| 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 | 75.3 | Confident | 89.7 | Confident | 189 Ų | 189 | 120.6 Ų | 120.6 | 93% | 0.931 | 61% | 0.608 | S | S | * | * | 0 | -44.5 | 0 | -57 | -45.7 | 179.2 | 0 | 0 | 113.3 | L3 F4 | M1-L3 PolarHBondContact O-N 2.91Å; M1-F4 PolarHBondContact O-N 3.43Å | |||
| 2 | Q | 86.7 | Confident | 89.8 | Confident | 160 Ų | 160 | 124.8 Ų | 124.8 | 75% | 0.748 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -60.4 | -37.9 | -177.1 | -165.3 | 165.7 | 4.9 | 0 | 0 | 114.8 | F4 I5 V6 | Q2-F4 VanDerWaalsContact C-N 3.31Å; Q2-F4 PolarHBondContact O-N 3.17Å; Q2-I5 PolarHBondContact O-N 3.31Å; Q2-V6 PolarHBondContact O-N 3.22Å |
| 3 | L | 88.7 | Confident | 89.9 | Confident | 151 Ų | 151 | 125.4 Ų | 125.4 | 79% | 0.791 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -61.3 | -35.5 | 177.1 | -79.3 | 162.1 | 0 | 0 | 0 | 113.3 | M1 V6 F7 | M1-L3 PolarHBondContact O-N 2.91Å; L3-V6 PolarHBondContact O-N 3.45Å; L3-F7 WeakPolarHBondContact O-CB 3.18Å; L3-F7 PolarHBondContact O-N 3.24Å |
| 4 | F | 91.8 | Very high | 89.6 | Confident | 149 Ų | 149 | 121.7 Ų | 121.7 | 65% | 0.654 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.4 | -38.4 | 177.7 | -75.9 | -75.1 | 0 | 0 | 0 | 111.7 | M1 Q2 F7 T8 | M1-F4 PolarHBondContact O-N 3.43Å; Q2-F4 VanDerWaalsContact C-N 3.31Å; Q2-F4 PolarHBondContact O-N 3.17Å; F4-F7 PolarHBondContact O-N 2.85Å; F4-T8 WeakPolarHBondContact O-CG2 3.08Å; F4-T8 PolarHBondContact O-N 2.77Å; F4-T8 PolarHBondContact O-OG1 3.41Å |
| 5 | I | 91 | Very high | 89.1 | Confident | 100 Ų | 100 | 121.5 Ų | 121.5 | 51% | 0.513 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.8 | -43.2 | 178.3 | -60.3 | 170.5 | 0 | 0 | 0 | 110.6 | Q2 F7 T8 I9 | Q2-I5 PolarHBondContact O-N 3.31Å; I5-F7 VanDerWaalsContact C-N 3.33Å; I5-F7 PolarHBondContact O-N 3.44Å; I5-T8 PolarHBondContact O-N 3.33Å; I5-T8 PolarHBondContact O-OG1 2.63Å; I5-I9 HydrophobicContact CG2-CD1 3.84Å; I5-I9 WeakPolarHBondContact O-CD1 3.31Å; I5-I9 VanDerWaalsContact O-CG1 3.23Å; I5-I9 WeakPolarHBondContact O-CG1 3.35Å; I5-I9 PolarHBondContact O-N 2.8Å; I5-I9 VanDerWaalsContact O-N 3.09Å |
| 6 | V | 91.6 | Very high | 88.6 | Confident | 85 Ų | 85 | 118.3 Ų | 118.3 | 52% | 0.515 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.1 | -42 | 177.8 | 178.9 | 0 | 0 | 0 | 0 | 110.6 | Q2 L3 I9 L10 | Q2-V6 PolarHBondContact O-N 3.22Å; L3-V6 PolarHBondContact O-N 3.45Å; V6-I9 PolarHBondContact O-N 3.45Å; V6-L10 WeakPolarHBondContact O-CB 3.49Å; V6-L10 PolarHBondContact O-N 3.41Å |
| 7 | F | 93.6 | Very high | 87.9 | Confident | 123 Ų | 123 | 114.5 Ų | 114.5 | 54% | 0.539 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.5 | -41.7 | 179.4 | -172.3 | -108.1 | 0 | 0 | 0 | 112.6 | L3 F4 I5 L10 L11 | L3-F7 WeakPolarHBondContact O-CB 3.18Å; L3-F7 PolarHBondContact O-N 3.24Å; F4-F7 PolarHBondContact O-N 2.85Å; I5-F7 VanDerWaalsContact C-N 3.33Å; I5-F7 PolarHBondContact O-N 3.44Å; F7-L10 PolarHBondContact O-N 3.5Å; F7-L11 HydrophobicContact CD1-CD1 3.75Å; F7-L11 HydrophobicContact CD1-CG 4.34Å; F7-L11 HydrophobicContact CE1-CD1 3.29Å; F7-L11 HydrophobicContact CE1-CG 4.04Å; F7-L11 HydrophobicContact CE2-CG 4.48Å; F7-L11 HydrophobicContact CZ-CD1 3.75Å; F7-L11 HydrophobicContact CZ-CD2 4.29Å; F7-L11 HydrophobicContact CZ-CG 4.1Å; F7-L11 WeakPolarHBondContact O-CG 2.88Å; F7-L11 PolarHBondContact O-N 2.77Å |
| 8 | T | 92.1 | Very high | 86.8 | Confident | 83 Ų | 83 | 114.2 Ų | 114.2 | 51% | 0.509 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.7 | -39.3 | 177.3 | 53.8 | 0 | 0 | 0 | 0 | 112.3 | F4 I5 L10 W12 | F4-T8 WeakPolarHBondContact O-CG2 3.08Å; F4-T8 PolarHBondContact O-N 2.77Å; F4-T8 PolarHBondContact O-OG1 3.41Å; I5-T8 PolarHBondContact O-N 3.33Å; I5-T8 PolarHBondContact O-OG1 2.63Å; T8-L10 VanDerWaalsContact C-N 3.33Å; T8-L10 PolarHBondContact O-N 3.3Å; T8-W12 VanDerWaalsContact O-CB 3.29Å; T8-W12 WeakPolarHBondContact O-CB 3.5Å; T8-W12 PolarHBondContact O-N 2.72Å |
| 9 | I | 93 | Very high | 85.6 | Confident | 102 Ų | 102 | 114.8 Ų | 114.8 | 52% | 0.523 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.4 | -42.5 | 174.6 | -67.6 | 166.3 | 0 | 0 | 0 | 110.8 | I5 V6 W12 F13 | I5-I9 HydrophobicContact CG2-CD1 3.84Å; I5-I9 WeakPolarHBondContact O-CD1 3.31Å; I5-I9 VanDerWaalsContact O-CG1 3.23Å; I5-I9 WeakPolarHBondContact O-CG1 3.35Å; I5-I9 PolarHBondContact O-N 2.8Å; I5-I9 VanDerWaalsContact O-N 3.09Å; V6-I9 PolarHBondContact O-N 3.45Å; I9-W12 PolarHBondContact O-N 3.39Å; I9-F13 WeakPolarHBondContact O-CB 3.47Å; I9-F13 PolarHBondContact O-N 3.24Å |
| 10 | L | 92 | Very high | 84.4 | Confident | 98 Ų | 98 | 114.2 Ų | 114.2 | 51% | 0.513 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -68.1 | -42.4 | -178.3 | -157.7 | 132.6 | 0 | 0 | 0 | 111.6 | V6 F7 T8 F13 I14 | V6-L10 WeakPolarHBondContact O-CB 3.49Å; V6-L10 PolarHBondContact O-N 3.41Å; F7-L10 PolarHBondContact O-N 3.5Å; T8-L10 VanDerWaalsContact C-N 3.33Å; T8-L10 PolarHBondContact O-N 3.3Å; L10-F13 PolarHBondContact O-N 3.3Å; L10-I14 HydrophobicContact CD2-CD1 3.78Å; L10-I14 WeakPolarHBondContact O-CG1 3.19Å; L10-I14 PolarHBondContact O-N 3.4Å |
| 11 | L | 90.8 | Very high | 83 | Confident | 87 Ų | 87 | 113.3 Ų | 113.3 | 46% | 0.455 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -62.7 | -41.7 | 172.9 | -73.9 | 179.8 | 0 | 0 | 0 | 112.3 | F7 F13 I14 H15 | F7-L11 HydrophobicContact CD1-CD1 3.75Å; F7-L11 HydrophobicContact CD1-CG 4.34Å; F7-L11 HydrophobicContact CE1-CD1 3.29Å; F7-L11 HydrophobicContact CE1-CG 4.04Å; F7-L11 HydrophobicContact CE2-CG 4.48Å; F7-L11 HydrophobicContact CZ-CD1 3.75Å; F7-L11 HydrophobicContact CZ-CD2 4.29Å; F7-L11 HydrophobicContact CZ-CG 4.1Å; F7-L11 WeakPolarHBondContact O-CG 2.88Å; F7-L11 PolarHBondContact O-N 2.77Å; L11-F13 VanDerWaalsContact C-N 3.34Å; L11-F13 PolarHBondContact O-N 3.34Å; L11-I14 PolarHBondContact O-N 3.12Å; L11-H15 PolarHBondContact O-N 3.11Å |
| 12 | W | 91.2 | Very high | 82.2 | Confident | 171 Ų | 171 | 109.9 Ų | 109.9 | 65% | 0.648 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.8 | -42.5 | 177 | -176.4 | 80.2 | 0 | 0 | 0 | 111.8 | T8 I9 H15 I16 | T8-W12 VanDerWaalsContact O-CB 3.29Å; T8-W12 WeakPolarHBondContact O-CB 3.5Å; T8-W12 PolarHBondContact O-N 2.72Å; I9-W12 PolarHBondContact O-N 3.39Å; W12-H15 PolarHBondContact O-N 3.3Å; W12-I16 HydrophobicContact CD2-CD1 3.98Å; W12-I16 VanDerWaalsContact CE2-CD1 3.47Å; W12-I16 HydrophobicContact CE3-CD1 4.21Å; W12-I16 HydrophobicContact CH2-CD1 3.54Å; W12-I16 HydrophobicContact CZ2-CD1 3.25Å; W12-I16 HydrophobicContact CZ2-CG1 4.48Å; W12-I16 HydrophobicContact CZ3-CD1 4Å; W12-I16 PolarHBondContact O-N 2.97Å |
