| 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 | 51.6 | Low | 85.4 | Confident | 243 Ų | 243 | 118.6 Ų | 118.6 | 100% | 1.197 | 60% | 0.6 | S | S | * | * | 0 | 130.8 | 0 | -66.4 | -178.8 | 82.6 | 0 | 0 | 107.9 | |||||
| 2 | A | 72.6 | Confident | 86.2 | Confident | 72 Ų | 72 | 123.9 Ų | 123.9 | 60% | 0.595 | 61% | 0.607 | S | S | * | * | trans | -60.3 | 142.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | V6 | A2-V6 HydrophobicContact CB-CB 4.19Å; A2-V6 HydrophobicContact CB-CG1 4.01Å | ||
| 3 | S | 87.7 | Confident | 86.9 | Confident | 59 Ų | 59 | 119.5 Ų | 119.5 | 41% | 0.413 | 59% | 0.587 | S | S | . | * | trans | -64.1 | 152.8 | 178 | 73.5 | 0 | 0 | 0 | 0 | 110.2 | Q5 V6 Y7 | S3-Q5 PolarHBondContact O-N 2.9Å; S3-V6 WeakPolarHBondContact O-CB 3.11Å; S3-V6 PolarHBondContact O-N 2.87Å; S3-V6 WeakPolarHBondContact OG-CG2 3.27Å; S3-V6 PolarHBondContact OG-N 2.75Å; S3-Y7 PolarHBondContact O-N 3.14Å; S3-Y7 VanDerWaalsContact O-N 3.11Å | ||
| 4 | A | 87.5 | Confident | 87.3 | Confident | 71 Ų | 71 | 115.8 Ų | 115.8 | 59% | 0.587 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -55.2 | -27.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | R8 | A4-R8 VanDerWaalsContact O-CG 3.3Å; A4-R8 WeakPolarHBondContact O-CG 3.45Å; A4-R8 PolarHBondContact O-N 3.21Å; A4-R8 VanDerWaalsContact O-N 3.11Å |
| 5 | Q | 89.3 | Confident | 87.7 | Confident | 157 Ų | 157 | 114.2 Ų | 114.2 | 73% | 0.734 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -68.2 | -44.4 | 173.8 | -68.5 | 177.8 | -17.5 | 0 | 0 | 112.1 | S3 Y7 R8 F9 | S3-Q5 PolarHBondContact O-N 2.9Å; Q5-Y7 VanDerWaalsContact C-N 3.33Å; Q5-Y7 PolarHBondContact O-N 2.86Å; Q5-R8 PolarHBondContact O-N 3.1Å; Q5-F9 WeakPolarHBondContact O-CB 3.24Å; Q5-F9 PolarHBondContact O-N 2.72Å |
| 6 | V | 89.9 | Confident | 88.2 | Confident | 61 Ų | 61 | 114.7 Ų | 114.7 | 37% | 0.37 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -61.7 | -42.6 | 176.2 | 173.1 | 0 | 0 | 0 | 0 | 110.6 | A2 S3 F9 Q10 | A2-V6 HydrophobicContact CB-CB 4.19Å; A2-V6 HydrophobicContact CB-CG1 4.01Å; S3-V6 WeakPolarHBondContact O-CB 3.11Å; S3-V6 PolarHBondContact O-N 2.87Å; S3-V6 WeakPolarHBondContact OG-CG2 3.27Å; S3-V6 PolarHBondContact OG-N 2.75Å; V6-F9 PolarHBondContact O-N 2.86Å; V6-Q10 HydrophobicContact CG1-CG 4.4Å; V6-Q10 WeakPolarHBondContact O-CG 3.26Å; V6-Q10 PolarHBondContact O-N 2.84Å |
| 7 | Y | 90.3 | Very high | 88.6 | Confident | 145 Ų | 145 | 115.4 Ų | 115.4 | 57% | 0.569 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -62 | -46 | 177.1 | -177.6 | -96.7 | 0 | 0 | 0 | 112.4 | S3 Q5 F9 Q10 Q11 | S3-Y7 PolarHBondContact O-N 3.14Å; S3-Y7 VanDerWaalsContact O-N 3.11Å; Q5-Y7 VanDerWaalsContact C-N 3.33Å; Q5-Y7 PolarHBondContact O-N 2.86Å; Y7-F9 VanDerWaalsContact C-N 3.29Å; Y7-F9 PolarHBondContact O-N 2.94Å; Y7-Q10 PolarHBondContact O-N 2.81Å; Y7-Q11 WeakPolarHBondContact O-CB 3.44Å; Y7-Q11 PolarHBondContact O-N 2.7Å |
| 8 | R | 91.1 | Very high | 88.8 | Confident | 166 Ų | 166 | 112.6 Ų | 112.6 | 63% | 0.626 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -61 | -38.5 | 176.1 | -73.5 | 174.6 | -176.5 | -174.9 | 1.7 | 112.1 | A4 Q5 R12 | A4-R8 VanDerWaalsContact O-CG 3.3Å; A4-R8 WeakPolarHBondContact O-CG 3.45Å; A4-R8 PolarHBondContact O-N 3.21Å; A4-R8 VanDerWaalsContact O-N 3.11Å; Q5-R8 PolarHBondContact O-N 3.1Å; R8-R12 WeakPolarHBondContact O-CG 3.29Å; R8-R12 PolarHBondContact O-N 3.39Å; R8-R12 VanDerWaalsContact O-N 3.08Å |
| 9 | F | 94.1 | Very high | 89.1 | Confident | 128 Ų | 128 | 113.2 Ų | 113.2 | 56% | 0.561 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67.1 | -46.3 | 177.2 | -178.3 | -106.6 | 0 | 0 | 0 | 111.8 | Q5 V6 Y7 Q11 R12 I13 | Q5-F9 WeakPolarHBondContact O-CB 3.24Å; Q5-F9 PolarHBondContact O-N 2.72Å; V6-F9 PolarHBondContact O-N 2.86Å; Y7-F9 VanDerWaalsContact C-N 3.29Å; Y7-F9 PolarHBondContact O-N 2.94Å; F9-Q11 VanDerWaalsContact C-N 3.31Å; F9-Q11 PolarHBondContact O-N 2.66Å; F9-R12 PolarHBondContact O-N 2.95Å; F9-R12 VanDerWaalsContact O-N 3.16Å; F9-I13 HydrophobicContact CD1-CD1 3.79Å; F9-I13 HydrophobicContact CE1-CD1 3.22Å; F9-I13 HydrophobicContact CE1-CG1 4.24Å; F9-I13 HydrophobicContact CE2-CD1 4.25Å; F9-I13 HydrophobicContact CZ-CD1 3.49Å; F9-I13 VanDerWaalsContact CZ-CD1 3.49Å; F9-I13 HydrophobicContact CZ-CG1 4.22Å; F9-I13 PolarHBondContact O-N 3.13Å |
| 10 | Q | 92.4 | Very high | 89.4 | Confident | 107 Ų | 107 | 113.9 Ų | 113.9 | 50% | 0.5 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -59 | -42.2 | 175.2 | -73.4 | 173 | -1.4 | 0 | 0 | 111.9 | V6 Y7 R12 I13 S14 | V6-Q10 HydrophobicContact CG1-CG 4.4Å; V6-Q10 WeakPolarHBondContact O-CG 3.26Å; V6-Q10 PolarHBondContact O-N 2.84Å; Y7-Q10 PolarHBondContact O-N 2.81Å; Q10-R12 PolarHBondContact O-N 3.13Å; Q10-I13 PolarHBondContact O-N 2.82Å; Q10-S14 PolarHBondContact O-N 2.82Å |
| 11 | Q | 93.1 | Very high | 89.6 | Confident | 96 Ų | 96 | 114.1 Ų | 114.1 | 45% | 0.449 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62.4 | -41.2 | 176.1 | -171 | 176.9 | 17 | 0 | 0 | 112.1 | Y7 F9 S14 N15 | Y7-Q11 WeakPolarHBondContact O-CB 3.44Å; Y7-Q11 PolarHBondContact O-N 2.7Å; F9-Q11 VanDerWaalsContact C-N 3.31Å; F9-Q11 PolarHBondContact O-N 2.66Å; Q11-S14 PolarHBondContact O-N 2.74Å; Q11-N15 WeakPolarHBondContact O-CB 3.45Å; Q11-N15 VanDerWaalsContact O-CG 3.23Å; Q11-N15 PolarHBondContact O-N 3.11Å; Q11-N15 PolarHBondContact O-OD1 2.73Å |
