| 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 | 59.7 | Low | 74.2 | Confident | 206 Ų | 206 | 121.3 Ų | 121.3 | 100% | 1.015 | 63% | 0.625 | S | S | * | * | 0 | -11.1 | 0 | -69.5 | 175.8 | 75.2 | 0 | 0 | 114.7 | S4 | M1-S4 PolarHBondContact O-OG 2Š| |||
| 2 | I | 61.7 | Low | 75.1 | Confident | 148 Ų | 148 | 118.1 Ų | 118.1 | 76% | 0.759 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -78.5 | -42.7 | -178.5 | -68 | 142.1 | 0 | 0 | 0 | 112.1 | S4 R5 S6 | I2-S4 PolarHBondContact O-N 2.92Å; I2-R5 WeakPolarHBondContact O-CB 3.2Å; I2-R5 PolarHBondContact O-N 2.82Å; I2-R5 VanDerWaalsContact O-N 3.17Å; I2-S6 PolarHBondContact O-N 3.06Å; I2-S6 PolarHBondContact O-OG 3.08Å |
| 3 | L | 65.4 | Low | 75.7 | Confident | 142 Ų | 142 | 114.8 Ų | 114.8 | 74% | 0.743 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -60.6 | -39.2 | 178.5 | -101.8 | 103.1 | 0 | 0 | 0 | 113.9 | R5 S6 L7 | L3-R5 VanDerWaalsContact C-N 3.26Å; L3-R5 PolarHBondContact O-N 3.4Å; L3-S6 WeakPolarHBondContact CA-OG 3.48Å; L3-S6 PolarHBondContact O-N 3.38Å; L3-S6 PolarHBondContact O-OG 2.93Å; L3-L7 PolarHBondContact O-N 3.23Å; L3-L7 VanDerWaalsContact O-N 3.11Å |
| 4 | S | 70.4 | Confident | 76.2 | Confident | 70 Ų | 70 | 113.8 Ų | 113.8 | 49% | 0.49 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.1 | -31.5 | 179 | 51.2 | 0 | 0 | 0 | 0 | 112 | M1 I2 L8 | M1-S4 PolarHBondContact O-OG 2Å; I2-S4 PolarHBondContact O-N 2.92Å; S4-L8 PolarHBondContact O-N 3.05Å |
| 5 | R | 72 | Confident | 76.1 | Confident | 193 Ų | 193 | 110.3 Ų | 110.3 | 73% | 0.728 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -72.3 | -41.8 | 178.5 | -122.6 | 178.7 | 163.2 | -172.8 | -5.9 | 111.4 | I2 L3 L8 I9 | I2-R5 WeakPolarHBondContact O-CB 3.2Å; I2-R5 PolarHBondContact O-N 2.82Å; I2-R5 VanDerWaalsContact O-N 3.17Å; L3-R5 VanDerWaalsContact C-N 3.26Å; L3-R5 PolarHBondContact O-N 3.4Å; R5-L8 PolarHBondContact O-N 3.3Å; R5-I9 VanDerWaalsContact O-CG1 3.31Å; R5-I9 WeakPolarHBondContact O-CG1 3.1Å; R5-I9 PolarHBondContact O-N 3.36Å |
| 6 | S | 76.6 | Confident | 76 | Confident | 52 Ų | 52 | 110.8 Ų | 110.8 | 36% | 0.364 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -67.1 | -37.4 | 175.7 | 22.7 | 0 | 0 | 0 | 0 | 112.4 | I2 L3 L8 I9 I10 | I2-S6 PolarHBondContact O-N 3.06Å; I2-S6 PolarHBondContact O-OG 3.08Å; L3-S6 WeakPolarHBondContact CA-OG 3.48Å; L3-S6 PolarHBondContact O-N 3.38Å; L3-S6 PolarHBondContact O-OG 2.93Å; S6-L8 PolarHBondContact O-N 3.06Å; S6-I9 PolarHBondContact O-N 3.36Å; S6-I10 WeakPolarHBondContact O-CG1 3.08Å; S6-I10 PolarHBondContact O-N 2.87Å |
| 7 | L | 79.4 | Confident | 75.7 | Confident | 110 Ų | 110 | 112.4 Ų | 112.4 | 58% | 0.576 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -60 | -45 | 174.6 | -109.5 | 144.1 | 0 | 0 | 0 | 112.4 | L3 I9 I10 T11 | L3-L7 PolarHBondContact O-N 3.23Å; L3-L7 VanDerWaalsContact O-N 3.11Å; L7-I9 VanDerWaalsContact C-N 3.35Å; L7-I9 PolarHBondContact O-N 2.75Å; L7-I10 PolarHBondContact O-N 3Å; L7-T11 PolarHBondContact O-N 2.79Å; L7-T11 PolarHBondContact O-OG1 2Å |
| 8 | L | 82.2 | Confident | 75.2 | Confident | 115 Ų | 115 | 113.2 Ų | 113.2 | 60% | 0.602 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -59.9 | -43.6 | 176.1 | -92.6 | 164.8 | 0 | 0 | 0 | 112.3 | S4 R5 S6 I10 T11 V12 | S4-L8 PolarHBondContact O-N 3.05Å; R5-L8 PolarHBondContact O-N 3.3Å; S6-L8 PolarHBondContact O-N 3.06Å; L8-I10 PolarHBondContact O-N 3.3Å; L8-T11 WeakPolarHBondContact CA-OG1 3.31Å; L8-T11 PolarHBondContact O-N 3.34Å; L8-T11 PolarHBondContact O-OG1 1.94Å; L8-V12 WeakPolarHBondContact O-CG2 3.33Å; L8-V12 PolarHBondContact O-N 2.76Å |
| 9 | I | 82.7 | Confident | 74.2 | Confident | 110 Ų | 110 | 110 Ų | 110 | 56% | 0.564 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -62.7 | -44.9 | 179.2 | -63.5 | 164.5 | 0 | 0 | 0 | 110.4 | R5 S6 L7 T11 V12 V13 | R5-I9 VanDerWaalsContact O-CG1 3.31Å; R5-I9 WeakPolarHBondContact O-CG1 3.1Å; R5-I9 PolarHBondContact O-N 3.36Å; S6-I9 PolarHBondContact O-N 3.36Å; L7-I9 VanDerWaalsContact C-N 3.35Å; L7-I9 PolarHBondContact O-N 2.75Å; I9-T11 VanDerWaalsContact C-N 3.35Å; I9-T11 PolarHBondContact O-N 3.12Å; I9-V12 PolarHBondContact O-N 2.81Å; I9-V13 HydrophobicContact CG2-CG2 4.43Å; I9-V13 WeakPolarHBondContact O-CG2 3.46Å; I9-V13 PolarHBondContact O-N 2.81Å |
| 10 | I | 83.2 | Confident | 73 | Confident | 114 Ų | 114 | 110.5 Ų | 110.5 | 59% | 0.585 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -62.3 | -42.9 | 178.6 | -67.1 | 165.3 | 0 | 0 | 0 | 110.8 | S6 L7 L8 V12 V13 L14 | S6-I10 WeakPolarHBondContact O-CG1 3.08Å; S6-I10 PolarHBondContact O-N 2.87Å; L7-I10 PolarHBondContact O-N 3Å; L8-I10 PolarHBondContact O-N 3.3Å; I10-V12 PolarHBondContact O-N 3.45Å; I10-V13 PolarHBondContact O-N 3.23Å; I10-L14 WeakPolarHBondContact O-CB 3.08Å; I10-L14 PolarHBondContact O-N 3.47Å |
| 11 | T | 83.2 | Confident | 71.8 | Confident | 74 Ų | 74 | 113.3 Ų | 113.3 | 45% | 0.454 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -63.9 | -38.1 | 177.9 | 47.3 | 0 | 0 | 0 | 0 | 113.2 | L7 L8 I9 A15 | L7-T11 PolarHBondContact O-N 2.79Å; L7-T11 PolarHBondContact O-OG1 2Å; L8-T11 WeakPolarHBondContact CA-OG1 3.31Å; L8-T11 PolarHBondContact O-N 3.34Å; L8-T11 PolarHBondContact O-OG1 1.94Å; I9-T11 VanDerWaalsContact C-N 3.35Å; I9-T11 PolarHBondContact O-N 3.12Å; T11-A15 WeakPolarHBondContact O-CB 3.28Å; T11-A15 PolarHBondContact O-N 3.47Å |
