| 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 | 58.8 | Low | 82.7 | Confident | 217 Ų | 217 | 111.6 Ų | 111.6 | 100% | 1.069 | 62% | 0.622 | S | S | * | * | 0 | -31.7 | 0 | -64.1 | 170.7 | 80.2 | 0 | 0 | 113.9 | V3 | M1-V3 PolarHBondContact O-N 3.32Š| |||
| 2 | K | 63.1 | Low | 83.4 | Confident | 188 Ų | 188 | 109.1 Ų | 109.1 | 82% | 0.817 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -73.5 | -23.6 | -174.8 | -139.9 | 136.2 | 78.6 | 167.7 | 0 | 116.1 | S4 A6 | K2-S4 VanDerWaalsContact C-N 3.34Å; K2-A6 PolarHBondContact O-N 3.14Å |
| 3 | V | 70.8 | Confident | 83.9 | Confident | 125 Ų | 125 | 108.2 Ų | 108.2 | 76% | 0.758 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -71.7 | -29.4 | 178.1 | 84.7 | 0 | 0 | 0 | 0 | 112.5 | M1 A7 | M1-V3 PolarHBondContact O-N 3.32Å; V3-A7 WeakPolarHBondContact O-CB 3.39Å; V3-A7 PolarHBondContact O-N 3.41Å |
| 4 | S | 83.3 | Confident | 84.4 | Confident | 62 Ų | 62 | 106.6 Ų | 106.6 | 43% | 0.434 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -64.7 | -46.7 | 176.4 | 178.1 | 0 | 0 | 0 | 0 | 110.9 | K2 A6 A7 L8 | K2-S4 VanDerWaalsContact C-N 3.34Å; S4-A6 PolarHBondContact O-N 3.27Å; S4-A7 PolarHBondContact O-N 2.95Å; S4-L8 WeakPolarHBondContact O-CG 3.46Å; S4-L8 PolarHBondContact O-N 2.96Å |
| 5 | E | 86.4 | Confident | 84.7 | Confident | 129 Ų | 129 | 106.5 Ų | 106.5 | 60% | 0.603 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -60.9 | -44 | 178.9 | -60.6 | -64 | 95.1 | 0 | 0 | 111.7 | A7 L8 S9 | E5-A7 PolarHBondContact O-N 3.37Å; E5-L8 PolarHBondContact O-N 3.44Å; E5-S9 VanDerWaalsContact O-CB 3.3Å; E5-S9 WeakPolarHBondContact O-CB 3.38Å; E5-S9 PolarHBondContact O-N 3.26Å |
| 6 | A | 89.1 | Confident | 84.7 | Confident | 62 Ų | 62 | 106.4 Ų | 106.4 | 51% | 0.512 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.9 | -39 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | K2 S4 S9 L10 | K2-A6 PolarHBondContact O-N 3.14Å; S4-A6 PolarHBondContact O-N 3.27Å; A6-S9 PolarHBondContact O-N 2.81Å; A6-L10 WeakPolarHBondContact O-CB 3.02Å; A6-L10 PolarHBondContact O-N 3.29Å |
| 7 | A | 90.9 | Very high | 84.6 | Confident | 57 Ų | 57 | 105.8 Ų | 105.8 | 47% | 0.471 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -66.5 | -42.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | V3 S4 E5 L10 L11 | V3-A7 WeakPolarHBondContact O-CB 3.39Å; V3-A7 PolarHBondContact O-N 3.41Å; S4-A7 PolarHBondContact O-N 2.95Å; E5-A7 PolarHBondContact O-N 3.37Å; A7-L10 PolarHBondContact O-N 2.82Å; A7-L11 WeakPolarHBondContact O-CB 3.44Å; A7-L11 PolarHBondContact O-N 3.21Å |
| 8 | L | 91.7 | Very high | 84.6 | Confident | 94 Ų | 94 | 102.8 Ų | 102.8 | 49% | 0.492 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.1 | -44 | 173.8 | -69.1 | 174.1 | 0 | 0 | 0 | 111.1 | S4 E5 L10 L11 V12 | S4-L8 WeakPolarHBondContact O-CG 3.46Å; S4-L8 PolarHBondContact O-N 2.96Å; E5-L8 PolarHBondContact O-N 3.44Å; L8-L10 VanDerWaalsContact C-N 3.33Å; L8-L10 PolarHBondContact O-N 3.39Å; L8-L11 PolarHBondContact O-N 3.29Å; L8-V12 VanDerWaalsContact O-CG2 3.29Å; L8-V12 WeakPolarHBondContact O-CG2 3.12Å; L8-V12 PolarHBondContact O-N 3.07Å |