| 12 | R | 95.1 | Very high | 91.6 | Very high | 182 Ų | 182 | 106.3 Ų | 106.3 | 69% | 0.687 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.4 | -41.9 | 175.9 | -73.8 | 174.7 | -174 | -176.9 | 0.1 | 112.3 | R8 F9 Q10 N15 L16 | R8-R12 WeakPolarHBondContact O-CG 3.29Å; R8-R12 PolarHBondContact O-N 3.39Å; R8-R12 VanDerWaalsContact O-N 3.08Å; F9-R12 PolarHBondContact O-N 2.95Å; F9-R12 VanDerWaalsContact O-N 3.16Å; Q10-R12 PolarHBondContact O-N 3.13Å; R12-N15 PolarHBondContact O-N 2.67Å; R12-L16 WeakPolarHBondContact O-CB 3.27Å; R12-L16 PolarHBondContact O-N 3.11Å |
| 13 | I | 94.6 | Very high | 92.5 | Very high | 66 Ų | 66 | 105 Ų | 105 | 34% | 0.338 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.9 | -48.6 | 176.5 | -70.5 | 176 | 0 | 0 | 0 | 110.5 | F9 Q10 N15 L16 Q17 | F9-I13 HydrophobicContact CD1-CD1 3.79Å; F9-I13 HydrophobicContact CE1-CD1 3.22Å; F9-I13 HydrophobicContact CE1-CG1 4.24Å; F9-I13 HydrophobicContact CE2-CD1 4.25Å; F9-I13 HydrophobicContact CZ-CD1 3.49Å; F9-I13 VanDerWaalsContact CZ-CD1 3.49Å; F9-I13 HydrophobicContact CZ-CG1 4.22Å; F9-I13 PolarHBondContact O-N 3.13Å; Q10-I13 PolarHBondContact O-N 2.82Å; I13-N15 VanDerWaalsContact C-N 3.33Å; I13-N15 PolarHBondContact O-N 2.93Å; I13-L16 PolarHBondContact O-N 3.3Å; I13-L16 VanDerWaalsContact O-N 3.15Å; I13-Q17 HydrophobicContact CG2-CG 4.26Å; I13-Q17 WeakPolarHBondContact O-CB 3.33Å; I13-Q17 WeakPolarHBondContact O-CG 3.25Å; I13-Q17 PolarHBondContact O-N 2.78Å |
| 14 | S | 92.8 | Very high | 92.7 | Very high | 68 Ų | 68 | 104.2 Ų | 104.2 | 48% | 0.476 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58.8 | -45 | 178.8 | 178.5 | 0 | 0 | 0 | 0 | 111.7 | Q10 Q11 L16 Q17 S18 | Q10-S14 PolarHBondContact O-N 2.82Å; Q11-S14 PolarHBondContact O-N 2.74Å; S14-L16 PolarHBondContact O-N 3.07Å; S14-Q17 PolarHBondContact O-N 2.62Å; S14-S18 PolarHBondContact O-N 3.21Å; S14-S18 PolarHBondContact O-OG 2.66Å |
| 15 | N | 93.9 | Very high | 93 | Very high | 92 Ų | 92 | 103.4 Ų | 103.4 | 49% | 0.492 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.9 | -43.4 | 175.7 | -71.7 | -2.9 | 0 | 0 | 0 | 111.8 | Q11 R12 I13 S18 H19 | Q11-N15 WeakPolarHBondContact O-CB 3.45Å; Q11-N15 VanDerWaalsContact O-CG 3.23Å; Q11-N15 PolarHBondContact O-N 3.11Å; Q11-N15 PolarHBondContact O-OD1 2.73Å; R12-N15 PolarHBondContact O-N 2.67Å; I13-N15 VanDerWaalsContact C-N 3.33Å; I13-N15 PolarHBondContact O-N 2.93Å; N15-S18 PolarHBondContact O-N 2.83Å; N15-S18 PolarHBondContact O-OG 2.89Å; N15-H19 WeakPolarHBondContact O-CB 3.4Å; N15-H19 PolarHBondContact O-N 3.49Å |
| 16 | L | 95.2 | Very high | 93 | Very high | 122 Ų | 122 | 100.8 Ų | 100.8 | 64% | 0.639 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.8 | -42 | 178 | -177 | 62.3 | 0 | 0 | 0 | 111.8 | R12 I13 S14 H19 H20 | R12-L16 WeakPolarHBondContact O-CB 3.27Å; R12-L16 PolarHBondContact O-N 3.11Å; I13-L16 PolarHBondContact O-N 3.3Å; I13-L16 VanDerWaalsContact O-N 3.15Å; S14-L16 PolarHBondContact O-N 3.07Å; L16-H19 PolarHBondContact O-N 2.83Å; L16-H20 WeakPolarHBondContact O-CB 3.36Å; L16-H20 PolarHBondContact O-N 2.86Å |
| 17 | Q | 94.4 | Very high | 93.2 | Very high | 127 Ų | 127 | 104.1 Ų | 104.1 | 59% | 0.593 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.7 | -47.3 | 175.8 | -74.6 | 174.9 | -35.3 | 0 | 0 | 111 | I13 S14 H19 H20 E21 | I13-Q17 HydrophobicContact CG2-CG 4.26Å; I13-Q17 WeakPolarHBondContact O-CB 3.33Å; I13-Q17 WeakPolarHBondContact O-CG 3.25Å; I13-Q17 PolarHBondContact O-N 2.78Å; S14-Q17 PolarHBondContact O-N 2.62Å; Q17-H19 VanDerWaalsContact C-N 3.31Å; Q17-H19 PolarHBondContact O-N 2.95Å; Q17-H20 PolarHBondContact O-N 3.07Å; Q17-E21 PolarHBondContact O-N 3.25Å |
| 18 | S | 93 | Very high | 93.3 | Very high | 64 Ų | 64 | 98.2 Ų | 98.2 | 45% | 0.448 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.8 | -38.4 | 177.8 | 72.4 | 0 | 0 | 0 | 0 | 112.7 | S14 N15 L22 | S14-S18 PolarHBondContact O-N 3.21Å; S14-S18 PolarHBondContact O-OG 2.66Å; N15-S18 PolarHBondContact O-N 2.83Å; N15-S18 PolarHBondContact O-OG 2.89Å; S18-L22 WeakPolarHBondContact O-CB 3.27Å; S18-L22 PolarHBondContact O-N 3.21Å |
| 19 | H | 94.4 | Very high | 93.3 | Very high | 125 Ų | 125 | 95.7 Ų | 95.7 | 58% | 0.579 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -68.3 | -40.3 | 175.2 | -173.4 | -82.2 | 0 | 0 | 0 | 112.1 | N15 L16 Q17 L22 A23 | N15-H19 WeakPolarHBondContact O-CB 3.4Å; N15-H19 PolarHBondContact O-N 3.49Å; L16-H19 PolarHBondContact O-N 2.83Å; Q17-H19 VanDerWaalsContact C-N 3.31Å; Q17-H19 PolarHBondContact O-N 2.95Å; H19-L22 PolarHBondContact O-N 3.19Å; H19-A23 WeakPolarHBondContact O-CB 3.5Å; H19-A23 PolarHBondContact O-N 3.2Å |
| 20 | H | 94.5 | Very high | 93.1 | Very high | 127 Ų | 127 | 92.4 Ų | 92.4 | 59% | 0.588 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -62.7 | -45.1 | 175.7 | 178.3 | 67.9 | 0 | 0 | 0 | 111.4 | L16 Q17 L22 A23 S24 | L16-H20 WeakPolarHBondContact O-CB 3.36Å; L16-H20 PolarHBondContact O-N 2.86Å; Q17-H20 PolarHBondContact O-N 3.07Å; H20-L22 PolarHBondContact O-N 3.15Å; H20-A23 PolarHBondContact O-N 2.95Å; H20-S24 PolarHBondContact O-N 2.84Å; H20-S24 PolarHBondContact O-OG 2.85Å; H20-S24 VanDerWaalsContact O-OG 3.06Å |
