| 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 | 40.4 | Very low | 55.3 | Low | 244 Ų | 244 | 148.4 Ų | 148.4 | 100% | 1.202 | 78% | 0.781 | S | S | * | * | 0 | 103.1 | 0 | -73.3 | 170.3 | 163.4 | 0 | 0 | 106.1 | |||||
| 2 | T | 43.7 | Very low | 55.8 | Low | 94 Ų | 94 | 146.8 Ų | 146.8 | 58% | 0.577 | 76% | 0.759 | S | S | * | * | trans | -89 | 122.4 | -170.7 | 47.7 | 0 | 0 | 0 | 0 | 110.3 | E4 | T2-E4 VanDerWaalsContact C-N 3.25Å; T2-E4 WeakPolarHBondContact CB-OE1 2.97Å; T2-E4 PolarHBondContact O-N 3.24Å; T2-E4 PolarHBondContact OG1-OE1 2.68Å | ||
| 3 | T | 50.3 | Low | 56.7 | Low | 143 Ų | 143 | 141.8 Ų | 141.8 | 88% | 0.877 | 74% | 0.742 | S | S | * | * | trans | -89.6 | 55.5 | 177.9 | 48.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 4 | E | 51 | Low | 56.2 | Low | 134 Ų | 134 | 141.6 Ų | 141.6 | 63% | 0.626 | 75% | 0.753 | S | S | * | * | trans | -105.4 | 2.4 | -176.5 | 64.3 | -158.4 | 139.9 | 0 | 0 | 113.7 | T2 | T2-E4 VanDerWaalsContact C-N 3.25Å; T2-E4 WeakPolarHBondContact CB-OE1 2.97Å; T2-E4 PolarHBondContact O-N 3.24Å; T2-E4 PolarHBondContact OG1-OE1 2.68Å | ||
| 5 | W | 57.2 | Low | 56.3 | Low | 210 Ų | 210 | 137.9 Ų | 137.9 | 80% | 0.795 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | 5.6 | -172.6 | -67.3 | 100.5 | 0 | 0 | 0 | 116.2 | ||
| 6 | L | 54.3 | Low | 56.5 | Low | 160 Ų | 160 | 134.1 Ų | 134.1 | 84% | 0.838 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105 | 4.2 | -175 | -70.9 | 177.5 | 0 | 0 | 0 | 115.7 | ||
| 7 | H | 54 | Low | 57.1 | Low | 178 Ų | 178 | 129 Ų | 129 | 82% | 0.824 | 73% | 0.729 | S | S | * | * | trans | -116.6 | 56.9 | 179.4 | -70.1 | -94.4 | 0 | 0 | 0 | 111.6 | ||||
| 8 | L | 62.2 | Low | 57.6 | Low | 150 Ų | 150 | 127.4 Ų | 127.4 | 79% | 0.785 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 127.9 | 157.7 | -81.2 | 144.7 | 0 | 0 | 0 | 107.5 | ||
| 9 | P | 65.9 | Low | 57.9 | Low | 104 Ų | 104 | 125.2 Ų | 125.2 | 68% | 0.675 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -57 | 143.3 | 170.5 | 24.8 | -31.9 | 0 | 0 | 0 | 108.8 | ||
| 10 | P | 61.8 | Low | 58.6 | Low | 104 Ų | 104 | 122.7 Ų | 122.7 | 68% | 0.675 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 135.4 | 176.5 | 20.4 | -30.1 | 0 | 0 | 0 | 108.9 | Y12 | P10-Y12 PolarHBondContact O-N 3.28Š|
| 11 | P | 67.7 | Low | 59.4 | Low | 111 Ų | 111 | 119.6 Ų | 119.6 | 72% | 0.721 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -66.2 | 4.8 | -173.4 | 22.9 | -31.2 | 0 | 0 | 0 | 114.2 | ||
| 12 | Y | 61.4 | Low | 61.3 | Low | 129 Ų | 129 | 111.7 Ų | 111.7 | 51% | 0.506 | 67% | 0.668 | S | S | . | * | S | Bend | trans | -131.4 | 139.4 | -175.8 | -54.8 | -72.4 | 0 | 0 | 0 | 111.7 | P10 V16 P18 | P10-Y12 PolarHBondContact O-N 3.28Å; Y12-V16 WeakPolarHBondContact CB-O 3.21Å; Y12-P18 HydrophobicContact CE2-CG 4.41Å |
| 13 | P | 67.7 | Low | 63.2 | Low | 83 Ų | 83 | 111.7 Ų | 111.7 | 54% | 0.539 | 66% | 0.662 | S | S | . | * | trans | -64.1 | 154 | 178.7 | 26.2 | -33 | 0 | 0 | 0 | 111.8 | G15 V16 | P13-G15 PolarHBondContact O-N 3.2Å; P13-V16 HydrophobicContact CG-CB 4.16Å; P13-V16 HydrophobicContact CG-CG2 4.04Å; P13-V16 PolarHBondContact O-N 2.83Å; P13-V16 VanDerWaalsContact O-N 3.1Å | ||
| 14 | P | 48.8 | Very low | 65 | Low | 138 Ų | 138 | 108.2 Ų | 108.2 | 90% | 0.896 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.1 | 123 | -179.4 | -23.8 | 33.2 | 0 | 0 | 0 | 112 | ||
| 15 | G | 57.8 | Low | 66.6 | Low | 87 Ų | 87 | 107 Ų | 107 | 90% | 0.897 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 98 | -11.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | P13 | P13-G15 PolarHBondContact O-N 3.2Š|
| 16 | V | 60.7 | Low | 68.2 | Low | 76 Ų | 76 | 99.7 Ų | 99.7 | 46% | 0.461 | 62% | 0.616 | S | S | . | * | trans | -105.6 | 82.8 | 172.1 | -169.9 | 0 | 0 | 0 | 0 | 107 | Y12 P13 | Y12-V16 WeakPolarHBondContact CB-O 3.21Å; P13-V16 HydrophobicContact CG-CB 4.16Å; P13-V16 HydrophobicContact CG-CG2 4.04Å; P13-V16 PolarHBondContact O-N 2.83Å; P13-V16 VanDerWaalsContact O-N 3.1Å | ||
| 17 | G | 65.2 | Low | 70 | Confident | 48 Ų | 48 | 99.1 Ų | 99.1 | 50% | 0.495 | 60% | 0.603 | S | S | . | * | P | Polyproline II helix | trans | -61.2 | 165.9 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | L19 | G17-L19 PolarHBondContact O-N 3.1Š|
| 18 | P | 66.9 | Low | 71.8 | Confident | 101 Ų | 101 | 96.4 Ų | 96.4 | 66% | 0.656 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -48.1 | 119.2 | 168.6 | -22.6 | 32.4 | 0 | 0 | 0 | 107.8 | Y12 C20 | Y12-P18 HydrophobicContact CE2-CG 4.41Å; P18-C20 PolarHBondContact O-N 3.16Å; P18-C20 VanDerWaalsContact O-N 3.12Å |
| 19 | L | 64 | Low | 73.3 | Confident | 85 Ų | 85 | 94.2 Ų | 94.2 | 45% | 0.445 | 57% | 0.572 | S | S | . | * | P | Polyproline II helix | trans | -47.5 | 127.7 | 177.8 | -74.1 | 168.3 | 0 | 0 | 0 | 106.9 | G17 G21 E23 L24 | G17-L19 PolarHBondContact O-N 3.1Å; L19-G21 PolarHBondContact O-N 3.4Å; L19-E23 HydrophobicContact CD2-CG 4.47Å; L19-L24 HydrophobicContact CB-CB 4.4Å |
| 20 | C | 71.8 | Confident | 74.6 | Confident | 75 Ų | 75 | 93.2 Ų | 93.2 | 51% | 0.507 | 56% | 0.561 | S | S | . | * | P | Polyproline II helix | trans | -56.1 | 137 | -178 | 68.8 | 0 | 0 | 0 | 0 | 107.7 | P18 A22 E23 L24 | P18-C20 PolarHBondContact O-N 3.16Å; P18-C20 VanDerWaalsContact O-N 3.12Å; C20-A22 PolarHBondContact O-N 2.82Å; C20-E23 PolarHBondContact O-N 3.28Å; C20-E23 WeakPolarHBondContact SG-CB 3.26Å; C20-L24 PolarHBondContact O-N 3.12Å; C20-L24 VanDerWaalsContact O-N 3.12Å |
| 21 | G | 74.6 | Confident | 76.1 | Confident | 58 Ų | 58 | 92 Ų | 92 | 60% | 0.598 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -52.5 | -28.9 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | L19 E25 | L19-G21 PolarHBondContact O-N 3.4Å; G21-E25 VanDerWaalsContact O-CB 3.22Å; G21-E25 WeakPolarHBondContact O-CB 3.49Å; G21-E25 PolarHBondContact O-N 2.89Å |
| 22 | A | 79.8 | Confident | 77.2 | Confident | 77 Ų | 77 | 92.1 Ų | 92.1 | 64% | 0.636 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -69.1 | -36.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | C20 A26 | C20-A22 PolarHBondContact O-N 2.82Å; A22-A26 WeakPolarHBondContact O-CB 3.31Å; A22-A26 PolarHBondContact O-N 3.33Å |
| 23 | E | 84.9 | Confident | 78.5 | Confident | 95 Ų | 95 | 91 Ų | 91 | 44% | 0.444 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -74.5 | -39.5 | 176.1 | -176.6 | 174.5 | -170.1 | 0 | 0 | 110.6 | L19 C20 A26 W27 | L19-E23 HydrophobicContact CD2-CG 4.47Å; C20-E23 PolarHBondContact O-N 3.28Å; C20-E23 WeakPolarHBondContact SG-CB 3.26Å; E23-A26 PolarHBondContact O-N 2.88Å; E23-W27 VanDerWaalsContact O-CD1 3.3Å; E23-W27 PolarHBondContact O-N 3.4Å |
| 24 | L | 86.8 | Confident | 79.6 | Confident | 69 Ų | 69 | 92.1 Ų | 92.1 | 36% | 0.361 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 173.4 | -176.2 | 64.9 | 0 | 0 | 0 | 111.5 | L19 C20 W27 Y28 | L19-L24 HydrophobicContact CB-CB 4.4Å; C20-L24 PolarHBondContact O-N 3.12Å; C20-L24 VanDerWaalsContact O-N 3.12Å; L24-W27 WeakPolarHBondContact O-CB 3.39Å; L24-W27 PolarHBondContact O-N 2.97Å; L24-Y28 HydrophobicContact CD1-CD2 4.26Å; L24-Y28 HydrophobicContact CD1-CE2 3.66Å; L24-Y28 HydrophobicContact CD2-CE2 3.92Å; L24-Y28 HydrophobicContact CG-CD2 3.91Å; L24-Y28 HydrophobicContact CG-CE2 3.46Å; L24-Y28 VanDerWaalsContact CG-CE2 3.46Å; L24-Y28 WeakPolarHBondContact O-CD2 3.32Å; L24-Y28 PolarHBondContact O-N 3.18Å |
| 25 | E | 85.1 | Confident | 81.4 | Confident | 108 Ų | 108 | 91.8 Ų | 91.8 | 51% | 0.505 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.8 | -42.2 | 174.9 | -166.8 | 67.5 | -163.7 | 0 | 0 | 111.5 | G21 W27 Y28 E29 | G21-E25 VanDerWaalsContact O-CB 3.22Å; G21-E25 WeakPolarHBondContact O-CB 3.49Å; G21-E25 PolarHBondContact O-N 2.89Å; E25-W27 VanDerWaalsContact C-N 3.28Å; E25-W27 PolarHBondContact O-N 3.3Å; E25-Y28 PolarHBondContact O-N 3.14Å; E25-Y28 VanDerWaalsContact O-N 3.12Å; E25-E29 WeakPolarHBondContact O-CG 3.31Å; E25-E29 PolarHBondContact O-N 3.39Å |
| 26 | A | 91.4 | Very high | 82.2 | Confident | 58 Ų | 58 | 89.2 Ų | 89.2 | 48% | 0.479 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62 | -36.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | A22 E23 D30 | A22-A26 WeakPolarHBondContact O-CB 3.31Å; A22-A26 PolarHBondContact O-N 3.33Å; E23-A26 PolarHBondContact O-N 2.88Å; A26-D30 WeakPolarHBondContact O-CB 3.14Å; A26-D30 PolarHBondContact O-N 3.16Å |
| 27 | W | 92.8 | Very high | 82.6 | Confident | 148 Ų | 148 | 89.6 Ų | 89.6 | 56% | 0.561 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66 | -40.9 | 172 | -92 | 101.4 | 0 | 0 | 0 | 112.4 | E23 L24 E25 D30 L31 | E23-W27 VanDerWaalsContact O-CD1 3.3Å; E23-W27 PolarHBondContact O-N 3.4Å; L24-W27 WeakPolarHBondContact O-CB 3.39Å; L24-W27 PolarHBondContact O-N 2.97Å; E25-W27 VanDerWaalsContact C-N 3.28Å; E25-W27 PolarHBondContact O-N 3.3Å; W27-D30 PolarHBondContact O-N 3.07Å; W27-L31 WeakPolarHBondContact O-CB 3.35Å; W27-L31 VanDerWaalsContact O-CG 3.24Å; W27-L31 WeakPolarHBondContact O-CG 3.5Å; W27-L31 PolarHBondContact O-N 3.48Å |
| 28 | Y | 91.8 | Very high | 82.4 | Confident | 121 Ų | 121 | 94.8 Ų | 94.8 | 48% | 0.475 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.8 | -39.8 | 176.1 | -77.5 | -60.2 | 0 | 0 | 0 | 112.3 | L24 E25 Q32 | L24-Y28 HydrophobicContact CD1-CD2 4.26Å; L24-Y28 HydrophobicContact CD1-CE2 3.66Å; L24-Y28 HydrophobicContact CD2-CE2 3.92Å; L24-Y28 HydrophobicContact CG-CD2 3.91Å; L24-Y28 HydrophobicContact CG-CE2 3.46Å; L24-Y28 VanDerWaalsContact CG-CE2 3.46Å; L24-Y28 WeakPolarHBondContact O-CD2 3.32Å; L24-Y28 PolarHBondContact O-N 3.18Å; E25-Y28 PolarHBondContact O-N 3.14Å; E25-Y28 VanDerWaalsContact O-N 3.12Å; Y28-Q32 WeakPolarHBondContact O-CB 3.49Å; Y28-Q32 VanDerWaalsContact O-CG 3.23Å; Y28-Q32 WeakPolarHBondContact O-CG 3.43Å; Y28-Q32 PolarHBondContact O-N 3.22Å |
| 29 | E | 93.4 | Very high | 82 | Confident | 104 Ų | 104 | 95.4 Ų | 95.4 | 49% | 0.486 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.5 | -44 | 174.9 | -72.4 | -68.6 | 127.2 | 0 | 0 | 111.7 | E25 Q32 D33 | E25-E29 WeakPolarHBondContact O-CG 3.31Å; E25-E29 PolarHBondContact O-N 3.39Å; E29-Q32 WeakPolarHBondContact O-CB 3.47Å; E29-Q32 PolarHBondContact O-N 3.13Å; E29-D33 PolarHBondContact O-N 2.88Å |
| 30 | D | 93.1 | Very high | 81.8 | Confident | 83 Ų | 83 | 95 Ų | 95 | 44% | 0.444 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.5 | -42.6 | 177 | -168.3 | 59 | 0 | 0 | 0 | 111.6 | A26 W27 Q32 D33 I34 | A26-D30 WeakPolarHBondContact O-CB 3.14Å; A26-D30 PolarHBondContact O-N 3.16Å; W27-D30 PolarHBondContact O-N 3.07Å; D30-Q32 VanDerWaalsContact C-N 3.33Å; D30-Q32 PolarHBondContact O-N 3.41Å; D30-D33 PolarHBondContact O-N 2.81Å; D30-I34 WeakPolarHBondContact O-CD1 3.49Å; D30-I34 VanDerWaalsContact O-CG1 3.24Å; D30-I34 WeakPolarHBondContact O-CG1 3.22Å; D30-I34 PolarHBondContact O-N 2.91Å |
| 31 | L | 93.5 | Very high | 81 | Confident | 77 Ų | 77 | 95.3 Ų | 95.3 | 40% | 0.403 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.7 | -38.6 | 173.7 | -72.4 | 172.7 | 0 | 0 | 0 | 112.1 | W27 D33 L35 | W27-L31 WeakPolarHBondContact O-CB 3.35Å; W27-L31 VanDerWaalsContact O-CG 3.24Å; W27-L31 WeakPolarHBondContact O-CG 3.5Å; W27-L31 PolarHBondContact O-N 3.48Å; L31-D33 VanDerWaalsContact C-N 3.35Å; L31-L35 VanDerWaalsContact O-CB 3.25Å; L31-L35 WeakPolarHBondContact O-CB 3.32Å; L31-L35 WeakPolarHBondContact O-CG 3.3Å; L31-L35 PolarHBondContact O-N 3.32Å |
| 32 | Q | 90.4 | Very high | 79.8 | Confident | 115 Ų | 115 | 97 Ų | 97 | 54% | 0.537 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.8 | -35.4 | 174.4 | -77.9 | 177.6 | 55 | 0 | 0 | 112.2 | Y28 E29 D30 G36 | Y28-Q32 WeakPolarHBondContact O-CB 3.49Å; Y28-Q32 VanDerWaalsContact O-CG 3.23Å; Y28-Q32 WeakPolarHBondContact O-CG 3.43Å; Y28-Q32 PolarHBondContact O-N 3.22Å; E29-Q32 WeakPolarHBondContact O-CB 3.47Å; E29-Q32 PolarHBondContact O-N 3.13Å; D30-Q32 VanDerWaalsContact C-N 3.33Å; D30-Q32 PolarHBondContact O-N 3.41Å; Q32-G36 WeakPolarHBondContact O-CA 3.34Å; Q32-G36 PolarHBondContact O-N 2.86Å |