| 9 | S | 90.3 | Very high | 84.3 | Confident | 83 Ų | 83 | 101.1 Ų | 101.1 | 58% | 0.58 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.1 | -39.7 | 177.7 | -160.6 | 0 | 0 | 0 | 0 | 111.9 | E5 A6 L13 | E5-S9 VanDerWaalsContact O-CB 3.3Å; E5-S9 WeakPolarHBondContact O-CB 3.38Å; E5-S9 PolarHBondContact O-N 3.26Å; A6-S9 PolarHBondContact O-N 2.81Å; S9-L13 WeakPolarHBondContact O-CB 3.39Å; S9-L13 PolarHBondContact O-N 2.57Å |
| 10 | L | 92.4 | Very high | 83.7 | Confident | 106 Ų | 106 | 98.1 Ų | 98.1 | 56% | 0.555 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.4 | -43.2 | 175.2 | -172.5 | 70.4 | 0 | 0 | 0 | 111.2 | A6 A7 L8 L13 I14 | A6-L10 WeakPolarHBondContact O-CB 3.02Å; A6-L10 PolarHBondContact O-N 3.29Å; A7-L10 PolarHBondContact O-N 2.82Å; L8-L10 VanDerWaalsContact C-N 3.33Å; L8-L10 PolarHBondContact O-N 3.39Å; L10-L13 PolarHBondContact O-N 3.16Å; L10-I14 HydrophobicContact CG-CD1 4.01Å; L10-I14 VanDerWaalsContact O-CG1 3.27Å; L10-I14 WeakPolarHBondContact O-CG1 3.41Å; L10-I14 PolarHBondContact O-N 2.99Å |
| 11 | L | 93 | Very high | 83 | Confident | 105 Ų | 105 | 96.7 Ų | 96.7 | 55% | 0.55 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.2 | -46.3 | 178.1 | -165.8 | 83.2 | 0 | 0 | 0 | 111.5 | A7 L8 I14 L15 | A7-L11 WeakPolarHBondContact O-CB 3.44Å; A7-L11 PolarHBondContact O-N 3.21Å; L8-L11 PolarHBondContact O-N 3.29Å; L11-I14 PolarHBondContact O-N 2.94Å; L11-L15 WeakPolarHBondContact O-CG 3.44Å; L11-L15 PolarHBondContact O-N 3.06Å |
| 12 | V | 91.1 | Very high | 83.3 | Confident | 81 Ų | 81 | 95.7 Ų | 95.7 | 49% | 0.491 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62 | -44 | 177.2 | 171.3 | 0 | 0 | 0 | 0 | 110.9 | L8 I14 L15 I16 | L8-V12 VanDerWaalsContact O-CG2 3.29Å; L8-V12 WeakPolarHBondContact O-CG2 3.12Å; L8-V12 PolarHBondContact O-N 3.07Å; V12-I14 PolarHBondContact O-N 2.97Å; V12-L15 PolarHBondContact O-N 3.44Å; V12-I16 HydrophobicContact CG1-CD1 4.06Å; V12-I16 WeakPolarHBondContact O-CG1 3.09Å; V12-I16 PolarHBondContact O-N 2.75Å |
| 13 | L | 90 | Very high | 83.4 | Confident | 97 Ų | 97 | 90.8 Ų | 90.8 | 51% | 0.508 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 177.9 | -176.2 | 63.4 | 0 | 0 | 0 | 111.9 | S9 L10 L15 I16 I17 | S9-L13 WeakPolarHBondContact O-CB 3.39Å; S9-L13 PolarHBondContact O-N 2.57Å; L10-L13 PolarHBondContact O-N 3.16Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L15 PolarHBondContact O-N 3.14Å; L13-I16 PolarHBondContact O-N 2.68Å; L13-I17 HydrophobicContact CD1-CD1 4.19Å; L13-I17 HydrophobicContact CG-CD1 4.04Å; L13-I17 WeakPolarHBondContact O-CG1 3.38Å; L13-I17 PolarHBondContact O-N 3.15Å; L13-I17 VanDerWaalsContact O-N 3.12Å |
