| 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 | Y | 58.7 | Low | 83.5 | Confident | 252 Ų | 252 | 121.9 Ų | 121.9 | 99% | 0.988 | 58% | 0.581 | S | S | * | * | 0 | -34.5 | 0 | -166.2 | -117.5 | 0 | 0 | 0 | 113.3 | |||||
| 2 | I | 65.8 | Low | 84.4 | Confident | 152 Ų | 152 | 116.8 Ų | 116.8 | 78% | 0.779 | 57% | 0.568 | S | S | * | * | trans | -71 | -34.1 | 177.8 | -61.5 | -79.8 | 0 | 0 | 0 | 113.6 | S4 R5 | I2-S4 PolarHBondContact O-N 3.44Å; I2-R5 PolarHBondContact O-N 3.46Å | ||
| 3 | D | 79.4 | Confident | 85.3 | Confident | 90 Ų | 90 | 115.2 Ų | 115.2 | 48% | 0.481 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.4 | -38 | -175.1 | -174.5 | 63.9 | 0 | 0 | 0 | 114.7 | R5 A6 R7 | D3-R5 VanDerWaalsContact C-N 3.27Å; D3-R5 PolarHBondContact O-N 3.47Å; D3-A6 PolarHBondContact O-N 3.29Å; D3-R7 PolarHBondContact O-N 3.25Å; D3-R7 WeakPolarHBondContact OD2-CD 3.42Å; D3-R7 IonicContact OD2-CZ 3.86Å; D3-R7 IonicContact OD2-NE 3.9Å; D3-R7 IonicContact OD2-NH1 2.99Å; D3-R7 PolarHBondContact OD2-NH1 3.37Å |
| 4 | S | 82.1 | Confident | 86.1 | Confident | 70 Ų | 70 | 113.1 Ų | 113.1 | 49% | 0.49 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -70.2 | -20.6 | -176.6 | -46.1 | 0 | 0 | 0 | 0 | 113.8 | I2 R8 | I2-S4 PolarHBondContact O-N 3.44Å; S4-R8 WeakPolarHBondContact O-CG 3.44Å; S4-R8 PolarHBondContact O-N 3.46Å; S4-R8 PolarHBondContact O-NE 3.46Å; S4-R8 VanDerWaalsContact O-NE 3.14Å |
| 5 | R | 85.7 | Confident | 86.8 | Confident | 165 Ų | 165 | 111.5 Ų | 111.5 | 62% | 0.623 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -81.3 | -44.8 | 173.3 | -173.7 | 176.4 | -74.8 | -113.7 | 2.1 | 110.3 | I2 D3 R7 R8 N9 | I2-R5 PolarHBondContact O-N 3.46Å; D3-R5 VanDerWaalsContact C-N 3.27Å; D3-R5 PolarHBondContact O-N 3.47Å; R5-R7 VanDerWaalsContact C-N 3.35Å; R5-R7 PolarHBondContact O-N 2.91Å; R5-R8 PolarHBondContact O-N 3.35Å; R5-N9 PolarHBondContact O-N 3.49Å; R5-N9 PolarHBondContact O-OD1 3.42Å |
| 6 | A | 87.6 | Confident | 87.5 | Confident | 46 Ų | 46 | 111.9 Ų | 111.9 | 38% | 0.38 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -58.6 | -44.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | D3 R8 N9 L10 | D3-A6 PolarHBondContact O-N 3.29Å; A6-R8 PolarHBondContact O-N 3.49Å; A6-N9 PolarHBondContact O-N 3.23Å; A6-L10 WeakPolarHBondContact O-CG 3.39Å; A6-L10 PolarHBondContact O-N 2.83Å |
| 7 | R | 89.8 | Confident | 88.2 | Confident | 170 Ų | 170 | 111.3 Ų | 111.3 | 64% | 0.642 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.8 | -38.3 | 178.1 | -76.1 | 164.2 | 84.4 | 177.1 | 7 | 113.6 | D3 R5 G11 | D3-R7 PolarHBondContact O-N 3.25Å; D3-R7 WeakPolarHBondContact OD2-CD 3.42Å; D3-R7 IonicContact OD2-CZ 3.86Å; D3-R7 IonicContact OD2-NE 3.9Å; D3-R7 IonicContact OD2-NH1 2.99Å; D3-R7 PolarHBondContact OD2-NH1 3.37Å; R5-R7 VanDerWaalsContact C-N 3.35Å; R5-R7 PolarHBondContact O-N 2.91Å; R7-G11 PolarHBondContact O-N 3.47Å |
| 8 | R | 90.9 | Very high | 88.7 | Confident | 168 Ų | 168 | 112.2 Ų | 112.2 | 63% | 0.634 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.2 | -40.9 | 174.3 | -76.8 | -173.7 | -69.1 | 165.3 | -3.1 | 112 | S4 R5 A6 G11 S12 | S4-R8 WeakPolarHBondContact O-CG 3.44Å; S4-R8 PolarHBondContact O-N 3.46Å; S4-R8 PolarHBondContact O-NE 3.46Å; S4-R8 VanDerWaalsContact O-NE 3.14Å; R5-R8 PolarHBondContact O-N 3.35Å; A6-R8 PolarHBondContact O-N 3.49Å; R8-G11 PolarHBondContact O-N 3.29Å; R8-S12 PolarHBondContact O-N 2.75Å |
| 9 | N | 91.5 | Very high | 89.2 | Confident | 91 Ų | 91 | 111.1 Ų | 111.1 | 49% | 0.487 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.8 | -44 | 176.7 | -65.8 | -4.6 | 0 | 0 | 0 | 111.2 | R5 A6 G11 S12 I13 | R5-N9 PolarHBondContact O-N 3.49Å; R5-N9 PolarHBondContact O-OD1 3.42Å; A6-N9 PolarHBondContact O-N 3.23Å; N9-G11 VanDerWaalsContact C-N 3.33Å; N9-G11 PolarHBondContact O-N 2.88Å; N9-S12 WeakPolarHBondContact O-CB 3.4Å; N9-S12 PolarHBondContact O-N 2.87Å; N9-I13 WeakPolarHBondContact O-CG1 3.21Å; N9-I13 PolarHBondContact O-N 3.41Å |
| 10 | L | 92.9 | Very high | 89.7 | Confident | 103 Ų | 103 | 109.1 Ų | 109.1 | 54% | 0.539 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64 | -36.6 | 174 | -71.3 | 172.3 | 0 | 0 | 0 | 112.5 | A6 N14 | A6-L10 WeakPolarHBondContact O-CG 3.39Å; A6-L10 PolarHBondContact O-N 2.83Å; L10-N14 WeakPolarHBondContact O-CB 3.29Å; L10-N14 PolarHBondContact O-N 3.35Å; L10-N14 PolarHBondContact O-ND2 3.15Å |
| 11 | G | 94.5 | Very high | 90.1 | Very high | 34 Ų | 34 | 109.3 Ų | 109.3 | 35% | 0.351 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.4 | -41.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | R7 R8 N9 T15 | R7-G11 PolarHBondContact O-N 3.47Å; R8-G11 PolarHBondContact O-N 3.29Å; N9-G11 VanDerWaalsContact C-N 3.33Å; N9-G11 PolarHBondContact O-N 2.88Å; G11-T15 PolarHBondContact O-N 2.96Å; G11-T15 VanDerWaalsContact O-N 3.11Å; G11-T15 PolarHBondContact O-OG1 2.74Å |
