| 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 | 68.3 | Low | 86.9 | Confident | 233 Ų | 233 | 132.6 Ų | 132.6 | 100% | 1.148 | 64% | 0.639 | S | S | * | * | 0 | 151.9 | 0 | -72.2 | 178.2 | 170.2 | 0 | 0 | 109.3 | |||||
| 2 | S | 85.5 | Confident | 87 | Confident | 72 Ų | 72 | 125.2 Ų | 125.2 | 50% | 0.503 | 62% | 0.623 | S | S | . | * | trans | -84.3 | 147.4 | 174.5 | 60.6 | 0 | 0 | 0 | 0 | 111.9 | F4 S5 A6 | S2-F4 VanDerWaalsContact C-N 3.25Å; S2-F4 PolarHBondContact O-N 3.15Å; S2-S5 WeakPolarHBondContact O-CB 3.35Å; S2-S5 PolarHBondContact O-N 2.8Å; S2-A6 PolarHBondContact O-N 3.37Å | ||
| 3 | F | 89.6 | Confident | 87.2 | Confident | 154 Ų | 154 | 126.5 Ų | 126.5 | 68% | 0.675 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -54.4 | -40.6 | 177.4 | 176.6 | -98.6 | 0 | 0 | 0 | 112.6 | S5 A6 L7 | F3-S5 VanDerWaalsContact C-N 3.31Å; F3-S5 PolarHBondContact O-N 2.93Å; F3-A6 PolarHBondContact O-N 3.49Å; F3-L7 HydrophobicContact CE1-CD2 4.29Å; F3-L7 WeakPolarHBondContact O-CB 3.46Å; F3-L7 PolarHBondContact O-N 3.41Å |
| 4 | F | 89.1 | Confident | 87.4 | Confident | 163 Ų | 163 | 120.1 Ų | 120.1 | 72% | 0.715 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -63 | -32.3 | 176.4 | -67.6 | -78.3 | 0 | 0 | 0 | 113.7 | S2 R8 | S2-F4 VanDerWaalsContact C-N 3.25Å; S2-F4 PolarHBondContact O-N 3.15Å; F4-R8 WeakPolarHBondContact O-CB 3.26Å; F4-R8 PolarHBondContact O-N 2.84Å |
| 5 | S | 87.5 | Confident | 87.5 | Confident | 47 Ų | 47 | 115.8 Ų | 115.8 | 33% | 0.329 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.5 | -46.5 | 175.2 | -172.8 | 0 | 0 | 0 | 0 | 111 | S2 F3 L7 R8 W9 | S2-S5 WeakPolarHBondContact O-CB 3.35Å; S2-S5 PolarHBondContact O-N 2.8Å; F3-S5 VanDerWaalsContact C-N 3.31Å; F3-S5 PolarHBondContact O-N 2.93Å; S5-L7 PolarHBondContact O-N 3.28Å; S5-R8 PolarHBondContact O-N 3.35Å; S5-W9 PolarHBondContact O-N 3.26Å |
| 6 | A | 88 | Confident | 87.4 | Confident | 50 Ų | 50 | 116.1 Ų | 116.1 | 41% | 0.413 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -60.9 | -43.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | S2 F3 R8 W9 M10 | S2-A6 PolarHBondContact O-N 3.37Å; F3-A6 PolarHBondContact O-N 3.49Å; A6-R8 PolarHBondContact O-N 3.18Å; A6-W9 PolarHBondContact O-N 3.16Å; A6-M10 VanDerWaalsContact O-CG 3.29Å; A6-M10 WeakPolarHBondContact O-CG 3.31Å; A6-M10 PolarHBondContact O-N 2.95Å |
| 7 | L | 90.6 | Very high | 87.5 | Confident | 77 Ų | 77 | 114.3 Ų | 114.3 | 40% | 0.403 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.7 | -40 | 177 | -175.5 | 61.2 | 0 | 0 | 0 | 112.3 | F3 S5 M10 L11 | F3-L7 HydrophobicContact CE1-CD2 4.29Å; F3-L7 WeakPolarHBondContact O-CB 3.46Å; F3-L7 PolarHBondContact O-N 3.41Å; S5-L7 PolarHBondContact O-N 3.28Å; L7-M10 PolarHBondContact O-N 3.3Å; L7-L11 HydrophobicContact CD1-CD1 4.32Å; L7-L11 HydrophobicContact CD1-CG 4.4Å; L7-L11 HydrophobicContact CG-CD1 4.14Å; L7-L11 WeakPolarHBondContact O-CB 3.36Å; L7-L11 WeakPolarHBondContact O-CG 3.5Å; L7-L11 PolarHBondContact O-N 3.24Å |
| 8 | R | 89.8 | Confident | 87.6 | Confident | 207 Ų | 207 | 113.7 Ų | 113.7 | 78% | 0.781 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.4 | -41.7 | 175 | -175.8 | 175.5 | 177.8 | 126.5 | 2.3 | 111.8 | F4 S5 A6 G12 | F4-R8 WeakPolarHBondContact O-CB 3.26Å; F4-R8 PolarHBondContact O-N 2.84Å; S5-R8 PolarHBondContact O-N 3.35Å; A6-R8 PolarHBondContact O-N 3.18Å; R8-G12 PolarHBondContact O-N 2.59Å |
| 9 | W | 89.2 | Confident | 87.5 | Confident | 195 Ų | 195 | 112.1 Ų | 112.1 | 74% | 0.739 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.6 | -45.9 | 174.6 | -92.6 | 93.4 | 0 | 0 | 0 | 112.5 | S5 A6 L11 G12 F13 | S5-W9 PolarHBondContact O-N 3.26Å; A6-W9 PolarHBondContact O-N 3.16Å; W9-L11 PolarHBondContact O-N 3.06Å; W9-G12 PolarHBondContact O-N 3.17Å; W9-F13 WeakPolarHBondContact O-CB 3.33Å; W9-F13 PolarHBondContact O-N 2.63Å |
| 10 | M | 88.9 | Confident | 87.4 | Confident | 144 Ų | 144 | 110.7 Ų | 110.7 | 71% | 0.709 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -61.3 | -42.6 | 178.1 | -71.1 | -71.9 | -76.4 | 0 | 0 | 112.3 | A6 L7 G14 | A6-M10 VanDerWaalsContact O-CG 3.29Å; A6-M10 WeakPolarHBondContact O-CG 3.31Å; A6-M10 PolarHBondContact O-N 2.95Å; L7-M10 PolarHBondContact O-N 3.3Å; M10-G14 PolarHBondContact O-N 3.03Å |
| 11 | L | 89.4 | Confident | 87.4 | Confident | 117 Ų | 117 | 109.3 Ų | 109.3 | 61% | 0.613 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -67.9 | -43.3 | 176.8 | -70.8 | 170.4 | 0 | 0 | 0 | 112 | L7 W9 G14 A15 | L7-L11 HydrophobicContact CD1-CD1 4.32Å; L7-L11 HydrophobicContact CD1-CG 4.4Å; L7-L11 HydrophobicContact CG-CD1 4.14Å; L7-L11 WeakPolarHBondContact O-CB 3.36Å; L7-L11 WeakPolarHBondContact O-CG 3.5Å; L7-L11 PolarHBondContact O-N 3.24Å; W9-L11 PolarHBondContact O-N 3.06Å; L11-G14 PolarHBondContact O-N 3.14Å; L11-A15 WeakPolarHBondContact O-CB 3.2Å; L11-A15 PolarHBondContact O-N 3.19Å |
| 12 | G | 88.5 | Confident | 88.2 | Confident | 43 Ų | 43 | 101.3 Ų | 101.3 | 44% | 0.443 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.2 | -47.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | R8 W9 A15 H16 | R8-G12 PolarHBondContact O-N 2.59Å; W9-G12 PolarHBondContact O-N 3.17Å; G12-A15 PolarHBondContact O-N 2.85Å; G12-H16 WeakPolarHBondContact O-CB 3.46Å; G12-H16 PolarHBondContact O-N 3Å |
| 13 | F | 89.3 | Confident | 87.9 | Confident | 143 Ų | 143 | 105.5 Ų | 105.5 | 63% | 0.627 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.4 | -41.5 | 177.2 | -170.3 | -95.2 | 0 | 0 | 0 | 112 | W9 H16 L17 | W9-F13 WeakPolarHBondContact O-CB 3.33Å; W9-F13 PolarHBondContact O-N 2.63Å; F13-H16 PolarHBondContact O-N 2.66Å; F13-L17 HydrophobicContact CE1-CD2 4.48Å; F13-L17 VanDerWaalsContact O-CB 3.3Å; F13-L17 WeakPolarHBondContact O-CB 3.35Å; F13-L17 PolarHBondContact O-N 3.31Å |
| 14 | G | 90.7 | Very high | 87.3 | Confident | 36 Ų | 36 | 104.1 Ų | 104.1 | 37% | 0.371 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61 | -44.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | M10 L11 L18 | M10-G14 PolarHBondContact O-N 3.03Å; L11-G14 PolarHBondContact O-N 3.14Å; G14-L18 WeakPolarHBondContact O-CB 3.32Å; G14-L18 PolarHBondContact O-N 2.9Å |
| 15 | A | 88 | Confident | 86.8 | Confident | 56 Ų | 56 | 99.6 Ų | 99.6 | 46% | 0.463 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.1 | -43.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | L11 G12 L17 L18 Y19 | L11-A15 WeakPolarHBondContact O-CB 3.2Å; L11-A15 PolarHBondContact O-N 3.19Å; G12-A15 PolarHBondContact O-N 2.85Å; A15-L17 PolarHBondContact O-N 3.03Å; A15-L18 PolarHBondContact O-N 2.92Å; A15-Y19 WeakPolarHBondContact O-CB 3.42Å; A15-Y19 PolarHBondContact O-N 2.98Å |
| 16 | H | 86.1 | Confident | 85.9 | Confident | 121 Ų | 121 | 103.4 Ų | 103.4 | 56% | 0.56 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -68.6 | -34.6 | -179.4 | -148 | -49.7 | 0 | 0 | 0 | 112.7 | G12 F13 L20 | G12-H16 WeakPolarHBondContact O-CB 3.46Å; G12-H16 PolarHBondContact O-N 3Å; F13-H16 PolarHBondContact O-N 2.66Å; H16-L20 WeakPolarHBondContact O-CG 3.37Å; H16-L20 PolarHBondContact O-N 3.33Å; H16-L20 VanDerWaalsContact O-N 3.11Å |
| 17 | L | 89.3 | Confident | 84.6 | Confident | 85 Ų | 85 | 103.3 Ų | 103.3 | 45% | 0.445 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -69.1 | -43.1 | 172.7 | -178.2 | 63.2 | 0 | 0 | 0 | 111.4 | F13 A15 Y19 L20 I21 | F13-L17 HydrophobicContact CE1-CD2 4.48Å; F13-L17 VanDerWaalsContact O-CB 3.3Å; F13-L17 WeakPolarHBondContact O-CB 3.35Å; F13-L17 PolarHBondContact O-N 3.31Å; A15-L17 PolarHBondContact O-N 3.03Å; L17-Y19 PolarHBondContact O-N 3.5Å; L17-L20 PolarHBondContact O-N 2.92Å; L17-I21 HydrophobicContact CD1-CD1 4.43Å; L17-I21 HydrophobicContact CG-CD1 4.1Å; L17-I21 WeakPolarHBondContact O-CG1 3.44Å; L17-I21 PolarHBondContact O-N 3.4Å |
| 18 | L | 89.4 | Confident | 83 | Confident | 103 Ų | 103 | 105.3 Ų | 105.3 | 54% | 0.539 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.8 | -42.7 | 175.4 | -178.8 | 62 | 0 | 0 | 0 | 111.5 | G14 A15 L20 I21 L22 | G14-L18 WeakPolarHBondContact O-CB 3.32Å; G14-L18 PolarHBondContact O-N 2.9Å; A15-L18 PolarHBondContact O-N 2.92Å; L18-L20 PolarHBondContact O-N 3.21Å; L18-I21 PolarHBondContact O-N 2.86Å; L18-L22 HydrophobicContact CD1-CD1 4.36Å; L18-L22 HydrophobicContact CD1-CG 4.44Å; L18-L22 HydrophobicContact CG-CD1 4.05Å; L18-L22 WeakPolarHBondContact O-CB 3.41Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 3.44Å |
| 19 | Y | 85.5 | Confident | 81.3 | Confident | 83 Ų | 83 | 100.9 Ų | 100.9 | 33% | 0.325 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.3 | -44 | 173.5 | 175 | -92.2 | 0 | 0 | 0 | 112.1 | A15 L17 L22 R23 | A15-Y19 WeakPolarHBondContact O-CB 3.42Å; A15-Y19 PolarHBondContact O-N 2.98Å; L17-Y19 PolarHBondContact O-N 3.5Å; Y19-L22 PolarHBondContact O-N 2.98Å; Y19-R23 VanDerWaalsContact O-CB 3.23Å; Y19-R23 WeakPolarHBondContact O-CB 3.32Å; Y19-R23 PolarHBondContact O-N 3.3Å; Y19-R23 PolarHBondContact OH-NH1 3.41Å |
| 20 | L | 86.3 | Confident | 79.4 | Confident | 85 Ų | 85 | 101 Ų | 101 | 45% | 0.445 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.3 | -40.1 | 176.3 | -74 | 169.3 | 0 | 0 | 0 | 112.3 | H16 L17 L18 R23 L24 | H16-L20 WeakPolarHBondContact O-CG 3.37Å; H16-L20 PolarHBondContact O-N 3.33Å; H16-L20 VanDerWaalsContact O-N 3.11Å; L17-L20 PolarHBondContact O-N 2.92Å; L18-L20 PolarHBondContact O-N 3.21Å; L20-R23 PolarHBondContact O-N 3.13Å; L20-L24 WeakPolarHBondContact O-CB 3.37Å; L20-L24 WeakPolarHBondContact O-CG 3.35Å; L20-L24 PolarHBondContact O-N 2.95Å |
| 21 | I | 86.1 | Confident | 76.9 | Confident | 82 Ų | 82 | 97.4 Ų | 97.4 | 42% | 0.421 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.5 | -47.7 | 174.9 | -68.9 | 164.6 | 0 | 0 | 0 | 110.7 | L17 L18 R23 L24 L25 | L17-I21 HydrophobicContact CD1-CD1 4.43Å; L17-I21 HydrophobicContact CG-CD1 4.1Å; L17-I21 WeakPolarHBondContact O-CG1 3.44Å; L17-I21 PolarHBondContact O-N 3.4Å; L18-I21 PolarHBondContact O-N 2.86Å; I21-R23 PolarHBondContact O-N 3.26Å; I21-L24 PolarHBondContact O-N 3.31Å; I21-L25 HydrophobicContact CG2-CD1 4.04Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.3Å; I21-L25 PolarHBondContact O-N 3.46Å |
| 22 | L | 84.8 | Confident | 74.4 | Confident | 64 Ų | 64 | 96.1 Ų | 96.1 | 34% | 0.335 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61 | -43.7 | 176.5 | -72 | 166.7 | 0 | 0 | 0 | 111.5 | L18 Y19 L24 L25 F26 | L18-L22 HydrophobicContact CD1-CD1 4.36Å; L18-L22 HydrophobicContact CD1-CG 4.44Å; L18-L22 HydrophobicContact CG-CD1 4.05Å; L18-L22 WeakPolarHBondContact O-CB 3.41Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 3.44Å; Y19-L22 PolarHBondContact O-N 2.98Å; L22-L24 VanDerWaalsContact C-N 3.35Å; L22-L24 PolarHBondContact O-N 2.82Å; L22-L25 PolarHBondContact O-N 3.21Å; L22-F26 HydrophobicContact CD2-CE2 4.21Å; L22-F26 VanDerWaalsContact O-CD2 3.29Å; L22-F26 WeakPolarHBondContact O-CD2 3.42Å; L22-F26 PolarHBondContact O-N 3.46Å |
| 23 | R | 79.1 | Confident | 71.9 | Confident | 160 Ų | 160 | 103.1 Ų | 103.1 | 60% | 0.604 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -68.1 | -31.2 | 179 | -173 | 168.2 | 174.9 | 165.4 | -5.3 | 112.9 | Y19 L20 I21 G27 | Y19-R23 VanDerWaalsContact O-CB 3.23Å; Y19-R23 WeakPolarHBondContact O-CB 3.32Å; Y19-R23 PolarHBondContact O-N 3.3Å; Y19-R23 PolarHBondContact OH-NH1 3.41Å; L20-R23 PolarHBondContact O-N 3.13Å; I21-R23 PolarHBondContact O-N 3.26Å; R23-G27 WeakPolarHBondContact O-CA 3.2Å; R23-G27 PolarHBondContact O-N 3.44Å |
| 24 | L | 77.9 | Confident | 69.2 | Low | 125 Ų | 125 | 104.7 Ų | 104.7 | 65% | 0.654 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -67.7 | -46.8 | 169 | -80 | 164.4 | 0 | 0 | 0 | 111.4 | L20 I21 L22 G27 V28 | L20-L24 WeakPolarHBondContact O-CB 3.37Å; L20-L24 WeakPolarHBondContact O-CG 3.35Å; L20-L24 PolarHBondContact O-N 2.95Å; I21-L24 PolarHBondContact O-N 3.31Å; L22-L24 VanDerWaalsContact C-N 3.35Å; L22-L24 PolarHBondContact O-N 2.82Å; L24-G27 PolarHBondContact O-N 2.89Å; L24-V28 WeakPolarHBondContact O-CG2 3.3Å; L24-V28 PolarHBondContact O-N 3.48Å; L24-V28 VanDerWaalsContact O-N 3.16Å |
| 25 | L | 78.2 | Confident | 66.5 | Low | 69 Ų | 69 | 108.5 Ų | 108.5 | 36% | 0.361 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -60.3 | -55.6 | 178.4 | -70.3 | 170.2 | 0 | 0 | 0 | 111.6 | I21 L22 G27 V28 F29 | I21-L25 HydrophobicContact CG2-CD1 4.04Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.3Å; I21-L25 PolarHBondContact O-N 3.46Å; L22-L25 PolarHBondContact O-N 3.21Å; L25-G27 VanDerWaalsContact C-N 3.33Å; L25-G27 PolarHBondContact O-N 2.92Å; L25-V28 PolarHBondContact O-N 2.86Å; L25-F29 WeakPolarHBondContact O-CD2 3.33Å |
| 26 | F | 69.7 | Low | 63.9 | Low | 127 Ų | 127 | 112.2 Ų | 112.2 | 56% | 0.557 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -69.9 | -27.6 | 178.7 | -72.6 | -68.7 | 0 | 0 | 0 | 113.3 | L22 V28 F29 K30 | L22-F26 HydrophobicContact CD2-CE2 4.21Å; L22-F26 VanDerWaalsContact O-CD2 3.29Å; L22-F26 WeakPolarHBondContact O-CD2 3.42Å; L22-F26 PolarHBondContact O-N 3.46Å; F26-V28 VanDerWaalsContact C-N 3.32Å; F26-V28 PolarHBondContact O-N 3.13Å; F26-F29 PolarHBondContact O-N 3.43Å; F26-K30 PolarHBondContact O-N 2.96Å |
| 27 | G | 60.3 | Low | 61.1 | Low | 48 Ų | 48 | 114.5 Ų | 114.5 | 50% | 0.495 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -61.8 | -38.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R23 L24 L25 F29 K30 | R23-G27 WeakPolarHBondContact O-CA 3.2Å; R23-G27 PolarHBondContact O-N 3.44Å; L24-G27 PolarHBondContact O-N 2.89Å; L25-G27 VanDerWaalsContact C-N 3.33Å; L25-G27 PolarHBondContact O-N 2.92Å; G27-F29 VanDerWaalsContact C-N 3.3Å; G27-F29 PolarHBondContact O-N 2.84Å; G27-K30 PolarHBondContact O-N 3.36Å |
| 28 | V | 57.2 | Low | 58.3 | Low | 118 Ų | 118 | 116.2 Ų | 116.2 | 72% | 0.715 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -67 | -29.4 | 174.8 | 170.5 | 0 | 0 | 0 | 0 | 112.3 | L24 L25 F26 | L24-V28 WeakPolarHBondContact O-CG2 3.3Å; L24-V28 PolarHBondContact O-N 3.48Å; L24-V28 VanDerWaalsContact O-N 3.16Å; L25-V28 PolarHBondContact O-N 2.86Å; F26-V28 VanDerWaalsContact C-N 3.32Å; F26-V28 PolarHBondContact O-N 3.13Å |