| 12 | V | 84.4 | Confident | 71.4 | Confident | 83 Ų | 83 | 108.2 Ų | 108.2 | 50% | 0.503 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -68.5 | -44.2 | 177.2 | 171.5 | 0 | 0 | 0 | 0 | 111 | L8 I9 I10 L14 A15 I16 | L8-V12 WeakPolarHBondContact O-CG2 3.33Å; L8-V12 PolarHBondContact O-N 2.76Å; I9-V12 PolarHBondContact O-N 2.81Å; I10-V12 PolarHBondContact O-N 3.45Å; V12-L14 VanDerWaalsContact C-N 3.33Å; V12-L14 PolarHBondContact O-N 2.89Å; V12-A15 PolarHBondContact O-N 2.74Å; V12-I16 HydrophobicContact CG1-CD1 3.93Å; V12-I16 WeakPolarHBondContact O-CG1 3.37Å; V12-I16 PolarHBondContact O-N 3.45Å |
| 13 | V | 82.7 | Confident | 70.9 | Confident | 75 Ų | 75 | 106.7 Ų | 106.7 | 46% | 0.455 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -62.2 | -42.8 | 177.2 | 172.1 | 0 | 0 | 0 | 0 | 110.9 | I9 I10 A15 I16 L17 | I9-V13 HydrophobicContact CG2-CG2 4.43Å; I9-V13 WeakPolarHBondContact O-CG2 3.46Å; I9-V13 PolarHBondContact O-N 2.81Å; I10-V13 PolarHBondContact O-N 3.23Å; V13-A15 VanDerWaalsContact C-N 3.35Å; V13-A15 PolarHBondContact O-N 3.34Å; V13-I16 PolarHBondContact O-N 3.16Å; V13-L17 HydrophobicContact CG1-CD1 3.79Å; V13-L17 VanDerWaalsContact O-CD1 3.23Å; V13-L17 WeakPolarHBondContact O-CD1 3.27Å; V13-L17 PolarHBondContact O-N 3.4Å |
| 14 | L | 82.6 | Confident | 70.2 | Confident | 101 Ų | 101 | 102.7 Ų | 102.7 | 53% | 0.529 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -65.1 | -38.6 | 177.6 | -163.5 | 70.4 | 0 | 0 | 0 | 111.9 | I10 V12 I16 L17 L18 | I10-L14 WeakPolarHBondContact O-CB 3.08Å; I10-L14 PolarHBondContact O-N 3.47Å; V12-L14 VanDerWaalsContact C-N 3.33Å; V12-L14 PolarHBondContact O-N 2.89Å; L14-I16 VanDerWaalsContact C-N 3.35Å; L14-I16 PolarHBondContact O-N 2.72Å; L14-L17 PolarHBondContact O-N 3.29Å; L14-L18 HydrophobicContact CD2-CD1 4.41Å; L14-L18 HydrophobicContact CG-CD1 3.89Å; L14-L18 WeakPolarHBondContact O-CB 3.44Å; L14-L18 WeakPolarHBondContact O-CD1 2.85Å; L14-L18 WeakPolarHBondContact O-CG 3.21Å; L14-L18 PolarHBondContact O-N 2.04Å |
| 15 | A | 75.2 | Confident | 69.3 | Low | 61 Ų | 61 | 100.6 Ų | 100.6 | 50% | 0.504 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.1 | -35.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | T11 V12 V13 A19 | T11-A15 WeakPolarHBondContact O-CB 3.28Å; T11-A15 PolarHBondContact O-N 3.47Å; V12-A15 PolarHBondContact O-N 2.74Å; V13-A15 VanDerWaalsContact C-N 3.35Å; V13-A15 PolarHBondContact O-N 3.34Å; A15-A19 PolarHBondContact O-N 3.01Å |
| 16 | I | 75.3 | Confident | 68.1 | Low | 119 Ų | 119 | 98.7 Ų | 98.7 | 61% | 0.61 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -71.3 | -39.3 | 175.5 | -63.9 | 162.8 | 0 | 0 | 0 | 111 | V12 V13 L14 L18 A19 | V12-I16 HydrophobicContact CG1-CD1 3.93Å; V12-I16 WeakPolarHBondContact O-CG1 3.37Å; V12-I16 PolarHBondContact O-N 3.45Å; V13-I16 PolarHBondContact O-N 3.16Å; L14-I16 VanDerWaalsContact C-N 3.35Å; L14-I16 PolarHBondContact O-N 2.72Å; I16-L18 VanDerWaalsContact C-N 3.33Å; I16-A19 WeakPolarHBondContact O-CB 3.04Å; I16-A19 PolarHBondContact O-N 3.29Å |
| 17 | L | 69.6 | Low | 67 | Low | 137 Ų | 137 | 97.3 Ų | 97.3 | 72% | 0.717 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.6 | -33.4 | 176 | -96.1 | 90.1 | 0 | 0 | 0 | 112.9 | V13 L14 | V13-L17 HydrophobicContact CG1-CD1 3.79Å; V13-L17 VanDerWaalsContact O-CD1 3.23Å; V13-L17 WeakPolarHBondContact O-CD1 3.27Å; V13-L17 PolarHBondContact O-N 3.4Å; L14-L17 PolarHBondContact O-N 3.29Å |
| 18 | L | 67.8 | Low | 65.9 | Low | 128 Ų | 128 | 97.3 Ų | 97.3 | 67% | 0.67 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -85.1 | -10.3 | 178.3 | -71.9 | 164.8 | 0 | 0 | 0 | 113 | L14 I16 P20 | L14-L18 HydrophobicContact CD2-CD1 4.41Å; L14-L18 HydrophobicContact CG-CD1 3.89Å; L14-L18 WeakPolarHBondContact O-CB 3.44Å; L14-L18 WeakPolarHBondContact O-CD1 2.85Å; L14-L18 WeakPolarHBondContact O-CG 3.21Å; L14-L18 PolarHBondContact O-N 2.04Å; I16-L18 VanDerWaalsContact C-N 3.33Å; L18-P20 WeakPolarHBondContact O-CD 3.09Å; L18-P20 VanDerWaalsContact O-N 3.12Å |
| 19 | A | 55.6 | Low | 64.4 | Low | 52 Ų | 52 | 94.1 Ų | 94.1 | 43% | 0.43 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -62.1 | 117.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | A15 I16 M21 | A15-A19 PolarHBondContact O-N 3.01Å; I16-A19 WeakPolarHBondContact O-CB 3.04Å; I16-A19 PolarHBondContact O-N 3.29Å; A19-M21 PolarHBondContact O-N 3.27Å |
| 20 | P | 51.2 | Low | 63.2 | Low | 120 Ų | 120 | 92.6 Ų | 92.6 | 78% | 0.779 | 54% | 0.543 | S | S | * | . | trans | -61.2 | 114.6 | -177.3 | 24.6 | -31.2 | 0 | 0 | 0 | 107.1 | L18 | L18-P20 WeakPolarHBondContact O-CD 3.09Å; L18-P20 VanDerWaalsContact O-N 3.12Å | ||
| 21 | M | 47.9 | Very low | 62.3 | Low | 170 Ų | 170 | 87.2 Ų | 87.2 | 84% | 0.837 | 52% | 0.515 | S | S | * | . | trans | -51.6 | 121.5 | 172 | -67.5 | -130 | -178.6 | 0 | 0 | 106.5 | A19 T23 | A19-M21 PolarHBondContact O-N 3.27Å; M21-T23 PolarHBondContact O-N 3.29Å | ||
| 22 | P | 49.4 | Very low | 61.7 | Low | 98 Ų | 98 | 87.8 Ų | 87.8 | 64% | 0.636 | 51% | 0.512 | S | S | * | . | trans | -60.5 | 121.9 | -177.4 | 25.8 | -32.3 | 0 | 0 | 0 | 106.2 | D24 | P22-D24 WeakPolarHBondContact CB-OD2 2.96Å; P22-D24 PolarHBondContact O-N 3.33Å | ||
| 23 | T | 52.2 | Low | 61.3 | Low | 116 Ų | 116 | 84 Ų | 84 | 71% | 0.712 | 49% | 0.49 | S | S | * | . | trans | -69.4 | 67.7 | 173.5 | 49.7 | 0 | 0 | 0 | 0 | 108.2 | M21 | M21-T23 PolarHBondContact O-N 3.29Š| ||
| 24 | D | 51.3 | Low | 61.1 | Low | 59 Ų | 59 | 89.8 Ų | 89.8 | 32% | 0.316 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 112.3 | 173.6 | -76.6 | -43.5 | 0 | 0 | 0 | 106.3 | P22 Q32 | P22-D24 WeakPolarHBondContact CB-OD2 2.96Å; P22-D24 PolarHBondContact O-N 3.33Å; D24-Q32 HydrophobicContact CB-CB 4.32Å; D24-Q32 HydrophobicContact CB-CG 4.32Å |
