| 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 | 44 | Very low | 63 | Low | 202 Ų | 202 | 115.9 Ų | 115.9 | 100% | 0.995 | 66% | 0.661 | S | S | * | * | 0 | 95.4 | 0 | -70.3 | -63.2 | 165.2 | 0 | 0 | 106.8 | N3 | M1-N3 PolarHBondContact O-N 3.15Å; M1-N3 VanDerWaalsContact O-N 3.09Å | |||
| 2 | S | 51.7 | Low | 64.9 | Low | 102 Ų | 102 | 111.9 Ų | 111.9 | 71% | 0.713 | 65% | 0.645 | S | S | * | * | trans | -64.7 | 108.7 | 164.6 | 38.8 | 0 | 0 | 0 | 0 | 105.7 | L4 | S2-L4 PolarHBondContact O-N 3.11Š| ||
| 3 | N | 56.6 | Low | 66.6 | Low | 146 Ų | 146 | 117.3 Ų | 117.3 | 78% | 0.781 | 66% | 0.657 | S | S | * | * | trans | -64.1 | 86.4 | 163.7 | -77.5 | -26.5 | 0 | 0 | 0 | 105.6 | M1 D5 | M1-N3 PolarHBondContact O-N 3.15Å; M1-N3 VanDerWaalsContact O-N 3.09Å; N3-D5 PolarHBondContact O-N 3.1Å | ||
| 4 | L | 60.9 | Low | 68 | Low | 126 Ų | 126 | 117.3 Ų | 117.3 | 66% | 0.66 | 65% | 0.654 | S | S | * | * | trans | -60.6 | 99.8 | 160.7 | -93.7 | 156.3 | 0 | 0 | 0 | 104.5 | S2 I6 L9 | S2-L4 PolarHBondContact O-N 3.11Å; L4-I6 PolarHBondContact O-N 2.82Å; L4-L9 HydrophobicContact CD2-CD1 4.19Å | ||
| 5 | D | 59.7 | Low | 69.4 | Low | 97 Ų | 97 | 114.1 Ų | 114.1 | 52% | 0.519 | 64% | 0.635 | S | S | . | * | trans | -58.5 | 103.8 | 178 | -100.2 | -20.2 | 0 | 0 | 0 | 107.3 | N3 S7 E8 | N3-D5 PolarHBondContact O-N 3.1Å; D5-S7 PolarHBondContact O-N 3.09Å; D5-S7 VanDerWaalsContact O-N 3.09Å; D5-E8 HydrophobicContact CB-CB 4.2Å; D5-E8 WeakPolarHBondContact O-CB 3.35Å; D5-E8 PolarHBondContact O-N 3.06Å | ||
| 6 | I | 63.3 | Low | 70.4 | Confident | 115 Ų | 115 | 109.9 Ų | 109.9 | 59% | 0.59 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | -26.7 | -177 | -61.2 | 171.5 | 0 | 0 | 0 | 110 | L4 E8 L16 | L4-I6 PolarHBondContact O-N 2.82Å; I6-E8 VanDerWaalsContact C-N 3.31Å; I6-L16 HydrophobicContact CG2-CD2 3.57Å |
| 7 | S | 64.3 | Low | 71.4 | Confident | 103 Ų | 103 | 110.8 Ų | 110.8 | 72% | 0.72 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | -30.1 | 171.6 | 33.1 | 0 | 0 | 0 | 0 | 113.9 | D5 | D5-S7 PolarHBondContact O-N 3.09Å; D5-S7 VanDerWaalsContact O-N 3.09Å |
| 8 | E | 67.1 | Low | 72.6 | Confident | 167 Ų | 167 | 110.2 Ų | 110.2 | 78% | 0.78 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.2 | -23.4 | -177.2 | -146.8 | 176.2 | -158.3 | 0 | 0 | 112.4 | D5 I6 G10 | D5-E8 HydrophobicContact CB-CB 4.2Å; D5-E8 WeakPolarHBondContact O-CB 3.35Å; D5-E8 PolarHBondContact O-N 3.06Å; I6-E8 VanDerWaalsContact C-N 3.31Å; E8-G10 PolarHBondContact O-N 3.18Å |
| 9 | L | 69.2 | Low | 73.6 | Confident | 83 Ų | 83 | 110.6 Ų | 110.6 | 44% | 0.435 | 60% | 0.604 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.8 | -10.9 | -179.6 | -107.2 | 76.5 | 0 | 0 | 0 | 114.2 | L4 I11 | L4-L9 HydrophobicContact CD2-CD1 4.19Å; L9-I11 HydrophobicContact CB-CD1 4.07Å; L9-I11 HydrophobicContact CB-CG1 4.11Å; L9-I11 HydrophobicContact CD2-CD1 3.56Å; L9-I11 HydrophobicContact CD2-CG1 4.49Å; L9-I11 HydrophobicContact CG-CD1 4.26Å; L9-I11 PolarHBondContact O-N 3.35Å |
| 10 | G | 77 | Confident | 74.4 | Confident | 75 Ų | 75 | 112.1 Ų | 112.1 | 77% | 0.773 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 61.6 | 15.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | E8 | E8-G10 PolarHBondContact O-N 3.18Š|
| 11 | I | 79 | Confident | 75.1 | Confident | 59 Ų | 59 | 108.1 Ų | 108.1 | 30% | 0.303 | 58% | 0.583 | S | S | . | * | trans | -87.7 | 133.9 | -176.9 | -68.1 | 175.3 | 0 | 0 | 0 | 109.9 | L9 L15 | L9-I11 HydrophobicContact CB-CD1 4.07Å; L9-I11 HydrophobicContact CB-CG1 4.11Å; L9-I11 HydrophobicContact CD2-CD1 3.56Å; L9-I11 HydrophobicContact CD2-CG1 4.49Å; L9-I11 HydrophobicContact CG-CD1 4.26Å; L9-I11 PolarHBondContact O-N 3.35Å; I11-L15 HydrophobicContact CG2-CB 3.95Å; I11-L15 HydrophobicContact CG2-CD2 4.03Å; I11-L15 HydrophobicContact CG2-CG 4.11Å | ||
| 12 | S | 86.1 | Confident | 77.2 | Confident | 68 Ų | 68 | 105.1 Ų | 105.1 | 48% | 0.476 | 56% | 0.56 | S | S | . | * | trans | -63.3 | 143.5 | 175.8 | 72.5 | 0 | 0 | 0 | 0 | 111.6 | N14 L15 L16 | S12-N14 PolarHBondContact O-N 3.12Å; S12-N14 VanDerWaalsContact O-N 3.15Å; S12-L15 PolarHBondContact O-N 3.08Å; S12-L15 VanDerWaalsContact O-N 3.1Å; S12-L15 WeakPolarHBondContact OG-CB 3.37Å; S12-L15 PolarHBondContact OG-N 2.85Å; S12-L16 PolarHBondContact O-N 3.34Å; S12-L16 VanDerWaalsContact O-N 3.11Å | ||
| 13 | K | 86.5 | Confident | 78.9 | Confident | 182 Ų | 182 | 109.9 Ų | 109.9 | 79% | 0.791 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -54.9 | -34 | 176.3 | -70.8 | -176.9 | 178.7 | 179.5 | 0 | 112.5 | L16 Q17 | K13-L16 PolarHBondContact O-N 2.93Å; K13-Q17 WeakPolarHBondContact O-CG 3.42Å; K13-Q17 PolarHBondContact O-N 2.78Å; K13-Q17 VanDerWaalsContact O-N 3.12Å |
| 14 | N | 87.2 | Confident | 80.4 | Confident | 117 Ų | 117 | 104.9 Ų | 104.9 | 63% | 0.626 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -67.2 | -45.2 | 178.2 | -169.2 | 9.1 | 0 | 0 | 0 | 111.8 | S12 L16 Q17 M18 | S12-N14 PolarHBondContact O-N 3.12Å; S12-N14 VanDerWaalsContact O-N 3.15Å; N14-L16 VanDerWaalsContact C-N 3.27Å; N14-L16 PolarHBondContact O-N 3.42Å; N14-Q17 WeakPolarHBondContact O-CB 3.34Å; N14-Q17 PolarHBondContact O-N 3.42Å; N14-Q17 VanDerWaalsContact O-N 3.08Å; N14-M18 PolarHBondContact O-N 3.25Å |
| 15 | L | 88.5 | Confident | 81.6 | Confident | 69 Ų | 69 | 101.8 Ų | 101.8 | 36% | 0.361 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.5 | -37.1 | 176.5 | -176.3 | 57.9 | 0 | 0 | 0 | 111.5 | I11 S12 Q17 M18 M21 | I11-L15 HydrophobicContact CG2-CB 3.95Å; I11-L15 HydrophobicContact CG2-CD2 4.03Å; I11-L15 HydrophobicContact CG2-CG 4.11Å; S12-L15 PolarHBondContact O-N 3.08Å; S12-L15 VanDerWaalsContact O-N 3.1Å; S12-L15 WeakPolarHBondContact OG-CB 3.37Å; S12-L15 PolarHBondContact OG-N 2.85Å; L15-Q17 VanDerWaalsContact C-N 3.29Å; L15-Q17 PolarHBondContact O-N 3.46Å; L15-M18 HydrophobicContact CD1-SD 3.82Å; L15-M18 WeakPolarHBondContact O-CB 3.44Å; L15-M18 PolarHBondContact O-N 3.23Å; L15-M21 HydrophobicContact CD1-CE 4.42Å; L15-M21 HydrophobicContact CG-CE 4.5Å; L15-M21 WeakPolarHBondContact O-CB 3.15Å |
| 16 | L | 85.8 | Confident | 82.7 | Confident | 48 Ų | 48 | 100.5 Ų | 100.5 | 25% | 0.251 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.5 | -28.9 | 175.6 | -167.4 | 65 | 0 | 0 | 0 | 113.2 | I6 S12 K13 N14 M18 M21 L25 | I6-L16 HydrophobicContact CG2-CD2 3.57Å; S12-L16 PolarHBondContact O-N 3.34Å; S12-L16 VanDerWaalsContact O-N 3.11Å; K13-L16 PolarHBondContact O-N 2.93Å; N14-L16 VanDerWaalsContact C-N 3.27Å; N14-L16 PolarHBondContact O-N 3.42Å; L16-M18 VanDerWaalsContact C-N 3.31Å; L16-M21 HydrophobicContact CD1-CG 4.45Å; L16-L25 HydrophobicContact CD1-CD1 3.3Å |
| 17 | Q | 87.9 | Confident | 83.7 | Confident | 124 Ų | 124 | 97.8 Ų | 97.8 | 58% | 0.579 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -73.3 | -22 | 175.9 | -74.9 | 172.9 | -7 | 0 | 0 | 112.9 | K13 N14 L15 N19 | K13-Q17 WeakPolarHBondContact O-CG 3.42Å; K13-Q17 PolarHBondContact O-N 2.78Å; K13-Q17 VanDerWaalsContact O-N 3.12Å; N14-Q17 WeakPolarHBondContact O-CB 3.34Å; N14-Q17 PolarHBondContact O-N 3.42Å; N14-Q17 VanDerWaalsContact O-N 3.08Å; L15-Q17 VanDerWaalsContact C-N 3.29Å; L15-Q17 PolarHBondContact O-N 3.46Å; Q17-N19 PolarHBondContact O-N 3.09Å |