| 29 | F | 52.7 | Low | 55.4 | Low | 114 Ų | 114 | 114.7 Ų | 114.7 | 50% | 0.5 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -82.4 | -10.2 | 177.8 | -73.2 | -69.2 | 0 | 0 | 0 | 114.7 | L25 F26 G27 G31 A32 | L25-F29 WeakPolarHBondContact O-CD2 3.33Å; F26-F29 PolarHBondContact O-N 3.43Å; G27-F29 VanDerWaalsContact C-N 3.3Å; G27-F29 PolarHBondContact O-N 2.84Å; F29-G31 PolarHBondContact O-N 3.38Å; F29-A32 PolarHBondContact O-N 3.24Å; F29-A32 VanDerWaalsContact O-N 3.14Å |
| 30 | K | 49.2 | Very low | 52.7 | Low | 197 Ų | 197 | 116.7 Ų | 116.7 | 86% | 0.857 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | 6 | -177.3 | -117.1 | -170.6 | 179.8 | -166.5 | 0 | 115.6 | F26 G27 | F26-K30 PolarHBondContact O-N 2.96Å; G27-K30 PolarHBondContact O-N 3.36Å |
| 31 | G | 37.1 | Very low | 50.2 | Low | 70 Ų | 70 | 117.4 Ų | 117.4 | 72% | 0.722 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | -0.2 | 169.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | F29 K33 | F29-G31 PolarHBondContact O-N 3.38Å; G31-K33 VanDerWaalsContact C-N 3.35Å; G31-K33 PolarHBondContact O-N 3.16Å |
| 32 | A | 36.2 | Very low | 47.7 | Very low | 90 Ų | 90 | 119.9 Ų | 119.9 | 74% | 0.744 | 68% | 0.679 | S | S | * | * | trans | -69.7 | 89.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | F29 E34 | F29-A32 PolarHBondContact O-N 3.24Å; F29-A32 VanDerWaalsContact O-N 3.14Å; A32-E34 PolarHBondContact O-N 3.47Å | ||
| 33 | K | 37.4 | Very low | 45.2 | Very low | 189 Ų | 189 | 123.7 Ų | 123.7 | 82% | 0.822 | 70% | 0.7 | S | S | * | * | trans | -59.2 | 134.2 | 179.1 | -167.7 | 177.7 | -178.7 | -177 | 0 | 110.1 | G31 V35 | G31-K33 VanDerWaalsContact C-N 3.35Å; G31-K33 PolarHBondContact O-N 3.16Å; K33-V35 PolarHBondContact O-N 2.87Å | ||
| 34 | E | 32.9 | Very low | 43.2 | Very low | 176 Ų | 176 | 125.3 Ų | 125.3 | 82% | 0.822 | 71% | 0.714 | S | S | * | * | trans | -56.1 | 121.6 | 172.1 | -159 | 156.7 | -142.9 | 0 | 0 | 108.9 | A32 | A32-E34 PolarHBondContact O-N 3.47Š| ||
| 35 | V | 32.6 | Very low | 41.2 | Very low | 117 Ų | 117 | 126.4 Ų | 126.4 | 71% | 0.709 | 72% | 0.716 | S | S | * | * | trans | -115.4 | 111.7 | 175.8 | 177.8 | 0 | 0 | 0 | 0 | 106.3 | K33 N37 | K33-V35 PolarHBondContact O-N 2.87Å; V35-N37 PolarHBondContact O-N 3.45Å | ||
| 36 | D | 33.3 | Very low | 39.2 | Very low | 133 Ų | 133 | 130.4 Ų | 130.4 | 71% | 0.711 | 73% | 0.73 | S | S | * | * | trans | -54.9 | 136.1 | 178 | -63.7 | -72.5 | 0 | 0 | 0 | 111.2 | V38 | D36-V38 HydrophobicContact CB-CG2 4.46Å; D36-V38 PolarHBondContact O-N 3.36Å | ||
| 37 | N | 28.9 | Very low | 37.7 | Very low | 170 Ų | 170 | 132.5 Ų | 132.5 | 91% | 0.909 | 75% | 0.746 | S | S | * | * | trans | -74.6 | 69 | 175 | -75.5 | -56.9 | 0 | 0 | 0 | 110.5 | V35 G39 | V35-N37 PolarHBondContact O-N 3.45Å; N37-G39 VanDerWaalsContact C-N 3.33Å; N37-G39 PolarHBondContact O-N 3.14Å | ||
| 38 | V | 30.3 | Very low | 36.4 | Very low | 121 Ų | 121 | 134.9 Ų | 134.9 | 73% | 0.733 | 76% | 0.755 | S | S | * | * | trans | -66.8 | 96.1 | 164.3 | -179.2 | 0 | 0 | 0 | 0 | 107.3 | D36 T40 | D36-V38 HydrophobicContact CB-CG2 4.46Å; D36-V38 PolarHBondContact O-N 3.36Å; V38-T40 PolarHBondContact O-N 3.32Å | ||
| 39 | G | 28.5 | Very low | 35.4 | Very low | 70 Ų | 70 | 135.7 Ų | 135.7 | 72% | 0.722 | 76% | 0.761 | S | S | * | * | trans | -65.9 | 99.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | N37 S41 | N37-G39 VanDerWaalsContact C-N 3.33Å; N37-G39 PolarHBondContact O-N 3.14Å; G39-S41 PolarHBondContact O-N 2.99Å | ||
| 40 | T | 28.7 | Very low | 34.4 | Very low | 125 Ų | 125 | 133.5 Ų | 133.5 | 77% | 0.767 | 77% | 0.77 | S | S | * | * | trans | -74.3 | 92.4 | 172.1 | 51.2 | 0 | 0 | 0 | 0 | 110 | V38 | V38-T40 PolarHBondContact O-N 3.32Š| ||
| 41 | S | 33 | Very low | 33.8 | Very low | 101 Ų | 101 | 131.8 Ų | 131.8 | 71% | 0.706 | 77% | 0.771 | S | S | * | * | trans | -59.8 | 134.3 | 156.9 | 46.4 | 0 | 0 | 0 | 0 | 109.2 | G39 D43 | G39-S41 PolarHBondContact O-N 2.99Å; S41-D43 PolarHBondContact O-N 3.45Å | ||
| 42 | V | 33.3 | Very low | 33.9 | Very low | 133 Ų | 133 | 136.1 Ų | 136.1 | 81% | 0.806 | 77% | 0.772 | S | S | * | * | trans | -84.8 | 108.5 | 177 | 178 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 43 | D | 33.5 | Very low | 33.8 | Very low | 145 Ų | 145 | 137.8 Ų | 137.8 | 78% | 0.775 | 78% | 0.775 | S | S | * | * | trans | -78.4 | 119.2 | 166 | -83.4 | -46.9 | 0 | 0 | 0 | 109.8 | S41 E45 | S41-D43 PolarHBondContact O-N 3.45Å; D43-E45 PolarHBondContact O-N 3.18Å | ||
| 44 | E | 36.8 | Very low | 33.6 | Very low | 194 Ų | 194 | 139.4 Ų | 139.4 | 91% | 0.907 | 78% | 0.776 | S | S | * | * | trans | -80.7 | 94.9 | 167 | -70.3 | -167.7 | 139.4 | 0 | 0 | 109.7 | ||||
| 45 | E | 36.2 | Very low | 33.7 | Very low | 147 Ų | 147 | 136.7 Ų | 136.7 | 69% | 0.687 | 78% | 0.777 | S | S | * | * | trans | -105.9 | 103.7 | 175.9 | -147 | -137.1 | 145.9 | 0 | 0 | 112.4 | D43 | D43-E45 PolarHBondContact O-N 3.18Š| ||
| 46 | K | 35.4 | Very low | 33.5 | Very low | 154 Ų | 154 | 135.5 Ų | 135.5 | 67% | 0.67 | 78% | 0.779 | S | S | * | * | trans | 140.1 | 104.2 | 130.3 | -75.5 | -180 | 171.5 | 87.3 | 0 | 113.6 | ||||
| 47 | L | 38.5 | Very low | 33.5 | Very low | 170 Ų | 170 | 138.3 Ų | 138.3 | 89% | 0.89 | 79% | 0.785 | S | S | * | * | -155.7 | 105.5 | 127 | -107.5 | 159.9 | 0 | 0 | 0 | 110.3 | |||||
| 48 | S | 33.8 | Very low | 33.8 | Very low | 98 Ų | 98 | 137.4 Ų | 137.4 | 69% | 0.685 | 79% | 0.785 | S | S | * | * | trans | -40.7 | 153.2 | 165 | 57.9 | 0 | 0 | 0 | 0 | 114 | ||||
| 49 | T | 35.6 | Very low | 33.8 | Very low | 135 Ų | 135 | 139.7 Ų | 139.7 | 83% | 0.828 | 79% | 0.785 | S | S | * | * | cis | -157.6 | 152.8 | 35.6 | 47.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 50 | G | 30.8 | Very low | 33.9 | Very low | 68 Ų | 68 | 142.1 Ų | 142.1 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | trans | 121.8 | 128.9 | 139.3 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 51 | N | 37.6 | Very low | 33.9 | Very low | 162 Ų | 162 | 145.9 Ų | 145.9 | 87% | 0.866 | 78% | 0.778 | S | S | * | * | trans | 75.9 | 100.3 | 150.4 | -58.3 | -7.2 | 0 | 0 | 0 | 121.7 | ||||
| 52 | E | 37.7 | Very low | 33.9 | Very low | 161 Ų | 161 | 149.7 Ų | 149.7 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | trans | 64.5 | 124.7 | 144.7 | -63.5 | -147.3 | 113.3 | 0 | 0 | 122.6 | ||||
| 53 | P | 34.8 | Very low | 33.8 | Very low | 125 Ų | 125 | 147.1 Ų | 147.1 | 81% | 0.812 | 78% | 0.783 | S | S | * | * | trans | -103.9 | 126.1 | 170.5 | 36.4 | -29.1 | 0 | 0 | 0 | 114.3 | ||||
| 54 | R | 34 | Very low | 33.8 | Very low | 222 Ų | 222 | 149.2 Ų | 149.2 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | trans | -147 | 142.5 | 160.5 | -62.3 | -174 | -171.6 | 177.7 | 6.2 | 107.9 | ||||
| 55 | S | 34.6 | Very low | 33.9 | Very low | 119 Ų | 119 | 145.6 Ų | 145.6 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | cis | -151.8 | 152.8 | 1.5 | 49.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 56 | A | 29.2 | Very low | 33.6 | Very low | 92 Ų | 92 | 147.9 Ų | 147.9 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | trans | -90.2 | 138.5 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 57 | K | 31.6 | Very low | 33.2 | Very low | 193 Ų | 193 | 142.8 Ų | 142.8 | 84% | 0.839 | 78% | 0.782 | S | S | * | * | trans | 169.9 | 98.2 | 144.8 | -98.4 | 169.9 | -179.6 | -176.9 | 0 | 112.6 | ||||
| 58 | V | 36.6 | Very low | 32.7 | Very low | 150 Ų | 150 | 141.5 Ų | 141.5 | 91% | 0.909 | 78% | 0.782 | S | S | * | * | trans | -139.9 | 73.1 | 143 | -170.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 59 | F | 29.9 | Very low | 32.5 | Very low | 169 Ų | 169 | 147.5 Ų | 147.5 | 74% | 0.741 | 79% | 0.791 | S | S | * | * | trans | -73.4 | 163.1 | 153.9 | -83 | -127.7 | 0 | 0 | 0 | 106.9 | ||||
| 60 | E | 30.2 | Very low | 32.1 | Very low | 122 Ų | 122 | 145.6 Ų | 145.6 | 57% | 0.57 | 78% | 0.784 | S | S | * | * | cis | -162.5 | 172.9 | 13.7 | -137.9 | 168.9 | 145.4 | 0 | 0 | 113.2 | ||||
| 61 | R | 28.4 | Very low | 32.1 | Very low | 203 Ų | 203 | 147.8 Ų | 147.8 | 77% | 0.766 | 79% | 0.788 | S | S | * | * | trans | 37.5 | 115.9 | 151.1 | -79 | 172.5 | -132.6 | -162.7 | 6.5 | 119.7 | ||||
| 62 | L | 33.7 | Very low | 31.6 | Very low | 182 Ų | 182 | 150.9 Ų | 150.9 | 95% | 0.953 | 79% | 0.788 | S | S | * | * | -138.5 | 144.8 | 111.7 | -109.2 | 166 | 0 | 0 | 0 | 108.2 | |||||
| 63 | A | 31.3 | Very low | 31.1 | Very low | 79 Ų | 79 | 150.9 Ų | 150.9 | 65% | 0.653 | 79% | 0.789 | S | S | * | * | trans | -144.5 | 155.3 | -165.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 64 | Q | 34.1 | Very low | 30.8 | Very low | 189 Ų | 189 | 151.6 Ų | 151.6 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | trans | 66.4 | 162.7 | 172.2 | -69.1 | -176 | -23.1 | 0 | 0 | 116.7 | ||||
| 65 | P | 37.1 | Very low | 30.8 | Very low | 117 Ų | 117 | 147.3 Ų | 147.3 | 76% | 0.76 | 79% | 0.785 | S | S | * | * | cis | -117.6 | 175.6 | -4.9 | 16.8 | 6.9 | 0 | 0 | 0 | 115 | G67 | P65-G67 PolarHBondContact O-N 2.91Š| ||
| 66 | E | 30 | Very low | 30.6 | Very low | 196 Ų | 196 | 146 Ų | 146 | 92% | 0.916 | 78% | 0.781 | S | S | * | * | trans | -26.3 | 117.9 | 166.6 | -60 | 169.8 | 163.9 | 0 | 0 | 116 | ||||
| 67 | G | 28.1 | Very low | 30.8 | Very low | 46 Ų | 46 | 144.6 Ų | 144.6 | 47% | 0.474 | 77% | 0.766 | S | S | . | * | trans | -129.7 | 104.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | P65 Y69 | P65-G67 PolarHBondContact O-N 2.91Å; G67-Y69 VanDerWaalsContact O-CD2 3.26Å; G67-Y69 WeakPolarHBondContact O-CD2 3.29Å; G67-Y69 PolarHBondContact O-N 2.95Å | ||
| 68 | T | 27 | Very low | 30.7 | Very low | 144 Ų | 144 | 138.2 Ų | 138.2 | 88% | 0.883 | 75% | 0.754 | S | S | * | * | trans | -77.6 | 67.8 | -175.8 | -43.9 | 0 | 0 | 0 | 0 | 111.5 | S70 | T68-S70 VanDerWaalsContact C-N 3.34Å; T68-S70 PolarHBondContact O-N 3.29Å | ||
| 69 | Y | 30.2 | Very low | 30.3 | Very low | 223 Ų | 223 | 137.1 Ų | 137.1 | 88% | 0.875 | 74% | 0.739 | S | S | * | * | trans | -72.4 | 84.7 | -176.3 | -74.7 | -74.1 | 0 | 0 | 0 | 112.3 | G67 S71 | G67-Y69 VanDerWaalsContact O-CD2 3.26Å; G67-Y69 WeakPolarHBondContact O-CD2 3.29Å; G67-Y69 PolarHBondContact O-N 2.95Å; Y69-S71 PolarHBondContact O-N 3.33Å | ||
| 70 | S | 27.3 | Very low | 30.4 | Very low | 96 Ų | 96 | 136.3 Ų | 136.3 | 67% | 0.671 | 74% | 0.742 | S | S | * | * | trans | -57.2 | 108.8 | 166.1 | -177.7 | 0 | 0 | 0 | 0 | 109.6 | T68 R72 | T68-S70 VanDerWaalsContact C-N 3.34Å; T68-S70 PolarHBondContact O-N 3.29Å; S70-R72 VanDerWaalsContact C-N 3.25Å; S70-R72 PolarHBondContact O-N 2.97Å | ||
| 71 | S | 30 | Very low | 30.3 | Very low | 113 Ų | 113 | 138.4 Ų | 138.4 | 79% | 0.79 | 75% | 0.75 | S | S | * | * | trans | -66.8 | 87.1 | 169.3 | -174.9 | 0 | 0 | 0 | 0 | 109.2 | Y69 M73 | Y69-S71 PolarHBondContact O-N 3.33Å; S71-M73 PolarHBondContact O-N 3.5Å | ||
| 72 | R | 27.6 | Very low | 30.5 | Very low | 228 Ų | 228 | 138.2 Ų | 138.2 | 86% | 0.86 | 75% | 0.75 | S | S | * | * | trans | -70.8 | 85.7 | 170.2 | -81.8 | -170.3 | 170.2 | -172.3 | -1.8 | 108.8 | S70 N74 | S70-R72 VanDerWaalsContact C-N 3.25Å; S70-R72 PolarHBondContact O-N 2.97Å; R72-N74 PolarHBondContact O-N 3.25Å | ||
| 73 | M | 28.3 | Very low | 30.3 | Very low | 161 Ų | 161 | 136.1 Ų | 136.1 | 79% | 0.793 | 75% | 0.748 | S | S | * | * | trans | -54.9 | 96.2 | 171.1 | -159.3 | -180 | -162.5 | 0 | 0 | 109.1 | S71 V75 | S71-M73 PolarHBondContact O-N 3.5Å; M73-V75 HydrophobicContact CG-CG2 4.26Å; M73-V75 VanDerWaalsContact O-CG2 3.24Å; M73-V75 WeakPolarHBondContact O-CG2 3.23Å; M73-V75 PolarHBondContact O-N 3.47Å; M73-V75 VanDerWaalsContact O-N 3.13Å | ||
| 74 | N | 27.9 | Very low | 30.2 | Very low | 139 Ų | 139 | 135.4 Ų | 135.4 | 74% | 0.743 | 75% | 0.747 | S | S | * | * | trans | -86.5 | 86.5 | -177.6 | -151.4 | 10.1 | 0 | 0 | 0 | 108.2 | R72 A76 | R72-N74 PolarHBondContact O-N 3.25Å; N74-A76 PolarHBondContact O-N 3.32Å | ||
| 75 | V | 33.7 | Very low | 29.9 | Very low | 133 Ų | 133 | 129.5 Ų | 129.5 | 81% | 0.806 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | 22.2 | -164.2 | -157.5 | 0 | 0 | 0 | 0 | 114.1 | M73 | M73-V75 HydrophobicContact CG-CG2 4.26Å; M73-V75 VanDerWaalsContact O-CG2 3.24Å; M73-V75 WeakPolarHBondContact O-CG2 3.23Å; M73-V75 PolarHBondContact O-N 3.47Å; M73-V75 VanDerWaalsContact O-N 3.13Å |
| 76 | A | 29.5 | Very low | 29.4 | Very low | 91 Ų | 91 | 132.4 Ų | 132.4 | 75% | 0.752 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.5 | -25.1 | -170.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | N74 | N74-A76 PolarHBondContact O-N 3.32Š|
| 77 | S | 33.4 | Very low | 29.3 | Very low | 63 Ų | 63 | 128.6 Ų | 128.6 | 44% | 0.441 | 73% | 0.73 | S | S | . | * | S | Bend | trans | -102.1 | -31.2 | -175.6 | 59.9 | 0 | 0 | 0 | 0 | 115 | E79 | S77-E79 PolarHBondContact O-N 2.91Š|
| 78 | G | 29.8 | Very low | 29.3 | Very low | 58 Ų | 58 | 133.6 Ų | 133.6 | 60% | 0.598 | 75% | 0.746 | S | S | * | * | trans | 72.1 | 1.2 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 79 | E | 29.7 | Very low | 29.6 | Very low | 128 Ų | 128 | 136 Ų | 136 | 60% | 0.598 | 74% | 0.739 | S | S | * | * | trans | -83.1 | 118.3 | -175.4 | -67.8 | -179.6 | 133.5 | 0 | 0 | 112.2 | S77 F81 | S77-E79 PolarHBondContact O-N 2.91Å; E79-F81 VanDerWaalsContact C-N 3.29Å; E79-F81 HydrophobicContact CB-CD2 3.85Å; E79-F81 HydrophobicContact CB-CE2 3.71Å; E79-F81 PolarHBondContact O-N 3.48Å; E79-F81 WeakPolarHBondContact OE2-CE2 3.33Å | ||
| 80 | L | 31.4 | Very low | 29.7 | Very low | 152 Ų | 152 | 136.7 Ų | 136.7 | 80% | 0.796 | 74% | 0.74 | S | S | * | * | trans | -75.7 | 77.9 | 171.9 | -101.3 | 160.4 | 0 | 0 | 0 | 110.5 | Y82 | L80-Y82 PolarHBondContact O-N 3.44Š| ||
| 81 | F | 28.5 | Very low | 30 | Very low | 166 Ų | 166 | 138 Ų | 138 | 73% | 0.728 | 74% | 0.737 | S | S | * | * | trans | -65 | 103.6 | 170.8 | -84.1 | -87.9 | 0 | 0 | 0 | 110.9 | E79 | E79-F81 VanDerWaalsContact C-N 3.29Å; E79-F81 HydrophobicContact CB-CD2 3.85Å; E79-F81 HydrophobicContact CB-CE2 3.71Å; E79-F81 PolarHBondContact O-N 3.48Å; E79-F81 WeakPolarHBondContact OE2-CE2 3.33Å | ||
| 82 | Y | 32.6 | Very low | 30.1 | Very low | 198 Ų | 198 | 136.7 Ų | 136.7 | 78% | 0.776 | 73% | 0.726 | S | S | * | * | trans | -72.5 | 127.1 | 162.1 | -86.8 | -91.8 | 0 | 0 | 0 | 109.6 | L80 G84 | L80-Y82 PolarHBondContact O-N 3.44Å; Y82-G84 PolarHBondContact O-N 2.84Å | ||