| 33 | D | 88.9 | Confident | 78.5 | Confident | 106 Ų | 106 | 103.3 Ų | 103.3 | 57% | 0.567 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.9 | -45.9 | 175.1 | -170.4 | 45.3 | 0 | 0 | 0 | 110.9 | E29 D30 L31 L35 G36 S37 | E29-D33 PolarHBondContact O-N 2.88Å; D30-D33 PolarHBondContact O-N 2.81Å; L31-D33 VanDerWaalsContact C-N 3.35Å; D33-L35 PolarHBondContact O-N 2.91Å; D33-G36 PolarHBondContact O-N 3.35Å; D33-S37 WeakPolarHBondContact O-CB 3.29Å; D33-S37 PolarHBondContact O-N 3.02Å; D33-S37 PolarHBondContact O-OG 3.12Å |
| 34 | I | 90.6 | Very high | 76.8 | Confident | 105 Ų | 105 | 106.5 Ų | 106.5 | 54% | 0.538 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -61.9 | -46.4 | 177.8 | -65.7 | 162.6 | 0 | 0 | 0 | 111 | D30 | D30-I34 WeakPolarHBondContact O-CD1 3.49Å; D30-I34 VanDerWaalsContact O-CG1 3.24Å; D30-I34 WeakPolarHBondContact O-CG1 3.22Å; D30-I34 PolarHBondContact O-N 2.91Å |
| 35 | L | 86.1 | Confident | 74.5 | Confident | 132 Ų | 132 | 110.1 Ų | 110.1 | 69% | 0.691 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -75.7 | -34.4 | -180 | -66.9 | 171.4 | 0 | 0 | 0 | 112.3 | L31 D33 | L31-L35 VanDerWaalsContact O-CB 3.25Å; L31-L35 WeakPolarHBondContact O-CB 3.32Å; L31-L35 WeakPolarHBondContact O-CG 3.3Å; L31-L35 PolarHBondContact O-N 3.32Å; D33-L35 PolarHBondContact O-N 2.91Å |
| 36 | G | 74.8 | Confident | 72.6 | Confident | 33 Ų | 33 | 115.5 Ų | 115.5 | 34% | 0.34 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -76.8 | -23.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q32 D33 D38 T39 | Q32-G36 WeakPolarHBondContact O-CA 3.34Å; Q32-G36 PolarHBondContact O-N 2.86Å; D33-G36 PolarHBondContact O-N 3.35Å; G36-D38 PolarHBondContact O-N 3.23Å; G36-D38 VanDerWaalsContact O-N 3.16Å; G36-T39 PolarHBondContact O-N 3.34Å; G36-T39 PolarHBondContact O-OG1 3.41Å |
| 37 | S | 68.6 | Low | 70.2 | Confident | 84 Ų | 84 | 116.5 Ų | 116.5 | 59% | 0.587 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.6 | -22.5 | 179.7 | -77 | 0 | 0 | 0 | 0 | 114.2 | D33 | D33-S37 WeakPolarHBondContact O-CB 3.29Å; D33-S37 PolarHBondContact O-N 3.02Å; D33-S37 PolarHBondContact O-OG 3.12Å |
| 38 | D | 61.3 | Low | 67.8 | Low | 157 Ų | 157 | 114.8 Ų | 114.8 | 84% | 0.84 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | -7.5 | 177.7 | -158.8 | 27.2 | 0 | 0 | 0 | 113.5 | G36 | G36-D38 PolarHBondContact O-N 3.23Å; G36-D38 VanDerWaalsContact O-N 3.16Å |
| 39 | T | 59.1 | Low | 65.5 | Low | 114 Ų | 114 | 114.4 Ų | 114.4 | 70% | 0.699 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.3 | -2.5 | -176.7 | 24.6 | 0 | 0 | 0 | 0 | 114.9 | G36 G41 | G36-T39 PolarHBondContact O-N 3.34Å; G36-T39 PolarHBondContact O-OG1 3.41Å; T39-G41 PolarHBondContact O-N 2.91Å |
| 40 | G | 59 | Low | 62.7 | Low | 76 Ų | 76 | 114.5 Ų | 114.5 | 78% | 0.784 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -92.5 | 64.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 41 | G | 56 | Low | 60.5 | Low | 81 Ų | 81 | 115 Ų | 115 | 84% | 0.835 | 69% | 0.693 | S | S | * | * | S | Bend | trans | 167.7 | -9.9 | 166.7 | 0 | 0 | 0 | 0 | 0 | 120.3 | T39 | T39-G41 PolarHBondContact O-N 2.91Š|
| 42 | A | 48.6 | Very low | 58.2 | Low | 94 Ų | 94 | 119.7 Ų | 119.7 | 78% | 0.777 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -125.8 | 120.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | L44 | A42-L44 PolarHBondContact O-N 3.23Š|
| 43 | K | 52.2 | Low | 56.2 | Low | 209 Ų | 209 | 121.1 Ų | 121.1 | 91% | 0.909 | 72% | 0.718 | S | S | * | * | trans | -56.9 | 125.3 | 179.7 | -67.1 | 175.1 | 172 | 178 | 0 | 110.8 | ||||
| 44 | L | 49.6 | Very low | 54.5 | Low | 163 Ų | 163 | 123.7 Ų | 123.7 | 85% | 0.853 | 73% | 0.726 | S | S | * | * | trans | 14.4 | 111.2 | 164.3 | -84.3 | 90.5 | 0 | 0 | 0 | 117.4 | A42 | A42-L44 PolarHBondContact O-N 3.23Š| ||
| 45 | T | 37.8 | Very low | 52.8 | Low | 145 Ų | 145 | 123.6 Ų | 123.6 | 89% | 0.89 | 73% | 0.731 | S | S | * | * | trans | -120.2 | 103.1 | 132.3 | 28.9 | 0 | 0 | 0 | 0 | 108.4 | A47 | T45-A47 PolarHBondContact O-N 2.99Š| ||
| 46 | R | 44.8 | Very low | 51.4 | Low | 221 Ų | 221 | 124 Ų | 124 | 83% | 0.834 | 73% | 0.729 | S | S | * | * | trans | -41.3 | 118.7 | 165.5 | 171.9 | 177 | 176.8 | 155.2 | -1.1 | 109.4 | ||||
| 47 | A | 41.5 | Very low | 50.5 | Low | 79 Ų | 79 | 129.8 Ų | 129.8 | 65% | 0.653 | 75% | 0.745 | S | S | * | * | trans | -55 | 139.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | T45 | T45-A47 PolarHBondContact O-N 2.99Š| ||
| 48 | P | 43 | Very low | 50.1 | Low | 112 Ų | 112 | 130.6 Ų | 130.6 | 73% | 0.727 | 74% | 0.742 | S | S | * | * | trans | -55.5 | 143.5 | 174.7 | -20.9 | 31.1 | 0 | 0 | 0 | 110.5 | C50 | P48-C50 PolarHBondContact O-N 3.3Š| ||
| 49 | P | 43.4 | Very low | 50.3 | Low | 113 Ų | 113 | 128 Ų | 128 | 73% | 0.734 | 73% | 0.729 | S | S | * | * | trans | -60.5 | 107.1 | 165 | 25.9 | -30.2 | 0 | 0 | 0 | 107.5 | S51 | P49-S51 VanDerWaalsContact C-N 3.25Å; P49-S51 PolarHBondContact O-N 3.41Å | ||
| 50 | C | 35.4 | Very low | 50.9 | Low | 106 Ų | 106 | 126.9 Ų | 126.9 | 72% | 0.716 | 72% | 0.722 | S | S | * | * | trans | -73.9 | 83.9 | 176.7 | -162.5 | 0 | 0 | 0 | 0 | 107.6 | P48 | P48-C50 PolarHBondContact O-N 3.3Š| ||
| 51 | S | 45.9 | Very low | 51.5 | Low | 92 Ų | 92 | 127.7 Ų | 127.7 | 64% | 0.643 | 71% | 0.707 | S | S | * | * | trans | -75.8 | 128.6 | 164.3 | 51.9 | 0 | 0 | 0 | 0 | 108.6 | P49 | P49-S51 VanDerWaalsContact C-N 3.25Å; P49-S51 PolarHBondContact O-N 3.41Å | ||
| 52 | E | 46.2 | Very low | 51.9 | Low | 177 Ų | 177 | 131.5 Ų | 131.5 | 83% | 0.827 | 70% | 0.704 | S | S | * | * | S | Bend | trans | 69.1 | 68.6 | 149.1 | -156.6 | 174.3 | -177.8 | 0 | 0 | 115.9 | ||
| 53 | K | 48.4 | Very low | 52.8 | Low | 144 Ų | 144 | 131.7 Ų | 131.7 | 63% | 0.626 | 70% | 0.699 | S | S | * | * | trans | -135.4 | 16.5 | 159.8 | -42.3 | -166.3 | -174.5 | -166.2 | 0 | 113.1 | T55 | K53-T55 VanDerWaalsContact C-N 3.35Š| ||
| 54 | E | 52.2 | Low | 52.8 | Low | 160 Ų | 160 | 125 Ų | 125 | 75% | 0.748 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -81.5 | -14.9 | -169.2 | -143.9 | 173.4 | 170.1 | 0 | 0 | 112.9 | L58 | E54-L58 VanDerWaalsContact O-CD1 3.3Å; E54-L58 WeakPolarHBondContact O-CD1 3.4Å; E54-L58 VanDerWaalsContact O-CG 3.29Å; E54-L58 WeakPolarHBondContact O-CG 3.48Å |
| 55 | T | 54.8 | Low | 53.2 | Low | 104 Ų | 104 | 121.9 Ų | 121.9 | 64% | 0.638 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -80.9 | -39.6 | 178.4 | 24.8 | 0 | 0 | 0 | 0 | 113.4 | K53 D59 | K53-T55 VanDerWaalsContact C-N 3.35Å; T55-D59 PolarHBondContact O-N 2.9Å; T55-D59 VanDerWaalsContact O-N 3.11Å |
| 56 | E | 56.1 | Low | 53.8 | Low | 141 Ų | 141 | 118.8 Ų | 118.8 | 66% | 0.659 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -76.2 | -36.2 | -173.8 | -57.9 | 170.5 | -159.3 | 0 | 0 | 112.4 | L58 D59 V60 | E56-L58 VanDerWaalsContact C-N 3.35Å; E56-D59 PolarHBondContact O-N 3.4Å; E56-V60 WeakPolarHBondContact O-CG2 3.29Å; E56-V60 PolarHBondContact O-N 3.11Å; E56-V60 VanDerWaalsContact O-N 3.13Å |
| 57 | F | 56 | Low | 54.5 | Low | 154 Ų | 154 | 114 Ų | 114 | 68% | 0.675 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -71.1 | -33.7 | 177.9 | -161 | -94.2 | 0 | 0 | 0 | 111.6 | V60 L61 | F57-V60 PolarHBondContact O-N 2.8Å; F57-L61 HydrophobicContact CE1-CD1 4.44Å; F57-L61 WeakPolarHBondContact O-CB 3.29Å; F57-L61 PolarHBondContact O-N 3.02Å |
| 58 | L | 61.6 | Low | 55 | Low | 100 Ų | 100 | 119.8 Ų | 119.8 | 52% | 0.524 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.3 | -41.3 | 172.4 | -77.1 | 175.3 | 0 | 0 | 0 | 111.6 | E54 E56 V60 L61 E62 | E54-L58 VanDerWaalsContact O-CD1 3.3Å; E54-L58 WeakPolarHBondContact O-CD1 3.4Å; E54-L58 VanDerWaalsContact O-CG 3.29Å; E54-L58 WeakPolarHBondContact O-CG 3.48Å; E56-L58 VanDerWaalsContact C-N 3.35Å; L58-V60 VanDerWaalsContact C-N 3.31Å; L58-V60 PolarHBondContact O-N 3.47Å; L58-L61 CarbonylContact O-C 3.56Å; L58-L61 WeakPolarHBondContact O-CB 3.41Å; L58-L61 PolarHBondContact O-N 3.39Å; L58-L61 VanDerWaalsContact O-N 3.13Å; L58-E62 WeakPolarHBondContact O-CB 3.24Å; L58-E62 PolarHBondContact O-N 3.5Å |
| 59 | D | 64 | Low | 55.4 | Low | 104 Ų | 104 | 119.5 Ų | 119.5 | 56% | 0.556 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -60.5 | -38.8 | 175.1 | -102 | 8.8 | 0 | 0 | 0 | 112.3 | T55 E56 E62 S63 | T55-D59 PolarHBondContact O-N 2.9Å; T55-D59 VanDerWaalsContact O-N 3.11Å; E56-D59 PolarHBondContact O-N 3.4Å; D59-E62 PolarHBondContact O-N 2.76Å; D59-S63 VanDerWaalsContact O-CB 3.29Å; D59-S63 WeakPolarHBondContact O-CB 3.43Å; D59-S63 PolarHBondContact O-N 2.91Å; D59-S63 PolarHBondContact O-OG 2.78Å |
| 60 | V | 72.3 | Confident | 55.6 | Low | 90 Ų | 90 | 119.6 Ų | 119.6 | 55% | 0.545 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -68 | -41.4 | 174.3 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | E56 F57 L58 E62 S63 C64 | E56-V60 WeakPolarHBondContact O-CG2 3.29Å; E56-V60 PolarHBondContact O-N 3.11Å; E56-V60 VanDerWaalsContact O-N 3.13Å; F57-V60 PolarHBondContact O-N 2.8Å; L58-V60 VanDerWaalsContact C-N 3.31Å; L58-V60 PolarHBondContact O-N 3.47Å; V60-E62 VanDerWaalsContact C-N 3.3Å; V60-E62 PolarHBondContact O-N 3.08Å; V60-S63 PolarHBondContact O-N 3.26Å; V60-C64 PolarHBondContact O-N 3.5Å; V60-C64 PolarHBondContact O-SG 3.13Å; V60-C64 VanDerWaalsContact O-SG 3.36Å |
| 61 | L | 71.1 | Confident | 56.2 | Low | 93 Ų | 93 | 122.4 Ų | 122.4 | 49% | 0.487 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -66.9 | -32.1 | 177.7 | -149.2 | 79.8 | 0 | 0 | 0 | 112.3 | F57 L58 | F57-L61 HydrophobicContact CE1-CD1 4.44Å; F57-L61 WeakPolarHBondContact O-CB 3.29Å; F57-L61 PolarHBondContact O-N 3.02Å; L58-L61 CarbonylContact O-C 3.56Å; L58-L61 WeakPolarHBondContact O-CB 3.41Å; L58-L61 PolarHBondContact O-N 3.39Å; L58-L61 VanDerWaalsContact O-N 3.13Å |
| 62 | E | 65.5 | Low | 56.3 | Low | 161 Ų | 161 | 121.1 Ų | 121.1 | 75% | 0.752 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -77.6 | -30.4 | 174.9 | -161.6 | 171.7 | -153.9 | 0 | 0 | 111.7 | L58 D59 V60 | L58-E62 WeakPolarHBondContact O-CB 3.24Å; L58-E62 PolarHBondContact O-N 3.5Å; D59-E62 PolarHBondContact O-N 2.76Å; V60-E62 VanDerWaalsContact C-N 3.3Å; V60-E62 PolarHBondContact O-N 3.08Å |
| 63 | S | 67.2 | Low | 56.1 | Low | 97 Ų | 97 | 118.6 Ų | 118.6 | 68% | 0.678 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -74 | -25.7 | 172.1 | -62.3 | 0 | 0 | 0 | 0 | 113.1 | D59 V60 S65 | D59-S63 VanDerWaalsContact O-CB 3.29Å; D59-S63 WeakPolarHBondContact O-CB 3.43Å; D59-S63 PolarHBondContact O-N 2.91Å; D59-S63 PolarHBondContact O-OG 2.78Å; V60-S63 PolarHBondContact O-N 3.26Å; S63-S65 PolarHBondContact O-N 2.88Å; S63-S65 VanDerWaalsContact O-N 3.08Å |
| 64 | C | 51.5 | Low | 56.1 | Low | 70 Ų | 70 | 115.5 Ų | 115.5 | 47% | 0.473 | 65% | 0.652 | S | S | . | * | S | Bend | trans | -69.4 | 101.2 | 166.5 | -70.8 | 0 | 0 | 0 | 0 | 108.5 | V60 L66 | V60-C64 PolarHBondContact O-N 3.5Å; V60-C64 PolarHBondContact O-SG 3.13Å; V60-C64 VanDerWaalsContact O-SG 3.36Å; C64-L66 VanDerWaalsContact O-CD1 3.29Å; C64-L66 WeakPolarHBondContact O-CD1 3.36Å; C64-L66 PolarHBondContact O-N 2.88Å |
| 65 | S | 57.9 | Low | 55.5 | Low | 96 Ų | 96 | 113.9 Ų | 113.9 | 67% | 0.671 | 65% | 0.653 | S | S | * | * | trans | -53.9 | 109 | 174.1 | -62.6 | 0 | 0 | 0 | 0 | 110.1 | S63 T67 | S63-S65 PolarHBondContact O-N 2.88Å; S63-S65 VanDerWaalsContact O-N 3.08Å; S65-T67 PolarHBondContact O-N 2.96Å | ||
| 66 | L | 52 | Low | 54.7 | Low | 81 Ų | 81 | 112.3 Ų | 112.3 | 42% | 0.424 | 66% | 0.657 | S | S | . | * | trans | -69.2 | 45.9 | 178.1 | -105 | 76.2 | 0 | 0 | 0 | 112.3 | C64 W68 L69 | C64-L66 VanDerWaalsContact O-CD1 3.29Å; C64-L66 WeakPolarHBondContact O-CD1 3.36Å; C64-L66 PolarHBondContact O-N 2.88Å; L66-W68 PolarHBondContact O-N 3.38Å; L66-L69 HydrophobicContact CB-CB 4.46Å; L66-L69 HydrophobicContact CD2-CB 4.21Å; L66-L69 HydrophobicContact CD2-CD1 3.41Å; L66-L69 VanDerWaalsContact CD2-CD1 3.41Å; L66-L69 HydrophobicContact CD2-CG 4.43Å; L66-L69 HydrophobicContact CG-CB 4.45Å; L66-L69 HydrophobicContact CG-CD1 3.87Å; L66-L69 PolarHBondContact O-N 3.12Å; L66-L69 VanDerWaalsContact O-N 3.13Å | ||
| 67 | T | 58 | Low | 54 | Low | 119 Ų | 119 | 112.4 Ų | 112.4 | 73% | 0.73 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | -18.8 | -179.6 | 52.3 | 0 | 0 | 0 | 0 | 112.7 | S65 | S65-T67 PolarHBondContact O-N 2.96Š|
| 68 | W | 52.4 | Low | 53 | Low | 201 Ų | 201 | 108.9 Ų | 108.9 | 76% | 0.761 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.1 | -6.8 | 175.6 | 59 | -86.6 | 0 | 0 | 0 | 114 | L66 | L66-W68 PolarHBondContact O-N 3.38Š|
