3 | 174.6 | -118.9 | 5.7 | 107.7 | K37 E41 | K37-R39 PolarHBondContact O-N 3.42Å; R39-E41 PolarHBondContact O-N 3.48Å |
| 40 | R | 82.1 | Confident | 80.6 | Confident | 220 Ų | 220 | 128.7 Ų | 128.7 | 83% | 0.83 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 135.9 | 176.1 | -73.6 | 179.7 | 178.7 | 177.7 | -1.4 | 109.5 | Q38 | Q38-R40 PolarHBondContact O-N 2.89Š|
| 41 | E | 90.2 | Very high | 82.9 | Confident | 148 Ų | 148 | 128.1 Ų | 128.1 | 69% | 0.692 | 62% | 0.619 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 139.9 | 178.1 | -64.8 | -58 | 154.7 | 0 | 0 | 111.7 | R39 R81 | R39-E41 PolarHBondContact O-N 3.48Å; E41-R81 PolarHBondContact O-NH1 3.12Å; E41-R81 PolarHBondContact O-NH2 3.39Å |
| 42 | R | 93.6 | Very high | 84.9 | Confident | 205 Ų | 205 | 120.7 Ų | 120.7 | 77% | 0.774 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 135.7 | -179.2 | -171.5 | 178.8 | -176.3 | 179.9 | 1.8 | 109.4 | ||
| 43 | T | 94.3 | Very high | 86.9 | Confident | 32 Ų | 32 | 115.1 Ų | 115.1 | 20% | 0.196 | 56% | 0.558 | C | S | . | * | P | Polyproline II helix | trans | -84.6 | 129.5 | 172.3 | -56.8 | 0 | 0 | 0 | 0 | 108.8 | F45 L77 R81 | T43-F45 HydrophobicContact CG2-CE1 4.35Å; T43-F45 HydrophobicContact CG2-CZ 4.41Å; T43-L77 HydrophobicContact CG2-CD1 4.27Å; T43-L77 HydrophobicContact CG2-CD2 3.79Å; T43-R81 VanDerWaalsContact OG1-CD 3.23Å; T43-R81 WeakPolarHBondContact OG1-CD 3.44Å; T43-R81 PolarHBondContact OG1-NE 3.48Å; T43-R81 PolarHBondContact OG1-NH1 3.42Å |
| 44 | T | 96.1 | Very high | 88.6 | Confident | 123 Ų | 123 | 113.8 Ų | 113.8 | 76% | 0.755 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -103.1 | 125.7 | 166.6 | -57.9 | 0 | 0 | 0 | 0 | 107.7 | ||
| 45 | F | 97.3 | Very high | 90.2 | Very high | 53 Ų | 53 | 110.8 Ų | 110.8 | 23% | 0.232 | 52% | 0.524 | C | S | . | . | P | Polyproline II helix | trans | -86.1 | 137.2 | -179.4 | -59.5 | -88.3 | 0 | 0 | 0 | 109.9 | T43 L50 L53 L77 W85 | T43-F45 HydrophobicContact CG2-CE1 4.35Å; T43-F45 HydrophobicContact CG2-CZ 4.41Å; F45-L50 HydrophobicContact CB-CD1 4.5Å; F45-L50 HydrophobicContact CB-CD2 3.73Å; F45-L50 HydrophobicContact CB-CG 3.85Å; F45-L50 HydrophobicContact CD2-CD2 4.46Å; F45-L50 HydrophobicContact CG-CD2 4.12Å; F45-L53 HydrophobicContact CD1-CD1 4.01Å; F45-L53 HydrophobicContact CE1-CD1 4.08Å; F45-L77 HydrophobicContact CD1-CD1 3.47Å; F45-L77 VanDerWaalsContact CD1-CD1 3.47Å; F45-L77 HydrophobicContact CE1-CD1 3.39Å; F45-W85 AromaticContact CE2-CD1 3.72Å; F45-W85 HydrophobicContact CZ-CB 4.04Å; F45-W85 AromaticContact CZ-CD1 3.8Å; F45-W85 HydrophobicContact CZ-CG 4.29Å |
| 46 | T | 98.4 | Very high | 91.9 | Very high | 79 Ų | 79 | 105.8 Ų | 105.8 | 49% | 0.485 | 49% | 0.49 | S | S | . | . | P | Polyproline II helix | trans | -75.2 | 164.6 | 169.2 | 75.8 | 0 | 0 | 0 | 0 | 110.3 | A48 Q49 L50 | T46-A48 PolarHBondContact O-N 3.42Å; T46-Q49 PolarHBondContact O-N 3.45Å; T46-Q49 VanDerWaalsContact OG1-CG 3.26Å; T46-Q49 WeakPolarHBondContact OG1-CG 3.47Å; T46-L50 WeakPolarHBondContact O-CG 3.49Å; T46-L50 PolarHBondContact O-N 3.23Å; T46-L50 VanDerWaalsContact O-N 3.11Å |
| 47 | R | 98 | Very high | 93.4 | Very high | 166 Ų | 166 | 95.6 Ų | 95.6 | 63% | 0.626 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -60 | -47.6 | -179.2 | -178 | 62.9 | -163.4 | -167.7 | 6 | 112.3 | Q49 L50 D51 | R47-Q49 VanDerWaalsContact C-N 3.27Å; R47-Q49 PolarHBondContact O-N 2.79Å; R47-L50 WeakPolarHBondContact O-CB 3.28Å; R47-L50 PolarHBondContact O-N 3.19Å; R47-D51 IonicContact CZ-OD1 3.02Å; R47-D51 IonicContact NE-OD1 3.71Å; R47-D51 PolarHBondContact NE-OD1 3.15Å; R47-D51 IonicContact NE-OD2 3.38Å; R47-D51 IonicContact NH2-OD1 2.98Å; R47-D51 PolarHBondContact NH2-OD1 3.03Å; R47-D51 PolarHBondContact O-N 3.09Å |
| 48 | A | 98.1 | Very high | 94.9 | Very high | 65 Ų | 65 | 90 Ų | 90 | 54% | 0.537 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.1 | -37.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | T46 D51 V52 | T46-A48 PolarHBondContact O-N 3.42Å; A48-D51 PolarHBondContact O-N 2.77Å; A48-V52 WeakPolarHBondContact O-CG2 3.49Å; A48-V52 PolarHBondContact O-N 3.39Å |
| 49 | Q | 98.4 | Very high | 95.9 | Very high | 30 Ų | 30 | 90.5 Ų | 90.5 | 14% | 0.14 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -66.2 | -41.1 | 175.7 | -63.7 | 175.2 | -32.2 | 0 | 0 | 111.5 | T46 R47 D51 V52 L53 I75 | T46-Q49 PolarHBondContact O-N 3.45Å; T46-Q49 VanDerWaalsContact OG1-CG 3.26Å; T46-Q49 WeakPolarHBondContact OG1-CG 3.47Å; R47-Q49 VanDerWaalsContact C-N 3.27Å; R47-Q49 PolarHBondContact O-N 2.79Å; Q49-D51 VanDerWaalsContact C-N 3.35Å; Q49-V52 PolarHBondContact O-N 3.11Å; Q49-L53 WeakPolarHBondContact O-CD1 3.34Å; Q49-L53 VanDerWaalsContact O-CG 3.27Å; Q49-L53 WeakPolarHBondContact O-CG 3.38Å; Q49-L53 PolarHBondContact O-N 3.25Å; Q49-L53 VanDerWaalsContact O-N 3.09Å; Q49-I75 HydrophobicContact CB-CB 4.34Å; Q49-I75 HydrophobicContact CG-CB 4Å; Q49-I75 HydrophobicContact CG-CG2 4.49Å; Q49-I75 PolarHBondContact NE2-O 3.48Å |
| 50 | L | 98.5 | Very high | 96.5 | Very high | 44 Ų | 44 | 83 Ų | 83 | 23% | 0.23 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.2 | -41 | 175.3 | -67.8 | 174.2 | 0 | 0 | 0 | 111.6 | F45 T46 R47 V52 L53 E54 W85 | F45-L50 HydrophobicContact CB-CD1 4.5Å; F45-L50 HydrophobicContact CB-CD2 3.73Å; F45-L50 HydrophobicContact CB-CG 3.85Å; F45-L50 HydrophobicContact CD2-CD2 4.46Å; F45-L50 HydrophobicContact CG-CD2 4.12Å; T46-L50 WeakPolarHBondContact O-CG 3.49Å; T46-L50 PolarHBondContact O-N 3.23Å; T46-L50 VanDerWaalsContact O-N 3.11Å; R47-L50 WeakPolarHBondContact O-CB 3.28Å; R47-L50 PolarHBondContact O-N 3.19Å; L50-V52 VanDerWaalsContact C-N 3.33Å; L50-V52 PolarHBondContact O-N 3.27Å; L50-L53 PolarHBondContact O-N 3.38Å; L50-E54 WeakPolarHBondContact O-CB 3.27Å; L50-E54 WeakPolarHBondContact O-CG 3.48Å; L50-E54 PolarHBondContact O-N 3.44Å; L50-W85 HydrophobicContact CD2-CZ2 4.38Å |
| 51 | D | 98.4 | Very high | 97.2 | Very high | 69 Ų | 69 | 79 Ų | 79 | 37% | 0.369 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.3 | -40.9 | 179.9 | -61.9 | -34.3 | 0 | 0 | 0 | 111.2 | R47 A48 Q49 E54 A55 | R47-D51 IonicContact CZ-OD1 3.02Å; R47-D51 IonicContact NE-OD1 3.71Å; R47-D51 PolarHBondContact NE-OD1 3.15Å; R47-D51 IonicContact NE-OD2 3.38Å; R47-D51 IonicContact NH2-OD1 2.98Å; R47-D51 PolarHBondContact NH2-OD1 3.03Å; R47-D51 PolarHBondContact O-N 3.09Å; A48-D51 PolarHBondContact O-N 2.77Å; Q49-D51 VanDerWaalsContact C-N 3.35Å; D51-E54 PolarHBondContact O-N 2.86Å; D51-A55 VanDerWaalsContact O-CB 3.28Å; D51-A55 WeakPolarHBondContact O-CB 3.48Å; D51-A55 PolarHBondContact O-N 3.35Å |
| 52 | V | 98.3 | Very high | 97.6 | Very high | 40 Ų | 40 | 78.6 Ų | 78.6 | 24% | 0.242 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63.7 | -44.7 | 173.7 | 176.4 | 0 | 0 | 0 | 0 | 111.6 | A48 Q49 L50 A55 L56 V71 K74 I75 | A48-V52 WeakPolarHBondContact O-CG2 3.49Å; A48-V52 PolarHBondContact O-N 3.39Å; Q49-V52 PolarHBondContact O-N 3.11Å; L50-V52 VanDerWaalsContact C-N 3.33Å; L50-V52 PolarHBondContact O-N 3.27Å; V52-A55 PolarHBondContact O-N 3.49Å; V52-L56 PolarHBondContact O-N 2.89Å; V52-V71 HydrophobicContact CG1-CG1 4.05Å; V52-K74 HydrophobicContact CG1-CD 4.31Å; V52-I75 HydrophobicContact CB-CG2 4Å; V52-I75 HydrophobicContact CG1-CG2 3.94Å; V52-I75 HydrophobicContact CG2-CG2 4.32Å |
| 53 | L | 98.6 | Very high | 97.8 | Very high | 0 Ų | 0 | 69.2 Ų | 69.2 | 0% | 0 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.7 | -40.5 | 179.1 | -71.5 | 166.6 | 0 | 0 | 0 | 111.9 | F45 Q49 L50 L56 F57 V71 I75 V82 W85 F86 | F45-L53 HydrophobicContact CD1-CD1 4.01Å; F45-L53 HydrophobicContact CE1-CD1 4.08Å; Q49-L53 WeakPolarHBondContact O-CD1 3.34Å; Q49-L53 VanDerWaalsContact O-CG 3.27Å; Q49-L53 WeakPolarHBondContact O-CG 3.38Å; Q49-L53 PolarHBondContact O-N 3.25Å; Q49-L53 VanDerWaalsContact O-N 3.09Å; L50-L53 PolarHBondContact O-N 3.38Å; L53-L56 PolarHBondContact O-N 3.45Å; L53-F57 WeakPolarHBondContact O-CB 3.47Å; L53-F57 PolarHBondContact O-N 3.05Å; L53-V71 HydrophobicContact CD2-CG1 3.91Å; L53-I75 HydrophobicContact CD1-CD1 4.01Å; L53-I75 HydrophobicContact CD2-CD1 3.96Å; L53-I75 HydrophobicContact CG-CD1 3.96Å; L53-V82 HydrophobicContact CD2-CG1 3.86Å; L53-V82 HydrophobicContact CD2-CG2 4.34Å; L53-W85 HydrophobicContact CB-CD2 4.07Å; L53-W85 HydrophobicContact CB-CE3 3.98Å; L53-W85 HydrophobicContact CB-CH2 3.66Å; L53-W85 HydrophobicContact CB-CZ2 3.73Å; L53-W85 HydrophobicContact CB-CZ3 3.79Å; L53-W85 HydrophobicContact CD1-CD2 3.9Å; L53-W85 HydrophobicContact CD1-CE3 4.46Å; L53-W85 HydrophobicContact CD1-CG 3.92Å; L53-W85 HydrophobicContact CD2-CD2 4.47Å; L53-W85 HydrophobicContact CD2-CE3 4.27Å; L53-W85 HydrophobicContact CG-CD2 4.38Å; L53-W85 HydrophobicContact CG-CE3 4.48Å; L53-F86 HydrophobicContact CD2-CE2 3.98Å |
| 54 | E | 98.4 | Very high | 98 | Very high | 62 Ų | 62 | 72 Ų | 72 | 29% | 0.29 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -69.4 | -39.7 | 176.6 | -71.7 | -169.6 | 159.5 | 0 | 0 | 111.8 | L50 D51 L56 F57 A58 W85 R89 | L50-E54 WeakPolarHBondContact O-CB 3.27Å; L50-E54 WeakPolarHBondContact O-CG 3.48Å; L50-E54 PolarHBondContact O-N 3.44Å; D51-E54 PolarHBondContact O-N 2.86Å; E54-L56 VanDerWaalsContact C-N 3.33Å; E54-L56 PolarHBondContact O-N 2.91Å; E54-F57 PolarHBondContact O-N 3.5Å; E54-A58 PolarHBondContact O-N 3.04Å; E54-W85 HydrophobicContact CG-CH2 3.88Å; E54-W85 HydrophobicContact CG-CZ2 3.9Å; E54-R89 IonicContact OE1-CZ 2.77Å; E54-R89 IonicContact OE1-NH1 3.45Å; E54-R89 PolarHBondContact OE1-NH1 3.48Å; E54-R89 IonicContact OE1-NH2 3.32Å; E54-R89 PolarHBondContact OE1-NH2 3.23Å |
| 55 | A | 98.3 | Very high | 98.1 | Very high | 57 Ų | 57 | 68.8 Ų | 68.8 | 47% | 0.471 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -60.8 | -40.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112 | D51 V52 K59 | D51-A55 VanDerWaalsContact O-CB 3.28Å; D51-A55 WeakPolarHBondContact O-CB 3.48Å; D51-A55 PolarHBondContact O-N 3.35Å; V52-A55 PolarHBondContact O-N 3.49Å; A55-K59 PolarHBondContact O-N 2.93Å |
| 56 | L | 98.1 | Very high | 98.2 | Very high | 19 Ų | 19 | 73.2 Ų | 73.2 | 10% | 0.099 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -68.1 | -40.8 | 173.8 | -175 | 63.9 | 0 | 0 | 0 | 111.6 | V52 L53 E54 A58 K59 T60 P63 M67 V71 F86 | V52-L56 PolarHBondContact O-N 2.89Å; L53-L56 PolarHBondContact O-N 3.45Å; E54-L56 VanDerWaalsContact C-N 3.33Å; E54-L56 PolarHBondContact O-N 2.91Å; L56-A58 VanDerWaalsContact C-N 3.26Å; L56-A58 PolarHBondContact O-N 2.79Å; L56-K59 WeakPolarHBondContact O-CB 3.43Å; L56-K59 PolarHBondContact O-N 3.46Å; L56-T60 PolarHBondContact O-N 3.44Å; L56-P63 HydrophobicContact CD2-CB 4.14Å; L56-M67 HydrophobicContact CD1-CE 3.73Å; L56-V71 HydrophobicContact CD2-CB 4.4Å; L56-V71 HydrophobicContact CD2-CG2 3.63Å; L56-F86 HydrophobicContact CB-CZ 4.16Å; L56-F86 HydrophobicContact CD2-CE2 4.2Å; L56-F86 HydrophobicContact CD2-CZ 3.77Å; L56-F86 HydrophobicContact CG-CZ 3.97Å |