| 83 | P | 29.1 | Very low | 30.9 | Very low | 139 Ų | 139 | 130.7 Ų | 130.7 | 90% | 0.903 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -76.9 | 70.6 | 174 | 32.4 | -34.7 | 0 | 0 | 0 | 110.4 | ||
| 84 | G | 30.1 | Very low | 31.2 | Very low | 63 Ų | 63 | 129.8 Ų | 129.8 | 65% | 0.649 | 72% | 0.724 | S | S | * | * | trans | -145.6 | 106.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | Y82 | Y82-G84 PolarHBondContact O-N 2.84Š| ||
| 85 | G | 26.4 | Very low | 31.3 | Very low | 65 Ų | 65 | 127.1 Ų | 127.1 | 67% | 0.67 | 71% | 0.712 | S | S | * | * | trans | -64.8 | 167.6 | -170 | 0 | 0 | 0 | 0 | 0 | 114.9 | I87 | G85-I87 PolarHBondContact O-N 3.4Å; G85-I87 VanDerWaalsContact O-N 3.16Å | ||
| 86 | L | 26.5 | Very low | 31.1 | Very low | 178 Ų | 178 | 126.5 Ų | 126.5 | 93% | 0.932 | 71% | 0.714 | S | S | * | * | trans | -46.8 | 117.9 | -178.8 | -69 | 114 | 0 | 0 | 0 | 112.7 | ||||
| 87 | I | 29.2 | Very low | 31.2 | Very low | 116 Ų | 116 | 132.5 Ų | 132.5 | 60% | 0.595 | 72% | 0.717 | S | S | * | * | trans | -105.5 | 74.6 | 167.5 | -57.8 | -170 | 0 | 0 | 0 | 108.2 | G85 R89 | G85-I87 PolarHBondContact O-N 3.4Å; G85-I87 VanDerWaalsContact O-N 3.16Å; I87-R89 HydrophobicContact CG2-CB 3.99Å; I87-R89 HydrophobicContact CG2-CG 3.46Å; I87-R89 VanDerWaalsContact CG2-CG 3.46Å; I87-R89 PolarHBondContact O-N 2.88Å; I87-R89 VanDerWaalsContact O-N 3.09Å | ||
| 88 | D | 27.9 | Very low | 31 | Very low | 151 Ų | 151 | 134.9 Ų | 134.9 | 81% | 0.807 | 73% | 0.734 | S | S | * | * | trans | -70.6 | 95.8 | 159.5 | -178.3 | 13.7 | 0 | 0 | 0 | 107.9 | ||||
| 89 | R | 33 | Very low | 31.1 | Very low | 195 Ų | 195 | 138.1 Ų | 138.1 | 74% | 0.736 | 74% | 0.742 | S | S | * | * | trans | -118.9 | 101 | 176.6 | -83.4 | -178.9 | -169.9 | 159 | 6.8 | 110.6 | I87 M91 | I87-R89 HydrophobicContact CG2-CB 3.99Å; I87-R89 HydrophobicContact CG2-CG 3.46Å; I87-R89 VanDerWaalsContact CG2-CG 3.46Å; I87-R89 PolarHBondContact O-N 2.88Å; I87-R89 VanDerWaalsContact O-N 3.09Å; R89-M91 PolarHBondContact O-N 3.42Å | ||
| 90 | R | 30.9 | Very low | 31.4 | Very low | 237 Ų | 237 | 137.9 Ų | 137.9 | 89% | 0.894 | 75% | 0.751 | S | S | * | * | trans | -44.6 | 121.6 | 143 | -70 | -176.6 | 173.1 | -153.6 | -1.8 | 108.4 | ||||
| 91 | M | 34.3 | Very low | 31.4 | Very low | 125 Ų | 125 | 143.2 Ų | 143.2 | 62% | 0.616 | 76% | 0.761 | S | S | * | * | trans | -65.9 | 127.7 | 176.2 | -167.6 | 162.7 | 177.2 | 0 | 0 | 108.6 | R89 V95 | R89-M91 PolarHBondContact O-N 3.42Å; M91-V95 HydrophobicContact CE-CB 3.81Å; M91-V95 HydrophobicContact CE-CG1 3.67Å; M91-V95 HydrophobicContact CG-CB 4.48Å | ||
| 92 | P | 33 | Very low | 31.8 | Very low | 84 Ų | 84 | 137.9 Ų | 137.9 | 55% | 0.545 | 75% | 0.753 | S | S | . | * | trans | -60.2 | 143.4 | 175.2 | -20.4 | 31.4 | 0 | 0 | 0 | 110.4 | D94 V95 | P92-D94 PolarHBondContact O-N 2.9Å; P92-D94 VanDerWaalsContact O-N 3.07Å; P92-V95 HydrophobicContact CB-CG2 4.08Å; P92-V95 HydrophobicContact CG-CG2 4.2Å; P92-V95 PolarHBondContact O-N 2.88Å | ||
| 93 | A | 42.9 | Very low | 32 | Very low | 103 Ų | 103 | 134.1 Ų | 134.1 | 85% | 0.851 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60 | -24.6 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 94 | D | 35.3 | Very low | 32.4 | Very low | 142 Ų | 142 | 133.4 Ų | 133.4 | 76% | 0.759 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | 0.6 | -169.5 | -42.8 | -70.6 | 0 | 0 | 0 | 114 | P92 S96 | P92-D94 PolarHBondContact O-N 2.9Å; P92-D94 VanDerWaalsContact O-N 3.07Å; D94-S96 VanDerWaalsContact C-N 3.33Å; D94-S96 PolarHBondContact O-N 3.42Å |
| 95 | V | 30.5 | Very low | 32.7 | Very low | 82 Ų | 82 | 135.9 Ų | 135.9 | 50% | 0.497 | 76% | 0.755 | S | S | . | * | trans | -79.4 | 80.1 | -177.7 | -173 | 0 | 0 | 0 | 0 | 111.2 | M91 P92 R97 | M91-V95 HydrophobicContact CE-CB 3.81Å; M91-V95 HydrophobicContact CE-CG1 3.67Å; M91-V95 HydrophobicContact CG-CB 4.48Å; P92-V95 HydrophobicContact CB-CG2 4.08Å; P92-V95 HydrophobicContact CG-CG2 4.2Å; P92-V95 PolarHBondContact O-N 2.88Å; V95-R97 PolarHBondContact O-N 2.92Å | ||
| 96 | S | 29.6 | Very low | 33.3 | Very low | 120 Ų | 120 | 139.1 Ų | 139.1 | 84% | 0.839 | 75% | 0.753 | S | S | * | * | trans | -63.6 | 101.3 | 175.8 | -69.4 | 0 | 0 | 0 | 0 | 111.9 | D94 S98 | D94-S96 VanDerWaalsContact C-N 3.33Å; D94-S96 PolarHBondContact O-N 3.42Å; S96-S98 PolarHBondContact O-N 2.88Å | ||
| 97 | R | 31.1 | Very low | 33.6 | Very low | 218 Ų | 218 | 134 Ų | 134 | 82% | 0.823 | 73% | 0.73 | S | S | * | * | trans | -80 | 103.5 | 179.2 | -161.8 | 179 | -162.8 | 176 | 6 | 110.5 | V95 T99 | V95-R97 PolarHBondContact O-N 2.92Å; R97-T99 PolarHBondContact O-N 3.49Å | ||
| 98 | S | 29 | Very low | 33.6 | Very low | 113 Ų | 113 | 132.2 Ų | 132.2 | 79% | 0.79 | 72% | 0.724 | S | S | * | * | trans | -62.9 | 105.2 | 176.7 | 42.2 | 0 | 0 | 0 | 0 | 111.6 | S96 P100 | S96-S98 PolarHBondContact O-N 2.88Å; S98-P100 WeakPolarHBondContact O-CD 3.29Å | ||
| 99 | T | 32.8 | Very low | 33.7 | Very low | 126 Ų | 126 | 128.4 Ų | 128.4 | 77% | 0.773 | 71% | 0.707 | S | S | * | * | trans | -80.2 | 115.4 | 173 | 16.6 | 0 | 0 | 0 | 0 | 110.2 | R97 R101 | R97-T99 PolarHBondContact O-N 3.49Å; T99-R101 PolarHBondContact O-N 3.44Å | ||
| 100 | P | 35.9 | Very low | 33.4 | Very low | 122 Ų | 122 | 126.1 Ų | 126.1 | 79% | 0.792 | 70% | 0.704 | S | S | * | * | trans | -68.4 | 115.8 | 174 | 27.6 | -32.8 | 0 | 0 | 0 | 109.6 | S98 G102 | S98-P100 WeakPolarHBondContact O-CD 3.29Å; P100-G102 PolarHBondContact O-N 2.95Å | ||
| 101 | R | 29.9 | Very low | 33.4 | Very low | 264 Ų | 264 | 119.3 Ų | 119.3 | 100% | 0.996 | 69% | 0.689 | S | S | * | * | trans | -70.8 | 80.3 | 166.6 | -78.7 | -176.3 | 170.7 | -179.9 | -2.5 | 109.4 | T99 | T99-R101 PolarHBondContact O-N 3.44Š| ||
| 102 | G | 37.6 | Very low | 34 | Very low | 55 Ų | 55 | 116.4 Ų | 116.4 | 57% | 0.567 | 69% | 0.691 | S | S | * | * | trans | -113.7 | 155.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112 | P100 | P100-G102 PolarHBondContact O-N 2.95Š| ||
| 103 | P | 36.1 | Very low | 33.8 | Very low | 119 Ų | 119 | 124.1 Ų | 124.1 | 77% | 0.773 | 71% | 0.709 | S | S | * | * | trans | -62.1 | 154.8 | 169.4 | 28.9 | -34.9 | 0 | 0 | 0 | 110.7 | S105 | P103-S105 PolarHBondContact O-N 3.11Š| ||
| 104 | P | 37.3 | Very low | 33 | Very low | 124 Ų | 124 | 125.7 Ų | 125.7 | 81% | 0.805 | 70% | 0.699 | S | S | * | * | trans | -63.2 | 109.2 | -172.2 | 25.1 | -34.6 | 0 | 0 | 0 | 111.5 | H106 | P104-H106 PolarHBondContact O-N 3.31Š| ||
| 105 | S | 38.1 | Very low | 32.6 | Very low | 114 Ų | 114 | 123 Ų | 123 | 80% | 0.797 | 69% | 0.688 | S | S | * | * | trans | -62 | 131 | 174.3 | 44.5 | 0 | 0 | 0 | 0 | 110.1 | P103 | P103-S105 PolarHBondContact O-N 3.11Š| ||
| 106 | H | 37.2 | Very low | 32.4 | Very low | 133 Ų | 133 | 121.7 Ų | 121.7 | 62% | 0.616 | 68% | 0.68 | S | S | * | * | trans | -60 | 144.2 | 178.9 | -61.2 | -41.9 | 0 | 0 | 0 | 110.8 | P104 V108 | P104-H106 PolarHBondContact O-N 3.31Å; H106-V108 PolarHBondContact O-N 3.29Å | ||
| 107 | P | 33.7 | Very low | 32.4 | Very low | 72 Ų | 72 | 121.8 Ų | 121.8 | 47% | 0.468 | 67% | 0.667 | S | S | . | * | trans | -64.2 | 98.3 | 171.6 | 26.6 | -33.2 | 0 | 0 | 0 | 109.5 | W324 | P107-W324 HydrophobicContact CG-CE3 4.19Å; P107-W324 HydrophobicContact CG-CH2 4.19Å; P107-W324 HydrophobicContact CG-CZ3 3.62Å | ||
| 108 | V | 28.9 | Very low | 32.4 | Very low | 77 Ų | 77 | 116 Ų | 116 | 47% | 0.467 | 65% | 0.651 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -75.8 | 121.6 | 174 | 163.8 | 0 | 0 | 0 | 0 | 108.3 | H106 T115 | H106-V108 PolarHBondContact O-N 3.29Å; V108-T115 HydrophobicContact CG1-CG2 3.51Å; V108-T115 HydrophobicContact CG2-CG2 4.19Å |
| 109 | V | 29.5 | Very low | 32.4 | Very low | 72 Ų | 72 | 119 Ų | 119 | 44% | 0.436 | 65% | 0.652 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -101.6 | 110.4 | 166 | -175 | 0 | 0 | 0 | 0 | 107.2 | V111 V116 I118 | V109-V111 HydrophobicContact CG1-CG2 4Å; V109-V116 PolarHBondContact N-O 2.92Å; V109-V116 PolarHBondContact O-N 2.78Å; V109-V116 VanDerWaalsContact O-N 3.12Å; V109-I118 HydrophobicContact CG2-CD1 4.31Å |
| 110 | Q | 26.6 | Very low | 32.5 | Very low | 146 Ų | 146 | 119.9 Ų | 119.9 | 68% | 0.682 | 65% | 0.652 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -80.2 | 121.9 | 175.3 | -169.4 | 173.3 | 12.9 | 0 | 0 | 109 | ||
| 111 | V | 32.7 | Very low | 32.2 | Very low | 94 Ų | 94 | 125.2 Ų | 125.2 | 57% | 0.57 | 66% | 0.656 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -120.5 | 87.1 | -178.1 | -174.3 | 0 | 0 | 0 | 0 | 108.1 | V109 R113 E114 V116 | V109-V111 HydrophobicContact CG1-CG2 4Å; V111-R113 PolarHBondContact O-N 3.48Å; V111-E114 PolarHBondContact N-O 3.07Å; V111-E114 PolarHBondContact O-N 3.12Å; V111-V116 HydrophobicContact CG2-CG2 4.4Å |
| 112 | G | 45.2 | Very low | 32.4 | Very low | 64 Ų | 64 | 116.3 Ų | 116.3 | 66% | 0.66 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.1 | -123.6 | -169.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 113 | R | 29.6 | Very low | 32.2 | Very low | 247 Ų | 247 | 120.5 Ų | 120.5 | 93% | 0.932 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -6.8 | 178 | -68.7 | -173.8 | 177 | -173.4 | -2 | 114.2 | V111 | V111-R113 PolarHBondContact O-N 3.48Š|
| 114 | E | 25.5 | Very low | 32 | Very low | 135 Ų | 135 | 124.5 Ų | 124.5 | 63% | 0.631 | 66% | 0.661 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -103.7 | 135.5 | -177.2 | -68.9 | -171.9 | 174.3 | 0 | 0 | 112.9 | V111 | V111-E114 PolarHBondContact N-O 3.07Å; V111-E114 PolarHBondContact O-N 3.12Å |
| 115 | T | 26.9 | Very low | 31.7 | Very low | 86 Ų | 86 | 129.9 Ų | 129.9 | 53% | 0.528 | 67% | 0.665 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -95.3 | 106 | 179.5 | -51 | 0 | 0 | 0 | 0 | 109.1 | V108 | V108-T115 HydrophobicContact CG1-CG2 3.51Å; V108-T115 HydrophobicContact CG2-CG2 4.19Å |
| 116 | V | 27.4 | Very low | 31.4 | Very low | 55 Ų | 55 | 135.2 Ų | 135.2 | 33% | 0.333 | 67% | 0.668 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -106.6 | 115.7 | -172.9 | -173.2 | 0 | 0 | 0 | 0 | 111.5 | V109 V111 I118 | V109-V116 PolarHBondContact N-O 2.92Å; V109-V116 PolarHBondContact O-N 2.78Å; V109-V116 VanDerWaalsContact O-N 3.12Å; V111-V116 HydrophobicContact CG2-CG2 4.4Å; V116-I118 HydrophobicContact CG1-CG1 4.05Å |
| 117 | H | 30.1 | Very low | 31.3 | Very low | 121 Ų | 121 | 136.2 Ų | 136.2 | 56% | 0.56 | 68% | 0.676 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -83.4 | 119.1 | 170.3 | -63.4 | -77.9 | 0 | 0 | 0 | 110.5 | ||
| 118 | I | 29.9 | Very low | 31.1 | Very low | 96 Ų | 96 | 139.9 Ų | 139.9 | 49% | 0.492 | 69% | 0.691 | S | S | . | * | trans | -108.5 | 108 | -178.4 | -55.9 | 178.5 | 0 | 0 | 0 | 109.9 | V109 V116 L120 | V109-I118 HydrophobicContact CG2-CD1 4.31Å; V116-I118 HydrophobicContact CG1-CG1 4.05Å; I118-L120 HydrophobicContact CG2-CD2 3.88Å; I118-L120 HydrophobicContact CG2-CG 4.17Å | ||
| 119 | Q | 30.1 | Very low | 31.4 | Very low | 176 Ų | 176 | 141.4 Ų | 141.4 | 82% | 0.822 | 71% | 0.705 | S | S | * | * | trans | -97.3 | 108.9 | 178.2 | -162.8 | -178.5 | 75 | 0 | 0 | 110.7 | ||||
| 120 | L | 34 | Very low | 31.6 | Very low | 145 Ų | 145 | 143.3 Ų | 143.3 | 76% | 0.759 | 72% | 0.721 | S | S | * | * | trans | -95.2 | 106 | -177.3 | -63.3 | 179 | 0 | 0 | 0 | 111.8 | I118 G122 | I118-L120 HydrophobicContact CG2-CD2 3.88Å; I118-L120 HydrophobicContact CG2-CG 4.17Å; L120-G122 PolarHBondContact O-N 3.31Å | ||
| 121 | R | 30.7 | Very low | 31.7 | Very low | 235 Ų | 235 | 144.4 Ų | 144.4 | 89% | 0.887 | 73% | 0.732 | S | S | * | * | trans | -79.8 | 112.7 | 167.8 | -73.1 | -172.8 | 175.8 | -163.9 | -1.6 | 110.6 | ||||
| 122 | G | 34 | Very low | 32 | Very low | 76 Ų | 76 | 145.6 Ų | 145.6 | 78% | 0.784 | 75% | 0.745 | S | S | * | * | trans | -102.7 | 123 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L120 | L120-G122 PolarHBondContact O-N 3.31Š| ||
| 123 | T | 32.2 | Very low | 31.6 | Very low | 143 Ų | 143 | 147.4 Ų | 147.4 | 88% | 0.877 | 75% | 0.747 | S | S | * | * | trans | -88.6 | 114.9 | 173 | 41.2 | 0 | 0 | 0 | 0 | 110.7 | R125 | T123-R125 PolarHBondContact O-N 3.38Š| ||
| 124 | R | 32.6 | Very low | 32.1 | Very low | 204 Ų | 204 | 141.1 Ų | 141.1 | 77% | 0.77 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -69 | 128.7 | 174 | -70.6 | -171.5 | 179.8 | -156.9 | 0.7 | 110.3 | ||
| 125 | R | 31.7 | Very low | 33 | Very low | 237 Ų | 237 | 143.6 Ų | 143.6 | 89% | 0.894 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -100.4 | 123.2 | 153.2 | -74.2 | -175.4 | 172.2 | -172.4 | -3.6 | 107.8 | T123 | T123-R125 PolarHBondContact O-N 3.38Š|
| 126 | R | 31.7 | Very low | 34 | Very low | 226 Ų | 226 | 147.8 Ų | 147.8 | 85% | 0.853 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 128.9 | 162.3 | -79.3 | -179.6 | 170.6 | 161.6 | -3.9 | 107.4 | ||
| 127 | I | 34.8 | Very low | 35 | Very low | 154 Ų | 154 | 150.8 Ų | 150.8 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | trans | -96.5 | 113.6 | 156.2 | -60.7 | 177.2 | 0 | 0 | 0 | 104.7 | ||||
| 128 | L | 30.2 | Very low | 35.9 | Very low | 148 Ų | 148 | 153.5 Ų | 153.5 | 78% | 0.775 | 79% | 0.786 | S | S | * | * | trans | -96.7 | 123.9 | 166.8 | -64.8 | 171.7 | 0 | 0 | 0 | 106.3 | ||||
| 129 | S | 34.1 | Very low | 36.8 | Very low | 109 Ų | 109 | 157.9 Ų | 157.9 | 76% | 0.762 | 80% | 0.804 | S | S | * | * | trans | -120.6 | 124.2 | 166.8 | -64.7 | 0 | 0 | 0 | 0 | 106 | ||||
| 130 | S | 34.2 | Very low | 37.7 | Very low | 113 Ų | 113 | 157.7 Ų | 157.7 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | trans | -81.3 | 142.3 | -162.3 | -44.4 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 131 | D | 27.6 | Very low | 38.5 | Very low | 169 Ų | 169 | 159 Ų | 159 | 90% | 0.904 | 80% | 0.803 | S | S | * | * | trans | -70 | 146.9 | 147.9 | -58.1 | -61.8 | 0 | 0 | 0 | 109.3 | ||||