| 69 | L | 52 | Low | 51.7 | Low | 107 Ų | 107 | 107.2 Ų | 107.2 | 56% | 0.56 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -106.3 | -3.5 | 178.7 | -89.4 | 160.6 | 0 | 0 | 0 | 114 | L66 | L66-L69 HydrophobicContact CB-CB 4.46Å; L66-L69 HydrophobicContact CD2-CB 4.21Å; L66-L69 HydrophobicContact CD2-CD1 3.41Å; L66-L69 VanDerWaalsContact CD2-CD1 3.41Å; L66-L69 HydrophobicContact CD2-CG 4.43Å; L66-L69 HydrophobicContact CG-CB 4.45Å; L66-L69 HydrophobicContact CG-CD1 3.87Å; L66-L69 PolarHBondContact O-N 3.12Å; L66-L69 VanDerWaalsContact O-N 3.13Å |
| 70 | T | 47.2 | Very low | 50.3 | Low | 115 Ų | 115 | 111.2 Ų | 111.2 | 71% | 0.706 | 70% | 0.697 | S | S | * | * | trans | -124.6 | 54.3 | -177.4 | -43.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 71 | D | 47.3 | Very low | 49.1 | Very low | 165 Ų | 165 | 110.7 Ų | 110.7 | 88% | 0.882 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -115.9 | 100.5 | 151.5 | -165.4 | 16.7 | 0 | 0 | 0 | 107.8 | ||
| 72 | G | 49.7 | Very low | 47.6 | Very low | 65 Ų | 65 | 118.5 Ų | 118.5 | 67% | 0.67 | 73% | 0.725 | S | S | * | * | S | Bend | trans | 90.8 | 68 | 169.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 73 | V | 40.8 | Very low | 46.3 | Very low | 124 Ų | 124 | 114 Ų | 114 | 75% | 0.752 | 72% | 0.723 | S | S | * | * | -172.5 | 114.2 | 126.3 | 157.4 | 0 | 0 | 0 | 0 | 107.1 | V75 | V73-V75 HydrophobicContact CG1-CG2 4.28Å; V73-V75 PolarHBondContact O-N 2.96Å | |||
| 74 | G | 48.8 | Very low | 44.9 | Very low | 78 Ų | 78 | 113.5 Ų | 113.5 | 80% | 0.804 | 73% | 0.733 | S | S | * | * | trans | -66.4 | 117.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 75 | V | 39.7 | Very low | 44.1 | Very low | 127 Ų | 127 | 114 Ų | 114 | 77% | 0.77 | 75% | 0.749 | S | S | * | * | trans | -125.3 | 96.1 | 147.3 | 179.6 | 0 | 0 | 0 | 0 | 105.6 | V73 | V73-V75 HydrophobicContact CG1-CG2 4.28Å; V73-V75 PolarHBondContact O-N 2.96Å | ||
| 76 | G | 38.2 | Very low | 43.4 | Very low | 70 Ų | 70 | 118.7 Ų | 118.7 | 72% | 0.722 | 76% | 0.76 | S | S | * | * | trans | -71.2 | 135.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 77 | V | 40.3 | Very low | 42.8 | Very low | 143 Ų | 143 | 118.3 Ų | 118.3 | 87% | 0.867 | 78% | 0.776 | S | S | * | * | trans | -126.7 | 100.2 | 142.7 | 177.6 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 78 | G | 35 | Very low | 42 | Very low | 81 Ų | 81 | 118.8 Ų | 118.8 | 84% | 0.835 | 78% | 0.778 | S | S | * | * | S | Bend | trans | 65.5 | 118.5 | 161 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 79 | G | 35.6 | Very low | 41.3 | Very low | 65 Ų | 65 | 116.5 Ų | 116.5 | 67% | 0.67 | 78% | 0.776 | S | S | * | * | cis | 156.7 | 129.5 | 13.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 80 | Q | 33.6 | Very low | 40.7 | Very low | 187 Ų | 187 | 120.9 Ų | 120.9 | 87% | 0.874 | 79% | 0.785 | S | S | * | * | trans | 68.9 | 104.4 | 152.3 | -62.8 | -179.3 | 74.1 | 0 | 0 | 116.9 | ||||
| 81 | A | 46.6 | Very low | 40.2 | Very low | 79 Ų | 79 | 121.7 Ų | 121.7 | 65% | 0.653 | 79% | 0.79 | S | S | * | * | 88.8 | 98.4 | 77.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 82 | W | 41.3 | Very low | 39.7 | Very low | 257 Ų | 257 | 119.8 Ų | 119.8 | 97% | 0.973 | 78% | 0.784 | S | S | * | * | trans | -143.9 | 112.3 | 137.5 | -64.9 | 87.9 | 0 | 0 | 0 | 103.2 | ||||
| 83 | G | 37.3 | Very low | 39.2 | Very low | 68 Ų | 68 | 123.1 Ų | 123.1 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | cis | 72.3 | 87.6 | 36.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 84 | G | 37.1 | Very low | 39.2 | Very low | 86 Ų | 86 | 122.9 Ų | 122.9 | 89% | 0.887 | 79% | 0.786 | S | S | * | * | trans | 76.8 | 126.1 | 155.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 85 | G | 36.6 | Very low | 38.4 | Very low | 79 Ų | 79 | 127.3 Ų | 127.3 | 81% | 0.814 | 79% | 0.786 | S | S | * | * | trans | 179.9 | 55 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 86 | E | 43.1 | Very low | 38.2 | Very low | 195 Ų | 195 | 129.2 Ų | 129.2 | 91% | 0.911 | 79% | 0.787 | S | S | * | * | trans | -46.3 | 134.5 | 157.3 | -177.5 | 179.9 | 166.8 | 0 | 0 | 110.8 | ||||
| 87 | G | 37.7 | Very low | 39.2 | Very low | 73 Ų | 73 | 129.9 Ų | 129.9 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | trans | -167.7 | 55 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q89 | G87-Q89 PolarHBondContact O-N 3.46Š| ||
| 88 | V | 42.1 | Very low | 39.6 | Very low | 129 Ų | 129 | 128 Ų | 128 | 78% | 0.782 | 77% | 0.769 | S | S | * | * | trans | -46.5 | 129.1 | 150.3 | 162.2 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 89 | Q | 37.3 | Very low | 39.5 | Very low | 154 Ų | 154 | 129.5 Ų | 129.5 | 72% | 0.72 | 76% | 0.762 | S | S | * | * | trans | -168.9 | 110.4 | 142.2 | -83.6 | -136 | 86.9 | 0 | 0 | 112.3 | G87 | G87-Q89 PolarHBondContact O-N 3.46Š| ||
| 90 | R | 39 | Very low | 39.8 | Very low | 199 Ų | 199 | 134.6 Ų | 134.6 | 75% | 0.751 | 77% | 0.768 | S | S | * | * | trans | 92.4 | 90 | 136.4 | -55.2 | -178.1 | -55.1 | -179.5 | 9.2 | 119 | ||||
| 91 | V | 38 | Very low | 40.5 | Very low | 132 Ų | 132 | 131.1 Ų | 131.1 | 80% | 0.8 | 76% | 0.762 | S | S | * | * | trans | -56.7 | 125.4 | 141.1 | 171.1 | 0 | 0 | 0 | 0 | 108.9 | I93 | V91-I93 HydrophobicContact CG1-CD1 4.49Å; V91-I93 HydrophobicContact CG1-CG1 3.87Å | ||
| 92 | T | 35.7 | Very low | 40.5 | Very low | 124 Ų | 124 | 132.7 Ų | 132.7 | 76% | 0.761 | 77% | 0.765 | S | S | * | * | trans | -117 | 110.2 | 162.7 | -56.8 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 93 | I | 39.9 | Very low | 41.1 | Very low | 135 Ų | 135 | 126.7 Ų | 126.7 | 69% | 0.692 | 76% | 0.759 | S | S | * | * | trans | -80.8 | 138.7 | 167.7 | -62.5 | 179.4 | 0 | 0 | 0 | 107.9 | V91 E95 | V91-I93 HydrophobicContact CG1-CD1 4.49Å; V91-I93 HydrophobicContact CG1-CG1 3.87Å; I93-E95 VanDerWaalsContact CG2-N 3.34Å | ||
| 94 | P | 40.4 | Very low | 41.3 | Very low | 119 Ų | 119 | 128.6 Ų | 128.6 | 77% | 0.773 | 76% | 0.762 | S | S | * | * | trans | -120.8 | 101.3 | 139.8 | 22.8 | -6.8 | 0 | 0 | 0 | 107.9 | ||||
| 95 | E | 32.3 | Very low | 41.2 | Very low | 172 Ų | 172 | 129.6 Ų | 129.6 | 80% | 0.804 | 76% | 0.755 | S | S | * | * | 48.3 | 110.6 | 86.9 | -148.3 | -116.7 | 136.9 | 0 | 0 | 114.3 | I93 | I93-E95 VanDerWaalsContact CG2-N 3.34Š| |||
| 96 | E | 36.1 | Very low | 41.2 | Very low | 167 Ų | 167 | 132.1 Ų | 132.1 | 78% | 0.78 | 76% | 0.755 | S | S | * | * | trans | -143.9 | 158.2 | 174.7 | -164.6 | -115.9 | 142.1 | 0 | 0 | 104.5 | ||||
| 97 | P | 58 | Low | 40.8 | Very low | 84 Ų | 84 | 126.9 Ų | 126.9 | 55% | 0.545 | 75% | 0.745 | S | S | . | * | cis | -131.6 | -162.7 | -24.7 | 40.6 | -22.5 | 0 | 0 | 0 | 112.4 | ||||
| 98 | P | 48.3 | Very low | 40.7 | Very low | 104 Ų | 104 | 131.6 Ų | 131.6 | 68% | 0.675 | 75% | 0.752 | S | S | * | * | -146.2 | 164.5 | 77 | 35.1 | -13.1 | 0 | 0 | 0 | 113.2 | |||||
| 99 | T | 33.8 | Very low | 40.6 | Very low | 112 Ų | 112 | 131.1 Ų | 131.1 | 69% | 0.687 | 75% | 0.754 | S | S | * | * | 175.3 | 121.9 | 57.2 | -1 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 100 | H | 40.8 | Very low | 40.8 | Very low | 171 Ų | 171 | 132 Ų | 132 | 79% | 0.792 | 76% | 0.762 | S | S | * | * | trans | 27.7 | 168.3 | 147.2 | -38.8 | -68 | 0 | 0 | 0 | 124.4 | ||||
| 101 | P | 48.6 | Very low | 40.9 | Very low | 115 Ų | 115 | 130 Ų | 130 | 75% | 0.747 | 77% | 0.767 | S | S | * | * | cis | -132.2 | 179.4 | -35.1 | 29.8 | -8.3 | 0 | 0 | 0 | 113.8 | ||||
| 102 | P | 47.6 | Very low | 41.2 | Very low | 112 Ų | 112 | 129.5 Ų | 129.5 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -94.5 | 158.7 | 176.9 | 37.3 | -32.6 | 0 | 0 | 0 | 113.2 | ||
| 103 | P | 52.7 | Low | 41.1 | Very low | 130 Ų | 130 | 127.7 Ų | 127.7 | 84% | 0.844 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -93 | 121.7 | 160.6 | 32.3 | -27.2 | 0 | 0 | 0 | 111.9 | ||
| 104 | S | 42 | Very low | 41.2 | Very low | 109 Ų | 109 | 130.5 Ų | 130.5 | 76% | 0.762 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 137.9 | 155.2 | -60.7 | 0 | 0 | 0 | 0 | 110.1 | ||
| 105 | S | 35.3 | Very low | 41.1 | Very low | 106 Ų | 106 | 133.7 Ų | 133.7 | 74% | 0.741 | 78% | 0.778 | S | S | * | * | trans | -176.9 | 99.6 | 148.3 | -82.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 106 | T | 36.5 | Very low | 41.6 | Very low | 133 Ų | 133 | 134.6 Ų | 134.6 | 82% | 0.816 | 77% | 0.774 | S | S | * | * | 69.7 | 119 | 98.7 | 55.7 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 107 | A | 35.3 | Very low | 41.8 | Very low | 85 Ų | 85 | 132.7 Ų | 132.7 | 70% | 0.702 | 77% | 0.774 | S | S | * | * | 121.8 | 127.8 | 119.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 108 | L | 35.9 | Very low | 40.8 | Very low | 171 Ų | 171 | 135.5 Ų | 135.5 | 90% | 0.895 | 78% | 0.78 | S | S | * | * | trans | 92.1 | 108.8 | 142.7 | -57.3 | 170.7 | 0 | 0 | 0 | 120 | ||||
| 109 | C | 39 | Very low | 40.4 | Very low | 120 Ų | 120 | 134 Ų | 134 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | trans | -42.2 | 146.8 | 146.9 | -47.9 | 0 | 0 | 0 | 0 | 112 | ||||
| 110 | L | 41.9 | Very low | 41.2 | Very low | 171 Ų | 171 | 134.5 Ų | 134.5 | 90% | 0.895 | 79% | 0.789 | S | S | * | * | trans | -176.7 | 121 | 138.2 | -93.6 | 172.1 | 0 | 0 | 0 | 109.4 | ||||
| 111 | N | 40.8 | Very low | 41.3 | Very low | 159 Ų | 159 | 138 Ų | 138 | 85% | 0.85 | 80% | 0.795 | S | S | * | * | trans | -89.8 | 149.2 | 156.5 | -78.8 | -53 | 0 | 0 | 0 | 108.5 | ||||
| 112 | P | 44.4 | Very low | 41 | Very low | 120 Ų | 120 | 140 Ų | 140 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | -141.2 | 132.7 | 121.1 | 25.4 | -5.5 | 0 | 0 | 0 | 111.7 | |||||
| 113 | A | 34.3 | Very low | 41.2 | Very low | 87 Ų | 87 | 146.8 Ų | 146.8 | 72% | 0.719 | 81% | 0.811 | S | S | * | * | 86.5 | 117.3 | 84.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 114 | E | 41.9 | Very low | 40.9 | Very low | 193 Ų | 193 | 150 Ų | 150 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | trans | 54.2 | 117.7 | 144.1 | -52.5 | -165.6 | 142.6 | 0 | 0 | 121.1 | ||||
| 115 | E | 38.1 | Very low | 40.7 | Very low | 186 Ų | 186 | 148.5 Ų | 148.5 | 87% | 0.869 | 82% | 0.817 | S | S | * | * | -149.6 | 130.5 | 125.5 | -161.1 | 170.8 | 144.1 | 0 | 0 | 111.1 | |||||
| 116 | R | 41.6 | Very low | 41 | Very low | 191 Ų | 191 | 146.9 Ų | 146.9 | 72% | 0.721 | 82% | 0.817 | S | S | * | * | trans | -105.2 | 127 | -175.2 | -171.9 | -178.5 | -169.8 | -77.7 | -9.5 | 106.3 | E118 | R116-E118 IonicContact CZ-OE1 3.12Å; R116-E118 IonicContact NH1-OE1 2.66Å; R116-E118 PolarHBondContact NH1-OE1 3.26Å; R116-E118 IonicContact NH1-OE2 3.63Å; R116-E118 IonicContact NH2-OE1 2.78Å; R116-E118 PolarHBondContact NH2-OE1 3Å | ||
| 117 | T | 41.8 | Very low | 41.6 | Very low | 127 Ų | 127 | 151.7 Ų | 151.7 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | trans | -145 | 123.8 | 160.3 | -42.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 118 | E | 37.1 | Very low | 42 | Very low | 143 Ų | 143 | 154.8 Ų | 154.8 | 67% | 0.668 | 83% | 0.825 | S | S | * | * | trans | -88.8 | 151.8 | -178.7 | -59.6 | 170.6 | 150.3 | 0 | 0 | 110.5 | R116 | R116-E118 IonicContact CZ-OE1 3.12Å; R116-E118 IonicContact NH1-OE1 2.66Å; R116-E118 PolarHBondContact NH1-OE1 3.26Å; R116-E118 IonicContact NH1-OE2 3.63Å; R116-E118 IonicContact NH2-OE1 2.78Å; R116-E118 PolarHBondContact NH2-OE1 3Å | ||
| 119 | G | 38.6 | Very low | 42.5 | Very low | 73 Ų | 73 | 150.6 Ų | 150.6 | 75% | 0.753 | 82% | 0.823 | S | S | * | * | trans | 130.2 | 150.4 | 136.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 120 | P | 50.2 | Low | 42.9 | Very low | 122 Ų | 122 | 149.6 Ų | 149.6 | 79% | 0.792 | 82% | 0.823 | S | S | * | * | trans | -117.6 | 175 | -135.6 | 38.8 | -25.8 | 0 | 0 | 0 | 113.9 | ||||
| 121 | R | 43.2 | Very low | 43.1 | Very low | 246 Ų | 246 | 145.7 Ų | 145.7 | 93% | 0.928 | 82% | 0.824 | S | S | * | * | trans | -171.2 | 138.7 | 149.6 | -102.4 | 155.9 | -154.2 | -92.1 | 5 | 114.1 | ||||
| 122 | D | 43.3 | Very low | 43.2 | Very low | 157 Ų | 157 | 141.6 Ų | 141.6 | 84% | 0.84 | 82% | 0.82 | S | S | * | * | trans | -67.4 | 151.9 | -179.8 | -47 | -78 | 0 | 0 | 0 | 114.5 | ||||
| 123 | R | 51.2 | Low | 43.4 | Very low | 253 Ų | 253 | 142 Ų | 142 | 96% | 0.955 | 83% | 0.826 | S | S | * | * | trans | -161.7 | 123.2 | 134.4 | -127.2 | 174.4 | 176.1 | 134.4 | -2.7 | 114.6 | ||||