| 57 | F | 98.4 | Very high | 98.2 | Very high | 27 Ų | 27 | 72.8 Ų | 72.8 | 12% | 0.118 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61.2 | -35.3 | 178.5 | -173.2 | -92.3 | 0 | 0 | 0 | 112.9 | L53 E54 K59 T60 R61 W85 F86 R89 R90 | L53-F57 WeakPolarHBondContact O-CB 3.47Å; L53-F57 PolarHBondContact O-N 3.05Å; E54-F57 PolarHBondContact O-N 3.5Å; F57-K59 VanDerWaalsContact C-N 3.29Å; F57-K59 PolarHBondContact O-N 3.41Å; F57-T60 WeakPolarHBondContact CA-O 3.26Å; F57-T60 CarbonylContact O-C 3.33Å; F57-T60 PolarHBondContact O-N 3.04Å; F57-R61 HydrophobicContact CD1-CG 4.45Å; F57-R61 HydrophobicContact CD2-CG 4.48Å; F57-R61 HydrophobicContact CE1-CG 3.9Å; F57-R61 HydrophobicContact CE2-CB 4Å; F57-R61 HydrophobicContact CE2-CG 3.93Å; F57-R61 HydrophobicContact CZ-CB 4.15Å; F57-R61 HydrophobicContact CZ-CG 3.61Å; F57-W85 HydrophobicContact CB-CH2 4.38Å; F57-W85 HydrophobicContact CB-CZ3 4.25Å; F57-W85 HydrophobicContact CD2-CZ3 4.4Å; F57-F86 HydrophobicContact CB-CE1 4.01Å; F57-F86 HydrophobicContact CB-CZ 4.47Å; F57-F86 AromaticContact CD2-CD1 3.78Å; F57-F86 HydrophobicContact CD2-CD1 3.78Å; F57-F86 AromaticContact CD2-CE1 3.73Å; F57-F86 HydrophobicContact CD2-CE1 3.73Å; F57-F86 HydrophobicContact CE2-CD1 4.47Å; F57-F86 HydrophobicContact CG-CE1 4.37Å; F57-R89 HydrophobicContact CD1-CG 4.23Å; F57-R89 HydrophobicContact CD2-CB 4.31Å; F57-R89 HydrophobicContact CD2-CG 3.71Å; F57-R89 HydrophobicContact CE1-CG 4.1Å; F57-R89 HydrophobicContact CE2-CB 4.08Å; F57-R89 HydrophobicContact CE2-CG 3.56Å; F57-R89 HydrophobicContact CG-CG 4.05Å; F57-R89 HydrophobicContact CZ-CG 3.76Å; F57-R90 HydrophobicContact CE2-CG 3.88Å; F57-R90 HydrophobicContact CZ-CG 4.37Å |
| 58 | A | 98 | Very high | 98.2 | Very high | 88 Ų | 88 | 66.9 Ų | 66.9 | 73% | 0.727 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -63.5 | -34.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | E54 L56 | E54-A58 PolarHBondContact O-N 3.04Å; L56-A58 VanDerWaalsContact C-N 3.26Å; L56-A58 PolarHBondContact O-N 2.79Å |
| 59 | K | 97.6 | Very high | 98.2 | Very high | 176 Ų | 176 | 67.9 Ų | 67.9 | 77% | 0.765 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -74.5 | -46.9 | 174.9 | -63.5 | 176.9 | -178.6 | 179.1 | 0 | 111.9 | A55 L56 F57 | A55-K59 PolarHBondContact O-N 2.93Å; L56-K59 WeakPolarHBondContact O-CB 3.43Å; L56-K59 PolarHBondContact O-N 3.46Å; F57-K59 VanDerWaalsContact C-N 3.29Å; F57-K59 PolarHBondContact O-N 3.41Å |
| 60 | T | 97.7 | Very high | 98.2 | Very high | 41 Ų | 41 | 73 Ų | 73 | 25% | 0.252 | 36% | 0.363 | S | S | . | . | trans | -148.6 | 132.6 | 176.9 | 177.7 | 0 | 0 | 0 | 0 | 112.1 | L56 F57 Y62 P63 M67 | L56-T60 PolarHBondContact O-N 3.44Å; F57-T60 WeakPolarHBondContact CA-O 3.26Å; F57-T60 CarbonylContact O-C 3.33Å; F57-T60 PolarHBondContact O-N 3.04Å; T60-Y62 VanDerWaalsContact C-N 3.27Å; T60-Y62 PolarHBondContact O-N 3.14Å; T60-Y62 PolarHBondContact OG1-N 2.85Å; T60-Y62 PolarHBondContact OG1-O 3.23Å; T60-P63 HydrophobicContact CG2-CB 4.09Å; T60-M67 HydrophobicContact CG2-CE 3.53Å; T60-M67 HydrophobicContact CG2-SD 4.37Å | ||
| 61 | R | 97.4 | Very high | 98.2 | Very high | 136 Ų | 136 | 71.5 Ų | 71.5 | 51% | 0.513 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -76.6 | -16.2 | 174.7 | -63.7 | -171.3 | -76.6 | 112.4 | -2.2 | 112.8 | F57 R90 | F57-R61 HydrophobicContact CD1-CG 4.45Å; F57-R61 HydrophobicContact CD2-CG 4.48Å; F57-R61 HydrophobicContact CE1-CG 3.9Å; F57-R61 HydrophobicContact CE2-CB 4Å; F57-R61 HydrophobicContact CE2-CG 3.93Å; F57-R61 HydrophobicContact CZ-CB 4.15Å; F57-R61 HydrophobicContact CZ-CG 3.61Å; R61-R90 WeakPolarHBondContact O-CD 3.39Å; R61-R90 PolarHBondContact O-NH1 2.92Å |
| 62 | Y | 98.3 | Very high | 98.2 | Very high | 139 Ų | 139 | 68.5 Ų | 68.5 | 55% | 0.545 | 34% | 0.341 | S | S | . | . | S | Bend | trans | -132.3 | 75.7 | -177 | -63.7 | -93.4 | 0 | 0 | 0 | 109.8 | T60 R90 | T60-Y62 VanDerWaalsContact C-N 3.27Å; T60-Y62 PolarHBondContact O-N 3.14Å; T60-Y62 PolarHBondContact OG1-N 2.85Å; T60-Y62 PolarHBondContact OG1-O 3.23Å; Y62-R90 VanDerWaalsContact CE1-CD 3.42Å |
| 63 | P | 97.9 | Very high | 98.2 | Very high | 7 Ų | 7 | 73.2 Ų | 73.2 | 5% | 0.045 | 36% | 0.364 | C | S | . | . | trans | -69 | 140.6 | 177.7 | 29.4 | -36.3 | 0 | 0 | 0 | 111.1 | L56 T60 M67 R68 F86 | L56-P63 HydrophobicContact CD2-CB 4.14Å; T60-P63 HydrophobicContact CG2-CB 4.09Å; P63-M67 HydrophobicContact CB-CB 4.05Å; P63-M67 HydrophobicContact CB-CE 4.45Å; P63-M67 HydrophobicContact CB-SD 4.48Å; P63-R68 HydrophobicContact CB-CG 3.96Å; P63-R68 HydrophobicContact CG-CG 3.72Å; P63-R68 PolarHBondContact O-NH1 3.08Å; P63-F86 VanDerWaalsContact CD-CD1 3.43Å; P63-F86 HydrophobicContact CG-CD1 3.65Å; P63-F86 HydrophobicContact CG-CD2 4Å; P63-F86 HydrophobicContact CG-CE1 3.55Å; P63-F86 HydrophobicContact CG-CE2 3.93Å; P63-F86 HydrophobicContact CG-CG 3.89Å; P63-F86 HydrophobicContact CG-CZ 3.72Å | ||
| 64 | D | 98.4 | Very high | 98.2 | Very high | 91 Ų | 91 | 80.2 Ų | 80.2 | 49% | 0.487 | 39% | 0.394 | S | S | . | . | trans | -69.6 | 167.1 | 174.7 | -169.7 | 21.9 | 0 | 0 | 0 | 111.9 | F66 M67 R68 | D64-F66 VanDerWaalsContact C-N 3.33Å; D64-F66 PolarHBondContact O-N 3.42Å; D64-M67 HydrophobicContact CB-SD 4.49Å; D64-M67 PolarHBondContact O-N 3.17Å; D64-R68 WeakPolarHBondContact O-CG 3.29Å; D64-R68 PolarHBondContact O-N 3.29Å | ||
| 65 | I | 98.1 | Very high | 98.2 | Very high | 55 Ų | 55 | 77.8 Ų | 77.8 | 28% | 0.282 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -51.4 | -49.8 | 179.6 | -175.2 | 59.8 | 0 | 0 | 0 | 111.7 | M67 R68 E69 E79 | I65-M67 PolarHBondContact O-N 2.96Å; I65-R68 PolarHBondContact O-N 3.29Å; I65-R68 VanDerWaalsContact O-N 3.11Å; I65-E69 HydrophobicContact CD1-CG 4.29Å; I65-E69 HydrophobicContact CG1-CG 4.46Å; I65-E69 WeakPolarHBondContact O-CG 3.44Å; I65-E69 PolarHBondContact O-N 2.94Å; I65-E79 HydrophobicContact CD1-CG 4.12Å; I65-E79 WeakPolarHBondContact CD1-OE1 3.39Å |
| 66 | F | 98.4 | Very high | 98.1 | Very high | 146 Ų | 146 | 81.9 Ų | 81.9 | 64% | 0.64 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -62.7 | -41.9 | -178.7 | -59.5 | -66.8 | 0 | 0 | 0 | 112.5 | D64 R68 E69 E70 | D64-F66 VanDerWaalsContact C-N 3.33Å; D64-F66 PolarHBondContact O-N 3.42Å; F66-R68 VanDerWaalsContact C-N 3.29Å; F66-R68 PolarHBondContact O-N 3.1Å; F66-E69 PolarHBondContact O-N 3.31Å; F66-E70 PolarHBondContact O-N 3.37Å |
| 67 | M | 98.3 | Very high | 98.1 | Very high | 71 Ų | 71 | 82.4 Ų | 82.4 | 35% | 0.35 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.6 | -35.8 | 176.9 | -62.5 | 176.8 | 67.3 | 0 | 0 | 111.9 | L56 T60 P63 D64 I65 V71 | L56-M67 HydrophobicContact CD1-CE 3.73Å; T60-M67 HydrophobicContact CG2-CE 3.53Å; T60-M67 HydrophobicContact CG2-SD 4.37Å; P63-M67 HydrophobicContact CB-CB 4.05Å; P63-M67 HydrophobicContact CB-CE 4.45Å; P63-M67 HydrophobicContact CB-SD 4.48Å; D64-M67 HydrophobicContact CB-SD 4.49Å; D64-M67 PolarHBondContact O-N 3.17Å; I65-M67 PolarHBondContact O-N 2.96Å; M67-V71 PolarHBondContact O-N 3.06Å |
| 68 | R | 98.6 | Very high | 98.1 | Very high | 42 Ų | 42 | 84.6 Ų | 84.6 | 16% | 0.158 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -70.8 | -41 | 176.3 | -67.3 | -165.7 | -52.3 | -85.5 | -2 | 111.3 | P63 D64 I65 F66 V71 A72 E79 V82 | P63-R68 HydrophobicContact CB-CG 3.96Å; P63-R68 HydrophobicContact CG-CG 3.72Å; P63-R68 PolarHBondContact O-NH1 3.08Å; D64-R68 WeakPolarHBondContact O-CG 3.29Å; D64-R68 PolarHBondContact O-N 3.29Å; I65-R68 PolarHBondContact O-N 3.29Å; I65-R68 VanDerWaalsContact O-N 3.11Å; F66-R68 VanDerWaalsContact C-N 3.29Å; F66-R68 PolarHBondContact O-N 3.1Å; R68-V71 PolarHBondContact O-N 3.03Å; R68-A72 WeakPolarHBondContact O-CB 3.48Å; R68-A72 PolarHBondContact O-N 3.1Å; R68-E79 HydrophobicContact CB-CG 4.08Å; R68-E79 IonicContact CZ-OE1 3.26Å; R68-E79 VanDerWaalsContact CZ-OE1 3.26Å; R68-E79 IonicContact NE-OE1 2.76Å; R68-E79 PolarHBondContact NE-OE1 2.76Å; R68-E79 IonicContact NH2-OE1 2.86Å; R68-E79 PolarHBondContact NH2-OE1 3.26Å; R68-V82 HydrophobicContact CB-CG1 4.19Å; R68-V82 HydrophobicContact CG-CG1 4.19Å |
| 69 | E | 98.6 | Very high | 98.1 | Very high | 86 Ų | 86 | 82.6 Ų | 82.6 | 40% | 0.402 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.9 | -45 | 176.2 | -72.3 | 177.1 | 162 | 0 | 0 | 111.7 | I65 F66 V71 A72 L73 E79 | I65-E69 HydrophobicContact CD1-CG 4.29Å; I65-E69 HydrophobicContact CG1-CG 4.46Å; I65-E69 WeakPolarHBondContact O-CG 3.44Å; I65-E69 PolarHBondContact O-N 2.94Å; F66-E69 PolarHBondContact O-N 3.31Å; E69-V71 PolarHBondContact O-N 2.72Å; E69-A72 WeakPolarHBondContact O-CB 3.41Å; E69-A72 PolarHBondContact O-N 3.04Å; E69-L73 WeakPolarHBondContact O-CG 3.47Å; E69-L73 PolarHBondContact O-N 2.99Å; E69-E79 HydrophobicContact CG-CB 4.48Å; E69-E79 HydrophobicContact CG-CG 4.04Å |
| 70 | E | 98.3 | Very high | 98.1 | Very high | 138 Ų | 138 | 76.7 Ų | 76.7 | 65% | 0.645 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -57.8 | -47.7 | 176.6 | -170.6 | -166.3 | 152.5 | 0 | 0 | 111.6 | F66 K74 | F66-E70 PolarHBondContact O-N 3.37Å; E70-K74 WeakPolarHBondContact O-CB 3.35Å; E70-K74 PolarHBondContact O-N 3.35Å |
| 71 | V | 98.4 | Very high | 98.1 | Very high | 12 Ų | 12 | 77.9 Ų | 77.9 | 7% | 0.073 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -68.8 | -39.1 | 177.9 | 169.7 | 0 | 0 | 0 | 0 | 111.9 | V52 L53 L56 M67 R68 E69 L73 K74 I75 | V52-V71 HydrophobicContact CG1-CG1 4.05Å; L53-V71 HydrophobicContact CD2-CG1 3.91Å; L56-V71 HydrophobicContact CD2-CB 4.4Å; L56-V71 HydrophobicContact CD2-CG2 3.63Å; M67-V71 PolarHBondContact O-N 3.06Å; R68-V71 PolarHBondContact O-N 3.03Å; E69-V71 PolarHBondContact O-N 2.72Å; V71-L73 VanDerWaalsContact C-N 3.31Å; V71-L73 PolarHBondContact O-N 3.21Å; V71-K74 WeakPolarHBondContact O-CB 3.4Å; V71-K74 PolarHBondContact O-N 3.34Å; V71-K74 VanDerWaalsContact O-N 3.14Å; V71-I75 HydrophobicContact CG1-CD1 4.04Å; V71-I75 HydrophobicContact CG1-CG2 4.33Å; V71-I75 VanDerWaalsContact O-CG1 3.29Å; V71-I75 WeakPolarHBondContact O-CG1 3.48Å; V71-I75 PolarHBondContact O-N 3.49Å |