| 18 | M | 91.7 | Very high | 84.6 | Confident | 101 Ų | 101 | 99.1 Ų | 99.1 | 50% | 0.498 | 50% | 0.504 | S | S | . | . | S | Bend | trans | -64.3 | 133.3 | 178.6 | -65.7 | -174.3 | 64.7 | 0 | 0 | 111.8 | N14 L15 L16 F20 M21 R22 | N14-M18 PolarHBondContact O-N 3.25Å; L15-M18 HydrophobicContact CD1-SD 3.82Å; L15-M18 WeakPolarHBondContact O-CB 3.44Å; L15-M18 PolarHBondContact O-N 3.23Å; L16-M18 VanDerWaalsContact C-N 3.31Å; M18-F20 PolarHBondContact O-N 3.45Å; M18-F20 VanDerWaalsContact O-N 3.16Å; M18-M21 PolarHBondContact O-N 3.17Å; M18-R22 PolarHBondContact O-N 3.16Å; M18-R22 VanDerWaalsContact O-N 3.15Å |
| 19 | N | 92.4 | Very high | 85.3 | Confident | 118 Ų | 118 | 95.8 Ų | 95.8 | 63% | 0.631 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -57 | -33.8 | -179.2 | -74.8 | -31.3 | 0 | 0 | 0 | 113.4 | Q17 R22 R23 | Q17-N19 PolarHBondContact O-N 3.09Å; N19-R22 PolarHBondContact O-N 2.93Å; N19-R23 WeakPolarHBondContact O-CG 3.35Å; N19-R23 PolarHBondContact O-N 3.24Å |
| 20 | F | 89.3 | Confident | 85.8 | Confident | 140 Ų | 140 | 98.6 Ų | 98.6 | 61% | 0.614 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -58 | -49.1 | 173.8 | 172 | -103.5 | 0 | 0 | 0 | 111.1 | M18 R22 R23 T24 | M18-F20 PolarHBondContact O-N 3.45Å; M18-F20 VanDerWaalsContact O-N 3.16Å; F20-R22 PolarHBondContact O-N 3.42Å; F20-R23 PolarHBondContact O-N 3.15Å; F20-R23 VanDerWaalsContact O-N 3.17Å; F20-T24 PolarHBondContact O-N 3.46Å; F20-T24 PolarHBondContact O-OG1 2.97Å |
| 21 | M | 89 | Confident | 85.7 | Confident | 29 Ų | 29 | 98.3 Ų | 98.3 | 14% | 0.143 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -66.2 | -38.6 | -178.3 | -160.6 | 48.8 | 42.6 | 0 | 0 | 112.4 | L15 L16 M18 R23 T24 L25 | L15-M21 HydrophobicContact CD1-CE 4.42Å; L15-M21 HydrophobicContact CG-CE 4.5Å; L15-M21 WeakPolarHBondContact O-CB 3.15Å; L16-M21 HydrophobicContact CD1-CG 4.45Å; M18-M21 PolarHBondContact O-N 3.17Å; M21-R23 VanDerWaalsContact C-N 3.35Å; M21-R23 PolarHBondContact O-N 2.98Å; M21-T24 PolarHBondContact O-N 3.03Å; M21-L25 WeakPolarHBondContact O-CG 3.48Å; M21-L25 PolarHBondContact O-N 3.33Å |
| 22 | R | 87.7 | Confident | 85.4 | Confident | 138 Ų | 138 | 100.9 Ų | 100.9 | 52% | 0.521 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -57.6 | -45.9 | 171.9 | -66.9 | -179.2 | 175.7 | -178.5 | -3.6 | 112 | M18 N19 F20 T24 L25 V26 | M18-R22 PolarHBondContact O-N 3.16Å; M18-R22 VanDerWaalsContact O-N 3.15Å; N19-R22 PolarHBondContact O-N 2.93Å; F20-R22 PolarHBondContact O-N 3.42Å; R22-T24 VanDerWaalsContact C-N 3.35Å; R22-T24 PolarHBondContact O-N 3.45Å; R22-L25 PolarHBondContact O-N 2.88Å; R22-V26 WeakPolarHBondContact O-CG2 3.27Å; R22-V26 PolarHBondContact O-N 3.07Å |
| 23 | R | 88.2 | Confident | 84.3 | Confident | 202 Ų | 202 | 102.9 Ų | 102.9 | 76% | 0.762 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.6 | -39.6 | 177.6 | -68.1 | 174.4 | 99.5 | -179.3 | 7.1 | 111.5 | N19 F20 M21 A27 | N19-R23 WeakPolarHBondContact O-CG 3.35Å; N19-R23 PolarHBondContact O-N 3.24Å; F20-R23 PolarHBondContact O-N 3.15Å; F20-R23 VanDerWaalsContact O-N 3.17Å; M21-R23 VanDerWaalsContact C-N 3.35Å; M21-R23 PolarHBondContact O-N 2.98Å; R23-A27 VanDerWaalsContact O-CB 3.25Å; R23-A27 WeakPolarHBondContact O-CB 3.48Å; R23-A27 PolarHBondContact O-N 2.87Å |
| 24 | T | 88.3 | Confident | 83 | Confident | 42 Ų | 42 | 101.9 Ų | 101.9 | 26% | 0.258 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64 | -43.8 | 177.1 | -53.2 | 0 | 0 | 0 | 0 | 112 | F20 M21 R22 A27 K28 | F20-T24 PolarHBondContact O-N 3.46Å; F20-T24 PolarHBondContact O-OG1 2.97Å; M21-T24 PolarHBondContact O-N 3.03Å; R22-T24 VanDerWaalsContact C-N 3.35Å; R22-T24 PolarHBondContact O-N 3.45Å; T24-A27 PolarHBondContact O-N 3.5Å; T24-K28 WeakPolarHBondContact O-CB 3.32Å; T24-K28 WeakPolarHBondContact O-CG 3.39Å; T24-K28 PolarHBondContact O-N 3.05Å |
| 25 | L | 85.5 | Confident | 81.6 | Confident | 61 Ų | 61 | 99.1 Ų | 99.1 | 32% | 0.319 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.9 | -45.8 | 178 | -73.2 | 172.9 | 0 | 0 | 0 | 111.8 | L16 M21 R22 A27 K28 E29 | L16-L25 HydrophobicContact CD1-CD1 3.3Å; M21-L25 WeakPolarHBondContact O-CG 3.48Å; M21-L25 PolarHBondContact O-N 3.33Å; R22-L25 PolarHBondContact O-N 2.88Å; L25-A27 VanDerWaalsContact C-N 3.3Å; L25-A27 PolarHBondContact O-N 2.97Å; L25-K28 PolarHBondContact O-N 3.4Å; L25-E29 WeakPolarHBondContact O-CB 3.4Å; L25-E29 PolarHBondContact O-N 3.39Å |
| 26 | V | 83 | Confident | 80.1 | Confident | 70 Ų | 70 | 101.4 Ų | 101.4 | 42% | 0.424 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.1 | -38.5 | 175.1 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | R22 K30 | R22-V26 WeakPolarHBondContact O-CG2 3.27Å; R22-V26 PolarHBondContact O-N 3.07Å; V26-K30 HydrophobicContact CG1-CD 4.19Å; V26-K30 WeakPolarHBondContact O-CB 3.25Å; V26-K30 VanDerWaalsContact O-CG 3.27Å; V26-K30 WeakPolarHBondContact O-CG 3.44Å; V26-K30 PolarHBondContact O-N 3.19Å |
| 27 | A | 83.9 | Confident | 78.7 | Confident | 58 Ų | 58 | 103.6 Ų | 103.6 | 48% | 0.479 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.7 | -40.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | R23 T24 L25 K30 A31 | R23-A27 VanDerWaalsContact O-CB 3.25Å; R23-A27 WeakPolarHBondContact O-CB 3.48Å; R23-A27 PolarHBondContact O-N 2.87Å; T24-A27 PolarHBondContact O-N 3.5Å; L25-A27 VanDerWaalsContact C-N 3.3Å; L25-A27 PolarHBondContact O-N 2.97Å; A27-K30 PolarHBondContact O-N 2.91Å; A27-A31 WeakPolarHBondContact O-CB 3.27Å; A27-A31 PolarHBondContact O-N 3.47Å |
| 28 | K | 84.1 | Confident | 77.2 | Confident | 131 Ų | 131 | 105.8 Ų | 105.8 | 57% | 0.57 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.2 | -47.1 | 174.5 | -77.6 | -175.3 | 176 | -172.7 | 0 | 111.3 | T24 L25 K30 A31 T32 | T24-K28 WeakPolarHBondContact O-CB 3.32Å; T24-K28 WeakPolarHBondContact O-CG 3.39Å; T24-K28 PolarHBondContact O-N 3.05Å; L25-K28 PolarHBondContact O-N 3.4Å; K28-K30 VanDerWaalsContact C-N 3.31Å; K28-K30 PolarHBondContact O-N 3.39Å; K28-A31 WeakPolarHBondContact O-CB 3.35Å; K28-A31 PolarHBondContact O-N 3.48Å; K28-A31 VanDerWaalsContact O-N 3.08Å; K28-T32 PolarHBondContact O-N 2.91Å; K28-T32 PolarHBondContact O-OG1 2.89Å |
| 29 | E | 80.4 | Confident | 75.6 | Confident | 96 Ų | 96 | 107.8 Ų | 107.8 | 45% | 0.449 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -58.7 | -43.8 | 176.7 | -176.4 | -178.6 | -174.8 | 0 | 0 | 111.4 | L25 A31 T32 N33 | L25-E29 WeakPolarHBondContact O-CB 3.4Å; L25-E29 PolarHBondContact O-N 3.39Å; E29-A31 VanDerWaalsContact C-N 3.34Å; E29-A31 PolarHBondContact O-N 2.85Å; E29-T32 PolarHBondContact O-N 3.21Å; E29-N33 WeakPolarHBondContact CG-ND2 3.49Å; E29-N33 VanDerWaalsContact O-CB 3.27Å; E29-N33 WeakPolarHBondContact O-CB 3.39Å; E29-N33 VanDerWaalsContact O-CG 3.28Å; E29-N33 PolarHBondContact O-N 3.08Å; E29-N33 PolarHBondContact O-ND2 2.84Å |
| 30 | K | 79.7 | Confident | 74 | Confident | 142 Ų | 142 | 109 Ų | 109 | 62% | 0.617 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.9 | -34.5 | 174.8 | -73.3 | 179.7 | -179.8 | -171.8 | 0 | 113.1 | V26 A27 K28 Q34 | V26-K30 HydrophobicContact CG1-CD 4.19Å; V26-K30 WeakPolarHBondContact O-CB 3.25Å; V26-K30 VanDerWaalsContact O-CG 3.27Å; V26-K30 WeakPolarHBondContact O-CG 3.44Å; V26-K30 PolarHBondContact O-N 3.19Å; A27-K30 PolarHBondContact O-N 2.91Å; K28-K30 VanDerWaalsContact C-N 3.31Å; K28-K30 PolarHBondContact O-N 3.39Å; K30-Q34 PolarHBondContact O-N 3.33Å |
