| 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 | 62.1 | Low | 81.6 | Confident | 217 Ų | 217 | 116 Ų | 116 | 100% | 1.069 | 60% | 0.597 | S | S | * | * | 0 | -38.1 | 0 | -102 | 178.1 | -176.5 | 0 | 0 | 114.2 | K3 | M1-K3 PolarHBondContact O-N 3.24Š| |||
| 2 | S | 79.9 | Confident | 82.2 | Confident | 90 Ų | 90 | 116.1 Ų | 116.1 | 63% | 0.629 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63 | -33.6 | -176.7 | -62.7 | 0 | 0 | 0 | 0 | 116.5 | L5 I6 | S2-L5 PolarHBondContact O-N 3.45Å; S2-I6 WeakPolarHBondContact O-CD1 3.44Å; S2-I6 VanDerWaalsContact O-CG1 3.28Å; S2-I6 WeakPolarHBondContact O-CG1 3.39Å; S2-I6 PolarHBondContact O-N 2.9Å; S2-I6 VanDerWaalsContact O-N 3.08Å |
| 3 | K | 79.6 | Confident | 82.9 | Confident | 171 Ų | 171 | 119.1 Ų | 119.1 | 74% | 0.743 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -68 | -39.7 | -173.9 | -64.6 | -177.6 | 179 | -179.9 | 0 | 113.1 | M1 I6 M7 | M1-K3 PolarHBondContact O-N 3.24Å; K3-I6 PolarHBondContact O-N 3.44Å; K3-M7 PolarHBondContact O-N 2.85Å |
| 4 | E | 81 | Confident | 83.5 | Confident | 119 Ų | 119 | 118 Ų | 118 | 56% | 0.556 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -64.7 | -41.5 | 176.4 | -62.3 | -58.3 | 133.6 | 0 | 0 | 111.9 | M7 L8 | E4-M7 PolarHBondContact O-N 2.91Å; E4-L8 WeakPolarHBondContact O-CB 3.23Å; E4-L8 WeakPolarHBondContact O-CD1 3.47Å; E4-L8 WeakPolarHBondContact O-CG 3.37Å; E4-L8 PolarHBondContact O-N 2.97Å |
| 5 | L | 82.1 | Confident | 84.3 | Confident | 114 Ų | 114 | 120.4 Ų | 120.4 | 60% | 0.597 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.1 | -42 | 175.8 | -99.8 | 158.5 | 0 | 0 | 0 | 111.8 | S2 L8 T9 | S2-L5 PolarHBondContact O-N 3.45Å; L5-L8 PolarHBondContact O-N 3.11Å; L5-T9 VanDerWaalsContact O-CG2 3.31Å; L5-T9 WeakPolarHBondContact O-CG2 3.34Å; L5-T9 PolarHBondContact O-N 2.95Å; L5-T9 VanDerWaalsContact O-N 3.1Å; L5-T9 PolarHBondContact O-OG1 3.24Å |
| 6 | I | 84.7 | Confident | 84.9 | Confident | 93 Ų | 93 | 120.2 Ų | 120.2 | 48% | 0.477 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -64.1 | -48.6 | 176.9 | -67.1 | 163.6 | 0 | 0 | 0 | 110.4 | S2 K3 L8 T9 E10 | S2-I6 WeakPolarHBondContact O-CD1 3.44Å; S2-I6 VanDerWaalsContact O-CG1 3.28Å; S2-I6 WeakPolarHBondContact O-CG1 3.39Å; S2-I6 PolarHBondContact O-N 2.9Å; S2-I6 VanDerWaalsContact O-N 3.08Å; K3-I6 PolarHBondContact O-N 3.44Å; I6-L8 VanDerWaalsContact C-N 3.34Å; I6-L8 PolarHBondContact O-N 3.34Å; I6-T9 PolarHBondContact O-N 3.13Å; I6-T9 VanDerWaalsContact O-N 3.15Å; I6-T9 PolarHBondContact O-OG1 3.45Å; I6-E10 PolarHBondContact O-N 3.48Å; I6-E10 VanDerWaalsContact O-N 3.1Å |
| 7 | M | 84.7 | Confident | 85.4 | Confident | 99 Ų | 99 | 115.6 Ų | 115.6 | 49% | 0.488 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -58 | -44.1 | 176.9 | -80.9 | -158.4 | -66.5 | 0 | 0 | 112.3 | K3 E4 T9 E10 V11 | K3-M7 PolarHBondContact O-N 2.85Å; E4-M7 PolarHBondContact O-N 2.91Å; M7-T9 VanDerWaalsContact C-N 3.32Å; M7-T9 PolarHBondContact O-N 3.22Å; M7-E10 PolarHBondContact O-N 3.08Å; M7-V11 VanDerWaalsContact O-CG2 3.27Å; M7-V11 WeakPolarHBondContact O-CG2 3.43Å; M7-V11 PolarHBondContact O-N 3.25Å |
| 8 | L | 83.4 | Confident | 86 | Confident | 111 Ų | 111 | 114.1 Ų | 114.1 | 58% | 0.581 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -62 | -38.6 | 177.9 | -76.8 | 163.3 | 0 | 0 | 0 | 112.4 | E4 L5 I6 M12 | E4-L8 WeakPolarHBondContact O-CB 3.23Å; E4-L8 WeakPolarHBondContact O-CD1 3.47Å; E4-L8 WeakPolarHBondContact O-CG 3.37Å; E4-L8 PolarHBondContact O-N 2.97Å; L5-L8 PolarHBondContact O-N 3.11Å; I6-L8 VanDerWaalsContact C-N 3.34Å; I6-L8 PolarHBondContact O-N 3.34Å; L8-M12 WeakPolarHBondContact O-CB 3.5Å; L8-M12 PolarHBondContact O-N 3.47Å |
| 9 | T | 86.6 | Confident | 86.5 | Confident | 70 Ų | 70 | 112.5 Ų | 112.5 | 43% | 0.429 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -70 | -34.9 | 178.5 | 59.6 | 0 | 0 | 0 | 0 | 113.4 | L5 I6 M7 K13 | L5-T9 VanDerWaalsContact O-CG2 3.31Å; L5-T9 WeakPolarHBondContact O-CG2 3.34Å; L5-T9 PolarHBondContact O-N 2.95Å; L5-T9 VanDerWaalsContact O-N 3.1Å; L5-T9 PolarHBondContact O-OG1 3.24Å; I6-T9 PolarHBondContact O-N 3.13Å; I6-T9 VanDerWaalsContact O-N 3.15Å; I6-T9 PolarHBondContact O-OG1 3.45Å; M7-T9 VanDerWaalsContact C-N 3.32Å; M7-T9 PolarHBondContact O-N 3.22Å; T9-K13 WeakPolarHBondContact O-CG 3.44Å; T9-K13 PolarHBondContact O-N 2.99Å |
| 10 | E | 86.3 | Confident | 87 | Confident | 118 Ų | 118 | 112.7 Ų | 112.7 | 55% | 0.551 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -68.6 | -45.6 | 175.2 | -73 | 179.2 | 172.1 | 0 | 0 | 111.2 | I6 M7 M12 K13 V14 | I6-E10 PolarHBondContact O-N 3.48Å; I6-E10 VanDerWaalsContact O-N 3.1Å; M7-E10 PolarHBondContact O-N 3.08Å; E10-M12 VanDerWaalsContact C-N 3.31Å; E10-M12 PolarHBondContact O-N 3.21Å; E10-K13 PolarHBondContact O-N 3.47Å; E10-V14 WeakPolarHBondContact O-CG2 3.25Å; E10-V14 PolarHBondContact O-N 3.49Å; E10-V14 VanDerWaalsContact O-N 3.1Å |
| 11 | V | 87.5 | Confident | 87.5 | Confident | 74 Ų | 74 | 110 Ų | 110 | 45% | 0.448 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -57.6 | -46.3 | 175.9 | 171.2 | 0 | 0 | 0 | 0 | 110.2 | M7 K13 V14 W15 | M7-V11 VanDerWaalsContact O-CG2 3.27Å; M7-V11 WeakPolarHBondContact O-CG2 3.43Å; M7-V11 PolarHBondContact O-N 3.25Å; V11-K13 VanDerWaalsContact C-N 3.32Å; V11-K13 PolarHBondContact O-N 3.01Å; V11-V14 PolarHBondContact O-N 3.31Å; V11-W15 VanDerWaalsContact CG1-CD1 3.44Å; V11-W15 PolarHBondContact O-N 2.9Å |
| 12 | M | 88.4 | Confident | 89.2 | Confident | 117 Ų | 117 | 103.2 Ų | 103.2 | 58% | 0.576 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.6 | -36.4 | 179.9 | -163.3 | 121.6 | 68.3 | 0 | 0 | 112.9 | L8 E10 W15 H16 | L8-M12 WeakPolarHBondContact O-CB 3.5Å; L8-M12 PolarHBondContact O-N 3.47Å; E10-M12 VanDerWaalsContact C-N 3.31Å; E10-M12 PolarHBondContact O-N 3.21Å; M12-W15 PolarHBondContact O-N 3.15Å; M12-H16 PolarHBondContact O-N 3.49Å; M12-H16 PolarHBondContact O-ND1 3.49Å |
| 13 | K | 90.7 | Very high | 90 | Very high | 155 Ų | 155 | 103.1 Ų | 103.1 | 67% | 0.674 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.4 | -41.5 | 174.9 | -74.9 | 172.5 | 178.7 | 174.2 | 0 | 112.2 | T9 E10 V11 H16 G17 | T9-K13 WeakPolarHBondContact O-CG 3.44Å; T9-K13 PolarHBondContact O-N 2.99Å; E10-K13 PolarHBondContact O-N 3.47Å; V11-K13 VanDerWaalsContact C-N 3.32Å; V11-K13 PolarHBondContact O-N 3.01Å; K13-H16 PolarHBondContact O-N 2.95Å; K13-G17 PolarHBondContact O-N 3.28Å |
| 14 | V | 91.8 | Very high | 90.9 | Very high | 104 Ų | 104 | 98 Ų | 98 | 63% | 0.63 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.6 | -42.8 | 176.4 | 175.7 | 0 | 0 | 0 | 0 | 110.7 | E10 V11 H16 G17 L18 | E10-V14 WeakPolarHBondContact O-CG2 3.25Å; E10-V14 PolarHBondContact O-N 3.49Å; E10-V14 VanDerWaalsContact O-N 3.1Å; V11-V14 PolarHBondContact O-N 3.31Å; V14-H16 PolarHBondContact O-N 3.5Å; V14-G17 PolarHBondContact O-N 3.16Å; V14-L18 WeakPolarHBondContact O-CB 3.39Å; V14-L18 PolarHBondContact O-N 2.81Å |
| 15 | W | 94.9 | Very high | 91.7 | Very high | 154 Ų | 154 | 98 Ų | 98 | 58% | 0.583 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.9 | -41.3 | 175.7 | -77.5 | 109.9 | 0 | 0 | 0 | 112.8 | V11 M12 L18 V19 | V11-W15 VanDerWaalsContact CG1-CD1 3.44Å; V11-W15 PolarHBondContact O-N 2.9Å; M12-W15 PolarHBondContact O-N 3.15Å; W15-L18 HydrophobicContact CE3-CD2 3.97Å; W15-L18 HydrophobicContact CZ3-CD2 3.91Å; W15-L18 PolarHBondContact O-N 3.36Å; W15-V19 WeakPolarHBondContact O-CB 3.24Å; W15-V19 VanDerWaalsContact O-CG2 3.26Å; W15-V19 WeakPolarHBondContact O-CG2 3.3Å; W15-V19 PolarHBondContact O-N 2.81Å |
| 16 | H | 94.1 | Very high | 92.4 | Very high | 117 Ų | 117 | 97.7 Ų | 97.7 | 54% | 0.542 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.1 | -46.1 | 175.2 | -79.2 | 77.4 | 0 | 0 | 0 | 111.5 | M12 K13 V14 L18 V19 I20 | M12-H16 PolarHBondContact O-N 3.49Å; M12-H16 PolarHBondContact O-ND1 3.49Å; K13-H16 PolarHBondContact O-N 2.95Å; V14-H16 PolarHBondContact O-N 3.5Å; H16-L18 VanDerWaalsContact C-N 3.32Å; H16-L18 PolarHBondContact O-N 2.83Å; H16-V19 PolarHBondContact O-N 3.43Å; H16-I20 WeakPolarHBondContact O-CD1 3.47Å; H16-I20 VanDerWaalsContact O-CG1 3.24Å; H16-I20 WeakPolarHBondContact O-CG1 3.38Å; H16-I20 PolarHBondContact O-N 3.33Å |