| 12 | S | 94.2 | Very high | 92 | Very high | 60 Ų | 60 | 106.5 Ų | 106.5 | 42% | 0.42 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.1 | -50.7 | 175.7 | -160.7 | 0 | 0 | 0 | 0 | 111.1 | R8 N9 N14 T15 E16 | R8-S12 PolarHBondContact O-N 2.75Å; N9-S12 WeakPolarHBondContact O-CB 3.4Å; N9-S12 PolarHBondContact O-N 2.87Å; S12-N14 VanDerWaalsContact C-N 3.33Å; S12-N14 PolarHBondContact O-N 2.96Å; S12-T15 WeakPolarHBondContact O-CB 3.22Å; S12-T15 PolarHBondContact O-N 3.29Å; S12-E16 PolarHBondContact O-N 3.49Å; S12-E16 PolarHBondContact OG-OE1 3.33Å |
| 13 | I | 96.4 | Very high | 93.6 | Very high | 96 Ų | 96 | 103.2 Ų | 103.2 | 49% | 0.492 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.6 | -42.4 | -179.8 | -68.3 | 165.5 | 0 | 0 | 0 | 111.2 | N9 T15 E16 L17 | N9-I13 WeakPolarHBondContact O-CG1 3.21Å; N9-I13 PolarHBondContact O-N 3.41Å; I13-T15 VanDerWaalsContact C-N 3.29Å; I13-T15 PolarHBondContact O-N 3.07Å; I13-E16 PolarHBondContact O-N 2.86Å; I13-L17 VanDerWaalsContact O-CB 3.31Å; I13-L17 WeakPolarHBondContact O-CB 3.21Å; I13-L17 PolarHBondContact O-N 3.2Å |
| 14 | N | 96.1 | Very high | 94.5 | Very high | 86 Ų | 86 | 103.7 Ų | 103.7 | 46% | 0.46 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.8 | -37.9 | 176.6 | -82.1 | -45.5 | 0 | 0 | 0 | 111.9 | L10 S12 Q18 | L10-N14 WeakPolarHBondContact O-CB 3.29Å; L10-N14 PolarHBondContact O-N 3.35Å; L10-N14 PolarHBondContact O-ND2 3.15Å; S12-N14 VanDerWaalsContact C-N 3.33Å; S12-N14 PolarHBondContact O-N 2.96Å; N14-Q18 WeakPolarHBondContact O-CB 3.35Å; N14-Q18 WeakPolarHBondContact O-CG 3.48Å; N14-Q18 PolarHBondContact O-N 3.38Å |
| 15 | T | 97.1 | Very high | 95.3 | Very high | 89 Ų | 89 | 103.5 Ų | 103.5 | 55% | 0.546 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.1 | -45.4 | 176.7 | -53.9 | 0 | 0 | 0 | 0 | 111.3 | G11 S12 I13 L17 Q18 D19 | G11-T15 PolarHBondContact O-N 2.96Å; G11-T15 VanDerWaalsContact O-N 3.11Å; G11-T15 PolarHBondContact O-OG1 2.74Å; S12-T15 WeakPolarHBondContact O-CB 3.22Å; S12-T15 PolarHBondContact O-N 3.29Å; I13-T15 VanDerWaalsContact C-N 3.29Å; I13-T15 PolarHBondContact O-N 3.07Å; T15-L17 VanDerWaalsContact C-N 3.33Å; T15-L17 PolarHBondContact O-N 2.92Å; T15-Q18 WeakPolarHBondContact O-CB 3.46Å; T15-Q18 PolarHBondContact O-N 2.78Å; T15-D19 PolarHBondContact O-N 2.92Å |
| 16 | E | 97.8 | Very high | 95.9 | Very high | 119 Ų | 119 | 97.9 Ų | 97.9 | 56% | 0.556 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.6 | -42.3 | 176.4 | -72.5 | 172.6 | -152.6 | 0 | 0 | 111.5 | S12 I13 D19 V20 | S12-E16 PolarHBondContact O-N 3.49Å; S12-E16 PolarHBondContact OG-OE1 3.33Å; I13-E16 PolarHBondContact O-N 2.86Å; E16-D19 PolarHBondContact O-N 3.49Å; E16-V20 WeakPolarHBondContact O-CG2 3.41Å; E16-V20 PolarHBondContact O-N 3.47Å |
| 17 | L | 98.2 | Very high | 96.4 | Very high | 101 Ų | 101 | 99.6 Ų | 99.6 | 53% | 0.529 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.1 | -38 | 177.6 | -175.9 | 60.4 | 0 | 0 | 0 | 112 | I13 T15 D19 V20 Q21 | I13-L17 VanDerWaalsContact O-CB 3.31Å; I13-L17 WeakPolarHBondContact O-CB 3.21Å; I13-L17 PolarHBondContact O-N 3.2Å; T15-L17 VanDerWaalsContact C-N 3.33Å; T15-L17 PolarHBondContact O-N 2.92Å; L17-D19 VanDerWaalsContact C-N 3.3Å; L17-D19 PolarHBondContact O-N 3.42Å; L17-V20 PolarHBondContact O-N 2.89Å; L17-Q21 WeakPolarHBondContact O-CB 3.38Å; L17-Q21 PolarHBondContact O-N 3.48Å |
| 18 | Q | 98.2 | Very high | 96.8 | Very high | 128 Ų | 128 | 96.4 Ų | 96.4 | 60% | 0.598 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.5 | -38.8 | 173.1 | -77.1 | 171.6 | 14.1 | 0 | 0 | 111.7 | N14 T15 Q21 R22 | N14-Q18 WeakPolarHBondContact O-CB 3.35Å; N14-Q18 WeakPolarHBondContact O-CG 3.48Å; N14-Q18 PolarHBondContact O-N 3.38Å; T15-Q18 WeakPolarHBondContact O-CB 3.46Å; T15-Q18 PolarHBondContact O-N 2.78Å; Q18-Q21 PolarHBondContact O-N 3.45Å; Q18-R22 WeakPolarHBondContact O-CB 3.38Å; Q18-R22 PolarHBondContact O-N 3.28Å |
| 19 | D | 98.4 | Very high | 97.1 | Very high | 90 Ų | 90 | 94.3 Ų | 94.3 | 48% | 0.481 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.7 | -46.7 | 175.9 | -170.9 | 55.2 | 0 | 0 | 0 | 111.6 | T15 E16 L17 Q21 R22 I23 | T15-D19 PolarHBondContact O-N 2.92Å; E16-D19 PolarHBondContact O-N 3.49Å; L17-D19 VanDerWaalsContact C-N 3.3Å; L17-D19 PolarHBondContact O-N 3.42Å; D19-Q21 VanDerWaalsContact C-N 3.28Å; D19-Q21 PolarHBondContact O-N 2.98Å; D19-R22 WeakPolarHBondContact O-CA 3.29Å; D19-R22 VanDerWaalsContact O-CB 3.29Å; D19-R22 WeakPolarHBondContact O-CB 3.36Å; D19-R22 PolarHBondContact O-N 3.03Å; D19-I23 WeakPolarHBondContact O-CG1 3.32Å; D19-I23 PolarHBondContact O-N 3.08Å |
| 20 | V | 98.5 | Very high | 97.5 | Very high | 71 Ų | 71 | 94 Ų | 94 | 43% | 0.43 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -57.4 | -43.4 | 173.5 | 172.1 | 0 | 0 | 0 | 0 | 110.9 | E16 L17 R22 I23 M24 | E16-V20 WeakPolarHBondContact O-CG2 3.41Å; E16-V20 PolarHBondContact O-N 3.47Å; L17-V20 PolarHBondContact O-N 2.89Å; V20-R22 VanDerWaalsContact C-N 3.33Å; V20-R22 PolarHBondContact O-N 3.32Å; V20-I23 PolarHBondContact O-N 2.94Å; V20-M24 HydrophobicContact CG1-CE 4.1Å; V20-M24 HydrophobicContact CG1-CG 4.34Å; V20-M24 HydrophobicContact CG1-SD 4.31Å; V20-M24 WeakPolarHBondContact O-CG 3.39Å; V20-M24 PolarHBondContact O-N 3.4Å |