| 31 | A | 76.4 | Confident | 72.4 | Confident | 69 Ų | 69 | 107.7 Ų | 107.7 | 57% | 0.57 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -70.4 | -38.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A27 K28 E29 | A27-A31 WeakPolarHBondContact O-CB 3.27Å; A27-A31 PolarHBondContact O-N 3.47Å; K28-A31 WeakPolarHBondContact O-CB 3.35Å; K28-A31 PolarHBondContact O-N 3.48Å; K28-A31 VanDerWaalsContact O-N 3.08Å; E29-A31 VanDerWaalsContact C-N 3.34Å; E29-A31 PolarHBondContact O-N 2.85Å |
| 32 | T | 73 | Confident | 70.8 | Confident | 114 Ų | 114 | 109.4 Ų | 109.4 | 70% | 0.699 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -74.2 | -35.2 | 177.2 | -46.9 | 0 | 0 | 0 | 0 | 112.1 | K28 E29 Q34 | K28-T32 PolarHBondContact O-N 2.91Å; K28-T32 PolarHBondContact O-OG1 2.89Å; E29-T32 PolarHBondContact O-N 3.21Å; T32-Q34 VanDerWaalsContact C-N 3.27Å; T32-Q34 PolarHBondContact O-N 3Å |
| 33 | N | 62.4 | Low | 69.4 | Low | 110 Ų | 110 | 108.1 Ų | 108.1 | 59% | 0.588 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | 7.4 | 178.6 | -67.8 | -30.8 | 0 | 0 | 0 | 114.1 | E29 G35 | E29-N33 WeakPolarHBondContact CG-ND2 3.49Å; E29-N33 VanDerWaalsContact O-CB 3.27Å; E29-N33 WeakPolarHBondContact O-CB 3.39Å; E29-N33 VanDerWaalsContact O-CG 3.28Å; E29-N33 PolarHBondContact O-N 3.08Å; E29-N33 PolarHBondContact O-ND2 2.84Å; N33-G35 PolarHBondContact O-N 3.39Å |
| 34 | Q | 59.1 | Low | 68 | Low | 161 Ų | 161 | 106.5 Ų | 106.5 | 75% | 0.752 | 60% | 0.604 | S | S | * | * | trans | -73.7 | 65.4 | 156.4 | -70.6 | -165.2 | 3.8 | 0 | 0 | 108.5 | K30 T32 V36 | K30-Q34 PolarHBondContact O-N 3.33Å; T32-Q34 VanDerWaalsContact C-N 3.27Å; T32-Q34 PolarHBondContact O-N 3Å; Q34-V36 PolarHBondContact O-N 3.17Å; Q34-V36 VanDerWaalsContact O-N 3.17Å | ||
| 35 | G | 56.6 | Low | 66.5 | Low | 59 Ų | 59 | 110.8 Ų | 110.8 | 61% | 0.608 | 62% | 0.621 | S | S | * | * | trans | -51.1 | 123 | 155.4 | 0 | 0 | 0 | 0 | 0 | 106.1 | N33 | N33-G35 PolarHBondContact O-N 3.39Š| ||
| 36 | V | 56.9 | Low | 65 | Low | 116 Ų | 116 | 117.6 Ų | 117.6 | 70% | 0.703 | 64% | 0.644 | S | S | * | * | trans | -37.1 | 128 | 162.3 | 177.3 | 0 | 0 | 0 | 0 | 106.2 | Q34 D38 | Q34-V36 PolarHBondContact O-N 3.17Å; Q34-V36 VanDerWaalsContact O-N 3.17Å; V36-D38 PolarHBondContact O-N 3.48Å | ||
| 37 | P | 57.7 | Low | 64.1 | Low | 95 Ų | 95 | 116.9 Ų | 116.9 | 62% | 0.617 | 65% | 0.651 | S | S | * | * | trans | -53.6 | 113.3 | 173.8 | 22.7 | -30.8 | 0 | 0 | 0 | 106.2 | I39 | P37-I39 CarbonylContact O-C 3.28Å; P37-I39 VanDerWaalsContact O-C 3.28Å; P37-I39 PolarHBondContact O-N 2.83Å | ||
| 38 | D | 56 | Low | 63.6 | Low | 169 Ų | 169 | 121.6 Ų | 121.6 | 90% | 0.904 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -60.3 | -0.9 | 175.9 | -96.9 | -15.5 | 0 | 0 | 0 | 111.9 | V36 L40 | V36-D38 PolarHBondContact O-N 3.48Å; D38-L40 PolarHBondContact O-N 2.81Å; D38-L40 VanDerWaalsContact O-N 3.1Å |
| 39 | I | 58.6 | Low | 63.3 | Low | 143 Ų | 143 | 124.9 Ų | 124.9 | 73% | 0.733 | 68% | 0.675 | S | S | * | * | trans | -80.2 | 71 | 160.5 | -41.5 | 171.3 | 0 | 0 | 0 | 107.9 | P37 | P37-I39 CarbonylContact O-C 3.28Å; P37-I39 VanDerWaalsContact O-C 3.28Å; P37-I39 PolarHBondContact O-N 2.83Å | ||
| 40 | L | 57.7 | Low | 63.4 | Low | 144 Ų | 144 | 123 Ų | 123 | 75% | 0.754 | 67% | 0.668 | S | S | * | * | trans | -47.9 | 131.5 | 145.1 | -93.6 | 153 | 0 | 0 | 0 | 105.7 | D38 N42 | D38-L40 PolarHBondContact O-N 2.81Å; D38-L40 VanDerWaalsContact O-N 3.1Å; L40-N42 PolarHBondContact O-N 2.8Å | ||
| 41 | P | 57.2 | Low | 63.9 | Low | 112 Ų | 112 | 120.1 Ų | 120.1 | 73% | 0.727 | 66% | 0.664 | S | S | * | * | trans | -62.2 | 97.6 | 173 | 26 | -30.8 | 0 | 0 | 0 | 105.7 | S43 | P41-S43 VanDerWaalsContact C-N 3.25Å; P41-S43 PolarHBondContact O-N 3.1Å | ||
| 42 | N | 55.5 | Low | 64.5 | Low | 66 Ų | 66 | 120.6 Ų | 120.6 | 35% | 0.353 | 66% | 0.663 | S | S | . | * | trans | -65.8 | 97.9 | -179.6 | -157.5 | -0.3 | 0 | 0 | 0 | 104.7 | L40 Q44 E45 | L40-N42 PolarHBondContact O-N 2.8Å; N42-Q44 PolarHBondContact O-N 2.69Å; N42-E45 HydrophobicContact CB-CB 4.05Å; N42-E45 HydrophobicContact CB-CG 3.89Å; N42-E45 VanDerWaalsContact ND2-CD 3.29Å; N42-E45 WeakPolarHBondContact ND2-CG 3.49Å; N42-E45 PolarHBondContact ND2-OE1 2.72Å; N42-E45 PolarHBondContact O-N 2.76Å | ||
| 43 | S | 58.3 | Low | 65.3 | Low | 110 Ų | 110 | 119.1 Ų | 119.1 | 77% | 0.769 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | -13.3 | -175.6 | 55.8 | 0 | 0 | 0 | 0 | 111.4 | P41 | P41-S43 VanDerWaalsContact C-N 3.25Å; P41-S43 PolarHBondContact O-N 3.1Å |
| 44 | Q | 57.9 | Low | 66.7 | Low | 168 Ų | 168 | 116.5 Ų | 116.5 | 79% | 0.785 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -22.7 | 172.4 | -79.9 | 167.9 | -33.3 | 0 | 0 | 114.9 | N42 Y46 | N42-Q44 PolarHBondContact O-N 2.69Å; Q44-Y46 PolarHBondContact O-N 3.42Å |
| 45 | E | 56.7 | Low | 68.1 | Low | 133 Ų | 133 | 113.7 Ų | 113.7 | 62% | 0.621 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.3 | -14.3 | -174.7 | -80.9 | 175.3 | -164.1 | 0 | 0 | 114.4 | N42 | N42-E45 HydrophobicContact CB-CB 4.05Å; N42-E45 HydrophobicContact CB-CG 3.89Å; N42-E45 VanDerWaalsContact ND2-CD 3.29Å; N42-E45 WeakPolarHBondContact ND2-CG 3.49Å; N42-E45 PolarHBondContact ND2-OE1 2.72Å; N42-E45 PolarHBondContact O-N 2.76Å |
| 46 | Y | 54.9 | Low | 69.9 | Low | 203 Ų | 203 | 118.3 Ų | 118.3 | 80% | 0.796 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.4 | 13.3 | -178.5 | -67 | -77.9 | 0 | 0 | 0 | 114.6 | Q44 F48 | Q44-Y46 PolarHBondContact O-N 3.42Å; Y46-F48 PolarHBondContact O-N 3.49Å |
| 47 | G | 64 | Low | 71.6 | Confident | 56 Ų | 56 | 120.7 Ų | 120.7 | 58% | 0.577 | 63% | 0.632 | S | S | * | * | trans | -79.3 | 55.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114 | K49 | G47-K49 PolarHBondContact O-N 3.23Å; G47-K49 VanDerWaalsContact O-N 3.13Å | ||
| 48 | F | 72.9 | Confident | 73.2 | Confident | 157 Ų | 157 | 120.1 Ų | 120.1 | 69% | 0.689 | 62% | 0.623 | S | S | * | * | trans | -69.4 | 112.2 | 168.9 | 93.8 | -81.2 | 0 | 0 | 0 | 108.6 | Y46 L50 | Y46-F48 PolarHBondContact O-N 3.49Å; F48-L50 HydrophobicContact CD2-CD2 4.37Å; F48-L50 HydrophobicContact CD2-CG 4.18Å; F48-L50 HydrophobicContact CE2-CB 4.49Å; F48-L50 HydrophobicContact CE2-CD1 4.2Å; F48-L50 HydrophobicContact CE2-CD2 3.29Å; F48-L50 HydrophobicContact CE2-CG 3.34Å; F48-L50 HydrophobicContact CZ-CD1 3.87Å; F48-L50 HydrophobicContact CZ-CD2 3.65Å; F48-L50 HydrophobicContact CZ-CG 3.54Å; F48-L50 PolarHBondContact O-N 2.89Å | ||
| 49 | K | 77.1 | Confident | 74.8 | Confident | 199 Ų | 199 | 116.3 Ų | 116.3 | 87% | 0.865 | 60% | 0.602 | S | S | * | * | trans | -74.7 | 111.3 | 174.6 | -67.9 | -163.2 | 179.4 | -174.8 | 0 | 108.6 | G47 | G47-K49 PolarHBondContact O-N 3.23Å; G47-K49 VanDerWaalsContact O-N 3.13Å | ||
| 50 | L | 82.4 | Confident | 76.4 | Confident | 58 Ų | 58 | 116.6 Ų | 116.6 | 30% | 0.304 | 60% | 0.598 | S | S | . | * | trans | -61.1 | 134.7 | 170.4 | -79.8 | 157.5 | 0 | 0 | 0 | 109.4 | F48 S52 V54 E55 I58 | F48-L50 HydrophobicContact CD2-CD2 4.37Å; F48-L50 HydrophobicContact CD2-CG 4.18Å; F48-L50 HydrophobicContact CE2-CB 4.49Å; F48-L50 HydrophobicContact CE2-CD1 4.2Å; F48-L50 HydrophobicContact CE2-CD2 3.29Å; F48-L50 HydrophobicContact CE2-CG 3.34Å; F48-L50 HydrophobicContact CZ-CD1 3.87Å; F48-L50 HydrophobicContact CZ-CD2 3.65Å; F48-L50 HydrophobicContact CZ-CG 3.54Å; F48-L50 PolarHBondContact O-N 2.89Å; L50-S52 PolarHBondContact O-N 2.98Å; L50-V54 HydrophobicContact CD2-CB 4.08Å; L50-V54 HydrophobicContact CD2-CG1 3.61Å; L50-E55 HydrophobicContact CB-CB 4.39Å; L50-I58 HydrophobicContact CD1-CD1 4.11Å; L50-I58 HydrophobicContact CD2-CD1 4.26Å | ||