| 17 | G | 93.3 | Very high | 93 | Very high | 42 Ų | 42 | 98.2 Ų | 98.2 | 43% | 0.433 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.6 | -42.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K13 V14 I20 A21 | K13-G17 PolarHBondContact O-N 3.28Å; V14-G17 PolarHBondContact O-N 3.16Å; G17-I20 PolarHBondContact O-N 3.46Å; G17-A21 WeakPolarHBondContact O-CB 3.48Å; G17-A21 PolarHBondContact O-N 3.46Å |
| 18 | L | 95.9 | Very high | 93.7 | Very high | 88 Ų | 88 | 98.8 Ų | 98.8 | 46% | 0.461 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.9 | -45.8 | 177.7 | -177.6 | 63.8 | 0 | 0 | 0 | 112 | V14 W15 H16 I20 A21 V22 | V14-L18 WeakPolarHBondContact O-CB 3.39Å; V14-L18 PolarHBondContact O-N 2.81Å; W15-L18 HydrophobicContact CE3-CD2 3.97Å; W15-L18 HydrophobicContact CZ3-CD2 3.91Å; W15-L18 PolarHBondContact O-N 3.36Å; H16-L18 VanDerWaalsContact C-N 3.32Å; H16-L18 PolarHBondContact O-N 2.83Å; L18-I20 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 2.94Å; L18-A21 PolarHBondContact O-N 3.16Å; L18-V22 HydrophobicContact CD1-CG2 4.39Å; L18-V22 VanDerWaalsContact O-CG2 3.31Å; L18-V22 WeakPolarHBondContact O-CG2 3.5Å; L18-V22 PolarHBondContact O-N 2.95Å |
| 19 | V | 96.8 | Very high | 94.3 | Very high | 85 Ų | 85 | 95.7 Ų | 95.7 | 52% | 0.515 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.8 | -44.4 | 178 | 170.5 | 0 | 0 | 0 | 0 | 110.6 | W15 H16 A21 V22 V23 | W15-V19 WeakPolarHBondContact O-CB 3.24Å; W15-V19 VanDerWaalsContact O-CG2 3.26Å; W15-V19 WeakPolarHBondContact O-CG2 3.3Å; W15-V19 PolarHBondContact O-N 2.81Å; H16-V19 PolarHBondContact O-N 3.43Å; V19-A21 VanDerWaalsContact C-N 3.35Å; V19-A21 PolarHBondContact O-N 3.43Å; V19-V22 PolarHBondContact O-N 3.37Å; V19-V23 HydrophobicContact CG1-CG2 4.36Å; V19-V23 WeakPolarHBondContact O-CB 3.48Å; V19-V23 VanDerWaalsContact O-CG2 3.29Å; V19-V23 WeakPolarHBondContact O-CG2 3.28Å; V19-V23 PolarHBondContact O-N 3.21Å |
| 20 | I | 96.1 | Very high | 94.9 | Very high | 115 Ų | 115 | 95.9 Ų | 95.9 | 59% | 0.59 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.3 | -45.1 | 176.9 | -66.7 | 163.7 | 0 | 0 | 0 | 110.6 | H16 G17 L18 V22 V23 S24 | H16-I20 WeakPolarHBondContact O-CD1 3.47Å; H16-I20 VanDerWaalsContact O-CG1 3.24Å; H16-I20 WeakPolarHBondContact O-CG1 3.38Å; H16-I20 PolarHBondContact O-N 3.33Å; G17-I20 PolarHBondContact O-N 3.46Å; L18-I20 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 2.94Å; I20-V22 PolarHBondContact O-N 3.25Å; I20-V23 PolarHBondContact O-N 2.88Å; I20-S24 VanDerWaalsContact O-CB 3.22Å; I20-S24 WeakPolarHBondContact O-CB 3.3Å; I20-S24 PolarHBondContact O-N 3.32Å |
| 21 | A | 97.1 | Very high | 95.4 | Very high | 57 Ų | 57 | 94.9 Ų | 94.9 | 47% | 0.471 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | G17 L18 V19 S24 L25 | G17-A21 WeakPolarHBondContact O-CB 3.48Å; G17-A21 PolarHBondContact O-N 3.46Å; L18-A21 PolarHBondContact O-N 3.16Å; V19-A21 VanDerWaalsContact C-N 3.35Å; V19-A21 PolarHBondContact O-N 3.43Å; A21-S24 PolarHBondContact O-N 2.85Å; A21-L25 WeakPolarHBondContact O-CB 3.33Å; A21-L25 PolarHBondContact O-N 2.88Å |
| 22 | V | 97.7 | Very high | 95.9 | Very high | 75 Ų | 75 | 95.7 Ų | 95.7 | 46% | 0.455 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.4 | -46.4 | 178.1 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | L18 V19 I20 S24 L25 L26 | L18-V22 HydrophobicContact CD1-CG2 4.39Å; L18-V22 VanDerWaalsContact O-CG2 3.31Å; L18-V22 WeakPolarHBondContact O-CG2 3.5Å; L18-V22 PolarHBondContact O-N 2.95Å; V19-V22 PolarHBondContact O-N 3.37Å; I20-V22 PolarHBondContact O-N 3.25Å; V22-S24 VanDerWaalsContact C-N 3.33Å; V22-S24 PolarHBondContact O-N 3.46Å; V22-L25 PolarHBondContact O-N 3.41Å; V22-L26 HydrophobicContact CG1-CD1 4.16Å; V22-L26 WeakPolarHBondContact O-CG 3.34Å; V22-L26 PolarHBondContact O-N 3.44Å |
| 23 | V | 97.8 | Very high | 96.3 | Very high | 87 Ų | 87 | 95.7 Ų | 95.7 | 53% | 0.527 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.3 | -41.9 | 177.6 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | V19 I20 L25 L26 L27 | V19-V23 HydrophobicContact CG1-CG2 4.36Å; V19-V23 WeakPolarHBondContact O-CB 3.48Å; V19-V23 VanDerWaalsContact O-CG2 3.29Å; V19-V23 WeakPolarHBondContact O-CG2 3.28Å; V19-V23 PolarHBondContact O-N 3.21Å; I20-V23 PolarHBondContact O-N 2.88Å; V23-L25 PolarHBondContact O-N 2.95Å; V23-L26 PolarHBondContact O-N 2.8Å; V23-L27 WeakPolarHBondContact O-CB 3.15Å; V23-L27 PolarHBondContact O-N 3.15Å |
| 24 | S | 97.4 | Very high | 96.7 | Very high | 65 Ų | 65 | 92.1 Ų | 92.1 | 46% | 0.455 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.9 | -43 | 176.2 | -172.4 | 0 | 0 | 0 | 0 | 111.6 | I20 A21 V22 L27 Q28 | I20-S24 VanDerWaalsContact O-CB 3.22Å; I20-S24 WeakPolarHBondContact O-CB 3.3Å; I20-S24 PolarHBondContact O-N 3.32Å; A21-S24 PolarHBondContact O-N 2.85Å; V22-S24 VanDerWaalsContact C-N 3.33Å; V22-S24 PolarHBondContact O-N 3.46Å; S24-L27 PolarHBondContact O-N 2.93Å; S24-Q28 VanDerWaalsContact O-CB 3.3Å; S24-Q28 WeakPolarHBondContact O-CB 3.46Å; S24-Q28 PolarHBondContact O-N 3.29Å |
| 25 | L | 97.9 | Very high | 96.9 | Very high | 118 Ų | 118 | 91.7 Ų | 91.7 | 62% | 0.618 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.3 | -43.7 | 178.2 | -175.7 | 66.8 | 0 | 0 | 0 | 111.4 | A21 V22 V23 Q28 A29 | A21-L25 WeakPolarHBondContact O-CB 3.33Å; A21-L25 PolarHBondContact O-N 2.88Å; V22-L25 PolarHBondContact O-N 3.41Å; V23-L25 PolarHBondContact O-N 2.95Å; L25-Q28 PolarHBondContact O-N 2.98Å; L25-A29 WeakPolarHBondContact O-CB 3.45Å; L25-A29 PolarHBondContact O-N 3.29Å |
| 26 | L | 97.6 | Very high | 96.9 | Very high | 108 Ų | 108 | 88.8 Ų | 88.8 | 57% | 0.565 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.2 | -46.1 | 175.5 | -72.2 | 172.1 | 0 | 0 | 0 | 111.2 | V22 V23 Q28 A29 C30 | V22-L26 HydrophobicContact CG1-CD1 4.16Å; V22-L26 WeakPolarHBondContact O-CG 3.34Å; V22-L26 PolarHBondContact O-N 3.44Å; V23-L26 PolarHBondContact O-N 2.8Å; L26-Q28 VanDerWaalsContact C-N 3.34Å; L26-Q28 PolarHBondContact O-N 3.27Å; L26-A29 PolarHBondContact O-N 2.87Å; L26-C30 WeakPolarHBondContact O-CB 3.03Å; L26-C30 PolarHBondContact O-N 3.39Å; L26-C30 PolarHBondContact O-SG 2.96Å |
| 27 | L | 97.8 | Very high | 97 | Very high | 104 Ų | 104 | 90.5 Ų | 90.5 | 55% | 0.545 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 177.4 | -176.9 | 63.7 | 0 | 0 | 0 | 111.2 | V23 S24 C30 L31 | V23-L27 WeakPolarHBondContact O-CB 3.15Å; V23-L27 PolarHBondContact O-N 3.15Å; S24-L27 PolarHBondContact O-N 2.93Å; L27-C30 PolarHBondContact O-N 3.28Å; L27-L31 HydrophobicContact CG-CD1 4.29Å; L27-L31 VanDerWaalsContact O-CG 3.32Å; L27-L31 WeakPolarHBondContact O-CG 3.38Å; L27-L31 PolarHBondContact O-N 3.08Å |
| 28 | Q | 97.7 | Very high | 97.1 | Very high | 111 Ų | 111 | 93 Ų | 93 | 52% | 0.519 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 177.7 | -172.3 | 174.5 | -6.3 | 0 | 0 | 111.7 | S24 L25 L26 L31 L32 | S24-Q28 VanDerWaalsContact O-CB 3.3Å; S24-Q28 WeakPolarHBondContact O-CB 3.46Å; S24-Q28 PolarHBondContact O-N 3.29Å; L25-Q28 PolarHBondContact O-N 2.98Å; L26-Q28 VanDerWaalsContact C-N 3.34Å; L26-Q28 PolarHBondContact O-N 3.27Å; Q28-L31 PolarHBondContact O-N 3.47Å; Q28-L32 HydrophobicContact CG-CD1 4.42Å; Q28-L32 WeakPolarHBondContact O-CB 3.1Å; Q28-L32 VanDerWaalsContact O-CG 3.32Å; Q28-L32 WeakPolarHBondContact O-CG 3.48Å; Q28-L32 PolarHBondContact O-N 3.23Å |
| 29 | A | 97.9 | Very high | 97 | Very high | 45 Ų | 45 | 92.9 Ų | 92.9 | 37% | 0.372 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L25 L26 L32 I33 | L25-A29 WeakPolarHBondContact O-CB 3.45Å; L25-A29 PolarHBondContact O-N 3.29Å; L26-A29 PolarHBondContact O-N 2.87Å; A29-L32 PolarHBondContact O-N 2.93Å; A29-I33 VanDerWaalsContact O-CG1 3.29Å; A29-I33 WeakPolarHBondContact O-CG1 3.34Å; A29-I33 PolarHBondContact O-N 3.18Å |