| 132 | S | 38.7 | Very low | 39.1 | Very low | 119 Ų | 119 | 156.4 Ų | 156.4 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -145.7 | 127 | 172.7 | 60.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 133 | S | 38 | Very low | 39.7 | Very low | 102 Ų | 102 | 161.6 Ų | 161.6 | 71% | 0.713 | 80% | 0.802 | S | S | * | * | trans | -105.3 | -178.1 | -169.4 | 59.4 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 134 | T | 40.5 | Very low | 40.3 | Very low | 114 Ų | 114 | 161.1 Ų | 161.1 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | trans | 64.9 | 122.8 | 148.2 | 45.5 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 135 | E | 44.7 | Very low | 40.6 | Very low | 187 Ų | 187 | 157.1 Ų | 157.1 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | cis | -129.1 | -105.3 | -20.5 | -70.7 | -166.4 | 61.6 | 0 | 0 | 112.2 | ||||
| 136 | E | 47.4 | Very low | 41.4 | Very low | 174 Ų | 174 | 151.1 Ų | 151.1 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | cis | -158.9 | 149.4 | -0.9 | -157.5 | -159.3 | -64 | 0 | 0 | 110.9 | ||||
| 137 | D | 47.4 | Very low | 42.2 | Very low | 118 Ų | 118 | 147 Ų | 147 | 63% | 0.631 | 79% | 0.787 | S | S | * | * | trans | 9.3 | 112.2 | 159 | -99 | 31.4 | 0 | 0 | 0 | 122.9 | ||||
| 138 | K | 50.3 | Low | 42.4 | Very low | 179 Ų | 179 | 143.2 Ų | 143.2 | 78% | 0.778 | 79% | 0.787 | S | S | * | * | 168.3 | 149.6 | 94.1 | -98.1 | 157.1 | -176.3 | 77.5 | 0 | 114.8 | |||||
| 139 | E | 47.7 | Very low | 42.6 | Very low | 188 Ų | 188 | 140.1 Ų | 140.1 | 88% | 0.879 | 79% | 0.79 | S | S | * | * | trans | -86.3 | 149.3 | 171.1 | -56.8 | 178 | 100.3 | 0 | 0 | 112.3 | ||||
| 140 | E | 49.7 | Very low | 42.6 | Very low | 172 Ų | 172 | 141.3 Ų | 141.3 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | -164 | 121.8 | 121.9 | -113.2 | -173.2 | 165.4 | 0 | 0 | 115.4 | |||||
| 141 | K | 49.5 | Very low | 42.6 | Very low | 173 Ų | 173 | 140.2 Ų | 140.2 | 75% | 0.752 | 80% | 0.795 | S | S | * | * | trans | 17.6 | 108.9 | 150.2 | -66 | 158.1 | -170.2 | 152 | 0 | 120.9 | ||||
| 142 | E | 43.7 | Very low | 43.2 | Very low | 179 Ų | 179 | 139 Ų | 139 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | 42.8 | 117.1 | 108.2 | -173.9 | 176.1 | -127.7 | 0 | 0 | 119.9 | |||||
| 143 | K | 47.6 | Very low | 43 | Very low | 186 Ų | 186 | 142.5 Ų | 142.5 | 81% | 0.809 | 80% | 0.797 | S | S | * | * | trans | -167.3 | 133.9 | 131.9 | -110.1 | 173 | -178.9 | 176.2 | 0 | 115.8 | ||||
| 144 | D | 45 | Very low | 42.6 | Very low | 133 Ų | 133 | 142.7 Ų | 142.7 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | trans | 43.1 | 92.9 | 145.3 | -53.9 | -30.9 | 0 | 0 | 0 | 121.5 | ||||
| 145 | C | 37.3 | Very low | 42 | Very low | 120 Ų | 120 | 146.3 Ų | 146.3 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | 17.6 | 158.5 | 112.7 | -65.4 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 146 | P | 48.7 | Very low | 41.3 | Very low | 111 Ų | 111 | 142.7 Ų | 142.7 | 72% | 0.721 | 79% | 0.794 | S | S | * | * | cis | -142.9 | -158.7 | -38.9 | 40.2 | -21.2 | 0 | 0 | 0 | 112.1 | ||||
| 147 | T | 48.9 | Very low | 40.3 | Very low | 138 Ų | 138 | 141.9 Ų | 141.9 | 85% | 0.847 | 80% | 0.795 | S | S | * | * | trans | 96.9 | 117.7 | 159 | -40.2 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 148 | G | 39 | Very low | 39.4 | Very low | 76 Ų | 76 | 144.2 Ų | 144.2 | 78% | 0.784 | 81% | 0.805 | S | S | * | * | trans | 105.7 | 137.6 | 144.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 149 | G | 35 | Very low | 38.2 | Very low | 82 Ų | 82 | 141.1 Ų | 141.1 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | 94.3 | 93.2 | 148 | 0 | 0 | 0 | 0 | 0 | 118.1 | A151 | G149-A151 PolarHBondContact O-N 3.46Š| ||
| 150 | C | 33.2 | Very low | 37.2 | Very low | 134 Ų | 134 | 138.1 Ų | 138.1 | 91% | 0.905 | 81% | 0.806 | S | S | * | * | trans | -33.5 | 123.1 | 168.7 | -58.1 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 151 | A | 35.6 | Very low | 35.9 | Very low | 91 Ų | 91 | 141.1 Ų | 141.1 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | trans | 40.2 | 103.5 | 142.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | G149 | G149-A151 PolarHBondContact O-N 3.46Š| ||
| 152 | P | 39.4 | Very low | 34.6 | Very low | 142 Ų | 142 | 138.8 Ų | 138.8 | 92% | 0.922 | 81% | 0.81 | S | S | * | * | trans | -72.4 | 161.8 | 174.2 | 31.6 | -35.6 | 0 | 0 | 0 | 113.3 | ||||
| 153 | K | 34.5 | Very low | 33.8 | Very low | 194 Ų | 194 | 136.9 Ų | 136.9 | 84% | 0.843 | 81% | 0.811 | S | S | * | * | trans | -124 | 138.5 | -169 | -148.2 | -169 | -176 | 174.3 | 0 | 109.5 | ||||
| 154 | V | 29.2 | Very low | 32.7 | Very low | 106 Ų | 106 | 133.2 Ų | 133.2 | 64% | 0.642 | 80% | 0.804 | S | S | * | * | trans | 81.5 | 118.2 | 156.8 | -167 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 155 | K | 29.1 | Very low | 32 | Very low | 190 Ų | 190 | 132.3 Ų | 132.3 | 83% | 0.826 | 81% | 0.805 | S | S | * | * | trans | 54.3 | 121.4 | 148.1 | -61.7 | 166.5 | -164.8 | 171.8 | 0 | 123 | ||||
| 156 | S | 29.5 | Very low | 31.4 | Very low | 110 Ų | 110 | 134.4 Ų | 134.4 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | -148.3 | 148.8 | 116.5 | 52.8 | 0 | 0 | 0 | 0 | 107.5 | |||||
| 157 | L | 25.5 | Very low | 30.6 | Very low | 158 Ų | 158 | 133.8 Ų | 133.8 | 83% | 0.827 | 81% | 0.805 | S | S | * | * | cis | 74.5 | 87.5 | 34.8 | -77.1 | 173.8 | 0 | 0 | 0 | 115.4 | ||||
| 158 | I | 28.2 | Very low | 29.6 | Very low | 166 Ų | 166 | 135.5 Ų | 135.5 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | trans | -177.8 | 126.1 | 151.2 | -89.4 | 142.6 | 0 | 0 | 0 | 104.2 | ||||
| 159 | S | 25.2 | Very low | 29.2 | Very low | 115 Ų | 115 | 136.9 Ų | 136.9 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | cis | 90.8 | 87.7 | 28.5 | -163 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 160 | S | 27 | Very low | 28.8 | Very low | 124 Ų | 124 | 141.5 Ų | 141.5 | 87% | 0.867 | 81% | 0.806 | S | S | * | * | trans | -152.5 | 168 | 159.4 | 65.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 161 | R | 23.6 | Very low | 28.6 | Very low | 236 Ų | 236 | 139.5 Ų | 139.5 | 89% | 0.891 | 79% | 0.793 | S | S | * | * | trans | -115.2 | 135.5 | -155.2 | -68.8 | 176.1 | 174 | 166.8 | -3.4 | 115.5 | ||||
| 162 | V | 22.1 | Very low | 28.2 | Very low | 124 Ų | 124 | 143.6 Ų | 143.6 | 75% | 0.752 | 80% | 0.797 | S | S | * | * | trans | 37.7 | 117.2 | 130.7 | -172.7 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 163 | V | 25.6 | Very low | 27.8 | Very low | 139 Ų | 139 | 148.2 Ų | 148.2 | 84% | 0.842 | 80% | 0.796 | S | S | * | * | trans | -138.6 | 139.7 | 130.7 | -178.7 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 164 | V | 25.6 | Very low | 27.5 | Very low | 109 Ų | 109 | 144.7 Ų | 144.7 | 66% | 0.661 | 79% | 0.791 | S | S | * | * | trans | -124.9 | 123.7 | 173.2 | 176.9 | 0 | 0 | 0 | 0 | 109.1 | L166 | V164-L166 PolarHBondContact O-N 3.45Å; V164-L166 VanDerWaalsContact O-N 3.13Å | ||
| 165 | P | 29.1 | Very low | 27.7 | Very low | 114 Ų | 114 | 146.6 Ų | 146.6 | 74% | 0.74 | 80% | 0.797 | S | S | * | * | trans | -71.6 | 104.2 | 174.7 | -17.9 | 32.2 | 0 | 0 | 0 | 111.6 | S167 | P165-S167 PolarHBondContact O-N 2.9Š| ||
| 166 | L | 26.3 | Very low | 27.8 | Very low | 164 Ų | 164 | 142.7 Ų | 142.7 | 86% | 0.859 | 79% | 0.789 | S | S | * | * | trans | -79 | 100.3 | 168.2 | -77.7 | 167.3 | 0 | 0 | 0 | 109.7 | V164 | V164-L166 PolarHBondContact O-N 3.45Å; V164-L166 VanDerWaalsContact O-N 3.13Å | ||
| 167 | S | 31.5 | Very low | 28.2 | Very low | 98 Ų | 98 | 143.8 Ų | 143.8 | 69% | 0.685 | 79% | 0.791 | S | S | * | * | trans | -138.6 | 30.9 | 171.5 | 72.2 | 0 | 0 | 0 | 0 | 114.6 | P165 V169 | P165-S167 PolarHBondContact O-N 2.9Å; S167-V169 PolarHBondContact O-N 3.11Å | ||
| 168 | N | 28.4 | Very low | 28.5 | Very low | 174 Ų | 174 | 142.6 Ų | 142.6 | 93% | 0.93 | 79% | 0.79 | S | S | * | * | trans | -73.6 | 68.4 | 149.9 | -84.8 | -0.5 | 0 | 0 | 0 | 108.5 | ||||
| 169 | V | 28.8 | Very low | 29 | Very low | 104 Ų | 104 | 144 Ų | 144 | 63% | 0.63 | 79% | 0.793 | S | S | * | * | trans | -107.7 | 96.2 | 175.6 | 178.3 | 0 | 0 | 0 | 0 | 108.2 | S167 | S167-V169 PolarHBondContact O-N 3.11Š| ||
| 170 | I | 26.8 | Very low | 29.5 | Very low | 179 Ų | 179 | 147 Ų | 147 | 92% | 0.918 | 79% | 0.792 | S | S | * | * | trans | -83.2 | 108 | 160.7 | -56.9 | 171.5 | 0 | 0 | 0 | 105.4 | ||||
| 171 | S | 28.9 | Very low | 30.2 | Very low | 92 Ų | 92 | 152.6 Ų | 152.6 | 64% | 0.643 | 79% | 0.794 | S | S | * | * | trans | -143.7 | 131.7 | 174.9 | 64.5 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 172 | E | 27.7 | Very low | 30.8 | Very low | 178 Ų | 178 | 147.6 Ų | 147.6 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | trans | -67 | 147.9 | -177.3 | -61.6 | 154.8 | 109.5 | 0 | 0 | 112.4 | ||||
| 173 | R | 31.5 | Very low | 31.2 | Very low | 238 Ų | 238 | 150 Ų | 150 | 90% | 0.898 | 78% | 0.783 | S | S | * | * | trans | -135.7 | 87.6 | 154.4 | -89.1 | -166.1 | 167.9 | 160.2 | -1.4 | 111 | L175 | R173-L175 PolarHBondContact O-N 3.03Š| ||
| 174 | T | 27.7 | Very low | 31.8 | Very low | 120 Ų | 120 | 153.6 Ų | 153.6 | 74% | 0.736 | 78% | 0.782 | S | S | * | * | trans | -65.3 | 109.4 | 162.6 | 16.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 175 | L | 32.8 | Very low | 32.2 | Very low | 146 Ų | 146 | 157.5 Ų | 157.5 | 76% | 0.764 | 79% | 0.79 | S | S | * | * | trans | -143.5 | 91.5 | 164.2 | -77.9 | 173.9 | 0 | 0 | 0 | 107.1 | R173 | R173-L175 PolarHBondContact O-N 3.03Š| ||
| 176 | T | 31.9 | Very low | 32.3 | Very low | 109 Ų | 109 | 156.3 Ų | 156.3 | 67% | 0.669 | 79% | 0.79 | S | S | * | * | 75.4 | 62 | 66 | 73.6 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 177 | T | 37.5 | Very low | 32.4 | Very low | 133 Ų | 133 | 156.3 Ų | 156.3 | 82% | 0.816 | 79% | 0.791 | S | S | * | * | trans | -155.2 | 101.8 | 145.8 | 42.9 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 178 | V | 32.5 | Very low | 32.2 | Very low | 133 Ų | 133 | 156.6 Ų | 156.6 | 81% | 0.806 | 79% | 0.788 | S | S | * | * | 56.9 | 82.7 | 70.9 | -170 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 179 | E | 39.4 | Very low | 32.1 | Very low | 195 Ų | 195 | 160 Ų | 160 | 91% | 0.911 | 79% | 0.788 | S | S | * | * | trans | -130.3 | 140.9 | 147.9 | -168.2 | 164 | -151.7 | 0 | 0 | 108.6 | ||||
| 180 | K | 35.7 | Very low | 32.1 | Very low | 179 Ų | 179 | 161.5 Ų | 161.5 | 78% | 0.778 | 79% | 0.792 | S | S | * | * | trans | -108.2 | 134.7 | -170.8 | -69.9 | 176.6 | 175 | 177.5 | 0 | 111.3 | ||||
| 181 | R | 40.8 | Very low | 32 | Very low | 240 Ų | 240 | 158.5 Ų | 158.5 | 91% | 0.906 | 79% | 0.787 | S | S | * | * | trans | 154.5 | 144.9 | 148.6 | -89.1 | 152.5 | 176.4 | 161.4 | -2.9 | 109.3 | ||||
| 182 | E | 35.3 | Very low | 32.2 | Very low | 131 Ų | 131 | 161 Ų | 161 | 61% | 0.612 | 79% | 0.791 | S | S | * | * | cis | -152.5 | 133.2 | -19.7 | 178.9 | 175.9 | 144.6 | 0 | 0 | 106.5 | R184 | E182-R184 IonicContact OE1-CZ 3.32Å; E182-R184 IonicContact OE1-NE 2.66Å; E182-R184 PolarHBondContact OE1-NE 3.37Å; E182-R184 IonicContact OE1-NH2 2.8Å; E182-R184 PolarHBondContact OE1-NH2 2.87Å | ||
| 183 | E | 31.9 | Very low | 32.1 | Very low | 174 Ų | 174 | 157.9 Ų | 157.9 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -77.1 | 126.9 | 174.2 | -68.4 | -175.6 | 106.7 | 0 | 0 | 110.9 | ||||
| 184 | R | 37.1 | Very low | 32.1 | Very low | 216 Ų | 216 | 152.3 Ų | 152.3 | 82% | 0.815 | 78% | 0.782 | S | S | * | * | trans | -136.5 | 126.4 | 149.6 | -66.1 | -167.3 | -171 | -133.4 | -3.1 | 111.1 | E182 | E182-R184 IonicContact OE1-CZ 3.32Å; E182-R184 IonicContact OE1-NE 2.66Å; E182-R184 PolarHBondContact OE1-NE 3.37Å; E182-R184 IonicContact OE1-NH2 2.8Å; E182-R184 PolarHBondContact OE1-NH2 2.87Å | ||
| 185 | K | 34.2 | Very low | 32.4 | Very low | 190 Ų | 190 | 155.3 Ų | 155.3 | 83% | 0.826 | 78% | 0.784 | S | S | * | * | trans | -75.7 | 149.5 | 179.9 | -57.9 | 171.6 | -177.6 | 176.4 | 0 | 110.6 | ||||
| 186 | A | 31.5 | Very low | 32.4 | Very low | 90 Ų | 90 | 157.6 Ų | 157.6 | 74% | 0.744 | 79% | 0.788 | S | S | * | * | trans | -152 | 75.3 | 162.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | V188 | A186-V188 HydrophobicContact CB-CG2 4.34Å; A186-V188 PolarHBondContact O-N 3.37Å | ||
| 187 | D | 28.4 | Very low | 32.4 | Very low | 164 Ų | 164 | 157.9 Ų | 157.9 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | -64.5 | 109.9 | 159 | -82.6 | -63.9 | 0 | 0 | 0 | 108.5 | ||||
| 188 | V | 28.1 | Very low | 32.2 | Very low | 104 Ų | 104 | 158.8 Ų | 158.8 | 63% | 0.63 | 79% | 0.785 | S | S | * | * | trans | -125.8 | 93.7 | 176.9 | -179.5 | 0 | 0 | 0 | 0 | 109.8 | A186 L190 | A186-V188 HydrophobicContact CB-CG2 4.34Å; A186-V188 PolarHBondContact O-N 3.37Å; V188-L190 HydrophobicContact CG1-CD1 3.72Å; V188-L190 HydrophobicContact CG1-CG 3.72Å; V188-L190 PolarHBondContact O-N 2.91Å | ||
| 189 | R | 25.7 | Very low | 32.3 | Very low | 246 Ų | 246 | 159.7 Ų | 159.7 | 93% | 0.928 | 78% | 0.784 | S | S | * | * | trans | -71.5 | 114.2 | 159.4 | -73.8 | 177.9 | 169.2 | -177.2 | -4.1 | 108.3 | ||||
| 190 | L | 28.6 | Very low | 32.1 | Very low | 135 Ų | 135 | 159 Ų | 159 | 71% | 0.707 | 78% | 0.781 | S | S | * | * | trans | -115.1 | 86.5 | 168.3 | -88.3 | 167.3 | 0 | 0 | 0 | 110.8 | V188 I192 | V188-L190 HydrophobicContact CG1-CD1 3.72Å; V188-L190 HydrophobicContact CG1-CG 3.72Å; V188-L190 PolarHBondContact O-N 2.91Å; L190-I192 HydrophobicContact CB-CG1 4.46Å; L190-I192 PolarHBondContact O-N 2.88Å; L190-I192 VanDerWaalsContact O-N 3.15Å | ||
| 191 | S | 25.5 | Very low | 32.1 | Very low | 115 Ų | 115 | 154.5 Ų | 154.5 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | trans | -72.7 | 92.4 | 161.9 | 51.6 | 0 | 0 | 0 | 0 | 109.2 | V193 | S191-V193 PolarHBondContact O-N 3.46Š| ||
| 192 | I | 31.7 | Very low | 32 | Very low | 144 Ų | 144 | 149.4 Ų | 149.4 | 74% | 0.738 | 76% | 0.763 | S | S | * | * | trans | -84.6 | 107.1 | 174.7 | -62.1 | -178.8 | 0 | 0 | 0 | 108.9 | L190 S194 | L190-I192 HydrophobicContact CB-CG1 4.46Å; L190-I192 PolarHBondContact O-N 2.88Å; L190-I192 VanDerWaalsContact O-N 3.15Å; I192-S194 PolarHBondContact O-N 2.67Å | ||
| 193 | V | 27.2 | Very low | 32.3 | Very low | 113 Ų | 113 | 150.9 Ų | 150.9 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | trans | -70.8 | 122.8 | 169.1 | 174.4 | 0 | 0 | 0 | 0 | 108.8 | S191 K195 | S191-V193 PolarHBondContact O-N 3.46Å; V193-K195 HydrophobicContact CG1-CG 3.72Å | ||
| 194 | S | 31.4 | Very low | 32.5 | Very low | 121 Ų | 121 | 150.3 Ų | 150.3 | 85% | 0.846 | 77% | 0.768 | S | S | * | * | trans | -111.4 | 130.4 | 155.1 | -165.8 | 0 | 0 | 0 | 0 | 108.2 | I192 | I192-S194 PolarHBondContact O-N 2.67Š| ||