| 21 | Q | 98.4 | Very high | 97.7 | Very high | 114 Ų | 114 | 93.8 Ų | 93.8 | 53% | 0.533 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.6 | -43.5 | 175.7 | -176.8 | 179.5 | -12.2 | 0 | 0 | 111.6 | L17 Q18 D19 I23 M24 V25 | L17-Q21 WeakPolarHBondContact O-CB 3.38Å; L17-Q21 PolarHBondContact O-N 3.48Å; Q18-Q21 PolarHBondContact O-N 3.45Å; D19-Q21 VanDerWaalsContact C-N 3.28Å; D19-Q21 PolarHBondContact O-N 2.98Å; Q21-I23 VanDerWaalsContact C-N 3.31Å; Q21-I23 PolarHBondContact O-N 2.71Å; Q21-M24 HydrophobicContact CB-CE 4.42Å; Q21-M24 PolarHBondContact O-N 3.3Å; Q21-V25 WeakPolarHBondContact O-CG2 3.43Å; Q21-V25 PolarHBondContact O-N 3.44Å |
| 22 | R | 98.6 | Very high | 97.9 | Very high | 193 Ų | 193 | 97.8 Ų | 97.8 | 73% | 0.728 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -58.4 | -44.6 | 176 | -166.3 | -169 | -162.5 | 95.8 | 4.8 | 111.3 | Q18 D19 V20 V25 A26 | Q18-R22 WeakPolarHBondContact O-CB 3.38Å; Q18-R22 PolarHBondContact O-N 3.28Å; D19-R22 WeakPolarHBondContact O-CA 3.29Å; D19-R22 VanDerWaalsContact O-CB 3.29Å; D19-R22 WeakPolarHBondContact O-CB 3.36Å; D19-R22 PolarHBondContact O-N 3.03Å; V20-R22 VanDerWaalsContact C-N 3.33Å; V20-R22 PolarHBondContact O-N 3.32Å; R22-V25 PolarHBondContact O-N 3.26Å; R22-A26 PolarHBondContact O-N 3.43Å |
| 23 | I | 98.7 | Very high | 98.1 | Very high | 84 Ų | 84 | 101.5 Ų | 101.5 | 43% | 0.431 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65 | -44.3 | 177.6 | -66.4 | 166 | 0 | 0 | 0 | 110.8 | D19 V20 Q21 V25 A26 N27 | D19-I23 WeakPolarHBondContact O-CG1 3.32Å; D19-I23 PolarHBondContact O-N 3.08Å; V20-I23 PolarHBondContact O-N 2.94Å; Q21-I23 VanDerWaalsContact C-N 3.31Å; Q21-I23 PolarHBondContact O-N 2.71Å; I23-V25 VanDerWaalsContact C-N 3.32Å; I23-V25 PolarHBondContact O-N 2.92Å; I23-A26 PolarHBondContact O-N 2.95Å; I23-N27 WeakPolarHBondContact O-CB 3.49Å; I23-N27 PolarHBondContact O-N 3.42Å; I23-N27 PolarHBondContact O-ND2 2.75Å; I23-N27 PolarHBondContact O-OD1 2.81Å |
| 24 | M | 98.6 | Very high | 98.1 | Very high | 99 Ų | 99 | 104.4 Ų | 104.4 | 49% | 0.488 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61 | -41.9 | 178.4 | -73.1 | -170.7 | -59.9 | 0 | 0 | 111.8 | V20 Q21 N27 I28 | V20-M24 HydrophobicContact CG1-CE 4.1Å; V20-M24 HydrophobicContact CG1-CG 4.34Å; V20-M24 HydrophobicContact CG1-SD 4.31Å; V20-M24 WeakPolarHBondContact O-CG 3.39Å; V20-M24 PolarHBondContact O-N 3.4Å; Q21-M24 HydrophobicContact CB-CE 4.42Å; Q21-M24 PolarHBondContact O-N 3.3Å; M24-N27 PolarHBondContact O-N 2.89Å; M24-I28 WeakPolarHBondContact O-CD1 3.37Å; M24-I28 VanDerWaalsContact O-CG1 3.25Å; M24-I28 WeakPolarHBondContact O-CG1 3.44Å; M24-I28 PolarHBondContact O-N 3.36Å |
| 25 | V | 98.4 | Very high | 98.2 | Very high | 66 Ų | 66 | 101.8 Ų | 101.8 | 40% | 0.4 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.6 | -47.4 | 175.8 | 172 | 0 | 0 | 0 | 0 | 110.6 | Q21 R22 I23 N27 I28 E29 | Q21-V25 WeakPolarHBondContact O-CG2 3.43Å; Q21-V25 PolarHBondContact O-N 3.44Å; R22-V25 PolarHBondContact O-N 3.26Å; I23-V25 VanDerWaalsContact C-N 3.32Å; I23-V25 PolarHBondContact O-N 2.92Å; V25-N27 VanDerWaalsContact C-N 3.31Å; V25-N27 PolarHBondContact O-N 3.47Å; V25-I28 PolarHBondContact O-N 2.92Å; V25-I28 VanDerWaalsContact O-N 3.16Å; V25-E29 WeakPolarHBondContact O-CG 3.49Å; V25-E29 PolarHBondContact O-N 3Å |
| 26 | A | 98.3 | Very high | 98.1 | Very high | 48 Ų | 48 | 104.6 Ų | 104.6 | 40% | 0.397 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.3 | -41.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | R22 I23 I28 E29 E30 | R22-A26 PolarHBondContact O-N 3.43Å; I23-A26 PolarHBondContact O-N 2.95Å; A26-I28 PolarHBondContact O-N 3.24Å; A26-E29 PolarHBondContact O-N 3.25Å; A26-E30 WeakPolarHBondContact O-CB 3.47Å; A26-E30 PolarHBondContact O-N 2.94Å |
| 27 | N | 98.1 | Very high | 98 | Very high | 81 Ų | 81 | 101.5 Ų | 101.5 | 43% | 0.433 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.7 | -39.3 | 177.2 | -69.4 | -13.2 | 0 | 0 | 0 | 112.1 | I23 M24 V25 E30 V31 | I23-N27 WeakPolarHBondContact O-CB 3.49Å; I23-N27 PolarHBondContact O-N 3.42Å; I23-N27 PolarHBondContact O-ND2 2.75Å; I23-N27 PolarHBondContact O-OD1 2.81Å; M24-N27 PolarHBondContact O-N 2.89Å; V25-N27 VanDerWaalsContact C-N 3.31Å; V25-N27 PolarHBondContact O-N 3.47Å; N27-E30 PolarHBondContact O-N 3.42Å; N27-V31 WeakPolarHBondContact O-CG2 3.47Å; N27-V31 PolarHBondContact O-N 2.88Å |