| 21 | E | 93.4 | Very high | 93.1 | Very high | 119 Ų | 119 | 90.2 Ų | 90.2 | 56% | 0.556 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -59 | -47.8 | 176.1 | -174.8 | 177.7 | -179.6 | 0 | 0 | 111.7 | Q17 A23 S24 I25 | Q17-E21 PolarHBondContact O-N 3.25Å; E21-A23 VanDerWaalsContact C-N 3.35Å; E21-A23 PolarHBondContact O-N 3.01Å; E21-S24 WeakPolarHBondContact O-CB 3.28Å; E21-S24 PolarHBondContact O-N 3.1Å; E21-I25 HydrophobicContact CG-CD1 4.3Å; E21-I25 WeakPolarHBondContact O-CG1 3.49Å; E21-I25 PolarHBondContact O-N 2.89Å |
| 22 | L | 93.7 | Very high | 93.1 | Very high | 78 Ų | 78 | 88.8 Ų | 88.8 | 41% | 0.408 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62.9 | -40.1 | 177.2 | -178 | 61.6 | 0 | 0 | 0 | 112.5 | S18 H19 H20 S24 I25 R26 | S18-L22 WeakPolarHBondContact O-CB 3.27Å; S18-L22 PolarHBondContact O-N 3.21Å; H19-L22 PolarHBondContact O-N 3.19Å; H20-L22 PolarHBondContact O-N 3.15Å; L22-S24 VanDerWaalsContact C-N 3.34Å; L22-I25 PolarHBondContact O-N 3.18Å; L22-R26 VanDerWaalsContact O-CG 3.3Å; L22-R26 WeakPolarHBondContact O-CG 3.46Å; L22-R26 PolarHBondContact O-N 3.18Å |
| 23 | A | 92.1 | Very high | 92.9 | Very high | 45 Ų | 45 | 83.8 Ų | 83.8 | 37% | 0.372 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.4 | -41.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | H19 H20 E21 R26 H27 | H19-A23 WeakPolarHBondContact O-CB 3.5Å; H19-A23 PolarHBondContact O-N 3.2Å; H20-A23 PolarHBondContact O-N 2.95Å; E21-A23 VanDerWaalsContact C-N 3.35Å; E21-A23 PolarHBondContact O-N 3.01Å; A23-R26 PolarHBondContact O-N 3.25Å; A23-H27 WeakPolarHBondContact O-CB 3.47Å; A23-H27 PolarHBondContact O-N 2.85Å |
| 24 | S | 92.7 | Very high | 92.8 | Very high | 43 Ų | 43 | 87.9 Ų | 87.9 | 30% | 0.301 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.5 | -45.6 | 176.3 | -64.3 | 0 | 0 | 0 | 0 | 111.7 | H20 E21 L22 R26 H27 C28 | H20-S24 PolarHBondContact O-N 2.84Å; H20-S24 PolarHBondContact O-OG 2.85Å; H20-S24 VanDerWaalsContact O-OG 3.06Å; E21-S24 WeakPolarHBondContact O-CB 3.28Å; E21-S24 PolarHBondContact O-N 3.1Å; L22-S24 VanDerWaalsContact C-N 3.34Å; S24-R26 PolarHBondContact O-N 3.12Å; S24-H27 PolarHBondContact O-N 2.92Å; S24-C28 PolarHBondContact O-N 3.43Å; S24-C28 PolarHBondContact O-SG 3.13Å |
| 25 | I | 93.5 | Very high | 92.7 | Very high | 53 Ų | 53 | 88.7 Ų | 88.7 | 27% | 0.272 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -59 | -46.8 | 176.2 | -67.1 | 166 | 0 | 0 | 0 | 111 | E21 L22 H27 C28 E29 F341 | E21-I25 HydrophobicContact CG-CD1 4.3Å; E21-I25 WeakPolarHBondContact O-CG1 3.49Å; E21-I25 PolarHBondContact O-N 2.89Å; L22-I25 PolarHBondContact O-N 3.18Å; I25-H27 VanDerWaalsContact C-N 3.34Å; I25-H27 PolarHBondContact O-N 2.88Å; I25-C28 WeakPolarHBondContact O-CB 3.47Å; I25-C28 PolarHBondContact O-N 3.48Å; I25-E29 PolarHBondContact O-N 2.95Å; I25-F341 HydrophobicContact CG1-CD1 4.37Å; I25-F341 HydrophobicContact CG1-CE1 4.46Å; I25-F341 HydrophobicContact CG2-CD1 4.39Å; I25-F341 HydrophobicContact CG2-CE1 4.27Å |
| 26 | R | 89.3 | Confident | 92.4 | Very high | 102 Ų | 102 | 87 Ų | 87 | 39% | 0.385 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.1 | -40.6 | 178.7 | -71.6 | 172.8 | 179.6 | -167.7 | -1.7 | 112.4 | L22 A23 S24 E29 A30 | L22-R26 VanDerWaalsContact O-CG 3.3Å; L22-R26 WeakPolarHBondContact O-CG 3.46Å; L22-R26 PolarHBondContact O-N 3.18Å; A23-R26 PolarHBondContact O-N 3.25Å; S24-R26 PolarHBondContact O-N 3.12Å; R26-E29 PolarHBondContact O-N 3.34Å; R26-A30 WeakPolarHBondContact O-CB 3.47Å; R26-A30 PolarHBondContact O-N 3.35Å |
| 27 | H | 92.9 | Very high | 92.3 | Very high | 132 Ų | 132 | 87.8 Ų | 87.8 | 61% | 0.611 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -62.8 | -44.3 | 176 | -178.7 | -90.2 | 0 | 0 | 0 | 110.9 | A23 S24 I25 E29 A30 V31 | A23-H27 WeakPolarHBondContact O-CB 3.47Å; A23-H27 PolarHBondContact O-N 2.85Å; S24-H27 PolarHBondContact O-N 2.92Å; I25-H27 VanDerWaalsContact C-N 3.34Å; I25-H27 PolarHBondContact O-N 2.88Å; H27-E29 PolarHBondContact O-N 2.79Å; H27-A30 PolarHBondContact O-N 3.01Å; H27-V31 WeakPolarHBondContact O-CG2 3.48Å; H27-V31 PolarHBondContact O-N 2.9Å |
| 28 | C | 93.3 | Very high | 92.1 | Very high | 20 Ų | 20 | 84.8 Ų | 84.8 | 14% | 0.135 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -58.6 | -46.7 | 175.1 | -67.2 | 0 | 0 | 0 | 0 | 113 | S24 I25 A30 V31 S32 F341 C346 | S24-C28 PolarHBondContact O-N 3.43Å; S24-C28 PolarHBondContact O-SG 3.13Å; I25-C28 WeakPolarHBondContact O-CB 3.47Å; I25-C28 PolarHBondContact O-N 3.48Å; C28-A30 VanDerWaalsContact C-N 3.34Å; C28-A30 PolarHBondContact O-N 3.36Å; C28-V31 PolarHBondContact O-N 2.91Å; C28-S32 WeakPolarHBondContact O-CB 3.36Å; C28-S32 PolarHBondContact O-N 2.97Å; C28-F341 HydrophobicContact CB-CE1 4.43Å; C28-F341 HydrophobicContact CB-CZ 4.19Å; C28-C346 HydrophobicContact CB-CB 3.99Å; C28-C346 WeakPolarHBondContact CB-SG 3.28Å; C28-C346 WeakPolarHBondContact SG-CB 3.47Å; C28-C346 CovalentContact SG-SG 2.01Å; C28-C346 PolarHBondContact SG-SG 3.11Å |