| 124 | E | 46.1 | Very low | 44.1 | Very low | 197 Ų | 197 | 141 Ų | 141 | 92% | 0.921 | 82% | 0.823 | S | S | * | * | trans | -58.5 | 152.6 | 163.3 | -176.1 | -177.3 | 171.9 | 0 | 0 | 113.6 | ||||
| 125 | G | 39 | Very low | 44.7 | Very low | 79 Ų | 79 | 136.3 Ų | 136.3 | 81% | 0.814 | 83% | 0.827 | S | S | * | * | trans | 165.4 | 107 | 164.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 126 | G | 41.6 | Very low | 45.6 | Very low | 72 Ų | 72 | 129.1 Ų | 129.1 | 74% | 0.742 | 80% | 0.803 | S | S | * | * | trans | -106.9 | -170.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 127 | R | 48.7 | Very low | 46.5 | Very low | 233 Ų | 233 | 127.7 Ų | 127.7 | 88% | 0.879 | 81% | 0.81 | S | S | * | * | trans | 75.7 | 140.9 | 171.6 | -51.2 | 179.2 | 158.6 | -133.2 | -2.3 | 113.6 | ||||
| 128 | D | 43.9 | Very low | 47.3 | Very low | 150 Ų | 150 | 129.7 Ų | 129.7 | 80% | 0.802 | 82% | 0.815 | S | S | * | * | cis | -145.4 | 150.4 | 32.7 | -61.4 | -70.4 | 0 | 0 | 0 | 108.6 | ||||
| 129 | G | 46.8 | Very low | 49 | Very low | 84 Ų | 84 | 126.9 Ų | 126.9 | 87% | 0.866 | 80% | 0.803 | S | S | * | * | 85.9 | 61.9 | 61.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 130 | A | 45.6 | Very low | 50.8 | Low | 99 Ų | 99 | 127.5 Ų | 127.5 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -136.9 | 112 | 165.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 131 | G | 47.3 | Very low | 51.6 | Low | 88 Ų | 88 | 126.9 Ų | 126.9 | 91% | 0.907 | 79% | 0.791 | S | S | * | * | trans | -67.7 | 132.6 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 132 | G | 42.4 | Very low | 52.7 | Low | 74 Ų | 74 | 122.4 Ų | 122.4 | 76% | 0.763 | 78% | 0.78 | S | S | * | * | trans | -150.3 | 109.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 133 | S | 49.1 | Very low | 53.8 | Low | 129 Ų | 129 | 119.6 Ų | 119.6 | 90% | 0.902 | 76% | 0.761 | S | S | * | * | trans | -59.5 | 145 | 175.3 | -177.4 | 0 | 0 | 0 | 0 | 112 | ||||
| 134 | G | 49.4 | Very low | 54.6 | Low | 65 Ų | 65 | 112.2 Ų | 112.2 | 67% | 0.67 | 74% | 0.735 | S | S | * | * | S | Bend | trans | 89.5 | 119.7 | 150.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | G136 | G134-G136 PolarHBondContact O-N 3.35Å; G134-G136 VanDerWaalsContact O-N 3.11Å |
| 135 | G | 53.5 | Low | 55.7 | Low | 94 Ų | 94 | 109.5 Ų | 109.5 | 97% | 0.969 | 72% | 0.723 | S | S | * | * | trans | -56.2 | 113.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 136 | G | 57.4 | Low | 56.8 | Low | 36 Ų | 36 | 112 Ų | 112 | 37% | 0.371 | 72% | 0.717 | S | S | . | * | trans | -121.4 | 12.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | G134 L138 | G134-G136 PolarHBondContact O-N 3.35Å; G134-G136 VanDerWaalsContact O-N 3.11Å; G136-L138 VanDerWaalsContact C-N 3.3Å; G136-L138 PolarHBondContact O-N 3Å | ||
| 137 | D | 59.4 | Low | 57.8 | Low | 161 Ų | 161 | 114.3 Ų | 114.3 | 86% | 0.861 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.1 | 20.7 | -170.1 | -155.1 | 29.2 | 0 | 0 | 0 | 114.3 | ||
| 138 | L | 59.7 | Low | 58.3 | Low | 169 Ų | 169 | 108.2 Ų | 108.2 | 89% | 0.885 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.7 | 5.3 | 176 | -67.8 | 177 | 0 | 0 | 0 | 113.3 | G136 | G136-L138 VanDerWaalsContact C-N 3.3Å; G136-L138 PolarHBondContact O-N 3Å |
| 139 | L | 72.1 | Confident | 59 | Low | 83 Ų | 83 | 109.5 Ų | 109.5 | 44% | 0.435 | 71% | 0.706 | S | S | . | * | S | Bend | trans | -116.3 | 127.3 | -175.7 | -65 | 173.7 | 0 | 0 | 0 | 110 | F143 F144 | L139-F143 HydrophobicContact CB-CB 4.27Å; L139-F143 HydrophobicContact CB-CD1 4.38Å; L139-F143 HydrophobicContact CD1-CD1 3.66Å; L139-F143 HydrophobicContact CD1-CE1 3.84Å; L139-F143 HydrophobicContact CD1-CG 4.43Å; L139-F143 HydrophobicContact CD2-CD1 4.44Å; L139-F143 HydrophobicContact CD2-CG 4.49Å; L139-F143 HydrophobicContact CG-CD1 4.38Å; L139-F144 HydrophobicContact CB-CE2 4.01Å |
| 140 | P | 76.6 | Confident | 59.2 | Low | 86 Ų | 86 | 107.9 Ų | 107.9 | 56% | 0.558 | 69% | 0.689 | S | S | * | * | trans | -52.2 | 144.9 | 173.1 | -24.6 | 33.2 | 0 | 0 | 0 | 110.5 | E142 F143 | P140-E142 PolarHBondContact O-N 3.44Å; P140-F143 WeakPolarHBondContact O-CB 3.3Å; P140-F143 PolarHBondContact O-N 2.97Å | ||
| 141 | P | 66.6 | Low | 59.5 | Low | 110 Ų | 110 | 107 Ų | 107 | 71% | 0.714 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.1 | -31.4 | 178.7 | -28.4 | 34.8 | 0 | 0 | 0 | 113.7 | F143 F144 | P141-F143 PolarHBondContact O-N 3.4Å; P141-F144 PolarHBondContact O-N 3.48Å |
| 142 | E | 67.4 | Low | 59.6 | Low | 152 Ų | 152 | 111.1 Ų | 111.1 | 71% | 0.71 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -61.7 | -23.7 | 178 | -56.3 | -161.7 | 179.8 | 0 | 0 | 114 | P140 F144 | P140-E142 PolarHBondContact O-N 3.44Å; E142-F144 VanDerWaalsContact C-N 3.33Å; E142-F144 PolarHBondContact O-N 3.16Å |
| 143 | F | 65.5 | Low | 59.8 | Low | 98 Ų | 98 | 110.9 Ų | 110.9 | 43% | 0.43 | 69% | 0.688 | S | S | . | * | H | α-helix | trans | -73.9 | -25.2 | 178.7 | -168.8 | -94.4 | 0 | 0 | 0 | 112.8 | L139 P140 P141 L147 | L139-F143 HydrophobicContact CB-CB 4.27Å; L139-F143 HydrophobicContact CB-CD1 4.38Å; L139-F143 HydrophobicContact CD1-CD1 3.66Å; L139-F143 HydrophobicContact CD1-CE1 3.84Å; L139-F143 HydrophobicContact CD1-CG 4.43Å; L139-F143 HydrophobicContact CD2-CD1 4.44Å; L139-F143 HydrophobicContact CD2-CG 4.49Å; L139-F143 HydrophobicContact CG-CD1 4.38Å; P140-F143 WeakPolarHBondContact O-CB 3.3Å; P140-F143 PolarHBondContact O-N 2.97Å; P141-F143 PolarHBondContact O-N 3.4Å; F143-L147 HydrophobicContact CD1-CD1 4.26Å; F143-L147 HydrophobicContact CE1-CD1 3.97Å |
| 144 | F | 67.4 | Low | 60.1 | Low | 97 Ų | 97 | 113.9 Ų | 113.9 | 43% | 0.425 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -80.1 | -26.1 | -179.3 | -72.7 | -89.4 | 0 | 0 | 0 | 113.1 | L139 P141 E142 L147 S148 | L139-F144 HydrophobicContact CB-CE2 4.01Å; P141-F144 PolarHBondContact O-N 3.48Å; E142-F144 VanDerWaalsContact C-N 3.33Å; E142-F144 PolarHBondContact O-N 3.16Å; F144-L147 PolarHBondContact O-N 3.5Å; F144-S148 PolarHBondContact O-N 3.46Å; F144-S148 VanDerWaalsContact O-N 3.16Å; F144-S148 PolarHBondContact O-OG 2.94Å |
| 145 | E | 69.7 | Low | 59.8 | Low | 140 Ų | 140 | 117.2 Ų | 117.2 | 65% | 0.654 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -65.6 | -40.6 | 175.9 | -70.7 | -177 | 166.8 | 0 | 0 | 111.1 | L147 S148 E149 | E145-L147 VanDerWaalsContact C-N 3.32Å; E145-L147 PolarHBondContact O-N 3.28Å; E145-S148 PolarHBondContact O-N 3.36Å; E145-S148 VanDerWaalsContact O-N 3.14Å; E145-E149 PolarHBondContact O-N 3.37Å |
| 146 | L | 62.4 | Low | 58.9 | Low | 133 Ų | 133 | 120 Ų | 120 | 70% | 0.696 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -60.7 | -36.9 | 176.3 | -79 | 150.7 | 0 | 0 | 0 | 113.6 | ||
| 147 | L | 63.1 | Low | 57.7 | Low | 119 Ų | 119 | 123.8 Ų | 123.8 | 62% | 0.623 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -77.1 | -28.4 | 177.9 | -68.7 | 174.5 | 0 | 0 | 0 | 112.4 | F143 F144 E145 E149 | F143-L147 HydrophobicContact CD1-CD1 4.26Å; F143-L147 HydrophobicContact CE1-CD1 3.97Å; F144-L147 PolarHBondContact O-N 3.5Å; E145-L147 VanDerWaalsContact C-N 3.32Å; E145-L147 PolarHBondContact O-N 3.28Å; L147-E149 VanDerWaalsContact C-N 3.28Å; L147-E149 PolarHBondContact O-N 2.81Å |
| 148 | S | 59.1 | Low | 56.4 | Low | 105 Ų | 105 | 120.4 Ų | 120.4 | 73% | 0.734 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -73.6 | -22.5 | -179.8 | -57.7 | 0 | 0 | 0 | 0 | 112.3 | F144 E145 | F144-S148 PolarHBondContact O-N 3.46Å; F144-S148 VanDerWaalsContact O-N 3.16Å; F144-S148 PolarHBondContact O-OG 2.94Å; E145-S148 PolarHBondContact O-N 3.36Å; E145-S148 VanDerWaalsContact O-N 3.14Å |
| 149 | E | 58.2 | Low | 55.1 | Low | 178 Ų | 178 | 121.6 Ų | 121.6 | 83% | 0.832 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.3 | 2.3 | -172.3 | -162.6 | 144.2 | -170.3 | 0 | 0 | 114.7 | E145 L147 | E145-E149 PolarHBondContact O-N 3.37Å; L147-E149 VanDerWaalsContact C-N 3.28Å; L147-E149 PolarHBondContact O-N 2.81Å |
| 150 | G | 52.3 | Low | 53.3 | Low | 49 Ų | 49 | 126.4 Ų | 126.4 | 51% | 0.505 | 71% | 0.714 | S | S | . | * | trans | -139.1 | 53.4 | -171.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | L152 | G150-L152 PolarHBondContact O-N 3.01Š| ||
| 151 | G | 49.9 | Very low | 51.2 | Low | 82 Ų | 82 | 130.2 Ų | 130.2 | 85% | 0.845 | 72% | 0.723 | S | S | * | * | trans | -67.9 | 86.5 | 173 | 0 | 0 | 0 | 0 | 0 | 112.7 | G153 | G151-G153 PolarHBondContact O-N 2.91Š| ||
| 152 | L | 51.3 | Low | 49.6 | Very low | 173 Ų | 173 | 133.6 Ų | 133.6 | 91% | 0.906 | 73% | 0.729 | S | S | * | * | trans | -80.7 | 110.1 | 173.4 | -66.4 | 179.2 | 0 | 0 | 0 | 110.4 | G150 | G150-L152 PolarHBondContact O-N 3.01Š| ||
| 153 | G | 46.7 | Very low | 48 | Very low | 70 Ų | 70 | 133.9 Ų | 133.9 | 72% | 0.722 | 73% | 0.73 | S | S | * | * | trans | -64.4 | 152.1 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | G151 V155 | G151-G153 PolarHBondContact O-N 2.91Å; G153-V155 PolarHBondContact O-N 2.81Å | ||
| 154 | M | 54 | Low | 46.3 | Very low | 192 Ų | 192 | 133.2 Ų | 133.2 | 95% | 0.946 | 74% | 0.738 | S | S | * | * | trans | -58.6 | 119.1 | 167.6 | -64.9 | -118.1 | 62.1 | 0 | 0 | 109.8 | ||||
| 155 | V | 43.8 | Very low | 44.6 | Very low | 134 Ų | 134 | 135.6 Ų | 135.6 | 81% | 0.812 | 76% | 0.755 | S | S | * | * | trans | -114.9 | 132.4 | 167 | 81.3 | 0 | 0 | 0 | 0 | 110.5 | G153 | G153-V155 PolarHBondContact O-N 2.81Š| ||
| 156 | D | 33.4 | Very low | 42.8 | Very low | 152 Ų | 152 | 135.9 Ų | 135.9 | 81% | 0.813 | 76% | 0.761 | S | S | * | * | trans | -65.7 | 144.2 | -169.5 | -156.8 | 0.1 | 0 | 0 | 0 | 112.8 | ||||
| 157 | S | 34.1 | Very low | 41.5 | Very low | 116 Ų | 116 | 135 Ų | 135 | 81% | 0.811 | 76% | 0.761 | S | S | * | * | trans | -111 | 116.9 | 179.8 | -82.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 158 | S | 30.4 | Very low | 40.1 | Very low | 90 Ų | 90 | 137.4 Ų | 137.4 | 63% | 0.629 | 77% | 0.769 | S | S | * | * | trans | -144.1 | 102 | -178.7 | -136.1 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 159 | Y | 32.4 | Very low | 39.2 | Very low | 194 Ų | 194 | 140.9 Ų | 140.9 | 76% | 0.761 | 77% | 0.774 | S | S | * | * | trans | 50.1 | 121.3 | 151.4 | -39.8 | -75.8 | 0 | 0 | 0 | 122.8 | ||||
| 160 | H | 34.3 | Very low | 38.6 | Very low | 185 Ų | 185 | 138.1 Ų | 138.1 | 86% | 0.856 | 77% | 0.771 | S | S | * | * | 166.4 | 160.8 | 92.4 | -96 | -57.5 | 0 | 0 | 0 | 112.7 | |||||
| 161 | H | 32.8 | Very low | 37.7 | Very low | 165 Ų | 165 | 140.1 Ų | 140.1 | 76% | 0.764 | 78% | 0.783 | S | S | * | * | trans | -128.6 | 129.7 | -152.3 | -163 | 76.4 | 0 | 0 | 0 | 110.6 | ||||
| 162 | H | 33.8 | Very low | 36.9 | Very low | 181 Ų | 181 | 142.1 Ų | 142.1 | 84% | 0.838 | 78% | 0.784 | S | S | * | * | trans | -166.8 | 156.2 | 162.9 | -74.6 | -68.4 | 0 | 0 | 0 | 109 | ||||
| 163 | H | 32.4 | Very low | 36.6 | Very low | 158 Ų | 158 | 139.9 Ų | 139.9 | 73% | 0.731 | 78% | 0.78 | S | S | * | * | cis | -171.8 | 142.4 | -39.4 | -147.5 | -75.7 | 0 | 0 | 0 | 105 | ||||
| 164 | S | 31.1 | Very low | 36.1 | Very low | 84 Ų | 84 | 142 Ų | 142 | 59% | 0.587 | 78% | 0.784 | S | S | * | * | trans | 78.7 | 136.3 | 147.4 | 9.8 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 165 | N | 31.5 | Very low | 34.9 | Very low | 148 Ų | 148 | 138.9 Ų | 138.9 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | trans | 100.8 | 103.7 | 142.7 | -60 | -15.8 | 0 | 0 | 0 | 116.7 | ||||
| 166 | N | 31.8 | Very low | 34.4 | Very low | 145 Ų | 145 | 136.6 Ų | 136.6 | 78% | 0.775 | 77% | 0.766 | S | S | * | * | 85.6 | 146 | 71 | -167 | 16.7 | 0 | 0 | 0 | 111.4 | |||||
| 167 | V | 35.3 | Very low | 34.8 | Very low | 116 Ų | 116 | 136.4 Ų | 136.4 | 70% | 0.703 | 76% | 0.76 | S | S | * | * | trans | 108 | 92.8 | 174.2 | -177.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 168 | Q | 34.4 | Very low | 34.9 | Very low | 168 Ų | 168 | 138.1 Ų | 138.1 | 79% | 0.785 | 76% | 0.755 | S | S | * | * | 107.4 | 104.2 | 70.7 | -125.6 | 151.1 | -13 | 0 | 0 | 110.3 | |||||
| 169 | Q | 39.6 | Very low | 35.3 | Very low | 179 Ų | 179 | 140.3 Ų | 140.3 | 84% | 0.836 | 76% | 0.76 | S | S | * | * | trans | -84.9 | 153.7 | 151.4 | -70.2 | -164.5 | -19.7 | 0 | 0 | 108.7 | ||||