| 14 | I | 90.4 | Very high | 83.1 | Confident | 87 Ų | 87 | 88 Ų | 88 | 45% | 0.446 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.2 | -40.3 | 177.5 | -68.3 | 166.9 | 0 | 0 | 0 | 111.1 | L10 L11 V12 I17 T18 | L10-I14 HydrophobicContact CG-CD1 4.01Å; L10-I14 VanDerWaalsContact O-CG1 3.27Å; L10-I14 WeakPolarHBondContact O-CG1 3.41Å; L10-I14 PolarHBondContact O-N 2.99Å; L11-I14 PolarHBondContact O-N 2.94Å; V12-I14 PolarHBondContact O-N 2.97Å; I14-I17 PolarHBondContact O-N 2.92Å; I14-T18 VanDerWaalsContact O-CB 3.28Å; I14-T18 WeakPolarHBondContact O-CB 3.43Å; I14-T18 PolarHBondContact O-N 3.4Å; I14-T18 PolarHBondContact O-OG1 2.89Å |
| 15 | L | 89.1 | Confident | 81.7 | Confident | 105 Ų | 105 | 90.5 Ų | 90.5 | 55% | 0.55 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.3 | -41.3 | 177.4 | -73.7 | 175.2 | 0 | 0 | 0 | 112.4 | L11 V12 L13 S19 | L11-L15 WeakPolarHBondContact O-CG 3.44Å; L11-L15 PolarHBondContact O-N 3.06Å; V12-L15 PolarHBondContact O-N 3.44Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L15 PolarHBondContact O-N 3.14Å; L15-S19 VanDerWaalsContact O-CB 3.23Å; L15-S19 WeakPolarHBondContact O-CB 3.06Å; L15-S19 PolarHBondContact O-N 2.92Å; L15-S19 PolarHBondContact O-OG 3.33Å |
| 16 | I | 84.8 | Confident | 80.4 | Confident | 105 Ų | 105 | 87 Ų | 87 | 54% | 0.538 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.8 | -45.8 | 178.2 | -67.4 | 174.9 | 0 | 0 | 0 | 110.8 | V12 L13 S19 A20 | V12-I16 HydrophobicContact CG1-CD1 4.06Å; V12-I16 WeakPolarHBondContact O-CG1 3.09Å; V12-I16 PolarHBondContact O-N 2.75Å; L13-I16 PolarHBondContact O-N 2.68Å; I16-S19 WeakPolarHBondContact CA-OG 3.49Å; I16-S19 PolarHBondContact O-OG 2.86Å; I16-A20 WeakPolarHBondContact O-CB 3.44Å; I16-A20 PolarHBondContact O-N 3.24Å; I16-A20 VanDerWaalsContact O-N 3.09Å |
| 17 | I | 82.9 | Confident | 78.8 | Confident | 95 Ų | 95 | 92.9 Ų | 92.9 | 49% | 0.487 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.9 | -46.9 | 179.2 | -64.3 | 167 | 0 | 0 | 0 | 110.5 | L13 I14 S19 A20 S21 | L13-I17 HydrophobicContact CD1-CD1 4.19Å; L13-I17 HydrophobicContact CG-CD1 4.04Å; L13-I17 WeakPolarHBondContact O-CG1 3.38Å; L13-I17 PolarHBondContact O-N 3.15Å; L13-I17 VanDerWaalsContact O-N 3.12Å; I14-I17 PolarHBondContact O-N 2.92Å; I17-S19 PolarHBondContact O-N 2.97Å; I17-A20 PolarHBondContact O-N 3.19Å; I17-S21 WeakPolarHBondContact O-CB 2.87Å; I17-S21 PolarHBondContact O-N 3.43Å; I17-S21 PolarHBondContact O-OG 3.43Å; I17-S21 VanDerWaalsContact O-OG 3.11Å |
| 18 | T | 84.3 | Confident | 77.1 | Confident | 53 Ų | 53 | 92.8 Ų | 92.8 | 33% | 0.325 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -69.5 | -34.5 | -176.3 | -50 | 0 | 0 | 0 | 0 | 112.5 | I14 R22 | I14-T18 VanDerWaalsContact O-CB 3.28Å; I14-T18 WeakPolarHBondContact O-CB 3.43Å; I14-T18 PolarHBondContact O-N 3.4Å; I14-T18 PolarHBondContact O-OG1 2.89Å; T18-R22 WeakPolarHBondContact O-CB 3.39Å; T18-R22 PolarHBondContact O-N 2.81Å |