| 29 | E | 91.5 | Very high | 92 | Very high | 113 Ų | 113 | 85.8 Ų | 85.8 | 53% | 0.528 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.6 | -43.9 | 178.8 | -172.4 | -177.6 | 174.8 | 0 | 0 | 111.1 | I25 R26 H27 V31 S32 N33 | I25-E29 PolarHBondContact O-N 2.95Å; R26-E29 PolarHBondContact O-N 3.34Å; H27-E29 PolarHBondContact O-N 2.79Å; E29-V31 PolarHBondContact O-N 3.07Å; E29-S32 PolarHBondContact O-N 2.91Å; E29-N33 WeakPolarHBondContact O-CB 3.46Å; E29-N33 VanDerWaalsContact O-CG 3.25Å; E29-N33 PolarHBondContact O-N 2.89Å; E29-N33 PolarHBondContact O-ND2 3.46Å |
| 30 | A | 89.4 | Confident | 91.8 | Very high | 59 Ų | 59 | 85 Ų | 85 | 49% | 0.488 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.3 | -43.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | R26 H27 C28 N33 Y34 | R26-A30 WeakPolarHBondContact O-CB 3.47Å; R26-A30 PolarHBondContact O-N 3.35Å; H27-A30 PolarHBondContact O-N 3.01Å; C28-A30 VanDerWaalsContact C-N 3.34Å; C28-A30 PolarHBondContact O-N 3.36Å; A30-N33 PolarHBondContact O-N 2.9Å; A30-Y34 WeakPolarHBondContact O-CB 3.3Å; A30-Y34 PolarHBondContact O-N 3.5Å |
| 31 | V | 93 | Very high | 91.7 | Very high | 61 Ų | 61 | 84.5 Ų | 84.5 | 37% | 0.37 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.5 | -45.7 | 177 | 170.7 | 0 | 0 | 0 | 0 | 111.1 | H27 C28 E29 N33 Y34 I35 | H27-V31 WeakPolarHBondContact O-CG2 3.48Å; H27-V31 PolarHBondContact O-N 2.9Å; C28-V31 PolarHBondContact O-N 2.91Å; E29-V31 PolarHBondContact O-N 3.07Å; V31-N33 VanDerWaalsContact C-N 3.34Å; V31-N33 PolarHBondContact O-N 2.96Å; V31-Y34 PolarHBondContact O-N 3.09Å; V31-I35 HydrophobicContact CG1-CD1 3.74Å; V31-I35 HydrophobicContact CG1-CG1 4.42Å; V31-I35 VanDerWaalsContact O-CG1 3.3Å; V31-I35 WeakPolarHBondContact O-CG1 3.1Å; V31-I35 PolarHBondContact O-N 3.4Å |
| 32 | S | 92.3 | Very high | 91.6 | Very high | 66 Ų | 66 | 82.8 Ų | 82.8 | 46% | 0.462 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.2 | -42.8 | 177.9 | -175.3 | 0 | 0 | 0 | 0 | 112.1 | C28 E29 I35 S36 | C28-S32 WeakPolarHBondContact O-CB 3.36Å; C28-S32 PolarHBondContact O-N 2.97Å; E29-S32 PolarHBondContact O-N 2.91Å; S32-I35 PolarHBondContact O-N 3.42Å; S32-S36 WeakPolarHBondContact O-CB 3.4Å; S32-S36 PolarHBondContact O-N 3.24Å; S32-S36 PolarHBondContact O-OG 3.44Å |
| 33 | N | 91.2 | Very high | 91.5 | Very high | 77 Ų | 77 | 84.9 Ų | 84.9 | 41% | 0.412 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.8 | -43.7 | 175.6 | -75.5 | -22.6 | 0 | 0 | 0 | 111.6 | E29 A30 V31 S36 Q37 | E29-N33 WeakPolarHBondContact O-CB 3.46Å; E29-N33 VanDerWaalsContact O-CG 3.25Å; E29-N33 PolarHBondContact O-N 2.89Å; E29-N33 PolarHBondContact O-ND2 3.46Å; A30-N33 PolarHBondContact O-N 2.9Å; V31-N33 VanDerWaalsContact C-N 3.34Å; V31-N33 PolarHBondContact O-N 2.96Å; N33-S36 PolarHBondContact O-N 2.82Å; N33-Q37 WeakPolarHBondContact O-CB 3.35Å; N33-Q37 VanDerWaalsContact O-CG 3.28Å; N33-Q37 WeakPolarHBondContact O-CG 3.47Å; N33-Q37 PolarHBondContact O-N 3.36Å |
| 34 | Y | 92.4 | Very high | 91.3 | Very high | 152 Ų | 152 | 86.6 Ų | 86.6 | 60% | 0.596 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -61.1 | -47.3 | 176.5 | 177.5 | -97.4 | 0 | 0 | 0 | 112 | A30 V31 S36 Q37 N38 | A30-Y34 WeakPolarHBondContact O-CB 3.3Å; A30-Y34 PolarHBondContact O-N 3.5Å; V31-Y34 PolarHBondContact O-N 3.09Å; Y34-S36 VanDerWaalsContact C-N 3.33Å; Y34-S36 PolarHBondContact O-N 3.39Å; Y34-Q37 PolarHBondContact O-N 3.02Å; Y34-N38 VanDerWaalsContact O-CB 3.3Å; Y34-N38 WeakPolarHBondContact O-CB 3.35Å; Y34-N38 PolarHBondContact O-N 3.17Å |
| 35 | I | 90.2 | Very high | 91.2 | Very high | 85 Ų | 85 | 88.4 Ų | 88.4 | 44% | 0.436 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -59.9 | -45.5 | 177.2 | -68.8 | 167.4 | 0 | 0 | 0 | 110.4 | V31 S32 N38 N39 | V31-I35 HydrophobicContact CG1-CD1 3.74Å; V31-I35 HydrophobicContact CG1-CG1 4.42Å; V31-I35 VanDerWaalsContact O-CG1 3.3Å; V31-I35 WeakPolarHBondContact O-CG1 3.1Å; V31-I35 PolarHBondContact O-N 3.4Å; S32-I35 PolarHBondContact O-N 3.42Å; I35-N38 PolarHBondContact O-N 3.4Å; I35-N39 WeakPolarHBondContact O-CB 3.44Å; I35-N39 PolarHBondContact O-N 2.9Å; I35-N39 PolarHBondContact O-ND2 2.83Å |
| 36 | S | 89.2 | Confident | 91 | Very high | 58 Ų | 58 | 90.1 Ų | 90.1 | 41% | 0.406 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.1 | -46.4 | 179.9 | -61.1 | 0 | 0 | 0 | 0 | 111.9 | S32 N33 Y34 N38 N39 E40 | S32-S36 WeakPolarHBondContact O-CB 3.4Å; S32-S36 PolarHBondContact O-N 3.24Å; S32-S36 PolarHBondContact O-OG 3.44Å; N33-S36 PolarHBondContact O-N 2.82Å; Y34-S36 VanDerWaalsContact C-N 3.33Å; Y34-S36 PolarHBondContact O-N 3.39Å; S36-N38 PolarHBondContact O-N 3.12Å; S36-N39 PolarHBondContact O-N 2.95Å; S36-E40 WeakPolarHBondContact O-CG 3.3Å; S36-E40 PolarHBondContact O-N 2.94Å |
| 37 | Q | 91.4 | Very high | 90.9 | Very high | 137 Ų | 137 | 88.2 Ų | 88.2 | 64% | 0.64 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -63.4 | -41.4 | 177.2 | -73.4 | 177 | 8.1 | 0 | 0 | 112.2 | N33 Y34 E40 L41 | N33-Q37 WeakPolarHBondContact O-CB 3.35Å; N33-Q37 VanDerWaalsContact O-CG 3.28Å; N33-Q37 WeakPolarHBondContact O-CG 3.47Å; N33-Q37 PolarHBondContact O-N 3.36Å; Y34-Q37 PolarHBondContact O-N 3.02Å; Q37-E40 PolarHBondContact O-N 2.76Å; Q37-L41 WeakPolarHBondContact O-CB 3.02Å; Q37-L41 PolarHBondContact O-N 3.39Å |