| 30 | C | 97.9 | Very high | 96.8 | Very high | 74 Ų | 74 | 91.9 Ų | 91.9 | 50% | 0.5 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.3 | -46.1 | 175.2 | -73 | 0 | 0 | 0 | 0 | 111.9 | L26 L27 L32 I33 V34 | L26-C30 WeakPolarHBondContact O-CB 3.03Å; L26-C30 PolarHBondContact O-N 3.39Å; L26-C30 PolarHBondContact O-SG 2.96Å; L27-C30 PolarHBondContact O-N 3.28Å; C30-L32 VanDerWaalsContact C-N 3.34Å; C30-L32 PolarHBondContact O-N 3.46Å; C30-I33 PolarHBondContact O-N 2.72Å; C30-V34 WeakPolarHBondContact O-CG2 3.23Å; C30-V34 PolarHBondContact O-N 2.84Å |
| 31 | L | 97.6 | Very high | 96.7 | Very high | 97 Ų | 97 | 94.9 Ų | 94.9 | 51% | 0.508 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.2 | -43.4 | 177 | -71.8 | 173.5 | 0 | 0 | 0 | 111.5 | L27 Q28 I33 V34 I35 | L27-L31 HydrophobicContact CG-CD1 4.29Å; L27-L31 VanDerWaalsContact O-CG 3.32Å; L27-L31 WeakPolarHBondContact O-CG 3.38Å; L27-L31 PolarHBondContact O-N 3.08Å; Q28-L31 PolarHBondContact O-N 3.47Å; L31-I33 VanDerWaalsContact C-N 3.34Å; L31-I33 PolarHBondContact O-N 2.85Å; L31-V34 PolarHBondContact O-N 2.86Å; L31-I35 WeakPolarHBondContact O-CB 3.46Å; L31-I35 VanDerWaalsContact O-CG1 3.25Å; L31-I35 WeakPolarHBondContact O-CG1 3.23Å; L31-I35 PolarHBondContact O-N 3.3Å |
| 32 | L | 97.5 | Very high | 96.3 | Very high | 92 Ų | 92 | 98.1 Ų | 98.1 | 48% | 0.482 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.3 | -40.6 | 176.7 | -73.8 | 172.8 | 0 | 0 | 0 | 112.2 | Q28 A29 C30 N36 | Q28-L32 HydrophobicContact CG-CD1 4.42Å; Q28-L32 WeakPolarHBondContact O-CB 3.1Å; Q28-L32 VanDerWaalsContact O-CG 3.32Å; Q28-L32 WeakPolarHBondContact O-CG 3.48Å; Q28-L32 PolarHBondContact O-N 3.23Å; A29-L32 PolarHBondContact O-N 2.93Å; C30-L32 VanDerWaalsContact C-N 3.34Å; C30-L32 PolarHBondContact O-N 3.46Å; L32-N36 VanDerWaalsContact O-CB 3.3Å; L32-N36 WeakPolarHBondContact O-CB 3.49Å; L32-N36 PolarHBondContact O-N 2.56Å; L32-N36 PolarHBondContact O-ND2 3.34Å |
| 33 | I | 97.5 | Very high | 96 | Very high | 117 Ų | 117 | 99.4 Ų | 99.4 | 60% | 0.6 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.3 | -46.3 | 175.9 | -70 | 164.7 | 0 | 0 | 0 | 110.4 | A29 C30 L31 N36 Y37 | A29-I33 VanDerWaalsContact O-CG1 3.29Å; A29-I33 WeakPolarHBondContact O-CG1 3.34Å; A29-I33 PolarHBondContact O-N 3.18Å; C30-I33 PolarHBondContact O-N 2.72Å; L31-I33 VanDerWaalsContact C-N 3.34Å; L31-I33 PolarHBondContact O-N 2.85Å; I33-N36 PolarHBondContact O-N 3.45Å; I33-Y37 WeakPolarHBondContact O-CB 3.32Å; I33-Y37 PolarHBondContact O-N 2.91Å |
| 34 | V | 97.4 | Very high | 95.6 | Very high | 79 Ų | 79 | 99.1 Ų | 99.1 | 48% | 0.479 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.5 | -48.9 | 178.6 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | C30 L31 N36 Y37 L38 | C30-V34 WeakPolarHBondContact O-CG2 3.23Å; C30-V34 PolarHBondContact O-N 2.84Å; L31-V34 PolarHBondContact O-N 2.86Å; V34-N36 PolarHBondContact O-N 3.28Å; V34-Y37 WeakPolarHBondContact O-CB 3.37Å; V34-Y37 PolarHBondContact O-N 2.97Å; V34-L38 HydrophobicContact CG1-CD1 3.51Å; V34-L38 WeakPolarHBondContact O-CD1 3.3Å; V34-L38 PolarHBondContact O-N 2.91Å |
| 35 | I | 96.8 | Very high | 95 | Very high | 96 Ų | 96 | 101 Ų | 101 | 49% | 0.492 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -58.8 | -49.1 | 177.8 | -67.9 | 164.9 | 0 | 0 | 0 | 110.4 | L31 Y37 L38 L39 | L31-I35 WeakPolarHBondContact O-CB 3.46Å; L31-I35 VanDerWaalsContact O-CG1 3.25Å; L31-I35 WeakPolarHBondContact O-CG1 3.23Å; L31-I35 PolarHBondContact O-N 3.3Å; I35-Y37 VanDerWaalsContact C-N 3.28Å; I35-Y37 PolarHBondContact O-N 3.3Å; I35-L38 PolarHBondContact O-N 2.9Å; I35-L39 WeakPolarHBondContact O-CB 3.5Å; I35-L39 PolarHBondContact O-N 3Å |
| 36 | N | 95.3 | Very high | 94.5 | Very high | 93 Ų | 93 | 100.3 Ų | 100.3 | 50% | 0.497 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.8 | -37.5 | 178.1 | -83.4 | -58.1 | 0 | 0 | 0 | 112.6 | L32 I33 V34 S40 | L32-N36 VanDerWaalsContact O-CB 3.3Å; L32-N36 WeakPolarHBondContact O-CB 3.49Å; L32-N36 PolarHBondContact O-N 2.56Å; L32-N36 PolarHBondContact O-ND2 3.34Å; I33-N36 PolarHBondContact O-N 3.45Å; V34-N36 PolarHBondContact O-N 3.28Å; N36-S40 VanDerWaalsContact O-CB 3.23Å; N36-S40 WeakPolarHBondContact O-CB 3.36Å; N36-S40 PolarHBondContact O-N 3.12Å; N36-S40 PolarHBondContact O-OG 3.37Å |
| 37 | Y | 95.9 | Very high | 93.7 | Very high | 153 Ų | 153 | 98 Ų | 98 | 60% | 0.6 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.2 | -46.5 | 176.1 | 176.3 | -100.6 | 0 | 0 | 0 | 111.6 | I33 V34 I35 S40 R41 | I33-Y37 WeakPolarHBondContact O-CB 3.32Å; I33-Y37 PolarHBondContact O-N 2.91Å; V34-Y37 WeakPolarHBondContact O-CB 3.37Å; V34-Y37 PolarHBondContact O-N 2.97Å; I35-Y37 VanDerWaalsContact C-N 3.28Å; I35-Y37 PolarHBondContact O-N 3.3Å; Y37-S40 PolarHBondContact O-N 2.89Å; Y37-R41 WeakPolarHBondContact O-CB 3.45Å; Y37-R41 PolarHBondContact O-N 3.31Å |
| 38 | L | 95.7 | Very high | 92.9 | Very high | 94 Ų | 94 | 97.7 Ų | 97.7 | 49% | 0.492 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 175.3 | -86 | 94.7 | 0 | 0 | 0 | 111.6 | V34 I35 R41 Q42 | V34-L38 HydrophobicContact CG1-CD1 3.51Å; V34-L38 WeakPolarHBondContact O-CD1 3.3Å; V34-L38 PolarHBondContact O-N 2.91Å; I35-L38 PolarHBondContact O-N 2.9Å; L38-R41 WeakPolarHBondContact O-CB 3.5Å; L38-R41 PolarHBondContact O-N 3.46Å; L38-Q42 WeakPolarHBondContact O-CG 3.48Å; L38-Q42 PolarHBondContact O-N 3.32Å |
| 39 | L | 94.2 | Very high | 92.2 | Very high | 85 Ų | 85 | 97.2 Ų | 97.2 | 45% | 0.445 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.4 | -47.3 | 178.9 | -135.7 | 74.1 | 0 | 0 | 0 | 110.7 | I35 R41 Q42 I43 | I35-L39 WeakPolarHBondContact O-CB 3.5Å; I35-L39 PolarHBondContact O-N 3Å; L39-R41 VanDerWaalsContact C-N 3.3Å; L39-R41 PolarHBondContact O-N 2.88Å; L39-Q42 PolarHBondContact O-N 2.94Å; L39-Q42 VanDerWaalsContact O-N 3.16Å; L39-I43 HydrophobicContact CG-CD1 4.45Å; L39-I43 WeakPolarHBondContact O-CB 3.25Å; L39-I43 WeakPolarHBondContact O-CD1 3.29Å; L39-I43 VanDerWaalsContact O-CG1 3.23Å; L39-I43 WeakPolarHBondContact O-CG1 3.47Å; L39-I43 PolarHBondContact O-N 3.34Å |
| 40 | S | 92.6 | Very high | 91.5 | Very high | 65 Ų | 65 | 100.6 Ų | 100.6 | 46% | 0.455 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.4 | -42.5 | 176.8 | -61 | 0 | 0 | 0 | 0 | 111.2 | N36 Y37 Q42 I43 V44 | N36-S40 VanDerWaalsContact O-CB 3.23Å; N36-S40 WeakPolarHBondContact O-CB 3.36Å; N36-S40 PolarHBondContact O-N 3.12Å; N36-S40 PolarHBondContact O-OG 3.37Å; Y37-S40 PolarHBondContact O-N 2.89Å; S40-Q42 VanDerWaalsContact C-N 3.35Å; S40-Q42 PolarHBondContact O-N 3.35Å; S40-I43 PolarHBondContact O-N 3.38Å; S40-V44 VanDerWaalsContact O-CG2 3.28Å; S40-V44 WeakPolarHBondContact O-CG2 3.32Å; S40-V44 PolarHBondContact O-N 2.88Å |
| 41 | R | 92.5 | Very high | 90.9 | Very high | 178 Ų | 178 | 101.4 Ų | 101.4 | 67% | 0.672 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.1 | -41.7 | 176.6 | -174.3 | 178.7 | 179.3 | -164.1 | -0.5 | 112.1 | Y37 L38 L39 H45 | Y37-R41 WeakPolarHBondContact O-CB 3.45Å; Y37-R41 PolarHBondContact O-N 3.31Å; L38-R41 WeakPolarHBondContact O-CB 3.5Å; L38-R41 PolarHBondContact O-N 3.46Å; L39-R41 VanDerWaalsContact C-N 3.3Å; L39-R41 PolarHBondContact O-N 2.88Å; R41-H45 PolarHBondContact O-N 3.49Å; R41-H45 VanDerWaalsContact O-N 3.15Å |
| 42 | Q | 90.3 | Very high | 90.1 | Very high | 125 Ų | 125 | 102.6 Ų | 102.6 | 58% | 0.584 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67 | -43.5 | 176.2 | -73.1 | -175.7 | -14 | 0 | 0 | 111.6 | L38 L39 S40 V44 H45 Q46 | L38-Q42 WeakPolarHBondContact O-CG 3.48Å; L38-Q42 PolarHBondContact O-N 3.32Å; L39-Q42 PolarHBondContact O-N 2.94Å; L39-Q42 VanDerWaalsContact O-N 3.16Å; S40-Q42 VanDerWaalsContact C-N 3.35Å; S40-Q42 PolarHBondContact O-N 3.35Å; Q42-V44 VanDerWaalsContact C-N 3.34Å; Q42-V44 PolarHBondContact O-N 3.22Å; Q42-H45 PolarHBondContact O-N 3.29Å; Q42-Q46 WeakPolarHBondContact O-CB 3.49Å; Q42-Q46 VanDerWaalsContact O-CG 3.3Å; Q42-Q46 WeakPolarHBondContact O-CG 3.29Å; Q42-Q46 PolarHBondContact O-N 3.45Å |