| 170 | P | 45.4 | Very low | 35.5 | Very low | 119 Ų | 119 | 139.4 Ų | 139.4 | 77% | 0.773 | 76% | 0.762 | S | S | * | * | -142.9 | 138.7 | 96.8 | 25.7 | -4.9 | 0 | 0 | 0 | 112.6 | |||||
| 171 | A | 32.2 | Very low | 35.7 | Very low | 92 Ų | 92 | 139.4 Ų | 139.4 | 76% | 0.76 | 76% | 0.762 | S | S | * | * | 64.7 | 107.7 | 81.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 172 | S | 34.6 | Very low | 36.6 | Very low | 124 Ų | 124 | 137 Ų | 137 | 87% | 0.867 | 76% | 0.762 | S | S | * | * | trans | -84.3 | 154.2 | 164.1 | -51 | 0 | 0 | 0 | 0 | 111 | ||||
| 173 | P | 44.6 | Very low | 36.6 | Very low | 125 Ų | 125 | 134.6 Ų | 134.6 | 81% | 0.812 | 76% | 0.763 | S | S | * | * | trans | -117.7 | 138.5 | 157.2 | 33.9 | -22.4 | 0 | 0 | 0 | 113.5 | ||||
| 174 | S | 35.2 | Very low | 37.2 | Very low | 115 Ų | 115 | 133.3 Ų | 133.3 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | -58.7 | 154 | 165 | -51.8 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 175 | T | 30.1 | Very low | 38.4 | Very low | 127 Ų | 127 | 135.2 Ų | 135.2 | 78% | 0.779 | 78% | 0.777 | S | S | * | * | trans | -153.8 | 126 | 135.8 | 77.6 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 176 | S | 33 | Very low | 38.4 | Very low | 86 Ų | 86 | 135.1 Ų | 135.1 | 60% | 0.601 | 78% | 0.776 | S | S | * | * | 79.3 | 144.2 | 104.1 | 76.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 177 | E | 40.8 | Very low | 38.8 | Very low | 147 Ų | 147 | 133.3 Ų | 133.3 | 69% | 0.687 | 78% | 0.775 | S | S | * | * | cis | -176.5 | 162.6 | 24.1 | 33 | -151.9 | 51.5 | 0 | 0 | 108.9 | ||||
| 178 | E | 37.1 | Very low | 39.5 | Very low | 153 Ų | 153 | 133.1 Ų | 133.1 | 72% | 0.715 | 78% | 0.776 | S | S | * | * | trans | 31.3 | 130.1 | 152.2 | 69 | -152.4 | 82.5 | 0 | 0 | 123.6 | ||||
| 179 | D | 38.9 | Very low | 39.5 | Very low | 135 Ų | 135 | 130.2 Ų | 130.2 | 72% | 0.722 | 78% | 0.775 | S | S | * | * | 174.7 | 108.9 | 115.9 | -122.7 | -117.3 | 0 | 0 | 0 | 114 | |||||
| 180 | E | 36.5 | Very low | 39.1 | Very low | 175 Ų | 175 | 126.7 Ų | 126.7 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | 20.6 | 123.6 | 134 | -39.8 | -161.4 | 107.6 | 0 | 0 | 122.2 | ||||
| 181 | H | 38.9 | Very low | 38.8 | Very low | 185 Ų | 185 | 126.5 Ų | 126.5 | 86% | 0.856 | 77% | 0.77 | S | S | * | * | trans | -67.1 | 172.5 | 156.3 | -62.7 | -75.6 | 0 | 0 | 0 | 111 | ||||
| 182 | P | 51.9 | Low | 39.1 | Very low | 116 Ų | 116 | 127.1 Ų | 127.1 | 75% | 0.753 | 77% | 0.768 | S | S | * | * | cis | -148.4 | -177.4 | 22.3 | 39.4 | -16.8 | 0 | 0 | 0 | 115.7 | ||||
| 183 | C | 32.1 | Very low | 39.2 | Very low | 129 Ų | 129 | 126.7 Ų | 126.7 | 87% | 0.872 | 77% | 0.765 | S | S | * | * | trans | -175.2 | 113.6 | 141.8 | -101.9 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 184 | V | 46.1 | Very low | 39 | Very low | 132 Ų | 132 | 125.5 Ų | 125.5 | 80% | 0.8 | 77% | 0.767 | S | S | * | * | trans | -77.7 | 156 | 155 | -84.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 185 | P | 55.9 | Low | 39 | Very low | 123 Ų | 123 | 124.2 Ų | 124.2 | 80% | 0.799 | 76% | 0.762 | S | S | * | * | -135.3 | 152.7 | 127.3 | 32.3 | -18.3 | 0 | 0 | 0 | 114.6 | |||||
| 186 | D | 31.3 | Very low | 39.5 | Very low | 146 Ų | 146 | 123.6 Ų | 123.6 | 78% | 0.781 | 76% | 0.763 | S | S | * | * | trans | -63.9 | 146.7 | -179.3 | -66.1 | -70.6 | 0 | 0 | 0 | 115.9 | ||||
| 187 | S | 41.8 | Very low | 40.4 | Very low | 107 Ų | 107 | 125.1 Ų | 125.1 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | 28.6 | 162.5 | 129.4 | -46.2 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 188 | P | 49.1 | Very low | 40.2 | Very low | 113 Ų | 113 | 123.7 Ų | 123.7 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | cis | -152.1 | -176.2 | 21.5 | 40.4 | -16.8 | 0 | 0 | 0 | 117.7 | ||||
| 189 | S | 34.9 | Very low | 40.9 | Very low | 107 Ų | 107 | 122.2 Ų | 122.2 | 75% | 0.748 | 78% | 0.781 | S | S | * | * | trans | 54.8 | 154.5 | 141.2 | -75.9 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 190 | C | 31.6 | Very low | 40.9 | Very low | 104 Ų | 104 | 120.7 Ų | 120.7 | 70% | 0.703 | 78% | 0.781 | S | S | * | * | cis | 179.4 | 158.4 | -17.6 | -91.7 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 191 | S | 37.5 | Very low | 41.1 | Very low | 115 Ų | 115 | 119.6 Ų | 119.6 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | 82.2 | 149.6 | 156.4 | -48.1 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 192 | S | 38.6 | Very low | 40.9 | Very low | 105 Ų | 105 | 117.4 Ų | 117.4 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | cis | 176.2 | 153.5 | -18.6 | -89.4 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 193 | S | 36.8 | Very low | 39.9 | Very low | 115 Ų | 115 | 118.4 Ų | 118.4 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | 140.1 | 108.5 | 146.1 | -64.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 194 | A | 40.3 | Very low | 40.4 | Very low | 101 Ų | 101 | 117.6 Ų | 117.6 | 84% | 0.835 | 78% | 0.779 | S | S | * | * | 76 | 141.8 | 81.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 195 | A | 34.8 | Very low | 40.4 | Very low | 87 Ų | 87 | 117 Ų | 117 | 72% | 0.719 | 78% | 0.777 | S | S | * | * | cis | -177.3 | 168.6 | -10.6 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 196 | S | 41.8 | Very low | 40.5 | Very low | 114 Ų | 114 | 117.2 Ų | 117.2 | 80% | 0.797 | 78% | 0.779 | S | S | * | * | trans | 106 | 159 | 153.2 | -33.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 197 | P | 52.1 | Low | 40.6 | Very low | 118 Ų | 118 | 116.1 Ų | 116.1 | 77% | 0.766 | 78% | 0.783 | S | S | * | * | -134.3 | 167.1 | -95.4 | 27.3 | -2.7 | 0 | 0 | 0 | 116.5 | |||||
| 198 | S | 37.3 | Very low | 40.5 | Very low | 117 Ų | 117 | 116.1 Ų | 116.1 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | 12.4 | 156 | 150.6 | -54.9 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 199 | P | 49.9 | Very low | 40.6 | Very low | 123 Ų | 123 | 117 Ų | 117 | 80% | 0.799 | 79% | 0.789 | S | S | * | * | cis | -146.7 | 170.7 | 38.5 | 38.6 | -15.6 | 0 | 0 | 0 | 119.4 | ||||
| 200 | S | 39.2 | Very low | 40.6 | Very low | 103 Ų | 103 | 117.9 Ų | 117.9 | 72% | 0.72 | 79% | 0.789 | S | S | * | * | trans | -64.8 | 157.3 | 175.2 | 47.5 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 201 | L | 40.3 | Very low | 40.7 | Very low | 151 Ų | 151 | 118.4 Ų | 118.4 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | -176.4 | 123.5 | 120 | -91.4 | 171.6 | 0 | 0 | 0 | 113.2 | |||||
| 202 | N | 35 | Very low | 40.5 | Very low | 140 Ų | 140 | 117.7 Ų | 117.7 | 75% | 0.749 | 79% | 0.789 | S | S | * | * | trans | 57.5 | 117.5 | 147 | -67.2 | 12.4 | 0 | 0 | 0 | 122.9 | ||||
| 203 | C | 32.6 | Very low | 40.4 | Very low | 136 Ų | 136 | 120.1 Ų | 120.1 | 92% | 0.919 | 79% | 0.793 | S | S | * | * | -161.1 | 122.6 | 118.7 | -95.6 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 204 | S | 40.9 | Very low | 40.4 | Very low | 113 Ų | 113 | 121.5 Ų | 121.5 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 150.6 | -178.8 | -48.1 | 0 | 0 | 0 | 0 | 113.1 | ||
| 205 | P | 47.9 | Very low | 40.2 | Very low | 118 Ų | 118 | 121.7 Ų | 121.7 | 77% | 0.766 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 144.6 | 158.5 | 32.9 | -29.3 | 0 | 0 | 0 | 111.2 | ||
| 206 | P | 56.6 | Low | 40.3 | Very low | 129 Ų | 129 | 124 Ų | 124 | 84% | 0.838 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -79 | 152.4 | 174.3 | 31.1 | -32.5 | 0 | 0 | 0 | 113.1 | ||
| 207 | S | 33.9 | Very low | 40 | Very low | 122 Ų | 122 | 122.8 Ų | 122.8 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 154.4 | -171.4 | -50 | 0 | 0 | 0 | 0 | 116.8 | ||
| 208 | S | 39.6 | Very low | 39.4 | Very low | 107 Ų | 107 | 126.8 Ų | 126.8 | 75% | 0.748 | 80% | 0.8 | S | S | * | * | trans | -52 | 175.5 | 173 | -38.6 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 209 | P | 50.7 | Low | 39.2 | Very low | 133 Ų | 133 | 125.8 Ų | 125.8 | 86% | 0.864 | 79% | 0.793 | S | S | * | * | -127.7 | 153.1 | 110.6 | 35 | -26.6 | 0 | 0 | 0 | 114.8 | |||||
| 210 | V | 35.4 | Very low | 38.6 | Very low | 124 Ų | 124 | 128.1 Ų | 128.1 | 75% | 0.752 | 80% | 0.798 | S | S | * | * | trans | -67.2 | 139.6 | 177.7 | 162.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 211 | S | 33.9 | Very low | 38.6 | Very low | 115 Ų | 115 | 128.3 Ų | 128.3 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -160 | 102.9 | 137.1 | -80.9 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 212 | S | 33.4 | Very low | 38.7 | Very low | 100 Ų | 100 | 132.7 Ų | 132.7 | 70% | 0.699 | 81% | 0.805 | S | S | * | * | trans | 60 | 96.3 | 136.2 | -52.9 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 213 | L | 36 | Very low | 39.1 | Very low | 156 Ų | 156 | 134.1 Ų | 134.1 | 82% | 0.817 | 81% | 0.812 | S | S | * | * | 26.7 | 107.3 | 120 | -70.3 | 153.1 | 0 | 0 | 0 | 118.3 | |||||
| 214 | T | 36.4 | Very low | 39.4 | Very low | 144 Ų | 144 | 130.6 Ų | 130.6 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | -139.7 | 112.2 | 131.2 | 33.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 215 | S | 36.7 | Very low | 39.6 | Very low | 105 Ų | 105 | 134.7 Ų | 134.7 | 73% | 0.734 | 80% | 0.802 | S | S | * | * | trans | -76.8 | 129 | 175.7 | -71.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 216 | T | 36.9 | Very low | 39.6 | Very low | 135 Ų | 135 | 140.5 Ų | 140.5 | 83% | 0.828 | 81% | 0.809 | S | S | * | * | trans | -125.3 | 82 | 151.9 | 39.6 | 0 | 0 | 0 | 0 | 108.4 | F218 | T216-F218 PolarHBondContact O-N 2.93Š| ||
| 217 | A | 34.7 | Very low | 39.2 | Very low | 90 Ų | 90 | 144.2 Ų | 144.2 | 74% | 0.744 | 81% | 0.812 | S | S | * | * | trans | -69.5 | 106 | 161.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | S219 | A217-S219 PolarHBondContact O-N 2.92Š| ||
| 218 | F | 40 | Very low | 39.7 | Very low | 201 Ų | 201 | 150.3 Ų | 150.3 | 88% | 0.882 | 82% | 0.816 | S | S | * | * | trans | -82.8 | 97.7 | 164.2 | -122.8 | -89.5 | 0 | 0 | 0 | 107.9 | T216 L220 | T216-F218 PolarHBondContact O-N 2.93Å; F218-L220 PolarHBondContact O-N 3.13Å; F218-L220 VanDerWaalsContact O-N 3.08Å | ||
| 219 | S | 32.8 | Very low | 39.4 | Very low | 96 Ų | 96 | 149 Ų | 149 | 67% | 0.671 | 82% | 0.82 | S | S | * | * | trans | -58 | 106.2 | 171 | -63.1 | 0 | 0 | 0 | 0 | 110.5 | A217 S221 | A217-S219 PolarHBondContact O-N 2.92Å; S219-S221 VanDerWaalsContact C-N 3.27Å; S219-S221 PolarHBondContact O-N 3.36Å | ||
| 220 | L | 36.7 | Very low | 39.3 | Very low | 173 Ų | 173 | 150 Ų | 150 | 91% | 0.906 | 82% | 0.818 | S | S | * | * | trans | -73.1 | 81 | 164 | -90.9 | 151.7 | 0 | 0 | 0 | 109.3 | F218 R222 | F218-L220 PolarHBondContact O-N 3.13Å; F218-L220 VanDerWaalsContact O-N 3.08Å; L220-R222 PolarHBondContact O-N 2.95Å | ||
| 221 | S | 39.6 | Very low | 39.4 | Very low | 107 Ų | 107 | 149.4 Ų | 149.4 | 75% | 0.748 | 82% | 0.819 | S | S | * | * | trans | -79.7 | 96.4 | 168.8 | -65.2 | 0 | 0 | 0 | 0 | 109.8 | S219 L223 | S219-S221 VanDerWaalsContact C-N 3.27Å; S219-S221 PolarHBondContact O-N 3.36Å; S221-L223 PolarHBondContact O-N 3.46Å | ||
| 222 | R | 44 | Very low | 40.1 | Very low | 242 Ų | 242 | 151.6 Ų | 151.6 | 91% | 0.913 | 82% | 0.821 | S | S | * | * | trans | -61.3 | 121 | 154 | -70.4 | 178.1 | -179.5 | -122.3 | 0.1 | 108.2 | L220 | L220-R222 PolarHBondContact O-N 2.95Š| ||
| 223 | L | 41.7 | Very low | 40.3 | Very low | 171 Ų | 171 | 152.4 Ų | 152.4 | 90% | 0.895 | 83% | 0.826 | S | S | * | * | trans | -143.4 | 102.4 | 158.6 | -164.2 | 64.4 | 0 | 0 | 0 | 110.5 | S221 | S221-L223 PolarHBondContact O-N 3.46Š| ||
| 224 | G | 40.7 | Very low | 40.4 | Very low | 61 Ų | 61 | 154.4 Ų | 154.4 | 63% | 0.629 | 83% | 0.829 | S | S | * | * | trans | -80.1 | 143.3 | 163.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 225 | K | 44.1 | Very low | 41.2 | Very low | 200 Ų | 200 | 152.6 Ų | 152.6 | 87% | 0.87 | 82% | 0.82 | S | S | * | * | 157.2 | 111.9 | 129.9 | -89.3 | 173 | 171.7 | 172 | 0 | 112.1 | |||||
| 226 | R | 48.2 | Very low | 41.6 | Very low | 239 Ų | 239 | 152.9 Ų | 152.9 | 90% | 0.902 | 82% | 0.822 | S | S | * | * | trans | 32.9 | 129.6 | 141.4 | -12.7 | -177.8 | -54.2 | 176.4 | 6.5 | 120.2 | ||||
| 227 | K | 47.1 | Very low | 41.8 | Very low | 208 Ų | 208 | 153.4 Ų | 153.4 | 90% | 0.904 | 83% | 0.825 | S | S | * | * | -162.3 | 136.1 | 126.9 | -166.4 | 148.6 | 177.8 | -179.6 | 0 | 112.6 | |||||