| 72 | A | 98.5 | Very high | 98.1 | Very high | 6 Ų | 6 | 71.4 Ų | 71.4 | 5% | 0.05 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -56.8 | -45.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | R68 E69 N76 L77 E79 V82 | R68-A72 WeakPolarHBondContact O-CB 3.48Å; R68-A72 PolarHBondContact O-N 3.1Å; E69-A72 WeakPolarHBondContact O-CB 3.41Å; E69-A72 PolarHBondContact O-N 3.04Å; A72-N76 PolarHBondContact O-N 3.46Å; A72-L77 CarbonylContact C-O 3.44Å; A72-L77 VanDerWaalsContact CB-O 3.31Å; A72-L77 WeakPolarHBondContact CB-O 3.36Å; A72-L77 PolarHBondContact O-N 3.02Å; A72-L77 VanDerWaalsContact O-O 3.1Å; A72-E79 HydrophobicContact CB-CB 4.28Å; A72-V82 HydrophobicContact CB-CG2 3.9Å |
| 73 | L | 98.4 | Very high | 98.1 | Very high | 138 Ų | 138 | 68.7 Ų | 68.7 | 72% | 0.723 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -61.6 | -48.8 | 172.8 | -68.1 | 172.8 | 0 | 0 | 0 | 111.3 | E69 V71 I75 N76 | E69-L73 WeakPolarHBondContact O-CG 3.47Å; E69-L73 PolarHBondContact O-N 2.99Å; V71-L73 VanDerWaalsContact C-N 3.31Å; V71-L73 PolarHBondContact O-N 3.21Å; L73-I75 VanDerWaalsContact C-N 3.28Å; L73-I75 PolarHBondContact O-N 3.33Å; L73-N76 PolarHBondContact O-N 3.35Å; L73-N76 VanDerWaalsContact O-N 3.17Å |
| 74 | K | 97.8 | Very high | 98.2 | Very high | 148 Ų | 148 | 71.8 Ų | 71.8 | 64% | 0.643 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -57.7 | -37.5 | -179.3 | -175.7 | 171 | -177.4 | 167.1 | 0 | 113.5 | V52 E70 V71 | V52-K74 HydrophobicContact CG1-CD 4.31Å; E70-K74 WeakPolarHBondContact O-CB 3.35Å; E70-K74 PolarHBondContact O-N 3.35Å; V71-K74 WeakPolarHBondContact O-CB 3.4Å; V71-K74 PolarHBondContact O-N 3.34Å; V71-K74 VanDerWaalsContact O-N 3.14Å |
| 75 | I | 97.8 | Very high | 98.1 | Very high | 10 Ų | 10 | 68.5 Ų | 68.5 | 5% | 0.051 | 34% | 0.341 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99.5 | 5.6 | -177.8 | 73.7 | -175.9 | 0 | 0 | 0 | 113.7 | Q49 V52 L53 V71 L73 L77 V82 | Q49-I75 HydrophobicContact CB-CB 4.34Å; Q49-I75 HydrophobicContact CG-CB 4Å; Q49-I75 HydrophobicContact CG-CG2 4.49Å; Q49-I75 PolarHBondContact NE2-O 3.48Å; V52-I75 HydrophobicContact CB-CG2 4Å; V52-I75 HydrophobicContact CG1-CG2 3.94Å; V52-I75 HydrophobicContact CG2-CG2 4.32Å; L53-I75 HydrophobicContact CD1-CD1 4.01Å; L53-I75 HydrophobicContact CD2-CD1 3.96Å; L53-I75 HydrophobicContact CG-CD1 3.96Å; V71-I75 HydrophobicContact CG1-CD1 4.04Å; V71-I75 HydrophobicContact CG1-CG2 4.33Å; V71-I75 VanDerWaalsContact O-CG1 3.29Å; V71-I75 WeakPolarHBondContact O-CG1 3.48Å; V71-I75 PolarHBondContact O-N 3.49Å; L73-I75 VanDerWaalsContact C-N 3.28Å; L73-I75 PolarHBondContact O-N 3.33Å; I75-L77 HydrophobicContact CD1-CB 4.44Å; I75-L77 HydrophobicContact CD1-CD1 3.83Å; I75-L77 HydrophobicContact CD1-CG 4.39Å; I75-L77 HydrophobicContact CG1-CB 4.03Å; I75-L77 HydrophobicContact CG1-CD1 3.99Å; I75-L77 HydrophobicContact CG1-CG 4.01Å; I75-L77 PolarHBondContact O-N 3.36Å; I75-V82 HydrophobicContact CD1-CG2 4.11Å |
| 76 | N | 98.1 | Very high | 98.2 | Very high | 143 Ų | 143 | 66 Ų | 66 | 77% | 0.765 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53 | 48.8 | -177.9 | -69.8 | -82.3 | 0 | 0 | 0 | 113.5 | A72 L73 | A72-N76 PolarHBondContact O-N 3.46Å; L73-N76 PolarHBondContact O-N 3.35Å; L73-N76 VanDerWaalsContact O-N 3.17Å |
| 77 | L | 97.3 | Very high | 98.2 | Very high | 30 Ų | 30 | 64.7 Ų | 64.7 | 16% | 0.157 | 32% | 0.322 | C | S | . | . | S | Bend | trans | -129 | 155.6 | 175.4 | -66.7 | 179.2 | 0 | 0 | 0 | 110.7 | T43 F45 A72 I75 | T43-L77 HydrophobicContact CG2-CD1 4.27Å; T43-L77 HydrophobicContact CG2-CD2 3.79Å; F45-L77 HydrophobicContact CD1-CD1 3.47Å; F45-L77 VanDerWaalsContact CD1-CD1 3.47Å; F45-L77 HydrophobicContact CE1-CD1 3.39Å; A72-L77 CarbonylContact C-O 3.44Å; A72-L77 VanDerWaalsContact CB-O 3.31Å; A72-L77 WeakPolarHBondContact CB-O 3.36Å; A72-L77 PolarHBondContact O-N 3.02Å; A72-L77 VanDerWaalsContact O-O 3.1Å; I75-L77 HydrophobicContact CD1-CB 4.44Å; I75-L77 HydrophobicContact CD1-CD1 3.83Å; I75-L77 HydrophobicContact CD1-CG 4.39Å; I75-L77 HydrophobicContact CG1-CB 4.03Å; I75-L77 HydrophobicContact CG1-CD1 3.99Å; I75-L77 HydrophobicContact CG1-CG 4.01Å; I75-L77 PolarHBondContact O-N 3.36Å |
| 78 | P | 97.9 | Very high | 98.2 | Very high | 74 Ų | 74 | 66.4 Ų | 66.4 | 48% | 0.481 | 33% | 0.332 | S | S | . | . | trans | -62.5 | 142.9 | 170.5 | -20.9 | 32 | 0 | 0 | 0 | 111.8 | S80 R81 V82 | P78-S80 PolarHBondContact O-N 3.38Å; P78-S80 VanDerWaalsContact O-N 3.14Å; P78-R81 HydrophobicContact CB-CG 4.26Å; P78-R81 HydrophobicContact CG-CG 4.2Å; P78-R81 WeakPolarHBondContact O-CB 3.4Å; P78-R81 PolarHBondContact O-N 2.96Å; P78-V82 PolarHBondContact O-N 3.35Å | ||
| 79 | E | 98.1 | Very high | 98.1 | Very high | 45 Ų | 45 | 68.2 Ų | 68.2 | 21% | 0.21 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -50 | -41.9 | 176 | -178.8 | -81.1 | 164.1 | 0 | 0 | 111.8 | I65 R68 E69 A72 R81 V82 Q83 | I65-E79 HydrophobicContact CD1-CG 4.12Å; I65-E79 WeakPolarHBondContact CD1-OE1 3.39Å; R68-E79 HydrophobicContact CB-CG 4.08Å; R68-E79 IonicContact CZ-OE1 3.26Å; R68-E79 VanDerWaalsContact CZ-OE1 3.26Å; R68-E79 IonicContact NE-OE1 2.76Å; R68-E79 PolarHBondContact NE-OE1 2.76Å; R68-E79 IonicContact NH2-OE1 2.86Å; R68-E79 PolarHBondContact NH2-OE1 3.26Å; E69-E79 HydrophobicContact CG-CB 4.48Å; E69-E79 HydrophobicContact CG-CG 4.04Å; A72-E79 HydrophobicContact CB-CB 4.28Å; E79-R81 PolarHBondContact O-N 3.17Å; E79-R81 VanDerWaalsContact O-N 3.13Å; E79-V82 CarbonylContact O-C 3.58Å; E79-V82 WeakPolarHBondContact O-CA 3.15Å; E79-V82 VanDerWaalsContact O-CB 3.32Å; E79-V82 WeakPolarHBondContact O-CB 3.43Å; E79-V82 PolarHBondContact O-N 3.48Å; E79-Q83 PolarHBondContact O-N 3.03Å |
| 80 | S | 97.6 | Very high | 98.1 | Very high | 53 Ų | 53 | 66.1 Ų | 66.1 | 37% | 0.371 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -57 | -32 | 178 | 62.6 | 0 | 0 | 0 | 0 | 113.5 | P78 V84 | P78-S80 PolarHBondContact O-N 3.38Å; P78-S80 VanDerWaalsContact O-N 3.14Å; S80-V84 VanDerWaalsContact O-CG2 3.27Å; S80-V84 WeakPolarHBondContact O-CG2 3.5Å; S80-V84 PolarHBondContact O-N 3.01Å |
| 81 | R | 97.9 | Very high | 98.1 | Very high | 65 Ų | 65 | 60.8 Ų | 60.8 | 25% | 0.245 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -72 | -37.8 | 176.3 | -61 | -61.8 | 172.6 | 138.6 | -6.4 | 110.9 | E41 T43 P78 E79 W85 | E41-R81 PolarHBondContact O-NH1 3.12Å; E41-R81 PolarHBondContact O-NH2 3.39Å; T43-R81 VanDerWaalsContact OG1-CD 3.23Å; T43-R81 WeakPolarHBondContact OG1-CD 3.44Å; T43-R81 PolarHBondContact OG1-NE 3.48Å; T43-R81 PolarHBondContact OG1-NH1 3.42Å; P78-R81 HydrophobicContact CB-CG 4.26Å; P78-R81 HydrophobicContact CG-CG 4.2Å; P78-R81 WeakPolarHBondContact O-CB 3.4Å; P78-R81 PolarHBondContact O-N 2.96Å; E79-R81 PolarHBondContact O-N 3.17Å; E79-R81 VanDerWaalsContact O-N 3.13Å; R81-W85 WeakPolarHBondContact O-CB 3.38Å; R81-W85 PolarHBondContact O-N 3.13Å |
| 82 | V | 98.3 | Very high | 98 | Very high | 0 Ų | 0 | 66.4 Ų | 66.4 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.4 | -48 | 171.9 | -179.3 | 0 | 0 | 0 | 0 | 110 | L53 R68 A72 I75 P78 E79 V84 W85 F86 | L53-V82 HydrophobicContact CD2-CG1 3.86Å; L53-V82 HydrophobicContact CD2-CG2 4.34Å; R68-V82 HydrophobicContact CB-CG1 4.19Å; R68-V82 HydrophobicContact CG-CG1 4.19Å; A72-V82 HydrophobicContact CB-CG2 3.9Å; I75-V82 HydrophobicContact CD1-CG2 4.11Å; P78-V82 PolarHBondContact O-N 3.35Å; E79-V82 CarbonylContact O-C 3.58Å; E79-V82 WeakPolarHBondContact O-CA 3.15Å; E79-V82 VanDerWaalsContact O-CB 3.32Å; E79-V82 WeakPolarHBondContact O-CB 3.43Å; E79-V82 PolarHBondContact O-N 3.48Å; V82-V84 PolarHBondContact O-N 3.41Å; V82-W85 WeakPolarHBondContact O-CB 3.32Å; V82-W85 PolarHBondContact O-N 2.93Å; V82-W85 VanDerWaalsContact O-N 3.13Å; V82-F86 HydrophobicContact CG1-CD2 3.76Å; V82-F86 HydrophobicContact CG1-CE2 3.75Å; V82-F86 WeakPolarHBondContact O-CD2 3.36Å; V82-F86 PolarHBondContact O-N 3.26Å |
| 83 | Q | 98.3 | Very high | 97.8 | Very high | 82 Ų | 82 | 68.7 Ų | 68.7 | 38% | 0.383 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -55.4 | -49.4 | 177.1 | -171.7 | -164.7 | 6.1 | 0 | 0 | 112 | E79 W85 F86 K87 | E79-Q83 PolarHBondContact O-N 3.03Å; Q83-W85 VanDerWaalsContact C-N 3.34Å; Q83-W85 PolarHBondContact O-N 3.11Å; Q83-F86 PolarHBondContact O-N 3.24Å; Q83-K87 WeakPolarHBondContact O-CG 3.49Å; Q83-K87 PolarHBondContact O-N 3.02Å |
| 84 | V | 98.1 | Very high | 97.6 | Very high | 72 Ų | 72 | 68.2 Ų | 68.2 | 44% | 0.436 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.5 | -40.4 | 178 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | S80 V82 F86 K87 N88 | S80-V84 VanDerWaalsContact O-CG2 3.27Å; S80-V84 WeakPolarHBondContact O-CG2 3.5Å; S80-V84 PolarHBondContact O-N 3.01Å; V82-V84 PolarHBondContact O-N 3.41Å; V84-F86 PolarHBondContact O-N 3.39Å; V84-K87 PolarHBondContact O-N 3.45Å; V84-N88 WeakPolarHBondContact O-CB 3.4Å; V84-N88 VanDerWaalsContact O-CG 3.3Å; V84-N88 PolarHBondContact O-N 3.41Å |
| 85 | W | 98.3 | Very high | 97.4 | Very high | 23 Ų | 23 | 67 Ų | 67 | 9% | 0.087 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -59.1 | -47.8 | 176 | -173.5 | 99.9 | 0 | 0 | 0 | 111.5 | F45 L50 L53 E54 F57 R81 V82 Q83 K87 N88 R89 | F45-W85 AromaticContact CE2-CD1 3.72Å; F45-W85 HydrophobicContact CZ-CB 4.04Å; F45-W85 AromaticContact CZ-CD1 3.8Å; F45-W85 HydrophobicContact CZ-CG 4.29Å; L50-W85 HydrophobicContact CD2-CZ2 4.38Å; L53-W85 HydrophobicContact CB-CD2 4.07Å; L53-W85 HydrophobicContact CB-CE3 3.98Å; L53-W85 HydrophobicContact CB-CH2 3.66Å; L53-W85 HydrophobicContact CB-CZ2 3.73Å; L53-W85 HydrophobicContact CB-CZ3 3.79Å; L53-W85 HydrophobicContact CD1-CD2 3.9Å; L53-W85 HydrophobicContact CD1-CE3 4.46Å; L53-W85 HydrophobicContact CD1-CG 3.92Å; L53-W85 HydrophobicContact CD2-CD2 4.47Å; L53-W85 HydrophobicContact CD2-CE3 4.27Å; L53-W85 HydrophobicContact CG-CD2 4.38Å; L53-W85 HydrophobicContact CG-CE3 4.48Å; E54-W85 HydrophobicContact CG-CH2 3.88Å; E54-W85 HydrophobicContact CG-CZ2 3.9Å; F57-W85 HydrophobicContact CB-CH2 4.38Å; F57-W85 HydrophobicContact CB-CZ3 4.25Å; F57-W85 HydrophobicContact CD2-CZ3 4.4Å; R81-W85 WeakPolarHBondContact O-CB 3.38Å; R81-W85 PolarHBondContact O-N 3.13Å; V82-W85 WeakPolarHBondContact O-CB 3.32Å; V82-W85 PolarHBondContact O-N 2.93Å; V82-W85 VanDerWaalsContact O-N 3.13Å; Q83-W85 VanDerWaalsContact C-N 3.34Å; Q83-W85 PolarHBondContact O-N 3.11Å; W85-K87 PolarHBondContact O-N 3.4Å; W85-N88 PolarHBondContact O-N 3.28Å; W85-R89 HydrophobicContact CE3-CB 4.17Å; W85-R89 HydrophobicContact CH2-CB 4.21Å; W85-R89 HydrophobicContact CH2-CG 3.92Å; W85-R89 HydrophobicContact CZ3-CB 3.97Å; W85-R89 HydrophobicContact CZ3-CG 4.03Å; W85-R89 WeakPolarHBondContact O-CB 3.31Å; W85-R89 PolarHBondContact O-N 3.21Å |