| 25 | A | 50.1 | Low | 60.9 | Low | 25 Ų | 25 | 87.9 Ų | 87.9 | 21% | 0.207 | 49% | 0.494 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 138.7 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | I27 G31 C33 L35 | A25-I27 PolarHBondContact O-N 2.83Å; A25-G31 VanDerWaalsContact O-O 3.13Å; A25-C33 PolarHBondContact N-O 3.16Å; A25-L35 HydrophobicContact CB-CD1 3.13Å; A25-L35 HydrophobicContact CB-CD2 3.89Å; A25-L35 HydrophobicContact CB-CG 3.35Å |
| 26 | Q | 47.8 | Very low | 61.3 | Low | 154 Ų | 154 | 87.5 Ų | 87.5 | 72% | 0.72 | 49% | 0.485 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75 | 107.1 | 174 | -68.9 | 174.1 | -6.1 | 0 | 0 | 109.2 | G31 | Q26-G31 VanDerWaalsContact CA-O 3.26Å; Q26-G31 WeakPolarHBondContact CA-O 3.48Å |
| 27 | I | 53.9 | Low | 61.9 | Low | 22 Ų | 22 | 86.4 Ų | 86.4 | 11% | 0.113 | 49% | 0.486 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.3 | 120.4 | 169.9 | -51.2 | -159.5 | 0 | 0 | 0 | 109.3 | A25 G29 G31 L35 C75 L87 | A25-I27 PolarHBondContact O-N 2.83Å; I27-G29 PolarHBondContact O-N 2.89Å; I27-G31 PolarHBondContact N-O 2.74Å; I27-L35 HydrophobicContact CD1-CD2 3.88Å; I27-L35 HydrophobicContact CG1-CD2 4.41Å; I27-C75 WeakPolarHBondContact CD1-SG 3.5Å; I27-L87 HydrophobicContact CG2-CB 3.79Å; I27-L87 HydrophobicContact CG2-CD1 3.86Å; I27-L87 HydrophobicContact CG2-CG 3.64Å |
| 28 | L | 55 | Low | 62.8 | Low | 111 Ų | 111 | 81.6 Ų | 81.6 | 58% | 0.581 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.4 | 52.1 | 176.2 | -92.8 | 149.4 | 0 | 0 | 0 | 115.7 | N85 L87 | L28-N85 HydrophobicContact CB-CB 4.26Å; L28-N85 WeakPolarHBondContact O-CB 3.35Å; L28-N85 PolarHBondContact O-ND2 3.25Å; L28-L87 HydrophobicContact CD1-CD1 3.64Å; L28-L87 HydrophobicContact CD1-CG 4.16Å |
| 29 | G | 51.2 | Low | 64 | Low | 48 Ų | 48 | 86 Ų | 86 | 50% | 0.495 | 47% | 0.468 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 93.2 | 76.5 | 167.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | I27 | I27-G29 PolarHBondContact O-N 2.89Š|
| 30 | S | 57.9 | Low | 65.7 | Low | 78 Ų | 78 | 83.8 Ų | 83.8 | 55% | 0.545 | 45% | 0.449 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90.8 | -4.1 | 162.3 | -126.3 | 0 | 0 | 0 | 0 | 117.7 | ||
| 31 | G | 64.4 | Low | 67.8 | Low | 0 Ų | 0 | 82.1 Ų | 82.1 | 0% | 0 | 44% | 0.44 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.8 | 136.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | A25 Q26 I27 S82 P84 C86 | A25-G31 VanDerWaalsContact O-O 3.13Å; Q26-G31 VanDerWaalsContact CA-O 3.26Å; Q26-G31 WeakPolarHBondContact CA-O 3.48Å; I27-G31 PolarHBondContact N-O 2.74Å; G31-S82 CarbonylContact C-O 3.56Å; G31-S82 WeakPolarHBondContact CA-O 3.45Å; G31-P84 PolarHBondContact N-O 3.3Å; G31-C86 WeakPolarHBondContact CA-SG 3.47Å |
| 32 | Q | 70.9 | Confident | 70 | Confident | 86 Ų | 86 | 76.7 Ų | 76.7 | 40% | 0.402 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.1 | 119.6 | 180 | -68.5 | 179.7 | -31 | 0 | 0 | 112.7 | D24 C80 R81 S82 | D24-Q32 HydrophobicContact CB-CB 4.32Å; D24-Q32 HydrophobicContact CB-CG 4.32Å; Q32-C80 VanDerWaalsContact C-SG 3.59Å; Q32-C80 CarbonylContact O-C 3.56Å; Q32-C80 VanDerWaalsContact O-CA 3.28Å; Q32-C80 WeakPolarHBondContact O-CA 3.05Å; Q32-C80 WeakPolarHBondContact O-CB 3.32Å; Q32-C80 PolarHBondContact O-SG 3.23Å; Q32-C80 VanDerWaalsContact O-SG 3.34Å; Q32-R81 PolarHBondContact O-N 3.04Å; Q32-S82 WeakPolarHBondContact CB-OG 2.68Å; Q32-S82 PolarHBondContact N-O 3.45Å; Q32-S82 PolarHBondContact OE1-OG 2.76Å |
| 33 | C | 76.5 | Confident | 72.1 | Confident | 4 Ų | 4 | 74.7 Ų | 74.7 | 3% | 0.027 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.2 | 153.7 | 178.5 | 112.5 | 0 | 0 | 0 | 0 | 113.1 | A25 L35 C75 C80 | A25-C33 PolarHBondContact N-O 3.16Å; C33-L35 PolarHBondContact O-N 3.32Å; C33-C75 HydrophobicContact CB-CB 3.88Å; C33-C75 WeakPolarHBondContact CB-SG 3.36Å; C33-C75 VanDerWaalsContact SG-CA 3.54Å; C33-C75 WeakPolarHBondContact SG-CB 3.16Å; C33-C75 CovalentContact SG-SG 2Å; C33-C75 PolarHBondContact SG-SG 3.21Å; C33-C80 HydrophobicContact CB-CB 4.37Å; C33-C80 WeakPolarHBondContact CB-SG 3.09Å |
| 34 | R | 77.1 | Confident | 74.1 | Confident | 197 Ų | 197 | 70 Ų | 70 | 74% | 0.743 | 40% | 0.395 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.6 | 108.4 | 166.4 | -173.4 | 178.5 | -177 | -178 | 1 | 109.9 | ||
| 35 | L | 79.6 | Confident | 76.1 | Confident | 61 Ų | 61 | 69.2 Ų | 69.2 | 32% | 0.319 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.4 | 135.7 | 170.3 | -70.8 | 179.6 | 0 | 0 | 0 | 111 | A25 I27 C33 P73 V74 | A25-L35 HydrophobicContact CB-CD1 3.13Å; A25-L35 HydrophobicContact CB-CD2 3.89Å; A25-L35 HydrophobicContact CB-CG 3.35Å; I27-L35 HydrophobicContact CD1-CD2 3.88Å; I27-L35 HydrophobicContact CG1-CD2 4.41Å; C33-L35 PolarHBondContact O-N 3.32Å; L35-P73 HydrophobicContact CB-CB 4.44Å; L35-P73 HydrophobicContact CD1-CB 3.81Å; L35-P73 HydrophobicContact CD2-CB 4.06Å; L35-P73 HydrophobicContact CG-CB 4.34Å; L35-V74 CarbonylContact C-O 3.5Å; L35-V74 WeakPolarHBondContact CA-O 3.44Å |
| 36 | T | 83.2 | Confident | 78 | Confident | 53 Ų | 53 | 68 Ų | 68 | 33% | 0.325 | 38% | 0.382 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.8 | 119.3 | 173.9 | -48.2 | 0 | 0 | 0 | 0 | 107.1 | I38 V74 G76 | T36-I38 PolarHBondContact O-N 3.48Å; T36-V74 PolarHBondContact N-O 3.03Å; T36-V74 WeakPolarHBondContact O-CG2 3.26Å; T36-V74 PolarHBondContact O-N 3.05Å; T36-V74 VanDerWaalsContact O-N 3.16Å; T36-G76 WeakPolarHBondContact OG1-CA 3.5Å; T36-G76 PolarHBondContact OG1-N 3Å |
| 37 | P | 87.2 | Confident | 79.9 | Confident | 96 Ų | 96 | 60.8 Ų | 60.8 | 62% | 0.623 | 35% | 0.348 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73 | 124.2 | 176 | 28.1 | -31.4 | 0 | 0 | 0 | 109.7 | V71 | P37-V71 HydrophobicContact CB-CG1 3.56Å |