| 13 | F | 90.7 | Very high | 80.5 | Confident | 132 Ų | 132 | 106.6 Ų | 106.6 | 58% | 0.579 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.5 | -41.2 | 176.9 | -166.9 | -97.6 | 0 | 0 | 0 | 112.6 | I9 L10 L11 H15 I16 T17 | I9-F13 WeakPolarHBondContact O-CB 3.47Å; I9-F13 PolarHBondContact O-N 3.24Å; L10-F13 PolarHBondContact O-N 3.3Å; L11-F13 VanDerWaalsContact C-N 3.34Å; L11-F13 PolarHBondContact O-N 3.34Å; F13-H15 VanDerWaalsContact C-N 3.33Å; F13-H15 PolarHBondContact O-N 3.4Å; F13-I16 PolarHBondContact O-N 3.13Å; F13-T17 HydrophobicContact CD1-CG2 4.02Å; F13-T17 HydrophobicContact CE1-CG2 3.71Å; F13-T17 HydrophobicContact CZ-CG2 4.04Å; F13-T17 WeakPolarHBondContact O-CB 3.43Å; F13-T17 VanDerWaalsContact O-CG2 3.32Å; F13-T17 WeakPolarHBondContact O-CG2 3.14Å; F13-T17 PolarHBondContact O-N 3.36Å; F13-T17 PolarHBondContact O-OG1 3.09Å |
| 14 | I | 86.1 | Confident | 78.6 | Confident | 74 Ų | 74 | 109 Ų | 109 | 38% | 0.379 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.9 | -41.5 | 175.5 | -67.1 | 166.3 | 0 | 0 | 0 | 110.7 | L10 L11 T17 Q18 | L10-I14 HydrophobicContact CD2-CD1 3.78Å; L10-I14 WeakPolarHBondContact O-CG1 3.19Å; L10-I14 PolarHBondContact O-N 3.4Å; L11-I14 PolarHBondContact O-N 3.12Å; I14-T17 WeakPolarHBondContact CA-OG1 3.46Å; I14-T17 PolarHBondContact O-N 3.32Å; I14-T17 PolarHBondContact O-OG1 3.47Å; I14-Q18 WeakPolarHBondContact O-CG 3Å; I14-Q18 PolarHBondContact O-N 3.18Å |
| 15 | H | 82.2 | Confident | 76.6 | Confident | 118 Ų | 118 | 112.9 Ų | 112.9 | 55% | 0.546 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.8 | -43.4 | 179.8 | -165.1 | -91.9 | 0 | 0 | 0 | 112.2 | L11 W12 F13 Q18 Q19 | L11-H15 PolarHBondContact O-N 3.11Å; W12-H15 PolarHBondContact O-N 3.3Å; F13-H15 VanDerWaalsContact C-N 3.33Å; F13-H15 PolarHBondContact O-N 3.4Å; H15-Q18 PolarHBondContact O-N 3.06Å; H15-Q19 PolarHBondContact CE1-NE2 3.23Å; H15-Q19 PolarHBondContact O-N 3.24Å |
| 16 | I | 81.7 | Confident | 74.4 | Confident | 70 Ų | 70 | 116.6 Ų | 116.6 | 36% | 0.359 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.3 | -45.3 | 176.2 | -71.7 | -167.2 | 0 | 0 | 0 | 111.4 | W12 F13 Q18 Q19 V20 | W12-I16 HydrophobicContact CD2-CD1 3.98Å; W12-I16 VanDerWaalsContact CE2-CD1 3.47Å; W12-I16 HydrophobicContact CE3-CD1 4.21Å; W12-I16 HydrophobicContact CH2-CD1 3.54Å; W12-I16 HydrophobicContact CZ2-CD1 3.25Å; W12-I16 HydrophobicContact CZ2-CG1 4.48Å; W12-I16 HydrophobicContact CZ3-CD1 4Å; W12-I16 PolarHBondContact O-N 2.97Å; F13-I16 PolarHBondContact O-N 3.13Å; I16-Q18 VanDerWaalsContact C-N 3.29Å; I16-Q18 PolarHBondContact O-N 3.42Å; I16-Q19 PolarHBondContact O-N 3.28Å; I16-Q19 VanDerWaalsContact O-N 3.16Å; I16-V20 WeakPolarHBondContact O-CG2 3.03Å; I16-V20 PolarHBondContact O-N 2.84Å; I16-V20 VanDerWaalsContact O-N 3.14Å |
| 17 | T | 75.2 | Confident | 71.8 | Confident | 54 Ų | 54 | 121.7 Ų | 121.7 | 33% | 0.331 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.6 | -33.5 | -179.3 | 50.2 | 0 | 0 | 0 | 0 | 112.4 | F13 I14 T21 | F13-T17 HydrophobicContact CD1-CG2 4.02Å; F13-T17 HydrophobicContact CE1-CG2 3.71Å; F13-T17 HydrophobicContact CZ-CG2 4.04Å; F13-T17 WeakPolarHBondContact O-CB 3.43Å; F13-T17 VanDerWaalsContact O-CG2 3.32Å; F13-T17 WeakPolarHBondContact O-CG2 3.14Å; F13-T17 PolarHBondContact O-N 3.36Å; F13-T17 PolarHBondContact O-OG1 3.09Å; I14-T17 WeakPolarHBondContact CA-OG1 3.46Å; I14-T17 PolarHBondContact O-N 3.32Å; I14-T17 PolarHBondContact O-OG1 3.47Å; T17-T21 WeakPolarHBondContact O-CB 2.98Å; T17-T21 VanDerWaalsContact O-CG2 3.3Å; T17-T21 WeakPolarHBondContact O-CG2 3.44Å; T17-T21 PolarHBondContact O-N 3.12Å; T17-T21 PolarHBondContact O-OG1 2.92Å |
| 18 | Q | 69.3 | Low | 69.4 | Low | 109 Ų | 109 | 121.1 Ų | 121.1 | 51% | 0.509 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -64.8 | -42.8 | 171.8 | -74.7 | -165.2 | 47.7 | 0 | 0 | 112.4 | I14 H15 I16 V20 T21 I22 | I14-Q18 WeakPolarHBondContact O-CG 3Å; I14-Q18 PolarHBondContact O-N 3.18Å; H15-Q18 PolarHBondContact O-N 3.06Å; I16-Q18 VanDerWaalsContact C-N 3.29Å; I16-Q18 PolarHBondContact O-N 3.42Å; Q18-V20 VanDerWaalsContact C-N 3.33Å; Q18-V20 PolarHBondContact O-N 3.26Å; Q18-T21 WeakPolarHBondContact CA-OG1 3.34Å; Q18-T21 PolarHBondContact O-N 3.01Å; Q18-T21 PolarHBondContact O-OG1 3.18Å; Q18-T21 VanDerWaalsContact O-OG1 3.09Å; Q18-I22 HydrophobicContact CB-CD1 4.39Å; Q18-I22 WeakPolarHBondContact O-CB 3.37Å; Q18-I22 WeakPolarHBondContact O-CD1 3.35Å; Q18-I22 WeakPolarHBondContact O-CG1 3.1Å; Q18-I22 PolarHBondContact O-N 3.39Å |
| 19 | Q | 63.8 | Low | 67.1 | Low | 126 Ų | 126 | 125.1 Ų | 125.1 | 59% | 0.589 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -63.8 | -37.5 | 178.3 | -67.6 | -153.4 | 3.3 | 0 | 0 | 113.1 | H15 I16 | H15-Q19 PolarHBondContact CE1-NE2 3.23Å; H15-Q19 PolarHBondContact O-N 3.24Å; I16-Q19 PolarHBondContact O-N 3.28Å; I16-Q19 VanDerWaalsContact O-N 3.16Å |
| 20 | V | 61.7 | Low | 64.7 | Low | 103 Ų | 103 | 127.4 Ų | 127.4 | 62% | 0.624 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -73.1 | -33.4 | 178.4 | -177.3 | 0 | 0 | 0 | 0 | 111.9 | I16 Q18 | I16-V20 WeakPolarHBondContact O-CG2 3.03Å; I16-V20 PolarHBondContact O-N 2.84Å; I16-V20 VanDerWaalsContact O-N 3.14Å; Q18-V20 VanDerWaalsContact C-N 3.33Å; Q18-V20 PolarHBondContact O-N 3.26Å |
| 21 | T | 55.3 | Low | 62.6 | Low | 95 Ų | 95 | 129.7 Ų | 129.7 | 58% | 0.583 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -78.8 | -31.7 | -179.8 | 50.2 | 0 | 0 | 0 | 0 | 113.2 | T17 Q18 S23 R24 | T17-T21 WeakPolarHBondContact O-CB 2.98Å; T17-T21 VanDerWaalsContact O-CG2 3.3Å; T17-T21 WeakPolarHBondContact O-CG2 3.44Å; T17-T21 PolarHBondContact O-N 3.12Å; T17-T21 PolarHBondContact O-OG1 2.92Å; Q18-T21 WeakPolarHBondContact CA-OG1 3.34Å; Q18-T21 PolarHBondContact O-N 3.01Å; Q18-T21 PolarHBondContact O-OG1 3.18Å; Q18-T21 VanDerWaalsContact O-OG1 3.09Å; T21-S23 VanDerWaalsContact C-N 3.33Å; T21-S23 PolarHBondContact O-N 3.15Å; T21-R24 PolarHBondContact O-N 3.39Å |
| 22 | I | 57.7 | Low | 60.2 | Low | 117 Ų | 117 | 132.9 Ų | 132.9 | 60% | 0.6 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -67.1 | -32.7 | 179.8 | -68.7 | 163 | 0 | 0 | 0 | 111.7 | Q18 R24 | Q18-I22 HydrophobicContact CB-CD1 4.39Å; Q18-I22 WeakPolarHBondContact O-CB 3.37Å; Q18-I22 WeakPolarHBondContact O-CD1 3.35Å; Q18-I22 WeakPolarHBondContact O-CG1 3.1Å; Q18-I22 PolarHBondContact O-N 3.39Å; I22-R24 VanDerWaalsContact C-N 3.31Å; I22-R24 PolarHBondContact O-N 2.94Å |