| 51 | P | 90.7 | Very high | 77.8 | Confident | 80 Ų | 80 | 117 Ų | 117 | 52% | 0.519 | 59% | 0.59 | S | S | . | * | trans | -55.9 | 139.1 | 166.4 | -23.4 | 33 | 0 | 0 | 0 | 109.9 | S53 V54 E55 | P51-S53 PolarHBondContact O-N 2.89Å; P51-V54 HydrophobicContact CB-CG2 4.18Å; P51-V54 HydrophobicContact CG-CG2 4.26Å; P51-V54 WeakPolarHBondContact O-CA 3.31Å; P51-V54 WeakPolarHBondContact O-CB 3.42Å; P51-V54 PolarHBondContact O-N 3.24Å; P51-E55 PolarHBondContact O-N 3.27Å; P51-E55 VanDerWaalsContact O-N 3.15Å | ||
| 52 | S | 88.8 | Confident | 79.1 | Confident | 80 Ų | 80 | 113.5 Ų | 113.5 | 56% | 0.559 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -56 | -27.8 | -174.5 | 62.6 | 0 | 0 | 0 | 0 | 113.6 | L50 K56 | L50-S52 PolarHBondContact O-N 2.98Å; S52-K56 WeakPolarHBondContact O-CB 2.91Å; S52-K56 VanDerWaalsContact O-CG 3.24Å; S52-K56 WeakPolarHBondContact O-CG 3.32Å; S52-K56 PolarHBondContact O-N 3.13Å; S52-K56 VanDerWaalsContact O-N 3.08Å |
| 53 | S | 90.5 | Very high | 80.5 | Confident | 82 Ų | 82 | 114.4 Ų | 114.4 | 57% | 0.573 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -65.9 | -39 | 173.5 | 59.5 | 0 | 0 | 0 | 0 | 113 | P51 R57 | P51-S53 PolarHBondContact O-N 2.89Å; S53-R57 WeakPolarHBondContact O-CB 3.48Å; S53-R57 PolarHBondContact O-N 2.88Å |
| 54 | V | 90.7 | Very high | 81.7 | Confident | 56 Ų | 56 | 113 Ų | 113 | 34% | 0.339 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -73.7 | -44.2 | 179.5 | -174.6 | 0 | 0 | 0 | 0 | 109.9 | L50 P51 K56 R57 I58 | L50-V54 HydrophobicContact CD2-CB 4.08Å; L50-V54 HydrophobicContact CD2-CG1 3.61Å; P51-V54 HydrophobicContact CB-CG2 4.18Å; P51-V54 HydrophobicContact CG-CG2 4.26Å; P51-V54 WeakPolarHBondContact O-CA 3.31Å; P51-V54 WeakPolarHBondContact O-CB 3.42Å; P51-V54 PolarHBondContact O-N 3.24Å; V54-K56 PolarHBondContact O-N 3.14Å; V54-R57 WeakPolarHBondContact O-CB 3.31Å; V54-R57 PolarHBondContact O-N 3.02Å; V54-R57 VanDerWaalsContact O-N 3.09Å; V54-I58 HydrophobicContact CG1-CD1 3.86Å; V54-I58 HydrophobicContact CG1-CG1 4.34Å; V54-I58 WeakPolarHBondContact O-CG1 3.19Å; V54-I58 PolarHBondContact O-N 3.2Å |
| 55 | E | 90 | Very high | 82.5 | Confident | 102 Ų | 102 | 110 Ų | 110 | 48% | 0.477 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -60 | -46.5 | 177.4 | -169.2 | 176.4 | -169.7 | 0 | 0 | 111.6 | L50 P51 R57 I58 N59 | L50-E55 HydrophobicContact CB-CB 4.39Å; P51-E55 PolarHBondContact O-N 3.27Å; P51-E55 VanDerWaalsContact O-N 3.15Å; E55-R57 VanDerWaalsContact C-N 3.28Å; E55-R57 PolarHBondContact O-N 2.7Å; E55-I58 PolarHBondContact O-N 3.09Å; E55-N59 WeakPolarHBondContact O-CB 2.95Å; E55-N59 VanDerWaalsContact O-CG 3.3Å; E55-N59 PolarHBondContact O-N 3.18Å; E55-N59 PolarHBondContact O-ND2 2.95Å |
| 56 | K | 92.5 | Very high | 83.4 | Confident | 155 Ų | 155 | 112 Ų | 112 | 67% | 0.674 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -57.3 | -40.2 | 172.8 | -75.6 | 176 | -177.4 | -178.5 | 0 | 112.3 | S52 V54 K60 | S52-K56 WeakPolarHBondContact O-CB 2.91Å; S52-K56 VanDerWaalsContact O-CG 3.24Å; S52-K56 WeakPolarHBondContact O-CG 3.32Å; S52-K56 PolarHBondContact O-N 3.13Å; S52-K56 VanDerWaalsContact O-N 3.08Å; V54-K56 PolarHBondContact O-N 3.14Å; K56-K60 WeakPolarHBondContact O-CB 3.44Å; K56-K60 PolarHBondContact O-N 3.28Å |
| 57 | R | 93 | Very high | 84.2 | Confident | 166 Ų | 166 | 106.3 Ų | 106.3 | 63% | 0.626 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -70.3 | -40.5 | 179.6 | -167.7 | 177.7 | -173.8 | -174.3 | 2.6 | 112.3 | S53 V54 E55 R61 | S53-R57 WeakPolarHBondContact O-CB 3.48Å; S53-R57 PolarHBondContact O-N 2.88Å; V54-R57 WeakPolarHBondContact O-CB 3.31Å; V54-R57 PolarHBondContact O-N 3.02Å; V54-R57 VanDerWaalsContact O-N 3.09Å; E55-R57 VanDerWaalsContact C-N 3.28Å; E55-R57 PolarHBondContact O-N 2.7Å; R57-R61 PolarHBondContact O-N 3.39Å |
| 58 | I | 91.3 | Very high | 84.3 | Confident | 84 Ų | 84 | 108.8 Ų | 108.8 | 43% | 0.431 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.4 | -48.6 | 174.8 | -69.4 | 169.3 | 0 | 0 | 0 | 109.4 | L50 V54 E55 K60 R61 A62 | L50-I58 HydrophobicContact CD1-CD1 4.11Å; L50-I58 HydrophobicContact CD2-CD1 4.26Å; V54-I58 HydrophobicContact CG1-CD1 3.86Å; V54-I58 HydrophobicContact CG1-CG1 4.34Å; V54-I58 WeakPolarHBondContact O-CG1 3.19Å; V54-I58 PolarHBondContact O-N 3.2Å; E55-I58 PolarHBondContact O-N 3.09Å; I58-K60 PolarHBondContact O-N 2.98Å; I58-R61 PolarHBondContact O-N 2.93Å; I58-R61 VanDerWaalsContact O-N 3.1Å; I58-A62 WeakPolarHBondContact O-CB 3.44Å; I58-A62 PolarHBondContact O-N 2.63Å |
| 59 | N | 89.8 | Confident | 83.6 | Confident | 89 Ų | 89 | 111.5 Ų | 111.5 | 48% | 0.476 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.6 | -43.3 | 179.2 | -73.1 | -22.5 | 0 | 0 | 0 | 111.9 | E55 R61 A62 T63 | E55-N59 WeakPolarHBondContact O-CB 2.95Å; E55-N59 VanDerWaalsContact O-CG 3.3Å; E55-N59 PolarHBondContact O-N 3.18Å; E55-N59 PolarHBondContact O-ND2 2.95Å; N59-R61 VanDerWaalsContact C-N 3.34Å; N59-R61 PolarHBondContact O-N 3.12Å; N59-A62 PolarHBondContact O-N 2.83Å; N59-T63 WeakPolarHBondContact O-CG2 3.35Å; N59-T63 PolarHBondContact O-N 3.15Å; N59-T63 PolarHBondContact O-OG1 3.19Å |
| 60 | K | 91.8 | Very high | 82.7 | Confident | 148 Ų | 148 | 110 Ų | 110 | 64% | 0.643 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62 | -38.3 | 174.2 | -173 | 175.1 | -177.9 | 175.4 | 0 | 112.8 | K56 I58 T63 I64 | K56-K60 WeakPolarHBondContact O-CB 3.44Å; K56-K60 PolarHBondContact O-N 3.28Å; I58-K60 PolarHBondContact O-N 2.98Å; K60-T63 PolarHBondContact O-OG1 3.43Å; K60-I64 HydrophobicContact CG-CD1 4.38Å; K60-I64 VanDerWaalsContact O-CD1 3.31Å; K60-I64 WeakPolarHBondContact O-CD1 3.35Å; K60-I64 VanDerWaalsContact O-CG1 3.24Å; K60-I64 WeakPolarHBondContact O-CG1 3.41Å; K60-I64 PolarHBondContact O-N 3.38Å |
| 61 | R | 86.7 | Confident | 81.6 | Confident | 154 Ų | 154 | 117 Ų | 117 | 58% | 0.581 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -70.4 | -40.7 | 175 | -78.4 | -175.1 | 173.2 | -170.1 | -1.2 | 111.7 | R57 I58 N59 T63 I64 L65 | R57-R61 PolarHBondContact O-N 3.39Å; I58-R61 PolarHBondContact O-N 2.93Å; I58-R61 VanDerWaalsContact O-N 3.1Å; N59-R61 VanDerWaalsContact C-N 3.34Å; N59-R61 PolarHBondContact O-N 3.12Å; R61-T63 PolarHBondContact O-N 2.64Å; R61-I64 PolarHBondContact O-N 3.45Å; R61-L65 VanDerWaalsContact O-CG 3.31Å; R61-L65 WeakPolarHBondContact O-CG 3.36Å; R61-L65 PolarHBondContact O-N 3.19Å |
| 62 | A | 85.7 | Confident | 79.9 | Confident | 37 Ų | 37 | 121.1 Ų | 121.1 | 31% | 0.306 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.2 | -40.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I58 N59 L65 K66 | I58-A62 WeakPolarHBondContact O-CB 3.44Å; I58-A62 PolarHBondContact O-N 2.63Å; N59-A62 PolarHBondContact O-N 2.83Å; A62-L65 PolarHBondContact O-N 3.01Å; A62-K66 WeakPolarHBondContact O-CB 3.4Å; A62-K66 WeakPolarHBondContact O-CG 3.47Å; A62-K66 PolarHBondContact O-N 3.1Å |