| 195 | K | 33.3 | Very low | 32.5 | Very low | 183 Ų | 183 | 143.2 Ų | 143.2 | 80% | 0.796 | 76% | 0.755 | S | S | * | * | trans | -102.2 | 161.3 | -171 | -76.3 | -171.4 | 176.6 | 178.1 | 0 | 112.3 | V193 | V193-K195 HydrophobicContact CG1-CG 3.72Š| ||
| 196 | K | 33.7 | Very low | 32.8 | Very low | 194 Ų | 194 | 142.4 Ų | 142.4 | 84% | 0.843 | 76% | 0.758 | S | S | * | * | trans | 78.1 | 81.5 | 148.1 | -136.8 | -175.7 | -177.5 | -159.8 | 0 | 116.7 | ||||
| 197 | T | 30 | Very low | 33.2 | Very low | 116 Ų | 116 | 142.3 Ų | 142.3 | 71% | 0.712 | 76% | 0.758 | S | S | * | * | trans | -57.1 | 153.9 | 138.1 | 14.2 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 198 | E | 33.4 | Very low | 33.7 | Very low | 152 Ų | 152 | 139.8 Ų | 139.8 | 71% | 0.71 | 75% | 0.75 | S | S | * | * | trans | 75 | 130.1 | 145.1 | -71.6 | 167.3 | 152.5 | 0 | 0 | 122.5 | ||||
| 199 | L | 34.6 | Very low | 34 | Very low | 151 Ų | 151 | 142.4 Ų | 142.4 | 79% | 0.791 | 76% | 0.76 | S | S | * | * | trans | 62 | 99.1 | 137.1 | -65.6 | 168.2 | 0 | 0 | 0 | 120.8 | ||||
| 200 | Q | 36.7 | Very low | 35 | Very low | 180 Ų | 180 | 135.4 Ų | 135.4 | 84% | 0.841 | 75% | 0.746 | S | S | * | * | trans | 173.2 | 117.9 | 131.6 | -94.9 | 163.8 | -9.2 | 0 | 0 | 105.3 | ||||
| 201 | S | 35.5 | Very low | 35.4 | Very low | 85 Ų | 85 | 137.8 Ų | 137.8 | 59% | 0.594 | 75% | 0.754 | S | S | * | * | 50.1 | 112 | 69.1 | 88.2 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 202 | D | 38.9 | Very low | 36.1 | Very low | 133 Ų | 133 | 136.7 Ų | 136.7 | 71% | 0.711 | 75% | 0.752 | S | S | * | * | -168.6 | 168.6 | 57.1 | -76.7 | -57.3 | 0 | 0 | 0 | 111.8 | |||||
| 203 | Q | 40.4 | Very low | 36.5 | Very low | 163 Ų | 163 | 135.8 Ų | 135.8 | 76% | 0.762 | 75% | 0.753 | S | S | * | * | trans | 59.3 | 119 | 152.8 | -74.2 | -178.7 | -65.9 | 0 | 0 | 119.5 | ||||
| 204 | E | 35.9 | Very low | 37.2 | Very low | 162 Ų | 162 | 141.4 Ų | 141.4 | 76% | 0.757 | 76% | 0.762 | S | S | * | * | 96.2 | 137.3 | 80.6 | -166.2 | 161.9 | -173.4 | 0 | 0 | 110.3 | |||||
| 205 | A | 37.2 | Very low | 37.4 | Very low | 66 Ų | 66 | 146.9 Ų | 146.9 | 55% | 0.545 | 77% | 0.765 | S | S | . | * | cis | -154.7 | 165.9 | 11.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 206 | L | 41.8 | Very low | 37.5 | Very low | 173 Ų | 173 | 146 Ų | 146 | 91% | 0.906 | 77% | 0.769 | S | S | * | * | trans | 56.8 | 142.5 | 143.8 | -60.8 | 168.4 | 0 | 0 | 0 | 119.9 | ||||
| 207 | A | 38.3 | Very low | 37.8 | Very low | 89 Ų | 89 | 148.3 Ų | 148.3 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | cis | -153.9 | 169.9 | -2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 208 | P | 40.9 | Very low | 38 | Very low | 110 Ų | 110 | 147 Ų | 147 | 71% | 0.714 | 77% | 0.773 | S | S | * | * | trans | -119.6 | 172.4 | -165.6 | 43.3 | -33.6 | 0 | 0 | 0 | 116.8 | ||||
| 209 | L | 33.9 | Very low | 38.4 | Very low | 160 Ų | 160 | 145.5 Ų | 145.5 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | trans | 72 | 159.6 | 160.9 | -66 | 159.9 | 0 | 0 | 0 | 117.9 | ||||
| 210 | P | 46.3 | Very low | 38.7 | Very low | 98 Ų | 98 | 146.5 Ų | 146.5 | 64% | 0.636 | 78% | 0.782 | S | S | * | * | cis | -137.7 | -163.6 | -34.4 | 39.8 | -22 | 0 | 0 | 0 | 113.7 | ||||
| 211 | E | 37.2 | Very low | 38.7 | Very low | 185 Ų | 185 | 142.2 Ų | 142.2 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | 63.8 | 104.9 | 156.7 | -69.7 | 176.7 | -171.9 | 0 | 0 | 120.6 | ||||
| 212 | A | 38.9 | Very low | 38.6 | Very low | 93 Ų | 93 | 146 Ų | 146 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | 178.4 | 121 | 111.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 213 | V | 40.3 | Very low | 38.6 | Very low | 124 Ų | 124 | 146 Ų | 146 | 75% | 0.752 | 79% | 0.792 | S | S | * | * | 45.9 | 83.9 | 129 | -170.7 | 0 | 0 | 0 | 0 | 119 | |||||
| 214 | R | 42 | Very low | 38.4 | Very low | 232 Ų | 232 | 145.5 Ų | 145.5 | 88% | 0.875 | 79% | 0.794 | S | S | * | * | 175 | 152.2 | 105.3 | -100 | 154.7 | -170.3 | -173.7 | 2.5 | 114.4 | |||||
| 215 | Y | 35.3 | Very low | 38.1 | Very low | 235 Ų | 235 | 142.4 Ų | 142.4 | 92% | 0.922 | 80% | 0.796 | S | S | * | * | trans | -85 | 122.7 | 165.5 | -72.8 | -97.5 | 0 | 0 | 0 | 109.2 | ||||
| 216 | D | 36.7 | Very low | 38 | Very low | 164 Ų | 164 | 144.4 Ų | 144.4 | 88% | 0.877 | 81% | 0.813 | S | S | * | * | trans | -140.9 | 157.5 | 153.4 | -120.2 | -44.7 | 0 | 0 | 0 | 110 | ||||
| 217 | R | 38.7 | Very low | 37.6 | Very low | 244 Ų | 244 | 141.3 Ų | 141.3 | 92% | 0.921 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 149.2 | -161.9 | -85.3 | 177.5 | 165.5 | 153.6 | -5.4 | 114.3 | ||
| 218 | A | 35.2 | Very low | 37.2 | Very low | 87 Ų | 87 | 143.1 Ų | 143.1 | 72% | 0.719 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 145.7 | -175 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 219 | P | 42.5 | Very low | 36.8 | Very low | 122 Ų | 122 | 141.4 Ų | 141.4 | 79% | 0.792 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 136.6 | 170.9 | 28.9 | -34.4 | 0 | 0 | 0 | 110.3 | A221 | P219-A221 PolarHBondContact O-N 3.31Š|
| 220 | I | 40.4 | Very low | 37.5 | Very low | 172 Ų | 172 | 145 Ų | 145 | 88% | 0.882 | 82% | 0.818 | S | S | * | * | trans | -71.8 | 115.5 | 174 | -61 | 174.3 | 0 | 0 | 0 | 107.6 | ||||
| 221 | A | 36.3 | Very low | 37.3 | Very low | 90 Ų | 90 | 146.1 Ų | 146.1 | 74% | 0.744 | 83% | 0.825 | S | S | * | * | trans | -66 | 143.5 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | P219 | P219-A221 PolarHBondContact O-N 3.31Š| ||
| 222 | E | 33.8 | Very low | 38 | Very low | 163 Ų | 163 | 145.2 Ų | 145.2 | 76% | 0.762 | 83% | 0.825 | S | S | * | * | trans | -61.1 | 144.5 | 168.9 | -66.4 | -179 | 101.3 | 0 | 0 | 111.2 | L224 | E222-L224 PolarHBondContact O-N 2.85Š| ||
| 223 | P | 39.1 | Very low | 39 | Very low | 134 Ų | 134 | 146.1 Ų | 146.1 | 87% | 0.87 | 81% | 0.812 | S | S | * | * | trans | -73.9 | 77.8 | 173 | 31.6 | -34.8 | 0 | 0 | 0 | 111 | A225 | P223-A225 PolarHBondContact O-N 3.41Å; P223-A225 VanDerWaalsContact O-N 3.16Å | ||
| 224 | L | 36.6 | Very low | 40.3 | Very low | 153 Ų | 153 | 142.8 Ų | 142.8 | 80% | 0.801 | 79% | 0.794 | S | S | * | * | trans | -59.3 | 113.9 | 174.5 | -77.2 | 168.5 | 0 | 0 | 0 | 111.6 | E222 A226 | E222-L224 PolarHBondContact O-N 2.85Å; L224-A226 PolarHBondContact O-N 3.44Å | ||
| 225 | A | 29 | Very low | 41.2 | Very low | 96 Ų | 96 | 138 Ų | 138 | 79% | 0.793 | 78% | 0.782 | S | S | * | * | trans | 26.5 | 75.3 | 155.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | P223 S227 | P223-A225 PolarHBondContact O-N 3.41Å; P223-A225 VanDerWaalsContact O-N 3.16Å; A225-S227 PolarHBondContact O-N 2.92Å | ||
| 226 | A | 34.8 | Very low | 42.5 | Very low | 109 Ų | 109 | 135.6 Ų | 135.6 | 90% | 0.901 | 77% | 0.771 | S | S | * | * | trans | -69.4 | 114.9 | 161.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | L224 | L224-A226 PolarHBondContact O-N 3.44Š| ||
| 227 | S | 32.4 | Very low | 44.1 | Very low | 107 Ų | 107 | 131.4 Ų | 131.4 | 75% | 0.748 | 75% | 0.748 | S | S | * | * | trans | -85.7 | 151.1 | -174.4 | 57.7 | 0 | 0 | 0 | 0 | 113.3 | A225 | A225-S227 PolarHBondContact O-N 2.92Š| ||
| 228 | S | 30.6 | Very low | 45.3 | Very low | 127 Ų | 127 | 124.6 Ų | 124.6 | 89% | 0.888 | 73% | 0.727 | S | S | * | * | trans | 62.1 | 114.2 | 174.4 | 74.3 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 229 | G | 32.8 | Very low | 46.8 | Very low | 75 Ų | 75 | 123.2 Ų | 123.2 | 77% | 0.773 | 71% | 0.709 | S | S | * | * | trans | 177.5 | 150 | 172 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 230 | R | 47.9 | Very low | 48.2 | Very low | 234 Ų | 234 | 120.9 Ų | 120.9 | 88% | 0.883 | 69% | 0.69 | S | S | * | * | trans | -65.2 | 145.4 | 166.8 | -73.9 | 178.9 | 173.6 | 170 | -1.7 | 108.7 | L232 | R230-L232 PolarHBondContact O-N 3.47Š| ||
| 231 | P | 43.3 | Very low | 49.6 | Very low | 122 Ų | 122 | 115.7 Ų | 115.7 | 79% | 0.792 | 66% | 0.662 | S | S | * | * | trans | -56.1 | 119.5 | 171.1 | 24.2 | -33.4 | 0 | 0 | 0 | 109.2 | K233 | P231-K233 PolarHBondContact O-N 2.9Š| ||
| 232 | L | 50.6 | Low | 51.1 | Low | 166 Ų | 166 | 115.1 Ų | 115.1 | 87% | 0.869 | 64% | 0.644 | S | S | * | * | trans | -67.1 | 99.1 | 178.9 | -77 | 165.9 | 0 | 0 | 0 | 108.6 | R230 S234 | R230-L232 PolarHBondContact O-N 3.47Å; L232-S234 PolarHBondContact O-N 3.28Å | ||
| 233 | K | 60.9 | Low | 52.7 | Low | 113 Ų | 113 | 111.4 Ų | 111.4 | 49% | 0.491 | 63% | 0.632 | S | S | . | * | trans | -47.9 | 130.4 | 167.9 | -78.9 | -176.7 | 174.3 | 176.6 | 0 | 108.7 | P231 D237 Q238 E241 | P231-K233 PolarHBondContact O-N 2.9Å; K233-D237 HydrophobicContact CB-CB 4.1Å; K233-Q238 HydrophobicContact CB-CG 4.04Å; K233-Q238 PolarHBondContact O-NE2 3.49Å; K233-E241 IonicContact NZ-OE2 2.62Å; K233-E241 PolarHBondContact NZ-OE2 3.46Å | ||
| 234 | S | 68.3 | Low | 54.3 | Low | 54 Ų | 54 | 112.6 Ų | 112.6 | 38% | 0.378 | 62% | 0.62 | S | S | . | * | trans | -58.2 | 155.3 | -178.7 | 75.4 | 0 | 0 | 0 | 0 | 110.3 | L232 R236 D237 Q238 | L232-S234 PolarHBondContact O-N 3.28Å; S234-R236 PolarHBondContact O-N 3.01Å; S234-R236 VanDerWaalsContact O-N 3.14Å; S234-D237 WeakPolarHBondContact CB-OD2 3.34Å; S234-D237 PolarHBondContact N-OD2 3.42Å; S234-D237 WeakPolarHBondContact O-CB 3.41Å; S234-D237 PolarHBondContact O-N 3.46Å; S234-D237 PolarHBondContact OG-N 3.35Å; S234-D237 VanDerWaalsContact OG-N 3.17Å; S234-D237 PolarHBondContact OG-OD2 2.94Å; S234-Q238 WeakPolarHBondContact O-CG 3.39Å; S234-Q238 PolarHBondContact O-N 2.98Å | ||
| 235 | H | 60.4 | Low | 55.9 | Low | 132 Ų | 132 | 110.8 Ų | 110.8 | 61% | 0.611 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -54 | -37.4 | 177.4 | -178.2 | 69.1 | 0 | 0 | 0 | 111.5 | D237 Q238 V239 | H235-D237 PolarHBondContact O-N 2.98Å; H235-Q238 PolarHBondContact O-N 3.38Å; H235-V239 WeakPolarHBondContact O-CG2 3.33Å; H235-V239 PolarHBondContact O-N 3.01Å |
| 236 | R | 61.5 | Low | 57.6 | Low | 184 Ų | 184 | 109.4 Ų | 109.4 | 69% | 0.694 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -58.4 | -45.2 | 172.8 | -171.7 | 179.3 | -174.7 | -178.7 | 3.9 | 112.6 | S234 L240 | S234-R236 PolarHBondContact O-N 3.01Å; S234-R236 VanDerWaalsContact O-N 3.14Å; R236-L240 HydrophobicContact CG-CD1 4.03Å; R236-L240 VanDerWaalsContact O-CB 3.31Å; R236-L240 WeakPolarHBondContact O-CB 3.2Å; R236-L240 WeakPolarHBondContact O-CG 3.47Å; R236-L240 PolarHBondContact O-N 2.98Å |
| 237 | D | 70.6 | Confident | 59.2 | Low | 75 Ų | 75 | 113 Ų | 113 | 40% | 0.401 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66 | -40.1 | 177.4 | -63.3 | -53.6 | 0 | 0 | 0 | 112.3 | K233 S234 H235 L240 E241 | K233-D237 HydrophobicContact CB-CB 4.1Å; S234-D237 WeakPolarHBondContact CB-OD2 3.34Å; S234-D237 PolarHBondContact N-OD2 3.42Å; S234-D237 WeakPolarHBondContact O-CB 3.41Å; S234-D237 PolarHBondContact O-N 3.46Å; S234-D237 PolarHBondContact OG-N 3.35Å; S234-D237 VanDerWaalsContact OG-N 3.17Å; S234-D237 PolarHBondContact OG-OD2 2.94Å; H235-D237 PolarHBondContact O-N 2.98Å; D237-L240 PolarHBondContact O-N 3.27Å; D237-E241 VanDerWaalsContact O-CB 3.32Å; D237-E241 WeakPolarHBondContact O-CB 3.26Å; D237-E241 PolarHBondContact O-N 3.3Å |
| 238 | Q | 65.3 | Low | 60.9 | Low | 101 Ų | 101 | 111.6 Ų | 111.6 | 47% | 0.472 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.2 | -47.8 | 177.8 | -63.1 | -178.1 | 36 | 0 | 0 | 111 | K233 S234 H235 E241 Q242 | K233-Q238 HydrophobicContact CB-CG 4.04Å; K233-Q238 PolarHBondContact O-NE2 3.49Å; S234-Q238 WeakPolarHBondContact O-CG 3.39Å; S234-Q238 PolarHBondContact O-N 2.98Å; H235-Q238 PolarHBondContact O-N 3.38Å; Q238-E241 PolarHBondContact O-N 3.29Å; Q238-Q242 WeakPolarHBondContact O-CB 3.41Å; Q238-Q242 PolarHBondContact O-N 3.47Å |
| 239 | V | 66.3 | Low | 62.3 | Low | 58 Ų | 58 | 110.4 Ų | 110.4 | 35% | 0.352 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63 | -45.2 | 175.7 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | H235 E241 Q242 V243 | H235-V239 WeakPolarHBondContact O-CG2 3.33Å; H235-V239 PolarHBondContact O-N 3.01Å; V239-E241 VanDerWaalsContact C-N 3.33Å; V239-E241 PolarHBondContact O-N 3Å; V239-Q242 PolarHBondContact O-N 3.3Å; V239-V243 HydrophobicContact CG1-CG2 4.4Å; V239-V243 WeakPolarHBondContact O-CG2 3.4Å; V239-V243 PolarHBondContact O-N 3.13Å |
| 240 | L | 71.2 | Confident | 63.5 | Low | 73 Ų | 73 | 111.1 Ų | 111.1 | 38% | 0.382 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.5 | -36 | 177.2 | -74.2 | 172 | 0 | 0 | 0 | 112.7 | R236 D237 R244 | R236-L240 HydrophobicContact CG-CD1 4.03Å; R236-L240 VanDerWaalsContact O-CB 3.31Å; R236-L240 WeakPolarHBondContact O-CB 3.2Å; R236-L240 WeakPolarHBondContact O-CG 3.47Å; R236-L240 PolarHBondContact O-N 2.98Å; D237-L240 PolarHBondContact O-N 3.27Å; L240-R244 VanDerWaalsContact O-CG 3.26Å; L240-R244 WeakPolarHBondContact O-CG 3.45Å; L240-R244 PolarHBondContact O-N 2.94Å |
| 241 | E | 70.6 | Confident | 64.1 | Low | 63 Ų | 63 | 105.3 Ų | 105.3 | 29% | 0.294 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -71.1 | -36.5 | 174.5 | -163.8 | 179.9 | 124.9 | 0 | 0 | 112 | K233 D237 Q238 V239 R244 K245 | K233-E241 IonicContact NZ-OE2 2.62Å; K233-E241 PolarHBondContact NZ-OE2 3.46Å; D237-E241 VanDerWaalsContact O-CB 3.32Å; D237-E241 WeakPolarHBondContact O-CB 3.26Å; D237-E241 PolarHBondContact O-N 3.3Å; Q238-E241 PolarHBondContact O-N 3.29Å; V239-E241 VanDerWaalsContact C-N 3.33Å; V239-E241 PolarHBondContact O-N 3Å; E241-R244 PolarHBondContact O-N 3.28Å; E241-K245 WeakPolarHBondContact O-CG 3.43Å; E241-K245 PolarHBondContact O-N 3Å; E241-K245 WeakPolarHBondContact OE1-CE 3.4Å; E241-K245 IonicContact OE1-NZ 2.64Å; E241-K245 PolarHBondContact OE1-NZ 3.46Å |
| 242 | Q | 66.3 | Low | 64.7 | Low | 78 Ų | 78 | 101.8 Ų | 101.8 | 36% | 0.364 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.7 | -43.8 | 172.8 | -173.1 | 173.6 | -12.1 | 0 | 0 | 111.7 | Q238 V239 R244 K245 C246 | Q238-Q242 WeakPolarHBondContact O-CB 3.41Å; Q238-Q242 PolarHBondContact O-N 3.47Å; V239-Q242 PolarHBondContact O-N 3.3Å; Q242-R244 VanDerWaalsContact C-N 3.33Å; Q242-R244 PolarHBondContact O-N 3.25Å; Q242-K245 PolarHBondContact O-N 3.35Å; Q242-K245 VanDerWaalsContact O-N 3.13Å; Q242-C246 PolarHBondContact O-N 2.99Å; Q242-C246 PolarHBondContact O-SG 3.45Å; Q242-C246 VanDerWaalsContact O-SG 3.38Å |