| 228 | R | 44.5 | Very low | 42.4 | Very low | 250 Ų | 250 | 152.9 Ų | 152.9 | 94% | 0.943 | 83% | 0.828 | S | S | * | * | trans | -63 | 150.4 | 173.2 | -66 | -179.5 | -175.2 | -165.8 | 0.4 | 112 | ||||
| 229 | G | 34.8 | Very low | 42.5 | Very low | 80 Ų | 80 | 148.5 Ų | 148.5 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | trans | -166.7 | 96 | 163.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 230 | N | 47.3 | Very low | 43.3 | Very low | 154 Ų | 154 | 155 Ų | 155 | 82% | 0.824 | 83% | 0.832 | S | S | * | * | trans | -86.3 | 125 | 170 | 166.2 | 77.1 | 0 | 0 | 0 | 109.4 | ||||
| 231 | S | 38.5 | Very low | 44 | Very low | 111 Ų | 111 | 151.9 Ų | 151.9 | 78% | 0.776 | 83% | 0.825 | S | S | * | * | trans | -172.4 | 126.9 | 148.8 | 51.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 232 | L | 48.8 | Very low | 44.7 | Very low | 161 Ų | 161 | 151.3 Ų | 151.3 | 84% | 0.843 | 82% | 0.821 | S | S | * | * | trans | -60.2 | 138.7 | 170.4 | -61.1 | 155.5 | 0 | 0 | 0 | 112.5 | ||||
| 233 | S | 37.8 | Very low | 45 | Very low | 116 Ų | 116 | 144.5 Ų | 144.5 | 81% | 0.811 | 81% | 0.811 | S | S | * | * | trans | 176 | 124.5 | 139.5 | 54.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 234 | F | 38.1 | Very low | 45.2 | Very low | 198 Ų | 198 | 140.3 Ų | 140.3 | 87% | 0.868 | 80% | 0.795 | S | S | * | * | trans | -50.9 | -168.8 | 173.9 | -58.5 | -90.2 | 0 | 0 | 0 | 117.1 | ||||
| 235 | P | 52.5 | Low | 45.7 | Very low | 107 Ų | 107 | 140.8 Ų | 140.8 | 70% | 0.695 | 79% | 0.789 | S | S | * | * | -128 | 172.4 | -55.9 | 34.3 | -17 | 0 | 0 | 0 | 113.6 | |||||
| 236 | S | 44.1 | Very low | 46.1 | Very low | 111 Ų | 111 | 135.4 Ų | 135.4 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | trans | 52.9 | 116 | 151.3 | -57.8 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 237 | T | 42.1 | Very low | 46.3 | Very low | 145 Ų | 145 | 127.7 Ų | 127.7 | 89% | 0.89 | 76% | 0.76 | S | S | * | * | trans | -166.2 | 131 | 130.5 | 15.2 | 0 | 0 | 0 | 0 | 109.9 | S239 | T237-S239 PolarHBondContact O-N 3.21Š| ||
| 238 | G | 47.3 | Very low | 46.7 | Very low | 79 Ų | 79 | 120.9 Ų | 120.9 | 81% | 0.814 | 74% | 0.742 | S | S | * | * | trans | -58.9 | 130.8 | -175 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 239 | S | 42.5 | Very low | 47.3 | Very low | 110 Ų | 110 | 116.3 Ų | 116.3 | 77% | 0.769 | 73% | 0.729 | S | S | * | * | trans | -112.2 | 110.3 | 154.8 | -72.4 | 0 | 0 | 0 | 0 | 107.1 | T237 S241 | T237-S239 PolarHBondContact O-N 3.21Å; S239-S241 VanDerWaalsContact C-N 3.26Å; S239-S241 PolarHBondContact O-N 2.89Å | ||
| 240 | R | 49.4 | Very low | 48.7 | Very low | 231 Ų | 231 | 120.1 Ų | 120.1 | 87% | 0.872 | 72% | 0.723 | S | S | * | * | trans | -60.9 | 88.2 | 172.3 | -61.7 | 163.9 | 87.8 | 178.1 | 7.4 | 107.9 | S242 | R240-S242 PolarHBondContact O-N 2.93Å; R240-S242 VanDerWaalsContact O-N 3.12Å | ||
| 241 | S | 49.9 | Very low | 50.2 | Low | 109 Ų | 109 | 116.3 Ų | 116.3 | 76% | 0.762 | 71% | 0.708 | S | S | * | * | trans | -83.1 | 65.7 | 166.4 | 55.5 | 0 | 0 | 0 | 0 | 108.8 | S239 | S239-S241 VanDerWaalsContact C-N 3.26Å; S239-S241 PolarHBondContact O-N 2.89Å | ||
| 242 | S | 54.5 | Low | 52.6 | Low | 95 Ų | 95 | 119.1 Ų | 119.1 | 66% | 0.664 | 70% | 0.702 | S | S | * | * | trans | -123 | 49.6 | 176.9 | 66.5 | 0 | 0 | 0 | 0 | 110.9 | R240 | R240-S242 PolarHBondContact O-N 2.93Å; R240-S242 VanDerWaalsContact O-N 3.12Å | ||
| 243 | S | 50.9 | Low | 54.6 | Low | 99 Ų | 99 | 119.6 Ų | 119.6 | 69% | 0.692 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -146.6 | 12.2 | 172.8 | 57.2 | 0 | 0 | 0 | 0 | 114.8 | ||
| 244 | S | 46.5 | Very low | 57.1 | Low | 82 Ų | 82 | 120.2 Ų | 120.2 | 57% | 0.573 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -94.8 | 0.2 | 171.2 | 52.7 | 0 | 0 | 0 | 0 | 113.9 | S247 | S244-S247 PolarHBondContact O-OG 3.01Š|
| 245 | S | 50.4 | Low | 59.6 | Low | 72 Ų | 72 | 119.9 Ų | 119.9 | 50% | 0.503 | 68% | 0.675 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84.4 | -6.4 | -178.1 | 61.4 | 0 | 0 | 0 | 0 | 114.5 | K249 | S245-K249 WeakPolarHBondContact O-CD 3.42Å; S245-K249 WeakPolarHBondContact O-CG 3.37Å |
| 246 | S | 52.8 | Low | 61.6 | Low | 86 Ų | 86 | 118.4 Ų | 118.4 | 60% | 0.601 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | -30.1 | 176.6 | 59.2 | 0 | 0 | 0 | 0 | 112.8 | K250 | S246-K250 WeakPolarHBondContact O-CB 3.32Å; S246-K250 PolarHBondContact O-N 3.39Å; S246-K250 VanDerWaalsContact O-N 3.15Å |
| 247 | S | 52.3 | Low | 64 | Low | 78 Ų | 78 | 117 Ų | 117 | 55% | 0.545 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -77.3 | -41.5 | 178 | 57 | 0 | 0 | 0 | 0 | 112.5 | S244 K249 K250 S251 | S244-S247 PolarHBondContact O-OG 3.01Å; S247-K249 VanDerWaalsContact C-N 3.32Å; S247-K249 PolarHBondContact O-N 2.78Å; S247-K250 PolarHBondContact O-N 3.18Å; S247-S251 PolarHBondContact O-N 2.9Å |
| 248 | A | 55.9 | Low | 66.6 | Low | 64 Ų | 64 | 116.4 Ų | 116.4 | 53% | 0.529 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -64.8 | -35.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | R252 | A248-R252 WeakPolarHBondContact O-CB 3.48Å; A248-R252 PolarHBondContact O-N 2.98Å |
| 249 | K | 57.9 | Low | 68.9 | Low | 154 Ų | 154 | 117.3 Ų | 117.3 | 67% | 0.67 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -70.9 | -33.7 | 174.4 | -72.3 | -177.5 | -175.6 | -176.6 | 0 | 112.8 | S245 S247 R253 | S245-K249 WeakPolarHBondContact O-CD 3.42Å; S245-K249 WeakPolarHBondContact O-CG 3.37Å; S247-K249 VanDerWaalsContact C-N 3.32Å; S247-K249 PolarHBondContact O-N 2.78Å; K249-R253 PolarHBondContact O-N 2.91Å |
| 250 | K | 62.3 | Low | 71.6 | Confident | 161 Ų | 161 | 118.4 Ų | 118.4 | 70% | 0.7 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -71.6 | -39.3 | 174.3 | -169.7 | 148.6 | 178.3 | 171.3 | 0 | 111.9 | S246 S247 R253 E254 | S246-K250 WeakPolarHBondContact O-CB 3.32Å; S246-K250 PolarHBondContact O-N 3.39Å; S246-K250 VanDerWaalsContact O-N 3.15Å; S247-K250 PolarHBondContact O-N 3.18Å; K250-R253 PolarHBondContact O-N 3.17Å; K250-E254 WeakPolarHBondContact O-CB 3.42Å; K250-E254 PolarHBondContact O-N 3.21Å |
| 251 | S | 80.7 | Confident | 73.9 | Confident | 73 Ų | 73 | 116 Ų | 116 | 51% | 0.51 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -66.3 | -40.4 | 174.8 | 173.1 | 0 | 0 | 0 | 0 | 113.1 | S247 E254 R255 | S247-S251 PolarHBondContact O-N 2.9Å; S251-E254 PolarHBondContact O-N 3.01Å; S251-R255 WeakPolarHBondContact O-CB 3.23Å; S251-R255 PolarHBondContact O-N 2.68Å |
| 252 | R | 88.3 | Confident | 76.2 | Confident | 171 Ų | 171 | 117 Ų | 117 | 65% | 0.645 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -60.8 | -47.6 | 175.1 | -175.4 | 176.4 | -171.5 | -97.7 | 13.1 | 111.6 | A248 E254 R255 E256 | A248-R252 WeakPolarHBondContact O-CB 3.48Å; A248-R252 PolarHBondContact O-N 2.98Å; R252-E254 VanDerWaalsContact C-N 3.31Å; R252-E254 PolarHBondContact O-N 2.92Å; R252-R255 PolarHBondContact O-N 3.43Å; R252-E256 WeakPolarHBondContact CG-OE1 3.18Å; R252-E256 IonicContact CZ-OE1 3.13Å; R252-E256 IonicContact NE-OE1 3.49Å; R252-E256 PolarHBondContact NE-OE1 3.01Å; R252-E256 IonicContact NH1-OE1 2.74Å; R252-E256 PolarHBondContact NH1-OE1 3.08Å; R252-E256 IonicContact NH2-OE1 3.86Å; R252-E256 VanDerWaalsContact O-CG 3.31Å; R252-E256 WeakPolarHBondContact O-CG 3.37Å; R252-E256 PolarHBondContact O-N 2.88Å |
| 253 | R | 89.4 | Confident | 78.3 | Confident | 171 Ų | 171 | 116.1 Ų | 116.1 | 65% | 0.645 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66 | -32.3 | 178.6 | -173.3 | 177.5 | 178.4 | -177.3 | 1.4 | 113.1 | K249 K250 Q257 | K249-R253 PolarHBondContact O-N 2.91Å; K250-R253 PolarHBondContact O-N 3.17Å; R253-Q257 WeakPolarHBondContact O-CG 3.25Å; R253-Q257 PolarHBondContact O-N 3.21Å; R253-Q257 VanDerWaalsContact O-N 3.15Å; R253-Q257 PolarHBondContact O-NE2 3.42Å |
| 254 | E | 90.6 | Very high | 80.5 | Confident | 129 Ų | 129 | 116.7 Ų | 116.7 | 60% | 0.603 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -70.3 | -43.9 | 174.9 | -178.4 | 174.3 | -166.7 | 0 | 0 | 111.5 | K250 S251 R252 E256 Q257 E258 | K250-E254 WeakPolarHBondContact O-CB 3.42Å; K250-E254 PolarHBondContact O-N 3.21Å; S251-E254 PolarHBondContact O-N 3.01Å; R252-E254 VanDerWaalsContact C-N 3.31Å; R252-E254 PolarHBondContact O-N 2.92Å; E254-E256 VanDerWaalsContact C-N 3.33Å; E254-E256 PolarHBondContact O-N 3.14Å; E254-Q257 PolarHBondContact O-N 2.95Å; E254-E258 PolarHBondContact O-N 2.87Å |
| 255 | R | 91.9 | Very high | 83 | Confident | 190 Ų | 190 | 118 Ų | 118 | 72% | 0.717 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62.9 | -38.6 | 174.3 | -175.2 | 179.7 | 179.7 | 179.4 | -0.5 | 112.4 | S251 R252 E258 N259 | S251-R255 WeakPolarHBondContact O-CB 3.23Å; S251-R255 PolarHBondContact O-N 2.68Å; R252-R255 PolarHBondContact O-N 3.43Å; R255-E258 PolarHBondContact O-N 3.43Å; R255-N259 WeakPolarHBondContact O-CB 3.4Å; R255-N259 PolarHBondContact O-N 3.43Å |
| 256 | E | 92.9 | Very high | 85.3 | Confident | 76 Ų | 76 | 118.4 Ų | 118.4 | 36% | 0.355 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -62.3 | -45.8 | 174.3 | -74.9 | 164.6 | -174 | 0 | 0 | 110.9 | R252 E254 E258 N259 E260 | R252-E256 WeakPolarHBondContact CG-OE1 3.18Å; R252-E256 IonicContact CZ-OE1 3.13Å; R252-E256 IonicContact NE-OE1 3.49Å; R252-E256 PolarHBondContact NE-OE1 3.01Å; R252-E256 IonicContact NH1-OE1 2.74Å; R252-E256 PolarHBondContact NH1-OE1 3.08Å; R252-E256 IonicContact NH2-OE1 3.86Å; R252-E256 VanDerWaalsContact O-CG 3.31Å; R252-E256 WeakPolarHBondContact O-CG 3.37Å; R252-E256 PolarHBondContact O-N 2.88Å; E254-E256 VanDerWaalsContact C-N 3.33Å; E254-E256 PolarHBondContact O-N 3.14Å; E256-E258 PolarHBondContact O-N 3.42Å; E256-N259 WeakPolarHBondContact O-CB 3.47Å; E256-N259 PolarHBondContact O-N 2.72Å; E256-E260 WeakPolarHBondContact O-CG 3.49Å; E256-E260 PolarHBondContact O-N 3.21Å |
| 257 | Q | 96.1 | Very high | 87.5 | Confident | 82 Ų | 82 | 117.7 Ų | 117.7 | 38% | 0.383 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.9 | -37.6 | 175.6 | -77.1 | 172.3 | 58.8 | 0 | 0 | 113.3 | R253 E254 N259 E260 R261 | R253-Q257 WeakPolarHBondContact O-CG 3.25Å; R253-Q257 PolarHBondContact O-N 3.21Å; R253-Q257 VanDerWaalsContact O-N 3.15Å; R253-Q257 PolarHBondContact O-NE2 3.42Å; E254-Q257 PolarHBondContact O-N 2.95Å; Q257-N259 VanDerWaalsContact C-N 3.32Å; Q257-E260 PolarHBondContact O-N 2.85Å; Q257-R261 VanDerWaalsContact O-CG 3.27Å; Q257-R261 WeakPolarHBondContact O-CG 3.43Å; Q257-R261 PolarHBondContact O-N 2.93Å |
| 258 | E | 95.8 | Very high | 89.7 | Confident | 132 Ų | 132 | 117.3 Ų | 117.3 | 62% | 0.617 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.3 | -40.3 | 173.5 | -174.6 | -177.4 | -173.9 | 0 | 0 | 111.2 | E254 R255 E256 R261 K262 | E254-E258 PolarHBondContact O-N 2.87Å; R255-E258 PolarHBondContact O-N 3.43Å; E256-E258 PolarHBondContact O-N 3.42Å; E258-R261 PolarHBondContact O-N 2.89Å; E258-K262 WeakPolarHBondContact O-CB 3.31Å; E258-K262 PolarHBondContact O-N 3.25Å |
| 259 | N | 96.6 | Very high | 91.7 | Very high | 98 Ų | 98 | 118 Ų | 118 | 52% | 0.524 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.1 | -46.7 | 175.5 | -165 | -14.4 | 0 | 0 | 0 | 111 | R255 E256 Q257 R261 K262 V263 | R255-N259 WeakPolarHBondContact O-CB 3.4Å; R255-N259 PolarHBondContact O-N 3.43Å; E256-N259 WeakPolarHBondContact O-CB 3.47Å; E256-N259 PolarHBondContact O-N 2.72Å; Q257-N259 VanDerWaalsContact C-N 3.32Å; N259-R261 VanDerWaalsContact C-N 3.31Å; N259-R261 PolarHBondContact O-N 2.91Å; N259-K262 CarbonylContact O-C 3.59Å; N259-K262 WeakPolarHBondContact O-CB 3.24Å; N259-K262 PolarHBondContact O-N 2.64Å; N259-K262 VanDerWaalsContact O-N 3.08Å; N259-V263 WeakPolarHBondContact O-CG2 3.39Å; N259-V263 PolarHBondContact O-N 3.49Å |
| 260 | E | 97.6 | Very high | 93.7 | Very high | 134 Ų | 134 | 115 Ų | 115 | 63% | 0.626 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -56.7 | -44 | 174.4 | -73 | 173.3 | -176.1 | 0 | 0 | 112 | E256 Q257 K262 V263 Q264 | E256-E260 WeakPolarHBondContact O-CG 3.49Å; E256-E260 PolarHBondContact O-N 3.21Å; Q257-E260 PolarHBondContact O-N 2.85Å; E260-K262 VanDerWaalsContact C-N 3.34Å; E260-K262 PolarHBondContact O-N 3.23Å; E260-V263 PolarHBondContact O-N 2.91Å; E260-Q264 PolarHBondContact O-N 3.33Å |