| 63 | T | 85.1 | Confident | 78.3 | Confident | 85 Ų | 85 | 126.9 Ų | 126.9 | 52% | 0.521 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -64.7 | -40 | 175.4 | 53.6 | 0 | 0 | 0 | 0 | 112.3 | N59 K60 R61 L65 K66 S67 | N59-T63 WeakPolarHBondContact O-CG2 3.35Å; N59-T63 PolarHBondContact O-N 3.15Å; N59-T63 PolarHBondContact O-OG1 3.19Å; K60-T63 PolarHBondContact O-OG1 3.43Å; R61-T63 PolarHBondContact O-N 2.64Å; T63-L65 VanDerWaalsContact C-N 3.32Å; T63-L65 PolarHBondContact O-N 3.04Å; T63-K66 PolarHBondContact O-N 3.04Å; T63-S67 PolarHBondContact O-N 3.08Å; T63-S67 PolarHBondContact O-OG 3.29Å |
| 64 | I | 83.1 | Confident | 76.7 | Confident | 81 Ų | 81 | 128.8 Ų | 128.8 | 42% | 0.415 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -64.3 | -37.2 | 174 | -65.6 | 164.8 | 0 | 0 | 0 | 111.6 | K60 R61 S67 K68 | K60-I64 HydrophobicContact CG-CD1 4.38Å; K60-I64 VanDerWaalsContact O-CD1 3.31Å; K60-I64 WeakPolarHBondContact O-CD1 3.35Å; K60-I64 VanDerWaalsContact O-CG1 3.24Å; K60-I64 WeakPolarHBondContact O-CG1 3.41Å; K60-I64 PolarHBondContact O-N 3.38Å; R61-I64 PolarHBondContact O-N 3.45Å; I64-S67 PolarHBondContact O-OG 3.29Å; I64-S67 VanDerWaalsContact O-OG 3.07Å; I64-K68 PolarHBondContact O-N 2.77Å |
| 65 | L | 75.9 | Confident | 75.4 | Confident | 106 Ų | 106 | 133.1 Ų | 133.1 | 56% | 0.555 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -74.1 | -36.3 | 177.3 | -70.4 | 172.8 | 0 | 0 | 0 | 111.9 | R61 A62 T63 K68 | R61-L65 VanDerWaalsContact O-CG 3.31Å; R61-L65 WeakPolarHBondContact O-CG 3.36Å; R61-L65 PolarHBondContact O-N 3.19Å; A62-L65 PolarHBondContact O-N 3.01Å; T63-L65 VanDerWaalsContact C-N 3.32Å; T63-L65 PolarHBondContact O-N 3.04Å; L65-K68 CarbonylContact O-C 3.5Å; L65-K68 PolarHBondContact O-N 3.28Å |
| 66 | K | 74.7 | Confident | 74.1 | Confident | 173 Ų | 173 | 131.3 Ų | 131.3 | 75% | 0.752 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65.4 | -38.3 | 174.2 | -77.2 | -179.6 | 179.9 | -175.4 | 0 | 112.1 | A62 T63 K68 | A62-K66 WeakPolarHBondContact O-CB 3.4Å; A62-K66 WeakPolarHBondContact O-CG 3.47Å; A62-K66 PolarHBondContact O-N 3.1Å; T63-K66 PolarHBondContact O-N 3.04Å; K66-K68 VanDerWaalsContact C-N 3.31Å |
| 67 | S | 71.1 | Confident | 73 | Confident | 85 Ų | 85 | 128.7 Ų | 128.7 | 59% | 0.594 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -74.2 | -21.9 | 177.7 | 65.4 | 0 | 0 | 0 | 0 | 113.3 | T63 I64 Y69 | T63-S67 PolarHBondContact O-N 3.08Å; T63-S67 PolarHBondContact O-OG 3.29Å; I64-S67 PolarHBondContact O-OG 3.29Å; I64-S67 VanDerWaalsContact O-OG 3.07Å; S67-Y69 PolarHBondContact O-N 2.89Å |
| 68 | K | 66 | Low | 71.8 | Confident | 108 Ų | 108 | 125.4 Ų | 125.4 | 47% | 0.47 | 59% | 0.593 | S | S | . | * | S | Bend | trans | -93.4 | 92.5 | 171.2 | -73.6 | -175.9 | 177.9 | -178.3 | 0 | 109.6 | I64 L65 K66 R70 | I64-K68 PolarHBondContact O-N 2.77Å; L65-K68 CarbonylContact O-C 3.5Å; L65-K68 PolarHBondContact O-N 3.28Å; K66-K68 VanDerWaalsContact C-N 3.31Å; K68-R70 HydrophobicContact CB-CG 4.18Å; K68-R70 PolarHBondContact O-N 2.88Å |
| 69 | Y | 59.4 | Low | 70.6 | Confident | 214 Ų | 214 | 128.7 Ų | 128.7 | 84% | 0.839 | 60% | 0.604 | S | S | * | * | trans | -54.2 | 82.3 | 163.8 | -71.8 | -84.1 | 0 | 0 | 0 | 110.5 | S67 | S67-Y69 PolarHBondContact O-N 2.89Š| ||
| 70 | R | 58.6 | Low | 69.6 | Low | 167 Ų | 167 | 129.9 Ų | 129.9 | 63% | 0.63 | 61% | 0.609 | S | S | * | * | trans | -94.5 | -10.7 | -176.3 | -90.1 | -178.8 | 166.3 | -172.4 | -6.6 | 113.7 | K68 | K68-R70 HydrophobicContact CB-CG 4.18Å; K68-R70 PolarHBondContact O-N 2.88Å | ||
| 71 | Y | 57.3 | Low | 68.7 | Low | 204 Ų | 204 | 131.6 Ų | 131.6 | 80% | 0.8 | 61% | 0.613 | S | S | * | * | trans | -136.5 | 94.5 | 175.6 | -54.9 | -74.6 | 0 | 0 | 0 | 108.7 | F73 | Y71-F73 PolarHBondContact O-N 3.38Š| ||
| 72 | Q | 55.3 | Low | 68.1 | Low | 168 Ų | 168 | 131.5 Ų | 131.5 | 79% | 0.785 | 62% | 0.624 | S | S | * | * | trans | -74.1 | 115.8 | 151 | -74.3 | -177.9 | 0.2 | 0 | 0 | 105.3 | V74 | Q72-V74 PolarHBondContact O-N 3.4Š| ||
| 73 | F | 55.1 | Low | 67.6 | Low | 200 Ų | 200 | 132.5 Ų | 132.5 | 88% | 0.877 | 63% | 0.626 | S | S | * | * | trans | -60.8 | 99.7 | 160.6 | -78.9 | -85.2 | 0 | 0 | 0 | 106 | Y71 K75 | Y71-F73 PolarHBondContact O-N 3.38Å; F73-K75 PolarHBondContact O-N 3.27Å | ||
| 74 | V | 57.5 | Low | 67.1 | Low | 123 Ų | 123 | 132.5 Ų | 132.5 | 75% | 0.745 | 63% | 0.63 | S | S | * | * | trans | -54.6 | 118.1 | 170.3 | 177.3 | 0 | 0 | 0 | 0 | 105.2 | Q72 S76 | Q72-V74 PolarHBondContact O-N 3.4Å; V74-S76 PolarHBondContact O-N 3.46Å | ||
| 75 | K | 62.7 | Low | 66.4 | Low | 146 Ų | 146 | 134.8 Ų | 134.8 | 64% | 0.635 | 65% | 0.65 | S | S | * | * | trans | -51.5 | 130 | 175.2 | -70 | 178.5 | -178.5 | 174.7 | 0 | 106.5 | F73 I77 | F73-K75 PolarHBondContact O-N 3.27Å; K75-I77 PolarHBondContact O-N 3.19Å | ||
| 76 | S | 64 | Low | 66.2 | Low | 64 Ų | 64 | 133.7 Ų | 133.7 | 45% | 0.448 | 67% | 0.665 | S | S | . | * | trans | -42.4 | 133 | 174.8 | 173.3 | 0 | 0 | 0 | 0 | 109.6 | V74 F78 K79 L80 | V74-S76 PolarHBondContact O-N 3.46Å; S76-F78 PolarHBondContact O-N 3.27Å; S76-F78 VanDerWaalsContact OG-CD2 3.31Å; S76-F78 WeakPolarHBondContact OG-CD2 3.37Å; S76-F78 PolarHBondContact OG-N 3.1Å; S76-K79 WeakPolarHBondContact O-CA 3.4Å; S76-K79 WeakPolarHBondContact O-CB 3.24Å; S76-K79 PolarHBondContact O-N 3.41Å; S76-L80 PolarHBondContact O-N 2.88Å | ||
| 77 | I | 68.9 | Low | 66 | Low | 101 Ų | 101 | 127.7 Ų | 127.7 | 52% | 0.518 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -51.4 | -31.3 | 176.3 | 54.4 | 170.1 | 0 | 0 | 0 | 111.1 | K75 K79 L80 Y81 | K75-I77 PolarHBondContact O-N 3.19Å; I77-K79 VanDerWaalsContact C-N 3.26Å; I77-K79 PolarHBondContact O-N 2.85Å; I77-L80 WeakPolarHBondContact O-CB 3.45Å; I77-L80 PolarHBondContact O-N 2.8Å; I77-L80 VanDerWaalsContact O-N 3.08Å; I77-Y81 HydrophobicContact CB-CD2 4.44Å; I77-Y81 WeakPolarHBondContact O-CD2 3.39Å; I77-Y81 PolarHBondContact O-N 3.28Å |
| 78 | F | 68 | Low | 66.1 | Low | 97 Ų | 97 | 134.2 Ų | 134.2 | 43% | 0.425 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -61.7 | -32.3 | 174.9 | -60.5 | -64 | 0 | 0 | 0 | 113.1 | S76 N82 V83 | S76-F78 PolarHBondContact O-N 3.27Å; S76-F78 VanDerWaalsContact OG-CD2 3.31Å; S76-F78 WeakPolarHBondContact OG-CD2 3.37Å; S76-F78 PolarHBondContact OG-N 3.1Å; F78-N82 PolarHBondContact O-N 2.85Å; F78-N82 VanDerWaalsContact O-N 3.1Å; F78-V83 HydrophobicContact CB-CB 4.34Å; F78-V83 HydrophobicContact CB-CG2 4.48Å; F78-V83 HydrophobicContact CD1-CB 3.85Å; F78-V83 HydrophobicContact CD1-CG1 4.35Å; F78-V83 HydrophobicContact CD1-CG2 3.93Å; F78-V83 PolarHBondContact O-N 3.06Å |
| 79 | K | 66.4 | Low | 66.1 | Low | 152 Ų | 152 | 135.4 Ų | 135.4 | 66% | 0.661 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -79.6 | -25.5 | 175.5 | -161.8 | 169.3 | -171.4 | 171.1 | 0 | 112.7 | S76 I77 | S76-K79 WeakPolarHBondContact O-CA 3.4Å; S76-K79 WeakPolarHBondContact O-CB 3.24Å; S76-K79 PolarHBondContact O-N 3.41Å; I77-K79 VanDerWaalsContact C-N 3.26Å; I77-K79 PolarHBondContact O-N 2.85Å |
| 80 | L | 68.2 | Low | 66.4 | Low | 114 Ų | 114 | 127.5 Ų | 127.5 | 60% | 0.597 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -72.2 | -36.2 | 172.3 | -81.3 | 147.2 | 0 | 0 | 0 | 111.5 | S76 I77 | S76-L80 PolarHBondContact O-N 2.88Å; I77-L80 WeakPolarHBondContact O-CB 3.45Å; I77-L80 PolarHBondContact O-N 2.8Å; I77-L80 VanDerWaalsContact O-N 3.08Å |