| 28 | I | 98.4 | Very high | 98 | Very high | 104 Ų | 104 | 102.7 Ų | 102.7 | 53% | 0.533 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.5 | -47.5 | 176.4 | -69.6 | 162.7 | 0 | 0 | 0 | 109.8 | M24 V25 A26 E30 V31 L32 | M24-I28 WeakPolarHBondContact O-CD1 3.37Å; M24-I28 VanDerWaalsContact O-CG1 3.25Å; M24-I28 WeakPolarHBondContact O-CG1 3.44Å; M24-I28 PolarHBondContact O-N 3.36Å; V25-I28 PolarHBondContact O-N 2.92Å; V25-I28 VanDerWaalsContact O-N 3.16Å; A26-I28 PolarHBondContact O-N 3.24Å; I28-E30 VanDerWaalsContact C-N 3.31Å; I28-E30 PolarHBondContact O-N 3Å; I28-V31 PolarHBondContact O-N 3.39Å; I28-L32 HydrophobicContact CG2-CD1 4.01Å; I28-L32 HydrophobicContact CG2-CG 4.44Å; I28-L32 VanDerWaalsContact O-CG 3.3Å; I28-L32 WeakPolarHBondContact O-CG 3.3Å; I28-L32 PolarHBondContact O-N 3.44Å |
| 29 | E | 98.4 | Very high | 97.9 | Very high | 123 Ų | 123 | 100.1 Ų | 100.1 | 58% | 0.575 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.2 | -43.6 | 177.2 | -70.7 | 174.3 | -180 | 0 | 0 | 111.5 | V25 A26 V31 L32 Q33 | V25-E29 WeakPolarHBondContact O-CG 3.49Å; V25-E29 PolarHBondContact O-N 3Å; A26-E29 PolarHBondContact O-N 3.25Å; E29-V31 PolarHBondContact O-N 3.41Å; E29-L32 PolarHBondContact O-N 3.39Å; E29-Q33 WeakPolarHBondContact O-CB 3.4Å; E29-Q33 PolarHBondContact O-N 3.47Å |
| 30 | E | 98.3 | Very high | 97.8 | Very high | 84 Ų | 84 | 97.6 Ų | 97.6 | 39% | 0.393 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.5 | -45.9 | 177 | -171.9 | -173.1 | 168.2 | 0 | 0 | 112 | A26 N27 I28 L32 Q33 R34 | A26-E30 WeakPolarHBondContact O-CB 3.47Å; A26-E30 PolarHBondContact O-N 2.94Å; N27-E30 PolarHBondContact O-N 3.42Å; I28-E30 VanDerWaalsContact C-N 3.31Å; I28-E30 PolarHBondContact O-N 3Å; E30-L32 VanDerWaalsContact C-N 3.33Å; E30-L32 PolarHBondContact O-N 2.95Å; E30-Q33 PolarHBondContact O-N 3.31Å; E30-R34 WeakPolarHBondContact O-CB 3.4Å; E30-R34 VanDerWaalsContact O-CG 3.31Å; E30-R34 WeakPolarHBondContact O-CG 3.4Å; E30-R34 PolarHBondContact O-N 3.14Å; E30-R34 IonicContact OE1-CZ 3.17Å; E30-R34 IonicContact OE1-NE 3Å; E30-R34 PolarHBondContact OE1-NE 3.5Å; E30-R34 IonicContact OE1-NH2 2.65Å; E30-R34 PolarHBondContact OE1-NH2 3.28Å |
| 31 | V | 98.3 | Very high | 97.7 | Very high | 100 Ų | 100 | 103.7 Ų | 103.7 | 61% | 0.606 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.2 | -41.8 | 177.9 | 166.9 | 0 | 0 | 0 | 0 | 111 | N27 I28 E29 R34 G35 | N27-V31 WeakPolarHBondContact O-CG2 3.47Å; N27-V31 PolarHBondContact O-N 2.88Å; I28-V31 PolarHBondContact O-N 3.39Å; E29-V31 PolarHBondContact O-N 3.41Å; V31-R34 PolarHBondContact O-N 2.96Å; V31-G35 PolarHBondContact O-N 2.98Å |
| 32 | L | 98.3 | Very high | 97.7 | Very high | 118 Ų | 118 | 101.7 Ų | 101.7 | 62% | 0.618 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.3 | -46.8 | 177.6 | -71.4 | 173.8 | 0 | 0 | 0 | 111.6 | I28 E29 E30 R34 G35 E36 | I28-L32 HydrophobicContact CG2-CD1 4.01Å; I28-L32 HydrophobicContact CG2-CG 4.44Å; I28-L32 VanDerWaalsContact O-CG 3.3Å; I28-L32 WeakPolarHBondContact O-CG 3.3Å; I28-L32 PolarHBondContact O-N 3.44Å; E29-L32 PolarHBondContact O-N 3.39Å; E30-L32 VanDerWaalsContact C-N 3.33Å; E30-L32 PolarHBondContact O-N 2.95Å; L32-R34 VanDerWaalsContact C-N 3.34Å; L32-R34 PolarHBondContact O-N 2.99Å; L32-G35 PolarHBondContact O-N 2.97Å; L32-G35 VanDerWaalsContact O-N 3.1Å; L32-E36 PolarHBondContact O-N 3.48Å |
| 33 | Q | 97.6 | Very high | 97.6 | Very high | 138 Ų | 138 | 95.3 Ų | 95.3 | 65% | 0.645 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.4 | -40.9 | 178.8 | -171 | 177.7 | 10 | 0 | 0 | 112.1 | E29 E30 G35 E36 A37 | E29-Q33 WeakPolarHBondContact O-CB 3.4Å; E29-Q33 PolarHBondContact O-N 3.47Å; E30-Q33 PolarHBondContact O-N 3.31Å; Q33-G35 VanDerWaalsContact C-N 3.32Å; Q33-G35 PolarHBondContact O-N 2.97Å; Q33-E36 PolarHBondContact O-N 3.1Å; Q33-A37 PolarHBondContact O-N 2.96Å |
| 34 | R | 97.7 | Very high | 97.5 | Very high | 156 Ų | 156 | 97.1 Ų | 97.1 | 59% | 0.589 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.5 | -41.1 | 173.1 | -72.9 | 172.9 | 178.3 | -131.3 | 5 | 111.4 | E30 V31 L32 A37 L38 | E30-R34 WeakPolarHBondContact O-CB 3.4Å; E30-R34 VanDerWaalsContact O-CG 3.31Å; E30-R34 WeakPolarHBondContact O-CG 3.4Å; E30-R34 PolarHBondContact O-N 3.14Å; E30-R34 IonicContact OE1-CZ 3.17Å; E30-R34 IonicContact OE1-NE 3Å; E30-R34 PolarHBondContact OE1-NE 3.5Å; E30-R34 IonicContact OE1-NH2 2.65Å; E30-R34 PolarHBondContact OE1-NH2 3.28Å; V31-R34 PolarHBondContact O-N 2.96Å; L32-R34 VanDerWaalsContact C-N 3.34Å; L32-R34 PolarHBondContact O-N 2.99Å; R34-A37 PolarHBondContact O-N 3.46Å; R34-L38 VanDerWaalsContact O-CG 3.3Å; R34-L38 WeakPolarHBondContact O-CG 3.31Å; R34-L38 PolarHBondContact O-N 3.43Å |
| 35 | G | 97.1 | Very high | 97.5 | Very high | 31 Ų | 31 | 95.3 Ų | 95.3 | 32% | 0.32 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.8 | -40.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | V31 L32 Q33 S39 | V31-G35 PolarHBondContact O-N 2.98Å; L32-G35 PolarHBondContact O-N 2.97Å; L32-G35 VanDerWaalsContact O-N 3.1Å; Q33-G35 VanDerWaalsContact C-N 3.32Å; Q33-G35 PolarHBondContact O-N 2.97Å; G35-S39 WeakPolarHBondContact O-CB 3.49Å; G35-S39 PolarHBondContact O-N 3.43Å; G35-S39 PolarHBondContact O-OG 3.35Å |