| 38 | N | 91 | Very high | 90.4 | Very high | 64 Ų | 64 | 88.8 Ų | 88.8 | 34% | 0.342 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 177 | -166.5 | -25.6 | 0 | 0 | 0 | 111 | Y34 I35 S36 E40 L41 M42 | Y34-N38 VanDerWaalsContact O-CB 3.3Å; Y34-N38 WeakPolarHBondContact O-CB 3.35Å; Y34-N38 PolarHBondContact O-N 3.17Å; I35-N38 PolarHBondContact O-N 3.4Å; S36-N38 PolarHBondContact O-N 3.12Å; N38-E40 PolarHBondContact O-N 3.37Å; N38-L41 WeakPolarHBondContact O-CB 3.28Å; N38-L41 PolarHBondContact O-N 2.91Å; N38-M42 WeakPolarHBondContact O-CB 3.5Å; N38-M42 WeakPolarHBondContact O-CG 3.42Å; N38-M42 PolarHBondContact O-N 2.87Å |
| 39 | N | 90.9 | Very high | 89.9 | Confident | 85 Ų | 85 | 93.9 Ų | 93.9 | 46% | 0.455 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.8 | -42.2 | 175.3 | -78.2 | -26 | 0 | 0 | 0 | 112.6 | I35 S36 M42 K43 | I35-N39 WeakPolarHBondContact O-CB 3.44Å; I35-N39 PolarHBondContact O-N 2.9Å; I35-N39 PolarHBondContact O-ND2 2.83Å; S36-N39 PolarHBondContact O-N 2.95Å; N39-M42 PolarHBondContact O-N 3.49Å; N39-K43 WeakPolarHBondContact O-CB 3.4Å; N39-K43 VanDerWaalsContact O-CG 3.28Å; N39-K43 WeakPolarHBondContact O-CG 2.94Å; N39-K43 PolarHBondContact O-N 3.42Å |
| 40 | E | 90.6 | Very high | 89.5 | Confident | 109 Ų | 109 | 96.1 Ų | 96.1 | 51% | 0.509 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.3 | -39.5 | 175.7 | -71.4 | -54.6 | 126 | 0 | 0 | 112.3 | S36 Q37 N38 K43 S44 | S36-E40 WeakPolarHBondContact O-CG 3.3Å; S36-E40 PolarHBondContact O-N 2.94Å; Q37-E40 PolarHBondContact O-N 2.76Å; N38-E40 PolarHBondContact O-N 3.37Å; E40-K43 PolarHBondContact O-N 2.99Å; E40-K43 IonicContact OE1-NZ 2.76Å; E40-K43 PolarHBondContact OE1-NZ 3.34Å; E40-S44 WeakPolarHBondContact O-CB 3.39Å; E40-S44 PolarHBondContact O-N 2.85Å |
| 41 | L | 92 | Very high | 88.8 | Confident | 116 Ų | 116 | 95.6 Ų | 95.6 | 61% | 0.607 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.7 | -47 | 173.1 | -174.5 | 108.4 | 0 | 0 | 0 | 111.2 | Q37 N38 K43 S44 L45 | Q37-L41 WeakPolarHBondContact O-CB 3.02Å; Q37-L41 PolarHBondContact O-N 3.39Å; N38-L41 WeakPolarHBondContact O-CB 3.28Å; N38-L41 PolarHBondContact O-N 2.91Å; L41-K43 PolarHBondContact O-N 3.37Å; L41-S44 WeakPolarHBondContact O-CB 3.46Å; L41-S44 PolarHBondContact O-N 3.49Å; L41-L45 WeakPolarHBondContact O-CB 3.34Å; L41-L45 PolarHBondContact O-N 3.23Å |
| 42 | M | 91.2 | Very high | 87.7 | Confident | 83 Ų | 83 | 97.1 Ų | 97.1 | 41% | 0.409 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.2 | -40.4 | 178.5 | -72.8 | -57.7 | -62.9 | 0 | 0 | 112.1 | N38 N39 L45 L46 | N38-M42 WeakPolarHBondContact O-CB 3.5Å; N38-M42 WeakPolarHBondContact O-CG 3.42Å; N38-M42 PolarHBondContact O-N 2.87Å; N39-M42 PolarHBondContact O-N 3.49Å; M42-L45 PolarHBondContact O-N 2.93Å; M42-L45 HydrophobicContact SD-CD2 4.42Å; M42-L46 WeakPolarHBondContact O-CB 3.33Å; M42-L46 VanDerWaalsContact O-CG 3.27Å; M42-L46 WeakPolarHBondContact O-CG 3.42Å; M42-L46 PolarHBondContact O-N 2.79Å |
| 43 | K | 91 | Very high | 86.4 | Confident | 123 Ų | 123 | 101.8 Ų | 101.8 | 54% | 0.535 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.1 | -43.8 | 172.8 | -74.4 | 174.1 | -168.3 | 168.5 | 0 | 111.8 | N39 E40 L41 L46 A47 | N39-K43 WeakPolarHBondContact O-CB 3.4Å; N39-K43 VanDerWaalsContact O-CG 3.28Å; N39-K43 WeakPolarHBondContact O-CG 2.94Å; N39-K43 PolarHBondContact O-N 3.42Å; E40-K43 PolarHBondContact O-N 2.99Å; E40-K43 IonicContact OE1-NZ 2.76Å; E40-K43 PolarHBondContact OE1-NZ 3.34Å; L41-K43 PolarHBondContact O-N 3.37Å; K43-L46 PolarHBondContact O-N 3.36Å; K43-A47 WeakPolarHBondContact O-CB 3.28Å; K43-A47 PolarHBondContact O-N 2.91Å |
| 44 | S | 89.4 | Confident | 84.9 | Confident | 80 Ų | 80 | 106.7 Ų | 106.7 | 56% | 0.559 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.9 | -45.1 | 177.2 | -177 | 0 | 0 | 0 | 0 | 111.5 | E40 L41 A47 H48 | E40-S44 WeakPolarHBondContact O-CB 3.39Å; E40-S44 PolarHBondContact O-N 2.85Å; L41-S44 WeakPolarHBondContact O-CB 3.46Å; L41-S44 PolarHBondContact O-N 3.49Å; S44-A47 PolarHBondContact O-N 3.29Å; S44-H48 WeakPolarHBondContact O-CB 3.43Å; S44-H48 PolarHBondContact O-N 3.16Å |
| 45 | L | 90.9 | Very high | 83 | Confident | 82 Ų | 82 | 103.6 Ų | 103.6 | 43% | 0.429 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -60.7 | -46.9 | 175.4 | -177.1 | 66.9 | 0 | 0 | 0 | 111.4 | L41 M42 A47 H48 L49 | L41-L45 WeakPolarHBondContact O-CB 3.34Å; L41-L45 PolarHBondContact O-N 3.23Å; M42-L45 PolarHBondContact O-N 2.93Å; M42-L45 HydrophobicContact SD-CD2 4.42Å; L45-A47 VanDerWaalsContact C-N 3.32Å; L45-A47 PolarHBondContact O-N 2.85Å; L45-H48 WeakPolarHBondContact O-CB 2.86Å; L45-H48 PolarHBondContact O-N 2.89Å; L45-L49 HydrophobicContact CG-CD1 4.15Å; L45-L49 WeakPolarHBondContact O-CG 3.38Å; L45-L49 PolarHBondContact O-N 2.93Å |