| 261 | R | 97.8 | Very high | 95.4 | Very high | 181 Ų | 181 | 113.8 Ų | 113.8 | 68% | 0.683 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.5 | -42.4 | 174.7 | -72.8 | 173.6 | -174.3 | -144.7 | 1.8 | 112.1 | Q257 E258 N259 Q264 E265 | Q257-R261 VanDerWaalsContact O-CG 3.27Å; Q257-R261 WeakPolarHBondContact O-CG 3.43Å; Q257-R261 PolarHBondContact O-N 2.93Å; E258-R261 PolarHBondContact O-N 2.89Å; N259-R261 VanDerWaalsContact C-N 3.31Å; N259-R261 PolarHBondContact O-N 2.91Å; R261-Q264 PolarHBondContact O-N 3.31Å; R261-E265 WeakPolarHBondContact O-CB 3.21Å; R261-E265 PolarHBondContact O-N 3.25Å |
| 262 | K | 98.3 | Very high | 96.3 | Very high | 128 Ų | 128 | 118.3 Ų | 118.3 | 56% | 0.557 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -67 | -38.9 | 178.6 | -171.9 | 172.7 | -176.4 | 174.9 | 0 | 111.8 | E258 N259 E260 Q264 E265 L266 | E258-K262 WeakPolarHBondContact O-CB 3.31Å; E258-K262 PolarHBondContact O-N 3.25Å; N259-K262 CarbonylContact O-C 3.59Å; N259-K262 WeakPolarHBondContact O-CB 3.24Å; N259-K262 PolarHBondContact O-N 2.64Å; N259-K262 VanDerWaalsContact O-N 3.08Å; E260-K262 VanDerWaalsContact C-N 3.34Å; E260-K262 PolarHBondContact O-N 3.23Å; K262-Q264 VanDerWaalsContact C-N 3.33Å; K262-E265 PolarHBondContact O-N 3.33Å; K262-L266 HydrophobicContact CG-CD1 4.15Å; K262-L266 HydrophobicContact CG-CG 4.45Å; K262-L266 WeakPolarHBondContact O-CB 3.19Å; K262-L266 VanDerWaalsContact O-CG 3.26Å; K262-L266 WeakPolarHBondContact O-CG 3.29Å; K262-L266 PolarHBondContact O-N 3.09Å |
| 263 | V | 98.7 | Very high | 96.8 | Very high | 78 Ų | 78 | 115 Ų | 115 | 47% | 0.473 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.4 | -45.1 | 173.3 | 169.5 | 0 | 0 | 0 | 0 | 110 | N259 E260 L266 T267 | N259-V263 WeakPolarHBondContact O-CG2 3.39Å; N259-V263 PolarHBondContact O-N 3.49Å; E260-V263 PolarHBondContact O-N 2.91Å; V263-L266 PolarHBondContact O-N 3.43Å; V263-T267 WeakPolarHBondContact O-CB 3.31Å; V263-T267 PolarHBondContact O-N 3.41Å; V263-T267 PolarHBondContact O-OG1 3.5Å |
| 264 | Q | 98.6 | Very high | 97.2 | Very high | 110 Ų | 110 | 113.4 Ų | 113.4 | 51% | 0.514 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62 | -48 | 176.2 | -171.5 | 61.4 | 50.2 | 0 | 0 | 111.6 | E260 R261 K262 L266 T267 D268 | E260-Q264 PolarHBondContact O-N 3.33Å; R261-Q264 PolarHBondContact O-N 3.31Å; K262-Q264 VanDerWaalsContact C-N 3.33Å; Q264-L266 VanDerWaalsContact C-N 3.34Å; Q264-L266 PolarHBondContact O-N 3.05Å; Q264-T267 WeakPolarHBondContact O-CA 3.49Å; Q264-T267 WeakPolarHBondContact O-CB 3.31Å; Q264-T267 PolarHBondContact O-N 3.29Å; Q264-D268 PolarHBondContact NE2-OD1 3.44Å; Q264-D268 PolarHBondContact O-N 3.02Å |
| 265 | E | 98.4 | Very high | 97.6 | Very high | 111 Ų | 111 | 110.2 Ų | 110.2 | 52% | 0.519 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.7 | -44.4 | 178.6 | -177.9 | 178.7 | -176.5 | 0 | 0 | 112 | R261 K262 T267 D268 Q269 | R261-E265 WeakPolarHBondContact O-CB 3.21Å; R261-E265 PolarHBondContact O-N 3.25Å; K262-E265 PolarHBondContact O-N 3.33Å; E265-T267 VanDerWaalsContact C-N 3.26Å; E265-T267 PolarHBondContact O-N 3.25Å; E265-D268 PolarHBondContact O-N 3.16Å; E265-Q269 WeakPolarHBondContact O-CB 3.49Å; E265-Q269 WeakPolarHBondContact O-CG 3.36Å; E265-Q269 PolarHBondContact O-N 2.88Å |
| 266 | L | 98.8 | Very high | 98 | Very high | 79 Ų | 79 | 104.8 Ų | 104.8 | 41% | 0.414 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.5 | -31.4 | 175.8 | -73.4 | 173.5 | 0 | 0 | 0 | 112.1 | K262 V263 Q264 N270 | K262-L266 HydrophobicContact CG-CD1 4.15Å; K262-L266 HydrophobicContact CG-CG 4.45Å; K262-L266 WeakPolarHBondContact O-CB 3.19Å; K262-L266 VanDerWaalsContact O-CG 3.26Å; K262-L266 WeakPolarHBondContact O-CG 3.29Å; K262-L266 PolarHBondContact O-N 3.09Å; V263-L266 PolarHBondContact O-N 3.43Å; Q264-L266 VanDerWaalsContact C-N 3.34Å; Q264-L266 PolarHBondContact O-N 3.05Å; L266-N270 VanDerWaalsContact O-CB 3.31Å; L266-N270 WeakPolarHBondContact O-CB 3.26Å; L266-N270 PolarHBondContact O-N 2.71Å; L266-N270 PolarHBondContact O-ND2 3.2Å |
| 267 | T | 98.7 | Very high | 98.2 | Very high | 71 Ų | 71 | 106.6 Ų | 106.6 | 44% | 0.436 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.5 | -48.9 | 175.4 | -59.8 | 0 | 0 | 0 | 0 | 110.2 | V263 Q264 E265 Q269 N270 E271 | V263-T267 WeakPolarHBondContact O-CB 3.31Å; V263-T267 PolarHBondContact O-N 3.41Å; V263-T267 PolarHBondContact O-OG1 3.5Å; Q264-T267 WeakPolarHBondContact O-CA 3.49Å; Q264-T267 WeakPolarHBondContact O-CB 3.31Å; Q264-T267 PolarHBondContact O-N 3.29Å; E265-T267 VanDerWaalsContact C-N 3.26Å; E265-T267 PolarHBondContact O-N 3.25Å; T267-Q269 VanDerWaalsContact C-N 3.33Å; T267-Q269 PolarHBondContact O-N 3.34Å; T267-N270 PolarHBondContact O-N 2.9Å; T267-E271 PolarHBondContact O-N 3.28Å |
| 268 | D | 98.7 | Very high | 98.4 | Very high | 70 Ų | 70 | 107.8 Ų | 107.8 | 37% | 0.374 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.5 | -39.3 | 178.2 | -61.7 | -3.5 | 0 | 0 | 0 | 111.6 | Q264 E265 E271 R272 | Q264-D268 PolarHBondContact NE2-OD1 3.44Å; Q264-D268 PolarHBondContact O-N 3.02Å; E265-D268 PolarHBondContact O-N 3.16Å; D268-E271 PolarHBondContact O-N 2.93Å; D268-R272 WeakPolarHBondContact O-CB 3.33Å; D268-R272 PolarHBondContact O-N 2.95Å |
| 269 | Q | 98.8 | Very high | 98.5 | Very high | 80 Ų | 80 | 107.5 Ų | 107.5 | 37% | 0.374 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.1 | -42.6 | 174.5 | -74.9 | -174.4 | 1.3 | 0 | 0 | 111.9 | E265 T267 R272 L273 | E265-Q269 WeakPolarHBondContact O-CB 3.49Å; E265-Q269 WeakPolarHBondContact O-CG 3.36Å; E265-Q269 PolarHBondContact O-N 2.88Å; T267-Q269 VanDerWaalsContact C-N 3.33Å; T267-Q269 PolarHBondContact O-N 3.34Å; Q269-R272 PolarHBondContact O-N 3.4Å; Q269-L273 WeakPolarHBondContact O-CB 3.38Å; Q269-L273 WeakPolarHBondContact O-CG 3.35Å; Q269-L273 PolarHBondContact O-N 3.36Å |
| 270 | N | 98.8 | Very high | 98.6 | Very high | 89 Ų | 89 | 106.8 Ų | 106.8 | 48% | 0.476 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.4 | -42.2 | 176.3 | -89.5 | -60.2 | 0 | 0 | 0 | 111.8 | L266 T267 R272 L273 K274 | L266-N270 VanDerWaalsContact O-CB 3.31Å; L266-N270 WeakPolarHBondContact O-CB 3.26Å; L266-N270 PolarHBondContact O-N 2.71Å; L266-N270 PolarHBondContact O-ND2 3.2Å; T267-N270 PolarHBondContact O-N 2.9Å; N270-R272 VanDerWaalsContact C-N 3.33Å; N270-R272 PolarHBondContact O-N 3.41Å; N270-L273 PolarHBondContact O-N 3.42Å; N270-K274 VanDerWaalsContact O-CG 3.29Å; N270-K274 WeakPolarHBondContact O-CG 3.41Å; N270-K274 PolarHBondContact O-N 3.05Å |
| 271 | E | 98.8 | Very high | 98.7 | Very high | 136 Ų | 136 | 101.9 Ų | 101.9 | 64% | 0.636 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -58.9 | -47.4 | 174.8 | -170.6 | -165.8 | 160.3 | 0 | 0 | 110.9 | T267 D268 L273 K274 A275 | T267-E271 PolarHBondContact O-N 3.28Å; D268-E271 PolarHBondContact O-N 2.93Å; E271-L273 VanDerWaalsContact C-N 3.34Å; E271-L273 PolarHBondContact O-N 2.91Å; E271-K274 WeakPolarHBondContact O-CB 3.48Å; E271-K274 PolarHBondContact O-N 3.42Å; E271-A275 PolarHBondContact O-N 3.03Å |
| 272 | R | 98.8 | Very high | 98.7 | Very high | 168 Ų | 168 | 98.8 Ų | 98.8 | 63% | 0.634 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59.9 | -43.7 | 177.4 | -170.7 | -176.5 | -64 | 115.2 | 3 | 112.2 | D268 Q269 N270 A275 E276 | D268-R272 WeakPolarHBondContact O-CB 3.33Å; D268-R272 PolarHBondContact O-N 2.95Å; Q269-R272 PolarHBondContact O-N 3.4Å; N270-R272 VanDerWaalsContact C-N 3.33Å; N270-R272 PolarHBondContact O-N 3.41Å; R272-A275 PolarHBondContact O-N 3.49Å; R272-E276 PolarHBondContact O-N 2.92Å; R272-E276 VanDerWaalsContact O-N 3.09Å |
| 273 | L | 98.9 | Very high | 98.7 | Very high | 103 Ų | 103 | 96.5 Ų | 96.5 | 54% | 0.539 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.3 | -38.6 | 178.3 | -74 | 172.7 | 0 | 0 | 0 | 112 | Q269 N270 E271 E276 I277 | Q269-L273 WeakPolarHBondContact O-CB 3.38Å; Q269-L273 WeakPolarHBondContact O-CG 3.35Å; Q269-L273 PolarHBondContact O-N 3.36Å; N270-L273 PolarHBondContact O-N 3.42Å; E271-L273 VanDerWaalsContact C-N 3.34Å; E271-L273 PolarHBondContact O-N 2.91Å; L273-E276 PolarHBondContact O-N 3.2Å; L273-I277 VanDerWaalsContact O-CG1 3.31Å; L273-I277 WeakPolarHBondContact O-CG1 3.45Å; L273-I277 PolarHBondContact O-N 3.43Å |
| 274 | K | 98.8 | Very high | 98.8 | Very high | 137 Ų | 137 | 97.7 Ų | 97.7 | 60% | 0.596 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -59.1 | -48.8 | 174.1 | -75.6 | 172.6 | 177.9 | -178.3 | 0 | 111.2 | N270 E271 E276 I277 D278 | N270-K274 VanDerWaalsContact O-CG 3.29Å; N270-K274 WeakPolarHBondContact O-CG 3.41Å; N270-K274 PolarHBondContact O-N 3.05Å; E271-K274 WeakPolarHBondContact O-CB 3.48Å; E271-K274 PolarHBondContact O-N 3.42Å; K274-E276 VanDerWaalsContact C-N 3.27Å; K274-E276 PolarHBondContact O-N 2.93Å; K274-I277 PolarHBondContact O-N 3.36Å; K274-D278 PolarHBondContact O-N 3.47Å |
| 275 | A | 98.8 | Very high | 98.8 | Very high | 61 Ų | 61 | 97.4 Ų | 97.4 | 50% | 0.504 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.4 | -38.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | E271 R272 R279 | E271-A275 PolarHBondContact O-N 3.03Å; R272-A275 PolarHBondContact O-N 3.49Å; A275-R279 WeakPolarHBondContact O-CB 3.48Å; A275-R279 PolarHBondContact O-N 3.08Å |
| 276 | E | 98.8 | Very high | 98.8 | Very high | 77 Ų | 77 | 97.5 Ų | 97.5 | 36% | 0.36 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -69.8 | -39.5 | 177.1 | -176.9 | 59.7 | -165.3 | 0 | 0 | 112.5 | R272 L273 K274 D278 R279 L280 | R272-E276 PolarHBondContact O-N 2.92Å; R272-E276 VanDerWaalsContact O-N 3.09Å; L273-E276 PolarHBondContact O-N 3.2Å; K274-E276 VanDerWaalsContact C-N 3.27Å; K274-E276 PolarHBondContact O-N 2.93Å; E276-D278 VanDerWaalsContact C-N 3.34Å; E276-R279 PolarHBondContact O-N 3.47Å; E276-R279 IonicContact OE1-CZ 3.62Å; E276-R279 IonicContact OE1-NE 3.14Å; E276-R279 PolarHBondContact OE1-NE 3.46Å; E276-R279 IonicContact OE1-NH2 2.88Å; E276-R279 PolarHBondContact OE1-NH2 2.94Å; E276-R279 IonicContact OE2-CZ 2.81Å; E276-R279 IonicContact OE2-NE 3.47Å; E276-R279 PolarHBondContact OE2-NE 2.97Å; E276-R279 IonicContact OE2-NH2 3.85Å; E276-L280 HydrophobicContact CG-CD1 4.12Å; E276-L280 HydrophobicContact CG-CG 4.49Å; E276-L280 WeakPolarHBondContact O-CB 3.35Å; E276-L280 VanDerWaalsContact O-CG 3.31Å; E276-L280 WeakPolarHBondContact O-CG 3.47Å; E276-L280 PolarHBondContact O-N 2.91Å |
| 277 | I | 98.8 | Very high | 98.8 | Very high | 114 Ų | 114 | 97 Ų | 97 | 59% | 0.585 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -60.5 | -46 | 174.2 | -71.6 | 165.7 | 0 | 0 | 0 | 110.2 | L273 K274 L280 G281 | L273-I277 VanDerWaalsContact O-CG1 3.31Å; L273-I277 WeakPolarHBondContact O-CG1 3.45Å; L273-I277 PolarHBondContact O-N 3.43Å; K274-I277 PolarHBondContact O-N 3.36Å; I277-L280 PolarHBondContact O-N 2.98Å; I277-G281 PolarHBondContact O-N 3.33Å |
| 278 | D | 98.8 | Very high | 98.8 | Very high | 107 Ų | 107 | 101.7 Ų | 101.7 | 57% | 0.572 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63 | -46.6 | 179.4 | -68.8 | -24.1 | 0 | 0 | 0 | 110.9 | K274 E276 L280 G281 E282 | K274-D278 PolarHBondContact O-N 3.47Å; E276-D278 VanDerWaalsContact C-N 3.34Å; D278-L280 PolarHBondContact O-N 3.31Å; D278-G281 PolarHBondContact O-N 2.89Å; D278-E282 PolarHBondContact O-N 2.74Å |
| 279 | R | 98.8 | Very high | 98.8 | Very high | 126 Ų | 126 | 105 Ų | 105 | 48% | 0.475 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58 | -46.3 | 176.5 | -170.6 | -165.6 | 73.7 | 79.1 | 0.9 | 112.3 | A275 E276 E283 | A275-R279 WeakPolarHBondContact O-CB 3.48Å; A275-R279 PolarHBondContact O-N 3.08Å; E276-R279 PolarHBondContact O-N 3.47Å; E276-R279 IonicContact OE1-CZ 3.62Å; E276-R279 IonicContact OE1-NE 3.14Å; E276-R279 PolarHBondContact OE1-NE 3.46Å; E276-R279 IonicContact OE1-NH2 2.88Å; E276-R279 PolarHBondContact OE1-NH2 2.94Å; E276-R279 IonicContact OE2-CZ 2.81Å; E276-R279 IonicContact OE2-NE 3.47Å; E276-R279 PolarHBondContact OE2-NE 2.97Å; E276-R279 IonicContact OE2-NH2 3.85Å; R279-E283 PolarHBondContact O-N 2.81Å |