| 86 | F | 98.6 | Very high | 97.1 | Very high | 2 Ų | 2 | 71.9 Ų | 71.9 | 1% | 0.009 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.2 | -39.1 | 177.8 | -89.2 | -89.9 | 0 | 0 | 0 | 112.4 | L53 L56 F57 P63 V82 Q83 V84 R89 R90 | L53-F86 HydrophobicContact CD2-CE2 3.98Å; L56-F86 HydrophobicContact CB-CZ 4.16Å; L56-F86 HydrophobicContact CD2-CE2 4.2Å; L56-F86 HydrophobicContact CD2-CZ 3.77Å; L56-F86 HydrophobicContact CG-CZ 3.97Å; F57-F86 HydrophobicContact CB-CE1 4.01Å; F57-F86 HydrophobicContact CB-CZ 4.47Å; F57-F86 AromaticContact CD2-CD1 3.78Å; F57-F86 HydrophobicContact CD2-CD1 3.78Å; F57-F86 AromaticContact CD2-CE1 3.73Å; F57-F86 HydrophobicContact CD2-CE1 3.73Å; F57-F86 HydrophobicContact CE2-CD1 4.47Å; F57-F86 HydrophobicContact CG-CE1 4.37Å; P63-F86 VanDerWaalsContact CD-CD1 3.43Å; P63-F86 HydrophobicContact CG-CD1 3.65Å; P63-F86 HydrophobicContact CG-CD2 4Å; P63-F86 HydrophobicContact CG-CE1 3.55Å; P63-F86 HydrophobicContact CG-CE2 3.93Å; P63-F86 HydrophobicContact CG-CG 3.89Å; P63-F86 HydrophobicContact CG-CZ 3.72Å; V82-F86 HydrophobicContact CG1-CD2 3.76Å; V82-F86 HydrophobicContact CG1-CE2 3.75Å; V82-F86 WeakPolarHBondContact O-CD2 3.36Å; V82-F86 PolarHBondContact O-N 3.26Å; Q83-F86 PolarHBondContact O-N 3.24Å; V84-F86 PolarHBondContact O-N 3.39Å; F86-R89 PolarHBondContact O-N 3.42Å; F86-R90 WeakPolarHBondContact O-CG 3.23Å; F86-R90 PolarHBondContact O-N 2.95Å |
| 87 | K | 98.3 | Very high | 96.7 | Very high | 119 Ų | 119 | 70.5 Ų | 70.5 | 52% | 0.517 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.3 | -48.5 | 173.3 | -73.7 | 177.5 | 66.5 | 174.5 | 0 | 111.4 | Q83 V84 W85 R90 A91 | Q83-K87 WeakPolarHBondContact O-CG 3.49Å; Q83-K87 PolarHBondContact O-N 3.02Å; V84-K87 PolarHBondContact O-N 3.45Å; W85-K87 PolarHBondContact O-N 3.4Å; K87-R90 PolarHBondContact O-N 2.98Å; K87-A91 PolarHBondContact O-N 3.5Å |
| 88 | N | 98.1 | Very high | 96.2 | Very high | 106 Ų | 106 | 75 Ų | 75 | 57% | 0.567 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -65.7 | -40.1 | 179.7 | -70.3 | -12.7 | 0 | 0 | 0 | 111.7 | V84 W85 R90 A91 K92 | V84-N88 WeakPolarHBondContact O-CB 3.4Å; V84-N88 VanDerWaalsContact O-CG 3.3Å; V84-N88 PolarHBondContact O-N 3.41Å; W85-N88 PolarHBondContact O-N 3.28Å; N88-R90 PolarHBondContact O-N 3.3Å; N88-A91 WeakPolarHBondContact O-CB 3.38Å; N88-A91 PolarHBondContact O-N 2.82Å; N88-K92 PolarHBondContact O-N 2.91Å |
| 89 | R | 98 | Very high | 95.5 | Very high | 80 Ų | 80 | 78.9 Ų | 78.9 | 30% | 0.302 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 178.2 | -172.7 | 64.2 | -176.2 | -157.8 | -1.7 | 111.6 | E54 F57 W85 F86 K92 C93 | E54-R89 IonicContact OE1-CZ 2.77Å; E54-R89 IonicContact OE1-NH1 3.45Å; E54-R89 PolarHBondContact OE1-NH1 3.48Å; E54-R89 IonicContact OE1-NH2 3.32Å; E54-R89 PolarHBondContact OE1-NH2 3.23Å; F57-R89 HydrophobicContact CD1-CG 4.23Å; F57-R89 HydrophobicContact CD2-CB 4.31Å; F57-R89 HydrophobicContact CD2-CG 3.71Å; F57-R89 HydrophobicContact CE1-CG 4.1Å; F57-R89 HydrophobicContact CE2-CB 4.08Å; F57-R89 HydrophobicContact CE2-CG 3.56Å; F57-R89 HydrophobicContact CG-CG 4.05Å; F57-R89 HydrophobicContact CZ-CG 3.76Å; W85-R89 HydrophobicContact CE3-CB 4.17Å; W85-R89 HydrophobicContact CH2-CB 4.21Å; W85-R89 HydrophobicContact CH2-CG 3.92Å; W85-R89 HydrophobicContact CZ3-CB 3.97Å; W85-R89 HydrophobicContact CZ3-CG 4.03Å; W85-R89 WeakPolarHBondContact O-CB 3.31Å; W85-R89 PolarHBondContact O-N 3.21Å; F86-R89 PolarHBondContact O-N 3.42Å; R89-K92 PolarHBondContact O-N 2.98Å; R89-C93 PolarHBondContact O-N 2.86Å; R89-C93 VanDerWaalsContact O-N 3.12Å |
| 90 | R | 97.9 | Very high | 94.6 | Very high | 43 Ų | 43 | 83.5 Ų | 83.5 | 16% | 0.162 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -64.3 | -38.3 | 174.5 | -70.1 | -166.7 | -63.8 | -95.2 | 5.1 | 112.6 | F57 R61 Y62 F86 K87 N88 C93 R94 | F57-R90 HydrophobicContact CE2-CG 3.88Å; F57-R90 HydrophobicContact CZ-CG 4.37Å; R61-R90 WeakPolarHBondContact O-CD 3.39Å; R61-R90 PolarHBondContact O-NH1 2.92Å; Y62-R90 VanDerWaalsContact CE1-CD 3.42Å; F86-R90 WeakPolarHBondContact O-CG 3.23Å; F86-R90 PolarHBondContact O-N 2.95Å; K87-R90 PolarHBondContact O-N 2.98Å; N88-R90 PolarHBondContact O-N 3.3Å; R90-C93 PolarHBondContact O-N 3.38Å; R90-R94 PolarHBondContact O-N 3.35Å; R90-R94 VanDerWaalsContact O-N 3.13Å |
| 91 | A | 97.8 | Very high | 93.4 | Very high | 26 Ų | 26 | 87.7 Ų | 87.7 | 22% | 0.215 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -61.8 | -46.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | K87 N88 C93 R94 Q95 | K87-A91 PolarHBondContact O-N 3.5Å; N88-A91 WeakPolarHBondContact O-CB 3.38Å; N88-A91 PolarHBondContact O-N 2.82Å; A91-C93 VanDerWaalsContact C-N 3.33Å; A91-C93 PolarHBondContact O-N 2.94Å; A91-R94 PolarHBondContact O-N 3.48Å; A91-Q95 WeakPolarHBondContact O-CG 3.39Å; A91-Q95 PolarHBondContact O-N 3.13Å |
| 92 | K | 96.6 | Very high | 91.8 | Very high | 129 Ų | 129 | 90.6 Ų | 90.6 | 56% | 0.561 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -60 | -42 | 176.3 | -172.8 | 178.2 | 179.2 | -178 | 0 | 112.2 | N88 R89 R94 Q95 Q96 | N88-K92 PolarHBondContact O-N 2.91Å; R89-K92 PolarHBondContact O-N 2.98Å; K92-R94 PolarHBondContact O-N 2.94Å; K92-Q95 PolarHBondContact O-N 3.14Å; K92-Q96 PolarHBondContact O-N 3.48Å |
| 93 | C | 93.9 | Very high | 89.7 | Confident | 54 Ų | 54 | 93.4 Ų | 93.4 | 37% | 0.365 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -60.2 | -44.7 | 177.2 | 179.7 | 0 | 0 | 0 | 0 | 112.1 | R89 R90 A91 Q95 Q96 Q97 | R89-C93 PolarHBondContact O-N 2.86Å; R89-C93 VanDerWaalsContact O-N 3.12Å; R90-C93 PolarHBondContact O-N 3.38Å; A91-C93 VanDerWaalsContact C-N 3.33Å; A91-C93 PolarHBondContact O-N 2.94Å; C93-Q95 PolarHBondContact O-N 3.13Å; C93-Q96 PolarHBondContact O-N 2.96Å; C93-Q97 PolarHBondContact O-N 3.49Å; C93-Q97 VanDerWaalsContact O-N 3.1Å |
| 94 | R | 95.7 | Very high | 87.5 | Confident | 128 Ų | 128 | 93.1 Ų | 93.1 | 48% | 0.483 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 175.3 | -68.4 | -168.6 | -58.8 | -88.2 | 1.6 | 112.6 | R90 A91 K92 Q97 Q98 | R90-R94 PolarHBondContact O-N 3.35Å; R90-R94 VanDerWaalsContact O-N 3.13Å; A91-R94 PolarHBondContact O-N 3.48Å; K92-R94 PolarHBondContact O-N 2.94Å; R94-Q97 PolarHBondContact O-N 2.88Å; R94-Q98 WeakPolarHBondContact O-CG 3.41Å; R94-Q98 PolarHBondContact O-N 3.5Å |
| 95 | Q | 93.6 | Very high | 85.2 | Confident | 124 Ų | 124 | 96.9 Ų | 96.9 | 58% | 0.579 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.3 | -42 | 177 | -71.4 | 171.5 | 6.7 | 0 | 0 | 111.7 | A91 K92 C93 Q97 Q98 Q99 | A91-Q95 WeakPolarHBondContact O-CG 3.39Å; A91-Q95 PolarHBondContact O-N 3.13Å; K92-Q95 PolarHBondContact O-N 3.14Å; C93-Q95 PolarHBondContact O-N 3.13Å; Q95-Q97 VanDerWaalsContact C-N 3.33Å; Q95-Q97 PolarHBondContact O-N 2.76Å; Q95-Q98 PolarHBondContact O-N 3.14Å; Q95-Q99 WeakPolarHBondContact O-CB 3.4Å; Q95-Q99 PolarHBondContact O-N 2.77Å |
| 96 | Q | 91.5 | Very high | 82.9 | Confident | 112 Ų | 112 | 103 Ų | 103 | 52% | 0.523 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.6 | -39.2 | 177.8 | -170.8 | 173.9 | 16.9 | 0 | 0 | 111.8 | K92 C93 Q99 Q100 | K92-Q96 PolarHBondContact O-N 3.48Å; C93-Q96 PolarHBondContact O-N 2.96Å; Q96-Q99 PolarHBondContact O-N 2.87Å; Q96-Q100 WeakPolarHBondContact O-CG 3.43Å; Q96-Q100 PolarHBondContact O-N 3.31Å |
| 97 | Q | 88.2 | Confident | 80.6 | Confident | 114 Ų | 114 | 111.9 Ų | 111.9 | 53% | 0.533 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.3 | -41.2 | 176.9 | -166.3 | 171 | 23.3 | 0 | 0 | 112.2 | C93 R94 Q95 Q99 Q100 Q101 | C93-Q97 PolarHBondContact O-N 3.49Å; C93-Q97 VanDerWaalsContact O-N 3.1Å; R94-Q97 PolarHBondContact O-N 2.88Å; Q95-Q97 VanDerWaalsContact C-N 3.33Å; Q95-Q97 PolarHBondContact O-N 2.76Å; Q97-Q99 VanDerWaalsContact C-N 3.32Å; Q97-Q99 PolarHBondContact O-N 2.96Å; Q97-Q100 PolarHBondContact O-N 3.4Å; Q97-Q101 WeakPolarHBondContact O-CG 3.4Å; Q97-Q101 PolarHBondContact O-N 2.78Å |
| 98 | Q | 87.1 | Confident | 78.3 | Confident | 123 Ų | 123 | 111.3 Ų | 111.3 | 58% | 0.575 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.6 | -38.8 | 174.4 | -72.4 | 172.4 | 9.2 | 0 | 0 | 112 | R94 Q95 Q100 Q101 N102 | R94-Q98 WeakPolarHBondContact O-CG 3.41Å; R94-Q98 PolarHBondContact O-N 3.5Å; Q95-Q98 PolarHBondContact O-N 3.14Å; Q98-Q100 VanDerWaalsContact C-N 3.34Å; Q98-Q101 PolarHBondContact O-N 2.96Å; Q98-N102 PolarHBondContact O-N 3.03Å |
| 99 | Q | 83.3 | Confident | 76.3 | Confident | 156 Ų | 156 | 117 Ų | 117 | 73% | 0.729 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -70 | -32.4 | 178.6 | -160.2 | 167 | 24.1 | 0 | 0 | 112.3 | Q95 Q96 Q97 G103 | Q95-Q99 WeakPolarHBondContact O-CB 3.4Å; Q95-Q99 PolarHBondContact O-N 2.77Å; Q96-Q99 PolarHBondContact O-N 2.87Å; Q97-Q99 VanDerWaalsContact C-N 3.32Å; Q97-Q99 PolarHBondContact O-N 2.96Å; Q99-G103 WeakPolarHBondContact O-CA 3.48Å; Q99-G103 PolarHBondContact O-N 3.31Å |
| 100 | Q | 79.1 | Confident | 73.9 | Confident | 142 Ų | 142 | 118.1 Ų | 118.1 | 66% | 0.664 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -69.8 | -39.1 | 171.2 | -76.7 | 174.1 | -3.3 | 0 | 0 | 112 | Q96 Q97 Q98 G103 | Q96-Q100 WeakPolarHBondContact O-CG 3.43Å; Q96-Q100 PolarHBondContact O-N 3.31Å; Q97-Q100 PolarHBondContact O-N 3.4Å; Q98-Q100 VanDerWaalsContact C-N 3.34Å; Q100-G103 PolarHBondContact O-N 3.37Å |
| 101 | Q | 73.7 | Confident | 71.6 | Confident | 142 Ų | 142 | 121 Ų | 121 | 66% | 0.664 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -70 | -34.8 | 177.5 | -72.4 | 179.6 | -5.8 | 0 | 0 | 113 | Q97 Q98 | Q97-Q101 WeakPolarHBondContact O-CG 3.4Å; Q97-Q101 PolarHBondContact O-N 2.78Å; Q98-Q101 PolarHBondContact O-N 2.96Å |
| 102 | N | 62.7 | Low | 69.1 | Low | 126 Ų | 126 | 129.6 Ų | 129.6 | 67% | 0.674 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -87.8 | -3.3 | 174.6 | -92.2 | 42.3 | 0 | 0 | 0 | 114.2 | Q98 G104 | Q98-N102 PolarHBondContact O-N 3.03Å; N102-G104 VanDerWaalsContact C-N 3.27Å; N102-G104 PolarHBondContact O-N 3.03Å |
| 103 | G | 54.8 | Low | 66.5 | Low | 59 Ų | 59 | 132.3 Ų | 132.3 | 61% | 0.608 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -76.2 | -4.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | Q99 Q100 Q105 | Q99-G103 WeakPolarHBondContact O-CA 3.48Å; Q99-G103 PolarHBondContact O-N 3.31Å; Q100-G103 PolarHBondContact O-N 3.37Å; G103-Q105 VanDerWaalsContact C-N 3.33Å |