| 38 | I | 88.2 | Confident | 81.4 | Confident | 36 Ų | 36 | 60.2 Ų | 60.2 | 19% | 0.185 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 140.6 | 170.7 | -0.1 | 158 | 0 | 0 | 0 | 109.6 | T36 V71 V72 V74 L89 T92 | T36-I38 PolarHBondContact O-N 3.48Å; I38-V71 CarbonylContact O-C 3.47Å; I38-V71 WeakPolarHBondContact O-CA 3.43Å; I38-V72 PolarHBondContact N-O 3.04Å; I38-V72 PolarHBondContact O-N 3.03Å; I38-V74 HydrophobicContact CD1-CB 4.22Å; I38-V74 HydrophobicContact CD1-CG1 3.77Å; I38-V74 HydrophobicContact CD1-CG2 3.41Å; I38-V74 VanDerWaalsContact CD1-CG2 3.41Å; I38-V74 HydrophobicContact CG1-CB 4.46Å; I38-V74 HydrophobicContact CG1-CG1 4.26Å; I38-V74 HydrophobicContact CG1-CG2 3.4Å; I38-V74 VanDerWaalsContact CG1-CG2 3.4Å; I38-L89 HydrophobicContact CD1-CD1 3.51Å; I38-L89 HydrophobicContact CD1-CD2 3.51Å; I38-L89 HydrophobicContact CD1-CG 4.09Å; I38-L89 HydrophobicContact CG1-CD2 4.26Å; I38-T92 HydrophobicContact CD1-CG2 3.45Å; I38-T92 VanDerWaalsContact CD1-CG2 3.45Å; I38-T92 HydrophobicContact CG2-CG2 4.37Å |
| 39 | R | 92.8 | Very high | 82.6 | Confident | 219 Ų | 219 | 59.1 Ų | 59.1 | 83% | 0.826 | 33% | 0.333 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -85.7 | 132.3 | 170.1 | -71.2 | -177.2 | -176.1 | -170.4 | 1.6 | 109.3 | V71 | R39-V71 HydrophobicContact CG-CG2 4.12Å |
| 40 | V | 91.7 | Very high | 83.8 | Confident | 7 Ų | 7 | 58.7 Ų | 58.7 | 4% | 0.042 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 128.1 | 178.5 | -171.7 | 0 | 0 | 0 | 0 | 107.6 | V46 I66 D69 A70 V72 T92 | V40-V46 HydrophobicContact CB-CG2 4.36Å; V40-V46 HydrophobicContact CG1-CG2 4.18Å; V40-V46 HydrophobicContact CG2-CG2 3.53Å; V40-I66 HydrophobicContact CB-CB 4.5Å; V40-I66 HydrophobicContact CB-CG1 4.24Å; V40-I66 HydrophobicContact CB-CG2 4.38Å; V40-I66 HydrophobicContact CG1-CB 3.99Å; V40-I66 HydrophobicContact CG1-CG1 3.83Å; V40-I66 HydrophobicContact CG1-CG2 4.34Å; V40-D69 WeakPolarHBondContact O-CA 3.1Å; V40-A70 PolarHBondContact N-O 3.02Å; V40-A70 PolarHBondContact O-N 3.5Å; V40-V72 HydrophobicContact CB-CG2 4.45Å; V40-V72 HydrophobicContact CG2-CB 4.42Å; V40-V72 HydrophobicContact CG2-CG2 4.03Å; V40-T92 HydrophobicContact CG2-CG2 4.12Å |
| 41 | S | 95.1 | Very high | 84.4 | Confident | 84 Ų | 84 | 55 Ų | 55 | 59% | 0.587 | 29% | 0.294 | S | S | * | . | trans | -71.9 | 157.3 | 179.4 | -60.7 | 0 | 0 | 0 | 0 | 111.8 | G43 G44 D69 | S41-G43 PolarHBondContact O-N 3.28Å; S41-G44 WeakPolarHBondContact O-CA 3.17Å; S41-G44 PolarHBondContact O-N 3.27Å; S41-D69 WeakPolarHBondContact CA-OD1 3.38Å | ||
| 42 | A | 93.8 | Very high | 84.4 | Confident | 57 Ų | 57 | 60.1 Ų | 60.1 | 47% | 0.471 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.8 | 130.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111 | G44 D69 | A42-G44 VanDerWaalsContact C-N 3.26Å; A42-G44 PolarHBondContact O-N 3.46Å; A42-D69 PolarHBondContact N-OD1 3.11Å |
| 43 | G | 93.5 | Very high | 84.1 | Confident | 56 Ų | 56 | 64.6 Ų | 64.6 | 58% | 0.577 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83 | -8.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | S41 I66 | S41-G43 PolarHBondContact O-N 3.28Å; G43-I66 WeakPolarHBondContact CA-O 3.36Å; G43-I66 PolarHBondContact N-O 3.39Å |
| 44 | G | 94 | Very high | 83.3 | Confident | 18 Ų | 18 | 74.7 Ų | 74.7 | 19% | 0.186 | 37% | 0.367 | C | S | . | . | trans | -65.3 | 168.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | S41 A42 I66 | S41-G44 WeakPolarHBondContact O-CA 3.17Å; S41-G44 PolarHBondContact O-N 3.27Å; A42-G44 VanDerWaalsContact C-N 3.26Å; A42-G44 PolarHBondContact O-N 3.46Å; G44-I66 PolarHBondContact O-N 3.45Å | ||
| 45 | T | 93.8 | Very high | 82.8 | Confident | 42 Ų | 42 | 72.4 Ų | 72.4 | 26% | 0.258 | 37% | 0.369 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.5 | 114.6 | -175.5 | -57.4 | 0 | 0 | 0 | 0 | 111 | C63 R64 T92 | T45-C63 HydrophobicContact CG2-CB 4Å; T45-R64 CarbonylContact C-O 3.55Å; T45-R64 WeakPolarHBondContact CA-O 3.35Å; T45-T92 PolarHBondContact N-OXT 3.17Å; T45-T92 CarbonylContact O-C 3.57Å; T45-T92 VanDerWaalsContact O-C 3.24Å; T45-T92 WeakPolarHBondContact O-CA 3.47Å |
| 46 | V | 90.5 | Very high | 82 | Confident | 0 Ų | 0 | 74 Ų | 74 | 0% | 0 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.6 | 117.8 | 173.6 | -177.6 | 0 | 0 | 0 | 0 | 108.8 | V40 E48 C63 R64 I66 V72 V74 L89 T92 | V40-V46 HydrophobicContact CB-CG2 4.36Å; V40-V46 HydrophobicContact CG1-CG2 4.18Å; V40-V46 HydrophobicContact CG2-CG2 3.53Å; V46-E48 HydrophobicContact CG1-CG 3.97Å; V46-C63 CarbonylContact O-C 3.44Å; V46-C63 WeakPolarHBondContact O-CA 3.04Å; V46-R64 HydrophobicContact CB-CG 3.94Å; V46-R64 PolarHBondContact N-O 3.29Å; V46-R64 WeakPolarHBondContact O-CG 2.97Å; V46-R64 PolarHBondContact O-N 2.95Å; V46-I66 HydrophobicContact CG2-CD1 4.19Å; V46-I66 HydrophobicContact CG2-CG1 3.83Å; V46-V72 HydrophobicContact CG2-CB 4.42Å; V46-V72 HydrophobicContact CG2-CG1 4.32Å; V46-V72 HydrophobicContact CG2-CG2 4.28Å; V46-V74 HydrophobicContact CG1-CG1 3.91Å; V46-L89 HydrophobicContact CG1-CD1 3.93Å; V46-T92 HydrophobicContact CG2-CG2 4.36Å |
| 47 | C | 87.5 | Confident | 81.1 | Confident | 1 Ų | 1 | 83.2 Ų | 83.2 | 1% | 0.007 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.2 | 130.4 | 173.1 | -67.3 | 0 | 0 | 0 | 0 | 110.4 | L62 C63 L90 Y91 | C47-L62 CarbonylContact C-O 3.58Å; C47-L62 WeakPolarHBondContact CA-O 3.41Å; C47-C63 HydrophobicContact CB-CB 4.19Å; C47-C63 WeakPolarHBondContact CB-SG 3.44Å; C47-C63 WeakPolarHBondContact SG-CB 3.36Å; C47-C63 CovalentContact SG-SG 2.04Å; C47-C63 PolarHBondContact SG-SG 3.43Å; C47-L90 VanDerWaalsContact O-CB 3.31Å; C47-L90 WeakPolarHBondContact O-CB 3.23Å; C47-L90 PolarHBondContact O-N 2.93Å; C47-Y91 HydrophobicContact CB-CD1 4.08Å; C47-Y91 HydrophobicContact CB-CD2 4.19Å; C47-Y91 HydrophobicContact CB-CE1 3.73Å; C47-Y91 HydrophobicContact CB-CE2 3.87Å; C47-Y91 HydrophobicContact CB-CG 4.3Å; C47-Y91 PolarHBondContact N-O 3Å; C47-Y91 PolarHBondContact O-N 3.39Å; C47-Y91 WeakPolarHBondContact SG-CE2 3.35Å; C47-Y91 PolarHBondContact SG-OH 2.81Å |