| 19 | S | 80.1 | Confident | 75.4 | Confident | 69 Ų | 69 | 90.9 Ų | 90.9 | 48% | 0.483 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -69 | -40.4 | 174.6 | 56.6 | 0 | 0 | 0 | 0 | 111.9 | L15 I16 I17 | L15-S19 VanDerWaalsContact O-CB 3.23Å; L15-S19 WeakPolarHBondContact O-CB 3.06Å; L15-S19 PolarHBondContact O-N 2.92Å; L15-S19 PolarHBondContact O-OG 3.33Å; I16-S19 WeakPolarHBondContact CA-OG 3.49Å; I16-S19 PolarHBondContact O-OG 2.86Å; I17-S19 PolarHBondContact O-N 2.97Å |
| 20 | A | 72.8 | Confident | 73.8 | Confident | 42 Ų | 42 | 91.5 Ų | 91.5 | 35% | 0.347 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62 | -42.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I16 I17 S23 Q24 | I16-A20 WeakPolarHBondContact O-CB 3.44Å; I16-A20 PolarHBondContact O-N 3.24Å; I16-A20 VanDerWaalsContact O-N 3.09Å; I17-A20 PolarHBondContact O-N 3.19Å; A20-S23 PolarHBondContact O-N 3.26Å; A20-Q24 WeakPolarHBondContact O-CG 3.14Å; A20-Q24 PolarHBondContact O-N 3.06Å; A20-Q24 PolarHBondContact O-OE1 3.47Å |
| 21 | S | 68.3 | Low | 72 | Confident | 68 Ų | 68 | 88.9 Ų | 88.9 | 48% | 0.476 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -72.1 | -31.5 | -179.5 | -61.7 | 0 | 0 | 0 | 0 | 114.5 | I17 S23 Q24 | I17-S21 WeakPolarHBondContact O-CB 2.87Å; I17-S21 PolarHBondContact O-N 3.43Å; I17-S21 PolarHBondContact O-OG 3.43Å; I17-S21 VanDerWaalsContact O-OG 3.11Å; S21-S23 VanDerWaalsContact C-N 3.26Å; S21-S23 PolarHBondContact O-N 3.46Å; S21-Q24 VanDerWaalsContact CA-OE1 3.29Å; S21-Q24 PolarHBondContact O-N 3.36Å |
| 22 | R | 65 | Low | 70.2 | Confident | 197 Ų | 197 | 91.6 Ų | 91.6 | 74% | 0.743 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -70.6 | -20.2 | 176.4 | -100.5 | -175.6 | -74.7 | -134.8 | 2.5 | 114.1 | T18 | T18-R22 WeakPolarHBondContact O-CB 3.39Å; T18-R22 PolarHBondContact O-N 2.81Å |
| 23 | S | 65.5 | Low | 68.5 | Low | 84 Ų | 84 | 91.2 Ų | 91.2 | 59% | 0.587 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.2 | 15.6 | 177.4 | -58.9 | 0 | 0 | 0 | 0 | 113.2 | A20 S21 P25 | A20-S23 PolarHBondContact O-N 3.26Å; S21-S23 VanDerWaalsContact C-N 3.26Å; S21-S23 PolarHBondContact O-N 3.46Å; S23-P25 WeakPolarHBondContact O-CD 3.14Å |
| 24 | Q | 64.1 | Low | 66.9 | Low | 67 Ų | 67 | 95.2 Ų | 95.2 | 31% | 0.313 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | 101.7 | -177.8 | -95 | 154.9 | 2.3 | 0 | 0 | 112.6 | A20 S21 W27 | A20-Q24 WeakPolarHBondContact O-CG 3.14Å; A20-Q24 PolarHBondContact O-N 3.06Å; A20-Q24 PolarHBondContact O-OE1 3.47Å; S21-Q24 VanDerWaalsContact CA-OE1 3.29Å; S21-Q24 PolarHBondContact O-N 3.36Å; Q24-W27 HydrophobicContact CG-CB 3.98Å; Q24-W27 VanDerWaalsContact NE2-CB 3.35Å; Q24-W27 VanDerWaalsContact NE2-CD2 3.33Å |