| 43 | I | 90.6 | Very high | 89.2 | Confident | 101 Ų | 101 | 100.6 Ų | 100.6 | 52% | 0.518 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.7 | -41.4 | 178 | -66.9 | 162.9 | 0 | 0 | 0 | 110.7 | L39 S40 H45 Q46 S47 | L39-I43 HydrophobicContact CG-CD1 4.45Å; L39-I43 WeakPolarHBondContact O-CB 3.25Å; L39-I43 WeakPolarHBondContact O-CD1 3.29Å; L39-I43 VanDerWaalsContact O-CG1 3.23Å; L39-I43 WeakPolarHBondContact O-CG1 3.47Å; L39-I43 PolarHBondContact O-N 3.34Å; S40-I43 PolarHBondContact O-N 3.38Å; I43-H45 PolarHBondContact O-N 2.89Å; I43-Q46 PolarHBondContact O-N 3.48Å; I43-S47 WeakPolarHBondContact O-CB 3.35Å; I43-S47 PolarHBondContact O-N 2.92Å; I43-S47 PolarHBondContact O-OG 2.87Å |
| 44 | V | 90.1 | Very high | 88.1 | Confident | 81 Ų | 81 | 97.3 Ų | 97.3 | 49% | 0.491 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.3 | -48.1 | 174.1 | 169.7 | 0 | 0 | 0 | 0 | 110.5 | S40 Q42 Q46 S47 E48 | S40-V44 VanDerWaalsContact O-CG2 3.28Å; S40-V44 WeakPolarHBondContact O-CG2 3.32Å; S40-V44 PolarHBondContact O-N 2.88Å; Q42-V44 VanDerWaalsContact C-N 3.34Å; Q42-V44 PolarHBondContact O-N 3.22Å; V44-Q46 PolarHBondContact O-N 3.48Å; V44-S47 WeakPolarHBondContact CA-OG 3.3Å; V44-S47 PolarHBondContact O-OG 3.47Å; V44-E48 WeakPolarHBondContact O-CB 3.26Å; V44-E48 WeakPolarHBondContact O-CG 3.41Å; V44-E48 PolarHBondContact O-N 2.93Å |
| 45 | H | 84.8 | Confident | 86.8 | Confident | 106 Ų | 106 | 102.2 Ų | 102.2 | 49% | 0.491 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.9 | -43.4 | -180 | -174.1 | -84.6 | 0 | 0 | 0 | 112.9 | R41 Q42 I43 Q49 | R41-H45 PolarHBondContact O-N 3.49Å; R41-H45 VanDerWaalsContact O-N 3.15Å; Q42-H45 PolarHBondContact O-N 3.29Å; I43-H45 PolarHBondContact O-N 2.89Å; H45-Q49 PolarHBondContact CE1-NE2 3.43Å; H45-Q49 VanDerWaalsContact CE1-NE2 3.31Å; H45-Q49 WeakPolarHBondContact O-CG 3.45Å; H45-Q49 PolarHBondContact O-N 3.39Å |
| 46 | Q | 86.2 | Confident | 85.5 | Confident | 102 Ų | 102 | 104.9 Ų | 104.9 | 48% | 0.477 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -70.1 | -43.3 | 179.4 | -68.5 | -62.5 | -41.3 | 0 | 0 | 111.7 | Q42 I43 V44 E48 Q49 I50 | Q42-Q46 WeakPolarHBondContact O-CB 3.49Å; Q42-Q46 VanDerWaalsContact O-CG 3.3Å; Q42-Q46 WeakPolarHBondContact O-CG 3.29Å; Q42-Q46 PolarHBondContact O-N 3.45Å; I43-Q46 PolarHBondContact O-N 3.48Å; V44-Q46 PolarHBondContact O-N 3.48Å; Q46-E48 VanDerWaalsContact C-N 3.31Å; Q46-E48 PolarHBondContact O-N 3.4Å; Q46-Q49 PolarHBondContact O-N 2.76Å; Q46-Q49 VanDerWaalsContact O-N 3.16Å; Q46-I50 WeakPolarHBondContact O-CG1 3.36Å; Q46-I50 PolarHBondContact O-N 2.83Å |
| 47 | S | 80.8 | Confident | 83.8 | Confident | 60 Ų | 60 | 108.3 Ų | 108.3 | 42% | 0.42 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.5 | -36.1 | 177.5 | 64.5 | 0 | 0 | 0 | 0 | 112.3 | I43 V44 I50 L51 | I43-S47 WeakPolarHBondContact O-CB 3.35Å; I43-S47 PolarHBondContact O-N 2.92Å; I43-S47 PolarHBondContact O-OG 2.87Å; V44-S47 WeakPolarHBondContact CA-OG 3.3Å; V44-S47 PolarHBondContact O-OG 3.47Å; S47-I50 PolarHBondContact O-N 3.42Å; S47-L51 VanDerWaalsContact O-CB 3.24Å; S47-L51 WeakPolarHBondContact O-CB 3.39Å; S47-L51 PolarHBondContact O-N 3.4Å |
| 48 | E | 82.4 | Confident | 81.6 | Confident | 97 Ų | 97 | 105.5 Ų | 105.5 | 45% | 0.453 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.3 | -41.1 | 172.7 | -81.1 | -169.2 | -159.1 | 0 | 0 | 112.6 | V44 Q46 L51 K52 | V44-E48 WeakPolarHBondContact O-CB 3.26Å; V44-E48 WeakPolarHBondContact O-CG 3.41Å; V44-E48 PolarHBondContact O-N 2.93Å; Q46-E48 VanDerWaalsContact C-N 3.31Å; Q46-E48 PolarHBondContact O-N 3.4Å; E48-L51 PolarHBondContact O-N 2.93Å; E48-K52 WeakPolarHBondContact O-CB 3.39Å; E48-K52 VanDerWaalsContact O-CG 3.23Å; E48-K52 WeakPolarHBondContact O-CG 3.33Å; E48-K52 PolarHBondContact O-N 3.33Å; E48-K52 IonicContact OE2-NZ 3.48Å; E48-K52 PolarHBondContact OE2-NZ 2.99Å |
| 49 | Q | 82.3 | Confident | 79.5 | Confident | 101 Ų | 101 | 106.4 Ų | 106.4 | 47% | 0.472 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65 | -44.5 | 176.7 | -73 | -175.2 | -23.6 | 0 | 0 | 111.3 | H45 Q46 K52 A53 | H45-Q49 PolarHBondContact CE1-NE2 3.43Å; H45-Q49 VanDerWaalsContact CE1-NE2 3.31Å; H45-Q49 WeakPolarHBondContact O-CG 3.45Å; H45-Q49 PolarHBondContact O-N 3.39Å; Q46-Q49 PolarHBondContact O-N 2.76Å; Q46-Q49 VanDerWaalsContact O-N 3.16Å; Q49-K52 PolarHBondContact O-N 2.99Å; Q49-A53 WeakPolarHBondContact O-CB 3.45Å; Q49-A53 PolarHBondContact O-N 3.35Å |
| 50 | I | 84.3 | Confident | 77.4 | Confident | 116 Ų | 116 | 112.7 Ų | 112.7 | 60% | 0.595 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -64.7 | -42.4 | 177.1 | -64.3 | 165.6 | 0 | 0 | 0 | 110.8 | Q46 S47 K52 A53 A54 | Q46-I50 WeakPolarHBondContact O-CG1 3.36Å; Q46-I50 PolarHBondContact O-N 2.83Å; S47-I50 PolarHBondContact O-N 3.42Å; I50-K52 PolarHBondContact O-N 3.32Å; I50-A53 PolarHBondContact O-N 2.93Å; I50-A54 VanDerWaalsContact O-CB 3.3Å; I50-A54 WeakPolarHBondContact O-CB 3.24Å; I50-A54 PolarHBondContact O-N 3.46Å |
| 51 | L | 83.9 | Confident | 75.2 | Confident | 92 Ų | 92 | 115 Ų | 115 | 48% | 0.482 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63.9 | -40.9 | 177 | -179.1 | 66 | 0 | 0 | 0 | 111.7 | S47 E48 A54 R55 | S47-L51 VanDerWaalsContact O-CB 3.24Å; S47-L51 WeakPolarHBondContact O-CB 3.39Å; S47-L51 PolarHBondContact O-N 3.4Å; E48-L51 PolarHBondContact O-N 2.93Å; L51-A54 PolarHBondContact O-N 3.33Å; L51-R55 WeakPolarHBondContact O-CB 3.48Å; L51-R55 WeakPolarHBondContact O-CG 3.31Å; L51-R55 PolarHBondContact O-N 2.88Å |
| 52 | K | 82.1 | Confident | 72.8 | Confident | 122 Ų | 122 | 110 Ų | 110 | 53% | 0.53 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65.5 | -43.3 | 175.5 | -74.7 | 168.4 | -176.5 | 163.1 | 0 | 111.1 | E48 Q49 I50 R55 L56 | E48-K52 WeakPolarHBondContact O-CB 3.39Å; E48-K52 VanDerWaalsContact O-CG 3.23Å; E48-K52 WeakPolarHBondContact O-CG 3.33Å; E48-K52 PolarHBondContact O-N 3.33Å; E48-K52 IonicContact OE2-NZ 3.48Å; E48-K52 PolarHBondContact OE2-NZ 2.99Å; Q49-K52 PolarHBondContact O-N 2.99Å; I50-K52 PolarHBondContact O-N 3.32Å; K52-R55 PolarHBondContact O-N 3Å; K52-L56 WeakPolarHBondContact O-CG 3.22Å; K52-L56 PolarHBondContact O-N 3.28Å; K52-L56 VanDerWaalsContact O-N 3.08Å |
| 53 | A | 77.6 | Confident | 70.8 | Confident | 49 Ų | 49 | 109.9 Ų | 109.9 | 41% | 0.405 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.2 | -42.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q49 I50 R55 L56 Q57 | Q49-A53 WeakPolarHBondContact O-CB 3.45Å; Q49-A53 PolarHBondContact O-N 3.35Å; I50-A53 PolarHBondContact O-N 2.93Å; A53-R55 PolarHBondContact O-N 3.48Å; A53-L56 PolarHBondContact O-N 3.43Å; A53-Q57 PolarHBondContact O-N 2.89Å; A53-Q57 VanDerWaalsContact O-N 3.13Å |
| 54 | A | 73.6 | Confident | 68.5 | Low | 48 Ų | 48 | 110.2 Ų | 110.2 | 40% | 0.397 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -63.6 | -39.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | I50 L51 L56 Q57 V58 | I50-A54 VanDerWaalsContact O-CB 3.3Å; I50-A54 WeakPolarHBondContact O-CB 3.24Å; I50-A54 PolarHBondContact O-N 3.46Å; L51-A54 PolarHBondContact O-N 3.33Å; A54-L56 VanDerWaalsContact C-N 3.32Å; A54-L56 PolarHBondContact O-N 2.86Å; A54-Q57 PolarHBondContact O-N 2.95Å; A54-V58 PolarHBondContact O-N 2.73Å |
| 55 | R | 70.6 | Confident | 66 | Low | 182 Ų | 182 | 114 Ų | 114 | 69% | 0.687 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.2 | -30.4 | 174.8 | -77.2 | 179.6 | 179.2 | -179.2 | 1.5 | 113.6 | L51 K52 A53 | L51-R55 WeakPolarHBondContact O-CB 3.48Å; L51-R55 WeakPolarHBondContact O-CG 3.31Å; L51-R55 PolarHBondContact O-N 2.88Å; K52-R55 PolarHBondContact O-N 3Å; A53-R55 PolarHBondContact O-N 3.48Å |
| 56 | L | 70.4 | Confident | 63.6 | Low | 152 Ų | 152 | 118.7 Ų | 118.7 | 80% | 0.796 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -74.7 | -26.5 | 174.2 | -72.9 | 166.2 | 0 | 0 | 0 | 112.4 | K52 A53 A54 | K52-L56 WeakPolarHBondContact O-CG 3.22Å; K52-L56 PolarHBondContact O-N 3.28Å; K52-L56 VanDerWaalsContact O-N 3.08Å; A53-L56 PolarHBondContact O-N 3.43Å; A54-L56 VanDerWaalsContact C-N 3.32Å; A54-L56 PolarHBondContact O-N 2.86Å |
| 57 | Q | 59.3 | Low | 61.3 | Low | 166 Ų | 166 | 121.4 Ų | 121.4 | 78% | 0.776 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -82.6 | -14 | 176.2 | -73.3 | -160.6 | 84.2 | 0 | 0 | 114.3 | A53 A54 P59 | A53-Q57 PolarHBondContact O-N 2.89Å; A53-Q57 VanDerWaalsContact O-N 3.13Å; A54-Q57 PolarHBondContact O-N 2.95Å; Q57-P59 VanDerWaalsContact O-CD 3.25Å; Q57-P59 WeakPolarHBondContact O-CD 3.27Å |