| 46 | L | 88.2 | Confident | 81.4 | Confident | 89 Ų | 89 | 106.1 Ų | 106.1 | 47% | 0.466 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -62.4 | -38.9 | 176.6 | -74.6 | 169.8 | 0 | 0 | 0 | 112.1 | M42 K43 H48 L49 K50 | M42-L46 WeakPolarHBondContact O-CB 3.33Å; M42-L46 VanDerWaalsContact O-CG 3.27Å; M42-L46 WeakPolarHBondContact O-CG 3.42Å; M42-L46 PolarHBondContact O-N 2.79Å; K43-L46 PolarHBondContact O-N 3.36Å; L46-H48 VanDerWaalsContact C-N 3.34Å; L46-L49 PolarHBondContact O-N 2.93Å; L46-K50 VanDerWaalsContact O-CB 3.26Å; L46-K50 WeakPolarHBondContact O-CB 3.4Å; L46-K50 VanDerWaalsContact O-CG 3.24Å; L46-K50 WeakPolarHBondContact O-CG 3.28Å; L46-K50 PolarHBondContact O-N 3.44Å |
| 47 | A | 86.4 | Confident | 80 | Confident | 62 Ų | 62 | 111.9 Ų | 111.9 | 51% | 0.512 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.4 | -38.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | K43 S44 L45 K50 A51 | K43-A47 WeakPolarHBondContact O-CB 3.28Å; K43-A47 PolarHBondContact O-N 2.91Å; S44-A47 PolarHBondContact O-N 3.29Å; L45-A47 VanDerWaalsContact C-N 3.32Å; L45-A47 PolarHBondContact O-N 2.85Å; A47-K50 PolarHBondContact O-N 3.35Å; A47-A51 PolarHBondContact O-N 3.44Å |
| 48 | H | 82.8 | Confident | 78.3 | Confident | 144 Ų | 144 | 116.2 Ų | 116.2 | 67% | 0.667 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -67.3 | -42.4 | 175.8 | -169.6 | 73.8 | 0 | 0 | 0 | 112.1 | S44 L45 L46 A51 | S44-H48 WeakPolarHBondContact O-CB 3.43Å; S44-H48 PolarHBondContact O-N 3.16Å; L45-H48 WeakPolarHBondContact O-CB 2.86Å; L45-H48 PolarHBondContact O-N 2.89Å; L46-H48 VanDerWaalsContact C-N 3.34Å; H48-A51 VanDerWaalsContact O-CB 3.27Å; H48-A51 WeakPolarHBondContact O-CB 3.29Å; H48-A51 PolarHBondContact O-N 2.92Å |
| 49 | L | 83.5 | Confident | 76.6 | Confident | 126 Ų | 126 | 119.4 Ų | 119.4 | 66% | 0.66 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -70 | -32 | 176.3 | -67.4 | 172.8 | 0 | 0 | 0 | 112.8 | L45 L46 A51 | L45-L49 HydrophobicContact CG-CD1 4.15Å; L45-L49 WeakPolarHBondContact O-CG 3.38Å; L45-L49 PolarHBondContact O-N 2.93Å; L46-L49 PolarHBondContact O-N 2.93Å; L49-A51 VanDerWaalsContact C-N 3.32Å |
| 50 | K | 81.8 | Confident | 75.1 | Confident | 160 Ų | 160 | 124 Ų | 124 | 70% | 0.696 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -77.1 | -18.8 | 173 | -76.8 | 179.2 | -179.5 | -179.4 | 0 | 112.9 | L46 A47 P52 | L46-K50 VanDerWaalsContact O-CB 3.26Å; L46-K50 WeakPolarHBondContact O-CB 3.4Å; L46-K50 VanDerWaalsContact O-CG 3.24Å; L46-K50 WeakPolarHBondContact O-CG 3.28Å; L46-K50 PolarHBondContact O-N 3.44Å; A47-K50 PolarHBondContact O-N 3.35Å; K50-P52 WeakPolarHBondContact O-CD 3.4Å; K50-P52 VanDerWaalsContact O-N 3.12Å |
| 51 | A | 75.2 | Confident | 73.5 | Confident | 49 Ų | 49 | 129.9 Ų | 129.9 | 41% | 0.405 | 66% | 0.655 | S | S | . | * | S | Bend | trans | -59 | 122.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 106.5 | A47 H48 L49 D53 | A47-A51 PolarHBondContact O-N 3.44Å; H48-A51 VanDerWaalsContact O-CB 3.27Å; H48-A51 WeakPolarHBondContact O-CB 3.29Å; H48-A51 PolarHBondContact O-N 2.92Å; L49-A51 VanDerWaalsContact C-N 3.32Å; A51-D53 PolarHBondContact O-N 2.84Å; A51-D53 VanDerWaalsContact O-N 3.15Å |
| 52 | P | 71 | Confident | 71.9 | Confident | 93 Ų | 93 | 131.6 Ų | 131.6 | 60% | 0.604 | 66% | 0.663 | S | S | * | * | trans | -55.3 | 132.1 | 176 | 22.8 | -31.4 | 0 | 0 | 0 | 106.2 | K50 K54 | K50-P52 WeakPolarHBondContact O-CD 3.4Å; K50-P52 VanDerWaalsContact O-N 3.12Å; P52-K54 HydrophobicContact CG-CG 4.37Å; P52-K54 WeakPolarHBondContact O-CG 3.5Å; P52-K54 PolarHBondContact O-N 3.45Å | ||
| 53 | D | 63.5 | Low | 70.1 | Confident | 164 Ų | 164 | 133.6 Ų | 133.6 | 88% | 0.877 | 68% | 0.681 | S | S | * | * | trans | -52.4 | 92.7 | 163.2 | -89.3 | -34 | 0 | 0 | 0 | 105.3 | A51 S55 | A51-D53 PolarHBondContact O-N 2.84Å; A51-D53 VanDerWaalsContact O-N 3.15Å; D53-S55 PolarHBondContact O-N 2.9Å | ||
| 54 | K | 60 | Low | 68.4 | Low | 180 Ų | 180 | 136.4 Ų | 136.4 | 78% | 0.783 | 69% | 0.693 | S | S | * | * | trans | -69.9 | 87.6 | -178.4 | -74.8 | -174.9 | -175 | 177.2 | 0 | 103.5 | P52 V56 | P52-K54 HydrophobicContact CG-CG 4.37Å; P52-K54 WeakPolarHBondContact O-CG 3.5Å; P52-K54 PolarHBondContact O-N 3.45Å; K54-V56 PolarHBondContact O-N 3.25Å; K54-V56 VanDerWaalsContact O-N 3.11Å | ||
| 55 | S | 52.2 | Low | 66.6 | Low | 86 Ų | 86 | 137.4 Ų | 137.4 | 60% | 0.601 | 70% | 0.697 | S | S | * | * | trans | 18.9 | 86.8 | 165.8 | 60.2 | 0 | 0 | 0 | 0 | 110.3 | D53 K57 | D53-S55 PolarHBondContact O-N 2.9Å; S55-K57 PolarHBondContact O-N 3.39Å | ||
| 56 | V | 57.4 | Low | 64.5 | Low | 139 Ų | 139 | 145 Ų | 145 | 84% | 0.842 | 72% | 0.72 | S | S | * | * | trans | -53.5 | 97.3 | 151.3 | 178.8 | 0 | 0 | 0 | 0 | 102.5 | K54 R58 | K54-V56 PolarHBondContact O-N 3.25Å; K54-V56 VanDerWaalsContact O-N 3.11Å; V56-R58 PolarHBondContact O-N 3.43Å | ||
| 57 | K | 59.2 | Low | 62.6 | Low | 178 Ų | 178 | 146.1 Ų | 146.1 | 77% | 0.774 | 73% | 0.731 | S | S | * | * | trans | -56.6 | 103 | -179.5 | -83.1 | 179.6 | 178.9 | 174.5 | 0 | 102.3 | S55 T59 | S55-K57 PolarHBondContact O-N 3.39Å; K57-T59 VanDerWaalsContact C-N 3.27Å; K57-T59 PolarHBondContact O-N 2.92Å | ||