| 23 | S | 51.2 | Low | 57.9 | Low | 91 Ų | 91 | 133 Ų | 133 | 64% | 0.636 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -7.7 | -178 | -65.3 | 0 | 0 | 0 | 0 | 115.4 | T21 | T21-S23 VanDerWaalsContact C-N 3.33Å; T21-S23 PolarHBondContact O-N 3.15Å |
| 24 | R | 48.9 | Very low | 55.7 | Low | 203 Ų | 203 | 130.3 Ų | 130.3 | 77% | 0.766 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -3 | 176.9 | -80.1 | -148.8 | -178.3 | -151.8 | 2.4 | 115.2 | T21 I22 | T21-R24 PolarHBondContact O-N 3.39Å; I22-R24 VanDerWaalsContact C-N 3.31Å; I22-R24 PolarHBondContact O-N 2.94Å |
| 25 | R | 49.4 | Very low | 53.7 | Low | 230 Ų | 230 | 131.5 Ų | 131.5 | 87% | 0.868 | 65% | 0.654 | S | S | * | * | trans | -87.7 | 1 | 174 | -72 | -159.2 | -178.4 | -163.5 | 3.5 | 114.6 | Y27 | R25-Y27 PolarHBondContact O-N 2.76Š| ||
| 26 | Q | 45.3 | Very low | 51.8 | Low | 178 Ų | 178 | 132.6 Ų | 132.6 | 83% | 0.832 | 66% | 0.662 | S | S | * | * | trans | -79.9 | 67.2 | 156.4 | -80.7 | 175.8 | -37.5 | 0 | 0 | 109 | ||||
| 27 | Y | 36.6 | Very low | 49.9 | Very low | 192 Ų | 192 | 132.9 Ų | 132.9 | 75% | 0.753 | 67% | 0.669 | S | S | * | * | trans | -68.9 | 142.4 | 154.8 | -102.3 | -100.1 | 0 | 0 | 0 | 107.8 | R25 | R25-Y27 PolarHBondContact O-N 2.76Š| ||
| 28 | P | 44.5 | Very low | 48.4 | Very low | 110 Ų | 110 | 137.1 Ų | 137.1 | 71% | 0.714 | 69% | 0.69 | S | S | * | * | trans | -62.2 | 147.7 | -155.5 | 26.2 | -33.6 | 0 | 0 | 0 | 110.9 | Q30 | P28-Q30 PolarHBondContact O-N 3.27Š| ||
| 29 | Q | 43.4 | Very low | 47.1 | Very low | 167 Ų | 167 | 139 Ų | 139 | 78% | 0.78 | 70% | 0.698 | S | S | * | * | trans | -31.7 | 127.6 | 165.8 | -71.3 | -161.1 | -14.8 | 0 | 0 | 110.9 | I31 | Q29-I31 PolarHBondContact O-N 3.38Å; Q29-I31 VanDerWaalsContact O-N 3.13Å | ||
| 30 | Q | 42.6 | Very low | 46.3 | Very low | 151 Ų | 151 | 139.1 Ų | 139.1 | 71% | 0.706 | 71% | 0.707 | S | S | * | * | 33.2 | 83.9 | 128.9 | -52.9 | 179.5 | 18.5 | 0 | 0 | 111.2 | P28 Q32 | P28-Q30 PolarHBondContact O-N 3.27Å; Q30-Q32 PolarHBondContact O-N 3.13Å | |||
| 31 | I | 47 | Very low | 45.5 | Very low | 145 Ų | 145 | 142 Ų | 142 | 74% | 0.744 | 71% | 0.714 | S | S | * | * | trans | -54.8 | 92.7 | 136.5 | -61.5 | 168.9 | 0 | 0 | 0 | 102.3 | Q29 F33 | Q29-I31 PolarHBondContact O-N 3.38Å; Q29-I31 VanDerWaalsContact O-N 3.13Å; I31-F33 PolarHBondContact O-N 2.83Å | ||
| 32 | Q | 40.4 | Very low | 44.8 | Very low | 154 Ų | 154 | 145.1 Ų | 145.1 | 72% | 0.72 | 72% | 0.722 | S | S | * | * | trans | -49.3 | 99.2 | 161.5 | -92 | 174.7 | -11.6 | 0 | 0 | 102.7 | Q30 A34 | Q30-Q32 PolarHBondContact O-N 3.13Å; Q32-A34 PolarHBondContact O-N 3.18Å | ||
| 33 | F | 44 | Very low | 43.8 | Very low | 175 Ų | 175 | 141.9 Ų | 141.9 | 77% | 0.768 | 72% | 0.717 | S | S | * | * | trans | -59.6 | 81.7 | 137.9 | -61.2 | -82.1 | 0 | 0 | 0 | 103 | I31 S35 | I31-F33 PolarHBondContact O-N 2.83Å; F33-S35 PolarHBondContact O-N 3.46Å | ||
| 34 | A | 44.5 | Very low | 43.3 | Very low | 74 Ų | 74 | 143.6 Ų | 143.6 | 61% | 0.612 | 72% | 0.719 | S | S | * | * | trans | -45.6 | 104.8 | 148.2 | 0 | 0 | 0 | 0 | 0 | 101.8 | Q32 I36 | Q32-A34 PolarHBondContact O-N 3.18Å; A34-I36 PolarHBondContact O-N 3.38Å | ||
| 35 | S | 42.5 | Very low | 42.8 | Very low | 99 Ų | 99 | 142.5 Ų | 142.5 | 69% | 0.692 | 72% | 0.72 | S | S | * | * | trans | -30.9 | 108.4 | 179.2 | 48.5 | 0 | 0 | 0 | 0 | 107 | F33 P37 | F33-S35 PolarHBondContact O-N 3.46Å; S35-P37 VanDerWaalsContact C-N 3.3Å; S35-P37 WeakPolarHBondContact O-CD 3.15Å | ||
| 36 | I | 43 | Very low | 42.6 | Very low | 141 Ų | 141 | 139.8 Ų | 139.8 | 72% | 0.723 | 72% | 0.718 | S | S | * | * | trans | -54.4 | 109.5 | 167.6 | -64.6 | 166 | 0 | 0 | 0 | 102 | A34 | A34-I36 PolarHBondContact O-N 3.38Š| ||
| 37 | P | 41.3 | Very low | 42.5 | Very low | 76 Ų | 76 | 140.2 Ų | 140.2 | 49% | 0.494 | 72% | 0.717 | S | S | . | * | trans | -61.2 | 151.8 | -169.8 | 22.9 | -30.9 | 0 | 0 | 0 | 107.8 | S35 Q39 | S35-P37 VanDerWaalsContact C-N 3.3Å; S35-P37 WeakPolarHBondContact O-CD 3.15Å; P37-Q39 HydrophobicContact CB-CG 4.37Å; P37-Q39 HydrophobicContact CG-CG 4.2Å; P37-Q39 PolarHBondContact O-N 3.19Å | ||
| 38 | N | 44.8 | Very low | 42.7 | Very low | 144 Ų | 144 | 138.1 Ų | 138.1 | 77% | 0.77 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -55.6 | 54.9 | 169.6 | -71.6 | -50.6 | 0 | 0 | 0 | 112.7 | ||
| 39 | Q | 41 | Very low | 42.4 | Very low | 147 Ų | 147 | 141.9 Ų | 141.9 | 69% | 0.687 | 73% | 0.725 | S | S | * | * | trans | -96.1 | -13.5 | 174.6 | -73.5 | -153.2 | 15.2 | 0 | 0 | 112.2 | P37 E41 G43 | P37-Q39 HydrophobicContact CB-CG 4.37Å; P37-Q39 HydrophobicContact CG-CG 4.2Å; P37-Q39 PolarHBondContact O-N 3.19Å; Q39-E41 PolarHBondContact O-N 3.39Å; Q39-G43 PolarHBondContact O-N 3.43Å | ||
| 40 | V | 46.5 | Very low | 41.8 | Very low | 129 Ų | 129 | 137.6 Ų | 137.6 | 78% | 0.782 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | -21.6 | 172.3 | -172.6 | 0 | 0 | 0 | 0 | 111.4 | ||
| 41 | E | 45.2 | Very low | 41.2 | Very low | 164 Ų | 164 | 134 Ų | 134 | 77% | 0.766 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.7 | -18.2 | 178.9 | -142.4 | 176.3 | 141.2 | 0 | 0 | 113.9 | Q39 | Q39-E41 PolarHBondContact O-N 3.39Š|
| 42 | Q | 42 | Very low | 40.4 | Very low | 160 Ų | 160 | 134.7 Ų | 134.7 | 75% | 0.748 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.9 | -21.1 | 175.5 | -114.5 | 180 | -9.7 | 0 | 0 | 114 | N44 | Q42-N44 VanDerWaalsContact C-N 3.32Å; Q42-N44 PolarHBondContact O-N 2.93Å |
| 43 | G | 34.9 | Very low | 39.9 | Very low | 49 Ų | 49 | 130.5 Ų | 130.5 | 51% | 0.505 | 74% | 0.739 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.2 | -21.2 | 178 | 0 | 0 | 0 | 0 | 0 | 114.9 | Q39 | Q39-G43 PolarHBondContact O-N 3.43Š|
| 44 | N | 40.8 | Very low | 39.4 | Very low | 127 Ų | 127 | 129 Ų | 129 | 68% | 0.679 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | 0.3 | -174.6 | -131.3 | 15.1 | 0 | 0 | 0 | 114.6 | Q42 | Q42-N44 VanDerWaalsContact C-N 3.32Å; Q42-N44 PolarHBondContact O-N 2.93Å |
| 45 | K | 39.7 | Very low | 38.8 | Very low | 181 Ų | 181 | 130.4 Ų | 130.4 | 79% | 0.787 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -100.2 | -12.5 | 173.1 | -85.5 | -170.3 | 173.1 | -172 | 0 | 114.6 | ||
| 46 | Q | 45.6 | Very low | 38.1 | Very low | 173 Ų | 173 | 129 Ų | 129 | 81% | 0.808 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -96.5 | -6.2 | 177.4 | -81.4 | -176 | -9.6 | 0 | 0 | 114.5 | ||
| 47 | F | 41.3 | Very low | 38.1 | Very low | 187 Ų | 187 | 131.6 Ų | 131.6 | 82% | 0.82 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -101.9 | 3.1 | -176.1 | -135.9 | -94.3 | 0 | 0 | 0 | 115.5 | ||