| 243 | V | 68.5 | Low | 64.4 | Low | 86 Ų | 86 | 99.4 Ų | 99.4 | 52% | 0.521 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.6 | -41 | 174 | 170.1 | 0 | 0 | 0 | 0 | 111.3 | V239 C246 R247 | V239-V243 HydrophobicContact CG1-CG2 4.4Å; V239-V243 WeakPolarHBondContact O-CG2 3.4Å; V239-V243 PolarHBondContact O-N 3.13Å; V243-C246 PolarHBondContact O-N 3.38Å; V243-R247 WeakPolarHBondContact O-CB 3.35Å; V243-R247 PolarHBondContact O-N 3.19Å |
| 244 | R | 73 | Confident | 63.6 | Low | 159 Ų | 159 | 97.7 Ų | 97.7 | 60% | 0.6 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.4 | -42.6 | 172.7 | -73.6 | 173.7 | -171.7 | 115 | -8.3 | 112.1 | L240 E241 Q242 R247 S248 | L240-R244 VanDerWaalsContact O-CG 3.26Å; L240-R244 WeakPolarHBondContact O-CG 3.45Å; L240-R244 PolarHBondContact O-N 2.94Å; E241-R244 PolarHBondContact O-N 3.28Å; Q242-R244 VanDerWaalsContact C-N 3.33Å; Q242-R244 PolarHBondContact O-N 3.25Å; R244-R247 PolarHBondContact O-N 2.67Å; R244-S248 WeakPolarHBondContact O-CB 3.33Å; R244-S248 PolarHBondContact O-N 2.89Å |
| 245 | K | 70.5 | Confident | 62.6 | Low | 115 Ų | 115 | 99.6 Ų | 99.6 | 50% | 0.5 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64 | -47.4 | 176.5 | -73 | 165.4 | -174.7 | 165.7 | 0 | 111.8 | E241 Q242 R247 S248 I249 | E241-K245 WeakPolarHBondContact O-CG 3.43Å; E241-K245 PolarHBondContact O-N 3Å; E241-K245 WeakPolarHBondContact OE1-CE 3.4Å; E241-K245 IonicContact OE1-NZ 2.64Å; E241-K245 PolarHBondContact OE1-NZ 3.46Å; Q242-K245 PolarHBondContact O-N 3.35Å; Q242-K245 VanDerWaalsContact O-N 3.13Å; K245-R247 PolarHBondContact O-N 3.15Å; K245-S248 WeakPolarHBondContact O-CB 3.47Å; K245-S248 PolarHBondContact O-N 2.99Å; K245-I249 WeakPolarHBondContact O-CG1 3.28Å; K245-I249 PolarHBondContact O-N 3.49Å |
| 246 | C | 64.3 | Low | 61.6 | Low | 66 Ų | 66 | 98.2 Ų | 98.2 | 45% | 0.446 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.1 | -44 | 175.2 | -67.2 | 0 | 0 | 0 | 0 | 112 | Q242 V243 S248 I249 V250 | Q242-C246 PolarHBondContact O-N 2.99Å; Q242-C246 PolarHBondContact O-SG 3.45Å; Q242-C246 VanDerWaalsContact O-SG 3.38Å; V243-C246 PolarHBondContact O-N 3.38Å; C246-S248 VanDerWaalsContact C-N 3.35Å; C246-S248 PolarHBondContact O-N 3.13Å; C246-I249 PolarHBondContact O-N 3.2Å; C246-V250 WeakPolarHBondContact O-CG2 3.46Å; C246-V250 PolarHBondContact O-N 3.17Å |
| 247 | R | 69 | Low | 60.4 | Low | 184 Ų | 184 | 93 Ų | 93 | 69% | 0.694 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.6 | -41.4 | 175.4 | -173 | 173.7 | -178.3 | 163.6 | 1.8 | 112 | V243 R244 K245 V250 Q251 | V243-R247 WeakPolarHBondContact O-CB 3.35Å; V243-R247 PolarHBondContact O-N 3.19Å; R244-R247 PolarHBondContact O-N 2.67Å; K245-R247 PolarHBondContact O-N 3.15Å; R247-V250 PolarHBondContact O-N 2.95Å; R247-Q251 WeakPolarHBondContact O-CB 3.39Å; R247-Q251 PolarHBondContact O-N 3.15Å |
| 248 | S | 66.6 | Low | 58.8 | Low | 78 Ų | 78 | 93.6 Ų | 93.6 | 55% | 0.545 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.7 | -43.3 | 174.8 | -171.9 | 0 | 0 | 0 | 0 | 112.1 | R244 K245 C246 Q251 A252 | R244-S248 WeakPolarHBondContact O-CB 3.33Å; R244-S248 PolarHBondContact O-N 2.89Å; K245-S248 WeakPolarHBondContact O-CB 3.47Å; K245-S248 PolarHBondContact O-N 2.99Å; C246-S248 VanDerWaalsContact C-N 3.35Å; C246-S248 PolarHBondContact O-N 3.13Å; S248-Q251 PolarHBondContact O-N 3.46Å; S248-A252 WeakPolarHBondContact O-CB 3.37Å; S248-A252 PolarHBondContact O-N 2.81Å |
| 249 | I | 61.5 | Low | 57.3 | Low | 103 Ų | 103 | 92.1 Ų | 92.1 | 53% | 0.528 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.5 | -46.5 | 176.5 | -66.4 | 163.4 | 0 | 0 | 0 | 111.1 | K245 C246 Q251 A252 L253 | K245-I249 WeakPolarHBondContact O-CG1 3.28Å; K245-I249 PolarHBondContact O-N 3.49Å; C246-I249 PolarHBondContact O-N 3.2Å; I249-Q251 VanDerWaalsContact C-N 3.29Å; I249-Q251 PolarHBondContact O-N 3.25Å; I249-A252 PolarHBondContact O-N 3.11Å; I249-L253 HydrophobicContact CG2-CD1 3.93Å; I249-L253 HydrophobicContact CG2-CG 4.43Å; I249-L253 WeakPolarHBondContact O-CB 3.34Å; I249-L253 VanDerWaalsContact O-CG 3.28Å; I249-L253 WeakPolarHBondContact O-CG 3.49Å; I249-L253 PolarHBondContact O-N 3.46Å |
| 250 | V | 57.3 | Low | 55.7 | Low | 89 Ų | 89 | 91.5 Ų | 91.5 | 54% | 0.539 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.1 | -38.4 | 175.6 | 172.1 | 0 | 0 | 0 | 0 | 111.3 | C246 R247 L253 T254 | C246-V250 WeakPolarHBondContact O-CG2 3.46Å; C246-V250 PolarHBondContact O-N 3.17Å; R247-V250 PolarHBondContact O-N 2.95Å; V250-L253 PolarHBondContact O-N 3.21Å; V250-T254 WeakPolarHBondContact O-CB 3.5Å; V250-T254 WeakPolarHBondContact O-CG2 3.45Å; V250-T254 PolarHBondContact O-N 2.82Å; V250-T254 PolarHBondContact O-OG1 3.2Å |
| 251 | Q | 60.8 | Low | 54 | Low | 113 Ų | 113 | 92.1 Ų | 92.1 | 53% | 0.528 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -68.3 | -42.1 | 177.2 | -166.9 | 163.6 | -5 | 0 | 0 | 111.5 | R247 S248 I249 T254 T255 | R247-Q251 WeakPolarHBondContact O-CB 3.39Å; R247-Q251 PolarHBondContact O-N 3.15Å; S248-Q251 PolarHBondContact O-N 3.46Å; I249-Q251 VanDerWaalsContact C-N 3.29Å; I249-Q251 PolarHBondContact O-N 3.25Å; Q251-T254 WeakPolarHBondContact CA-OG1 3.43Å; Q251-T254 PolarHBondContact O-N 3.32Å; Q251-T254 PolarHBondContact O-OG1 3.43Å; Q251-T254 VanDerWaalsContact O-OG1 3.07Å; Q251-T255 WeakPolarHBondContact O-CG2 3.49Å; Q251-T255 PolarHBondContact O-N 2.83Å; Q251-T255 PolarHBondContact O-OG1 3.43Å |
| 252 | A | 54.8 | Low | 52.7 | Low | 48 Ų | 48 | 92.2 Ų | 92.2 | 40% | 0.397 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.2 | -41.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S248 I249 T255 T256 | S248-A252 WeakPolarHBondContact O-CB 3.37Å; S248-A252 PolarHBondContact O-N 2.81Å; I249-A252 PolarHBondContact O-N 3.11Å; A252-T255 WeakPolarHBondContact CA-OG1 3.47Å; A252-T255 PolarHBondContact O-OG1 3.06Å; A252-T255 VanDerWaalsContact O-OG1 3.11Å; A252-T256 VanDerWaalsContact O-CB 3.26Å; A252-T256 WeakPolarHBondContact O-CB 3.46Å; A252-T256 PolarHBondContact O-N 3.26Å; A252-T256 PolarHBondContact O-OG1 3.5Å |
| 253 | L | 44 | Very low | 51.4 | Low | 115 Ų | 115 | 96.7 Ų | 96.7 | 60% | 0.602 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.7 | -40.5 | 176.3 | -72.4 | 170.4 | 0 | 0 | 0 | 111.8 | I249 V250 T256 S257 | I249-L253 HydrophobicContact CG2-CD1 3.93Å; I249-L253 HydrophobicContact CG2-CG 4.43Å; I249-L253 WeakPolarHBondContact O-CB 3.34Å; I249-L253 VanDerWaalsContact O-CG 3.28Å; I249-L253 WeakPolarHBondContact O-CG 3.49Å; I249-L253 PolarHBondContact O-N 3.46Å; V250-L253 PolarHBondContact O-N 3.21Å; L253-T256 PolarHBondContact O-N 2.97Å; L253-S257 WeakPolarHBondContact O-CB 3.41Å; L253-S257 PolarHBondContact O-N 3.26Å |
| 254 | T | 45.7 | Very low | 50 | Low | 77 Ų | 77 | 95.1 Ų | 95.1 | 47% | 0.472 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -73.1 | -39.7 | 177.9 | 48.3 | 0 | 0 | 0 | 0 | 112.6 | V250 Q251 T256 S257 A258 | V250-T254 WeakPolarHBondContact O-CB 3.5Å; V250-T254 WeakPolarHBondContact O-CG2 3.45Å; V250-T254 PolarHBondContact O-N 2.82Å; V250-T254 PolarHBondContact O-OG1 3.2Å; Q251-T254 WeakPolarHBondContact CA-OG1 3.43Å; Q251-T254 PolarHBondContact O-N 3.32Å; Q251-T254 PolarHBondContact O-OG1 3.43Å; Q251-T254 VanDerWaalsContact O-OG1 3.07Å; T254-T256 VanDerWaalsContact C-N 3.32Å; T254-T256 PolarHBondContact O-N 2.82Å; T254-S257 WeakPolarHBondContact CA-OG 3.42Å; T254-S257 PolarHBondContact O-N 3.08Å; T254-S257 VanDerWaalsContact O-N 3.15Å; T254-S257 PolarHBondContact O-OG 3.13Å; T254-A258 PolarHBondContact O-N 2.96Å |
| 255 | T | 46.5 | Very low | 48.4 | Very low | 94 Ų | 94 | 93 Ų | 93 | 58% | 0.577 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.3 | -34.9 | 171 | 55 | 0 | 0 | 0 | 0 | 112.1 | Q251 A252 S257 A258 | Q251-T255 WeakPolarHBondContact O-CG2 3.49Å; Q251-T255 PolarHBondContact O-N 2.83Å; Q251-T255 PolarHBondContact O-OG1 3.43Å; A252-T255 WeakPolarHBondContact CA-OG1 3.47Å; A252-T255 PolarHBondContact O-OG1 3.06Å; A252-T255 VanDerWaalsContact O-OG1 3.11Å; T255-S257 VanDerWaalsContact C-N 3.34Å; T255-A258 WeakPolarHBondContact O-CB 3.34Å; T255-A258 PolarHBondContact O-N 3.46Å |
| 256 | T | 39.1 | Very low | 47 | Very low | 104 Ų | 104 | 94.6 Ų | 94.6 | 64% | 0.638 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67.5 | -34.6 | 172.2 | -54.5 | 0 | 0 | 0 | 0 | 111.5 | A252 L253 T254 A258 G259 | A252-T256 VanDerWaalsContact O-CB 3.26Å; A252-T256 WeakPolarHBondContact O-CB 3.46Å; A252-T256 PolarHBondContact O-N 3.26Å; A252-T256 PolarHBondContact O-OG1 3.5Å; L253-T256 PolarHBondContact O-N 2.97Å; T254-T256 VanDerWaalsContact C-N 3.32Å; T254-T256 PolarHBondContact O-N 2.82Å; T256-A258 VanDerWaalsContact C-N 3.28Å; T256-A258 PolarHBondContact O-N 3Å; T256-G259 WeakPolarHBondContact O-CA 3.41Å; T256-G259 PolarHBondContact O-N 3.31Å |
| 257 | S | 37.3 | Very low | 45.8 | Very low | 73 Ų | 73 | 96.9 Ų | 96.9 | 51% | 0.51 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -67.4 | -25.5 | 176.3 | 78.6 | 0 | 0 | 0 | 0 | 113.9 | L253 T254 T255 G259 G260 | L253-S257 WeakPolarHBondContact O-CB 3.41Å; L253-S257 PolarHBondContact O-N 3.26Å; T254-S257 WeakPolarHBondContact CA-OG 3.42Å; T254-S257 PolarHBondContact O-N 3.08Å; T254-S257 VanDerWaalsContact O-N 3.15Å; T254-S257 PolarHBondContact O-OG 3.13Å; T255-S257 VanDerWaalsContact C-N 3.34Å; S257-G259 PolarHBondContact O-N 3.04Å; S257-G260 PolarHBondContact O-N 3.1Å |
| 258 | A | 35.3 | Very low | 44.5 | Very low | 89 Ų | 89 | 95.6 Ų | 95.6 | 74% | 0.736 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -66.1 | -21.7 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T254 T255 T256 G260 | T254-A258 PolarHBondContact O-N 2.96Å; T255-A258 WeakPolarHBondContact O-CB 3.34Å; T255-A258 PolarHBondContact O-N 3.46Å; T256-A258 VanDerWaalsContact C-N 3.28Å; T256-A258 PolarHBondContact O-N 3Å; A258-G260 PolarHBondContact O-N 3.18Å; A258-G260 VanDerWaalsContact O-N 3.13Å |
| 259 | G | 34.9 | Very low | 43.2 | Very low | 70 Ų | 70 | 94.9 Ų | 94.9 | 72% | 0.722 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | 16.2 | 171.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | T256 S257 | T256-G259 WeakPolarHBondContact O-CA 3.41Å; T256-G259 PolarHBondContact O-N 3.31Å; S257-G259 PolarHBondContact O-N 3.04Å |
| 260 | G | 32 | Very low | 42.2 | Very low | 44 Ų | 44 | 93.5 Ų | 93.5 | 45% | 0.454 | 55% | 0.551 | S | S | . | * | trans | 84.1 | 126.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | S257 A258 S262 | S257-G260 PolarHBondContact O-N 3.1Å; A258-G260 PolarHBondContact O-N 3.18Å; A258-G260 VanDerWaalsContact O-N 3.13Å; G260-S262 PolarHBondContact O-N 3.08Å; G260-S262 VanDerWaalsContact O-N 3.13Å | ||
| 261 | L | 36.6 | Very low | 41.2 | Very low | 87 Ų | 87 | 98.9 Ų | 98.9 | 46% | 0.455 | 56% | 0.562 | S | S | . | * | trans | -49.5 | 119.9 | 177.1 | -67.7 | 170.5 | 0 | 0 | 0 | 111.3 | Q265 R266 | L261-Q265 HydrophobicContact CD2-CG 4.21Å; L261-R266 PolarHBondContact O-NE 3.12Å; L261-R266 PolarHBondContact O-NH2 2.9Å | ||
| 262 | S | 43 | Very low | 40.4 | Very low | 65 Ų | 65 | 98.9 Ų | 98.9 | 46% | 0.455 | 56% | 0.56 | S | S | . | * | trans | -59.7 | 155.6 | -173.6 | 82.6 | 0 | 0 | 0 | 0 | 111.7 | G260 A264 Q265 R266 | G260-S262 PolarHBondContact O-N 3.08Å; G260-S262 VanDerWaalsContact O-N 3.13Å; S262-A264 PolarHBondContact O-N 3.33Å; S262-A264 VanDerWaalsContact O-N 3.08Å; S262-Q265 PolarHBondContact O-N 3.12Å; S262-Q265 PolarHBondContact OG-N 3.31Å; S262-R266 PolarHBondContact O-N 3.12Å | ||
| 263 | K | 37.9 | Very low | 39.6 | Very low | 172 Ų | 172 | 103.3 Ų | 103.3 | 75% | 0.748 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -53.5 | -34.9 | -178.1 | -169.3 | 173.6 | -178.9 | 177.8 | 0 | 112.3 | M267 | K263-M267 WeakPolarHBondContact O-CG 3.42Å; K263-M267 PolarHBondContact O-N 3.3Å; K263-M267 VanDerWaalsContact O-N 3.13Å |
| 264 | A | 39.7 | Very low | 39.3 | Very low | 52 Ų | 52 | 107.7 Ų | 107.7 | 43% | 0.43 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.6 | -51.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | S262 R266 M267 F268 | S262-A264 PolarHBondContact O-N 3.33Å; S262-A264 VanDerWaalsContact O-N 3.08Å; A264-R266 VanDerWaalsContact C-N 3.26Å; A264-R266 PolarHBondContact O-N 2.92Å; A264-M267 PolarHBondContact O-N 2.97Å; A264-M267 VanDerWaalsContact O-N 3.1Å; A264-F268 WeakPolarHBondContact O-CD2 3.24Å; A264-F268 PolarHBondContact O-N 3.49Å |
| 265 | Q | 40.6 | Very low | 39 | Very low | 115 Ų | 115 | 107 Ų | 107 | 54% | 0.537 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -62.1 | -35.7 | -178.8 | -162.2 | 169.9 | 2.9 | 0 | 0 | 111.7 | L261 S262 F268 S269 | L261-Q265 HydrophobicContact CD2-CG 4.21Å; S262-Q265 PolarHBondContact O-N 3.12Å; S262-Q265 PolarHBondContact OG-N 3.31Å; Q265-F268 PolarHBondContact O-N 3.36Å; Q265-S269 PolarHBondContact O-N 2.89Å; Q265-S269 PolarHBondContact O-OG 3.43Å |
| 266 | R | 39.6 | Very low | 38.6 | Very low | 149 Ų | 149 | 107.1 Ų | 107.1 | 56% | 0.562 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -64.3 | -42.9 | 173.1 | -134.7 | 177.7 | -62 | -175 | 0.2 | 112.7 | L261 S262 A264 F268 S269 S270 | L261-R266 PolarHBondContact O-NE 3.12Å; L261-R266 PolarHBondContact O-NH2 2.9Å; S262-R266 PolarHBondContact O-N 3.12Å; A264-R266 VanDerWaalsContact C-N 3.26Å; A264-R266 PolarHBondContact O-N 2.92Å; R266-F268 VanDerWaalsContact C-N 3.33Å; R266-F268 PolarHBondContact O-N 3.22Å; R266-S269 PolarHBondContact O-N 3.3Å; R266-S269 PolarHBondContact O-OG 3.33Å; R266-S270 PolarHBondContact O-N 3Å; R266-S270 PolarHBondContact O-OG 3.26Å |
| 267 | M | 40.1 | Very low | 38.7 | Very low | 114 Ų | 114 | 106.2 Ų | 106.2 | 56% | 0.562 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -66.6 | -31.2 | 175.5 | -72.9 | -169.5 | -52.6 | 0 | 0 | 113.2 | K263 A264 | K263-M267 WeakPolarHBondContact O-CG 3.42Å; K263-M267 PolarHBondContact O-N 3.3Å; K263-M267 VanDerWaalsContact O-N 3.13Å; A264-M267 PolarHBondContact O-N 2.97Å; A264-M267 VanDerWaalsContact O-N 3.1Å |