| 81 | Y | 73.5 | Confident | 66.6 | Low | 185 Ų | 185 | 127.1 Ų | 127.1 | 73% | 0.725 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.4 | 11.5 | -176.7 | -63.9 | -70.3 | 0 | 0 | 0 | 114.7 | I77 V83 | I77-Y81 HydrophobicContact CB-CD2 4.44Å; I77-Y81 WeakPolarHBondContact O-CD2 3.39Å; I77-Y81 PolarHBondContact O-N 3.28Å; Y81-V83 PolarHBondContact O-N 3.32Å |
| 82 | N | 73.2 | Confident | 66.7 | Low | 151 Ų | 151 | 121 Ų | 121 | 81% | 0.807 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 47.7 | 41.7 | -177.6 | -75 | -14.1 | 0 | 0 | 0 | 114 | F78 | F78-N82 PolarHBondContact O-N 2.85Å; F78-N82 VanDerWaalsContact O-N 3.1Å |
| 83 | V | 74.8 | Confident | 67 | Low | 58 Ų | 58 | 115.7 Ų | 115.7 | 35% | 0.352 | 63% | 0.632 | S | S | . | * | P | Polyproline II helix | trans | -81 | 132.9 | -177.7 | -153.8 | 0 | 0 | 0 | 0 | 109.7 | F78 Y81 S87 | F78-V83 HydrophobicContact CB-CB 4.34Å; F78-V83 HydrophobicContact CB-CG2 4.48Å; F78-V83 HydrophobicContact CD1-CB 3.85Å; F78-V83 HydrophobicContact CD1-CG1 4.35Å; F78-V83 HydrophobicContact CD1-CG2 3.93Å; F78-V83 PolarHBondContact O-N 3.06Å; Y81-V83 PolarHBondContact O-N 3.32Å; V83-S87 WeakPolarHBondContact CG1-OG 3.34Å |
| 84 | S | 75.1 | Confident | 67.3 | Low | 85 Ų | 85 | 113.8 Ų | 113.8 | 59% | 0.594 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 137.2 | 179.5 | -172.8 | 0 | 0 | 0 | 0 | 111.1 | G86 S87 | S84-G86 PolarHBondContact O-N 3.09Å; S84-S87 WeakPolarHBondContact O-CB 3.44Å; S84-S87 PolarHBondContact O-N 3.17Å; S84-S87 VanDerWaalsContact O-N 3.09Å; S84-S87 PolarHBondContact O-OG 2.97Å |
| 85 | P | 69.6 | Low | 67.4 | Low | 130 Ų | 130 | 114.1 Ų | 114.1 | 84% | 0.844 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.9 | 131.6 | 173.6 | 22.8 | -32.6 | 0 | 0 | 0 | 110.6 | ||
| 86 | G | 71 | Confident | 67.2 | Low | 83 Ų | 83 | 110.1 Ų | 110.1 | 86% | 0.856 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 95 | -3.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | S84 R88 | S84-G86 PolarHBondContact O-N 3.09Å; G86-R88 PolarHBondContact O-N 3.37Å |
| 87 | S | 70.4 | Confident | 66.6 | Low | 46 Ų | 46 | 113.7 Ų | 113.7 | 32% | 0.322 | 63% | 0.633 | S | S | . | * | trans | -64.2 | 126.3 | 171 | 58.9 | 0 | 0 | 0 | 0 | 111.8 | V83 S84 | V83-S87 WeakPolarHBondContact CG1-OG 3.34Å; S84-S87 WeakPolarHBondContact O-CB 3.44Å; S84-S87 PolarHBondContact O-N 3.17Å; S84-S87 VanDerWaalsContact O-N 3.09Å; S84-S87 PolarHBondContact O-OG 2.97Å | ||
| 88 | R | 73.7 | Confident | 65.9 | Low | 223 Ų | 223 | 113 Ų | 113 | 84% | 0.842 | 63% | 0.633 | S | S | * | * | trans | -115.2 | 116.8 | 172.8 | -177.9 | 175.3 | 177.5 | 170.6 | -0.7 | 109 | G86 | G86-R88 PolarHBondContact O-N 3.37Š| ||
| 89 | E | 64.7 | Low | 64.7 | Low | 133 Ų | 133 | 115.3 Ų | 115.3 | 62% | 0.621 | 65% | 0.65 | S | S | * | * | trans | -70.6 | 136.6 | 169.5 | -169.7 | 175.9 | -173.7 | 0 | 0 | 109.3 | F91 | E89-F91 HydrophobicContact CG-CZ 4.47Š| ||
| 90 | S | 65.8 | Low | 63.9 | Low | 47 Ų | 47 | 112 Ų | 112 | 33% | 0.329 | 65% | 0.651 | S | S | . | * | trans | -106.7 | 120.9 | 173.4 | 60.1 | 0 | 0 | 0 | 0 | 109.8 | F94 | S90-F94 WeakPolarHBondContact CB-O 3.42Å; S90-F94 PolarHBondContact OG-O 3.08Å | ||
| 91 | F | 62.7 | Low | 62.9 | Low | 159 Ų | 159 | 113 Ų | 113 | 70% | 0.697 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -83.9 | 133.7 | 178.2 | -66.6 | -81.1 | 0 | 0 | 0 | 110.3 | E89 | E89-F91 HydrophobicContact CG-CZ 4.47Š|
| 92 | G | 59.6 | Low | 61.5 | Low | 77 Ų | 77 | 110.8 Ų | 110.8 | 79% | 0.794 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | 77.8 | 31.7 | 168 | 0 | 0 | 0 | 0 | 0 | 116 | F94 | G92-F94 PolarHBondContact O-N 3.47Š|
| 93 | G | 62.7 | Low | 60.2 | Low | 56 Ų | 56 | 109.2 Ų | 109.2 | 58% | 0.577 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | 76.8 | 1.6 | 176 | 0 | 0 | 0 | 0 | 0 | 115.1 | S96 | G93-S96 PolarHBondContact O-N 3.03Š|
| 94 | F | 61.3 | Low | 58.7 | Low | 160 Ų | 160 | 110.7 Ų | 110.7 | 70% | 0.702 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | 146.4 | 165.4 | -80.9 | -85.8 | 0 | 0 | 0 | 109.6 | S90 G92 S96 | S90-F94 WeakPolarHBondContact CB-O 3.42Å; S90-F94 PolarHBondContact OG-O 3.08Å; G92-F94 PolarHBondContact O-N 3.47Å; F94-S96 PolarHBondContact O-N 3.45Å |
| 95 | N | 58.8 | Low | 57.5 | Low | 129 Ų | 129 | 117.4 Ų | 117.4 | 69% | 0.69 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 50.3 | 36.3 | -174.5 | -57.3 | -16.7 | 0 | 0 | 0 | 114 | ||
| 96 | S | 58.4 | Low | 56.6 | Low | 63 Ų | 63 | 116 Ų | 116 | 44% | 0.441 | 68% | 0.676 | S | S | . | * | trans | -55.7 | 134.9 | 164 | 52.7 | 0 | 0 | 0 | 0 | 108 | G93 F94 T98 | G93-S96 PolarHBondContact O-N 3.03Å; F94-S96 PolarHBondContact O-N 3.45Å; S96-T98 PolarHBondContact O-N 3.36Å; S96-T98 PolarHBondContact O-OG1 2.82Å; S96-T98 PolarHBondContact OG-OG1 3.37Å | ||
| 97 | P | 52.8 | Low | 55.5 | Low | 138 Ų | 138 | 120.1 Ų | 120.1 | 90% | 0.896 | 67% | 0.673 | S | S | * | * | trans | -67.9 | 82.8 | 172.3 | 28.9 | -32.4 | 0 | 0 | 0 | 106.8 | ||||
| 98 | T | 52.7 | Low | 54.4 | Low | 86 Ų | 86 | 124.2 Ų | 124.2 | 53% | 0.528 | 70% | 0.696 | S | S | . | * | trans | -121.2 | 113 | 179.8 | 8.8 | 0 | 0 | 0 | 0 | 107.3 | S96 | S96-T98 PolarHBondContact O-N 3.36Å; S96-T98 PolarHBondContact O-OG1 2.82Å; S96-T98 PolarHBondContact OG-OG1 3.37Å | ||
| 99 | N | 43.1 | Very low | 53 | Low | 147 Ų | 147 | 121 Ų | 121 | 79% | 0.786 | 70% | 0.695 | S | S | * | * | S | Bend | trans | 92.2 | 131.4 | 159.5 | -44.2 | -36.3 | 0 | 0 | 0 | 114.9 | ||
| 100 | A | 50.4 | Low | 52.1 | Low | 82 Ų | 82 | 122 Ų | 122 | 68% | 0.678 | 71% | 0.705 | S | S | * | * | trans | 58.9 | 96 | 138.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 101 | D | 46.8 | Very low | 50.7 | Low | 135 Ų | 135 | 125 Ų | 125 | 72% | 0.722 | 73% | 0.725 | S | S | * | * | -146 | 114.7 | 54 | -65.4 | -44.6 | 0 | 0 | 0 | 111.6 | I103 | D101-I103 HydrophobicContact CB-CG1 3.74Å; D101-I103 PolarHBondContact O-N 3.26Å | |||
| 102 | T | 43.8 | Very low | 49.9 | Very low | 138 Ų | 138 | 123.1 Ų | 123.1 | 85% | 0.847 | 73% | 0.729 | S | S | * | * | trans | -64 | 81.9 | 145.5 | -52.5 | 0 | 0 | 0 | 0 | 106.8 | P104 | T102-P104 VanDerWaalsContact O-CD 3.31Å; T102-P104 WeakPolarHBondContact O-CD 3.31Å | ||
| 103 | I | 45.5 | Very low | 49 | Very low | 119 Ų | 119 | 125.9 Ų | 125.9 | 61% | 0.61 | 73% | 0.726 | S | S | * | * | trans | -67.2 | 116.9 | 161 | -57.6 | -178.9 | 0 | 0 | 0 | 105 | D101 K105 | D101-I103 HydrophobicContact CB-CG1 3.74Å; D101-I103 PolarHBondContact O-N 3.26Å; I103-K105 PolarHBondContact O-N 2.94Å | ||
| 104 | P | 43.7 | Very low | 47.9 | Very low | 88 Ų | 88 | 126.8 Ų | 126.8 | 57% | 0.571 | 72% | 0.724 | S | S | * | * | trans | -59.4 | 138.5 | 175.9 | -12.1 | 25.4 | 0 | 0 | 0 | 108.2 | T102 S106 | T102-P104 VanDerWaalsContact O-CD 3.31Å; T102-P104 WeakPolarHBondContact O-CD 3.31Å; P104-S106 PolarHBondContact O-N 3.26Å | ||
| 105 | K | 50.1 | Low | 46.9 | Very low | 227 Ų | 227 | 130 Ų | 130 | 99% | 0.987 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.4 | 30.6 | -179.2 | -72.5 | -179 | 170.7 | 179 | 0 | 114.7 | I103 | I103-K105 PolarHBondContact O-N 2.94Š|