| 48 | I | 42.4 | Very low | 37.9 | Very low | 147 Ų | 147 | 136.9 Ų | 136.9 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -107.7 | -1.8 | 177.7 | -46.8 | -169.3 | 0 | 0 | 0 | 112.6 | ||
| 49 | E | 37.1 | Very low | 37.4 | Very low | 189 Ų | 189 | 137.6 Ų | 137.6 | 88% | 0.883 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -115.2 | 77.5 | 173.8 | -71.1 | -169.2 | 141.8 | 0 | 0 | 111.1 | ||
| 50 | G | 31.3 | Very low | 37.3 | Very low | 77 Ų | 77 | 138.7 Ų | 138.7 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | S | Bend | trans | 146.2 | 85.5 | 163.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 51 | G | 30.4 | Very low | 36.9 | Very low | 76 Ų | 76 | 141 Ų | 141 | 78% | 0.784 | 79% | 0.789 | S | S | * | * | trans | 172.1 | 38.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | G53 | G51-G53 PolarHBondContact O-N 2.9Å; G51-G53 VanDerWaalsContact O-N 3.17Å | ||
| 52 | V | 29.9 | Very low | 36.6 | Very low | 159 Ų | 159 | 140.5 Ų | 140.5 | 96% | 0.964 | 79% | 0.787 | S | S | * | * | trans | -68.8 | 104.4 | 159.7 | 175.7 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 53 | G | 30.3 | Very low | 36.7 | Very low | 67 Ų | 67 | 140.7 Ų | 140.7 | 69% | 0.691 | 79% | 0.788 | S | S | * | * | trans | -169.7 | 71.2 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | G51 | G51-G53 PolarHBondContact O-N 2.9Å; G51-G53 VanDerWaalsContact O-N 3.17Å | ||
| 54 | V | 32.5 | Very low | 37.1 | Very low | 142 Ų | 142 | 146 Ų | 146 | 86% | 0.861 | 80% | 0.799 | S | S | * | * | trans | 15.8 | 131.1 | 142.3 | -175 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 55 | A | 31.6 | Very low | 37.2 | Very low | 104 Ų | 104 | 147.2 Ų | 147.2 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | 89.4 | 110.8 | 156.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 56 | G | 28.8 | Very low | 37.5 | Very low | 69 Ų | 69 | 145.9 Ų | 145.9 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | trans | 147.6 | 64.8 | 161 | 0 | 0 | 0 | 0 | 0 | 114 | E58 | G56-E58 PolarHBondContact O-N 3.1Š| ||
| 57 | E | 42.3 | Very low | 37.3 | Very low | 196 Ų | 196 | 139.8 Ų | 139.8 | 92% | 0.916 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | 24.9 | 179.1 | -72 | 177.5 | 106.5 | 0 | 0 | 115.3 | ||
| 58 | E | 38.2 | Very low | 37.6 | Very low | 188 Ų | 188 | 135.5 Ų | 135.5 | 88% | 0.879 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115 | 9.8 | -176.3 | -70.6 | -167.2 | 117.9 | 0 | 0 | 115.4 | G56 | G56-E58 PolarHBondContact O-N 3.1Š|
| 59 | Q | 34.4 | Very low | 37.8 | Very low | 159 Ų | 159 | 135 Ų | 135 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -110.7 | -0.5 | 173 | -82.7 | -174.5 | -24.7 | 0 | 0 | 115.5 | Q61 | Q59-Q61 PolarHBondContact O-N 2.02Š|
| 60 | Q | 38 | Very low | 38.4 | Very low | 169 Ų | 169 | 135 Ų | 135 | 79% | 0.79 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | -4.5 | -178.7 | -83.9 | -174.9 | -1.3 | 0 | 0 | 115.6 | ||
| 61 | Q | 37.3 | Very low | 39.5 | Very low | 177 Ų | 177 | 135.4 Ų | 135.4 | 83% | 0.827 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | -22.9 | 177.7 | -109 | 173.6 | 18.2 | 0 | 0 | 114.7 | Q59 | Q59-Q61 PolarHBondContact O-N 2.02Š|
| 62 | E | 39.6 | Very low | 40.4 | Very low | 155 Ų | 155 | 139.3 Ų | 139.3 | 72% | 0.724 | 74% | 0.742 | S | S | * | * | H | α-helix | trans | -85.2 | -19.8 | 178.1 | -80.9 | -175.6 | 110.4 | 0 | 0 | 113.8 | ||
| 63 | E | 44.2 | Very low | 41.3 | Very low | 164 Ų | 164 | 140.5 Ų | 140.5 | 77% | 0.766 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -81 | -22.1 | -179.1 | -115.1 | 176.5 | 100.5 | 0 | 0 | 113.6 | ||
| 64 | Q | 43.9 | Very low | 42.4 | Very low | 159 Ų | 159 | 142.1 Ų | 142.1 | 74% | 0.743 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -81.1 | -30.5 | -176.7 | -144.6 | 172.4 | 17.2 | 0 | 0 | 113.2 | T68 | Q64-T68 PolarHBondContact O-OG1 3.35Å |
| 65 | E | 42.8 | Very low | 43.5 | Very low | 153 Ų | 153 | 138.7 Ų | 138.7 | 72% | 0.715 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -76.2 | -28.4 | 178.4 | -75.9 | -166.3 | 138.9 | 0 | 0 | 113.5 | ||
| 66 | Q | 44.8 | Very low | 44.4 | Very low | 154 Ų | 154 | 138.9 Ų | 138.9 | 72% | 0.72 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -73.8 | -29.8 | 177.7 | -73.8 | -169.7 | 24.6 | 0 | 0 | 113.1 | R70 | Q66-R70 PolarHBondContact O-N 2.82Å |
| 67 | G | 41.8 | Very low | 45.3 | Very low | 44 Ų | 44 | 141.2 Ų | 141.2 | 45% | 0.454 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -64.1 | -40.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | R70 S71 | G67-R70 PolarHBondContact O-N 3.03Å; G67-S71 PolarHBondContact O-N 2.03Å |
| 68 | T | 47.9 | Very low | 45.7 | Very low | 97 Ų | 97 | 138.2 Ų | 138.2 | 60% | 0.595 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -71.7 | -36.2 | -177.4 | -24 | 0 | 0 | 0 | 0 | 112.1 | Q64 K72 | Q64-T68 PolarHBondContact O-OG1 3.35Å; T68-K72 PolarHBondContact O-N 3.45Å |
| 69 | H | 46.3 | Very low | 46.3 | Very low | 136 Ų | 136 | 135.6 Ų | 135.6 | 63% | 0.63 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -70 | -34.3 | 177 | -103.3 | -79 | 0 | 0 | 0 | 113 | R73 | H69-R73 PolarHBondContact O-N 2.85Å |
| 70 | R | 50.6 | Low | 47.1 | Very low | 189 Ų | 189 | 134.6 Ų | 134.6 | 71% | 0.713 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -70.8 | -40.5 | 178.7 | -164.4 | 172 | -175.8 | 154.5 | -0.7 | 111.9 | Q66 G67 K72 R73 L74 | Q66-R70 PolarHBondContact O-N 2.82Å; G67-R70 PolarHBondContact O-N 3.03Å; R70-K72 PolarHBondContact O-N 2.92Å; R70-R73 PolarHBondContact O-N 3.5Å; R70-L74 HydrophobicContact CG-CD1 4.18Å; R70-L74 PolarHBondContact O-N 3.05Å |
| 71 | S | 53.1 | Low | 47.8 | Very low | 86 Ų | 86 | 131 Ų | 131 | 60% | 0.601 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -68.2 | -35.3 | -179.5 | -160.6 | 0 | 0 | 0 | 0 | 113.1 | G67 S75 | G67-S71 PolarHBondContact O-N 2.03Å; S71-S75 PolarHBondContact O-N 3.1Å |
| 72 | K | 50.2 | Low | 48.7 | Very low | 158 Ų | 158 | 128 Ų | 128 | 69% | 0.687 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -64.7 | -43.9 | 174.7 | -102.1 | 176.2 | 177.9 | 171.2 | 0 | 112.4 | T68 R70 L74 S75 D76 | T68-K72 PolarHBondContact O-N 3.45Å; R70-K72 PolarHBondContact O-N 2.92Å; K72-L74 VanDerWaalsContact C-N 3.3Å; K72-L74 PolarHBondContact O-N 3.06Å; K72-S75 PolarHBondContact O-N 3.19Å; K72-D76 PolarHBondContact O-N 3.33Å |
| 73 | R | 49.5 | Very low | 49.6 | Very low | 185 Ų | 185 | 125.3 Ų | 125.3 | 70% | 0.698 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -64.8 | -30.5 | 180 | -76.3 | -175.1 | 177.7 | 175.1 | 2.6 | 113.7 | H69 R70 N77 | H69-R73 PolarHBondContact O-N 2.85Å; R70-R73 PolarHBondContact O-N 3.5Å; R73-N77 PolarHBondContact O-ND2 3.21Å |