| 58 | V | 50.1 | Low | 59.9 | Low | 94 Ų | 94 | 123.8 Ų | 123.8 | 57% | 0.57 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -78.2 | 115.6 | 168.3 | 178 | 0 | 0 | 0 | 0 | 107.2 | A54 R60 | A54-V58 PolarHBondContact O-N 2.73Å; V58-R60 PolarHBondContact O-N 2.76Å |
| 59 | P | 50 | Low | 58.1 | Low | 113 Ų | 113 | 124.6 Ų | 124.6 | 73% | 0.734 | 66% | 0.655 | S | S | * | * | trans | -56.3 | 112.3 | 170.2 | -20.9 | 33.6 | 0 | 0 | 0 | 107.4 | Q57 P61 | Q57-P59 VanDerWaalsContact O-CD 3.25Å; Q57-P59 WeakPolarHBondContact O-CD 3.27Å; P59-P61 WeakPolarHBondContact O-CD 3.44Å; P59-P61 VanDerWaalsContact O-N 3.16Å | ||
| 60 | R | 51.7 | Low | 55.8 | Low | 217 Ų | 217 | 124.4 Ų | 124.4 | 82% | 0.819 | 67% | 0.671 | S | S | * | * | trans | -53.3 | 123.6 | 171.9 | -176.6 | -176.1 | 178.1 | 104.7 | -0.9 | 106.3 | V58 S62 | V58-R60 PolarHBondContact O-N 2.76Å; R60-S62 PolarHBondContact O-N 2.75Å | ||
| 61 | P | 46.3 | Very low | 53.4 | Low | 112 Ų | 112 | 123.3 Ų | 123.3 | 73% | 0.727 | 68% | 0.679 | S | S | * | * | trans | -59.5 | 113.1 | 171.5 | 21.9 | -28 | 0 | 0 | 0 | 106.8 | P59 | P59-P61 WeakPolarHBondContact O-CD 3.44Å; P59-P61 VanDerWaalsContact O-N 3.16Å | ||
| 62 | S | 42.6 | Very low | 51.5 | Low | 75 Ų | 75 | 129 Ų | 129 | 52% | 0.524 | 70% | 0.7 | S | S | . | * | trans | -53 | 129.1 | 171.5 | -172.7 | 0 | 0 | 0 | 0 | 107.7 | R60 D64 | R60-S62 PolarHBondContact O-N 2.75Å; S62-D64 WeakPolarHBondContact CB-OD2 3.32Å; S62-D64 PolarHBondContact O-N 2.94Å; S62-D64 PolarHBondContact OG-OD2 3.26Å | ||
| 63 | P | 48.3 | Very low | 49.3 | Very low | 121 Ų | 121 | 131.7 Ų | 131.7 | 79% | 0.786 | 72% | 0.715 | S | S | * | * | trans | -75 | 75 | 172.3 | 30.2 | -30.3 | 0 | 0 | 0 | 108.3 | H65 | P63-H65 PolarHBondContact O-N 3.34Š| ||
| 64 | D | 40.3 | Very low | 47.2 | Very low | 109 Ų | 109 | 138.6 Ų | 138.6 | 58% | 0.583 | 74% | 0.741 | S | S | * | * | trans | -84.1 | 112.4 | 175.6 | -85.4 | -50.3 | 0 | 0 | 0 | 111.1 | S62 | S62-D64 WeakPolarHBondContact CB-OD2 3.32Å; S62-D64 PolarHBondContact O-N 2.94Å; S62-D64 PolarHBondContact OG-OD2 3.26Å | ||
| 65 | H | 39.1 | Very low | 45.5 | Very low | 160 Ų | 160 | 144.9 Ų | 144.9 | 74% | 0.741 | 76% | 0.759 | S | S | * | * | trans | 70.3 | 80.9 | 136.8 | -68.3 | 48.6 | 0 | 0 | 0 | 117 | P63 H67 | P63-H65 PolarHBondContact O-N 3.34Å; H65-H67 PolarHBondContact O-N 3.2Å | ||
| 66 | H | 34.4 | Very low | 43.8 | Very low | 205 Ų | 205 | 144.5 Ų | 144.5 | 95% | 0.949 | 77% | 0.765 | S | S | * | * | trans | -72.3 | 102.7 | 149.7 | -76.4 | -65.7 | 0 | 0 | 0 | 109.7 | ||||
| 67 | H | 36.7 | Very low | 42 | Very low | 159 Ų | 159 | 142.7 Ų | 142.7 | 74% | 0.736 | 76% | 0.761 | S | S | * | * | trans | -100.2 | 129.4 | 163.4 | -159.3 | -57.1 | 0 | 0 | 0 | 108.4 | H65 | H65-H67 PolarHBondContact O-N 3.2Š| ||
| 68 | P | 51.9 | Low | 40.5 | Very low | 110 Ų | 110 | 143.1 Ų | 143.1 | 71% | 0.714 | 76% | 0.762 | S | S | * | * | trans | -101.4 | 143.7 | 157.6 | 33.5 | -24.3 | 0 | 0 | 0 | 109.5 | ||||
| 69 | P | 44.1 | Very low | 39.6 | Very low | 114 Ų | 114 | 144.3 Ų | 144.3 | 74% | 0.74 | 77% | 0.77 | S | S | * | * | -139 | 125.2 | 129.9 | 27.1 | -8.6 | 0 | 0 | 0 | 113.4 | |||||
| 70 | A | 33.8 | Very low | 38.7 | Very low | 97 Ų | 97 | 146 Ų | 146 | 80% | 0.802 | 77% | 0.768 | S | S | * | * | trans | 13.2 | 139 | 146.6 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 71 | A | 35.7 | Very low | 37.8 | Very low | 93 Ų | 93 | 145 Ų | 145 | 77% | 0.769 | 77% | 0.765 | S | S | * | * | trans | 90.5 | 110 | 136.6 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 72 | K | 42.5 | Very low | 37.2 | Very low | 212 Ų | 212 | 146.3 Ų | 146.3 | 92% | 0.922 | 77% | 0.766 | S | S | * | * | -161.4 | 136.2 | 111.5 | -101 | 166.9 | -170.7 | -172.1 | 0 | 112.3 | |||||
| 73 | E | 37 | Very low | 36.8 | Very low | 178 Ų | 178 | 149.4 Ų | 149.4 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | trans | -50.2 | 142.5 | 178.1 | -68.5 | 166.6 | 91 | 0 | 0 | 114.3 | ||||
| 74 | M | 32.5 | Very low | 36.8 | Very low | 193 Ų | 193 | 148.8 Ų | 148.8 | 95% | 0.951 | 78% | 0.777 | S | S | * | * | -153.3 | 137 | 125.7 | -150.3 | 151.1 | 167.5 | 0 | 0 | 110.8 | |||||
| 75 | K | 38.6 | Very low | 36.4 | Very low | 181 Ų | 181 | 153 Ų | 153 | 79% | 0.787 | 80% | 0.796 | S | S | * | * | trans | -61.2 | 143.5 | -174.5 | -58 | 167.9 | 175.4 | -175 | 0 | 112.6 | ||||
| 76 | E | 35 | Very low | 36.2 | Very low | 173 Ų | 173 | 151 Ų | 151 | 81% | 0.808 | 80% | 0.799 | S | S | * | * | 173.5 | 136 | 112.5 | -104.6 | -175.1 | 138.6 | 0 | 0 | 113.7 | |||||
| 77 | T | 31.3 | Very low | 36.4 | Very low | 115 Ų | 115 | 148.7 Ų | 148.7 | 71% | 0.706 | 79% | 0.794 | S | S | * | * | trans | 52.2 | 117 | 148.4 | 55.1 | 0 | 0 | 0 | 0 | 122 | ||||
| 78 | Q | 29.6 | Very low | 37.1 | Very low | 174 Ų | 174 | 145.5 Ų | 145.5 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | 104 | 105.7 | 124.8 | -157.6 | 167.6 | 5.7 | 0 | 0 | 118.4 | |||||
| 79 | T | 30.6 | Very low | 36.5 | Very low | 120 Ų | 120 | 147.4 Ų | 147.4 | 74% | 0.736 | 79% | 0.791 | S | S | * | * | trans | 49.8 | 109.8 | 133.1 | -46.7 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 80 | E | 30.9 | Very low | 36 | Very low | 147 Ų | 147 | 152.6 Ų | 152.6 | 69% | 0.687 | 80% | 0.797 | S | S | * | * | 160.8 | 127.5 | 107.5 | -164.4 | 166.8 | 140.3 | 0 | 0 | 111.5 | |||||
| 81 | R | 33 | Very low | 36 | Very low | 197 Ų | 197 | 158.9 Ų | 158.9 | 74% | 0.743 | 80% | 0.8 | S | S | * | * | trans | 62.6 | 113.6 | 155.7 | -83.4 | -175 | 166.2 | 126.3 | -7.7 | 123 | ||||
| 82 | D | 32.4 | Very low | 36.2 | Very low | 140 Ų | 140 | 161.8 Ų | 161.8 | 75% | 0.749 | 80% | 0.803 | S | S | * | * | 93.1 | 123.3 | 126.5 | -59.4 | -29.8 | 0 | 0 | 0 | 120.4 | |||||
| 83 | V | 34.8 | Very low | 36.3 | Very low | 140 Ų | 140 | 154.6 Ų | 154.6 | 85% | 0.848 | 79% | 0.788 | S | S | * | * | trans | -84.9 | 154.3 | -173.8 | 162.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 84 | P | 49.1 | Very low | 36.6 | Very low | 108 Ų | 108 | 151.4 Ų | 151.4 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -98.2 | 162.5 | -167.8 | 37.9 | -29 | 0 | 0 | 0 | 112.8 | ||||
| 85 | M | 31.1 | Very low | 37.4 | Very low | 198 Ų | 198 | 150.2 Ų | 150.2 | 98% | 0.975 | 78% | 0.784 | S | S | * | * | trans | -166 | 138.2 | 153.8 | -114.7 | 157.2 | -176.9 | 0 | 0 | 114.2 | ||||
| 86 | S | 35.8 | Very low | 37.5 | Very low | 116 Ų | 116 | 147.9 Ų | 147.9 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | trans | -78.4 | 146.6 | -176.6 | -39.2 | 0 | 0 | 0 | 0 | 114 | ||||
| 87 | D | 37.2 | Very low | 38.2 | Very low | 157 Ų | 157 | 144.7 Ų | 144.7 | 84% | 0.84 | 78% | 0.782 | S | S | * | * | trans | 36.4 | 168.1 | 137.9 | -108.2 | -6.8 | 0 | 0 | 0 | 122 | ||||
| 88 | P | 52 | Low | 39 | Very low | 92 Ų | 92 | 144.7 Ų | 144.7 | 60% | 0.597 | 79% | 0.786 | S | S | * | * | cis | -145.7 | -166.5 | -2.8 | 31.7 | -5.2 | 0 | 0 | 0 | 115.6 | ||||
| 89 | L | 40.1 | Very low | 39.7 | Very low | 151 Ų | 151 | 144.1 Ų | 144.1 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | trans | 79.4 | 109 | 150.8 | -73.6 | 157.1 | 0 | 0 | 0 | 120.6 | ||||
| 90 | Y | 32.7 | Very low | 40.6 | Very low | 223 Ų | 223 | 143 Ų | 143 | 88% | 0.875 | 79% | 0.786 | S | S | * | * | -174.8 | 150.9 | 106.3 | -127.7 | -103 | 0 | 0 | 0 | 113.6 | |||||
| 91 | R | 34.8 | Very low | 41.5 | Very low | 229 Ų | 229 | 141.8 Ų | 141.8 | 86% | 0.864 | 79% | 0.793 | S | S | * | * | trans | 104.1 | 79.7 | 158.3 | -139.9 | 169.1 | -158.7 | 176.8 | 3.7 | 115.6 | ||||
| 92 | N | 39.9 | Very low | 42.5 | Very low | 154 Ų | 154 | 140 Ų | 140 | 82% | 0.824 | 80% | 0.798 | S | S | * | * | 65.6 | 103.8 | 86.7 | -159.3 | 72.4 | 0 | 0 | 0 | 110.3 | |||||
| 93 | G | 43.1 | Very low | 43.4 | Very low | 60 Ų | 60 | 138.9 Ų | 138.9 | 62% | 0.619 | 80% | 0.802 | S | S | * | * | cis | 109.6 | 103.2 | 38.1 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 94 | S | 44.6 | Very low | 44 | Very low | 112 Ų | 112 | 137.6 Ų | 137.6 | 78% | 0.783 | 80% | 0.799 | S | S | * | * | trans | -165.6 | 84.8 | 165.6 | -77.9 | 0 | 0 | 0 | 0 | 110 | ||||