| 48 | E | 84.8 | Confident | 79.9 | Confident | 10 Ų | 10 | 79.9 Ų | 79.9 | 5% | 0.047 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.8 | 149.3 | -179.1 | -49.7 | 175.7 | 73.6 | 0 | 0 | 109.5 | V46 S61 L62 R64 L87 Q88 | V46-E48 HydrophobicContact CG1-CG 3.97Å; E48-S61 CarbonylContact O-C 3.49Å; E48-S61 WeakPolarHBondContact O-CA 3.36Å; E48-L62 PolarHBondContact N-O 3.37Å; E48-L62 PolarHBondContact O-N 2.72Å; E48-R64 IonicContact OE1-NH2 3.97Å; E48-R64 IonicContact OE2-CZ 3.28Å; E48-R64 VanDerWaalsContact OE2-CZ 3.28Å; E48-R64 IonicContact OE2-NE 3.23Å; E48-R64 PolarHBondContact OE2-NE 3.17Å; E48-R64 IonicContact OE2-NH2 2.74Å; E48-R64 PolarHBondContact OE2-NH2 3.26Å; E48-L87 HydrophobicContact CB-CB 3.8Å; E48-L87 HydrophobicContact CB-CD1 4.25Å; E48-Q88 CarbonylContact C-O 3.51Å; E48-Q88 WeakPolarHBondContact CA-O 3.34Å |
| 49 | R | 79.7 | Confident | 78.6 | Confident | 88 Ų | 88 | 82.4 Ų | 82.4 | 33% | 0.332 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 146.2 | 173.3 | 59.3 | 179.7 | -166.7 | 173.4 | 8.9 | 111.4 | C51 L87 Q88 L90 | R49-C51 PolarHBondContact O-N 3.06Å; R49-L87 CarbonylContact O-C 3.24Å; R49-L87 VanDerWaalsContact O-CA 3.27Å; R49-L87 WeakPolarHBondContact O-CA 3.22Å; R49-Q88 HydrophobicContact CG-CB 4.12Å; R49-Q88 VanDerWaalsContact CZ-OE1 3.23Å; R49-Q88 PolarHBondContact N-O 3.04Å; R49-Q88 PolarHBondContact O-N 2.98Å; R49-L90 HydrophobicContact CB-CD1 3.55Å; R49-L90 HydrophobicContact CG-CD1 3.85Å; R49-L90 HydrophobicContact CG-CG 4.31Å |
| 50 | L | 76.9 | Confident | 77.5 | Confident | 39 Ų | 39 | 77.4 Ų | 77.4 | 20% | 0.204 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.8 | 129.8 | 168.7 | -138.3 | 110.9 | 0 | 0 | 0 | 110 | Y56 C86 L87 | L50-Y56 HydrophobicContact CD2-CE1 4.18Å; L50-C86 CarbonylContact C-O 3.51Å; L50-C86 WeakPolarHBondContact CA-O 3.4Å; L50-L87 HydrophobicContact CB-CD2 4.41Å; L50-L87 HydrophobicContact CD1-CD2 3.92Å; L50-L87 HydrophobicContact CG-CD2 4.35Å |
| 51 | C | 70.5 | Confident | 77 | Confident | 1 Ų | 1 | 79.7 Ų | 79.7 | 1% | 0.007 | 42% | 0.415 | C | S | . | . | trans | -136.3 | 75.9 | -166.3 | -145.2 | 0 | 0 | 0 | 0 | 109.2 | R49 C79 C86 Q88 | R49-C51 PolarHBondContact O-N 3.06Å; C51-C79 VanDerWaalsContact CA-SG 3.58Å; C51-C79 HydrophobicContact CB-CB 3.73Å; C51-C79 WeakPolarHBondContact CB-SG 3.48Å; C51-C79 WeakPolarHBondContact SG-CA 3.44Å; C51-C79 WeakPolarHBondContact SG-CB 3.41Å; C51-C79 CovalentContact SG-SG 2Å; C51-C79 PolarHBondContact SG-SG 3.32Å; C51-C86 PolarHBondContact N-O 2.96Å; C51-Q88 HydrophobicContact CB-CB 3.81Å; C51-Q88 PolarHBondContact SG-OE1 3.36Å | ||
| 52 | F | 65.8 | Low | 76.4 | Confident | 107 Ų | 107 | 80 Ų | 80 | 47% | 0.469 | 41% | 0.409 | S | S | . | . | S | Bend | trans | -80.7 | -31.8 | 177.6 | -173.6 | -111.5 | 0 | 0 | 0 | 112.5 | Y56 P84 | F52-Y56 HydrophobicContact CB-CD1 4.28Å; F52-Y56 HydrophobicContact CB-CG 4.39Å; F52-P84 HydrophobicContact CD2-CB 4.42Å; F52-P84 HydrophobicContact CE2-CB 4.18Å |
| 53 | R | 62.8 | Low | 76.1 | Confident | 181 Ų | 181 | 80.4 Ų | 80.4 | 68% | 0.683 | 41% | 0.408 | S | S | * | . | S | Bend | trans | -147.8 | 155.8 | 174.8 | -67.7 | -171.9 | -179.6 | -173.4 | -0.2 | 109.1 | D55 Y56 C79 | R53-D55 PolarHBondContact O-N 3.37Å; R53-Y56 WeakPolarHBondContact O-CB 3.36Å; R53-Y56 PolarHBondContact O-N 2.82Å; R53-C79 VanDerWaalsContact C-SG 3.54Å; R53-C79 PolarHBondContact O-SG 2.83Å; R53-C79 VanDerWaalsContact O-SG 3.38Å |
| 54 | R | 60.1 | Low | 75.9 | Confident | 216 Ų | 216 | 82.4 Ų | 82.4 | 82% | 0.815 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.4 | -35 | -175.7 | -126.8 | -179.2 | -172.7 | -175.3 | 1.6 | 113.6 | ||
| 55 | D | 66.4 | Low | 75.8 | Confident | 148 Ų | 148 | 91.6 Ų | 91.6 | 79% | 0.791 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.9 | 5.4 | -176 | -47 | -53.1 | 0 | 0 | 0 | 113.2 | R53 R57 | R53-D55 PolarHBondContact O-N 3.37Å; D55-R57 PolarHBondContact O-N 2.87Å; D55-R57 VanDerWaalsContact O-N 3.08Å |
| 56 | Y | 63 | Low | 75.7 | Confident | 95 Ų | 95 | 90.2 Ų | 90.2 | 37% | 0.373 | 42% | 0.418 | S | S | . | . | trans | -71.2 | 106.4 | 179.3 | -173.3 | -111.1 | 0 | 0 | 0 | 109.9 | L50 F52 R53 G58 P59 | L50-Y56 HydrophobicContact CD2-CE1 4.18Å; F52-Y56 HydrophobicContact CB-CD1 4.28Å; F52-Y56 HydrophobicContact CB-CG 4.39Å; R53-Y56 WeakPolarHBondContact O-CB 3.36Å; R53-Y56 PolarHBondContact O-N 2.82Å; Y56-G58 VanDerWaalsContact CZ-CA 3.48Å; Y56-G58 PolarHBondContact O-N 3.43Å; Y56-P59 WeakPolarHBondContact OH-CD 3.38Å | ||
| 57 | R | 65.6 | Low | 75.9 | Confident | 247 Ų | 247 | 95.8 Ų | 95.8 | 93% | 0.932 | 45% | 0.454 | S | S | * | . | trans | -87.7 | 50.9 | 171.2 | -63.7 | -174.3 | -178.1 | -174.3 | 0.2 | 111 | D55 | D55-R57 PolarHBondContact O-N 2.87Å; D55-R57 VanDerWaalsContact O-N 3.08Å | ||
| 58 | G | 60.6 | Low | 76.2 | Confident | 26 Ų | 26 | 105 Ų | 105 | 27% | 0.268 | 49% | 0.489 | S | S | . | . | P | Polyproline II helix | trans | -59.1 | 172.1 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y56 | Y56-G58 VanDerWaalsContact CZ-CA 3.48Å; Y56-G58 PolarHBondContact O-N 3.43Å |