| 36 | E | 96.4 | Very high | 97.4 | Very high | 149 Ų | 149 | 101.2 Ų | 101.2 | 70% | 0.696 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -63.5 | -47.4 | 174.2 | -175 | -178.3 | -174 | 0 | 0 | 111.4 | L32 Q33 L38 S39 G40 | L32-E36 PolarHBondContact O-N 3.48Å; Q33-E36 PolarHBondContact O-N 3.1Å; E36-L38 PolarHBondContact O-N 3.05Å; E36-S39 WeakPolarHBondContact O-CB 3.47Å; E36-S39 PolarHBondContact O-N 3.41Å; E36-S39 VanDerWaalsContact O-N 3.14Å; E36-G40 PolarHBondContact O-N 3.25Å |
| 37 | A | 95.5 | Very high | 97.4 | Very high | 54 Ų | 54 | 102.7 Ų | 102.7 | 45% | 0.446 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59 | -45.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q33 R34 S39 G40 W41 | Q33-A37 PolarHBondContact O-N 2.96Å; R34-A37 PolarHBondContact O-N 3.46Å; A37-S39 VanDerWaalsContact C-N 3.31Å; A37-S39 PolarHBondContact O-N 3.43Å; A37-G40 PolarHBondContact O-N 3.04Å; A37-W41 PolarHBondContact O-N 3.36Å |
| 38 | L | 97.6 | Very high | 97.4 | Very high | 125 Ų | 125 | 107.7 Ų | 107.7 | 65% | 0.654 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -60.9 | -40.5 | 175.8 | -71.7 | 173.4 | 0 | 0 | 0 | 112.1 | R34 E36 W41 S42 | R34-L38 VanDerWaalsContact O-CG 3.3Å; R34-L38 WeakPolarHBondContact O-CG 3.31Å; R34-L38 PolarHBondContact O-N 3.43Å; E36-L38 PolarHBondContact O-N 3.05Å; L38-W41 PolarHBondContact O-N 2.96Å; L38-S42 WeakPolarHBondContact O-CB 3.25Å; L38-S42 PolarHBondContact O-N 3.44Å |
| 39 | S | 96.7 | Very high | 97.4 | Very high | 74 Ų | 74 | 108.1 Ų | 108.1 | 52% | 0.517 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.8 | -45.2 | 176.4 | -59 | 0 | 0 | 0 | 0 | 111.1 | G35 E36 A37 S42 A43 | G35-S39 WeakPolarHBondContact O-CB 3.49Å; G35-S39 PolarHBondContact O-N 3.43Å; G35-S39 PolarHBondContact O-OG 3.35Å; E36-S39 WeakPolarHBondContact O-CB 3.47Å; E36-S39 PolarHBondContact O-N 3.41Å; E36-S39 VanDerWaalsContact O-N 3.14Å; A37-S39 VanDerWaalsContact C-N 3.31Å; A37-S39 PolarHBondContact O-N 3.43Å; S39-S42 PolarHBondContact O-N 3.27Å; S39-S42 PolarHBondContact O-OG 3.43Å; S39-A43 PolarHBondContact O-N 2.98Å |
| 40 | G | 96.1 | Very high | 97.3 | Very high | 37 Ų | 37 | 105.6 Ų | 105.6 | 38% | 0.381 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.4 | -47.6 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | E36 A37 S42 A43 M44 | E36-G40 PolarHBondContact O-N 3.25Å; A37-G40 PolarHBondContact O-N 3.04Å; G40-S42 VanDerWaalsContact C-N 3.34Å; G40-S42 PolarHBondContact O-N 3.16Å; G40-A43 PolarHBondContact O-N 3.48Å; G40-M44 WeakPolarHBondContact O-CG 3.33Å; G40-M44 PolarHBondContact O-N 3.49Å; G40-M44 VanDerWaalsContact O-N 3.08Å |
| 41 | W | 97.1 | Very high | 97.2 | Very high | 199 Ų | 199 | 104.3 Ų | 104.3 | 75% | 0.754 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -62.4 | -40.6 | 176.7 | -81 | 59.6 | 0 | 0 | 0 | 112.2 | A37 L38 A43 M44 A45 | A37-W41 PolarHBondContact O-N 3.36Å; L38-W41 PolarHBondContact O-N 2.96Å; W41-A43 VanDerWaalsContact C-N 3.32Å; W41-A43 PolarHBondContact O-N 2.85Å; W41-M44 PolarHBondContact O-N 3.38Å; W41-A45 WeakPolarHBondContact O-CB 3.3Å; W41-A45 PolarHBondContact O-N 2.88Å |
| 42 | S | 96.7 | Very high | 97.2 | Very high | 73 Ų | 73 | 102.3 Ų | 102.3 | 51% | 0.51 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -63.2 | -38.1 | 177.5 | 79.1 | 0 | 0 | 0 | 0 | 112.2 | L38 S39 G40 A45 R46 | L38-S42 WeakPolarHBondContact O-CB 3.25Å; L38-S42 PolarHBondContact O-N 3.44Å; S39-S42 PolarHBondContact O-N 3.27Å; S39-S42 PolarHBondContact O-OG 3.43Å; G40-S42 VanDerWaalsContact C-N 3.34Å; G40-S42 PolarHBondContact O-N 3.16Å; S42-A45 PolarHBondContact O-N 3.36Å; S42-R46 WeakPolarHBondContact O-CB 3.34Å; S42-R46 PolarHBondContact O-N 2.89Å |
| 43 | A | 97.1 | Very high | 97 | Very high | 59 Ų | 59 | 100.1 Ų | 100.1 | 49% | 0.488 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.6 | -43.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | S39 G40 W41 R46 S47 | S39-A43 PolarHBondContact O-N 2.98Å; G40-A43 PolarHBondContact O-N 3.48Å; W41-A43 VanDerWaalsContact C-N 3.32Å; W41-A43 PolarHBondContact O-N 2.85Å; A43-R46 PolarHBondContact O-N 3.01Å; A43-S47 WeakPolarHBondContact O-CB 3.42Å; A43-S47 PolarHBondContact O-N 3.45Å |
| 44 | M | 97.3 | Very high | 96.9 | Very high | 122 Ų | 122 | 97.8 Ų | 97.8 | 60% | 0.601 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.7 | -47.4 | 174.5 | -68.8 | 178.9 | 73.7 | 0 | 0 | 111.7 | G40 W41 R46 S47 W48 | G40-M44 WeakPolarHBondContact O-CG 3.33Å; G40-M44 PolarHBondContact O-N 3.49Å; G40-M44 VanDerWaalsContact O-N 3.08Å; W41-M44 PolarHBondContact O-N 3.38Å; M44-R46 VanDerWaalsContact C-N 3.33Å; M44-R46 PolarHBondContact O-N 2.65Å; M44-S47 WeakPolarHBondContact O-CB 3.33Å; M44-S47 PolarHBondContact O-N 3.42Å; M44-W48 PolarHBondContact O-N 2.92Å |