| 280 | L | 98.9 | Very high | 98.7 | Very high | 83 Ų | 83 | 103.2 Ų | 103.2 | 44% | 0.435 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.3 | -37.5 | 176.9 | -72.3 | 174.7 | 0 | 0 | 0 | 111.7 | E276 I277 D278 E282 E283 V284 | E276-L280 HydrophobicContact CG-CD1 4.12Å; E276-L280 HydrophobicContact CG-CG 4.49Å; E276-L280 WeakPolarHBondContact O-CB 3.35Å; E276-L280 VanDerWaalsContact O-CG 3.31Å; E276-L280 WeakPolarHBondContact O-CG 3.47Å; E276-L280 PolarHBondContact O-N 2.91Å; I277-L280 PolarHBondContact O-N 2.98Å; D278-L280 PolarHBondContact O-N 3.31Å; L280-E282 VanDerWaalsContact C-N 3.34Å; L280-E282 PolarHBondContact O-N 3.35Å; L280-E283 WeakPolarHBondContact O-CB 3.37Å; L280-E283 PolarHBondContact O-N 3.46Å; L280-E283 VanDerWaalsContact O-N 3.16Å; L280-V284 WeakPolarHBondContact O-CG2 3.42Å; L280-V284 PolarHBondContact O-N 2.89Å |
| 281 | G | 98.8 | Very high | 98.7 | Very high | 31 Ų | 31 | 102.8 Ų | 102.8 | 32% | 0.32 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.6 | -45.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | I277 D278 E283 V284 Q285 | I277-G281 PolarHBondContact O-N 3.33Å; D278-G281 PolarHBondContact O-N 2.89Å; G281-E283 VanDerWaalsContact C-N 3.32Å; G281-E283 PolarHBondContact O-N 2.88Å; G281-V284 PolarHBondContact O-N 2.88Å; G281-Q285 VanDerWaalsContact O-CG 3.3Å; G281-Q285 WeakPolarHBondContact O-CG 3.44Å; G281-Q285 PolarHBondContact O-N 3.33Å |
| 282 | E | 98.7 | Very high | 98.7 | Very high | 115 Ų | 115 | 100.3 Ų | 100.3 | 54% | 0.537 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.9 | -39.8 | 174.1 | -72.6 | -174 | -176.3 | 0 | 0 | 112.6 | D278 L280 Q285 R286 | D278-E282 PolarHBondContact O-N 2.74Å; L280-E282 VanDerWaalsContact C-N 3.34Å; L280-E282 PolarHBondContact O-N 3.35Å; E282-Q285 PolarHBondContact O-N 3.28Å; E282-R286 VanDerWaalsContact O-CB 3.32Å; E282-R286 WeakPolarHBondContact O-CB 3.4Å; E282-R286 PolarHBondContact O-N 3.32Å |
| 283 | E | 98.7 | Very high | 98.6 | Very high | 80 Ų | 80 | 98.1 Ų | 98.1 | 37% | 0.374 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.7 | -44.1 | 178.4 | -168.7 | 65.2 | -91.4 | 0 | 0 | 112.4 | R279 L280 G281 Q285 R286 T287 | R279-E283 PolarHBondContact O-N 2.81Å; L280-E283 WeakPolarHBondContact O-CB 3.37Å; L280-E283 PolarHBondContact O-N 3.46Å; L280-E283 VanDerWaalsContact O-N 3.16Å; G281-E283 VanDerWaalsContact C-N 3.32Å; G281-E283 PolarHBondContact O-N 2.88Å; E283-Q285 VanDerWaalsContact C-N 3.32Å; E283-Q285 PolarHBondContact O-N 3.48Å; E283-R286 PolarHBondContact O-N 3.43Å; E283-R286 IonicContact OE1-CZ 3.68Å; E283-R286 IonicContact OE1-NH1 3.43Å; E283-R286 PolarHBondContact OE1-NH1 3.45Å; E283-R286 IonicContact OE2-NH1 2.68Å; E283-R286 PolarHBondContact OE2-NH1 3.25Å; E283-R286 VanDerWaalsContact OE2-NH1 3.14Å; E283-T287 WeakPolarHBondContact O-CB 3.45Å; E283-T287 PolarHBondContact O-N 3.49Å; E283-T287 PolarHBondContact O-OG1 3.32Å |
| 284 | V | 98.9 | Very high | 98.5 | Very high | 103 Ų | 103 | 99.6 Ų | 99.6 | 62% | 0.624 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -60.8 | -45.1 | 174.6 | 170.7 | 0 | 0 | 0 | 0 | 110.1 | L280 G281 R286 T287 R288 | L280-V284 WeakPolarHBondContact O-CG2 3.42Å; L280-V284 PolarHBondContact O-N 2.89Å; G281-V284 PolarHBondContact O-N 2.88Å; V284-R286 PolarHBondContact O-N 3.15Å; V284-T287 PolarHBondContact O-N 2.99Å; V284-R288 WeakPolarHBondContact O-CB 3.48Å; V284-R288 PolarHBondContact O-N 3.26Å |
| 285 | Q | 98.7 | Very high | 98.4 | Very high | 105 Ų | 105 | 98.5 Ų | 98.5 | 49% | 0.491 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.3 | -40.3 | 177.2 | -71.1 | -178.5 | 17.1 | 0 | 0 | 112.5 | G281 E282 E283 R288 R289 | G281-Q285 VanDerWaalsContact O-CG 3.3Å; G281-Q285 WeakPolarHBondContact O-CG 3.44Å; G281-Q285 PolarHBondContact O-N 3.33Å; E282-Q285 PolarHBondContact O-N 3.28Å; E283-Q285 VanDerWaalsContact C-N 3.32Å; E283-Q285 PolarHBondContact O-N 3.48Å; Q285-R288 PolarHBondContact O-N 2.95Å; Q285-R289 WeakPolarHBondContact O-CG 3.33Å; Q285-R289 PolarHBondContact O-N 2.93Å |
| 286 | R | 98.8 | Very high | 98.3 | Very high | 112 Ų | 112 | 99.4 Ų | 99.4 | 42% | 0.423 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.6 | -48.2 | 175.5 | -174.8 | -176.1 | -64 | 103.6 | 4 | 110.7 | E282 E283 V284 R289 A290 | E282-R286 VanDerWaalsContact O-CB 3.32Å; E282-R286 WeakPolarHBondContact O-CB 3.4Å; E282-R286 PolarHBondContact O-N 3.32Å; E283-R286 PolarHBondContact O-N 3.43Å; E283-R286 IonicContact OE1-CZ 3.68Å; E283-R286 IonicContact OE1-NH1 3.43Å; E283-R286 PolarHBondContact OE1-NH1 3.45Å; E283-R286 IonicContact OE2-NH1 2.68Å; E283-R286 PolarHBondContact OE2-NH1 3.25Å; E283-R286 VanDerWaalsContact OE2-NH1 3.14Å; V284-R286 PolarHBondContact O-N 3.15Å; R286-R289 PolarHBondContact O-N 3.34Å; R286-A290 PolarHBondContact O-N 3.36Å |
| 287 | T | 98.7 | Very high | 97.9 | Very high | 70 Ų | 70 | 99.8 Ų | 99.8 | 43% | 0.429 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.1 | -46.7 | 176.8 | -59 | 0 | 0 | 0 | 0 | 111.1 | E283 V284 R289 A290 L291 | E283-T287 WeakPolarHBondContact O-CB 3.45Å; E283-T287 PolarHBondContact O-N 3.49Å; E283-T287 PolarHBondContact O-OG1 3.32Å; V284-T287 PolarHBondContact O-N 2.99Å; T287-R289 VanDerWaalsContact C-N 3.35Å; T287-R289 PolarHBondContact O-N 3Å; T287-A290 PolarHBondContact O-N 2.93Å; T287-L291 HydrophobicContact CG2-CD1 4.25Å; T287-L291 HydrophobicContact CG2-CG 4.39Å; T287-L291 VanDerWaalsContact O-CG 3.31Å; T287-L291 WeakPolarHBondContact O-CG 3.4Å; T287-L291 PolarHBondContact O-N 3.48Å |
| 288 | R | 98.8 | Very high | 97.2 | Very high | 169 Ų | 169 | 99.2 Ų | 99.2 | 64% | 0.638 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -56.2 | -47.6 | 176.2 | -178.4 | -177.5 | 174.7 | -149.4 | -0.7 | 111.5 | V284 Q285 L291 I292 | V284-R288 WeakPolarHBondContact O-CB 3.48Å; V284-R288 PolarHBondContact O-N 3.26Å; Q285-R288 PolarHBondContact O-N 2.95Å; R288-L291 PolarHBondContact O-N 3.29Å; R288-I292 HydrophobicContact CG-CD1 4Å; R288-I292 VanDerWaalsContact O-CG1 3.32Å; R288-I292 WeakPolarHBondContact O-CG1 3.38Å; R288-I292 PolarHBondContact O-N 3.16Å |
| 289 | R | 98.6 | Very high | 96 | Very high | 138 Ų | 138 | 103.2 Ų | 103.2 | 52% | 0.521 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.9 | -46.8 | 177.2 | -74.2 | -172.5 | -65 | -95.8 | 1.1 | 111.7 | Q285 R286 T287 L291 I292 E293 | Q285-R289 WeakPolarHBondContact O-CG 3.33Å; Q285-R289 PolarHBondContact O-N 2.93Å; R286-R289 PolarHBondContact O-N 3.34Å; T287-R289 VanDerWaalsContact C-N 3.35Å; T287-R289 PolarHBondContact O-N 3Å; R289-L291 VanDerWaalsContact C-N 3.33Å; R289-L291 PolarHBondContact O-N 3.14Å; R289-I292 PolarHBondContact O-N 3.34Å; R289-E293 WeakPolarHBondContact O-CB 3.31Å; R289-E293 PolarHBondContact O-N 3.5Å |
| 290 | A | 98.3 | Very high | 94 | Very high | 43 Ų | 43 | 107.9 Ų | 107.9 | 36% | 0.355 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.6 | -37 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | R286 T287 R294 | R286-A290 PolarHBondContact O-N 3.36Å; T287-A290 PolarHBondContact O-N 2.93Å; A290-R294 WeakPolarHBondContact O-CB 3.48Å; A290-R294 PolarHBondContact O-N 3.21Å; A290-R294 VanDerWaalsContact O-N 3.16Å |
| 291 | L | 98.4 | Very high | 93.7 | Very high | 81 Ų | 81 | 109.1 Ų | 109.1 | 42% | 0.424 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.4 | -46.7 | 173.7 | -69.3 | 174.4 | 0 | 0 | 0 | 111.3 | T287 R288 R289 R294 L295 | T287-L291 HydrophobicContact CG2-CD1 4.25Å; T287-L291 HydrophobicContact CG2-CG 4.39Å; T287-L291 VanDerWaalsContact O-CG 3.31Å; T287-L291 WeakPolarHBondContact O-CG 3.4Å; T287-L291 PolarHBondContact O-N 3.48Å; R288-L291 PolarHBondContact O-N 3.29Å; R289-L291 VanDerWaalsContact C-N 3.33Å; R289-L291 PolarHBondContact O-N 3.14Å; L291-R294 PolarHBondContact O-N 2.9Å; L291-L295 WeakPolarHBondContact O-CG 3.4Å; L291-L295 PolarHBondContact O-N 2.85Å; L291-L295 VanDerWaalsContact O-N 3.07Å |
| 292 | I | 97.9 | Very high | 93.4 | Very high | 84 Ų | 84 | 113.2 Ų | 113.2 | 43% | 0.431 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.9 | -49.3 | 177.9 | -68.6 | 166.6 | 0 | 0 | 0 | 110.3 | R288 R289 R294 L295 V296 | R288-I292 HydrophobicContact CG-CD1 4Å; R288-I292 VanDerWaalsContact O-CG1 3.32Å; R288-I292 WeakPolarHBondContact O-CG1 3.38Å; R288-I292 PolarHBondContact O-N 3.16Å; R289-I292 PolarHBondContact O-N 3.34Å; I292-R294 VanDerWaalsContact C-N 3.3Å; I292-R294 PolarHBondContact O-N 3.41Å; I292-L295 PolarHBondContact O-N 2.8Å; I292-L295 VanDerWaalsContact O-N 3.14Å; I292-V296 HydrophobicContact CG2-CG2 4.16Å; I292-V296 VanDerWaalsContact O-CG2 3.31Å; I292-V296 WeakPolarHBondContact O-CG2 3.34Å; I292-V296 PolarHBondContact O-N 3.25Å |
| 293 | E | 97.2 | Very high | 93.2 | Very high | 122 Ų | 122 | 113.1 Ų | 113.1 | 57% | 0.57 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -56.2 | -44.7 | 179.7 | -179.4 | 177 | -163.8 | 0 | 0 | 111.8 | R289 L295 V296 N297 | R289-E293 WeakPolarHBondContact O-CB 3.31Å; R289-E293 PolarHBondContact O-N 3.5Å; E293-L295 PolarHBondContact O-N 3.12Å; E293-V296 PolarHBondContact O-N 3.42Å; E293-N297 WeakPolarHBondContact CG-ND2 3.21Å; E293-N297 WeakPolarHBondContact O-CB 3.27Å; E293-N297 PolarHBondContact O-N 3.32Å; E293-N297 PolarHBondContact O-ND2 3.17Å |
| 294 | R | 97 | Very high | 92.8 | Very high | 133 Ų | 133 | 115.1 Ų | 115.1 | 50% | 0.502 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.7 | -41.6 | 177.3 | -162.1 | -172.4 | -40 | 96.7 | 10.6 | 112.6 | A290 L291 I292 V296 T298 | A290-R294 WeakPolarHBondContact O-CB 3.48Å; A290-R294 PolarHBondContact O-N 3.21Å; A290-R294 VanDerWaalsContact O-N 3.16Å; L291-R294 PolarHBondContact O-N 2.9Å; I292-R294 VanDerWaalsContact C-N 3.3Å; I292-R294 PolarHBondContact O-N 3.41Å; R294-V296 VanDerWaalsContact C-N 3.32Å; R294-T298 WeakPolarHBondContact O-CB 3.16Å; R294-T298 VanDerWaalsContact O-CG2 3.26Å; R294-T298 WeakPolarHBondContact O-CG2 3.48Å; R294-T298 PolarHBondContact O-N 2.98Å; R294-T298 PolarHBondContact O-OG1 2.78Å |
| 295 | L | 96.9 | Very high | 92.4 | Very high | 115 Ų | 115 | 115.8 Ų | 115.8 | 60% | 0.602 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67.7 | -33.8 | 177.7 | -73.3 | 170.5 | 0 | 0 | 0 | 112.3 | L291 I292 E293 T298 | L291-L295 WeakPolarHBondContact O-CG 3.4Å; L291-L295 PolarHBondContact O-N 2.85Å; L291-L295 VanDerWaalsContact O-N 3.07Å; I292-L295 PolarHBondContact O-N 2.8Å; I292-L295 VanDerWaalsContact O-N 3.14Å; E293-L295 PolarHBondContact O-N 3.12Å; L295-T298 PolarHBondContact O-OG1 3.15Å |
| 296 | V | 95.4 | Very high | 92 | Very high | 80 Ų | 80 | 116.5 Ų | 116.5 | 49% | 0.485 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -74.9 | -41.5 | 177.6 | 171.1 | 0 | 0 | 0 | 0 | 111 | I292 E293 R294 T298 K299 | I292-V296 HydrophobicContact CG2-CG2 4.16Å; I292-V296 VanDerWaalsContact O-CG2 3.31Å; I292-V296 WeakPolarHBondContact O-CG2 3.34Å; I292-V296 PolarHBondContact O-N 3.25Å; E293-V296 PolarHBondContact O-N 3.42Å; R294-V296 VanDerWaalsContact C-N 3.32Å; V296-T298 VanDerWaalsContact C-N 3.3Å; V296-T298 PolarHBondContact O-N 3.11Å; V296-K299 PolarHBondContact O-N 2.66Å |
| 297 | N | 89.9 | Confident | 91.6 | Very high | 85 Ų | 85 | 116.9 Ų | 116.9 | 46% | 0.455 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -72.3 | -20.6 | -178.9 | -70.8 | -20.2 | 0 | 0 | 0 | 113.7 | E293 | E293-N297 WeakPolarHBondContact CG-ND2 3.21Å; E293-N297 WeakPolarHBondContact O-CB 3.27Å; E293-N297 PolarHBondContact O-N 3.32Å; E293-N297 PolarHBondContact O-ND2 3.17Å |
| 298 | T | 86 | Confident | 91 | Very high | 101 Ų | 101 | 120.5 Ų | 120.5 | 62% | 0.62 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | -6.4 | 177.8 | 46.3 | 0 | 0 | 0 | 0 | 114.1 | R294 L295 V296 | R294-T298 WeakPolarHBondContact O-CB 3.16Å; R294-T298 VanDerWaalsContact O-CG2 3.26Å; R294-T298 WeakPolarHBondContact O-CG2 3.48Å; R294-T298 PolarHBondContact O-N 2.98Å; R294-T298 PolarHBondContact O-OG1 2.78Å; L295-T298 PolarHBondContact O-OG1 3.15Å; V296-T298 VanDerWaalsContact C-N 3.3Å; V296-T298 PolarHBondContact O-N 3.11Å |
| 299 | K | 73.6 | Confident | 90.4 | Very high | 191 Ų | 191 | 116.4 Ų | 116.4 | 83% | 0.83 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | 8.6 | 175.5 | -77.7 | -178.7 | 166.1 | 177.5 | 0 | 113.5 | V296 | V296-K299 PolarHBondContact O-N 2.66Š|
| 300 | K | 55.1 | Low | 89.6 | Confident | 224 Ų | 224 | 114.5 Ų | 114.5 | 97% | 0.974 | 57% | 0.568 | S | S | * | * | trans | -107.9 | 0 | 172.2 | -68.4 | -178.1 | 178.1 | 175.7 | 0 | 109.3 |
Retrieved 300 of 300 residues in 374 ms
(Link to these results)