| 25 | P | 53.7 | Low | 65.3 | Low | 114 Ų | 114 | 97 Ų | 97 | 74% | 0.74 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | -102 | -3 | 107.3 | 25.9 | -20.7 | 0 | 0 | 0 | 112.2 | S23 A29 | S23-P25 WeakPolarHBondContact O-CD 3.14Å; P25-A29 PolarHBondContact O-N 3.34Å | |
| 26 | S | 59.2 | Low | 63.7 | Low | 56 Ų | 56 | 96.4 Ų | 96.4 | 39% | 0.392 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -81.4 | -16.2 | -163.3 | 88.6 | 0 | 0 | 0 | 0 | 117.1 | S28 A29 V30 | S26-S28 VanDerWaalsContact C-N 3.28Å; S26-S28 PolarHBondContact O-N 3.12Å; S26-A29 PolarHBondContact O-N 3.46Å; S26-V30 WeakPolarHBondContact O-CG2 3.2Å; S26-V30 PolarHBondContact O-N 2.94Å |
| 27 | W | 55.3 | Low | 62.3 | Low | 186 Ų | 186 | 96.2 Ų | 96.2 | 71% | 0.705 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -68.5 | -35.1 | 175.9 | -135.4 | -10.4 | 0 | 0 | 0 | 111.4 | Q24 S31 | Q24-W27 HydrophobicContact CG-CB 3.98Å; Q24-W27 VanDerWaalsContact NE2-CB 3.35Å; Q24-W27 VanDerWaalsContact NE2-CD2 3.33Å; W27-S31 WeakPolarHBondContact O-CB 3.33Å; W27-S31 PolarHBondContact O-N 3.11Å; W27-S31 PolarHBondContact O-OG 3.5Å |
| 28 | S | 55.7 | Low | 61.1 | Low | 55 Ų | 55 | 94.9 Ų | 94.9 | 39% | 0.385 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -75 | -32.4 | 172.2 | -165 | 0 | 0 | 0 | 0 | 111.5 | S26 R32 | S26-S28 VanDerWaalsContact C-N 3.28Å; S26-S28 PolarHBondContact O-N 3.12Å; S28-R32 WeakPolarHBondContact O-CB 3.48Å; S28-R32 PolarHBondContact O-N 3.09Å; S28-R32 VanDerWaalsContact OG-CZ 3.29Å; S28-R32 PolarHBondContact OG-NE 2.94Å; S28-R32 PolarHBondContact OG-NH2 3.26Å |
| 29 | A | 55.6 | Low | 59.7 | Low | 54 Ų | 54 | 95.3 Ų | 95.3 | 45% | 0.446 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.6 | -46.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | P25 S26 S33 | P25-A29 PolarHBondContact O-N 3.34Å; S26-A29 PolarHBondContact O-N 3.46Å; A29-S33 WeakPolarHBondContact O-CB 3.37Å; A29-S33 PolarHBondContact O-N 2.75Å |
| 30 | V | 56.4 | Low | 58.6 | Low | 96 Ų | 96 | 94.5 Ų | 94.5 | 58% | 0.582 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -74.4 | -33 | -179.7 | -178.2 | 0 | 0 | 0 | 0 | 111.4 | S26 R34 | S26-V30 WeakPolarHBondContact O-CG2 3.2Å; S26-V30 PolarHBondContact O-N 2.94Å; V30-R34 PolarHBondContact O-N 2.93Å; V30-R34 VanDerWaalsContact O-N 3.15Å |
| 31 | S | 55.2 | Low | 58 | Low | 50 Ų | 50 | 96.1 Ų | 96.1 | 35% | 0.35 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -79.7 | -37.3 | 178.4 | -48.7 | 0 | 0 | 0 | 0 | 113.1 | W27 L35 | W27-S31 WeakPolarHBondContact O-CB 3.33Å; W27-S31 PolarHBondContact O-N 3.11Å; W27-S31 PolarHBondContact O-OG 3.5Å; S31-L35 WeakPolarHBondContact O-CB 3.29Å; S31-L35 PolarHBondContact O-N 3.4Å; S31-L35 VanDerWaalsContact O-N 3.14Å |