| 104 | G | 51.4 | Low | 64.3 | Low | 76 Ų | 76 | 139.6 Ų | 139.6 | 78% | 0.784 | 70% | 0.695 | S | S | * | * | G | 310 helix | trans | -80.9 | -7.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | N102 | N102-G104 VanDerWaalsContact C-N 3.27Å; N102-G104 PolarHBondContact O-N 3.03Å |
| 105 | Q | 51.3 | Low | 61.6 | Low | 150 Ų | 150 | 138.7 Ų | 138.7 | 70% | 0.701 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -107.2 | 91.9 | 177.6 | -54.8 | -169.4 | -2.8 | 0 | 0 | 109.3 | G103 K107 | G103-Q105 VanDerWaalsContact C-N 3.33Å; Q105-K107 PolarHBondContact O-N 2.86Å |
| 106 | N | 48.8 | Very low | 59 | Low | 153 Ų | 153 | 137.4 Ų | 137.4 | 82% | 0.818 | 71% | 0.713 | S | S | * | * | trans | -51.9 | 82.2 | 163.7 | -107.1 | -39.1 | 0 | 0 | 0 | 110.4 | V108 | N106-V108 HydrophobicContact CB-CG2 4.48Å; N106-V108 PolarHBondContact O-N 2.76Å | ||
| 107 | K | 50.8 | Low | 56.7 | Low | 187 Ų | 187 | 137.9 Ų | 137.9 | 81% | 0.813 | 73% | 0.726 | S | S | * | * | trans | -83.1 | 81.6 | 152.2 | -70.8 | -67.7 | -176.2 | -176.3 | 0 | 105.8 | Q105 R109 | Q105-K107 PolarHBondContact O-N 2.86Å; K107-R109 VanDerWaalsContact C-N 3.32Å; K107-R109 PolarHBondContact O-N 2.99Å | ||
| 108 | V | 50.9 | Low | 54.2 | Low | 107 Ų | 107 | 139 Ų | 139 | 65% | 0.648 | 74% | 0.741 | S | S | * | * | trans | -49.7 | 102.9 | 163.6 | 177 | 0 | 0 | 0 | 0 | 106.6 | N106 P110 | N106-V108 HydrophobicContact CB-CG2 4.48Å; N106-V108 PolarHBondContact O-N 2.76Å; V108-P110 WeakPolarHBondContact O-CD 3.27Å | ||
| 109 | R | 55.5 | Low | 52 | Low | 227 Ų | 227 | 144 Ų | 144 | 86% | 0.857 | 75% | 0.754 | S | S | * | * | trans | -64.3 | 119.6 | 166.7 | -167.7 | 177 | 177.2 | -168.9 | -0.8 | 105.1 | K107 P111 | K107-R109 VanDerWaalsContact C-N 3.32Å; K107-R109 PolarHBondContact O-N 2.99Å; R109-P111 WeakPolarHBondContact O-CD 3.16Å | ||
| 110 | P | 47.1 | Very low | 49.7 | Very low | 103 Ų | 103 | 145.7 Ų | 145.7 | 67% | 0.669 | 76% | 0.762 | S | S | * | * | trans | -62.4 | 127.5 | -175.6 | 23.4 | -31.1 | 0 | 0 | 0 | 108.4 | V108 K112 | V108-P110 WeakPolarHBondContact O-CD 3.27Å; P110-K112 PolarHBondContact O-N 3.24Å | ||
| 111 | P | 50.4 | Low | 47.8 | Very low | 103 Ų | 103 | 145.1 Ų | 145.1 | 67% | 0.669 | 77% | 0.768 | S | S | * | * | trans | -65.1 | 112.1 | 171 | 26 | -30.4 | 0 | 0 | 0 | 107 | R109 K113 | R109-P111 WeakPolarHBondContact O-CD 3.16Å; P111-K113 PolarHBondContact O-N 3.02Å | ||
| 112 | K | 44.1 | Very low | 46 | Very low | 206 Ų | 206 | 143.4 Ų | 143.4 | 90% | 0.896 | 77% | 0.772 | S | S | * | * | trans | -63.8 | 86.4 | 166 | -72.5 | -172.4 | 175.9 | -175.8 | 0 | 107.8 | P110 K114 | P110-K112 PolarHBondContact O-N 3.24Å; K112-K114 PolarHBondContact O-N 3.16Å; K112-K114 VanDerWaalsContact O-N 3.15Å | ||
| 113 | K | 43.3 | Very low | 44.6 | Very low | 187 Ų | 187 | 142.6 Ų | 142.6 | 81% | 0.813 | 78% | 0.776 | S | S | * | * | trans | -66.5 | 105.1 | 161 | -71.9 | -171.8 | 177.6 | -177.2 | 0 | 106.6 | P111 S115 | P111-K113 PolarHBondContact O-N 3.02Å; K113-S115 PolarHBondContact O-N 2.9Å | ||
| 114 | K | 45.8 | Very low | 43.7 | Very low | 207 Ų | 207 | 147.9 Ų | 147.9 | 90% | 0.9 | 79% | 0.785 | S | S | * | * | trans | -70.2 | 88.7 | 158.3 | -76.4 | -177.8 | 176.1 | -176.3 | 0 | 106.6 | K112 | K112-K114 PolarHBondContact O-N 3.16Å; K112-K114 VanDerWaalsContact O-N 3.15Å | ||
| 115 | S | 40.5 | Very low | 43 | Very low | 109 Ų | 109 | 149.8 Ų | 149.8 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | trans | -86.4 | 101.5 | 158.5 | 179.1 | 0 | 0 | 0 | 0 | 106.3 | K113 | K113-S115 PolarHBondContact O-N 2.9Š| ||
| 116 | S | 38.2 | Very low | 42.1 | Very low | 97 Ų | 97 | 146.3 Ų | 146.3 | 68% | 0.678 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 132.6 | 165 | 35.1 | 0 | 0 | 0 | 0 | 109.2 | ||
| 117 | P | 42.8 | Very low | 41.3 | Very low | 122 Ų | 122 | 143.8 Ų | 143.8 | 79% | 0.792 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 119.9 | 170.8 | 30.7 | -27.1 | 0 | 0 | 0 | 108.8 | R119 | P117-R119 PolarHBondContact O-N 3.03Š|
| 118 | T | 37.2 | Very low | 40.7 | Very low | 137 Ų | 137 | 141.4 Ų | 141.4 | 84% | 0.84 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -72 | 123.4 | 168.2 | -49.2 | 0 | 0 | 0 | 0 | 107.9 | ||
| 119 | R | 39.8 | Very low | 39.9 | Very low | 228 Ų | 228 | 139.9 Ų | 139.9 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 118.7 | 178.6 | -163.5 | -177.8 | -172.4 | -159.5 | 2.1 | 108.1 | P117 | P117-R119 PolarHBondContact O-N 3.03Š|
| 120 | E | 34.6 | Very low | 39.1 | Very low | 192 Ų | 192 | 137.7 Ų | 137.7 | 90% | 0.897 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 132.8 | 169.1 | -66.6 | -157.1 | 129 | 0 | 0 | 110.3 | ||
| 121 | V | 39.7 | Very low | 38.6 | Very low | 130 Ų | 130 | 142.3 Ų | 142.3 | 79% | 0.788 | 81% | 0.813 | S | S | * | * | trans | -135.7 | 128.4 | 160.8 | 158.5 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 122 | S | 35.5 | Very low | 38.2 | Very low | 105 Ų | 105 | 143.2 Ų | 143.2 | 73% | 0.734 | 82% | 0.817 | S | S | * | * | trans | -50 | 150.6 | 179.7 | -44.9 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 123 | S | 34.8 | Very low | 38.9 | Very low | 110 Ų | 110 | 138.8 Ų | 138.8 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | 166.5 | 153.8 | 99.8 | -84.7 | 0 | 0 | 0 | 0 | 113 | |||||
| 124 | E | 34.5 | Very low | 39.6 | Very low | 169 Ų | 169 | 135 Ų | 135 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | trans | -64.5 | 156.9 | -168.8 | 63.4 | -156.2 | 87.8 | 0 | 0 | 119.8 | ||||
| 125 | S | 36.4 | Very low | 38.9 | Very low | 117 Ų | 117 | 130.9 Ų | 130.9 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | 70.7 | 121.6 | 139.6 | -68.1 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 126 | G | 32.4 | Very low | 38.8 | Very low | 76 Ų | 76 | 130.8 Ų | 130.8 | 78% | 0.784 | 80% | 0.795 | S | S | * | * | 124.3 | 111.3 | 118.6 | 0 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 127 | A | 33.3 | Very low | 38.8 | Very low | 101 Ų | 101 | 132.7 Ų | 132.7 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | trans | 80.3 | 107.3 | 143 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 128 | S | 37.9 | Very low | 38.5 | Very low | 136 Ų | 136 | 132.9 Ų | 132.9 | 95% | 0.951 | 80% | 0.802 | S | S | * | * | 56.7 | 130.9 | 117.7 | -144.5 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 129 | G | 34.8 | Very low | 38.7 | Very low | 75 Ų | 75 | 132 Ų | 132 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | trans | 150.6 | 108.7 | 154 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 130 | Q | 37.8 | Very low | 39.1 | Very low | 182 Ų | 182 | 127.6 Ų | 127.6 | 85% | 0.85 | 80% | 0.795 | S | S | * | * | trans | -63.4 | 145.8 | 173.6 | -154.1 | 127.4 | -1.1 | 0 | 0 | 113.6 | ||||
| 131 | F | 36 | Very low | 39.6 | Very low | 200 Ų | 200 | 124 Ų | 124 | 88% | 0.877 | 79% | 0.788 | S | S | * | * | 170.3 | 140.3 | 127.7 | -111.9 | -99.5 | 0 | 0 | 0 | 113.1 | |||||
| 132 | T | 41.8 | Very low | 39.5 | Very low | 121 Ų | 121 | 122.3 Ų | 122.3 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | trans | -122.1 | 175.9 | 166.5 | 49.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 133 | P | 58.8 | Low | 39.7 | Very low | 114 Ų | 114 | 125 Ų | 125 | 74% | 0.74 | 79% | 0.792 | S | S | * | * | cis | -131.1 | -143.2 | -26.1 | 36.3 | -13.5 | 0 | 0 | 0 | 109.4 | ||||
| 134 | P | 57.8 | Low | 39.8 | Very low | 108 Ų | 108 | 124.6 Ų | 124.6 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | cis | -116.6 | 179.5 | -30 | 29.7 | -7.4 | 0 | 0 | 0 | 111.4 | ||||
| 135 | T | 33.1 | Very low | 40.1 | Very low | 120 Ų | 120 | 123.1 Ų | 123.1 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | 170 | 150.6 | 79.3 | -26.3 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 136 | S | 37.8 | Very low | 40.4 | Very low | 106 Ų | 106 | 123.3 Ų | 123.3 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | trans | 68.8 | 105.4 | 147.3 | -50.1 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 137 | T | 38.2 | Very low | 40.8 | Very low | 137 Ų | 137 | 126.3 Ų | 126.3 | 84% | 0.84 | 80% | 0.797 | S | S | * | * | trans | -36.3 | 132 | 144.5 | -29.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 138 | T | 36.7 | Very low | 41.4 | Very low | 127 Ų | 127 | 125.9 Ų | 125.9 | 78% | 0.779 | 79% | 0.793 | S | S | * | * | 174.7 | 136.4 | 123.7 | -70 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 139 | T | 40.2 | Very low | 41.8 | Very low | 118 Ų | 118 | 125.2 Ų | 125.2 | 72% | 0.724 | 79% | 0.786 | S | S | * | * | trans | -41.5 | 126.7 | 175.9 | 48 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 140 | V | 48.3 | Very low | 42.5 | Very low | 136 Ų | 136 | 128.4 Ų | 128.4 | 82% | 0.824 | 79% | 0.79 | S | S | * | * | 163.6 | 151.9 | 109.2 | -79.9 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 141 | P | 45.4 | Very low | 42.6 | Very low | 116 Ų | 116 | 125.3 Ų | 125.3 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | -141.6 | 142.5 | 124.8 | 32.4 | -16.5 | 0 | 0 | 0 | 114.7 | |||||
| 142 | A | 38.2 | Very low | 43.5 | Very low | 95 Ų | 95 | 123.9 Ų | 123.9 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | -65.5 | 141.4 | 153.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 143 | I | 38.4 | Very low | 43.6 | Very low | 161 Ų | 161 | 128.7 Ų | 128.7 | 83% | 0.826 | 79% | 0.793 | S | S | * | * | trans | -134.3 | 123.7 | 159.6 | -64.3 | -179.4 | 0 | 0 | 0 | 108.9 | ||||
| 144 | S | 37.7 | Very low | 42.5 | Very low | 101 Ų | 101 | 128.8 Ų | 128.8 | 71% | 0.706 | 80% | 0.796 | S | S | * | * | trans | -68 | 139.8 | 174.5 | -54.1 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 145 | T | 41.6 | Very low | 42.1 | Very low | 138 Ų | 138 | 129 Ų | 129 | 85% | 0.847 | 80% | 0.798 | S | S | * | * | trans | 8 | 125.8 | 143.7 | 47.5 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 146 | S | 41.6 | Very low | 42.6 | Very low | 122 Ų | 122 | 127.8 Ų | 127.8 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | -155 | 140.7 | 125.1 | 66.7 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 147 | T | 40.3 | Very low | 42.6 | Very low | 139 Ų | 139 | 128.4 Ų | 128.4 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | trans | -74.4 | 142.5 | -174.9 | 33.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 148 | A | 46.8 | Very low | 42.9 | Very low | 91 Ų | 91 | 129.9 Ų | 129.9 | 75% | 0.752 | 81% | 0.805 | S | S | * | * | 165.3 | 142.3 | 113.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 149 | P | 46.7 | Very low | 43 | Very low | 123 Ų | 123 | 128.8 Ų | 128.8 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | trans | -84 | 131.6 | -177.7 | 32.8 | -33 | 0 | 0 | 0 | 112.5 | S151 | P149-S151 PolarHBondContact O-N 3.42Š| ||