| 45 | A | 97.5 | Very high | 96.6 | Very high | 61 Ų | 61 | 93.8 Ų | 93.8 | 50% | 0.504 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.7 | -43 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | W41 S42 W48 L49 | W41-A45 WeakPolarHBondContact O-CB 3.3Å; W41-A45 PolarHBondContact O-N 2.88Å; S42-A45 PolarHBondContact O-N 3.36Å; A45-W48 PolarHBondContact O-N 3.46Å; A45-L49 WeakPolarHBondContact O-CB 3.44Å; A45-L49 PolarHBondContact O-N 3.06Å |
| 46 | R | 97.7 | Very high | 96.6 | Very high | 190 Ų | 190 | 100.5 Ų | 100.5 | 72% | 0.717 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65 | -40.3 | 176.9 | -171.1 | 173.8 | -173.9 | 158.1 | 1.9 | 112.5 | S42 A43 M44 L49 T50 | S42-R46 WeakPolarHBondContact O-CB 3.34Å; S42-R46 PolarHBondContact O-N 2.89Å; A43-R46 PolarHBondContact O-N 3.01Å; M44-R46 VanDerWaalsContact C-N 3.33Å; M44-R46 PolarHBondContact O-N 2.65Å; R46-L49 PolarHBondContact O-N 3Å; R46-T50 WeakPolarHBondContact O-CB 3.36Å; R46-T50 PolarHBondContact O-N 2.93Å; R46-T50 PolarHBondContact O-OG1 2.86Å |
| 47 | S | 97.3 | Very high | 96.3 | Very high | 79 Ų | 79 | 97 Ų | 97 | 55% | 0.552 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61.5 | -49.9 | 175.2 | -177 | 0 | 0 | 0 | 0 | 111.2 | A43 M44 L49 T50 A51 | A43-S47 WeakPolarHBondContact O-CB 3.42Å; A43-S47 PolarHBondContact O-N 3.45Å; M44-S47 WeakPolarHBondContact O-CB 3.33Å; M44-S47 PolarHBondContact O-N 3.42Å; S47-L49 PolarHBondContact O-N 2.92Å; S47-T50 PolarHBondContact O-N 3.49Å; S47-A51 WeakPolarHBondContact O-CB 3.15Å; S47-A51 PolarHBondContact O-N 3.25Å |
| 48 | W | 98.2 | Very high | 95.9 | Very high | 185 Ų | 185 | 99.8 Ų | 99.8 | 70% | 0.701 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -58.2 | -45 | 176.1 | -92.2 | 100.1 | 0 | 0 | 0 | 112.7 | M44 A45 A51 T52 | M44-W48 PolarHBondContact O-N 2.92Å; A45-W48 PolarHBondContact O-N 3.46Å; W48-A51 PolarHBondContact O-N 3.42Å; W48-T52 VanDerWaalsContact O-CB 3.29Å; W48-T52 WeakPolarHBondContact O-CB 3.49Å; W48-T52 PolarHBondContact O-N 2.86Å; W48-T52 PolarHBondContact O-OG1 2.87Å |
| 49 | L | 98 | Very high | 95.4 | Very high | 113 Ų | 113 | 97.7 Ų | 97.7 | 59% | 0.592 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.5 | -46.6 | 176.7 | -174.4 | 68.8 | 0 | 0 | 0 | 110.8 | A45 R46 S47 A51 T52 T53 | A45-L49 WeakPolarHBondContact O-CB 3.44Å; A45-L49 PolarHBondContact O-N 3.06Å; R46-L49 PolarHBondContact O-N 3Å; S47-L49 PolarHBondContact O-N 2.92Å; L49-A51 PolarHBondContact O-N 3.46Å; L49-T52 PolarHBondContact O-N 3.33Å; L49-T53 WeakPolarHBondContact O-CB 3.48Å; L49-T53 PolarHBondContact O-N 3.01Å; L49-T53 PolarHBondContact O-OG1 3.28Å |
| 50 | T | 96.8 | Very high | 95.2 | Very high | 70 Ų | 70 | 99.6 Ų | 99.6 | 43% | 0.429 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.1 | -47.6 | 179.6 | -56 | 0 | 0 | 0 | 0 | 111.3 | R46 S47 T52 T53 I54 | R46-T50 WeakPolarHBondContact O-CB 3.36Å; R46-T50 PolarHBondContact O-N 2.93Å; R46-T50 PolarHBondContact O-OG1 2.86Å; S47-T50 PolarHBondContact O-N 3.49Å; T50-T52 VanDerWaalsContact C-N 3.33Å; T50-T52 PolarHBondContact O-N 2.92Å; T50-T53 PolarHBondContact O-N 3.47Å; T50-I54 HydrophobicContact CG2-CD1 3.76Å; T50-I54 HydrophobicContact CG2-CG1 4.42Å; T50-I54 WeakPolarHBondContact O-CB 3.49Å; T50-I54 VanDerWaalsContact O-CG1 3.22Å; T50-I54 WeakPolarHBondContact O-CG1 3.31Å; T50-I54 PolarHBondContact O-N 2.94Å |
| 51 | A | 96.5 | Very high | 94.7 | Very high | 57 Ų | 57 | 105 Ų | 105 | 47% | 0.471 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60.8 | -43.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | S47 W48 L49 I54 S55 | S47-A51 WeakPolarHBondContact O-CB 3.15Å; S47-A51 PolarHBondContact O-N 3.25Å; W48-A51 PolarHBondContact O-N 3.42Å; L49-A51 PolarHBondContact O-N 3.46Å; A51-I54 PolarHBondContact O-N 3.23Å; A51-S55 WeakPolarHBondContact O-CB 3.49Å; A51-S55 PolarHBondContact O-N 3.41Å |
| 52 | T | 97 | Very high | 93.7 | Very high | 58 Ų | 58 | 100.2 Ų | 100.2 | 36% | 0.356 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.8 | -50.4 | 177.4 | -57.5 | 0 | 0 | 0 | 0 | 110.5 | W48 L49 T50 I54 S55 W56 | W48-T52 VanDerWaalsContact O-CB 3.29Å; W48-T52 WeakPolarHBondContact O-CB 3.49Å; W48-T52 PolarHBondContact O-N 2.86Å; W48-T52 PolarHBondContact O-OG1 2.87Å; L49-T52 PolarHBondContact O-N 3.33Å; T50-T52 VanDerWaalsContact C-N 3.33Å; T50-T52 PolarHBondContact O-N 2.92Å; T52-I54 VanDerWaalsContact C-N 3.35Å; T52-I54 PolarHBondContact O-N 2.95Å; T52-S55 WeakPolarHBondContact O-CB 3.4Å; T52-S55 PolarHBondContact O-N 3.06Å; T52-S55 VanDerWaalsContact O-N 3.15Å; T52-W56 VanDerWaalsContact CG2-CD1 3.48Å; T52-W56 PolarHBondContact O-N 3.37Å |
| 53 | T | 96.1 | Very high | 92.6 | Very high | 72 Ų | 72 | 101.7 Ų | 101.7 | 44% | 0.442 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -59.2 | -44.2 | 178.1 | -59.8 | 0 | 0 | 0 | 0 | 111.7 | L49 T50 S55 W56 V57 | L49-T53 WeakPolarHBondContact O-CB 3.48Å; L49-T53 PolarHBondContact O-N 3.01Å; L49-T53 PolarHBondContact O-OG1 3.28Å; T50-T53 PolarHBondContact O-N 3.47Å; T53-S55 VanDerWaalsContact C-N 3.33Å; T53-S55 PolarHBondContact O-N 3.21Å; T53-W56 PolarHBondContact O-N 2.95Å; T53-V57 HydrophobicContact CG2-CG2 4.24Å; T53-V57 WeakPolarHBondContact O-CB 3.36Å; T53-V57 WeakPolarHBondContact O-CG2 3.29Å; T53-V57 PolarHBondContact O-N 2.95Å |