| 106 | S | 51.8 | Low | 46.3 | Very low | 99 Ų | 99 | 132.4 Ų | 132.4 | 69% | 0.692 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117 | 6.9 | -172.7 | 60.3 | 0 | 0 | 0 | 0 | 115.7 | P104 | P104-S106 PolarHBondContact O-N 3.26Š|
| 107 | Q | 46.8 | Very low | 45.6 | Very low | 171 Ų | 171 | 134.6 Ų | 134.6 | 80% | 0.799 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -136.8 | 14.6 | -170.4 | -116.6 | -174.9 | 3.9 | 0 | 0 | 119.6 | ||
| 108 | V | 47.3 | Very low | 44.9 | Very low | 132 Ų | 132 | 135.5 Ų | 135.5 | 80% | 0.8 | 75% | 0.753 | S | S | * | * | trans | -127.6 | 73 | 171.6 | -166.8 | 0 | 0 | 0 | 0 | 110.7 | N110 | V108-N110 PolarHBondContact O-N 3.39Š| ||
| 109 | N | 43.7 | Very low | 44.5 | Very low | 154 Ų | 154 | 143 Ų | 143 | 82% | 0.824 | 77% | 0.771 | S | S | * | * | trans | -73.5 | 112.1 | 154.1 | -72.3 | -23.6 | 0 | 0 | 0 | 107.1 | ||||
| 110 | N | 45.7 | Very low | 44.5 | Very low | 156 Ų | 156 | 141.9 Ų | 141.9 | 83% | 0.834 | 77% | 0.765 | S | S | * | * | trans | 170.2 | 98.3 | 142 | -80 | -28.8 | 0 | 0 | 0 | 108.5 | V108 | V108-N110 PolarHBondContact O-N 3.39Š| ||
| 111 | S | 37.7 | Very low | 44.1 | Very low | 108 Ų | 108 | 145.4 Ų | 145.4 | 76% | 0.755 | 77% | 0.773 | S | S | * | * | trans | -69.1 | 144.9 | 160.2 | -168.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 112 | P | 45.4 | Very low | 44.1 | Very low | 120 Ų | 120 | 144.2 Ų | 144.2 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | -139.9 | 129.2 | 90.1 | 28.1 | -8.4 | 0 | 0 | 0 | 111.9 | |||||
| 113 | D | 39.6 | Very low | 43.9 | Very low | 135 Ų | 135 | 144 Ų | 144 | 72% | 0.722 | 77% | 0.774 | S | S | * | * | 85.8 | 124.5 | 87.2 | -159.4 | 14.7 | 0 | 0 | 0 | 114.3 | |||||
| 114 | S | 40.5 | Very low | 43.6 | Very low | 76 Ų | 76 | 143.3 Ų | 143.3 | 53% | 0.531 | 78% | 0.778 | S | S | . | * | trans | 74.3 | 112.7 | 151.3 | 73.6 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 115 | R | 40.4 | Very low | 43.5 | Very low | 228 Ų | 228 | 148.3 Ų | 148.3 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | 67.1 | 93.9 | 132.3 | -56.9 | 171.7 | -148.3 | -164.6 | 6.7 | 117.4 | ||||
| 116 | L | 45 | Very low | 43.2 | Very low | 178 Ų | 178 | 147.2 Ų | 147.2 | 93% | 0.932 | 79% | 0.785 | S | S | * | * | trans | -98.5 | 120.5 | 145.5 | -71.1 | 178.4 | 0 | 0 | 0 | 109.1 | ||||
| 117 | P | 45.3 | Very low | 42.9 | Very low | 109 Ų | 109 | 148 Ų | 148 | 71% | 0.708 | 79% | 0.79 | S | S | * | * | trans | -81.7 | 152.7 | 178.8 | 33.6 | -31.7 | 0 | 0 | 0 | 111 | R119 | P117-R119 PolarHBondContact O-N 3.32Š| ||
| 118 | N | 38.5 | Very low | 43 | Very low | 157 Ų | 157 | 149.1 Ų | 149.1 | 84% | 0.84 | 80% | 0.796 | S | S | * | * | trans | -36.8 | 120.5 | 158.3 | -101.8 | -30.5 | 0 | 0 | 0 | 110.7 | ||||
| 119 | R | 43.8 | Very low | 43 | Very low | 244 Ų | 244 | 148.2 Ų | 148.2 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | trans | -133.8 | 98.3 | 160.1 | -142.6 | -176.2 | -174.4 | -169.6 | 1.1 | 109.7 | P117 | P117-R119 PolarHBondContact O-N 3.32Š| ||
| 120 | D | 42.6 | Very low | 43.2 | Very low | 124 Ų | 124 | 150 Ų | 150 | 66% | 0.663 | 80% | 0.796 | S | S | * | * | trans | -48.8 | 142.6 | 163.2 | -63.7 | -61.3 | 0 | 0 | 0 | 111.5 | ||||
| 121 | N | 42.3 | Very low | 43.7 | Very low | 155 Ų | 155 | 150.7 Ų | 150.7 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | 58.6 | 92.6 | 150.3 | -56.1 | -28.9 | 0 | 0 | 0 | 118 | ||||
| 122 | S | 46.1 | Very low | 44.5 | Very low | 111 Ų | 111 | 147.4 Ų | 147.4 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | trans | -155.1 | 111.6 | 141.2 | 62.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 123 | V | 40.8 | Very low | 45 | Very low | 134 Ų | 134 | 153.7 Ų | 153.7 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | trans | 48.2 | 113.7 | 136.8 | -171.7 | 0 | 0 | 0 | 0 | 117.5 | E125 | V123-E125 PolarHBondContact O-N 3.43Å; V123-E125 VanDerWaalsContact O-N 3.14Å | ||
| 124 | C | 38.2 | Very low | 45.9 | Very low | 104 Ų | 104 | 150.9 Ų | 150.9 | 70% | 0.703 | 79% | 0.786 | S | S | * | * | trans | -64.5 | 100.8 | 170.5 | -157.3 | 0 | 0 | 0 | 0 | 110.7 | Y126 | C124-Y126 PolarHBondContact O-N 3.22Å; C124-Y126 WeakPolarHBondContact SG-CD2 3.31Å; C124-Y126 VanDerWaalsContact SG-CE2 3.53Å | ||
| 125 | E | 42.7 | Very low | 46.6 | Very low | 192 Ų | 192 | 151 Ų | 151 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | trans | -80.9 | 90.2 | 162 | -83.6 | -173.1 | 160.9 | 0 | 0 | 109.1 | V123 | V123-E125 PolarHBondContact O-N 3.43Å; V123-E125 VanDerWaalsContact O-N 3.14Å | ||
| 126 | Y | 43 | Very low | 47.5 | Very low | 204 Ų | 204 | 149.3 Ų | 149.3 | 80% | 0.8 | 79% | 0.786 | S | S | * | * | trans | -78.2 | 118.7 | 153.9 | -93.1 | -93.2 | 0 | 0 | 0 | 107.3 | C124 | C124-Y126 PolarHBondContact O-N 3.22Å; C124-Y126 WeakPolarHBondContact SG-CD2 3.31Å; C124-Y126 VanDerWaalsContact SG-CE2 3.53Å | ||
| 127 | S | 45.2 | Very low | 48.1 | Very low | 116 Ų | 116 | 145.4 Ų | 145.4 | 81% | 0.811 | 77% | 0.77 | S | S | * | * | trans | 154.5 | 85.2 | 143.1 | -66.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 128 | Q | 48.5 | Very low | 48.8 | Very low | 195 Ų | 195 | 143.4 Ų | 143.4 | 91% | 0.911 | 76% | 0.758 | S | S | * | * | trans | -107.5 | 111.5 | 145.1 | -82.5 | -176.3 | -8.1 | 0 | 0 | 106.9 | F130 | Q128-F130 PolarHBondContact O-N 3.37Š| ||
| 129 | S | 48.3 | Very low | 49.5 | Very low | 112 Ų | 112 | 141.1 Ų | 141.1 | 78% | 0.783 | 75% | 0.745 | S | S | * | * | trans | -57.4 | 115.3 | 171.8 | 42.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 130 | F | 48.4 | Very low | 50 | Low | 192 Ų | 192 | 139.8 Ų | 139.8 | 84% | 0.842 | 74% | 0.74 | S | S | * | * | trans | -91.3 | 111.1 | 175.5 | -150.3 | -95.5 | 0 | 0 | 0 | 108.2 | Q128 G132 | Q128-F130 PolarHBondContact O-N 3.37Å; F130-G132 PolarHBondContact O-N 3.3Å | ||
| 131 | D | 54.6 | Low | 50.4 | Low | 171 Ų | 171 | 142.1 Ų | 142.1 | 91% | 0.914 | 74% | 0.744 | S | S | * | * | trans | -74 | 51.2 | 170.4 | -79.1 | -38.5 | 0 | 0 | 0 | 111.2 | ||||
| 132 | G | 54.6 | Low | 51 | Low | 38 Ų | 38 | 144.2 Ų | 144.2 | 39% | 0.392 | 74% | 0.741 | S | S | . | * | trans | -112.6 | 127.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | F130 A134 | F130-G132 PolarHBondContact O-N 3.3Å; G132-A134 PolarHBondContact O-N 3.3Å | ||
| 133 | R | 56.4 | Low | 51.3 | Low | 252 Ų | 252 | 146.8 Ų | 146.8 | 95% | 0.951 | 74% | 0.738 | S | S | * | * | trans | -38 | 118.6 | 177.2 | -149.9 | 178 | -165.5 | -171.8 | 5.3 | 111.4 | S135 | R133-S135 PolarHBondContact O-N 3.5Å; R133-S135 VanDerWaalsContact O-N 3.12Å | ||
| 134 | A | 58.8 | Low | 51.9 | Low | 77 Ų | 77 | 148.8 Ų | 148.8 | 64% | 0.636 | 74% | 0.736 | S | S | * | * | trans | -53.6 | 119.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | G132 | G132-A134 PolarHBondContact O-N 3.3Š| ||
| 135 | S | 55.4 | Low | 52.5 | Low | 79 Ų | 79 | 152.1 Ų | 152.1 | 55% | 0.552 | 74% | 0.741 | S | S | * | * | trans | -65.4 | 136.6 | 177.6 | -157.7 | 0 | 0 | 0 | 0 | 109.9 | R133 T137 S138 | R133-S135 PolarHBondContact O-N 3.5Å; R133-S135 VanDerWaalsContact O-N 3.12Å; S135-T137 PolarHBondContact O-N 3.43Å; S135-S138 WeakPolarHBondContact O-CB 3.24Å; S135-S138 PolarHBondContact O-N 2.94Å | ||