| 268 | F | 41.4 | Very low | 38.6 | Very low | 156 Ų | 156 | 103.7 Ų | 103.7 | 68% | 0.684 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -69.3 | -41 | 175.2 | -89.8 | -77 | 0 | 0 | 0 | 112.6 | A264 Q265 R266 S270 R271 | A264-F268 WeakPolarHBondContact O-CD2 3.24Å; A264-F268 PolarHBondContact O-N 3.49Å; Q265-F268 PolarHBondContact O-N 3.36Å; R266-F268 VanDerWaalsContact C-N 3.33Å; R266-F268 PolarHBondContact O-N 3.22Å; F268-S270 VanDerWaalsContact C-N 3.35Å; F268-S270 PolarHBondContact O-N 3.14Å; F268-R271 PolarHBondContact O-N 3.28Å |
| 269 | S | 39.6 | Very low | 38.8 | Very low | 64 Ų | 64 | 105.5 Ų | 105.5 | 45% | 0.448 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -62.4 | -38.7 | 174.2 | 37.9 | 0 | 0 | 0 | 0 | 112.9 | Q265 R266 R271 K272 | Q265-S269 PolarHBondContact O-N 2.89Å; Q265-S269 PolarHBondContact O-OG 3.43Å; R266-S269 PolarHBondContact O-N 3.3Å; R266-S269 PolarHBondContact O-OG 3.33Å; S269-R271 PolarHBondContact O-N 2.81Å; S269-K272 PolarHBondContact O-N 3.43Å |
| 270 | S | 39.7 | Very low | 39.3 | Very low | 74 Ų | 74 | 111.5 Ų | 111.5 | 52% | 0.517 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.1 | -20.5 | 178.7 | -55.9 | 0 | 0 | 0 | 0 | 114.4 | R266 F268 | R266-S270 PolarHBondContact O-N 3Å; R266-S270 PolarHBondContact O-OG 3.26Å; F268-S270 VanDerWaalsContact C-N 3.35Å; F268-S270 PolarHBondContact O-N 3.14Å |
| 271 | R | 37.5 | Very low | 39.7 | Very low | 201 Ų | 201 | 112.8 Ų | 112.8 | 76% | 0.758 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -82.9 | -34.2 | 176.3 | -68.2 | -173.3 | -177.8 | -161.1 | -0 | 112.9 | F268 S269 R274 | F268-R271 PolarHBondContact O-N 3.28Å; S269-R271 PolarHBondContact O-N 2.81Å; R271-R274 PolarHBondContact O-N 3.23Å |
| 272 | K | 42.5 | Very low | 39.8 | Very low | 114 Ų | 114 | 116 Ų | 116 | 50% | 0.496 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -65.4 | -39.9 | 178.1 | -79.2 | -167.2 | 171.7 | -173.8 | 0 | 112.8 | S269 R274 A275 A276 F297 | S269-K272 PolarHBondContact O-N 3.43Å; K272-R274 PolarHBondContact O-N 3.37Å; K272-A275 PolarHBondContact O-N 3.47Å; K272-A275 VanDerWaalsContact O-N 3.16Å; K272-A276 PolarHBondContact O-N 2.57Å; K272-A276 VanDerWaalsContact O-N 3.14Å; K272-F297 VanDerWaalsContact NZ-CG 3.3Å |
| 273 | L | 38.4 | Very low | 39.5 | Very low | 140 Ų | 140 | 124.1 Ų | 124.1 | 73% | 0.733 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -62.4 | -22.4 | 179.9 | -93.3 | 161.8 | 0 | 0 | 0 | 114.6 | S277 | L273-S277 PolarHBondContact O-OG 3.26Å |
| 274 | R | 37.6 | Very low | 39.2 | Very low | 207 Ų | 207 | 120.9 Ų | 120.9 | 78% | 0.781 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -94.3 | -13.6 | 178.2 | -153.1 | -175.7 | -62 | -175.7 | -1.3 | 113.8 | R271 K272 S277 | R271-R274 PolarHBondContact O-N 3.23Å; K272-R274 PolarHBondContact O-N 3.37Å; R274-S277 PolarHBondContact O-OG 2.78Å |
| 275 | A | 38.9 | Very low | 38.9 | Very low | 64 Ų | 64 | 124.1 Ų | 124.1 | 53% | 0.529 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -88.5 | -39.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | K272 S277 A278 | K272-A275 PolarHBondContact O-N 3.47Å; K272-A275 VanDerWaalsContact O-N 3.16Å; A275-S277 PolarHBondContact O-N 3.24Å; A275-A278 WeakPolarHBondContact O-CB 3.32Å; A275-A278 PolarHBondContact O-N 3.13Å |
| 276 | A | 38.9 | Very low | 38.3 | Very low | 96 Ų | 96 | 122.5 Ų | 122.5 | 79% | 0.793 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -8.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | K272 | K272-A276 PolarHBondContact O-N 2.57Å; K272-A276 VanDerWaalsContact O-N 3.14Å |
| 277 | S | 40.5 | Very low | 37.8 | Very low | 84 Ų | 84 | 119 Ų | 119 | 59% | 0.587 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.3 | 15.4 | 179.4 | 69.3 | 0 | 0 | 0 | 0 | 113.4 | L273 R274 A275 | L273-S277 PolarHBondContact O-OG 3.26Å; R274-S277 PolarHBondContact O-OG 2.78Å; A275-S277 PolarHBondContact O-N 3.24Å |
| 278 | A | 36.5 | Very low | 37.4 | Very low | 21 Ų | 21 | 120.9 Ų | 120.9 | 17% | 0.174 | 69% | 0.69 | C | S | . | * | trans | -94.3 | 126.8 | -172.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A275 W280 A281 | A275-A278 WeakPolarHBondContact O-CB 3.32Å; A275-A278 PolarHBondContact O-N 3.13Å; A278-W280 HydrophobicContact CB-CD2 4.48Å; A278-W280 HydrophobicContact CB-CG 4.5Å; A278-W280 HydrophobicContact CB-CZ2 4.31Å; A278-W280 PolarHBondContact O-N 2.88Å; A278-A281 PolarHBondContact O-N 2.88Å | ||
| 279 | P | 39.8 | Very low | 36.8 | Very low | 126 Ų | 126 | 122.1 Ų | 122.1 | 82% | 0.818 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -71.9 | -2 | -168 | 28.3 | -36.3 | 0 | 0 | 0 | 115.5 | ||
| 280 | W | 45.7 | Very low | 36.3 | Very low | 197 Ų | 197 | 124.2 Ų | 124.2 | 75% | 0.746 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -81.3 | -14.7 | 175.6 | 51.1 | -100.9 | 0 | 0 | 0 | 113.8 | A278 N282 | A278-W280 HydrophobicContact CB-CD2 4.48Å; A278-W280 HydrophobicContact CB-CG 4.5Å; A278-W280 HydrophobicContact CB-CZ2 4.31Å; A278-W280 PolarHBondContact O-N 2.88Å; W280-N282 PolarHBondContact O-N 2.84Å; W280-N282 VanDerWaalsContact O-N 3.09Å |
| 281 | A | 39.4 | Very low | 35.8 | Very low | 71 Ų | 71 | 128 Ų | 128 | 59% | 0.587 | 73% | 0.728 | S | S | * | * | G | 310 helix | trans | -66.7 | -9.4 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | A278 | A278-A281 PolarHBondContact O-N 2.88Š|
| 282 | N | 39.5 | Very low | 35.2 | Very low | 154 Ų | 154 | 123.5 Ų | 123.5 | 82% | 0.824 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -103.5 | 10.7 | -175.4 | -72.6 | -8.6 | 0 | 0 | 0 | 114.6 | W280 A284 | W280-N282 PolarHBondContact O-N 2.84Å; W280-N282 VanDerWaalsContact O-N 3.09Å; N282-A284 PolarHBondContact O-N 3.06Å |
| 283 | R | 36.3 | Very low | 34.4 | Very low | 236 Ų | 236 | 123.7 Ų | 123.7 | 89% | 0.891 | 74% | 0.741 | S | S | * | * | trans | -96.7 | 77.6 | 176.2 | -74.2 | -165.6 | 176.9 | -160.4 | 0.2 | 112.4 | ||||
| 284 | A | 31.2 | Very low | 33.8 | Very low | 103 Ų | 103 | 121.7 Ų | 121.7 | 85% | 0.851 | 73% | 0.734 | S | S | * | * | trans | -96.1 | 95.8 | 165.8 | 0 | 0 | 0 | 0 | 0 | 110 | N282 | N282-A284 PolarHBondContact O-N 3.06Š| ||
| 285 | S | 33.2 | Very low | 33.3 | Very low | 120 Ų | 120 | 117.8 Ų | 117.8 | 84% | 0.839 | 73% | 0.728 | S | S | * | * | trans | -166.5 | 110.5 | 165.6 | -170.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 286 | G | 29.1 | Very low | 32.7 | Very low | 81 Ų | 81 | 120.5 Ų | 120.5 | 84% | 0.835 | 73% | 0.733 | S | S | * | * | trans | 70.7 | 147 | 162.7 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 287 | G | 28.8 | Very low | 32.1 | Very low | 76 Ų | 76 | 122.2 Ų | 122.2 | 78% | 0.784 | 72% | 0.723 | S | S | * | * | trans | 110.7 | 121 | 167.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 288 | D | 30.7 | Very low | 31.4 | Very low | 153 Ų | 153 | 124.4 Ų | 124.4 | 82% | 0.818 | 74% | 0.737 | S | S | * | * | trans | -61 | 154.1 | -177.3 | -55.2 | -72.4 | 0 | 0 | 0 | 116.2 | ||||
| 289 | E | 30 | Very low | 30.9 | Very low | 182 Ų | 182 | 132.3 Ų | 132.3 | 85% | 0.85 | 76% | 0.763 | S | S | * | * | trans | 65.1 | 154.8 | 152.3 | -67.9 | -178.3 | 152.4 | 0 | 0 | 121.2 | ||||
| 290 | S | 29.1 | Very low | 30.2 | Very low | 109 Ų | 109 | 132.6 Ų | 132.6 | 76% | 0.762 | 76% | 0.756 | S | S | * | * | trans | 81.9 | 122.2 | 169.6 | -42.9 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 291 | D | 27.3 | Very low | 29.2 | Very low | 154 Ų | 154 | 129.9 Ų | 129.9 | 82% | 0.824 | 75% | 0.747 | S | S | * | * | trans | 59.2 | 48.3 | 144.8 | -59.9 | -9.3 | 0 | 0 | 0 | 120.6 | C293 | D291-C293 PolarHBondContact O-N 3.09Š| ||
| 292 | S | 26.2 | Very low | 28.6 | Very low | 106 Ų | 106 | 131.2 Ų | 131.2 | 74% | 0.741 | 75% | 0.748 | S | S | * | * | trans | -68.5 | 96.7 | 160 | 65.2 | 0 | 0 | 0 | 0 | 111.5 | V294 | S292-V294 VanDerWaalsContact C-N 3.33Å; S292-V294 PolarHBondContact O-N 3.5Å | ||
| 293 | C | 25.2 | Very low | 28 | Very low | 118 Ų | 118 | 131.1 Ų | 131.1 | 80% | 0.797 | 74% | 0.742 | S | S | * | * | trans | -68.3 | 84.9 | 171.2 | -82.5 | 0 | 0 | 0 | 0 | 111.9 | D291 I295 | D291-C293 PolarHBondContact O-N 3.09Å; C293-I295 PolarHBondContact O-N 2.94Å | ||
| 294 | V | 26.7 | Very low | 27.6 | Very low | 97 Ų | 97 | 122.9 Ų | 122.9 | 59% | 0.588 | 72% | 0.724 | S | S | * | * | trans | -74 | 84.1 | 179.2 | -175.7 | 0 | 0 | 0 | 0 | 110.8 | S292 N296 | S292-V294 VanDerWaalsContact C-N 3.33Å; S292-V294 PolarHBondContact O-N 3.5Å; V294-N296 VanDerWaalsContact C-N 3.27Å; V294-N296 WeakPolarHBondContact CG1-OD1 3.27Å; V294-N296 PolarHBondContact O-N 3.47Å | ||
| 295 | I | 26.6 | Very low | 27.7 | Very low | 126 Ų | 126 | 124 Ų | 124 | 65% | 0.646 | 71% | 0.712 | S | S | * | * | trans | -79.4 | 77.2 | 174 | -44 | 180 | 0 | 0 | 0 | 109.9 | C293 F297 | C293-I295 PolarHBondContact O-N 2.94Å; I295-F297 HydrophobicContact CB-CD2 4.5Å; I295-F297 HydrophobicContact CB-CE2 4.17Å; I295-F297 HydrophobicContact CG2-CD2 3.87Å; I295-F297 HydrophobicContact CG2-CE2 3.33Å; I295-F297 HydrophobicContact CG2-CZ 3.9Å; I295-F297 WeakPolarHBondContact O-CD2 3.36Å; I295-F297 PolarHBondContact O-N 2.9Å | ||
| 296 | N | 26 | Very low | 27.6 | Very low | 121 Ų | 121 | 123.5 Ų | 123.5 | 65% | 0.647 | 70% | 0.7 | S | S | * | * | trans | -63 | 102 | 176.5 | -85.8 | -15.5 | 0 | 0 | 0 | 111.3 | V294 | V294-N296 VanDerWaalsContact C-N 3.27Å; V294-N296 WeakPolarHBondContact CG1-OD1 3.27Å; V294-N296 PolarHBondContact O-N 3.47Å | ||
| 297 | F | 27.3 | Very low | 28 | Very low | 131 Ų | 131 | 126 Ų | 126 | 58% | 0.575 | 69% | 0.694 | S | S | * | * | trans | -94.3 | 123.4 | 168.8 | -77.4 | -82.6 | 0 | 0 | 0 | 110.1 | K272 I295 R299 | K272-F297 VanDerWaalsContact NZ-CG 3.3Å; I295-F297 HydrophobicContact CB-CD2 4.5Å; I295-F297 HydrophobicContact CB-CE2 4.17Å; I295-F297 HydrophobicContact CG2-CD2 3.87Å; I295-F297 HydrophobicContact CG2-CE2 3.33Å; I295-F297 HydrophobicContact CG2-CZ 3.9Å; I295-F297 WeakPolarHBondContact O-CD2 3.36Å; I295-F297 PolarHBondContact O-N 2.9Å; F297-R299 PolarHBondContact O-N 3.17Å | ||
| 298 | C | 24.9 | Very low | 28.6 | Very low | 131 Ų | 131 | 126.4 Ų | 126.4 | 89% | 0.885 | 69% | 0.685 | S | S | * | * | trans | -53.7 | 104.1 | 169.7 | -59 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 299 | R | 25.8 | Very low | 29 | Very low | 187 Ų | 187 | 128.3 Ų | 128.3 | 71% | 0.706 | 69% | 0.686 | S | S | * | * | trans | -97.2 | 96.1 | -177.1 | -165.8 | 168 | -178.6 | -178.3 | 1.3 | 108.7 | F297 Y301 | F297-R299 PolarHBondContact O-N 3.17Å; R299-Y301 VanDerWaalsContact C-N 3.34Å; R299-Y301 HydrophobicContact CB-CD2 4.16Å; R299-Y301 HydrophobicContact CB-CE2 3.96Å; R299-Y301 VanDerWaalsContact CD-CE2 3.46Å; R299-Y301 HydrophobicContact CG-CD2 3.91Å; R299-Y301 HydrophobicContact CG-CE2 3.54Å; R299-Y301 PolarHBondContact NE-OH 2.72Å; R299-Y301 PolarHBondContact NH1-OH 3.19Å; R299-Y301 VanDerWaalsContact O-CD2 3.27Å; R299-Y301 WeakPolarHBondContact O-CD2 3.42Å; R299-Y301 PolarHBondContact O-N 2.62Å | ||
| 300 | L | 24.5 | Very low | 29.4 | Very low | 131 Ų | 131 | 124.2 Ų | 124.2 | 69% | 0.686 | 68% | 0.675 | S | S | * | * | trans | -72.9 | 87.1 | -176.1 | -158.5 | 155.5 | 0 | 0 | 0 | 110 | T302 | L300-T302 HydrophobicContact CD2-CG2 3.99Å; L300-T302 PolarHBondContact O-N 3.06Å | ||
| 301 | Y | 26 | Very low | 30.1 | Very low | 141 Ų | 141 | 124.7 Ų | 124.7 | 55% | 0.553 | 67% | 0.673 | S | S | * | * | trans | -77.1 | 100.9 | -179.6 | -84.5 | -83.4 | 0 | 0 | 0 | 111.5 | R299 H303 | R299-Y301 VanDerWaalsContact C-N 3.34Å; R299-Y301 HydrophobicContact CB-CD2 4.16Å; R299-Y301 HydrophobicContact CB-CE2 3.96Å; R299-Y301 VanDerWaalsContact CD-CE2 3.46Å; R299-Y301 HydrophobicContact CG-CD2 3.91Å; R299-Y301 HydrophobicContact CG-CE2 3.54Å; R299-Y301 PolarHBondContact NE-OH 2.72Å; R299-Y301 PolarHBondContact NH1-OH 3.19Å; R299-Y301 VanDerWaalsContact O-CD2 3.27Å; R299-Y301 WeakPolarHBondContact O-CD2 3.42Å; R299-Y301 PolarHBondContact O-N 2.62Å; Y301-H303 PolarHBondContact O-N 2.64Å; Y301-H303 VanDerWaalsContact O-N 3.12Å | ||
| 302 | T | 26.3 | Very low | 30.8 | Very low | 99 Ų | 99 | 124.6 Ų | 124.6 | 61% | 0.607 | 67% | 0.673 | S | S | * | * | trans | -78.4 | 87 | 166.4 | 52.9 | 0 | 0 | 0 | 0 | 109.9 | L300 A304 | L300-T302 HydrophobicContact CD2-CG2 3.99Å; L300-T302 PolarHBondContact O-N 3.06Å; T302-A304 PolarHBondContact O-N 3.27Å | ||
| 303 | H | 27.3 | Very low | 31.8 | Very low | 152 Ų | 152 | 126.6 Ų | 126.6 | 70% | 0.704 | 68% | 0.676 | S | S | * | * | trans | -75.8 | 95.9 | 174.9 | -140.4 | -85.8 | 0 | 0 | 0 | 110.2 | Y301 Q305 | Y301-H303 PolarHBondContact O-N 2.64Å; Y301-H303 VanDerWaalsContact O-N 3.12Å; H303-Q305 PolarHBondContact O-N 3.2Å | ||
| 304 | A | 27.2 | Very low | 32.7 | Very low | 62 Ų | 62 | 130.4 Ų | 130.4 | 51% | 0.512 | 68% | 0.681 | S | S | . | * | trans | -82.4 | 87.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | T302 | T302-A304 PolarHBondContact O-N 3.27Š| ||
| 305 | Q | 32.5 | Very low | 33.2 | Very low | 127 Ų | 127 | 130 Ų | 130 | 59% | 0.593 | 70% | 0.698 | S | S | * | * | trans | -82.3 | 116.3 | 173.7 | -169.6 | 165.4 | -20.2 | 0 | 0 | 109.4 | H303 D307 | H303-Q305 PolarHBondContact O-N 3.2Å; Q305-D307 WeakPolarHBondContact CG-OD2 3.35Å; Q305-D307 PolarHBondContact NE2-OD2 3.46Å; Q305-D307 PolarHBondContact O-N 3.3Å | ||
| 306 | D | 32.4 | Very low | 33.5 | Very low | 109 Ų | 109 | 127.4 Ų | 127.4 | 58% | 0.583 | 70% | 0.702 | S | S | * | * | trans | -98.3 | 63.2 | -179.1 | -81.6 | -64.4 | 0 | 0 | 0 | 111.6 | S308 K323 | D306-S308 PolarHBondContact O-N 3.01Å; D306-K323 WeakPolarHBondContact OD1-CE 3.33Å; D306-K323 IonicContact OD1-NZ 2.63Å; D306-K323 PolarHBondContact OD1-NZ 3.06Å; D306-K323 IonicContact OD2-NZ 2.93Å; D306-K323 PolarHBondContact OD2-NZ 3.24Å | ||
| 307 | D | 37.2 | Very low | 33.8 | Very low | 134 Ų | 134 | 130.8 Ų | 130.8 | 72% | 0.717 | 71% | 0.713 | S | S | * | * | trans | -78 | 69.1 | 173.2 | -67 | -26.7 | 0 | 0 | 0 | 110.9 | Q305 | Q305-D307 WeakPolarHBondContact CG-OD2 3.35Å; Q305-D307 PolarHBondContact NE2-OD2 3.46Å; Q305-D307 PolarHBondContact O-N 3.3Å | ||
| 308 | S | 41.1 | Very low | 33.9 | Very low | 84 Ų | 84 | 129.6 Ų | 129.6 | 59% | 0.587 | 73% | 0.728 | S | S | * | * | trans | -143.1 | 86.5 | 171.7 | 67.1 | 0 | 0 | 0 | 0 | 112.1 | D306 | D306-S308 PolarHBondContact O-N 3.01Š| ||