| 59 | P | 60.8 | Low | 76.7 | Confident | 88 Ų | 88 | 110.3 Ų | 110.3 | 57% | 0.571 | 52% | 0.518 | S | S | * | . | S | Bend | trans | -56.9 | 163.6 | -177.2 | 25.8 | -34 | 0 | 0 | 0 | 113 | Y56 | Y56-P59 WeakPolarHBondContact OH-CD 3.38Š|
| 60 | P | 70.7 | Confident | 77.3 | Confident | 114 Ų | 114 | 107.8 Ų | 107.8 | 74% | 0.74 | 52% | 0.516 | S | S | * | . | P | Polyproline II helix | trans | -63.8 | 152.4 | -143.9 | 26.3 | -33.9 | 0 | 0 | 0 | 113.5 | L62 | P60-L62 PolarHBondContact O-N 2.9Š|
| 61 | S | 80.2 | Confident | 78 | Confident | 56 Ų | 56 | 110.2 Ų | 110.2 | 39% | 0.392 | 53% | 0.532 | S | S | . | . | trans | -43 | 126.2 | 175.1 | 46.2 | 0 | 0 | 0 | 0 | 112.2 | E48 C63 | E48-S61 CarbonylContact O-C 3.49Å; E48-S61 WeakPolarHBondContact O-CA 3.36Å; S61-C63 PolarHBondContact O-N 3.32Å | ||
| 62 | L | 83.1 | Confident | 78.8 | Confident | 90 Ų | 90 | 110.6 Ų | 110.6 | 47% | 0.471 | 53% | 0.534 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.9 | 110.4 | 172 | -80.4 | 147.9 | 0 | 0 | 0 | 108.6 | C47 E48 P60 L87 | C47-L62 CarbonylContact C-O 3.58Å; C47-L62 WeakPolarHBondContact CA-O 3.41Å; E48-L62 PolarHBondContact N-O 3.37Å; E48-L62 PolarHBondContact O-N 2.72Å; P60-L62 PolarHBondContact O-N 2.9Å; L62-L87 HydrophobicContact CD1-CD1 4.24Å; L62-L87 HydrophobicContact CD1-CD2 3.54Å |
| 63 | C | 88.2 | Confident | 79.6 | Confident | 66 Ų | 66 | 108.8 Ų | 108.8 | 45% | 0.446 | 53% | 0.533 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.3 | 131.3 | 177.9 | -65.6 | 0 | 0 | 0 | 0 | 110.7 | T45 V46 C47 S61 | T45-C63 HydrophobicContact CG2-CB 4Å; V46-C63 CarbonylContact O-C 3.44Å; V46-C63 WeakPolarHBondContact O-CA 3.04Å; C47-C63 HydrophobicContact CB-CB 4.19Å; C47-C63 WeakPolarHBondContact CB-SG 3.44Å; C47-C63 WeakPolarHBondContact SG-CB 3.36Å; C47-C63 CovalentContact SG-SG 2.04Å; C47-C63 PolarHBondContact SG-SG 3.43Å; S61-C63 PolarHBondContact O-N 3.32Å |
| 64 | R | 88 | Confident | 80.4 | Confident | 98 Ų | 98 | 100.1 Ų | 100.1 | 37% | 0.37 | 50% | 0.501 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.9 | 130.5 | 173.4 | 56.7 | 177 | 164.5 | 173.8 | -8.4 | 110.2 | T45 V46 E48 I66 | T45-R64 CarbonylContact C-O 3.55Å; T45-R64 WeakPolarHBondContact CA-O 3.35Å; V46-R64 HydrophobicContact CB-CG 3.94Å; V46-R64 PolarHBondContact N-O 3.29Å; V46-R64 WeakPolarHBondContact O-CG 2.97Å; V46-R64 PolarHBondContact O-N 2.95Å; E48-R64 IonicContact OE1-NH2 3.97Å; E48-R64 IonicContact OE2-CZ 3.28Å; E48-R64 VanDerWaalsContact OE2-CZ 3.28Å; E48-R64 IonicContact OE2-NE 3.23Å; E48-R64 PolarHBondContact OE2-NE 3.17Å; E48-R64 IonicContact OE2-NH2 2.74Å; E48-R64 PolarHBondContact OE2-NH2 3.26Å; R64-I66 HydrophobicContact CG-CD1 4.29Å |
| 65 | R | 92.7 | Very high | 81.2 | Confident | 210 Ų | 210 | 90 Ų | 90 | 79% | 0.792 | 46% | 0.462 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 139.9 | 169.2 | -84.7 | -172.7 | -178.6 | -168 | 1.6 | 110.3 | ||
| 66 | I | 92.7 | Very high | 81.2 | Confident | 14 Ų | 14 | 84.6 Ų | 84.6 | 7% | 0.072 | 44% | 0.442 | C | S | . | . | trans | -104.3 | 109.3 | 178.5 | -58.9 | -54.8 | 0 | 0 | 0 | 107.9 | V40 G43 G44 V46 R64 R68 A70 V72 | V40-I66 HydrophobicContact CB-CB 4.5Å; V40-I66 HydrophobicContact CB-CG1 4.24Å; V40-I66 HydrophobicContact CB-CG2 4.38Å; V40-I66 HydrophobicContact CG1-CB 3.99Å; V40-I66 HydrophobicContact CG1-CG1 3.83Å; V40-I66 HydrophobicContact CG1-CG2 4.34Å; G43-I66 WeakPolarHBondContact CA-O 3.36Å; G43-I66 PolarHBondContact N-O 3.39Å; G44-I66 PolarHBondContact O-N 3.45Å; V46-I66 HydrophobicContact CG2-CD1 4.19Å; V46-I66 HydrophobicContact CG2-CG1 3.83Å; R64-I66 HydrophobicContact CG-CD1 4.29Å; I66-R68 VanDerWaalsContact C-N 3.3Å; I66-R68 WeakPolarHBondContact CG2-O 3.32Å; I66-R68 PolarHBondContact O-N 3.14Å; I66-A70 HydrophobicContact CG2-CB 3.95Å; I66-V72 HydrophobicContact CD1-CG2 3.87Å; I66-V72 HydrophobicContact CG1-CG2 4.23Å | ||
| 67 | P | 93.3 | Very high | 81.4 | Confident | 117 Ų | 117 | 83.7 Ų | 83.7 | 76% | 0.76 | 46% | 0.462 | S | S | * | . | S | Bend | trans | -74.6 | -18.3 | -170.5 | 27.8 | -34.6 | 0 | 0 | 0 | 114 | ||
| 68 | R | 94.7 | Very high | 81.5 | Confident | 194 Ų | 194 | 72.9 Ų | 72.9 | 73% | 0.732 | 43% | 0.427 | S | S | * | . | S | Bend | trans | -147.1 | 156.1 | -176.1 | 60.6 | -178 | 177.7 | -177.2 | -0.7 | 109.8 | I66 A70 | I66-R68 VanDerWaalsContact C-N 3.3Å; I66-R68 WeakPolarHBondContact CG2-O 3.32Å; I66-R68 PolarHBondContact O-N 3.14Å; R68-A70 PolarHBondContact O-N 3.46Å; R68-A70 VanDerWaalsContact O-N 3.17Å |
| 69 | D | 95.2 | Very high | 81.9 | Confident | 121 Ų | 121 | 73.4 Ų | 73.4 | 65% | 0.647 | 43% | 0.426 | S | S | * | . | trans | -51.7 | 124.2 | 176.9 | -60.1 | -49.9 | 0 | 0 | 0 | 110.7 | V40 S41 A42 | V40-D69 WeakPolarHBondContact O-CA 3.1Å; S41-D69 WeakPolarHBondContact CA-OD1 3.38Å; A42-D69 PolarHBondContact N-OD1 3.11Å | ||
| 70 | A | 93 | Very high | 82.2 | Confident | 36 Ų | 36 | 70.1 Ų | 70.1 | 30% | 0.298 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.8 | 151.3 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | V40 I66 R68 V72 | V40-A70 PolarHBondContact N-O 3.02Å; V40-A70 PolarHBondContact O-N 3.5Å; I66-A70 HydrophobicContact CG2-CB 3.95Å; R68-A70 PolarHBondContact O-N 3.46Å; R68-A70 VanDerWaalsContact O-N 3.17Å; A70-V72 HydrophobicContact CB-CG2 4.27Å |
| 71 | V | 91.3 | Very high | 82 | Confident | 90 Ų | 90 | 75.9 Ų | 75.9 | 55% | 0.545 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.2 | 112.5 | 163.5 | -179.3 | 0 | 0 | 0 | 0 | 107.2 | P37 I38 R39 | P37-V71 HydrophobicContact CB-CG1 3.56Å; I38-V71 CarbonylContact O-C 3.47Å; I38-V71 WeakPolarHBondContact O-CA 3.43Å; R39-V71 HydrophobicContact CG-CG2 4.12Å |