| 136 | K | 59.8 | Low | 53 | Low | 192 Ų | 192 | 150.9 Ų | 150.9 | 84% | 0.835 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | -17 | -175.6 | -69.4 | 179.9 | 177.9 | 177.5 | 0 | 113.6 | ||
| 137 | T | 57.8 | Low | 53.3 | Low | 95 Ų | 95 | 151.9 Ų | 151.9 | 58% | 0.583 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.4 | -24.5 | 175.9 | 51.5 | 0 | 0 | 0 | 0 | 114 | S135 I139 R140 | S135-T137 PolarHBondContact O-N 3.43Å; T137-I139 VanDerWaalsContact C-N 3.29Å; T137-I139 PolarHBondContact O-N 3.26Å; T137-R140 PolarHBondContact O-N 3Å |
| 138 | S | 58.3 | Low | 53.5 | Low | 68 Ų | 68 | 155.4 Ų | 155.4 | 48% | 0.476 | 74% | 0.739 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66 | -30.3 | 176.7 | 159.8 | 0 | 0 | 0 | 0 | 112.6 | S135 R140 F141 | S135-S138 WeakPolarHBondContact O-CB 3.24Å; S135-S138 PolarHBondContact O-N 2.94Å; S138-R140 VanDerWaalsContact C-N 3.3Å; S138-R140 PolarHBondContact O-N 2.68Å; S138-F141 PolarHBondContact O-N 3.48Å |
| 139 | I | 53.1 | Low | 53.4 | Low | 108 Ų | 108 | 154.9 Ų | 154.9 | 55% | 0.554 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -70.3 | -27.3 | -178 | -57.3 | 171.7 | 0 | 0 | 0 | 111.6 | T137 F141 R142 | T137-I139 VanDerWaalsContact C-N 3.29Å; T137-I139 PolarHBondContact O-N 3.26Å; I139-F141 VanDerWaalsContact C-N 3.27Å; I139-F141 PolarHBondContact O-N 3.07Å; I139-R142 PolarHBondContact O-N 3.32Å |
| 140 | R | 55.1 | Low | 53.2 | Low | 216 Ų | 216 | 155.2 Ų | 155.2 | 82% | 0.815 | 74% | 0.738 | S | S | * | * | H | α-helix | trans | -67.8 | -24.6 | -178.6 | -89.8 | -174.9 | 174.9 | -179.9 | -0.8 | 113.5 | T137 S138 | T137-R140 PolarHBondContact O-N 3Å; S138-R140 VanDerWaalsContact C-N 3.3Å; S138-R140 PolarHBondContact O-N 2.68Å |
| 141 | F | 50.9 | Low | 53.1 | Low | 173 Ų | 173 | 155.7 Ų | 155.7 | 76% | 0.759 | 74% | 0.74 | S | S | * | * | H | α-helix | trans | -89.6 | -23.6 | 179.3 | -68.2 | -78.4 | 0 | 0 | 0 | 113.8 | S138 I139 K143 | S138-F141 PolarHBondContact O-N 3.48Å; I139-F141 VanDerWaalsContact C-N 3.27Å; I139-F141 PolarHBondContact O-N 3.07Å; F141-K143 VanDerWaalsContact C-N 3.25Å; F141-K143 PolarHBondContact O-N 3.48Å |
| 142 | R | 55.5 | Low | 52.6 | Low | 200 Ų | 200 | 157.1 Ų | 157.1 | 76% | 0.755 | 74% | 0.738 | S | S | * | * | H | α-helix | trans | -67.3 | -25.4 | 172.6 | -98.2 | -174.7 | -176.6 | 176.4 | 2.4 | 113.4 | I139 F144 | I139-R142 PolarHBondContact O-N 3.32Å; R142-F144 PolarHBondContact O-N 3.35Å |
| 143 | K | 53.1 | Low | 52.4 | Low | 164 Ų | 164 | 164.5 Ų | 164.5 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -2.3 | -175.1 | -126.5 | 176.3 | -175.2 | 177.6 | 0 | 115 | F141 | F141-K143 VanDerWaalsContact C-N 3.25Å; F141-K143 PolarHBondContact O-N 3.48Å |
| 144 | F | 51.4 | Low | 52.3 | Low | 177 Ų | 177 | 159.3 Ų | 159.3 | 78% | 0.776 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.9 | -20.6 | -177.6 | -141.3 | -97.7 | 0 | 0 | 0 | 114.1 | R142 | R142-F144 PolarHBondContact O-N 3.35Š|
| 145 | E | 52.4 | Low | 51.5 | Low | 173 Ų | 173 | 161.3 Ų | 161.3 | 81% | 0.808 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -23.9 | 178.2 | -76.4 | -169.3 | 147.9 | 0 | 0 | 114 | R147 | E145-R147 VanDerWaalsContact C-N 3.29Å; E145-R147 PolarHBondContact O-N 2.93Å |
| 146 | E | 52.9 | Low | 51.5 | Low | 166 Ų | 166 | 167.1 Ų | 167.1 | 78% | 0.776 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -78.4 | -4.1 | -178.3 | -73.8 | 179.3 | 168.5 | 0 | 0 | 114.8 | K148 | E146-K148 PolarHBondContact O-N 3.48Š|
| 147 | R | 48.1 | Very low | 51 | Low | 226 Ų | 226 | 165.9 Ų | 165.9 | 85% | 0.853 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -88.8 | 8.2 | -179.2 | -76.4 | -170.5 | 174.3 | -173.5 | -1.3 | 115.2 | E145 | E145-R147 VanDerWaalsContact C-N 3.29Å; E145-R147 PolarHBondContact O-N 2.93Å |
| 148 | K | 49.7 | Very low | 50.4 | Low | 190 Ų | 190 | 171.7 Ų | 171.7 | 83% | 0.826 | 78% | 0.781 | S | S | * | * | G | 310 helix | trans | -108.4 | 8.9 | -172.2 | -79.5 | -84.3 | -178.6 | 169.3 | 0 | 115.8 | E146 | E146-K148 PolarHBondContact O-N 3.48Š|
| 149 | Q | 46.7 | Very low | 50.2 | Low | 184 Ų | 184 | 179.9 Ų | 179.9 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -132.4 | 144.7 | 175.4 | -61 | -165.7 | 7.5 | 0 | 0 | 112.2 | ||
| 150 | S | 43.7 | Very low | 50.2 | Low | 118 Ų | 118 | 183.5 Ų | 183.5 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | trans | 88.7 | 63.2 | 178.7 | -162.2 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 151 | K | 47.1 | Very low | 50.6 | Low | 203 Ų | 203 | 183 Ų | 183 | 88% | 0.883 | 82% | 0.82 | S | S | * | * | trans | -137.2 | 61 | 146.5 | -72.5 | -153.6 | -179.8 | -170.9 | 0 | 111.1 | ||||
| 152 | F | 44.5 | Very low | 50.4 | Low | 200 Ų | 200 | 184.7 Ų | 184.7 | 88% | 0.877 | 83% | 0.827 | S | S | * | * | trans | -146.1 | 97.6 | 161.4 | -86.3 | -80.7 | 0 | 0 | 0 | 107.8 | ||||
| 153 | K | 50.9 | Low | 50.6 | Low | 194 Ų | 194 | 184.8 Ų | 184.8 | 84% | 0.843 | 83% | 0.833 | S | S | * | * | trans | 177.5 | 121.8 | 139.4 | -98.4 | 163 | -177.2 | -176.6 | 0 | 111.5 | ||||
| 154 | N | 53.3 | Low | 50.5 | Low | 142 Ų | 142 | 186.8 Ų | 186.8 | 76% | 0.759 | 84% | 0.841 | S | S | * | * | trans | 89.2 | 102 | 148.9 | -53.9 | -15.8 | 0 | 0 | 0 | 118.4 | ||||
| 155 | P | 42.8 | Very low | 50.6 | Low | 120 Ų | 120 | 190.2 Ų | 190.2 | 78% | 0.779 | 87% | 0.866 | S | S | * | * | trans | -82.8 | 128.1 | 149.1 | 33.4 | -24.2 | 0 | 0 | 0 | 108.3 | ||||
| 156 | K | 53.7 | Low | 50.5 | Low | 200 Ų | 200 | 191.1 Ų | 191.1 | 87% | 0.87 | 87% | 0.869 | S | S | * | * | trans | -176.5 | 125.4 | 152 | -102.9 | 162.4 | -166.1 | -169.6 | 0 | 113.3 | ||||
| 157 | H | 49.5 | Very low | 50.3 | Low | 166 Ų | 166 | 192.4 Ų | 192.4 | 77% | 0.769 | 87% | 0.874 | S | S | * | * | trans | 72.6 | 114.2 | 143.6 | -91.7 | -49.3 | 0 | 0 | 0 | 123 | ||||
| 158 | R | 46.1 | Very low | 50.5 | Low | 217 Ų | 217 | 190.6 Ų | 190.6 | 82% | 0.819 | 88% | 0.875 | S | S | * | * | 75.4 | 111.5 | 115.5 | -164.2 | 177 | -175.6 | 174.4 | 0.8 | 117.7 | |||||
| 159 | R | 54.5 | Low | 50.5 | Low | 240 Ų | 240 | 190.6 Ų | 190.6 | 91% | 0.906 | 88% | 0.878 | S | S | * | * | -166.1 | 115.9 | 122.7 | -108.5 | 168.3 | 172.2 | 178.2 | -2.3 | 111.3 | |||||
| 160 | E | 52 | Low | 50.8 | Low | 185 Ų | 185 | 191 Ų | 191 | 86% | 0.864 | 88% | 0.879 | S | S | * | * | trans | -57.9 | 141 | 161.5 | -65.7 | 177.8 | 145.8 | 0 | 0 | 110.1 | ||||
| 161 | K | 63 | Low | 51.2 | Low | 205 Ų | 205 | 195.9 Ų | 195.9 | 89% | 0.891 | 88% | 0.883 | S | S | * | * | trans | -126 | 108.1 | 159 | -80 | -168.6 | 176.2 | -179.8 | 0 | 108.9 | ||||
| 162 | K | 48.2 | Very low | 51.5 | Low | 208 Ų | 208 | 195.4 Ų | 195.4 | 90% | 0.904 | 88% | 0.883 | S | S | * | * | trans | -63.8 | 134.7 | 155.3 | -81.5 | 178.5 | 169.3 | 176.4 | 0 | 109.9 | ||||
| 163 | K | 59.2 | Low | 52.1 | Low | 203 Ų | 203 | 195 Ų | 195 | 88% | 0.883 | 88% | 0.884 | S | S | * | * | trans | -159.1 | 99.9 | 149.7 | -97 | -174.4 | 175.5 | -173.1 | 0 | 104.9 | ||||
| 164 | K | 50.8 | Low | 52.2 | Low | 206 Ų | 206 | 195.1 Ų | 195.1 | 90% | 0.896 | 89% | 0.887 | S | S | * | * | 38.3 | 96.8 | 90.4 | -78.1 | -159.8 | 178.7 | -170.3 | 0 | 113.1 | |||||
| 165 | L | 52.9 | Low | 52.1 | Low | 249 Ų | 249 | 199.9 Ų | 199.9 | 100% | 1.304 | 90% | 0.899 | S | S | * | * | -140.7 | 0 | 125.7 | -103.7 | 156.7 | 0 | 0 | 0 | 106.7 |
Retrieved 165 of 165 residues in 33.8 ms
(Link to these results)