| 95 | D | 49.1 | Very low | 43.8 | Very low | 168 Ų | 168 | 138.2 Ų | 138.2 | 90% | 0.898 | 80% | 0.804 | S | S | * | * | trans | -84.4 | 116.4 | 147.9 | -72.3 | -47.5 | 0 | 0 | 0 | 107 | ||||
| 96 | T | 40.6 | Very low | 44.9 | Very low | 131 Ų | 131 | 134.8 Ų | 134.8 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | -140 | 117.6 | 161.7 | 46 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 97 | S | 49.4 | Very low | 45.8 | Very low | 107 Ų | 107 | 133.8 Ų | 133.8 | 75% | 0.748 | 79% | 0.793 | S | S | * | * | trans | -62.2 | 149 | 173.1 | 58 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 98 | S | 48.1 | Very low | 46.3 | Very low | 114 Ų | 114 | 131.7 Ų | 131.7 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | 38.4 | 119.2 | 142.4 | -55.4 | 0 | 0 | 0 | 0 | 120 | ||||
| 99 | D | 43.7 | Very low | 46.1 | Very low | 162 Ų | 162 | 133.1 Ų | 133.1 | 87% | 0.866 | 80% | 0.798 | S | S | * | * | -146.4 | 133.7 | 127.5 | -128.8 | -13.8 | 0 | 0 | 0 | 111.5 | |||||
| 100 | S | 50.8 | Low | 46.3 | Very low | 98 Ų | 98 | 130.5 Ų | 130.5 | 69% | 0.685 | 80% | 0.797 | S | S | * | * | trans | -72.9 | 146.1 | 176.1 | 48.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 101 | S | 49.4 | Very low | 47 | Very low | 120 Ų | 120 | 126 Ų | 126 | 84% | 0.839 | 80% | 0.797 | S | S | * | * | trans | -172 | 142 | 132.5 | -82.8 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 102 | D | 54.3 | Low | 47.9 | Very low | 159 Ų | 159 | 123.8 Ų | 123.8 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | trans | -63.7 | 147.4 | -171.8 | -62.3 | -61.6 | 0 | 0 | 0 | 115.2 | ||||
| 103 | S | 50.9 | Low | 48.6 | Very low | 117 Ų | 117 | 123.9 Ų | 123.9 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -158.3 | 93.8 | 135.3 | 48.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 104 | S | 47.1 | Very low | 49 | Very low | 114 Ų | 114 | 127.5 Ų | 127.5 | 80% | 0.797 | 81% | 0.807 | S | S | * | * | trans | 51.6 | 91.6 | 143.1 | -60.6 | 0 | 0 | 0 | 0 | 119.8 | S106 | S104-S106 PolarHBondContact O-N 3.18Š| ||
| 105 | C | 45.6 | Very low | 49.8 | Very low | 120 Ų | 120 | 130.1 Ų | 130.1 | 81% | 0.811 | 81% | 0.807 | S | S | * | * | trans | -57.1 | 123.3 | 149.9 | -61.4 | 0 | 0 | 0 | 0 | 110.6 | S107 | C105-S107 VanDerWaalsContact C-N 3.34Å; C105-S107 PolarHBondContact O-N 3.35Å; C105-S107 VanDerWaalsContact O-N 3.11Å | ||
| 106 | S | 53.3 | Low | 50.3 | Low | 126 Ų | 126 | 129.9 Ų | 129.9 | 88% | 0.881 | 81% | 0.806 | S | S | * | * | trans | -79.2 | 86.9 | 164.9 | -62.9 | 0 | 0 | 0 | 0 | 108.6 | S104 | S104-S106 PolarHBondContact O-N 3.18Š| ||
| 107 | S | 54.5 | Low | 51.6 | Low | 96 Ų | 96 | 127.4 Ų | 127.4 | 67% | 0.671 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 140 | 171.1 | -61.9 | 0 | 0 | 0 | 0 | 110.2 | C105 | C105-S107 VanDerWaalsContact C-N 3.34Å; C105-S107 PolarHBondContact O-N 3.35Å; C105-S107 VanDerWaalsContact O-N 3.11Å |
| 108 | P | 47.9 | Very low | 52.6 | Low | 113 Ų | 113 | 128.2 Ų | 128.2 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 153.6 | 171.5 | 29.8 | -31.3 | 0 | 0 | 0 | 109.9 | ||
| 109 | P | 47.4 | Very low | 53.2 | Low | 122 Ų | 122 | 132.5 Ų | 132.5 | 79% | 0.792 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 145.4 | -171.2 | 27.2 | -33.2 | 0 | 0 | 0 | 111.3 | C111 | P109-C111 PolarHBondContact O-N 3.44Š|
| 110 | A | 45.5 | Very low | 54.3 | Low | 95 Ų | 95 | 129 Ų | 129 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -46.1 | 116.8 | -179 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q112 | A110-Q112 PolarHBondContact O-N 3.05Š|
| 111 | C | 46.7 | Very low | 54.9 | Low | 129 Ų | 129 | 131.7 Ų | 131.7 | 87% | 0.872 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 127.6 | 158.2 | -73.7 | 0 | 0 | 0 | 0 | 107.9 | P109 | P109-C111 PolarHBondContact O-N 3.44Š|
| 112 | Q | 54.7 | Low | 55.6 | Low | 183 Ų | 183 | 132 Ų | 132 | 86% | 0.855 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 149.9 | -179.5 | -60.7 | -163.8 | -40.3 | 0 | 0 | 112 | A110 | A110-Q112 PolarHBondContact O-N 3.05Š|
| 113 | D | 53.5 | Low | 56.2 | Low | 156 Ų | 156 | 131 Ų | 131 | 83% | 0.834 | 76% | 0.763 | S | S | * | * | trans | 26.1 | 89.3 | 163.8 | -86.7 | -22.5 | 0 | 0 | 0 | 116.2 | E115 | D113-E115 PolarHBondContact O-N 3.03Š| ||
| 114 | T | 52.6 | Low | 56.8 | Low | 135 Ų | 135 | 134 Ų | 134 | 83% | 0.828 | 76% | 0.761 | S | S | * | * | trans | -75.5 | 99.2 | 147.7 | 53.5 | 0 | 0 | 0 | 0 | 106.7 | D116 | T114-D116 PolarHBondContact O-N 3.19Å; T114-D116 VanDerWaalsContact O-N 3.15Å | ||
| 115 | E | 61.4 | Low | 57.6 | Low | 167 Ų | 167 | 134 Ų | 134 | 78% | 0.78 | 76% | 0.761 | S | S | * | * | trans | -49.5 | 122.1 | 157.1 | -67.4 | -175.8 | 165 | 0 | 0 | 107 | D113 V117 | D113-E115 PolarHBondContact O-N 3.03Å; E115-V117 VanDerWaalsContact C-N 3.33Å; E115-V117 WeakPolarHBondContact O-CG2 3.43Å; E115-V117 PolarHBondContact O-N 3.38Å | ||
| 116 | D | 59.8 | Low | 58.5 | Low | 163 Ų | 163 | 132.4 Ų | 132.4 | 87% | 0.872 | 76% | 0.757 | S | S | * | * | trans | -69.1 | 92.5 | 178.8 | -175.6 | 36.3 | 0 | 0 | 0 | 108 | T114 D118 | T114-D116 PolarHBondContact O-N 3.19Å; T114-D116 VanDerWaalsContact O-N 3.15Å; D116-D118 PolarHBondContact O-N 3.03Å | ||
| 117 | V | 68 | Low | 58.7 | Low | 80 Ų | 80 | 132.5 Ų | 132.5 | 49% | 0.485 | 75% | 0.754 | S | S | . | * | trans | -80.5 | 106.8 | 178.9 | -172 | 0 | 0 | 0 | 0 | 107.9 | E115 Y119 | E115-V117 VanDerWaalsContact C-N 3.33Å; E115-V117 WeakPolarHBondContact O-CG2 3.43Å; E115-V117 PolarHBondContact O-N 3.38Å; V117-Y119 HydrophobicContact CB-CD2 4.41Å; V117-Y119 HydrophobicContact CB-CE2 3.86Å; V117-Y119 HydrophobicContact CG1-CD2 4.43Å; V117-Y119 HydrophobicContact CG1-CE1 4.16Å; V117-Y119 HydrophobicContact CG1-CE2 4.07Å; V117-Y119 WeakPolarHBondContact O-CD2 3.47Å; V117-Y119 WeakPolarHBondContact O-CE2 3.45Å; V117-Y119 PolarHBondContact O-N 3.1Å; V117-Y119 VanDerWaalsContact O-N 3.08Å | ||
| 118 | D | 69.1 | Low | 58.4 | Low | 124 Ų | 124 | 136.9 Ų | 136.9 | 66% | 0.663 | 76% | 0.764 | S | S | * | * | trans | -69.4 | 100.9 | 171.8 | -175.3 | 8.1 | 0 | 0 | 0 | 109.8 | D116 T120 | D116-D118 PolarHBondContact O-N 3.03Å; D118-T120 PolarHBondContact O-N 3.28Å; D118-T120 WeakPolarHBondContact OD1-CB 3.31Å; D118-T120 PolarHBondContact OD1-N 3.04Å; D118-T120 PolarHBondContact OD1-OG1 2.82Å | ||
| 119 | Y | 60.5 | Low | 58.6 | Low | 203 Ų | 203 | 139.5 Ų | 139.5 | 80% | 0.796 | 77% | 0.767 | S | S | * | * | trans | -78 | 35.2 | 177.4 | -69.9 | -81.7 | 0 | 0 | 0 | 113.1 | V117 Q121 | V117-Y119 HydrophobicContact CB-CD2 4.41Å; V117-Y119 HydrophobicContact CB-CE2 3.86Å; V117-Y119 HydrophobicContact CG1-CD2 4.43Å; V117-Y119 HydrophobicContact CG1-CE1 4.16Å; V117-Y119 HydrophobicContact CG1-CE2 4.07Å; V117-Y119 WeakPolarHBondContact O-CD2 3.47Å; V117-Y119 WeakPolarHBondContact O-CE2 3.45Å; V117-Y119 PolarHBondContact O-N 3.1Å; V117-Y119 VanDerWaalsContact O-N 3.08Å; Y119-Q121 PolarHBondContact O-N 3.31Å; Y119-Q121 VanDerWaalsContact O-N 3.12Å | ||
| 120 | T | 67.1 | Low | 58.6 | Low | 89 Ų | 89 | 141.6 Ų | 141.6 | 55% | 0.546 | 77% | 0.77 | S | S | . | * | trans | -82 | 98.7 | 177.9 | -56 | 0 | 0 | 0 | 0 | 110.8 | D118 | D118-T120 PolarHBondContact O-N 3.28Å; D118-T120 WeakPolarHBondContact OD1-CB 3.31Å; D118-T120 PolarHBondContact OD1-N 3.04Å; D118-T120 PolarHBondContact OD1-OG1 2.82Å | ||
| 121 | Q | 64.5 | Low | 59 | Low | 155 Ų | 155 | 144.3 Ų | 144.3 | 72% | 0.724 | 77% | 0.765 | S | S | * | * | trans | 60.1 | 97.5 | 153 | -59.7 | -178.6 | 60.5 | 0 | 0 | 118 | Y119 I123 | Y119-Q121 PolarHBondContact O-N 3.31Å; Y119-Q121 VanDerWaalsContact O-N 3.12Å; Q121-I123 PolarHBondContact O-N 3.42Å | ||
| 122 | V | 62.4 | Low | 59.5 | Low | 125 Ų | 125 | 145 Ų | 145 | 76% | 0.758 | 76% | 0.76 | S | S | * | * | trans | -74.2 | 99.7 | 153.4 | -85.9 | 0 | 0 | 0 | 0 | 109.3 | F124 | V122-F124 HydrophobicContact CB-CE2 4.43Å; V122-F124 HydrophobicContact CG2-CE2 4.2Å; V122-F124 PolarHBondContact O-N 3.36Å | ||
| 123 | I | 67.4 | Low | 59.4 | Low | 140 Ų | 140 | 144.3 Ų | 144.3 | 72% | 0.718 | 76% | 0.762 | S | S | * | * | trans | -79.2 | 112.8 | 169.3 | -61.8 | 170.7 | 0 | 0 | 0 | 107.2 | Q121 | Q121-I123 PolarHBondContact O-N 3.42Š| ||