| 72 | V | 85.7 | Confident | 81.4 | Confident | 8 Ų | 8 | 75.6 Ų | 75.6 | 5% | 0.048 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102 | 120 | -177.2 | -175.3 | 0 | 0 | 0 | 0 | 108.7 | I38 V40 V46 I66 A70 V74 | I38-V72 PolarHBondContact N-O 3.04Å; I38-V72 PolarHBondContact O-N 3.03Å; V40-V72 HydrophobicContact CB-CG2 4.45Å; V40-V72 HydrophobicContact CG2-CB 4.42Å; V40-V72 HydrophobicContact CG2-CG2 4.03Å; V46-V72 HydrophobicContact CG2-CB 4.42Å; V46-V72 HydrophobicContact CG2-CG1 4.32Å; V46-V72 HydrophobicContact CG2-CG2 4.28Å; I66-V72 HydrophobicContact CD1-CG2 3.87Å; I66-V72 HydrophobicContact CG1-CG2 4.23Å; A70-V72 HydrophobicContact CB-CG2 4.27Å; V72-V74 HydrophobicContact CG1-CG1 4.03Å |
| 73 | P | 83.3 | Confident | 80.3 | Confident | 69 Ų | 69 | 72.8 Ų | 72.8 | 45% | 0.448 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.1 | 127.7 | 171.3 | 28.5 | -30.6 | 0 | 0 | 0 | 110.1 | L35 | L35-P73 HydrophobicContact CB-CB 4.44Å; L35-P73 HydrophobicContact CD1-CB 3.81Å; L35-P73 HydrophobicContact CD2-CB 4.06Å; L35-P73 HydrophobicContact CG-CB 4.34Å |
| 74 | V | 80.1 | Confident | 79.1 | Confident | 0 Ų | 0 | 72.4 Ų | 72.4 | 0% | 0 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.3 | 164.2 | 176.4 | -60.2 | 0 | 0 | 0 | 0 | 110.9 | L35 T36 I38 V46 V72 G76 L89 | L35-V74 CarbonylContact C-O 3.5Å; L35-V74 WeakPolarHBondContact CA-O 3.44Å; T36-V74 PolarHBondContact N-O 3.03Å; T36-V74 WeakPolarHBondContact O-CG2 3.26Å; T36-V74 PolarHBondContact O-N 3.05Å; T36-V74 VanDerWaalsContact O-N 3.16Å; I38-V74 HydrophobicContact CD1-CB 4.22Å; I38-V74 HydrophobicContact CD1-CG1 3.77Å; I38-V74 HydrophobicContact CD1-CG2 3.41Å; I38-V74 VanDerWaalsContact CD1-CG2 3.41Å; I38-V74 HydrophobicContact CG1-CB 4.46Å; I38-V74 HydrophobicContact CG1-CG1 4.26Å; I38-V74 HydrophobicContact CG1-CG2 3.4Å; I38-V74 VanDerWaalsContact CG1-CG2 3.4Å; V46-V74 HydrophobicContact CG1-CG1 3.91Å; V72-V74 HydrophobicContact CG1-CG1 4.03Å; V74-G76 PolarHBondContact O-N 3.45Å; V74-L89 HydrophobicContact CB-CB 4.21Å; V74-L89 HydrophobicContact CB-CD1 4.5Å; V74-L89 HydrophobicContact CG1-CD1 4.31Å; V74-L89 HydrophobicContact CG2-CB 3.81Å; V74-L89 HydrophobicContact CG2-CD1 4.22Å; V74-L89 HydrophobicContact CG2-CD2 4Å; V74-L89 HydrophobicContact CG2-CG 4.2Å |
| 75 | C | 76.7 | Confident | 78.1 | Confident | 2 Ų | 2 | 71.1 Ų | 71.1 | 1% | 0.014 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 91.4 | 164.5 | -50.6 | 0 | 0 | 0 | 0 | 110 | I27 C33 L87 L89 | I27-C75 WeakPolarHBondContact CD1-SG 3.5Å; C33-C75 HydrophobicContact CB-CB 3.88Å; C33-C75 WeakPolarHBondContact CB-SG 3.36Å; C33-C75 VanDerWaalsContact SG-CA 3.54Å; C33-C75 WeakPolarHBondContact SG-CB 3.16Å; C33-C75 CovalentContact SG-SG 2Å; C33-C75 PolarHBondContact SG-SG 3.21Å; C75-L87 WeakPolarHBondContact CB-O 3.37Å; C75-L87 PolarHBondContact SG-O 3.48Å; C75-L89 PolarHBondContact O-N 2.97Å |
| 76 | G | 66.5 | Low | 77.1 | Confident | 35 Ų | 35 | 61.1 Ų | 61.1 | 36% | 0.361 | 36% | 0.363 | S | S | . | . | trans | -80.2 | -18 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | T36 V74 | T36-G76 WeakPolarHBondContact OG1-CA 3.5Å; T36-G76 PolarHBondContact OG1-N 3Å; V74-G76 PolarHBondContact O-N 3.45Å | ||
| 77 | G | 67.3 | Low | 76.4 | Confident | 77 Ų | 77 | 61 Ų | 61 | 79% | 0.794 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -97.7 | 0.7 | -170.5 | 0 | 0 | 0 | 0 | 0 | 117 | ||
| 78 | G | 66.3 | Low | 75.7 | Confident | 20 Ų | 20 | 57.1 Ų | 57.1 | 21% | 0.206 | 33% | 0.334 | C | S | . | . | S | Bend | trans | 131.7 | -172.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 79 | C | 69.2 | Low | 75.1 | Confident | 36 Ų | 36 | 49.8 Ų | 49.8 | 24% | 0.243 | 31% | 0.309 | C | S | . | . | S | Bend | trans | -61.9 | 161.2 | 172.1 | -66.6 | 0 | 0 | 0 | 0 | 111.6 | C51 R53 | C51-C79 VanDerWaalsContact CA-SG 3.58Å; C51-C79 HydrophobicContact CB-CB 3.73Å; C51-C79 WeakPolarHBondContact CB-SG 3.48Å; C51-C79 WeakPolarHBondContact SG-CA 3.44Å; C51-C79 WeakPolarHBondContact SG-CB 3.41Å; C51-C79 CovalentContact SG-SG 2Å; C51-C79 PolarHBondContact SG-SG 3.32Å; R53-C79 VanDerWaalsContact C-SG 3.54Å; R53-C79 PolarHBondContact O-SG 2.83Å; R53-C79 VanDerWaalsContact O-SG 3.38Å |
| 80 | C | 67.5 | Low | 74.4 | Confident | 20 Ų | 20 | 48.1 Ų | 48.1 | 14% | 0.135 | 30% | 0.299 | C | S | . | . | trans | -60.8 | 152.2 | 174.3 | -74.2 | 0 | 0 | 0 | 0 | 114 | Q32 C33 S82 C86 | Q32-C80 VanDerWaalsContact C-SG 3.59Å; Q32-C80 CarbonylContact O-C 3.56Å; Q32-C80 VanDerWaalsContact O-CA 3.28Å; Q32-C80 WeakPolarHBondContact O-CA 3.05Å; Q32-C80 WeakPolarHBondContact O-CB 3.32Å; Q32-C80 PolarHBondContact O-SG 3.23Å; Q32-C80 VanDerWaalsContact O-SG 3.34Å; C33-C80 HydrophobicContact CB-CB 4.37Å; C33-C80 WeakPolarHBondContact CB-SG 3.09Å; C80-S82 VanDerWaalsContact C-N 3.35Å; C80-C86 HydrophobicContact CB-CB 3.35Å; C80-C86 WeakPolarHBondContact CB-SG 3.32Å; C80-C86 WeakPolarHBondContact SG-CB 3.31Å; C80-C86 CovalentContact SG-SG 1.94Å; C80-C86 PolarHBondContact SG-SG 3.46Å | ||
| 81 | R | 67.4 | Low | 74 | Confident | 235 Ų | 235 | 52.5 Ų | 52.5 | 89% | 0.887 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -70.4 | -35.4 | 173.9 | -75.9 | -175.1 | 172.5 | -174.1 | -2.4 | 111.4 | Q32 | Q32-R81 PolarHBondContact O-N 3.04Š|
| 82 | S | 66.1 | Low | 73.7 | Confident | 49 Ų | 49 | 52.5 Ų | 52.5 | 34% | 0.343 | 31% | 0.309 | S | S | . | . | B | Isolated β-bridge | trans | -153.9 | 162 | -176.5 | 72.8 | 0 | 0 | 0 | 0 | 110.9 | G31 Q32 C80 | G31-S82 CarbonylContact C-O 3.56Å; G31-S82 WeakPolarHBondContact CA-O 3.45Å; Q32-S82 WeakPolarHBondContact CB-OG 2.68Å; Q32-S82 PolarHBondContact N-O 3.45Å; Q32-S82 PolarHBondContact OE1-OG 2.76Å; C80-S82 VanDerWaalsContact C-N 3.35Å |