| 74 | L | 52.7 | Low | 50.1 | Low | 101 Ų | 101 | 126.7 Ų | 126.7 | 53% | 0.529 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -73.9 | -36.6 | 176 | -94.9 | 129.6 | 0 | 0 | 0 | 112.3 | R70 K72 N77 Q78 | R70-L74 HydrophobicContact CG-CD1 4.18Å; R70-L74 PolarHBondContact O-N 3.05Å; K72-L74 VanDerWaalsContact C-N 3.3Å; K72-L74 PolarHBondContact O-N 3.06Å; L74-N77 PolarHBondContact O-N 2.96Å; L74-Q78 PolarHBondContact O-N 3.43Å; L74-Q78 VanDerWaalsContact O-N 3.11Å |
| 75 | S | 54.7 | Low | 50.6 | Low | 69 Ų | 69 | 129.7 Ų | 129.7 | 48% | 0.483 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -66.3 | -40.5 | 178.4 | -164.6 | 0 | 0 | 0 | 0 | 112.4 | S71 K72 N77 Q78 Q79 | S71-S75 PolarHBondContact O-N 3.1Å; K72-S75 PolarHBondContact O-N 3.19Å; S75-N77 VanDerWaalsContact C-N 3.31Å; S75-N77 PolarHBondContact O-N 3.19Å; S75-Q78 PolarHBondContact O-N 3.49Å; S75-Q79 PolarHBondContact O-N 3.47Å; S75-Q79 VanDerWaalsContact O-N 3.12Å |
| 76 | D | 51.9 | Low | 51.7 | Low | 109 Ų | 109 | 125.7 Ų | 125.7 | 58% | 0.583 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -65.5 | -33.1 | 178.5 | -74 | -37.9 | 0 | 0 | 0 | 112.5 | K72 | K72-D76 PolarHBondContact O-N 3.33Å |
| 77 | N | 48 | Very low | 52.6 | Low | 118 Ų | 118 | 122.5 Ų | 122.5 | 63% | 0.631 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -78.4 | -30.3 | 177.2 | -81 | -76.7 | 0 | 0 | 0 | 113 | R73 L74 S75 | R73-N77 PolarHBondContact O-ND2 3.21Å; L74-N77 PolarHBondContact O-N 2.96Å; S75-N77 VanDerWaalsContact C-N 3.31Å; S75-N77 PolarHBondContact O-N 3.19Å |
| 78 | Q | 49.1 | Very low | 53.4 | Low | 133 Ų | 133 | 127.6 Ų | 127.6 | 62% | 0.621 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -78.1 | -30.9 | 178.3 | -106.1 | -177.2 | 60.3 | 0 | 0 | 113.7 | L74 S75 L80 S81 | L74-Q78 PolarHBondContact O-N 3.43Å; L74-Q78 VanDerWaalsContact O-N 3.11Å; S75-Q78 PolarHBondContact O-N 3.49Å; Q78-L80 PolarHBondContact O-N 2.95Å; Q78-S81 PolarHBondContact O-N 3.49Å; Q78-S81 PolarHBondContact O-OG 3.35Å; Q78-S81 VanDerWaalsContact O-OG 3.09Å |
| 79 | Q | 50.5 | Low | 54.1 | Low | 133 Ų | 133 | 125 Ų | 125 | 62% | 0.621 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -67.9 | -23.7 | 173.4 | -98.1 | -177.1 | -30.9 | 0 | 0 | 112.9 | S75 T83 | S75-Q79 PolarHBondContact O-N 3.47Å; S75-Q79 VanDerWaalsContact O-N 3.12Å; Q79-T83 PolarHBondContact O-OG1 3.44Å |
| 80 | L | 52.1 | Low | 54.8 | Low | 138 Ų | 138 | 122 Ų | 122 | 72% | 0.723 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -79.6 | -24 | -179.4 | -136.7 | 75.9 | 0 | 0 | 0 | 113.6 | Q78 | Q78-L80 PolarHBondContact O-N 2.95Å |
| 81 | S | 53.3 | Low | 55.1 | Low | 92 Ų | 92 | 120.2 Ų | 120.2 | 64% | 0.643 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -88.9 | -25.3 | -175.3 | 52.9 | 0 | 0 | 0 | 0 | 114.1 | Q78 | Q78-S81 PolarHBondContact O-N 3.49Å; Q78-S81 PolarHBondContact O-OG 3.35Å; Q78-S81 VanDerWaalsContact O-OG 3.09Å |
| 82 | T | 56 | Low | 55.2 | Low | 115 Ų | 115 | 123.4 Ų | 123.4 | 71% | 0.706 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -94.1 | -17.5 | -177.9 | 57.1 | 0 | 0 | 0 | 0 | 114 | Y84 | T82-Y84 PolarHBondContact O-N 3.47Å; T82-Y84 VanDerWaalsContact O-N 3.13Å |
| 83 | T | 57.1 | Low | 55.3 | Low | 98 Ų | 98 | 124.3 Ų | 124.3 | 60% | 0.601 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -84.4 | 94.7 | 176.1 | -54.1 | 0 | 0 | 0 | 0 | 109.3 | Q79 R85 | Q79-T83 PolarHBondContact O-OG1 3.44Å; T83-R85 PolarHBondContact O-N 3.29Å |
| 84 | Y | 54.7 | Low | 55.3 | Low | 193 Ų | 193 | 124.9 Ų | 124.9 | 76% | 0.757 | 63% | 0.632 | S | S | * | * | trans | -48.2 | 102.4 | 168.7 | 176.2 | -98.7 | 0 | 0 | 0 | 110.1 | T82 N86 | T82-Y84 PolarHBondContact O-N 3.47Å; T82-Y84 VanDerWaalsContact O-N 3.13Å; Y84-N86 HydrophobicContact CD1-CB 4.5Å; Y84-N86 HydrophobicContact CE1-CB 4.05Å; Y84-N86 PolarHBondContact O-N 2.97Å | ||
| 85 | R | 55.6 | Low | 54.9 | Low | 222 Ų | 222 | 128.9 Ų | 128.9 | 84% | 0.838 | 65% | 0.645 | S | S | * | * | trans | -87 | 92.1 | -177.8 | -150.1 | 176.8 | -166.4 | -175.3 | 5 | 107.3 | T83 P87 | T83-R85 PolarHBondContact O-N 3.29Å; R85-P87 WeakPolarHBondContact O-CD 3.46Å | ||
| 86 | N | 65.8 | Low | 54.9 | Low | 69 Ų | 69 | 137.1 Ų | 137.1 | 37% | 0.369 | 67% | 0.665 | S | S | . | * | trans | -53.9 | 117.3 | 174.6 | -178.4 | -18.1 | 0 | 0 | 0 | 108.8 | Y84 F88 A89 | Y84-N86 HydrophobicContact CD1-CB 4.5Å; Y84-N86 HydrophobicContact CE1-CB 4.05Å; Y84-N86 PolarHBondContact O-N 2.97Å; N86-F88 PolarHBondContact O-N 3.34Å; N86-F88 VanDerWaalsContact O-N 3.14Å; N86-F88 WeakPolarHBondContact OD1-CB 3.34Å; N86-F88 WeakPolarHBondContact OD1-CD2 3.49Å; N86-F88 PolarHBondContact OD1-N 3.4Å; N86-A89 HydrophobicContact CB-CB 4.1Å; N86-A89 WeakPolarHBondContact O-CB 3.29Å; N86-A89 PolarHBondContact O-N 3.48Å | ||
| 87 | P | 63.3 | Low | 54.6 | Low | 88 Ų | 88 | 140.1 Ų | 140.1 | 57% | 0.571 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.9 | -25.3 | -174.8 | 24.2 | -34 | 0 | 0 | 0 | 112.4 | R85 | R85-P87 WeakPolarHBondContact O-CD 3.46Š|
| 88 | F | 59.5 | Low | 54.7 | Low | 150 Ų | 150 | 140.4 Ų | 140.4 | 66% | 0.658 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -21.2 | 176.4 | -60.2 | -75.2 | 0 | 0 | 0 | 113.2 | N86 A90 F91 L92 | N86-F88 PolarHBondContact O-N 3.34Å; N86-F88 VanDerWaalsContact O-N 3.14Å; N86-F88 WeakPolarHBondContact OD1-CB 3.34Å; N86-F88 WeakPolarHBondContact OD1-CD2 3.49Å; N86-F88 PolarHBondContact OD1-N 3.4Å; F88-A90 PolarHBondContact O-N 3.14Å; F88-F91 WeakPolarHBondContact O-CB 3.42Å; F88-F91 PolarHBondContact O-N 2.87Å; F88-L92 PolarHBondContact O-N 3.16Å; F88-L92 VanDerWaalsContact O-N 3.11Å |
| 89 | A | 62.3 | Low | 54.6 | Low | 44 Ų | 44 | 142.6 Ų | 142.6 | 36% | 0.364 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -65.5 | -30.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | N86 F91 L92 K93 | N86-A89 HydrophobicContact CB-CB 4.1Å; N86-A89 WeakPolarHBondContact O-CB 3.29Å; N86-A89 PolarHBondContact O-N 3.48Å; A89-F91 VanDerWaalsContact C-N 3.3Å; A89-F91 PolarHBondContact O-N 2.95Å; A89-L92 PolarHBondContact O-N 3.02Å; A89-K93 VanDerWaalsContact O-CB 3.29Å; A89-K93 WeakPolarHBondContact O-CB 3.33Å; A89-K93 PolarHBondContact O-N 3.24Å |
| 90 | A | 59.7 | Low | 54.4 | Low | 71 Ų | 71 | 141.4 Ų | 141.4 | 59% | 0.587 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -67.2 | -30.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | F88 | F88-A90 PolarHBondContact O-N 3.14Å |