| 54 | I | 94.6 | Very high | 90.9 | Very high | 89 Ų | 89 | 107.6 Ų | 107.6 | 46% | 0.456 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -59.9 | -46 | 175.8 | -70.7 | 168.2 | 0 | 0 | 0 | 110.5 | T50 A51 T52 V57 Q58 | T50-I54 HydrophobicContact CG2-CD1 3.76Å; T50-I54 HydrophobicContact CG2-CG1 4.42Å; T50-I54 WeakPolarHBondContact O-CB 3.49Å; T50-I54 VanDerWaalsContact O-CG1 3.22Å; T50-I54 WeakPolarHBondContact O-CG1 3.31Å; T50-I54 PolarHBondContact O-N 2.94Å; A51-I54 PolarHBondContact O-N 3.23Å; T52-I54 VanDerWaalsContact C-N 3.35Å; T52-I54 PolarHBondContact O-N 2.95Å; I54-V57 PolarHBondContact O-N 2.93Å; I54-Q58 HydrophobicContact CG2-CG 4.43Å; I54-Q58 WeakPolarHBondContact O-CB 3.41Å; I54-Q58 VanDerWaalsContact O-CG 3.29Å; I54-Q58 WeakPolarHBondContact O-CG 3.46Å; I54-Q58 PolarHBondContact O-N 2.97Å |
| 55 | S | 91.9 | Very high | 89.3 | Confident | 73 Ų | 73 | 104.9 Ų | 104.9 | 51% | 0.51 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -60.4 | -46.9 | 177.5 | 179.9 | 0 | 0 | 0 | 0 | 112.1 | A51 T52 T53 V57 Q58 A59 | A51-S55 WeakPolarHBondContact O-CB 3.49Å; A51-S55 PolarHBondContact O-N 3.41Å; T52-S55 WeakPolarHBondContact O-CB 3.4Å; T52-S55 PolarHBondContact O-N 3.06Å; T52-S55 VanDerWaalsContact O-N 3.15Å; T53-S55 VanDerWaalsContact C-N 3.33Å; T53-S55 PolarHBondContact O-N 3.21Å; S55-V57 PolarHBondContact O-N 3.23Å; S55-Q58 PolarHBondContact O-N 3.43Å; S55-A59 PolarHBondContact O-N 3.11Å |
| 56 | W | 95.8 | Very high | 87.7 | Confident | 171 Ų | 171 | 106.6 Ų | 106.6 | 65% | 0.648 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63.1 | -41.9 | 176 | -83.2 | 97.6 | 0 | 0 | 0 | 112.6 | T52 T53 Q58 A59 I60 | T52-W56 VanDerWaalsContact CG2-CD1 3.48Å; T52-W56 PolarHBondContact O-N 3.37Å; T53-W56 PolarHBondContact O-N 2.95Å; W56-Q58 VanDerWaalsContact C-N 3.35Å; W56-A59 PolarHBondContact O-N 3.29Å; W56-I60 WeakPolarHBondContact O-CG1 3.43Å; W56-I60 PolarHBondContact O-N 3.36Å |
| 57 | V | 91.6 | Very high | 85.7 | Confident | 77 Ų | 77 | 104.3 Ų | 104.3 | 47% | 0.467 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.3 | -43.3 | 175.9 | 168.2 | 0 | 0 | 0 | 0 | 110.5 | T53 I54 S55 A59 I60 F61 | T53-V57 HydrophobicContact CG2-CG2 4.24Å; T53-V57 WeakPolarHBondContact O-CB 3.36Å; T53-V57 WeakPolarHBondContact O-CG2 3.29Å; T53-V57 PolarHBondContact O-N 2.95Å; I54-V57 PolarHBondContact O-N 2.93Å; S55-V57 PolarHBondContact O-N 3.23Å; V57-A59 VanDerWaalsContact C-N 3.33Å; V57-A59 PolarHBondContact O-N 2.96Å; V57-I60 PolarHBondContact O-N 2.99Å; V57-F61 WeakPolarHBondContact O-CA 3.36Å; V57-F61 WeakPolarHBondContact O-CB 3.33Å; V57-F61 PolarHBondContact O-N 3.44Å |
| 58 | Q | 87.3 | Confident | 83.7 | Confident | 112 Ų | 112 | 107.9 Ų | 107.9 | 52% | 0.523 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.7 | -35.6 | 176.5 | -74.5 | 173.5 | -18.4 | 0 | 0 | 112.8 | I54 S55 W56 F61 P62 | I54-Q58 HydrophobicContact CG2-CG 4.43Å; I54-Q58 WeakPolarHBondContact O-CB 3.41Å; I54-Q58 VanDerWaalsContact O-CG 3.29Å; I54-Q58 WeakPolarHBondContact O-CG 3.46Å; I54-Q58 PolarHBondContact O-N 2.97Å; S55-Q58 PolarHBondContact O-N 3.43Å; W56-Q58 VanDerWaalsContact C-N 3.35Å; Q58-F61 CarbonylContact O-C 3.45Å; Q58-P62 WeakPolarHBondContact O-CA 3.39Å |
| 59 | A | 86.8 | Confident | 81.8 | Confident | 81 Ų | 81 | 105.3 Ų | 105.3 | 67% | 0.669 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -69.2 | -35.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | S55 W56 V57 | S55-A59 PolarHBondContact O-N 3.11Å; W56-A59 PolarHBondContact O-N 3.29Å; V57-A59 VanDerWaalsContact C-N 3.33Å; V57-A59 PolarHBondContact O-N 2.96Å |
| 60 | I | 91 | Very high | 80 | Confident | 113 Ų | 113 | 102.1 Ų | 102.1 | 58% | 0.579 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -87 | -42.2 | -179.1 | -63.8 | 169.6 | 0 | 0 | 0 | 111.6 | W56 V57 P62 | W56-I60 WeakPolarHBondContact O-CG1 3.43Å; W56-I60 PolarHBondContact O-N 3.36Å; V57-I60 PolarHBondContact O-N 2.99Å; I60-P62 VanDerWaalsContact C-CD 3.46Å; I60-P62 WeakPolarHBondContact O-CD 3.02Å |
| 61 | F | 85.6 | Confident | 78.2 | Confident | 152 Ų | 152 | 104.6 Ų | 104.6 | 67% | 0.667 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -113 | 80.9 | 177.2 | -67.1 | -82 | 0 | 0 | 0 | 108.6 | V57 Q58 | V57-F61 WeakPolarHBondContact O-CA 3.36Å; V57-F61 WeakPolarHBondContact O-CB 3.33Å; V57-F61 PolarHBondContact O-N 3.44Å; Q58-F61 CarbonylContact O-C 3.45Å |
| 62 | P | 77.9 | Confident | 76.3 | Confident | 97 Ų | 97 | 108.6 Ų | 108.6 | 63% | 0.63 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 136 | 176.2 | 20.8 | -30.2 | 0 | 0 | 0 | 109.5 | Q58 I60 Y64 | Q58-P62 WeakPolarHBondContact O-CA 3.39Å; I60-P62 VanDerWaalsContact C-CD 3.46Å; I60-P62 WeakPolarHBondContact O-CD 3.02Å; P62-Y64 PolarHBondContact O-N 3.48Å |