| 83 | G | 61.2 | Low | 73.1 | Confident | 31 Ų | 31 | 54.7 Ų | 54.7 | 32% | 0.32 | 32% | 0.322 | S | S | . | . | S | Bend | trans | 83.1 | 153.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 84 | P | 63.4 | Low | 72.6 | Confident | 59 Ų | 59 | 53.9 Ų | 53.9 | 38% | 0.383 | 32% | 0.316 | S | S | . | . | S | Bend | trans | -71.4 | 163.2 | 178.8 | 30.1 | -33.4 | 0 | 0 | 0 | 112.7 | G31 F52 C86 | G31-P84 PolarHBondContact N-O 3.3Å; F52-P84 HydrophobicContact CD2-CB 4.42Å; F52-P84 HydrophobicContact CE2-CB 4.18Å; P84-C86 VanDerWaalsContact C-N 3.34Å; P84-C86 PolarHBondContact O-N 3.49Å |
| 85 | N | 66.7 | Low | 72.2 | Confident | 71 Ų | 71 | 56.9 Ų | 56.9 | 38% | 0.38 | 33% | 0.333 | S | S | . | . | trans | 66.2 | 17.7 | 163.8 | -56.6 | -28.5 | 0 | 0 | 0 | 119 | L28 | L28-N85 HydrophobicContact CB-CB 4.26Å; L28-N85 WeakPolarHBondContact O-CB 3.35Å; L28-N85 PolarHBondContact O-ND2 3.25Å | ||
| 86 | C | 72.2 | Confident | 71.9 | Confident | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 35% | 0.352 | C | S | . | . | trans | -66.1 | 144.8 | 173.6 | -99.2 | 0 | 0 | 0 | 0 | 114.3 | G31 L50 C51 C80 P84 | G31-C86 WeakPolarHBondContact CA-SG 3.47Å; L50-C86 CarbonylContact C-O 3.51Å; L50-C86 WeakPolarHBondContact CA-O 3.4Å; C51-C86 PolarHBondContact N-O 2.96Å; C80-C86 HydrophobicContact CB-CB 3.35Å; C80-C86 WeakPolarHBondContact CB-SG 3.32Å; C80-C86 WeakPolarHBondContact SG-CB 3.31Å; C80-C86 CovalentContact SG-SG 1.94Å; C80-C86 PolarHBondContact SG-SG 3.46Å; P84-C86 VanDerWaalsContact C-N 3.34Å; P84-C86 PolarHBondContact O-N 3.49Å | ||
| 87 | L | 76.3 | Confident | 72.2 | Confident | 10 Ų | 10 | 61.8 Ų | 61.8 | 5% | 0.052 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 129.5 | 175.6 | -57 | 179.3 | 0 | 0 | 0 | 111.2 | I27 L28 E48 R49 L50 L62 C75 | I27-L87 HydrophobicContact CG2-CB 3.79Å; I27-L87 HydrophobicContact CG2-CD1 3.86Å; I27-L87 HydrophobicContact CG2-CG 3.64Å; L28-L87 HydrophobicContact CD1-CD1 3.64Å; L28-L87 HydrophobicContact CD1-CG 4.16Å; E48-L87 HydrophobicContact CB-CB 3.8Å; E48-L87 HydrophobicContact CB-CD1 4.25Å; R49-L87 CarbonylContact O-C 3.24Å; R49-L87 VanDerWaalsContact O-CA 3.27Å; R49-L87 WeakPolarHBondContact O-CA 3.22Å; L50-L87 HydrophobicContact CB-CD2 4.41Å; L50-L87 HydrophobicContact CD1-CD2 3.92Å; L50-L87 HydrophobicContact CG-CD2 4.35Å; L62-L87 HydrophobicContact CD1-CD1 4.24Å; L62-L87 HydrophobicContact CD1-CD2 3.54Å; C75-L87 WeakPolarHBondContact CB-O 3.37Å; C75-L87 PolarHBondContact SG-O 3.48Å |
| 88 | Q | 78.9 | Confident | 72.6 | Confident | 37 Ų | 37 | 60.7 Ų | 60.7 | 17% | 0.173 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.5 | 135.2 | 171.8 | -178.3 | -168.3 | -1.5 | 0 | 0 | 109.8 | E48 R49 C51 L90 | E48-Q88 CarbonylContact C-O 3.51Å; E48-Q88 WeakPolarHBondContact CA-O 3.34Å; R49-Q88 HydrophobicContact CG-CB 4.12Å; R49-Q88 VanDerWaalsContact CZ-OE1 3.23Å; R49-Q88 PolarHBondContact N-O 3.04Å; R49-Q88 PolarHBondContact O-N 2.98Å; C51-Q88 HydrophobicContact CB-CB 3.81Å; C51-Q88 PolarHBondContact SG-OE1 3.36Å; Q88-L90 PolarHBondContact O-N 3.01Å |
| 89 | L | 82.2 | Confident | 73 | Confident | 40 Ų | 40 | 63.6 Ų | 63.6 | 21% | 0.209 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -57.1 | 129.8 | 170.5 | -178.1 | 66.8 | 0 | 0 | 0 | 111.2 | I38 V46 V74 C75 T92 | I38-L89 HydrophobicContact CD1-CD1 3.51Å; I38-L89 HydrophobicContact CD1-CD2 3.51Å; I38-L89 HydrophobicContact CD1-CG 4.09Å; I38-L89 HydrophobicContact CG1-CD2 4.26Å; V46-L89 HydrophobicContact CG1-CD1 3.93Å; V74-L89 HydrophobicContact CB-CB 4.21Å; V74-L89 HydrophobicContact CB-CD1 4.5Å; V74-L89 HydrophobicContact CG1-CD1 4.31Å; V74-L89 HydrophobicContact CG2-CB 3.81Å; V74-L89 HydrophobicContact CG2-CD1 4.22Å; V74-L89 HydrophobicContact CG2-CD2 4Å; V74-L89 HydrophobicContact CG2-CG 4.2Å; C75-L89 PolarHBondContact O-N 2.97Å; L89-T92 HydrophobicContact CD1-CG2 4.04Å |
| 90 | L | 81.9 | Confident | 73.3 | Confident | 85 Ų | 85 | 65.8 Ų | 65.8 | 45% | 0.445 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | -55.5 | 174.6 | -117.6 | 155.2 | 0 | 0 | 0 | 110.4 | C47 R49 Q88 | C47-L90 VanDerWaalsContact O-CB 3.31Å; C47-L90 WeakPolarHBondContact O-CB 3.23Å; C47-L90 PolarHBondContact O-N 2.93Å; R49-L90 HydrophobicContact CB-CD1 3.55Å; R49-L90 HydrophobicContact CG-CD1 3.85Å; R49-L90 HydrophobicContact CG-CG 4.31Å; Q88-L90 PolarHBondContact O-N 3.01Å |
| 91 | Y | 83.8 | Confident | 73.8 | Confident | 129 Ų | 129 | 69.6 Ų | 69.6 | 51% | 0.506 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -163.4 | 166.8 | 176.2 | 59 | -89.9 | 0 | 0 | 0 | 111.3 | C47 | C47-Y91 HydrophobicContact CB-CD1 4.08Å; C47-Y91 HydrophobicContact CB-CD2 4.19Å; C47-Y91 HydrophobicContact CB-CE1 3.73Å; C47-Y91 HydrophobicContact CB-CE2 3.87Å; C47-Y91 HydrophobicContact CB-CG 4.3Å; C47-Y91 PolarHBondContact N-O 3Å; C47-Y91 PolarHBondContact O-N 3.39Å; C47-Y91 WeakPolarHBondContact SG-CE2 3.35Å; C47-Y91 PolarHBondContact SG-OH 2.81Å |
| 92 | T | 85.5 | Confident | 74.4 | Confident | 89 Ų | 89 | 54.5 Ų | 54.5 | 55% | 0.546 | 31% | 0.305 | S | S | . | . | trans | -123.6 | 0 | 178.5 | 56.7 | 0 | 0 | 0 | 0 | 111.7 | I38 V40 T45 V46 L89 | I38-T92 HydrophobicContact CD1-CG2 3.45Å; I38-T92 VanDerWaalsContact CD1-CG2 3.45Å; I38-T92 HydrophobicContact CG2-CG2 4.37Å; V40-T92 HydrophobicContact CG2-CG2 4.12Å; T45-T92 PolarHBondContact N-OXT 3.17Å; T45-T92 CarbonylContact O-C 3.57Å; T45-T92 VanDerWaalsContact O-C 3.24Å; T45-T92 WeakPolarHBondContact O-CA 3.47Å; V46-T92 HydrophobicContact CG2-CG2 4.36Å; L89-T92 HydrophobicContact CD1-CG2 4.04Å |
Retrieved 92 of 92 residues in 53.7 ms
(Link to these results)