| 91 | F | 56.8 | Low | 54.1 | Low | 152 Ų | 152 | 141.4 Ų | 141.4 | 67% | 0.667 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -72.7 | -40 | 174.9 | -109.7 | -88.6 | 0 | 0 | 0 | 111.7 | F88 A89 | F88-F91 WeakPolarHBondContact O-CB 3.42Å; F88-F91 PolarHBondContact O-N 2.87Å; A89-F91 VanDerWaalsContact C-N 3.3Å; A89-F91 PolarHBondContact O-N 2.95Å |
| 92 | L | 55.6 | Low | 53.5 | Low | 153 Ų | 153 | 143.8 Ų | 143.8 | 80% | 0.801 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -78.9 | -27.7 | 178.7 | -64.9 | 172.3 | 0 | 0 | 0 | 113.3 | F88 A89 R94 | F88-L92 PolarHBondContact O-N 3.16Å; F88-L92 VanDerWaalsContact O-N 3.11Å; A89-L92 PolarHBondContact O-N 3.02Å; L92-R94 VanDerWaalsContact C-N 3.25Å; L92-R94 PolarHBondContact O-N 2.75Å |
| 93 | K | 52.3 | Low | 52.8 | Low | 178 Ų | 178 | 143.9 Ų | 143.9 | 77% | 0.774 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | 13.1 | 173.4 | -93.8 | -177.7 | 174.9 | 177.1 | 0 | 114.4 | A89 K95 | A89-K93 VanDerWaalsContact O-CB 3.29Å; A89-K93 WeakPolarHBondContact O-CB 3.33Å; A89-K93 PolarHBondContact O-N 3.24Å; K93-K95 PolarHBondContact O-N 3.22Å |
| 94 | R | 50.8 | Low | 52 | Low | 197 Ų | 197 | 150.2 Ų | 150.2 | 74% | 0.743 | 73% | 0.73 | S | S | * | * | trans | -72.2 | 43.4 | 164.7 | -149.6 | -177.8 | -81.8 | 179.2 | -4.4 | 111.2 | L92 | L92-R94 VanDerWaalsContact C-N 3.25Å; L92-R94 PolarHBondContact O-N 2.75Å | ||
| 95 | K | 44.3 | Very low | 51.7 | Low | 185 Ų | 185 | 148.1 Ų | 148.1 | 80% | 0.804 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -84.4 | 115 | 157.9 | -121.5 | -175.9 | -174.6 | -178 | 0 | 106.1 | K93 H97 | K93-K95 PolarHBondContact O-N 3.22Å; K95-H97 PolarHBondContact O-N 3.36Å |
| 96 | R | 54.4 | Low | 51 | Low | 241 Ų | 241 | 143 Ų | 143 | 91% | 0.909 | 73% | 0.73 | S | S | * | * | trans | -42.2 | 97.7 | -176.2 | -60 | 172.6 | -173.1 | 168.1 | 0.6 | 112.4 | ||||
| 97 | H | 45.6 | Very low | 50.1 | Low | 172 Ų | 172 | 145.3 Ų | 145.3 | 80% | 0.796 | 74% | 0.741 | S | S | * | * | trans | -120.2 | 77.1 | 152.2 | -77.4 | -59 | 0 | 0 | 0 | 107.4 | K95 K99 | K95-H97 PolarHBondContact O-N 3.36Å; H97-K99 PolarHBondContact O-N 3.05Å | ||
| 98 | S | 50 | Low | 49.1 | Very low | 124 Ų | 124 | 150.6 Ų | 150.6 | 87% | 0.867 | 76% | 0.755 | S | S | * | * | trans | -68.2 | 82.7 | 151.1 | -178.5 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 99 | K | 45.8 | Very low | 48.5 | Very low | 180 Ų | 180 | 151.1 Ų | 151.1 | 78% | 0.783 | 76% | 0.757 | S | S | * | * | trans | -96.4 | 97.4 | 166.5 | -138.3 | 174 | -175.8 | -178.1 | 0 | 105.2 | H97 T101 | H97-K99 PolarHBondContact O-N 3.05Å; K99-T101 PolarHBondContact O-N 3.29Å; K99-T101 VanDerWaalsContact O-N 3.1Å | ||
| 100 | S | 47.5 | Very low | 47.6 | Very low | 108 Ų | 108 | 156.3 Ų | 156.3 | 76% | 0.755 | 78% | 0.778 | S | S | * | * | trans | -37.2 | 107.1 | 168 | 51.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 101 | T | 45.9 | Very low | 46.9 | Very low | 138 Ų | 138 | 160.1 Ų | 160.1 | 85% | 0.847 | 79% | 0.788 | S | S | * | * | trans | -111.2 | 102.3 | 156.7 | 49.6 | 0 | 0 | 0 | 0 | 108.4 | K99 | K99-T101 PolarHBondContact O-N 3.29Å; K99-T101 VanDerWaalsContact O-N 3.1Å | ||
| 102 | D | 40.2 | Very low | 46.5 | Very low | 142 Ų | 142 | 157.3 Ų | 157.3 | 76% | 0.759 | 78% | 0.784 | S | S | * | * | trans | 84.2 | 96.7 | 148 | -131.1 | -42 | 0 | 0 | 0 | 119.7 | R104 | D102-R104 PolarHBondContact O-N 2.99Š| ||
| 103 | S | 40.7 | Very low | 46.3 | Very low | 116 Ų | 116 | 155.1 Ų | 155.1 | 81% | 0.811 | 78% | 0.781 | S | S | * | * | trans | -67.5 | 96.2 | 160.4 | -62.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 104 | R | 41.8 | Very low | 46.3 | Very low | 231 Ų | 231 | 150.7 Ų | 150.7 | 87% | 0.872 | 78% | 0.778 | S | S | * | * | trans | -135.4 | 20.9 | 158.4 | -87.5 | -156.1 | 153.1 | -164.5 | -5.9 | 117.1 | D102 | D102-R104 PolarHBondContact O-N 2.99Š| ||
| 105 | L | 48.6 | Very low | 46.3 | Very low | 150 Ų | 150 | 146 Ų | 146 | 79% | 0.785 | 77% | 0.767 | S | S | * | * | trans | -135 | 78.3 | 157.2 | -78.3 | 166 | 0 | 0 | 0 | 108.2 | I107 | L105-I107 HydrophobicContact CB-CD1 4.3Å; L105-I107 HydrophobicContact CB-CG1 4.26Å; L105-I107 PolarHBondContact O-N 3.09Å | ||
| 106 | S | 40.9 | Very low | 47 | Very low | 114 Ų | 114 | 140 Ų | 140 | 80% | 0.797 | 75% | 0.748 | S | S | * | * | trans | -64.1 | 73.8 | 160.1 | 59.2 | 0 | 0 | 0 | 0 | 108.4 | K108 | S106-K108 PolarHBondContact O-N 2.8Š| ||
| 107 | I | 46.3 | Very low | 47.3 | Very low | 117 Ų | 117 | 136.4 Ų | 136.4 | 60% | 0.6 | 74% | 0.739 | S | S | * | * | trans | -78.3 | 78.8 | 164.5 | -61.1 | 166.7 | 0 | 0 | 0 | 104.6 | L105 K109 | L105-I107 HydrophobicContact CB-CD1 4.3Å; L105-I107 HydrophobicContact CB-CG1 4.26Å; L105-I107 PolarHBondContact O-N 3.09Å; I107-K109 HydrophobicContact CG2-CB 3.77Å; I107-K109 HydrophobicContact CG2-CD 4.04Å; I107-K109 HydrophobicContact CG2-CG 3.81Å; I107-K109 PolarHBondContact O-N 3.38Å | ||
| 108 | K | 41.9 | Very low | 48.1 | Very low | 199 Ų | 199 | 130.4 Ų | 130.4 | 87% | 0.865 | 72% | 0.716 | S | S | * | * | trans | -58.3 | 87.9 | 147.7 | -91.3 | 178.8 | 163.4 | -176.7 | 0 | 105.7 | S106 | S106-K108 PolarHBondContact O-N 2.8Š| ||
| 109 | K | 47.7 | Very low | 48.7 | Very low | 162 Ų | 162 | 124.7 Ų | 124.7 | 70% | 0.704 | 68% | 0.677 | S | S | * | * | trans | -134 | 103.1 | 158 | -76.7 | -175.3 | 173.5 | -178.3 | 0 | 105.8 | I107 L111 | I107-K109 HydrophobicContact CG2-CB 3.77Å; I107-K109 HydrophobicContact CG2-CD 4.04Å; I107-K109 HydrophobicContact CG2-CG 3.81Å; I107-K109 PolarHBondContact O-N 3.38Å; K109-L111 PolarHBondContact O-N 3.14Å | ||
| 110 | D | 43.6 | Very low | 49.5 | Very low | 153 Ų | 153 | 121.6 Ų | 121.6 | 82% | 0.818 | 67% | 0.668 | S | S | * | * | trans | -31.4 | 111.1 | 166.3 | -72.7 | -77.6 | 0 | 0 | 0 | 110.1 | T112 | D110-T112 PolarHBondContact O-N 2.77Š| ||
| 111 | L | 44.4 | Very low | 50.3 | Low | 150 Ų | 150 | 121.9 Ų | 121.9 | 79% | 0.785 | 66% | 0.659 | S | S | * | * | trans | -72.5 | 79.7 | 167.2 | -77.6 | 92.9 | 0 | 0 | 0 | 106.9 | K109 S113 | K109-L111 PolarHBondContact O-N 3.14Å; L111-S113 PolarHBondContact O-N 2.91Å; L111-S113 VanDerWaalsContact O-N 3.16Å | ||
| 112 | T | 49 | Very low | 51.1 | Low | 94 Ų | 94 | 115.7 Ų | 115.7 | 58% | 0.577 | 62% | 0.622 | S | S | * | * | trans | -61.5 | 112.9 | 148.4 | 43.8 | 0 | 0 | 0 | 0 | 105.5 | D110 A114 D115 | D110-T112 PolarHBondContact O-N 2.77Å; T112-A114 PolarHBondContact O-N 3.38Å; T112-D115 PolarHBondContact O-N 2.84Å | ||