| 309 | K | 39.2 | Very low | 34.1 | Very low | 194 Ų | 194 | 129.9 Ų | 129.9 | 84% | 0.843 | 73% | 0.725 | S | S | * | * | trans | -71.8 | 128.8 | 160.7 | -173.9 | -177 | 179.6 | -173.8 | 0 | 108.1 | T311 | K309-T311 PolarHBondContact O-N 3.06Š| ||
| 310 | P | 38.8 | Very low | 34.2 | Very low | 95 Ų | 95 | 123.8 Ų | 123.8 | 62% | 0.617 | 72% | 0.72 | S | S | * | * | trans | -66.1 | 135.2 | 171.9 | 28.2 | -32.9 | 0 | 0 | 0 | 109.9 | ||||
| 311 | T | 43.9 | Very low | 34.3 | Very low | 119 Ų | 119 | 120.6 Ų | 120.6 | 73% | 0.73 | 71% | 0.712 | S | S | * | * | trans | -103.8 | 109 | 160.6 | 47.5 | 0 | 0 | 0 | 0 | 106.6 | K309 D313 | K309-T311 PolarHBondContact O-N 3.06Å; T311-D313 PolarHBondContact O-N 2.96Å; T311-D313 VanDerWaalsContact O-N 3.09Å | ||
| 312 | D | 41.9 | Very low | 34.2 | Very low | 152 Ų | 152 | 118.4 Ų | 118.4 | 81% | 0.813 | 71% | 0.714 | S | S | * | * | trans | -77.3 | 89.3 | 176.5 | -58.4 | -59.5 | 0 | 0 | 0 | 109.1 | ||||
| 313 | D | 47.6 | Very low | 34.3 | Very low | 149 Ų | 149 | 118.5 Ų | 118.5 | 80% | 0.797 | 71% | 0.706 | S | S | * | * | trans | -133.7 | 143.4 | 171.7 | -88.3 | -57.6 | 0 | 0 | 0 | 109.6 | T311 | T311-D313 PolarHBondContact O-N 2.96Å; T311-D313 VanDerWaalsContact O-N 3.09Å | ||
| 314 | E | 43.7 | Very low | 34.2 | Very low | 197 Ų | 197 | 119 Ų | 119 | 92% | 0.921 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -77.9 | 152.5 | -165.6 | -57.7 | -172 | 128 | 0 | 0 | 114.2 | ||
| 315 | G | 36.4 | Very low | 34.2 | Very low | 90 Ų | 90 | 120.8 Ų | 120.8 | 93% | 0.928 | 71% | 0.706 | S | S | * | * | trans | 80.9 | 30.2 | 157.1 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 316 | G | 33.1 | Very low | 33.9 | Very low | 71 Ų | 71 | 119.9 Ų | 119.9 | 73% | 0.732 | 71% | 0.709 | S | S | * | * | trans | -106.6 | 136 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | A318 | G316-A318 PolarHBondContact O-N 2.95Š| ||
| 317 | H | 33.7 | Very low | 33.6 | Very low | 192 Ų | 192 | 119.2 Ų | 119.2 | 89% | 0.889 | 71% | 0.709 | S | S | * | * | trans | -61.8 | 133.4 | 169.9 | -76.6 | -57.4 | 0 | 0 | 0 | 111.5 | V319 | H317-V319 PolarHBondContact O-N 2.97Š| ||
| 318 | A | 27.6 | Very low | 33.1 | Very low | 106 Ų | 106 | 118.8 Ų | 118.8 | 88% | 0.876 | 71% | 0.711 | S | S | * | * | trans | -70.3 | 81.1 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | G316 G320 | G316-A318 PolarHBondContact O-N 2.95Å; A318-G320 PolarHBondContact O-N 2.86Å | ||
| 319 | V | 29.8 | Very low | 32.6 | Very low | 137 Ų | 137 | 120.4 Ų | 120.4 | 83% | 0.83 | 72% | 0.717 | S | S | * | * | trans | -69.7 | 108.9 | 168.9 | -177.8 | 0 | 0 | 0 | 0 | 108.9 | H317 A321 | H317-V319 PolarHBondContact O-N 2.97Å; V319-A321 PolarHBondContact O-N 2.85Å | ||
| 320 | G | 27.1 | Very low | 32 | Very low | 59 Ų | 59 | 113.8 Ų | 113.8 | 61% | 0.608 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 123.9 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | A318 V322 | A318-G320 PolarHBondContact O-N 2.86Å; G320-V322 PolarHBondContact O-N 2.85Å |
| 321 | A | 26.7 | Very low | 31.7 | Very low | 63 Ų | 63 | 112 Ų | 112 | 52% | 0.521 | 69% | 0.694 | S | S | . | * | P | Polyproline II helix | trans | -53.8 | 119.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | V319 | V319-A321 PolarHBondContact O-N 2.85Š|
| 322 | V | 24.9 | Very low | 31.2 | Very low | 95 Ų | 95 | 115.9 Ų | 115.9 | 58% | 0.576 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 119 | 177.1 | 177.6 | 0 | 0 | 0 | 0 | 109.1 | G320 W324 | G320-V322 PolarHBondContact O-N 2.85Å; V322-W324 HydrophobicContact CG1-CD2 4.28Å; V322-W324 HydrophobicContact CG1-CH2 4.36Å; V322-W324 HydrophobicContact CG1-CZ2 4.06Å |
| 323 | K | 27.1 | Very low | 30.8 | Very low | 101 Ų | 101 | 113.8 Ų | 113.8 | 44% | 0.439 | 69% | 0.689 | S | S | . | * | trans | -104.1 | 117.4 | 175.5 | -159.9 | 163.7 | -173.6 | 171.6 | 0 | 109.5 | D306 | D306-K323 WeakPolarHBondContact OD1-CE 3.33Å; D306-K323 IonicContact OD1-NZ 2.63Å; D306-K323 PolarHBondContact OD1-NZ 3.06Å; D306-K323 IonicContact OD2-NZ 2.93Å; D306-K323 PolarHBondContact OD2-NZ 3.24Å | ||
| 324 | W | 26.4 | Very low | 30.1 | Very low | 163 Ų | 163 | 109.8 Ų | 109.8 | 62% | 0.617 | 67% | 0.668 | S | S | * | * | trans | -76.4 | 148.8 | -176.3 | -56.8 | 98.6 | 0 | 0 | 0 | 111.4 | P107 V322 | P107-W324 HydrophobicContact CG-CE3 4.19Å; P107-W324 HydrophobicContact CG-CH2 4.19Å; P107-W324 HydrophobicContact CG-CZ3 3.62Å; V322-W324 HydrophobicContact CG1-CD2 4.28Å; V322-W324 HydrophobicContact CG1-CH2 4.36Å; V322-W324 HydrophobicContact CG1-CZ2 4.06Å | ||
| 325 | V | 26.1 | Very low | 29.5 | Very low | 100 Ų | 100 | 106.3 Ų | 106.3 | 61% | 0.606 | 66% | 0.655 | S | S | * | * | trans | -131 | 99.6 | 175.7 | -177.8 | 0 | 0 | 0 | 0 | 108.4 | V327 | V325-V327 HydrophobicContact CG1-CG2 4.17Å; V325-V327 PolarHBondContact O-N 3.28Å | ||
| 326 | T | 26.7 | Very low | 29.3 | Very low | 108 Ų | 108 | 103.9 Ų | 103.9 | 66% | 0.663 | 63% | 0.626 | S | S | * | * | trans | -74.7 | 120 | 173.8 | -52.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 327 | V | 27.2 | Very low | 29.2 | Very low | 95 Ų | 95 | 106 Ų | 106 | 58% | 0.576 | 62% | 0.617 | S | S | * | * | trans | -109.2 | 91.5 | 174.3 | -176.8 | 0 | 0 | 0 | 0 | 108.8 | V325 V329 | V325-V327 HydrophobicContact CG1-CG2 4.17Å; V325-V327 PolarHBondContact O-N 3.28Å; V327-V329 PolarHBondContact O-N 3.19Å | ||
| 328 | T | 26.7 | Very low | 29.1 | Very low | 124 Ų | 124 | 102.3 Ų | 102.3 | 76% | 0.761 | 60% | 0.603 | S | S | * | * | trans | -73.1 | 107.2 | 169.2 | 26.4 | 0 | 0 | 0 | 0 | 109.8 | G330 | T328-G330 PolarHBondContact O-N 3.42Š| ||
| 329 | V | 29.7 | Very low | 29.2 | Very low | 118 Ų | 118 | 99.5 Ų | 99.5 | 72% | 0.715 | 58% | 0.579 | S | S | * | * | trans | -78.7 | 107.5 | 166.2 | -178.2 | 0 | 0 | 0 | 0 | 107.4 | V327 S331 | V327-V329 PolarHBondContact O-N 3.19Å; V329-S331 PolarHBondContact O-N 3.44Å | ||
| 330 | G | 27.7 | Very low | 29.3 | Very low | 56 Ų | 56 | 100.3 Ų | 100.3 | 58% | 0.577 | 57% | 0.572 | S | S | * | * | trans | -61 | 129.2 | 167.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | T328 | T328-G330 PolarHBondContact O-N 3.42Š| ||
| 331 | S | 30.9 | Very low | 29.6 | Very low | 57 Ų | 57 | 104 Ų | 104 | 40% | 0.399 | 58% | 0.577 | S | S | . | * | trans | 21 | 137.5 | -179.8 | 104.2 | 0 | 0 | 0 | 0 | 120.3 | V329 L333 D334 | V329-S331 PolarHBondContact O-N 3.44Å; S331-L333 PolarHBondContact O-N 3.14Å; S331-L333 VanDerWaalsContact O-N 3.12Å; S331-L333 PolarHBondContact OG-N 3.16Å; S331-L333 VanDerWaalsContact OG-N 3.12Å; S331-D334 WeakPolarHBondContact CB-OD2 3.32Å; S331-D334 PolarHBondContact OG-N 2.85Å; S331-D334 VanDerWaalsContact OG-N 3.08Å; S331-D334 PolarHBondContact OG-OD2 3.01Å | ||
| 332 | F | 33.7 | Very low | 29.9 | Very low | 201 Ų | 201 | 108.1 Ų | 108.1 | 88% | 0.882 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | -7.6 | 166.6 | -95.7 | -96.6 | 0 | 0 | 0 | 113.7 | ||
| 333 | L | 33.9 | Very low | 30.3 | Very low | 107 Ų | 107 | 109.4 Ų | 109.4 | 56% | 0.56 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | -30.8 | -176.6 | -66.4 | 162.4 | 0 | 0 | 0 | 112.6 | S331 L335 A336 H337 | S331-L333 PolarHBondContact O-N 3.14Å; S331-L333 VanDerWaalsContact O-N 3.12Å; S331-L333 PolarHBondContact OG-N 3.16Å; S331-L333 VanDerWaalsContact OG-N 3.12Å; L333-L335 PolarHBondContact O-N 3.48Å; L333-A336 WeakPolarHBondContact O-CB 3.26Å; L333-A336 PolarHBondContact O-N 3.27Å; L333-H337 PolarHBondContact O-N 3.42Å |
| 334 | D | 32.3 | Very low | 30.5 | Very low | 66 Ų | 66 | 108 Ų | 108 | 35% | 0.353 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -59.3 | -30.5 | -179.9 | -73.5 | -73 | 0 | 0 | 0 | 112.7 | S331 A336 | S331-D334 WeakPolarHBondContact CB-OD2 3.32Å; S331-D334 PolarHBondContact OG-N 2.85Å; S331-D334 VanDerWaalsContact OG-N 3.08Å; S331-D334 PolarHBondContact OG-OD2 3.01Å; D334-A336 VanDerWaalsContact C-N 3.31Å; D334-A336 PolarHBondContact O-N 3.05Å |
| 335 | L | 32.5 | Very low | 30.8 | Very low | 123 Ų | 123 | 105.4 Ų | 105.4 | 64% | 0.644 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -75.5 | -18.7 | 176.6 | -148.3 | 77.9 | 0 | 0 | 0 | 113.3 | L333 | L333-L335 PolarHBondContact O-N 3.48Å |
| 336 | A | 31.3 | Very low | 31.1 | Very low | 40 Ų | 40 | 109 Ų | 109 | 33% | 0.331 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -87.5 | -40.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L333 D334 I338 A339 F340 | L333-A336 WeakPolarHBondContact O-CB 3.26Å; L333-A336 PolarHBondContact O-N 3.27Å; D334-A336 VanDerWaalsContact C-N 3.31Å; D334-A336 PolarHBondContact O-N 3.05Å; A336-I338 VanDerWaalsContact C-N 3.3Å; A336-I338 PolarHBondContact O-N 3.23Å; A336-A339 WeakPolarHBondContact O-CB 3.37Å; A336-A339 PolarHBondContact O-N 3.16Å; A336-F340 PolarHBondContact O-N 3.43Å |
| 337 | H | 31.8 | Very low | 31.5 | Very low | 114 Ų | 114 | 107.1 Ų | 107.1 | 53% | 0.528 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -59.7 | -39 | -178.7 | -85.4 | -113.2 | 0 | 0 | 0 | 112.7 | L333 A339 F340 D341 | L333-H337 PolarHBondContact O-N 3.42Å; H337-A339 PolarHBondContact O-N 2.91Å; H337-A339 VanDerWaalsContact O-N 3.17Å; H337-F340 PolarHBondContact O-N 3.07Å; H337-D341 PolarHBondContact O-N 3.36Å |
| 338 | I | 31.6 | Very low | 31.7 | Very low | 116 Ų | 116 | 110.3 Ų | 110.3 | 60% | 0.595 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -60.4 | -25.9 | 175.9 | -60.1 | 172 | 0 | 0 | 0 | 112.3 | A336 | A336-I338 VanDerWaalsContact C-N 3.3Å; A336-I338 PolarHBondContact O-N 3.23Å |
| 339 | A | 30.1 | Very low | 32.5 | Very low | 46 Ų | 46 | 113.4 Ų | 113.4 | 38% | 0.38 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -86.7 | -26.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | A336 H337 | A336-A339 WeakPolarHBondContact O-CB 3.37Å; A336-A339 PolarHBondContact O-N 3.16Å; H337-A339 PolarHBondContact O-N 2.91Å; H337-A339 VanDerWaalsContact O-N 3.17Å |
| 340 | F | 31.6 | Very low | 33 | Very low | 154 Ų | 154 | 115.1 Ų | 115.1 | 68% | 0.675 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -85.9 | -38 | -179.8 | -84.3 | -81.1 | 0 | 0 | 0 | 113.2 | A336 H337 M342 Q343 | A336-F340 PolarHBondContact O-N 3.43Å; H337-F340 PolarHBondContact O-N 3.07Å; F340-M342 VanDerWaalsContact C-N 3.3Å; F340-M342 PolarHBondContact O-N 3.09Å; F340-Q343 WeakPolarHBondContact O-CB 3.49Å; F340-Q343 PolarHBondContact O-N 3.47Å |
| 341 | D | 32.5 | Very low | 33.7 | Very low | 136 Ų | 136 | 119.9 Ų | 119.9 | 73% | 0.727 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -62.1 | -35.7 | -176 | -169.2 | 41.2 | 0 | 0 | 0 | 112.8 | H337 Q343 G344 | H337-D341 PolarHBondContact O-N 3.36Å; D341-Q343 PolarHBondContact O-N 3.03Å; D341-Q343 VanDerWaalsContact O-N 3.15Å; D341-G344 PolarHBondContact O-N 3.19Å |
| 342 | M | 32.9 | Very low | 34 | Very low | 150 Ų | 150 | 122.7 Ų | 122.7 | 74% | 0.739 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -12.9 | 174.5 | -63.4 | -160 | -173.6 | 0 | 0 | 114.3 | F340 | F340-M342 VanDerWaalsContact C-N 3.3Å; F340-M342 PolarHBondContact O-N 3.09Å |
| 343 | Q | 32.9 | Very low | 34.4 | Very low | 123 Ų | 123 | 121.7 Ų | 121.7 | 58% | 0.575 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -14.5 | -179.3 | -160.1 | 164 | 0.5 | 0 | 0 | 113.1 | F340 D341 | F340-Q343 WeakPolarHBondContact O-CB 3.49Å; F340-Q343 PolarHBondContact O-N 3.47Å; D341-Q343 PolarHBondContact O-N 3.03Å; D341-Q343 VanDerWaalsContact O-N 3.15Å |
| 344 | G | 31.9 | Very low | 35.1 | Very low | 71 Ų | 71 | 126.4 Ų | 126.4 | 73% | 0.732 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -79.6 | -12.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | D341 | D341-G344 PolarHBondContact O-N 3.19Š|
| 345 | S | 32.2 | Very low | 36 | Very low | 109 Ų | 109 | 133.4 Ų | 133.4 | 76% | 0.762 | 73% | 0.734 | S | S | * | * | trans | -103.7 | 35.6 | -168.2 | -147.7 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 346 | M | 34 | Very low | 36.2 | Very low | 175 Ų | 175 | 133.9 Ų | 133.9 | 86% | 0.862 | 74% | 0.739 | S | S | * | * | trans | -117.1 | 87.5 | 166 | -72 | -159.7 | -68.1 | 0 | 0 | 110 | ||||
| 347 | G | 33.4 | Very low | 36.4 | Very low | 69 Ų | 69 | 138.8 Ų | 138.8 | 71% | 0.711 | 76% | 0.76 | S | S | * | * | trans | -67.9 | 155.9 | -170.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | K349 | G347-K349 PolarHBondContact O-N 3.3Š| ||
| 348 | N | 32.4 | Very low | 36.7 | Very low | 161 Ų | 161 | 140.2 Ų | 140.2 | 86% | 0.861 | 77% | 0.773 | S | S | * | * | trans | -47.6 | 121.5 | 176 | -76.5 | -26.3 | 0 | 0 | 0 | 112.4 | ||||
| 349 | K | 42.5 | Very low | 37 | Very low | 190 Ų | 190 | 141.6 Ų | 141.6 | 83% | 0.826 | 78% | 0.784 | S | S | * | * | trans | -109.6 | 106 | 156 | -74.2 | -168.7 | 174.5 | -173.2 | 0 | 108.3 | G347 I351 | G347-K349 PolarHBondContact O-N 3.3Å; K349-I351 PolarHBondContact O-N 3.09Å; K349-I351 VanDerWaalsContact O-N 3.11Å | ||
| 350 | N | 40.2 | Very low | 37.4 | Very low | 154 Ų | 154 | 147.6 Ų | 147.6 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | trans | -59.5 | 112.9 | 175.3 | -68.9 | -18.6 | 0 | 0 | 0 | 109.8 | S352 | N350-S352 PolarHBondContact O-N 3.44Š| ||
| 351 | I | 43 | Very low | 37.8 | Very low | 155 Ų | 155 | 147.2 Ų | 147.2 | 80% | 0.795 | 82% | 0.818 | S | S | * | * | trans | -93.5 | 91.8 | 163.8 | -61.1 | 179.1 | 0 | 0 | 0 | 106.5 | K349 | K349-I351 PolarHBondContact O-N 3.09Å; K349-I351 VanDerWaalsContact O-N 3.11Å | ||
| 352 | S | 37.9 | Very low | 38.2 | Very low | 117 Ų | 117 | 148 Ų | 148 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | trans | -85.3 | 108.8 | 169 | -174.4 | 0 | 0 | 0 | 0 | 109 | N350 | N350-S352 PolarHBondContact O-N 3.44Š| ||
| 353 | Q | 41.8 | Very low | 38.6 | Very low | 179 Ų | 179 | 147.8 Ų | 147.8 | 84% | 0.836 | 83% | 0.831 | S | S | * | * | trans | -160.7 | 97.7 | 166.8 | -121.3 | 177.6 | -1.5 | 0 | 0 | 109.8 | ||||
| 354 | K | 48.9 | Very low | 39.1 | Very low | 206 Ų | 206 | 149.9 Ų | 149.9 | 90% | 0.896 | 85% | 0.853 | S | S | * | * | trans | -159 | 55.4 | 169.3 | -142.4 | -179.8 | -174.8 | -175.1 | 0 | 115.8 | ||||
| 355 | T | 50.9 | Low | 39.7 | Very low | 213 Ų | 213 | 157.1 Ų | 157.1 | 100% | 1.307 | 86% | 0.863 | S | S | * | * | trans | -149.8 | 0 | 152.3 | 45.9 | 0 | 0 | 0 | 0 | 107 |
Retrieved 355 of 355 residues in 67.1 ms
(Link to these results)