| 32 | R | 54.6 | Low | 57.5 | Low | 163 Ų | 163 | 101.8 Ų | 101.8 | 62% | 0.615 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66.2 | -42.2 | 167.4 | -86.8 | -177.7 | -83.7 | 179 | -7.5 | 111.2 | S28 R34 L35 T36 | S28-R32 WeakPolarHBondContact O-CB 3.48Å; S28-R32 PolarHBondContact O-N 3.09Å; S28-R32 VanDerWaalsContact OG-CZ 3.29Å; S28-R32 PolarHBondContact OG-NE 2.94Å; S28-R32 PolarHBondContact OG-NH2 3.26Å; R32-R34 PolarHBondContact O-N 3Å; R32-L35 CarbonylContact O-C 3.53Å; R32-L35 PolarHBondContact O-N 3.44Å; R32-L35 VanDerWaalsContact O-N 3.16Å; R32-T36 WeakPolarHBondContact O-CB 3.49Å; R32-T36 PolarHBondContact O-N 3.39Å; R32-T36 PolarHBondContact O-OG1 3.42Å |
| 33 | S | 55.8 | Low | 57.2 | Low | 72 Ų | 72 | 95.6 Ų | 95.6 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.3 | -39.2 | -176.8 | -164.1 | 0 | 0 | 0 | 0 | 112.2 | A29 T36 T37 | A29-S33 WeakPolarHBondContact O-CB 3.37Å; A29-S33 PolarHBondContact O-N 2.75Å; S33-T36 PolarHBondContact O-N 3.47Å; S33-T37 WeakPolarHBondContact O-CB 3.4Å; S33-T37 PolarHBondContact O-N 3.42Å; S33-T37 PolarHBondContact O-OG1 2.86Å; S33-T37 VanDerWaalsContact O-OG1 3.06Å |
| 34 | R | 56.8 | Low | 56.9 | Low | 182 Ų | 182 | 98.2 Ų | 98.2 | 69% | 0.687 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -69.6 | -38.9 | 172.8 | -144.8 | 171.9 | 86.8 | -118.2 | 6.4 | 112.2 | V30 R32 T38 | V30-R34 PolarHBondContact O-N 2.93Å; V30-R34 VanDerWaalsContact O-N 3.15Å; R32-R34 PolarHBondContact O-N 3Å; R34-T38 WeakPolarHBondContact O-CB 3.5Å; R34-T38 PolarHBondContact O-N 3.41Å; R34-T38 PolarHBondContact O-OG1 2.88Å |
| 35 | L | 56.9 | Low | 56.6 | Low | 125 Ų | 125 | 100.4 Ų | 100.4 | 65% | 0.654 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67.3 | -32.7 | 174.9 | -83.5 | 162.7 | 0 | 0 | 0 | 112.8 | S31 R32 S39 | S31-L35 WeakPolarHBondContact O-CB 3.29Å; S31-L35 PolarHBondContact O-N 3.4Å; S31-L35 VanDerWaalsContact O-N 3.14Å; R32-L35 CarbonylContact O-C 3.53Å; R32-L35 PolarHBondContact O-N 3.44Å; R32-L35 VanDerWaalsContact O-N 3.16Å; L35-S39 WeakPolarHBondContact O-CA 3.23Å; L35-S39 WeakPolarHBondContact O-CB 3.4Å; L35-S39 PolarHBondContact O-N 2.88Å |
| 36 | T | 55.2 | Low | 57.1 | Low | 91 Ų | 91 | 101.9 Ų | 101.9 | 56% | 0.558 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -77.1 | -41 | 177.4 | -51.2 | 0 | 0 | 0 | 0 | 111.9 | R32 S33 S39 A40 | R32-T36 WeakPolarHBondContact O-CB 3.49Å; R32-T36 PolarHBondContact O-N 3.39Å; R32-T36 PolarHBondContact O-OG1 3.42Å; S33-T36 PolarHBondContact O-N 3.47Å; T36-S39 PolarHBondContact O-N 3.44Å; T36-A40 WeakPolarHBondContact O-CB 3.36Å; T36-A40 PolarHBondContact O-N 3.49Å |
| 37 | T | 54.4 | Low | 57 | Low | 101 Ų | 101 | 105.4 Ų | 105.4 | 62% | 0.62 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -68.5 | -35.9 | 176.2 | -58.6 | 0 | 0 | 0 | 0 | 112 | S33 S41 | S33-T37 WeakPolarHBondContact O-CB 3.4Å; S33-T37 PolarHBondContact O-N 3.42Å; S33-T37 PolarHBondContact O-OG1 2.86Å; S33-T37 VanDerWaalsContact O-OG1 3.06Å; T37-S41 WeakPolarHBondContact O-CB 3.48Å; T37-S41 PolarHBondContact O-N 3.2Å |