| 124 | F | 62.8 | Low | 59.6 | Low | 179 Ų | 179 | 142.1 Ų | 142.1 | 79% | 0.785 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 121.8 | 169.3 | -66.4 | -82.6 | 0 | 0 | 0 | 108.9 | V122 A126 | V122-F124 HydrophobicContact CB-CE2 4.43Å; V122-F124 HydrophobicContact CG2-CE2 4.2Å; V122-F124 PolarHBondContact O-N 3.36Å; F124-A126 PolarHBondContact O-N 3.41Å |
| 125 | S | 64.8 | Low | 59.8 | Low | 114 Ų | 114 | 139.1 Ų | 139.1 | 80% | 0.797 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 130.4 | 167.6 | -58.3 | 0 | 0 | 0 | 0 | 109.4 | ||
| 126 | A | 65.4 | Low | 59.6 | Low | 87 Ų | 87 | 138.3 Ų | 138.3 | 72% | 0.719 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 140.3 | 170.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | F124 E128 | F124-A126 PolarHBondContact O-N 3.41Å; A126-E128 PolarHBondContact O-N 2.74Å |
| 127 | P | 56.4 | Low | 59.4 | Low | 127 Ų | 127 | 137.2 Ų | 137.2 | 83% | 0.825 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 127.9 | 176.1 | -19.1 | 30.4 | 0 | 0 | 0 | 109.7 | E129 | P127-E129 PolarHBondContact O-N 3.1Š|
| 128 | E | 48.6 | Very low | 59 | Low | 189 Ų | 189 | 143.9 Ų | 143.9 | 88% | 0.883 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 132.3 | 171.2 | -168.7 | 172.9 | -177.8 | 0 | 0 | 109.6 | A126 L130 | A126-E128 PolarHBondContact O-N 2.74Å; E128-L130 VanDerWaalsContact C-N 3.35Å; E128-L130 PolarHBondContact O-N 3.4Å |
| 129 | E | 53.1 | Low | 58.7 | Low | 167 Ų | 167 | 147 Ų | 147 | 78% | 0.78 | 77% | 0.771 | S | S | * | * | trans | -56.8 | 87 | -173.8 | -172.8 | -171.6 | 154.8 | 0 | 0 | 111.7 | P127 | P127-E129 PolarHBondContact O-N 3.1Š| ||
| 130 | L | 46.5 | Very low | 58.5 | Low | 167 Ų | 167 | 143 Ų | 143 | 87% | 0.874 | 76% | 0.763 | S | S | * | * | trans | -90.9 | 115.6 | 167.1 | -144.5 | 152.4 | 0 | 0 | 0 | 108.3 | E128 N132 | E128-L130 VanDerWaalsContact C-N 3.35Å; E128-L130 PolarHBondContact O-N 3.4Å; L130-N132 PolarHBondContact O-N 3.15Å | ||
| 131 | K | 54.7 | Low | 58.2 | Low | 152 Ų | 152 | 146.6 Ų | 146.6 | 66% | 0.661 | 78% | 0.777 | S | S | * | * | trans | -64.5 | 130.2 | -169.8 | -56.4 | -170.2 | 173.7 | -170.9 | 0 | 111 | ||||
| 132 | N | 56.8 | Low | 57.9 | Low | 144 Ų | 144 | 146.9 Ų | 146.9 | 77% | 0.77 | 78% | 0.776 | S | S | * | * | trans | 61 | 91.7 | 162.8 | -45.9 | -55.5 | 0 | 0 | 0 | 114.9 | L130 | L130-N132 PolarHBondContact O-N 3.15Š| ||
| 133 | D | 51.8 | Low | 57.8 | Low | 167 Ų | 167 | 149.4 Ų | 149.4 | 89% | 0.893 | 78% | 0.779 | S | S | * | * | trans | -143.1 | 124.8 | 133.1 | -83.9 | -40.2 | 0 | 0 | 0 | 107.8 | A135 | D133-A135 PolarHBondContact O-N 3.46Š| ||
| 134 | S | 58.7 | Low | 57.4 | Low | 111 Ų | 111 | 149.7 Ų | 149.7 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | trans | -47.7 | 123.2 | -171.9 | -170.4 | 0 | 0 | 0 | 0 | 111.6 | L136 | S134-L136 PolarHBondContact O-N 3.4Š| ||
| 135 | A | 55.5 | Low | 57 | Low | 71 Ų | 71 | 147 Ų | 147 | 59% | 0.587 | 78% | 0.779 | S | S | * | * | trans | -54.2 | 114.4 | 157.3 | 0 | 0 | 0 | 0 | 0 | 106.8 | D133 D137 | D133-A135 PolarHBondContact O-N 3.46Å; A135-D137 PolarHBondContact O-N 2.8Å | ||
| 136 | L | 58.3 | Low | 56.7 | Low | 151 Ų | 151 | 148.4 Ų | 148.4 | 79% | 0.791 | 78% | 0.778 | S | S | * | * | trans | -70.9 | 88.2 | 161.9 | -91.4 | 161.8 | 0 | 0 | 0 | 105.1 | S134 Y138 | S134-L136 PolarHBondContact O-N 3.4Å; L136-Y138 VanDerWaalsContact C-N 3.29Å; L136-Y138 PolarHBondContact O-N 2.96Å | ||
| 137 | D | 55.8 | Low | 56.3 | Low | 139 Ų | 139 | 154.5 Ų | 154.5 | 74% | 0.743 | 78% | 0.784 | S | S | * | * | trans | -54.5 | 96.7 | 170.7 | -73.3 | -29.6 | 0 | 0 | 0 | 108 | A135 E139 | A135-D137 PolarHBondContact O-N 2.8Å; D137-E139 PolarHBondContact O-N 3.43Å | ||
| 138 | Y | 59.5 | Low | 56.7 | Low | 220 Ų | 220 | 154 Ų | 154 | 86% | 0.863 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | 40.1 | -173 | -130.5 | -84.1 | 0 | 0 | 0 | 111.5 | L136 | L136-Y138 VanDerWaalsContact C-N 3.29Å; L136-Y138 PolarHBondContact O-N 2.96Å |
| 139 | E | 62.6 | Low | 57.4 | Low | 191 Ų | 191 | 151.6 Ų | 151.6 | 89% | 0.893 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.7 | 7.8 | -172.3 | -130.4 | 179.9 | -160.9 | 0 | 0 | 114.2 | D137 | D137-E139 PolarHBondContact O-N 3.43Š|
| 140 | N | 56.9 | Low | 57.8 | Low | 119 Ų | 119 | 148.7 Ų | 148.7 | 64% | 0.636 | 77% | 0.765 | S | S | * | * | trans | -148.4 | 54.9 | 177.8 | -157.1 | -3.5 | 0 | 0 | 0 | 114 | K142 | N140-K142 PolarHBondContact O-N 2.99Å; N140-K142 WeakPolarHBondContact OD1-CG 3.41Å | ||
| 141 | I | 58.8 | Low | 58.2 | Low | 164 Ų | 164 | 145 Ų | 145 | 84% | 0.841 | 75% | 0.746 | S | S | * | * | trans | -76.7 | 101 | 144.4 | 47.4 | 163.8 | 0 | 0 | 0 | 106.2 | E143 | I141-E143 PolarHBondContact O-N 3.36Š| ||
| 142 | K | 58.8 | Low | 58.1 | Low | 160 Ų | 160 | 143.8 Ų | 143.8 | 70% | 0.696 | 75% | 0.754 | S | S | * | * | trans | -50 | 115.7 | 167 | -67.5 | -171.8 | 178.4 | -137.8 | 0 | 107.3 | N140 I144 | N140-K142 PolarHBondContact O-N 2.99Å; N140-K142 WeakPolarHBondContact OD1-CG 3.41Å; K142-I144 HydrophobicContact CB-CG1 4.48Å; K142-I144 PolarHBondContact O-N 3.37Å | ||
| 143 | E | 60 | Low | 58.1 | Low | 179 Ų | 179 | 145.4 Ų | 145.4 | 84% | 0.836 | 76% | 0.756 | S | S | * | * | trans | -50.9 | 85.6 | 168.2 | -176.4 | -179.5 | -161.7 | 0 | 0 | 108.9 | I141 | I141-E143 PolarHBondContact O-N 3.36Š| ||
| 144 | I | 58.9 | Low | 58.7 | Low | 145 Ų | 145 | 140.8 Ų | 140.8 | 74% | 0.744 | 74% | 0.738 | S | S | * | * | trans | -112.9 | 69.3 | 165.1 | -60.1 | 174 | 0 | 0 | 0 | 105.1 | K142 | K142-I144 HydrophobicContact CB-CG1 4.48Å; K142-I144 PolarHBondContact O-N 3.37Å | ||
| 145 | T | 55.2 | Low | 58.4 | Low | 124 Ų | 124 | 143.4 Ų | 143.4 | 76% | 0.761 | 74% | 0.737 | S | S | * | * | trans | -150.7 | 72.4 | 145.8 | 16.6 | 0 | 0 | 0 | 0 | 105.2 | Y147 | T145-Y147 PolarHBondContact O-N 3.33Š| ||
| 146 | D | 58.4 | Low | 58.8 | Low | 143 Ų | 143 | 148.8 Ų | 148.8 | 77% | 0.765 | 75% | 0.747 | S | S | * | * | trans | -37.2 | 128.5 | 154 | -174.1 | 9.8 | 0 | 0 | 0 | 108.3 | V148 | D146-V148 VanDerWaalsContact C-N 3.32Å; D146-V148 PolarHBondContact O-N 3.08Å | ||
| 147 | Y | 58 | Low | 58.9 | Low | 214 Ų | 214 | 145.4 Ų | 145.4 | 84% | 0.839 | 74% | 0.735 | S | S | * | * | trans | -62.5 | 89.5 | -167.3 | -154.1 | -92.1 | 0 | 0 | 0 | 109.1 | T145 N149 | T145-Y147 PolarHBondContact O-N 3.33Å; Y147-N149 PolarHBondContact O-N 3.1Å | ||
| 148 | V | 64.9 | Low | 59 | Low | 118 Ų | 118 | 145.7 Ų | 145.7 | 72% | 0.715 | 74% | 0.736 | S | S | * | * | trans | -69.5 | 104.2 | 174.9 | 178.7 | 0 | 0 | 0 | 0 | 106.4 | D146 V150 | D146-V148 VanDerWaalsContact C-N 3.32Å; D146-V148 PolarHBondContact O-N 3.08Å; V148-V150 PolarHBondContact O-N 2.94Å | ||
| 149 | N | 63.1 | Low | 58.9 | Low | 137 Ų | 137 | 143.5 Ų | 143.5 | 73% | 0.733 | 73% | 0.731 | S | S | * | * | trans | -55.8 | 89.9 | 164.4 | -178.2 | 75 | 0 | 0 | 0 | 108.1 | Y147 N151 | Y147-N149 PolarHBondContact O-N 3.1Å; N149-N151 PolarHBondContact O-N 3.02Å | ||
| 150 | V | 61.6 | Low | 58.5 | Low | 107 Ų | 107 | 145.8 Ų | 145.8 | 65% | 0.648 | 73% | 0.732 | S | S | * | * | trans | -62.4 | 107.1 | 174.3 | -83.8 | 0 | 0 | 0 | 0 | 107.5 | V148 P152 | V148-V150 PolarHBondContact O-N 2.94Å; V150-P152 WeakPolarHBondContact O-CD 3.21Å | ||
| 151 | N | 54 | Low | 58.4 | Low | 90 Ų | 90 | 150.6 Ų | 150.6 | 48% | 0.481 | 74% | 0.743 | S | S | . | * | trans | -59.1 | 122.1 | 166.5 | -175.1 | 17 | 0 | 0 | 0 | 107.3 | N149 E153 S154 | N149-N151 PolarHBondContact O-N 3.02Å; N151-E153 PolarHBondContact O-N 3.28Å; N151-S154 PolarHBondContact O-N 3.13Å | ||
| 152 | P | 53.7 | Low | 58.2 | Low | 126 Ų | 126 | 152.1 Ų | 152.1 | 82% | 0.818 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -8.5 | -175.6 | 22.9 | -34.3 | 0 | 0 | 0 | 114.4 | V150 | V150-P152 WeakPolarHBondContact O-CD 3.21Š|
| 153 | E | 56.4 | Low | 58.1 | Low | 177 Ų | 177 | 150.8 Ų | 150.8 | 83% | 0.827 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -7 | -179 | -69 | -159 | 151.1 | 0 | 0 | 115.6 | N151 | N151-E153 PolarHBondContact O-N 3.28Š|