| 150 | V | 49.3 | Very low | 43.5 | Very low | 141 Ų | 141 | 129 Ų | 129 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | trans | -79 | 113.1 | 170.7 | -78.4 | 0 | 0 | 0 | 0 | 110.7 | I152 | V150-I152 PolarHBondContact O-N 2.87Š| ||
| 151 | S | 40.4 | Very low | 43.2 | Very low | 118 Ų | 118 | 130.7 Ų | 130.7 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -55.1 | 114.1 | 174.3 | -57.5 | 0 | 0 | 0 | 0 | 112.4 | P149 W153 | P149-S151 PolarHBondContact O-N 3.42Å; S151-W153 VanDerWaalsContact C-N 3.32Å; S151-W153 PolarHBondContact O-N 3.27Å | ||
| 152 | I | 53.8 | Low | 43.1 | Very low | 169 Ų | 169 | 130.6 Ų | 130.6 | 87% | 0.867 | 81% | 0.811 | S | S | * | * | trans | -89.6 | 69.2 | 167.1 | -53.9 | 173.3 | 0 | 0 | 0 | 107.8 | V150 | V150-I152 PolarHBondContact O-N 2.87Š| ||
| 153 | W | 44.4 | Very low | 43.2 | Very low | 222 Ų | 222 | 133.5 Ų | 133.5 | 84% | 0.841 | 81% | 0.814 | S | S | * | * | trans | -168.3 | 102.2 | 158.1 | -158.7 | -84.1 | 0 | 0 | 0 | 110.3 | S151 | S151-W153 VanDerWaalsContact C-N 3.32Å; S151-W153 PolarHBondContact O-N 3.27Å | ||
| 154 | S | 36.4 | Very low | 43.9 | Very low | 116 Ų | 116 | 131.2 Ų | 131.2 | 81% | 0.811 | 81% | 0.81 | S | S | * | * | trans | -141 | 122.5 | 157.2 | -93.2 | 0 | 0 | 0 | 0 | 108.6 | A156 | S154-A156 PolarHBondContact O-N 3.44Š| ||
| 155 | P | 47.9 | Very low | 44.1 | Very low | 113 Ų | 113 | 133.8 Ų | 133.8 | 73% | 0.734 | 82% | 0.815 | S | S | * | * | trans | -87.2 | 105.5 | 172.7 | 32.6 | -25.1 | 0 | 0 | 0 | 108.2 | ||||
| 156 | A | 43.6 | Very low | 44 | Very low | 94 Ų | 94 | 132.7 Ų | 132.7 | 78% | 0.777 | 81% | 0.813 | S | S | * | * | trans | -92.2 | 128.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | S154 | S154-A156 PolarHBondContact O-N 3.44Š| ||
| 157 | S | 39.5 | Very low | 44 | Very low | 119 Ų | 119 | 132.7 Ų | 132.7 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | trans | -54.5 | 140 | -176.1 | -47 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 158 | I | 44.3 | Very low | 44.2 | Very low | 169 Ų | 169 | 131.1 Ų | 131.1 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | trans | -110.7 | 114 | 168.4 | -48.2 | 172.4 | 0 | 0 | 0 | 107 | ||||
| 159 | S | 38.3 | Very low | 43.8 | Very low | 103 Ų | 103 | 132.3 Ų | 132.3 | 72% | 0.72 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 150.5 | 167.9 | -74.2 | 0 | 0 | 0 | 0 | 110.7 | ||
| 160 | P | 49.9 | Very low | 43.5 | Very low | 124 Ų | 124 | 132.1 Ų | 132.1 | 81% | 0.805 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 124 | -179.1 | 33.2 | -29.9 | 0 | 0 | 0 | 110.2 | ||
| 161 | L | 42.3 | Very low | 43.4 | Very low | 170 Ų | 170 | 131 Ų | 131 | 89% | 0.89 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -100.6 | 125.2 | 165.8 | -92.5 | 157.5 | 0 | 0 | 0 | 108.7 | ||
| 162 | S | 43.4 | Very low | 43.7 | Very low | 114 Ų | 114 | 132.6 Ų | 132.6 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 131.6 | 174 | -36.4 | 0 | 0 | 0 | 0 | 109.5 | ||
| 163 | D | 40.5 | Very low | 43.4 | Very low | 157 Ų | 157 | 132.8 Ų | 132.8 | 84% | 0.84 | 80% | 0.797 | S | S | * | * | trans | -122.9 | 142.2 | 164.4 | -94.9 | -42.8 | 0 | 0 | 0 | 111.1 | ||||
| 164 | P | 53.7 | Low | 43 | Very low | 113 Ų | 113 | 132.2 Ų | 132.2 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | trans | -92.8 | 141.3 | -175.9 | 35.5 | -32.5 | 0 | 0 | 0 | 114.3 | ||||
| 165 | L | 41.5 | Very low | 43.1 | Very low | 155 Ų | 155 | 132.1 Ų | 132.1 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | 28.7 | 116 | 142.9 | -152.4 | 72.4 | 0 | 0 | 0 | 120.3 | ||||
| 166 | S | 39.9 | Very low | 42.9 | Very low | 115 Ų | 115 | 136.9 Ų | 136.9 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -165.7 | 98.4 | 132.7 | -83.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 167 | T | 40.3 | Very low | 43.3 | Very low | 122 Ų | 122 | 138 Ų | 138 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | 52.7 | 110.5 | 123.9 | -47.1 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 168 | S | 44.6 | Very low | 43.5 | Very low | 106 Ų | 106 | 141.1 Ų | 141.1 | 74% | 0.741 | 80% | 0.802 | S | S | * | * | trans | 80.1 | 112.6 | 131 | -158.1 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 169 | S | 38.8 | Very low | 43.1 | Very low | 115 Ų | 115 | 138.9 Ų | 138.9 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | -178.2 | 92.7 | 110.7 | 31.7 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 170 | S | 39.8 | Very low | 43 | Very low | 120 Ų | 120 | 142.7 Ų | 142.7 | 84% | 0.839 | 80% | 0.796 | S | S | * | * | trans | -100.4 | 107.2 | 167.6 | -178.1 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 171 | C | 47.9 | Very low | 42.5 | Very low | 117 Ų | 117 | 143.2 Ų | 143.2 | 79% | 0.791 | 80% | 0.797 | S | S | * | * | trans | -102.6 | 123.3 | 174.3 | 55.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 172 | M | 47.8 | Very low | 42.3 | Very low | 151 Ų | 151 | 141.8 Ų | 141.8 | 74% | 0.744 | 79% | 0.786 | S | S | * | * | trans | 85.2 | 73.9 | 163.2 | -51.7 | -97.9 | 71 | 0 | 0 | 116.8 | ||||
| 173 | Q | 46.6 | Very low | 41.8 | Very low | 174 Ų | 174 | 141.2 Ų | 141.2 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | -50.1 | 133 | 128.9 | -67.5 | 162 | -5.9 | 0 | 0 | 109.9 | |||||
| 174 | R | 35.1 | Very low | 41.7 | Very low | 210 Ų | 210 | 139.9 Ų | 139.9 | 79% | 0.792 | 79% | 0.791 | S | S | * | * | trans | -137.7 | 101.3 | 150.5 | -104.5 | -174.7 | -173.9 | -97.6 | 1.1 | 108.8 | ||||
| 175 | S | 38.9 | Very low | 40.8 | Very low | 113 Ų | 113 | 137.9 Ų | 137.9 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 135.6 | 160.1 | -53.4 | 0 | 0 | 0 | 0 | 109 | ||
| 176 | Y | 44.4 | Very low | 40.5 | Very low | 214 Ų | 214 | 141.7 Ų | 141.7 | 84% | 0.839 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 134.9 | 167.6 | -16.7 | -82.4 | 0 | 0 | 0 | 108.8 | ||
| 177 | P | 51.9 | Low | 40.5 | Very low | 117 Ų | 117 | 140.3 Ų | 140.3 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 144.7 | 172 | 31.9 | -31.2 | 0 | 0 | 0 | 111.3 | ||
| 178 | M | 44.3 | Very low | 40.3 | Very low | 185 Ų | 185 | 142.9 Ų | 142.9 | 91% | 0.911 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 131.1 | 169.7 | -158.6 | 61 | 171.9 | 0 | 0 | 110.1 | ||
| 179 | T | 36 | Very low | 39.9 | Very low | 122 Ų | 122 | 140.6 Ų | 140.6 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | -124.2 | 122.7 | 167.6 | -58 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 180 | Y | 35.1 | Very low | 39.8 | Very low | 182 Ų | 182 | 145.6 Ų | 145.6 | 71% | 0.714 | 79% | 0.786 | S | S | * | * | trans | -86.4 | 130.8 | -178.5 | -169.6 | -108.7 | 0 | 0 | 0 | 108.9 | Q182 | Y180-Q182 HydrophobicContact CD1-CG 3.81Å; Y180-Q182 HydrophobicContact CE1-CG 3.4Å; Y180-Q182 VanDerWaalsContact CE1-CG 3.4Å; Y180-Q182 VanDerWaalsContact CE1-OE1 3.31Å; Y180-Q182 PolarHBondContact OH-OE1 2.93Å; Y180-Q182 VanDerWaalsContact OH-OE1 3.11Å | ||
| 181 | T | 40.7 | Very low | 39.8 | Very low | 136 Ų | 136 | 144.7 Ų | 144.7 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | trans | -127.7 | 117.5 | 168.1 | -18.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 182 | Q | 36.7 | Very low | 39.3 | Very low | 140 Ų | 140 | 142.7 Ų | 142.7 | 65% | 0.654 | 79% | 0.786 | S | S | * | * | trans | -79.6 | 134.8 | 178.5 | -66.5 | -94.8 | 71.1 | 0 | 0 | 110.2 | Y180 | Y180-Q182 HydrophobicContact CD1-CG 3.81Å; Y180-Q182 HydrophobicContact CE1-CG 3.4Å; Y180-Q182 VanDerWaalsContact CE1-CG 3.4Å; Y180-Q182 VanDerWaalsContact CE1-OE1 3.31Å; Y180-Q182 PolarHBondContact OH-OE1 2.93Å; Y180-Q182 VanDerWaalsContact OH-OE1 3.11Å | ||
| 183 | A | 32.7 | Very low | 39.5 | Very low | 102 Ų | 102 | 141.3 Ų | 141.3 | 84% | 0.843 | 79% | 0.79 | S | S | * | * | trans | -149.1 | 123.3 | 149.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 184 | S | 39.6 | Very low | 39.2 | Very low | 128 Ų | 128 | 139.5 Ų | 139.5 | 90% | 0.895 | 79% | 0.792 | S | S | * | * | trans | -71.2 | 149.9 | -175.6 | -56.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 185 | G | 34.3 | Very low | 39.5 | Very low | 72 Ų | 72 | 134.4 Ų | 134.4 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | trans | 151.1 | 96.9 | 148.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 186 | Y | 34.2 | Very low | 39.7 | Very low | 234 Ų | 234 | 140.4 Ų | 140.4 | 92% | 0.918 | 80% | 0.795 | S | S | * | * | trans | 86.2 | 147.4 | 155.1 | -109.3 | -101.4 | 0 | 0 | 0 | 120.6 | ||||
| 187 | S | 41.3 | Very low | 39.5 | Very low | 86 Ų | 86 | 139.5 Ų | 139.5 | 60% | 0.601 | 80% | 0.796 | S | S | * | * | trans | -118.2 | 174.4 | -137.3 | 50.5 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 188 | Q | 35.9 | Very low | 38.9 | Very low | 177 Ų | 177 | 137.2 Ų | 137.2 | 83% | 0.827 | 79% | 0.794 | S | S | * | * | trans | 86.4 | 130.2 | 162.9 | -65.1 | -81.7 | 17.7 | 0 | 0 | 115.2 | ||||
| 189 | G | 35.4 | Very low | 38.9 | Very low | 57 Ų | 57 | 131.6 Ų | 131.6 | 59% | 0.588 | 78% | 0.783 | S | S | * | * | cis | 175.5 | 148.2 | 3.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 190 | Y | 37.2 | Very low | 39.4 | Very low | 220 Ų | 220 | 134.1 Ų | 134.1 | 86% | 0.863 | 79% | 0.788 | S | S | * | * | trans | 55 | 117.8 | 157.9 | -72.2 | -87.4 | 0 | 0 | 0 | 123.4 | ||||
| 191 | A | 38.8 | Very low | 40.1 | Very low | 101 Ų | 101 | 131 Ų | 131 | 84% | 0.835 | 78% | 0.784 | S | S | * | * | 69.7 | 131.5 | 125.5 | 0 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 192 | G | 38.6 | Very low | 40.5 | Very low | 76 Ų | 76 | 130.7 Ų | 130.7 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | trans | 131.9 | 91.5 | 146.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | T194 | G192-T194 PolarHBondContact O-N 2.83Š| ||
| 193 | S | 50.9 | Low | 41.2 | Very low | 121 Ų | 121 | 129.1 Ų | 129.1 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | -52.7 | 129.9 | 163.3 | -54.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 194 | T | 40.8 | Very low | 41.9 | Very low | 137 Ų | 137 | 128.8 Ų | 128.8 | 84% | 0.84 | 78% | 0.782 | S | S | * | * | trans | -159.3 | 136.8 | 153.6 | -86.5 | 0 | 0 | 0 | 0 | 111.7 | G192 | G192-T194 PolarHBondContact O-N 2.83Š| ||