| 113 | S | 51.5 | Low | 52.3 | Low | 107 Ų | 107 | 115.8 Ų | 115.8 | 75% | 0.748 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.5 | -6.5 | -165.6 | 33.6 | 0 | 0 | 0 | 0 | 116.8 | L111 S116 | L111-S113 PolarHBondContact O-N 2.91Å; L111-S113 VanDerWaalsContact O-N 3.16Å; S113-S116 PolarHBondContact O-OG 3.36Å |
| 114 | A | 51.9 | Low | 53.3 | Low | 85 Ų | 85 | 116.6 Ų | 116.6 | 70% | 0.702 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.9 | -34 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | T112 S116 | T112-A114 PolarHBondContact O-N 3.38Å; A114-S116 VanDerWaalsContact C-N 3.29Å; A114-S116 PolarHBondContact O-N 3.44Å |
| 115 | D | 50.9 | Low | 54.3 | Low | 98 Ų | 98 | 112.1 Ų | 112.1 | 52% | 0.524 | 60% | 0.604 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.2 | -8.4 | -175.4 | -77.5 | -35.5 | 0 | 0 | 0 | 114.3 | T112 K117 C118 G119 | T112-D115 PolarHBondContact O-N 2.84Å; D115-K117 VanDerWaalsContact C-N 3.35Å; D115-K117 PolarHBondContact O-N 3.11Å; D115-C118 PolarHBondContact O-N 3.07Å; D115-G119 PolarHBondContact O-N 3.04Å |
| 116 | S | 59.2 | Low | 54.4 | Low | 58 Ų | 58 | 107 Ų | 107 | 41% | 0.406 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.4 | -32.8 | -171.9 | 65.6 | 0 | 0 | 0 | 0 | 113.6 | S113 A114 L120 | S113-S116 PolarHBondContact O-OG 3.36Å; A114-S116 VanDerWaalsContact C-N 3.29Å; A114-S116 PolarHBondContact O-N 3.44Å; S116-L120 WeakPolarHBondContact O-CB 3.49Å; S116-L120 PolarHBondContact O-N 3.16Å |
| 117 | K | 60.2 | Low | 55.1 | Low | 166 Ų | 166 | 111.7 Ų | 111.7 | 72% | 0.722 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69.9 | -46.4 | -179.2 | -93.3 | -171.9 | 177.3 | -174.1 | 0 | 112.4 | D115 L120 M121 | D115-K117 VanDerWaalsContact C-N 3.35Å; D115-K117 PolarHBondContact O-N 3.11Å; K117-L120 PolarHBondContact O-N 3.23Å; K117-M121 WeakPolarHBondContact O-CB 3.44Å; K117-M121 PolarHBondContact O-N 2.98Å |
| 118 | C | 61.7 | Low | 55.7 | Low | 46 Ų | 46 | 112.6 Ų | 112.6 | 31% | 0.311 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -69.7 | -43.3 | -177.1 | -165.2 | 0 | 0 | 0 | 0 | 110.9 | D115 L120 M121 C122 C138 | D115-C118 PolarHBondContact O-N 3.07Å; C118-L120 PolarHBondContact O-N 3.45Å; C118-M121 PolarHBondContact O-N 3.07Å; C118-C122 WeakPolarHBondContact O-CB 3.17Å; C118-C122 PolarHBondContact O-N 3.34Å; C118-C122 PolarHBondContact O-SG 3.03Å; C118-C138 HydrophobicContact CB-CB 3.64Å; C118-C138 WeakPolarHBondContact CB-SG 3.36Å; C118-C138 WeakPolarHBondContact SG-CB 3.45Å; C118-C138 CovalentContact SG-SG 2.02Å; C118-C138 PolarHBondContact SG-SG 3.37Å |
| 119 | G | 62.5 | Low | 56.4 | Low | 4 Ų | 4 | 106 Ų | 106 | 4% | 0.041 | 58% | 0.583 | C | S | . | * | H | α-helix | trans | -61.3 | -40.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | D115 C122 H123 Y135 | D115-G119 PolarHBondContact O-N 3.04Å; G119-C122 PolarHBondContact O-N 2.98Å; G119-H123 WeakPolarHBondContact O-CB 3.5Å; G119-H123 PolarHBondContact O-N 3.48Å; G119-Y135 VanDerWaalsContact CA-CE1 3.49Å |
| 120 | L | 62.9 | Low | 56.8 | Low | 115 Ų | 115 | 101 Ų | 101 | 60% | 0.602 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -69.3 | -42.9 | 177.2 | -164 | 103 | 0 | 0 | 0 | 111.9 | S116 K117 C118 C122 H123 L124 | S116-L120 WeakPolarHBondContact O-CB 3.49Å; S116-L120 PolarHBondContact O-N 3.16Å; K117-L120 PolarHBondContact O-N 3.23Å; C118-L120 PolarHBondContact O-N 3.45Å; L120-C122 VanDerWaalsContact C-N 3.33Å; L120-C122 PolarHBondContact O-N 2.86Å; L120-H123 PolarHBondContact O-N 2.96Å; L120-L124 HydrophobicContact CD2-CD1 3.9Å; L120-L124 HydrophobicContact CG-CD1 4.17Å; L120-L124 WeakPolarHBondContact O-CB 3.3Å; L120-L124 WeakPolarHBondContact O-CG 3.46Å; L120-L124 PolarHBondContact O-N 3.29Å |
| 121 | M | 64.1 | Low | 57.5 | Low | 114 Ų | 114 | 95.9 Ų | 95.9 | 56% | 0.562 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.7 | -43.9 | 173.6 | -89.2 | 159.3 | 65.3 | 0 | 0 | 110.9 | K117 C118 H123 L124 L125 | K117-M121 WeakPolarHBondContact O-CB 3.44Å; K117-M121 PolarHBondContact O-N 2.98Å; C118-M121 PolarHBondContact O-N 3.07Å; M121-H123 VanDerWaalsContact C-N 3.31Å; M121-H123 PolarHBondContact O-N 3.48Å; M121-L124 PolarHBondContact O-N 3Å; M121-L125 HydrophobicContact CB-CD1 4.03Å; M121-L125 HydrophobicContact CG-CD1 4.19Å; M121-L125 WeakPolarHBondContact O-CB 3.44Å; M121-L125 WeakPolarHBondContact O-CD1 3.33Å; M121-L125 PolarHBondContact O-N 3.38Å |
| 122 | C | 63.6 | Low | 58.2 | Low | 9 Ų | 9 | 97.3 Ų | 97.3 | 6% | 0.061 | 54% | 0.543 | C | S | . | . | H | α-helix | trans | -62.2 | -38.5 | 174.6 | -78.6 | 0 | 0 | 0 | 0 | 112.4 | C118 G119 L120 L124 C126 C134 | C118-C122 WeakPolarHBondContact O-CB 3.17Å; C118-C122 PolarHBondContact O-N 3.34Å; C118-C122 PolarHBondContact O-SG 3.03Å; G119-C122 PolarHBondContact O-N 2.98Å; L120-C122 VanDerWaalsContact C-N 3.33Å; L120-C122 PolarHBondContact O-N 2.86Å; C122-L124 VanDerWaalsContact C-N 3.31Å; C122-L124 PolarHBondContact O-N 3.47Å; C122-C126 WeakPolarHBondContact O-CA 3.46Å; C122-C126 WeakPolarHBondContact O-CB 3.41Å; C122-C126 PolarHBondContact O-N 3.47Å; C122-C134 WeakPolarHBondContact CA-SG 3.4Å; C122-C134 HydrophobicContact CB-CB 3.49Å; C122-C134 VanDerWaalsContact CB-CB 3.49Å; C122-C134 WeakPolarHBondContact CB-SG 3.41Å; C122-C134 WeakPolarHBondContact SG-CA 3.33Å; C122-C134 WeakPolarHBondContact SG-CB 3.49Å; C122-C134 PolarHBondContact SG-O 2.96Å; C122-C134 VanDerWaalsContact SG-O 3.35Å; C122-C134 CovalentContact SG-SG 2.03Å; C122-C134 PolarHBondContact SG-SG 3.46Å |
| 123 | H | 64.6 | Low | 58.6 | Low | 143 Ų | 143 | 98.5 Ų | 98.5 | 66% | 0.662 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -70.4 | -27 | 176.8 | -151.9 | -62.5 | 0 | 0 | 0 | 113.7 | G119 L120 M121 | G119-H123 WeakPolarHBondContact O-CB 3.5Å; G119-H123 PolarHBondContact O-N 3.48Å; L120-H123 PolarHBondContact O-N 2.96Å; M121-H123 VanDerWaalsContact C-N 3.31Å; M121-H123 PolarHBondContact O-N 3.48Å |
| 124 | L | 62.7 | Low | 59 | Low | 134 Ų | 134 | 94.7 Ų | 94.7 | 70% | 0.702 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -85 | -38.6 | 178.2 | -72.8 | 166.7 | 0 | 0 | 0 | 112.8 | L120 M121 C122 | L120-L124 HydrophobicContact CD2-CD1 3.9Å; L120-L124 HydrophobicContact CG-CD1 4.17Å; L120-L124 WeakPolarHBondContact O-CB 3.3Å; L120-L124 WeakPolarHBondContact O-CG 3.46Å; L120-L124 PolarHBondContact O-N 3.29Å; M121-L124 PolarHBondContact O-N 3Å; C122-L124 VanDerWaalsContact C-N 3.31Å; C122-L124 PolarHBondContact O-N 3.47Å |
| 125 | L | 61.9 | Low | 59.3 | Low | 137 Ų | 137 | 96.4 Ų | 96.4 | 72% | 0.717 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -92.9 | -30.1 | -175.8 | -76.2 | 105.5 | 0 | 0 | 0 | 113.4 | M121 | M121-L125 HydrophobicContact CB-CD1 4.03Å; M121-L125 HydrophobicContact CG-CD1 4.19Å; M121-L125 WeakPolarHBondContact O-CB 3.44Å; M121-L125 WeakPolarHBondContact O-CD1 3.33Å; M121-L125 PolarHBondContact O-N 3.38Å |