| 63 | P | 72.9 | Confident | 74.3 | Confident | 105 Ų | 105 | 109.2 Ų | 109.2 | 68% | 0.682 | 59% | 0.588 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 136.2 | 173.7 | 24 | -31.5 | 0 | 0 | 0 | 108.9 | ||
| 64 | Y | 60.8 | Low | 72.6 | Confident | 183 Ų | 183 | 111 Ų | 111 | 72% | 0.718 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 133.5 | 178.4 | -146.8 | -87 | 0 | 0 | 0 | 109.8 | P62 Y68 | P62-Y64 PolarHBondContact O-N 3.48Å; Y64-Y68 HydrophobicContact CD1-CE2 4.28Å; Y64-Y68 AromaticContact CE1-CE2 3.81Å; Y64-Y68 HydrophobicContact CE1-CE2 3.81Å |
| 65 | P | 64.5 | Low | 70.8 | Confident | 64 Ų | 64 | 110.4 Ų | 110.4 | 42% | 0.416 | 61% | 0.611 | S | S | . | * | P | Polyproline II helix | trans | -63.3 | 143 | -174.2 | 24 | -32.8 | 0 | 0 | 0 | 111.2 | E67 | P65-E67 HydrophobicContact CB-CG 4.17Å; P65-E67 PolarHBondContact O-N 3.27Å |
| 66 | P | 62.4 | Low | 69.2 | Low | 98 Ų | 98 | 112.1 Ų | 112.1 | 64% | 0.636 | 62% | 0.618 | S | S | * | * | trans | -77.9 | 37.5 | -179.6 | 34.7 | -35.9 | 0 | 0 | 0 | 112.3 | Y68 L69 | P66-Y68 PolarHBondContact O-N 3.44Å; P66-L69 HydrophobicContact CB-CD1 4.35Å; P66-L69 PolarHBondContact O-N 3.28Å | ||
| 67 | E | 57.1 | Low | 67.6 | Low | 141 Ų | 141 | 109.8 Ų | 109.8 | 66% | 0.659 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -69 | -18 | -177.7 | -74.2 | 176.2 | -166 | 0 | 0 | 112.6 | P65 L71 | P65-E67 HydrophobicContact CB-CG 4.17Å; P65-E67 PolarHBondContact O-N 3.27Å; E67-L71 WeakPolarHBondContact O-CG 3.38Å |
| 68 | Y | 55.4 | Low | 65.7 | Low | 155 Ų | 155 | 112.2 Ų | 112.2 | 61% | 0.608 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -78.3 | -21.2 | 174.7 | -58.5 | -71.2 | 0 | 0 | 0 | 114.3 | Y64 P66 Q72 | Y64-Y68 HydrophobicContact CD1-CE2 4.28Å; Y64-Y68 AromaticContact CE1-CE2 3.81Å; Y64-Y68 HydrophobicContact CE1-CE2 3.81Å; P66-Y68 PolarHBondContact O-N 3.44Å; Y68-Q72 PolarHBondContact O-N 2.9Å |
| 69 | L | 58.2 | Low | 64.2 | Low | 131 Ų | 131 | 113.9 Ų | 113.9 | 69% | 0.686 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -77.5 | -31.8 | 177.8 | -80.6 | 168.7 | 0 | 0 | 0 | 112.4 | P66 | P66-L69 HydrophobicContact CB-CD1 4.35Å; P66-L69 PolarHBondContact O-N 3.28Å |
| 70 | G | 59.9 | Low | 63 | Low | 46 Ų | 46 | 115.5 Ų | 115.5 | 47% | 0.474 | 69% | 0.688 | S | S | . | * | H | α-helix | trans | -71.8 | -33.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q72 A73 | G70-Q72 VanDerWaalsContact C-N 3.34Å; G70-Q72 PolarHBondContact O-N 2.98Å; G70-A73 PolarHBondContact O-N 3.5Å |
| 71 | L | 58.3 | Low | 61.6 | Low | 121 Ų | 121 | 115.6 Ų | 115.6 | 63% | 0.634 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -70.3 | -28.8 | 178.3 | -70.5 | 169.1 | 0 | 0 | 0 | 112.8 | E67 A75 | E67-L71 WeakPolarHBondContact O-CG 3.38Å; L71-A75 PolarHBondContact O-N 3.31Å |
| 72 | Q | 56.5 | Low | 60.2 | Low | 142 Ų | 142 | 113.6 Ų | 113.6 | 66% | 0.664 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -76.1 | -26.7 | 177.1 | -166.5 | 157.3 | -0.8 | 0 | 0 | 113.1 | Y68 G70 A75 | Y68-Q72 PolarHBondContact O-N 2.9Å; G70-Q72 VanDerWaalsContact C-N 3.34Å; G70-Q72 PolarHBondContact O-N 2.98Å; Q72-A75 PolarHBondContact O-N 3.46Å |
| 73 | A | 56.6 | Low | 59.2 | Low | 70 Ų | 70 | 114.6 Ų | 114.6 | 58% | 0.579 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -70.3 | -33 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | G70 T76 | G70-A73 PolarHBondContact O-N 3.5Å; A73-T76 PolarHBondContact O-OG1 3.25Å |
| 74 | C | 59.7 | Low | 58.3 | Low | 109 Ų | 109 | 115.2 Ų | 115.2 | 74% | 0.736 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -80.9 | -13.9 | 177.1 | -65.5 | 0 | 0 | 0 | 0 | 113.7 | ||
| 75 | A | 56.8 | Low | 58.2 | Low | 78 Ų | 78 | 110.7 Ų | 110.7 | 65% | 0.645 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -10 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | L71 Q72 | L71-A75 PolarHBondContact O-N 3.31Å; Q72-A75 PolarHBondContact O-N 3.46Å |
| 76 | T | 59.2 | Low | 57.7 | Low | 108 Ų | 108 | 114 Ų | 114 | 66% | 0.663 | 72% | 0.72 | S | S | * | * | trans | -103.1 | 70 | 176 | 49.4 | 0 | 0 | 0 | 0 | 111.2 | A73 | A73-T76 PolarHBondContact O-OG1 3.25Š| ||
| 77 | T | 60.9 | Low | 57.3 | Low | 123 Ų | 123 | 115.2 Ų | 115.2 | 76% | 0.755 | 73% | 0.726 | S | S | * | * | trans | -83.5 | 117.8 | 149.1 | 48.8 | 0 | 0 | 0 | 0 | 107.6 | G79 | T77-G79 PolarHBondContact O-N 3.14Š| ||
| 78 | P | 52.3 | Low | 57.4 | Low | 128 Ų | 128 | 113.1 Ų | 113.1 | 83% | 0.831 | 73% | 0.732 | S | S | * | * | trans | -74.6 | 112.6 | 167.7 | 23.8 | -16.2 | 0 | 0 | 0 | 107.7 | ||||
| 79 | G | 54.7 | Low | 57.6 | Low | 146 Ų | 146 | 109.3 Ų | 109.3 | 100% | 1.505 | 74% | 0.743 | S | S | * | * | trans | -79.7 | 0 | 156.8 | 0 | 0 | 0 | 0 | 0 | 110 | T77 | T77-G79 PolarHBondContact O-N 3.14Š|
Retrieved 79 of 79 residues in 58.6 ms
(Link to these results)