| 58 | R | 57 | Low | 60.9 | Low | 229 Ų | 229 | 149 Ų | 149 | 86% | 0.864 | 74% | 0.742 | S | S | * | * | trans | -51 | 105.7 | 175.6 | -170.8 | 176.9 | -172.5 | 131.9 | -1 | 103.1 | V56 K60 | V56-R58 PolarHBondContact O-N 3.43Å; R58-K60 PolarHBondContact O-N 2.76Å | ||
| 59 | T | 53.7 | Low | 58.8 | Low | 130 Ų | 130 | 150 Ų | 150 | 80% | 0.798 | 75% | 0.747 | S | S | * | * | trans | -58.3 | 97 | -178.7 | -61.9 | 0 | 0 | 0 | 0 | 103.8 | K57 R61 | K57-T59 VanDerWaalsContact C-N 3.27Å; K57-T59 PolarHBondContact O-N 2.92Å; T59-R61 VanDerWaalsContact C-N 3.29Å; T59-R61 PolarHBondContact O-N 2.78Å | ||
| 60 | K | 60.5 | Low | 57.2 | Low | 182 Ų | 182 | 149.1 Ų | 149.1 | 79% | 0.791 | 75% | 0.749 | S | S | * | * | trans | -61.1 | 108 | 175.5 | -73 | -172.8 | 179.9 | -177.9 | 0 | 101.9 | R58 I62 | R58-K60 PolarHBondContact O-N 2.76Å; K60-I62 VanDerWaalsContact C-N 3.33Å; K60-I62 PolarHBondContact O-N 2.73Å | ||
| 61 | R | 55.8 | Low | 55.3 | Low | 232 Ų | 232 | 150.3 Ų | 150.3 | 88% | 0.875 | 76% | 0.757 | S | S | * | * | trans | -44.9 | 109.1 | 170.9 | -141.2 | 178.8 | 177.4 | -158 | -0.2 | 104 | T59 T63 | T59-R61 VanDerWaalsContact C-N 3.29Å; T59-R61 PolarHBondContact O-N 2.78Å; R61-T63 PolarHBondContact O-N 2.73Å | ||
| 62 | I | 58.8 | Low | 53.7 | Low | 152 Ų | 152 | 155.2 Ų | 155.2 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | trans | -68.8 | 90.1 | -177.8 | -58.2 | 172.4 | 0 | 0 | 0 | 103.5 | K60 K64 | K60-I62 VanDerWaalsContact C-N 3.33Å; K60-I62 PolarHBondContact O-N 2.73Å; I62-K64 PolarHBondContact O-N 3.12Å | ||
| 63 | T | 53.2 | Low | 52.3 | Low | 126 Ų | 126 | 155.6 Ų | 155.6 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | trans | -61.7 | 98 | 165.4 | -52.3 | 0 | 0 | 0 | 0 | 103.6 | R61 P65 | R61-T63 PolarHBondContact O-N 2.73Å; T63-P65 VanDerWaalsContact O-CD 3.27Å; T63-P65 WeakPolarHBondContact O-CD 3.3Å | ||
| 64 | K | 55.4 | Low | 51.2 | Low | 181 Ų | 181 | 156.6 Ų | 156.6 | 79% | 0.787 | 78% | 0.783 | S | S | * | * | trans | -50.9 | 116.9 | 175.9 | -70.1 | -175.2 | 178.2 | -178.4 | 0 | 106.1 | I62 R66 | I62-K64 PolarHBondContact O-N 3.12Å; K64-R66 PolarHBondContact O-N 3.4Å; K64-R66 VanDerWaalsContact O-N 3.14Å | ||
| 65 | P | 51.9 | Low | 49.9 | Very low | 101 Ų | 101 | 153.6 Ų | 153.6 | 66% | 0.656 | 79% | 0.785 | S | S | * | * | trans | -58.2 | 126.6 | 173.5 | 23 | -30.2 | 0 | 0 | 0 | 106.1 | T63 T67 | T63-P65 VanDerWaalsContact O-CD 3.27Å; T63-P65 WeakPolarHBondContact O-CD 3.3Å; P65-T67 PolarHBondContact O-N 3.47Å | ||
| 66 | R | 47.9 | Very low | 49.3 | Very low | 241 Ų | 241 | 153.3 Ų | 153.3 | 91% | 0.909 | 78% | 0.783 | S | S | * | * | trans | -62.2 | 88.2 | 171.5 | -175.2 | 176.8 | -175.8 | 150.9 | -0.4 | 105.8 | K64 T68 | K64-R66 PolarHBondContact O-N 3.4Å; K64-R66 VanDerWaalsContact O-N 3.14Å; R66-T68 PolarHBondContact O-N 2.83Å | ||
| 67 | T | 47.5 | Very low | 48.3 | Very low | 113 Ų | 113 | 158.6 Ų | 158.6 | 69% | 0.693 | 79% | 0.788 | S | S | * | * | trans | -65.6 | 101.9 | 178.9 | 42.2 | 0 | 0 | 0 | 0 | 106.7 | P65 H69 | P65-T67 PolarHBondContact O-N 3.47Å; T67-H69 PolarHBondContact O-N 3.2Å | ||
| 68 | T | 50.3 | Low | 47.4 | Very low | 123 Ų | 123 | 158.9 Ų | 158.9 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | trans | -60 | 93 | 162.4 | 46.2 | 0 | 0 | 0 | 0 | 107 | R66 P70 | R66-T68 PolarHBondContact O-N 2.83Å; T68-P70 WeakPolarHBondContact O-CD 3.32Å | ||
| 69 | H | 39.7 | Very low | 46.4 | Very low | 165 Ų | 165 | 152.9 Ų | 152.9 | 76% | 0.764 | 78% | 0.783 | S | S | * | * | trans | 8.2 | 81 | 159.1 | -145.1 | -44.7 | 0 | 0 | 0 | 115.4 | T67 | T67-H69 PolarHBondContact O-N 3.2Š| ||
| 70 | P | 48.8 | Very low | 45.7 | Very low | 108 Ų | 108 | 150.9 Ų | 150.9 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | trans | -78.3 | 132.2 | 166.2 | -5.7 | 24.9 | 0 | 0 | 0 | 107.5 | T68 | T68-P70 WeakPolarHBondContact O-CD 3.32Š| ||
| 71 | Q | 42.2 | Very low | 44.7 | Very low | 184 Ų | 184 | 149.9 Ų | 149.9 | 86% | 0.86 | 78% | 0.775 | S | S | * | * | trans | -50.7 | 146.8 | -176.4 | -69.4 | 174.4 | -33.3 | 0 | 0 | 113.3 | A73 | Q71-A73 PolarHBondContact O-N 2.97Š| ||
| 72 | L | 41.7 | Very low | 43.8 | Very low | 152 Ų | 152 | 144.2 Ų | 144.2 | 80% | 0.796 | 77% | 0.771 | S | S | * | * | trans | -50.6 | 86.8 | 172.7 | -64.8 | 154 | 0 | 0 | 0 | 112.3 | K74 | L72-K74 PolarHBondContact O-N 3.04Š| ||
| 73 | A | 41.3 | Very low | 42.8 | Very low | 101 Ų | 101 | 146.3 Ų | 146.3 | 84% | 0.835 | 77% | 0.77 | S | S | * | * | trans | -79.2 | 94.6 | 155.7 | 0 | 0 | 0 | 0 | 0 | 107.8 | Q71 | Q71-A73 PolarHBondContact O-N 2.97Š| ||
| 74 | K | 39.7 | Very low | 42 | Very low | 185 Ų | 185 | 144.9 Ų | 144.9 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | -61.4 | 148 | 166.6 | -65.1 | 169.9 | 178.3 | 174.6 | 0 | 109.1 | L72 | L72-K74 PolarHBondContact O-N 3.04Š| ||
| 75 | S | 33.9 | Very low | 41.2 | Very low | 118 Ų | 118 | 142.7 Ų | 142.7 | 83% | 0.825 | 77% | 0.773 | S | S | * | * | trans | 80.1 | 129.3 | 170.1 | -159.2 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 76 | S | 40.1 | Very low | 40.4 | Very low | 80 Ų | 80 | 146.8 Ų | 146.8 | 56% | 0.559 | 78% | 0.784 | S | S | * | * | cis | -149.8 | 141.1 | 31.2 | 172.4 | 0 | 0 | 0 | 0 | 109.8 | F78 | S76-F78 PolarHBondContact O-N 2.93Å; S76-F78 WeakPolarHBondContact OG-CD2 3.42Å | ||