| 126 | C | 51.5 | Low | 59.7 | Low | 41 Ų | 41 | 95.7 Ų | 95.7 | 28% | 0.277 | 51% | 0.51 | S | S | . | . | S | Bend | trans | -90.4 | 126.1 | -177.5 | -93 | 0 | 0 | 0 | 0 | 112.3 | C122 C130 | C122-C126 WeakPolarHBondContact O-CA 3.46Å; C122-C126 WeakPolarHBondContact O-CB 3.41Å; C122-C126 PolarHBondContact O-N 3.47Å; C126-C130 HydrophobicContact CB-CB 3.56Å; C126-C130 WeakPolarHBondContact SG-CB 3.32Å |
| 127 | R | 54.9 | Low | 59.7 | Low | 214 Ų | 214 | 97.4 Ų | 97.4 | 81% | 0.808 | 52% | 0.522 | S | S | * | . | trans | -51.8 | 148.9 | 167.9 | -151.4 | 166 | -172.6 | 177.9 | 1.7 | 109.9 | G129 C130 | R127-G129 PolarHBondContact O-N 3.04Å; R127-C130 PolarHBondContact O-N 3.33Å | ||
| 128 | P | 59.1 | Low | 59.4 | Low | 136 Ų | 136 | 91 Ų | 91 | 88% | 0.883 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.2 | 110.9 | 178.3 | -22.9 | 31.6 | 0 | 0 | 0 | 110 | ||
| 129 | G | 57.2 | Low | 58.9 | Low | 61 Ų | 61 | 97 Ų | 97 | 63% | 0.629 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 127.3 | -29.3 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115 | R127 | R127-G129 PolarHBondContact O-N 3.04Š|
| 130 | C | 55.9 | Low | 58.7 | Low | 55 Ų | 55 | 101.7 Ų | 101.7 | 37% | 0.372 | 56% | 0.558 | S | S | . | * | trans | -89.2 | -5.4 | -178.1 | -62.8 | 0 | 0 | 0 | 0 | 113.9 | C126 R127 K132 I133 C134 | C126-C130 HydrophobicContact CB-CB 3.56Å; C126-C130 WeakPolarHBondContact SG-CB 3.32Å; R127-C130 PolarHBondContact O-N 3.33Å; C130-K132 VanDerWaalsContact C-N 3.28Å; C130-K132 PolarHBondContact O-N 2.97Å; C130-I133 PolarHBondContact O-N 3.46Å; C130-C134 WeakPolarHBondContact O-CB 3.47Å; C130-C134 PolarHBondContact O-N 3.49Å; C130-C134 VanDerWaalsContact O-N 3.12Å | ||
| 131 | S | 58.8 | Low | 58.5 | Low | 47 Ų | 47 | 100.9 Ų | 100.9 | 33% | 0.329 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -58.4 | -36.3 | -177.7 | 58 | 0 | 0 | 0 | 0 | 112.8 | I133 C134 Y135 | S131-I133 PolarHBondContact O-N 3.09Å; S131-C134 PolarHBondContact O-N 3.35Å; S131-Y135 WeakPolarHBondContact O-CB 3.42Å; S131-Y135 WeakPolarHBondContact O-CD2 3.38Å; S131-Y135 PolarHBondContact O-N 2.94Å |
| 132 | K | 57.2 | Low | 58.2 | Low | 179 Ų | 179 | 100.2 Ų | 100.2 | 78% | 0.778 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -61.1 | -42.7 | 179.7 | -73.2 | -175 | -179.9 | 178.4 | 0 | 113.4 | C130 C134 S136 | C130-K132 VanDerWaalsContact C-N 3.28Å; C130-K132 PolarHBondContact O-N 2.97Å; K132-C134 VanDerWaalsContact C-N 3.34Å; K132-S136 PolarHBondContact O-N 3.05Å |
| 133 | I | 58.8 | Low | 57.8 | Low | 119 Ų | 119 | 105.6 Ų | 105.6 | 61% | 0.61 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.8 | -41.8 | 178 | -58.5 | 157.6 | 0 | 0 | 0 | 109.2 | C130 S131 Y135 S136 S137 | C130-I133 PolarHBondContact O-N 3.46Å; S131-I133 PolarHBondContact O-N 3.09Å; I133-Y135 PolarHBondContact O-N 3.47Å; I133-S136 WeakPolarHBondContact O-CA 3.44Å; I133-S136 VanDerWaalsContact O-CB 3.31Å; I133-S136 WeakPolarHBondContact O-CB 3.23Å; I133-S136 PolarHBondContact O-N 3.19Å; I133-S137 PolarHBondContact O-N 3.44Å; I133-S137 VanDerWaalsContact O-N 3.15Å; I133-S137 PolarHBondContact O-OG 3.34Å |
| 134 | C | 58.5 | Low | 57.4 | Low | 28 Ų | 28 | 103.3 Ų | 103.3 | 19% | 0.189 | 58% | 0.579 | C | S | . | * | H | α-helix | trans | -66.9 | -39.1 | -175.5 | -152.1 | 0 | 0 | 0 | 0 | 111.5 | C122 C130 S131 K132 S137 C138 | C122-C134 WeakPolarHBondContact CA-SG 3.4Å; C122-C134 HydrophobicContact CB-CB 3.49Å; C122-C134 VanDerWaalsContact CB-CB 3.49Å; C122-C134 WeakPolarHBondContact CB-SG 3.41Å; C122-C134 WeakPolarHBondContact SG-CA 3.33Å; C122-C134 WeakPolarHBondContact SG-CB 3.49Å; C122-C134 PolarHBondContact SG-O 2.96Å; C122-C134 VanDerWaalsContact SG-O 3.35Å; C122-C134 CovalentContact SG-SG 2.03Å; C122-C134 PolarHBondContact SG-SG 3.46Å; C130-C134 WeakPolarHBondContact O-CB 3.47Å; C130-C134 PolarHBondContact O-N 3.49Å; C130-C134 VanDerWaalsContact O-N 3.12Å; S131-C134 PolarHBondContact O-N 3.35Å; K132-C134 VanDerWaalsContact C-N 3.34Å; C134-S137 PolarHBondContact O-N 3.23Å; C134-C138 PolarHBondContact O-SG 3.2Å |
| 135 | Y | 58.6 | Low | 57.1 | Low | 121 Ų | 121 | 101.2 Ų | 101.2 | 48% | 0.475 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.9 | -33.3 | 169.4 | -85 | -76.9 | 0 | 0 | 0 | 113 | G119 S131 I133 S137 C138 | G119-Y135 VanDerWaalsContact CA-CE1 3.49Å; S131-Y135 WeakPolarHBondContact O-CB 3.42Å; S131-Y135 WeakPolarHBondContact O-CD2 3.38Å; S131-Y135 PolarHBondContact O-N 2.94Å; I133-Y135 PolarHBondContact O-N 3.47Å; Y135-S137 PolarHBondContact O-N 2.97Å; Y135-C138 WeakPolarHBondContact O-CB 3.29Å; Y135-C138 PolarHBondContact O-N 3.38Å |
| 136 | S | 60 | Low | 56.7 | Low | 83 Ų | 83 | 98.6 Ų | 98.6 | 58% | 0.58 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.5 | -25 | 176.5 | 179.8 | 0 | 0 | 0 | 0 | 113.2 | K132 I133 C138 T139 | K132-S136 PolarHBondContact O-N 3.05Å; I133-S136 WeakPolarHBondContact O-CA 3.44Å; I133-S136 VanDerWaalsContact O-CB 3.31Å; I133-S136 WeakPolarHBondContact O-CB 3.23Å; I133-S136 PolarHBondContact O-N 3.19Å; S136-C138 VanDerWaalsContact C-N 3.32Å; S136-T139 PolarHBondContact O-OG1 3.23Å |
| 137 | S | 59.3 | Low | 57.1 | Low | 94 Ų | 94 | 103.1 Ų | 103.1 | 66% | 0.657 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -2.6 | 175.9 | -54.6 | 0 | 0 | 0 | 0 | 113.3 | I133 C134 Y135 | I133-S137 PolarHBondContact O-N 3.44Å; I133-S137 VanDerWaalsContact O-N 3.15Å; I133-S137 PolarHBondContact O-OG 3.34Å; C134-S137 PolarHBondContact O-N 3.23Å; Y135-S137 PolarHBondContact O-N 2.97Å |
| 138 | C | 54.7 | Low | 57.3 | Low | 30 Ų | 30 | 93.8 Ų | 93.8 | 20% | 0.203 | 56% | 0.564 | C | S | . | * | trans | -91.2 | -11 | 179.1 | -59.1 | 0 | 0 | 0 | 0 | 113.6 | C118 C134 Y135 S136 | C118-C138 HydrophobicContact CB-CB 3.64Å; C118-C138 WeakPolarHBondContact CB-SG 3.36Å; C118-C138 WeakPolarHBondContact SG-CB 3.45Å; C118-C138 CovalentContact SG-SG 2.02Å; C118-C138 PolarHBondContact SG-SG 3.37Å; C134-C138 PolarHBondContact O-SG 3.2Å; Y135-C138 WeakPolarHBondContact O-CB 3.29Å; Y135-C138 PolarHBondContact O-N 3.38Å; S136-C138 VanDerWaalsContact C-N 3.32Å | ||
| 139 | T | 49.6 | Very low | 57.1 | Low | 173 Ų | 173 | 90 Ų | 90 | 100% | 1.061 | 54% | 0.535 | S | S | * | . | trans | -87.9 | 0 | 168.9 | 52.3 | 0 | 0 | 0 | 0 | 110.3 | S136 | S136-T139 PolarHBondContact O-OG1 3.23Š|
Retrieved 139 of 139 residues in 83.3 ms
(Link to these results)