| 195 | S | 41.3 | Very low | 42.5 | Very low | 103 Ų | 103 | 133.8 Ų | 133.8 | 72% | 0.72 | 78% | 0.783 | S | S | * | * | trans | -45.7 | 131.7 | -176.2 | 46.9 | 0 | 0 | 0 | 0 | 116.7 | F197 | S195-F197 PolarHBondContact O-N 3.31Š| ||
| 196 | Y | 44 | Very low | 43.4 | Very low | 238 Ų | 238 | 138.7 Ų | 138.7 | 93% | 0.933 | 79% | 0.791 | S | S | * | * | trans | -83.4 | 82.4 | 167.1 | -156.7 | -94.7 | 0 | 0 | 0 | 110.1 | ||||
| 197 | F | 39.7 | Very low | 43.9 | Very low | 196 Ų | 196 | 133.3 Ų | 133.3 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | trans | -133.1 | 86.2 | 158.2 | -149.5 | -90.2 | 0 | 0 | 0 | 107.4 | S195 G199 | S195-F197 PolarHBondContact O-N 3.31Å; F197-G199 PolarHBondContact O-N 2.91Å | ||
| 198 | G | 39.3 | Very low | 44.5 | Very low | 69 Ų | 69 | 134.7 Ų | 134.7 | 71% | 0.711 | 79% | 0.79 | S | S | * | * | trans | -70.4 | 93.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 199 | G | 44.8 | Very low | 44.9 | Very low | 67 Ų | 67 | 133.6 Ų | 133.6 | 69% | 0.691 | 79% | 0.787 | S | S | * | * | trans | -92.9 | 96.7 | 151.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | F197 | F197-G199 PolarHBondContact O-N 2.91Š| ||
| 200 | M | 47.2 | Very low | 45.3 | Very low | 174 Ų | 174 | 138.3 Ų | 138.3 | 86% | 0.857 | 79% | 0.793 | S | S | * | * | trans | -87 | 115.8 | 162.5 | -94 | 98.3 | 143.1 | 0 | 0 | 108.9 | ||||
| 201 | D | 48.7 | Very low | 45.5 | Very low | 118 Ų | 118 | 135.2 Ų | 135.2 | 63% | 0.631 | 79% | 0.786 | S | S | * | * | trans | -29.3 | 137.8 | 162.1 | 49.5 | -76.6 | 0 | 0 | 0 | 117 | ||||
| 202 | C | 50.2 | Low | 45.5 | Very low | 129 Ų | 129 | 138 Ų | 138 | 87% | 0.872 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -96 | 78.2 | 163.5 | 50 | 0 | 0 | 0 | 0 | 109.4 | ||
| 203 | S | 50.8 | Low | 45.6 | Very low | 106 Ų | 106 | 141.3 Ų | 141.3 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | trans | -154.5 | 70.3 | 170.8 | -81.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 204 | S | 47.6 | Very low | 45 | Very low | 96 Ų | 96 | 141.5 Ų | 141.5 | 67% | 0.671 | 78% | 0.782 | S | S | * | * | trans | -147.8 | 25.8 | 172.9 | -53.1 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 205 | Y | 51.5 | Low | 44.8 | Very low | 232 Ų | 232 | 138.5 Ų | 138.5 | 91% | 0.91 | 78% | 0.779 | S | S | * | * | trans | -119.7 | 28.1 | 174.9 | -90.3 | -78.7 | 0 | 0 | 0 | 114.8 | ||||
| 206 | L | 54.2 | Low | 45.2 | Very low | 176 Ų | 176 | 140.3 Ų | 140.3 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | trans | -117.1 | 96.8 | 154.2 | -89 | 92.1 | 0 | 0 | 0 | 108.7 | ||||
| 207 | T | 44.8 | Very low | 44.8 | Very low | 121 Ų | 121 | 132.6 Ų | 132.6 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | trans | -104.5 | 131.6 | 156.6 | -32.6 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 208 | P | 52.7 | Low | 44.9 | Very low | 115 Ų | 115 | 129.1 Ų | 129.1 | 75% | 0.747 | 78% | 0.781 | S | S | * | * | trans | -80.2 | 124.8 | 170.5 | 5.6 | 11.7 | 0 | 0 | 0 | 108.9 | ||||
| 209 | M | 44.5 | Very low | 45.3 | Very low | 153 Ų | 153 | 131.9 Ų | 131.9 | 75% | 0.754 | 78% | 0.784 | S | S | * | * | trans | -97 | 108.3 | 167.2 | -97.4 | -68.1 | 146.9 | 0 | 0 | 110 | ||||
| 210 | H | 42.9 | Very low | 45.2 | Very low | 157 Ų | 157 | 136.4 Ų | 136.4 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -80.1 | 117.9 | 172.1 | 171 | -115.9 | 0 | 0 | 0 | 109 | ||||
| 211 | H | 43 | Very low | 45.4 | Very low | 154 Ų | 154 | 133.3 Ų | 133.3 | 71% | 0.713 | 79% | 0.787 | S | S | * | * | trans | -123.4 | 133.6 | 167.3 | -43.2 | 131.1 | 0 | 0 | 0 | 110.5 | ||||
| 212 | Q | 38.6 | Very low | 45.4 | Very low | 159 Ų | 159 | 134.1 Ų | 134.1 | 74% | 0.743 | 80% | 0.799 | S | S | * | * | trans | -40.6 | 155.8 | -175.6 | -67.7 | -80.5 | 17 | 0 | 0 | 119 | ||||
| 213 | L | 40.3 | Very low | 45 | Very low | 147 Ų | 147 | 136.5 Ų | 136.5 | 77% | 0.77 | 80% | 0.799 | S | S | * | * | trans | -52.8 | 142.7 | 176.1 | -67.2 | 87.5 | 0 | 0 | 0 | 115.3 | ||||
| 214 | S | 38.6 | Very low | 44.7 | Very low | 125 Ų | 125 | 136.7 Ų | 136.7 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | 179.5 | 130.1 | 120.6 | -80.3 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 215 | G | 36.9 | Very low | 44.6 | Very low | 74 Ų | 74 | 138.7 Ų | 138.7 | 76% | 0.763 | 81% | 0.809 | S | S | * | * | trans | 105.2 | 126.1 | 152.8 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 216 | P | 48.5 | Very low | 44.1 | Very low | 140 Ų | 140 | 135.7 Ų | 135.7 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | trans | -93.6 | 153.6 | -170.7 | 37 | -32.3 | 0 | 0 | 0 | 113.5 | ||||
| 217 | G | 37 | Very low | 43.3 | Very low | 76 Ų | 76 | 131.6 Ų | 131.6 | 78% | 0.784 | 80% | 0.8 | S | S | * | * | trans | 117.4 | 90.1 | 152.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 218 | S | 39.9 | Very low | 43.3 | Very low | 124 Ų | 124 | 132.3 Ų | 132.3 | 87% | 0.867 | 80% | 0.804 | S | S | * | * | trans | -114 | 102.3 | 159.6 | -63.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 219 | T | 48.9 | Very low | 42.7 | Very low | 126 Ų | 126 | 133 Ų | 133 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -143.5 | 132.2 | 150.8 | 72.8 | 0 | 0 | 0 | 0 | 102.6 | ||||
| 220 | L | 43.3 | Very low | 42.6 | Very low | 162 Ų | 162 | 130.4 Ų | 130.4 | 85% | 0.848 | 80% | 0.803 | S | S | * | * | cis | -161.9 | 167.6 | 36.4 | -69 | 161.2 | 0 | 0 | 0 | 108.8 | ||||
| 221 | S | 50.8 | Low | 42.4 | Very low | 110 Ų | 110 | 130.7 Ų | 130.7 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | -48.3 | 157.3 | 175.3 | -45.6 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 222 | P | 48.6 | Very low | 42.2 | Very low | 135 Ų | 135 | 130 Ų | 130 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | trans | -88.1 | 120.6 | 161.5 | 33.2 | -26.8 | 0 | 0 | 0 | 110.1 | ||||
| 223 | M | 41.5 | Very low | 42.2 | Very low | 178 Ų | 178 | 129.1 Ų | 129.1 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | trans | -116.4 | 128.1 | 163 | -153.5 | 171.2 | 88.5 | 0 | 0 | 109.2 | ||||
| 224 | S | 44.2 | Very low | 42.1 | Very low | 111 Ų | 111 | 130.1 Ų | 130.1 | 78% | 0.776 | 81% | 0.807 | S | S | * | * | trans | -51.7 | 139.4 | 175.1 | -55.3 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 225 | T | 45.5 | Very low | 42.3 | Very low | 137 Ų | 137 | 129.6 Ų | 129.6 | 84% | 0.84 | 80% | 0.803 | S | S | * | * | trans | -142.3 | 121.7 | 145.3 | 46 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 226 | N | 40.3 | Very low | 43 | Very low | 170 Ų | 170 | 131.5 Ų | 131.5 | 91% | 0.909 | 80% | 0.802 | S | S | * | * | trans | -77.8 | 135.7 | 157.8 | -93.1 | -19.6 | 0 | 0 | 0 | 108 | ||||
| 227 | A | 37.4 | Very low | 42.6 | Very low | 90 Ų | 90 | 128.9 Ų | 128.9 | 74% | 0.744 | 79% | 0.792 | S | S | * | * | trans | -169.8 | 115.3 | 142.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 228 | V | 46.8 | Very low | 42.7 | Very low | 135 Ų | 135 | 130.4 Ų | 130.4 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | 12.9 | 134.5 | 141.4 | -60.2 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 229 | T | 39.8 | Very low | 42.6 | Very low | 129 Ų | 129 | 132 Ų | 132 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | -170.8 | 123.7 | 121.7 | -61.5 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 230 | S | 42.2 | Very low | 42 | Very low | 100 Ų | 100 | 130.5 Ų | 130.5 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | trans | -63.1 | 142.1 | 171.2 | 44.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 231 | H | 37.3 | Very low | 41.7 | Very low | 163 Ų | 163 | 128.4 Ų | 128.4 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | 170.9 | 145.9 | 124.1 | 55.6 | -94.3 | 0 | 0 | 0 | 116.6 | |||||
| 232 | L | 39.2 | Very low | 41.3 | Very low | 139 Ų | 139 | 130.9 Ų | 130.9 | 73% | 0.728 | 78% | 0.777 | S | S | * | * | trans | 66.7 | 109.1 | 154.7 | -71.8 | 139.4 | 0 | 0 | 0 | 118.8 | ||||
| 233 | N | 39.1 | Very low | 40.6 | Very low | 140 Ų | 140 | 128.1 Ų | 128.1 | 75% | 0.749 | 77% | 0.773 | S | S | * | * | 58.7 | 100.2 | 67.3 | -160.1 | 37.4 | 0 | 0 | 0 | 114.5 | |||||
| 234 | Q | 37.8 | Very low | 40.5 | Very low | 169 Ų | 169 | 129.7 Ų | 129.7 | 79% | 0.79 | 77% | 0.77 | S | S | * | * | trans | 173.5 | 118.7 | 135.1 | -99 | 156.2 | 91.7 | 0 | 0 | 112.4 | ||||
| 235 | S | 42.3 | Very low | 40.1 | Very low | 113 Ų | 113 | 127.4 Ų | 127.4 | 79% | 0.79 | 77% | 0.765 | S | S | * | * | trans | -82.2 | 155 | 139.9 | -55.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 236 | P | 52.6 | Low | 39.8 | Very low | 115 Ų | 115 | 127.9 Ų | 127.9 | 75% | 0.747 | 77% | 0.768 | S | S | * | * | -150.6 | 149.8 | 95 | 35 | -15.7 | 0 | 0 | 0 | 116.7 | |||||
| 237 | A | 39.5 | Very low | 40.1 | Very low | 85 Ų | 85 | 125.9 Ų | 125.9 | 70% | 0.702 | 77% | 0.767 | S | S | * | * | 52.6 | 129 | 129.5 | 0 | 0 | 0 | 0 | 0 | 123.7 | |||||
| 238 | S | 39 | Very low | 40 | Very low | 108 Ų | 108 | 125.5 Ų | 125.5 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | 82 | 126 | 122.7 | 61.6 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 239 | L | 37.6 | Very low | 39.9 | Very low | 158 Ų | 158 | 127.9 Ų | 127.9 | 83% | 0.827 | 78% | 0.779 | S | S | * | * | trans | -172.9 | 108.5 | 130.4 | -93.8 | 151.9 | 0 | 0 | 0 | 106.3 | ||||
| 240 | S | 36.4 | Very low | 39.6 | Very low | 93 Ų | 93 | 125.3 Ų | 125.3 | 65% | 0.65 | 78% | 0.778 | S | S | * | * | 70.5 | 135.9 | 98.6 | 69.9 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 241 | T | 38 | Very low | 39.3 | Very low | 119 Ų | 119 | 129.8 Ų | 129.8 | 73% | 0.73 | 79% | 0.785 | S | S | * | * | cis | -172.2 | 147.2 | 4.3 | -83.1 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 242 | Q | 42.1 | Very low | 39.2 | Very low | 161 Ų | 161 | 128 Ų | 128 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | trans | 7.9 | 140.3 | 155 | -59 | 179 | -35.5 | 0 | 0 | 121.8 | ||||
| 243 | G | 34.8 | Very low | 39 | Very low | 77 Ų | 77 | 125.7 Ų | 125.7 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | trans | -166.2 | 111.3 | 154.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 244 | Y | 37.5 | Very low | 38.8 | Very low | 211 Ų | 211 | 125.6 Ų | 125.6 | 83% | 0.827 | 78% | 0.781 | S | S | * | * | trans | -61 | 158.2 | -176.4 | -66.5 | -102 | 0 | 0 | 0 | 114.8 | ||||