| 154 | S | 62.7 | Low | 58 | Low | 71 Ų | 71 | 147.3 Ų | 147.3 | 50% | 0.497 | 74% | 0.735 | S | S | . | * | S | Bend | trans | -132.9 | 101.4 | 173.9 | 62.9 | 0 | 0 | 0 | 0 | 109.3 | N151 | N151-S154 PolarHBondContact O-N 3.13Š|
| 155 | H | 54.3 | Low | 57.9 | Low | 165 Ų | 165 | 145.5 Ų | 145.5 | 76% | 0.764 | 73% | 0.733 | S | S | * | * | trans | -179.6 | 119.4 | 131.9 | -93.7 | -68.6 | 0 | 0 | 0 | 108.3 | P157 | H155-P157 WeakPolarHBondContact O-CD 3.47Š| ||
| 156 | K | 62.4 | Low | 58 | Low | 184 Ų | 184 | 143.5 Ų | 143.5 | 80% | 0.8 | 73% | 0.73 | S | S | * | * | trans | -55 | 122.1 | 164.8 | -167.5 | 179.4 | -178.2 | -167.9 | 0 | 106.7 | D158 | K156-D158 PolarHBondContact O-N 2.95Å; K156-D158 VanDerWaalsContact O-N 3.17Å | ||
| 157 | P | 60.5 | Low | 57.9 | Low | 81 Ų | 81 | 143.7 Ų | 143.7 | 53% | 0.526 | 73% | 0.73 | S | S | . | * | trans | -67.1 | 120.1 | 177.6 | 23.6 | -28.8 | 0 | 0 | 0 | 107.9 | H155 F159 | H155-P157 WeakPolarHBondContact O-CD 3.47Å; P157-F159 VanDerWaalsContact C-N 3.3Å; P157-F159 HydrophobicContact CB-CE2 4.41Å; P157-F159 HydrophobicContact CB-CZ 4.45Å; P157-F159 HydrophobicContact CG-CD2 4.46Å; P157-F159 HydrophobicContact CG-CE2 3.72Å; P157-F159 HydrophobicContact CG-CZ 3.76Å; P157-F159 WeakPolarHBondContact O-CD2 3.28Å; P157-F159 PolarHBondContact O-N 3.17Å | ||
| 158 | D | 58.3 | Low | 58 | Low | 145 Ų | 145 | 137.8 Ų | 137.8 | 78% | 0.775 | 72% | 0.72 | S | S | * | * | trans | -68.7 | 96 | 166.8 | -77.6 | -30.2 | 0 | 0 | 0 | 107.1 | K156 W160 | K156-D158 PolarHBondContact O-N 2.95Å; K156-D158 VanDerWaalsContact O-N 3.17Å; D158-W160 PolarHBondContact O-N 3.49Å; D158-W160 VanDerWaalsContact O-N 3.13Å | ||
| 159 | F | 57.8 | Low | 58 | Low | 174 Ų | 174 | 140.9 Ų | 140.9 | 76% | 0.763 | 73% | 0.726 | S | S | * | * | trans | -64.3 | 112.7 | 172.1 | -66.1 | -83.9 | 0 | 0 | 0 | 107.8 | P157 Y161 | P157-F159 VanDerWaalsContact C-N 3.3Å; P157-F159 HydrophobicContact CB-CE2 4.41Å; P157-F159 HydrophobicContact CB-CZ 4.45Å; P157-F159 HydrophobicContact CG-CD2 4.46Å; P157-F159 HydrophobicContact CG-CE2 3.72Å; P157-F159 HydrophobicContact CG-CZ 3.76Å; P157-F159 WeakPolarHBondContact O-CD2 3.28Å; P157-F159 PolarHBondContact O-N 3.17Å; F159-Y161 PolarHBondContact O-N 2.99Å | ||
| 160 | W | 53.9 | Low | 57.9 | Low | 239 Ų | 239 | 139.9 Ų | 139.9 | 91% | 0.905 | 73% | 0.728 | S | S | * | * | trans | -57.5 | 109.1 | 165.6 | -70.3 | 69.8 | 0 | 0 | 0 | 107.2 | D158 F162 | D158-W160 PolarHBondContact O-N 3.49Å; D158-W160 VanDerWaalsContact O-N 3.13Å; W160-F162 PolarHBondContact O-N 2.96Å | ||
| 161 | Y | 55.4 | Low | 58.3 | Low | 220 Ų | 220 | 138.1 Ų | 138.1 | 86% | 0.863 | 72% | 0.724 | S | S | * | * | trans | -61.7 | 108.5 | 176.6 | -123.5 | -94.3 | 0 | 0 | 0 | 107.1 | F159 V163 | F159-Y161 PolarHBondContact O-N 2.99Å; Y161-V163 PolarHBondContact O-N 3.13Å | ||
| 162 | F | 53.3 | Low | 59.1 | Low | 196 Ų | 196 | 142.2 Ų | 142.2 | 86% | 0.86 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 116.1 | 167.4 | -99.9 | -95.4 | 0 | 0 | 0 | 107.2 | W160 N164 | W160-F162 PolarHBondContact O-N 2.96Å; F162-N164 PolarHBondContact O-N 3.05Å; F162-N164 VanDerWaalsContact O-N 3.16Å |
| 163 | V | 58 | Low | 59.8 | Low | 131 Ų | 131 | 146.2 Ų | 146.2 | 79% | 0.794 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 122.1 | 172.1 | -172.8 | 0 | 0 | 0 | 0 | 106.6 | Y161 P165 | Y161-V163 PolarHBondContact O-N 3.13Å; V163-P165 WeakPolarHBondContact O-CD 3.32Å |
| 164 | N | 58.3 | Low | 60.5 | Low | 106 Ų | 106 | 144.6 Ų | 144.6 | 57% | 0.567 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 118.3 | -171.8 | -148.9 | -19.3 | 0 | 0 | 0 | 109.8 | F162 A166 L167 | F162-N164 PolarHBondContact O-N 3.05Å; F162-N164 VanDerWaalsContact O-N 3.16Å; N164-A166 PolarHBondContact O-N 3.16Å; N164-L167 PolarHBondContact O-N 3.43Å |
| 165 | P | 56.5 | Low | 60.8 | Low | 107 Ų | 107 | 149.7 Ų | 149.7 | 70% | 0.695 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -67.2 | -7.3 | 179.3 | 26 | -32 | 0 | 0 | 0 | 112.6 | V163 L167 S168 | V163-P165 WeakPolarHBondContact O-CD 3.32Å; P165-L167 PolarHBondContact O-N 3.23Å; P165-S168 PolarHBondContact O-N 3.28Å; P165-S168 PolarHBondContact O-OG 3.04Å; P165-S168 VanDerWaalsContact O-OG 3.13Å |
| 166 | A | 56.8 | Low | 61.3 | Low | 83 Ų | 83 | 148.3 Ų | 148.3 | 69% | 0.686 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -69.1 | -5.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | N164 | N164-A166 PolarHBondContact O-N 3.16Š|
| 167 | L | 55.4 | Low | 61.2 | Low | 146 Ų | 146 | 145.5 Ų | 145.5 | 76% | 0.764 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -107.2 | -0.1 | 177.8 | -67.4 | 176.7 | 0 | 0 | 0 | 114.1 | N164 P165 E169 | N164-L167 PolarHBondContact O-N 3.43Å; P165-L167 PolarHBondContact O-N 3.23Å; L167-E169 PolarHBondContact O-N 3.43Å |
| 168 | S | 60.5 | Low | 60.7 | Low | 91 Ų | 91 | 153.7 Ų | 153.7 | 64% | 0.636 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -77.8 | 114.5 | 173.4 | 61.8 | 0 | 0 | 0 | 0 | 109.7 | P165 | P165-S168 PolarHBondContact O-N 3.28Å; P165-S168 PolarHBondContact O-OG 3.04Å; P165-S168 VanDerWaalsContact O-OG 3.13Å |
| 169 | E | 64.7 | Low | 60.9 | Low | 182 Ų | 182 | 154.1 Ų | 154.1 | 85% | 0.85 | 79% | 0.79 | S | S | * | * | trans | -55.3 | 133.1 | 171.6 | -155.8 | 169.6 | -152.8 | 0 | 0 | 109.4 | L167 A171 | L167-E169 PolarHBondContact O-N 3.43Å; E169-A171 PolarHBondContact O-N 3.47Å; E169-A171 VanDerWaalsContact O-N 3.17Å | ||
| 170 | P | 62.5 | Low | 61 | Low | 117 Ų | 117 | 153.1 Ų | 153.1 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | trans | -64.6 | 120.5 | -178.9 | 23.9 | -30.4 | 0 | 0 | 0 | 109.4 | E172 | P170-E172 PolarHBondContact O-N 3.36Å; P170-E172 VanDerWaalsContact O-N 3.09Å | ||
| 171 | A | 68.4 | Low | 61.4 | Low | 70 Ų | 70 | 148.3 Ų | 148.3 | 58% | 0.579 | 79% | 0.785 | S | S | * | * | trans | -63.8 | 111.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109 | E169 Y173 | E169-A171 PolarHBondContact O-N 3.47Å; E169-A171 VanDerWaalsContact O-N 3.17Å; A171-Y173 HydrophobicContact CB-CE2 3.96Å; A171-Y173 VanDerWaalsContact O-CD2 3.32Å; A171-Y173 WeakPolarHBondContact O-CD2 3.45Å; A171-Y173 PolarHBondContact O-N 3.31Å | ||
| 172 | E | 70.5 | Confident | 61.8 | Low | 176 Ų | 176 | 144.1 Ų | 144.1 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | trans | -77.7 | 108.3 | 176.9 | -169 | 170.3 | -159.1 | 0 | 0 | 109.3 | P170 | P170-E172 PolarHBondContact O-N 3.36Å; P170-E172 VanDerWaalsContact O-N 3.09Å | ||
| 173 | Y | 69.1 | Low | 62.3 | Low | 210 Ų | 210 | 140.8 Ų | 140.8 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | trans | -88.9 | 109.2 | 173.9 | -67.9 | -85.2 | 0 | 0 | 0 | 109.2 | A171 Q175 | A171-Y173 HydrophobicContact CB-CE2 3.96Å; A171-Y173 VanDerWaalsContact O-CD2 3.32Å; A171-Y173 WeakPolarHBondContact O-CD2 3.45Å; A171-Y173 PolarHBondContact O-N 3.31Å; Y173-Q175 PolarHBondContact O-N 3.09Å | ||
| 174 | N | 71.5 | Confident | 62.6 | Low | 142 Ų | 142 | 141.5 Ų | 141.5 | 76% | 0.759 | 77% | 0.774 | S | S | * | * | trans | -72.1 | 120.3 | 168.8 | -84.1 | -37.3 | 0 | 0 | 0 | 109.9 | V176 | N174-V176 PolarHBondContact O-N 3.17Š| ||
| 175 | Q | 68.7 | Low | 62.9 | Low | 179 Ų | 179 | 144 Ų | 144 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | trans | -73.1 | 123.3 | 176.1 | -168.5 | 171.3 | 40.9 | 0 | 0 | 109.6 | Y173 T177 | Y173-Q175 PolarHBondContact O-N 3.09Å; Q175-T177 PolarHBondContact O-N 3.32Å | ||
| 176 | V | 65.9 | Low | 63.4 | Low | 135 Ų | 135 | 146.8 Ų | 146.8 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -81.5 | 111.3 | 170.8 | -179.9 | 0 | 0 | 0 | 0 | 107.7 | N174 | N174-V176 PolarHBondContact O-N 3.17Š| ||
| 177 | T | 60.1 | Low | 63.9 | Low | 126 Ų | 126 | 152.2 Ų | 152.2 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | -71.1 | 130.7 | 171.2 | -39.1 | 0 | 0 | 0 | 0 | 109 | Q175 | Q175-T177 PolarHBondContact O-N 3.32Š| ||
| 178 | M | 50.1 | Low | 64.7 | Low | 252 Ų | 252 | 152.7 Ų | 152.7 | 100% | 1.241 | 81% | 0.809 | S | S | * | * | trans | -76.7 | 0 | 167.8 | -93.1 | 177.1 | 38.4 | 0 | 0 | 111.6 |
Retrieved 178 of 178 residues in 74.4 ms
(Link to these results)