| 38 | T | 57.9 | Low | 57.3 | Low | 68 Ų | 68 | 103 Ų | 103 | 42% | 0.417 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -81.1 | -28.2 | 174.5 | -27.3 | 0 | 0 | 0 | 0 | 112.4 | R34 R42 | R34-T38 WeakPolarHBondContact O-CB 3.5Å; R34-T38 PolarHBondContact O-N 3.41Å; R34-T38 PolarHBondContact O-OG1 2.88Å; T38-R42 WeakPolarHBondContact O-CB 3.3Å; T38-R42 PolarHBondContact O-N 3.39Å |
| 39 | S | 55.2 | Low | 57.6 | Low | 62 Ų | 62 | 105.7 Ų | 105.7 | 43% | 0.434 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.8 | -47.2 | 175.3 | 179.8 | 0 | 0 | 0 | 0 | 111.2 | L35 T36 S41 R42 V43 | L35-S39 WeakPolarHBondContact O-CA 3.23Å; L35-S39 WeakPolarHBondContact O-CB 3.4Å; L35-S39 PolarHBondContact O-N 2.88Å; T36-S39 PolarHBondContact O-N 3.44Å; S39-S41 VanDerWaalsContact C-N 3.26Å; S39-S41 PolarHBondContact O-N 3.45Å; S39-R42 PolarHBondContact O-N 3.06Å; S39-V43 WeakPolarHBondContact O-CB 3.33Å; S39-V43 WeakPolarHBondContact O-CG2 3.36Å; S39-V43 PolarHBondContact O-N 2.93Å |
| 40 | A | 57.2 | Low | 58.1 | Low | 51 Ų | 51 | 111.6 Ų | 111.6 | 42% | 0.421 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64.4 | -31.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | T36 Q44 | T36-A40 WeakPolarHBondContact O-CB 3.36Å; T36-A40 PolarHBondContact O-N 3.49Å; A40-Q44 WeakPolarHBondContact O-CB 3.39Å; A40-Q44 WeakPolarHBondContact O-CG 3.27Å; A40-Q44 PolarHBondContact O-N 2.92Å; A40-Q44 PolarHBondContact O-NE2 3.35Å |
| 41 | S | 59.4 | Low | 58.2 | Low | 76 Ų | 76 | 112.1 Ų | 112.1 | 53% | 0.531 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -79.2 | -34.7 | 177.9 | -179 | 0 | 0 | 0 | 0 | 113.4 | T37 S39 V45 | T37-S41 WeakPolarHBondContact O-CB 3.48Å; T37-S41 PolarHBondContact O-N 3.2Å; S39-S41 VanDerWaalsContact C-N 3.26Å; S39-S41 PolarHBondContact O-N 3.45Å; S41-V45 WeakPolarHBondContact O-CG2 3.28Å |
| 42 | R | 58.1 | Low | 58.3 | Low | 187 Ų | 187 | 115.7 Ų | 115.7 | 71% | 0.706 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -80.4 | -34.3 | 172.5 | -84 | -172.7 | 178.8 | -177.9 | -0.5 | 113.7 | T38 S39 Q44 V45 I46 | T38-R42 WeakPolarHBondContact O-CB 3.3Å; T38-R42 PolarHBondContact O-N 3.39Å; S39-R42 PolarHBondContact O-N 3.06Å; R42-Q44 VanDerWaalsContact C-N 3.33Å; R42-V45 PolarHBondContact O-N 3Å; R42-I46 PolarHBondContact O-N 2.94Å |
| 43 | V | 59.7 | Low | 58.7 | Low | 67 Ų | 67 | 120.6 Ų | 120.6 | 41% | 0.406 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -69.1 | -32.8 | 178 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | S39 V45 I46 L47 | S39-V43 WeakPolarHBondContact O-CB 3.33Å; S39-V43 WeakPolarHBondContact O-CG2 3.36Å; S39-V43 PolarHBondContact O-N 2.93Å; V43-V45 VanDerWaalsContact C-N 3.29Å; V43-V45 PolarHBondContact O-N 2.7Å; V43-I46 PolarHBondContact O-N 3.47Å; V43-L47 HydrophobicContact CG1-CD1 3.79Å; V43-L47 HydrophobicContact CG1-CG 4.48Å; V43-L47 WeakPolarHBondContact O-CB 3.32Å; V43-L47 PolarHBondContact O-N 3.26Å |