| 245 | G | 36 | Very low | 39.1 | Very low | 64 Ų | 64 | 121.8 Ų | 121.8 | 66% | 0.66 | 78% | 0.778 | S | S | * | * | trans | 146.2 | 96.5 | 139.8 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 246 | T | 39.4 | Very low | 38.9 | Very low | 147 Ų | 147 | 124.5 Ų | 124.5 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | trans | 79.4 | 123.3 | 137.8 | 92.3 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 247 | S | 46.4 | Very low | 38.1 | Very low | 127 Ų | 127 | 124 Ų | 124 | 89% | 0.888 | 78% | 0.782 | S | S | * | * | trans | -79.2 | 150 | 161.9 | -46.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 248 | G | 37.1 | Very low | 38.3 | Very low | 82 Ų | 82 | 128.1 Ų | 128.1 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -169.1 | 110.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 249 | L | 43.4 | Very low | 38.4 | Very low | 186 Ų | 186 | 129.2 Ų | 129.2 | 97% | 0.974 | 79% | 0.789 | S | S | * | * | trans | -79.2 | 151 | 175.3 | -65.1 | 162.6 | 0 | 0 | 0 | 111.1 | ||||
| 250 | G | 34.8 | Very low | 38.4 | Very low | 74 Ų | 74 | 132.4 Ų | 132.4 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | trans | 118.2 | 105 | 138.4 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 251 | F | 34.1 | Very low | 38.7 | Very low | 195 Ų | 195 | 136.8 Ų | 136.8 | 86% | 0.855 | 80% | 0.799 | S | S | * | * | trans | 70.7 | 117.9 | 130.1 | -118 | -107.3 | 0 | 0 | 0 | 123.7 | ||||
| 252 | N | 35.4 | Very low | 38.8 | Very low | 126 Ų | 126 | 137.8 Ų | 137.8 | 67% | 0.674 | 80% | 0.8 | S | S | * | * | trans | 82.9 | 124.3 | 135.6 | -107.7 | 10.5 | 0 | 0 | 0 | 124.9 | ||||
| 253 | S | 35.7 | Very low | 38.5 | Very low | 89 Ų | 89 | 139 Ų | 139 | 62% | 0.622 | 81% | 0.805 | S | S | * | * | 63.9 | 106.8 | 129.9 | -65.3 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 254 | T | 35.8 | Very low | 38.5 | Very low | 138 Ų | 138 | 138.8 Ų | 138.8 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | -169 | 107.4 | 119.1 | 39.7 | 0 | 0 | 0 | 0 | 107.2 | |||||
| 255 | A | 43 | Very low | 38.7 | Very low | 89 Ų | 89 | 132.8 Ų | 132.8 | 74% | 0.736 | 79% | 0.79 | S | S | * | * | 71.3 | 92.7 | 104.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 256 | D | 38.7 | Very low | 38.8 | Very low | 171 Ų | 171 | 133.8 Ų | 133.8 | 91% | 0.914 | 79% | 0.787 | S | S | * | * | trans | -151.4 | 136.8 | 139.5 | -108 | -51.1 | 0 | 0 | 0 | 111 | ||||
| 257 | C | 34.4 | Very low | 38.8 | Very low | 105 Ų | 105 | 138.5 Ų | 138.5 | 71% | 0.709 | 79% | 0.788 | S | S | * | * | trans | -78.2 | 124.6 | -163.5 | -177.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 258 | L | 44 | Very low | 38.3 | Very low | 171 Ų | 171 | 140.8 Ų | 140.8 | 90% | 0.895 | 78% | 0.782 | S | S | * | * | trans | -120.3 | 89.9 | 154.7 | -81.9 | 173.3 | 0 | 0 | 0 | 108.7 | Y260 | L258-Y260 PolarHBondContact O-N 2.79Š| ||
| 259 | D | 40.8 | Very low | 38.5 | Very low | 131 Ų | 131 | 144.4 Ų | 144.4 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | -59.8 | 107.4 | 162.8 | 179.4 | -109 | 0 | 0 | 0 | 109.8 | ||||
| 260 | Y | 39.3 | Very low | 38 | Very low | 225 Ų | 225 | 141.6 Ų | 141.6 | 88% | 0.882 | 77% | 0.767 | S | S | * | * | trans | -141.4 | 80.4 | 156.9 | -111.9 | -86.3 | 0 | 0 | 0 | 109.1 | L258 | L258-Y260 PolarHBondContact O-N 2.79Š| ||
| 261 | K | 41.4 | Very low | 38.1 | Very low | 185 Ų | 185 | 147.1 Ų | 147.1 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | 35.1 | 92.2 | 134.5 | -161 | 160.6 | 178.4 | 168.6 | 0 | 116.3 | Q263 | K261-Q263 PolarHBondContact O-N 2.86Š| ||
| 262 | D | 39.6 | Very low | 38 | Very low | 140 Ų | 140 | 144.6 Ų | 144.6 | 75% | 0.749 | 77% | 0.766 | S | S | * | * | trans | -50.1 | 123.7 | 159.6 | -168.5 | -79.7 | 0 | 0 | 0 | 111.5 | A264 | D262-A264 PolarHBondContact OD1-N 3.03Å; D262-A264 VanDerWaalsContact OD1-N 3.16Å | ||
| 263 | Q | 35.9 | Very low | 38.3 | Very low | 186 Ų | 186 | 142 Ų | 142 | 87% | 0.869 | 76% | 0.762 | S | S | * | * | trans | -135.3 | 78.7 | 151.9 | -161.8 | 166.8 | 71.7 | 0 | 0 | 107.9 | K261 A265 | K261-Q263 PolarHBondContact O-N 2.86Å; Q263-A265 VanDerWaalsContact C-N 3.33Å; Q263-A265 PolarHBondContact O-N 3.48Å | ||
| 264 | A | 36.5 | Very low | 38.3 | Very low | 73 Ų | 73 | 145.1 Ų | 145.1 | 60% | 0.603 | 77% | 0.772 | S | S | * | * | trans | -58.6 | 89.7 | 165.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | D262 S266 | D262-A264 PolarHBondContact OD1-N 3.03Å; D262-A264 VanDerWaalsContact OD1-N 3.16Å; A264-S266 PolarHBondContact O-N 3.32Å | ||
| 265 | A | 40.7 | Very low | 38.4 | Very low | 84 Ų | 84 | 143.3 Ų | 143.3 | 69% | 0.694 | 76% | 0.764 | S | S | * | * | trans | -79.6 | 68 | 154.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | Q263 W267 | Q263-A265 VanDerWaalsContact C-N 3.33Å; Q263-A265 PolarHBondContact O-N 3.48Å; A265-W267 PolarHBondContact O-N 3.08Å; A265-W267 VanDerWaalsContact O-N 3.14Å | ||
| 266 | S | 37.8 | Very low | 38.5 | Very low | 85 Ų | 85 | 146.5 Ų | 146.5 | 59% | 0.594 | 77% | 0.768 | S | S | * | * | trans | -61.4 | 109.5 | 170.7 | -171.5 | 0 | 0 | 0 | 0 | 108.2 | A264 K268 | A264-S266 PolarHBondContact O-N 3.32Å; S266-K268 PolarHBondContact O-N 3.39Å | ||
| 267 | W | 39.9 | Very low | 38.8 | Very low | 246 Ų | 246 | 144.5 Ų | 144.5 | 93% | 0.932 | 76% | 0.757 | S | S | * | * | trans | -67.1 | 70.2 | 164.5 | -64.8 | 84.2 | 0 | 0 | 0 | 108.8 | A265 L269 | A265-W267 PolarHBondContact O-N 3.08Å; A265-W267 VanDerWaalsContact O-N 3.14Å; W267-L269 VanDerWaalsContact C-N 3.34Å; W267-L269 PolarHBondContact O-N 3.02Å; W267-L269 VanDerWaalsContact O-N 3.1Å | ||
| 268 | K | 35.3 | Very low | 38.8 | Very low | 176 Ų | 176 | 149.9 Ų | 149.9 | 77% | 0.765 | 76% | 0.764 | S | S | * | * | trans | -86.3 | 82.5 | -179.1 | -142.3 | 169.9 | 177.2 | 173.6 | 0 | 107.9 | S266 N270 | S266-K268 PolarHBondContact O-N 3.39Å; K268-N270 PolarHBondContact O-N 3.28Å; K268-N270 VanDerWaalsContact O-N 3.08Å | ||
| 269 | L | 42.4 | Very low | 38.8 | Very low | 157 Ų | 157 | 149.9 Ų | 149.9 | 82% | 0.822 | 76% | 0.757 | S | S | * | * | trans | -68 | 98 | 161.9 | -68.7 | 178.7 | 0 | 0 | 0 | 107.6 | W267 | W267-L269 VanDerWaalsContact C-N 3.34Å; W267-L269 PolarHBondContact O-N 3.02Å; W267-L269 VanDerWaalsContact O-N 3.1Å | ||
| 270 | N | 32.2 | Very low | 39.2 | Very low | 127 Ų | 127 | 149.3 Ų | 149.3 | 68% | 0.679 | 75% | 0.754 | S | S | * | * | trans | -89.5 | 107.7 | 168.3 | -162 | -21 | 0 | 0 | 0 | 108 | K268 N272 | K268-N270 PolarHBondContact O-N 3.28Å; K268-N270 VanDerWaalsContact O-N 3.08Å; N270-N272 PolarHBondContact O-N 3.19Å | ||
| 271 | F | 37.6 | Very low | 39.2 | Very low | 191 Ų | 191 | 147.1 Ų | 147.1 | 84% | 0.838 | 75% | 0.751 | S | S | * | * | trans | -74.5 | 110.9 | 160.5 | -89 | -91.9 | 0 | 0 | 0 | 107.5 | ||||
| 272 | N | 30.8 | Very low | 39.5 | Very low | 142 Ų | 142 | 143.6 Ų | 143.6 | 76% | 0.759 | 75% | 0.746 | S | S | * | * | trans | -111 | 110 | 151.8 | -113.3 | -101.5 | 0 | 0 | 0 | 107.7 | N270 | N270-N272 PolarHBondContact O-N 3.19Š| ||
| 273 | A | 43 | Very low | 39.5 | Very low | 72 Ų | 72 | 141.5 Ų | 141.5 | 60% | 0.595 | 74% | 0.742 | S | S | * | * | trans | -63.6 | 157 | 149.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 274 | D | 36.2 | Very low | 39.7 | Very low | 153 Ų | 153 | 137.8 Ų | 137.8 | 82% | 0.818 | 74% | 0.737 | S | S | * | * | trans | 93.1 | 102.6 | 173.8 | -67.5 | -71.5 | 0 | 0 | 0 | 118.5 | ||||
| 275 | C | 36.2 | Very low | 39.8 | Very low | 100 Ų | 100 | 146.2 Ų | 146.2 | 68% | 0.676 | 75% | 0.753 | S | S | * | * | 84.7 | 109.8 | 119 | -148.6 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 276 | L | 45.5 | Very low | 40 | Very low | 157 Ų | 157 | 150.4 Ų | 150.4 | 82% | 0.822 | 76% | 0.756 | S | S | * | * | trans | 58.2 | 135 | 139.4 | -74.6 | 170 | 0 | 0 | 0 | 121.4 | ||||
| 277 | D | 44.8 | Very low | 40.2 | Very low | 129 Ų | 129 | 155.2 Ų | 155.2 | 69% | 0.69 | 77% | 0.766 | S | S | * | * | trans | 77.2 | 98.7 | 152.3 | -143 | -98.2 | 0 | 0 | 0 | 118.1 | ||||
| 278 | Y | 35.4 | Very low | 40.1 | Very low | 217 Ų | 217 | 151 Ų | 151 | 85% | 0.851 | 76% | 0.757 | S | S | * | * | -163.2 | 97.6 | 126.6 | -130.4 | -102.3 | 0 | 0 | 0 | 112.2 | |||||
| 279 | K | 43.8 | Very low | 40.5 | Very low | 172 Ų | 172 | 148.7 Ų | 148.7 | 75% | 0.748 | 76% | 0.757 | S | S | * | * | 5.6 | 124.5 | 129.5 | -162.3 | 164.7 | 170.6 | -179.9 | 0 | 117.7 | |||||
| 280 | D | 49.4 | Very low | 40.8 | Very low | 119 Ų | 119 | 152.5 Ų | 152.5 | 64% | 0.636 | 78% | 0.777 | S | S | * | * | trans | 52.8 | 102.1 | 145.5 | -127.8 | -75.5 | 0 | 0 | 0 | 119.8 | ||||
| 281 | Q | 38.6 | Very low | 41.3 | Very low | 178 Ų | 178 | 153.8 Ų | 153.8 | 83% | 0.832 | 78% | 0.782 | S | S | * | * | trans | -137.3 | 74.9 | 148.9 | -161.4 | 87.4 | 70 | 0 | 0 | 109 | S283 | Q281-S283 PolarHBondContact O-N 3.48Š| ||
| 282 | T | 47.6 | Very low | 41.5 | Very low | 112 Ų | 112 | 151.8 Ų | 151.8 | 69% | 0.687 | 78% | 0.779 | S | S | * | * | trans | -70.5 | 114.4 | 159 | 66.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 283 | S | 39.8 | Very low | 42.1 | Very low | 95 Ų | 95 | 152.3 Ų | 152.3 | 66% | 0.664 | 78% | 0.78 | S | S | * | * | trans | -162.3 | 90 | 167 | -78.1 | 0 | 0 | 0 | 0 | 111.9 | Q281 | Q281-S283 PolarHBondContact O-N 3.48Š| ||
| 284 | S | 40.4 | Very low | 42 | Very low | 109 Ų | 109 | 157.1 Ų | 157.1 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | trans | 51.7 | 91.3 | 134.1 | -153.1 | 0 | 0 | 0 | 0 | 119.2 | K286 | S284-K286 PolarHBondContact O-N 3.11Š| ||
| 285 | W | 39.1 | Very low | 42.4 | Very low | 250 Ų | 250 | 157.3 Ų | 157.3 | 95% | 0.947 | 79% | 0.789 | S | S | * | * | trans | -80.9 | 93 | 154.4 | -66.1 | 93.5 | 0 | 0 | 0 | 108.8 | ||||
| 286 | K | 43.7 | Very low | 42.8 | Very low | 172 Ų | 172 | 161.1 Ų | 161.1 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | trans | -88.8 | 106.4 | 170.2 | -167.8 | 177.8 | 175 | -177.9 | 0 | 108.8 | S284 | S284-K286 PolarHBondContact O-N 3.11Š| ||
| 287 | F | 42 | Very low | 42.6 | Very low | 185 Ų | 185 | 161.4 Ų | 161.4 | 81% | 0.811 | 80% | 0.795 | S | S | * | * | trans | -71.7 | 123.3 | 170.5 | -106.4 | -95.8 | 0 | 0 | 0 | 109.6 | ||||
| 288 | Q | 39.1 | Very low | 42.4 | Very low | 158 Ų | 158 | 163.9 Ų | 163.9 | 74% | 0.738 | 80% | 0.803 | S | S | * | * | trans | -104.2 | 114.6 | 167.4 | -165.7 | 93.6 | 9.2 | 0 | 0 | 106.7 | ||||
| 289 | V | 42.6 | Very low | 43 | Very low | 128 Ų | 128 | 159.5 Ų | 159.5 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | trans | -92.8 | 126.4 | 171.5 | 175.5 | 0 | 0 | 0 | 0 | 107 | ||||
| 290 | L | 49.7 | Very low | 42.9 | Very low | 236 Ų | 236 | 158.4 Ų | 158.4 | 100% | 1.236 | 80% | 0.803 | S | S | * | * | trans | -90.7 | 0 | 163.2 | -87.3 | 145.1 | 0 | 0 | 0 | 108.6 |
Retrieved 290 of 290 residues in 100.5 ms
(Link to these results)