| 44 | Q | 57.5 | Low | 58.8 | Low | 139 Ų | 139 | 123.1 Ų | 123.1 | 65% | 0.65 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -63.6 | -30.9 | 170.8 | -88.5 | 173.6 | 72.4 | 0 | 0 | 113.6 | A40 R42 L48 | A40-Q44 WeakPolarHBondContact O-CB 3.39Å; A40-Q44 WeakPolarHBondContact O-CG 3.27Å; A40-Q44 PolarHBondContact O-N 2.92Å; A40-Q44 PolarHBondContact O-NE2 3.35Å; R42-Q44 VanDerWaalsContact C-N 3.33Å; Q44-L48 PolarHBondContact O-N 3.04Å |
| 45 | V | 59.3 | Low | 58.9 | Low | 114 Ų | 114 | 119.9 Ų | 119.9 | 69% | 0.691 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -77.5 | -25.4 | 177.7 | 178.8 | 0 | 0 | 0 | 0 | 111.8 | S41 R42 V43 | S41-V45 WeakPolarHBondContact O-CG2 3.28Å; R42-V45 PolarHBondContact O-N 3Å; V43-V45 VanDerWaalsContact C-N 3.29Å; V43-V45 PolarHBondContact O-N 2.7Å |
| 46 | I | 64 | Low | 59 | Low | 144 Ų | 144 | 119.7 Ų | 119.7 | 74% | 0.738 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -84.6 | -26.9 | 174.7 | -61.4 | 167.8 | 0 | 0 | 0 | 111.5 | R42 V43 | R42-I46 PolarHBondContact O-N 2.94Å; V43-I46 PolarHBondContact O-N 3.47Å |
| 47 | L | 57.9 | Low | 59.3 | Low | 130 Ų | 130 | 121.4 Ų | 121.4 | 68% | 0.681 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -89.8 | 6.1 | 177.1 | -83 | 169.2 | 0 | 0 | 0 | 114.3 | V43 P49 | V43-L47 HydrophobicContact CG1-CD1 3.79Å; V43-L47 HydrophobicContact CG1-CG 4.48Å; V43-L47 WeakPolarHBondContact O-CB 3.32Å; V43-L47 PolarHBondContact O-N 3.26Å; L47-P49 WeakPolarHBondContact O-CD 3.37Å |
| 48 | L | 61.1 | Low | 59.6 | Low | 137 Ų | 137 | 122.6 Ų | 122.6 | 72% | 0.717 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -85.5 | 100.8 | 164.5 | -148.3 | 75.1 | 0 | 0 | 0 | 107.1 | Q44 Q50 | Q44-L48 PolarHBondContact O-N 3.04Å; L48-Q50 PolarHBondContact O-N 3.01Å; L48-Q50 VanDerWaalsContact O-N 3.14Å |
| 49 | P | 62.3 | Low | 59.7 | Low | 110 Ų | 110 | 126.3 Ų | 126.3 | 71% | 0.714 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 122.4 | 168.4 | 28.1 | -32.3 | 0 | 0 | 0 | 106.5 | L47 | L47-P49 WeakPolarHBondContact O-CD 3.37Š|
| 50 | Q | 64.9 | Low | 60 | Low | 178 Ų | 178 | 130.9 Ų | 130.9 | 83% | 0.832 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 129.1 | 169.6 | -171.7 | 177 | 19.2 | 0 | 0 | 107.9 | L48 | L48-Q50 PolarHBondContact O-N 3.01Å; L48-Q50 VanDerWaalsContact O-N 3.14Å |
| 51 | P | 58.4 | Low | 60.2 | Low | 108 Ų | 108 | 137 Ų | 137 | 70% | 0.701 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 133.8 | 179.3 | 26.6 | -31.6 | 0 | 0 | 0 | 108.3 | ||
| 52 | P | 57.6 | Low | 60.3 | Low | 124 Ų | 124 | 142.1 Ų | 142.1 | 81% | 0.805 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 132.5 | 174.5 | 28.8 | -31.1 | 0 | 0 | 0 | 109 | ||
| 53 | E | 62.5 | Low | 60.5 | Low | 267 Ų | 267 | 138 Ų | 138 | 100% | 1.248 | 74% | 0.744 | S | S | * | * | trans | -72.7 | 0 | 149.6 | -73.7 | -174.9 | 148.9 | 0 | 0 | 109.6 |
Retrieved 53 of 53 residues in 39.7 ms
(Link to these results)