| 77 | R | 36.4 | Very low | 40 | Very low | 249 Ų | 249 | 140 Ų | 140 | 94% | 0.94 | 77% | 0.773 | S | S | * | * | trans | -67 | 89.5 | 171.2 | -70.2 | 174.8 | -179.3 | 166.5 | -0.9 | 109.2 | ||||
| 78 | F | 39.8 | Very low | 39.4 | Very low | 185 Ų | 185 | 141 Ų | 141 | 81% | 0.811 | 78% | 0.779 | S | S | * | * | trans | -104.8 | 91.8 | 159.2 | -86.1 | -77.5 | 0 | 0 | 0 | 109.8 | S76 A80 | S76-F78 PolarHBondContact O-N 2.93Å; S76-F78 WeakPolarHBondContact OG-CD2 3.42Å; F78-A80 PolarHBondContact O-N 2.81Å; F78-A80 VanDerWaalsContact O-N 3.11Å | ||
| 79 | S | 35.2 | Very low | 38.9 | Very low | 103 Ų | 103 | 141.4 Ų | 141.4 | 72% | 0.72 | 78% | 0.781 | S | S | * | * | trans | -63.2 | 94.2 | 159.8 | 160.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 80 | A | 39.2 | Very low | 38.6 | Very low | 88 Ų | 88 | 141 Ų | 141 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | trans | -111.8 | 90.7 | 159.8 | 0 | 0 | 0 | 0 | 0 | 107.6 | F78 S82 | F78-A80 PolarHBondContact O-N 2.81Å; F78-A80 VanDerWaalsContact O-N 3.11Å; A80-S82 PolarHBondContact O-N 3.45Å | ||
| 81 | K | 39.1 | Very low | 37.8 | Very low | 161 Ų | 161 | 145.4 Ų | 145.4 | 70% | 0.7 | 79% | 0.791 | S | S | * | * | trans | -62.8 | 89.4 | 161.3 | -66.9 | 173 | 179.2 | 177.9 | 0 | 106.8 | Y83 | K81-Y83 HydrophobicContact CB-CE2 4.27Å; K81-Y83 VanDerWaalsContact O-CD2 3.25Å; K81-Y83 WeakPolarHBondContact O-CD2 3.36Å; K81-Y83 PolarHBondContact O-N 2.99Å | ||
| 82 | S | 38.4 | Very low | 37.4 | Very low | 113 Ų | 113 | 143.2 Ų | 143.2 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | trans | -78 | 99.9 | 166.3 | 56.4 | 0 | 0 | 0 | 0 | 107.1 | A80 A84 | A80-S82 PolarHBondContact O-N 3.45Å; S82-A84 PolarHBondContact O-N 3.17Å | ||
| 83 | Y | 37.4 | Very low | 36.9 | Very low | 195 Ų | 195 | 141.7 Ų | 141.7 | 77% | 0.765 | 78% | 0.777 | S | S | * | * | trans | -51.4 | 118.1 | 173.4 | -67.6 | -96.8 | 0 | 0 | 0 | 109.1 | K81 T85 | K81-Y83 HydrophobicContact CB-CE2 4.27Å; K81-Y83 VanDerWaalsContact O-CD2 3.25Å; K81-Y83 WeakPolarHBondContact O-CD2 3.36Å; K81-Y83 PolarHBondContact O-N 2.99Å; Y83-T85 PolarHBondContact O-N 3.34Å | ||
| 84 | A | 36.9 | Very low | 36.6 | Very low | 96 Ų | 96 | 141.2 Ų | 141.2 | 79% | 0.793 | 77% | 0.773 | S | S | * | * | trans | -61.1 | 108.4 | 164 | 0 | 0 | 0 | 0 | 0 | 106.5 | S82 Q86 | S82-A84 PolarHBondContact O-N 3.17Å; A84-Q86 PolarHBondContact O-N 3.08Å | ||
| 85 | T | 37.1 | Very low | 36.5 | Very low | 135 Ų | 135 | 138.3 Ų | 138.3 | 83% | 0.828 | 77% | 0.765 | S | S | * | * | trans | -59.4 | 104.6 | 171.5 | 42.9 | 0 | 0 | 0 | 0 | 107.5 | Y83 S87 | Y83-T85 PolarHBondContact O-N 3.34Å; T85-S87 PolarHBondContact O-N 3.39Å | ||
| 86 | Q | 36.5 | Very low | 36.4 | Very low | 188 Ų | 188 | 139.5 Ų | 139.5 | 88% | 0.879 | 76% | 0.757 | S | S | * | * | trans | -58.5 | 102.3 | 165.3 | -75.4 | 177.1 | -16 | 0 | 0 | 106.6 | A84 T88 | A84-Q86 PolarHBondContact O-N 3.08Å; Q86-T88 PolarHBondContact O-N 3.22Å; Q86-T88 VanDerWaalsContact O-N 3.13Å | ||
| 87 | S | 38.7 | Very low | 36.1 | Very low | 98 Ų | 98 | 144.2 Ų | 144.2 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | trans | -68.1 | 111.9 | 165.1 | 64.3 | 0 | 0 | 0 | 0 | 106.3 | T85 V89 | T85-S87 PolarHBondContact O-N 3.39Å; S87-V89 VanDerWaalsContact C-N 3.27Å; S87-V89 PolarHBondContact O-N 2.91Å | ||
| 88 | T | 34.8 | Very low | 35.9 | Very low | 134 Ų | 134 | 139.6 Ų | 139.6 | 82% | 0.822 | 76% | 0.759 | S | S | * | * | trans | -46.3 | 89 | 163.4 | 44.1 | 0 | 0 | 0 | 0 | 109.8 | Q86 E90 | Q86-T88 PolarHBondContact O-N 3.22Å; Q86-T88 VanDerWaalsContact O-N 3.13Å; T88-E90 PolarHBondContact O-N 3.32Å | ||
| 89 | V | 40.5 | Very low | 35.6 | Very low | 131 Ų | 131 | 135.7 Ų | 135.7 | 79% | 0.794 | 75% | 0.754 | S | S | * | * | trans | -80.9 | 108.3 | 158 | 179.9 | 0 | 0 | 0 | 0 | 104.2 | S87 Q91 | S87-V89 VanDerWaalsContact C-N 3.27Å; S87-V89 PolarHBondContact O-N 2.91Å; V89-Q91 PolarHBondContact O-N 3.49Å | ||
| 90 | E | 34 | Very low | 35.6 | Very low | 158 Ų | 158 | 138 Ų | 138 | 74% | 0.738 | 76% | 0.758 | S | S | * | * | trans | -45.2 | 130.2 | -179.8 | -70.9 | 171.5 | 147.3 | 0 | 0 | 110.7 | T88 L92 | T88-E90 PolarHBondContact O-N 3.32Å; E90-L92 PolarHBondContact O-N 2.91Å | ||
| 91 | Q | 31.8 | Very low | 35.5 | Very low | 199 Ų | 199 | 138.9 Ų | 138.9 | 93% | 0.93 | 76% | 0.759 | S | S | * | * | trans | -69.4 | 60.5 | 176.8 | -160.9 | 172.6 | 10.5 | 0 | 0 | 109 | V89 N93 | V89-Q91 PolarHBondContact O-N 3.49Å; Q91-N93 PolarHBondContact O-N 3.47Å | ||
| 92 | L | 33 | Very low | 35.2 | Very low | 139 Ų | 139 | 141.5 Ų | 141.5 | 73% | 0.728 | 76% | 0.764 | S | S | * | * | trans | -83.5 | 112.2 | 173.2 | -82.8 | 166.9 | 0 | 0 | 0 | 108.1 | E90 | E90-L92 PolarHBondContact O-N 2.91Š| ||
| 93 | N | 31.9 | Very low | 34.9 | Very low | 120 Ų | 120 | 143.9 Ų | 143.9 | 64% | 0.642 | 76% | 0.763 | S | S | * | * | trans | 68.3 | 77.8 | 162.4 | -73.3 | -7.8 | 0 | 0 | 0 | 115.3 | Q91 I95 | Q91-N93 PolarHBondContact O-N 3.47Å; N93-I95 HydrophobicContact CB-CD1 3.88Å; N93-I95 HydrophobicContact CB-CG1 3.85Å; N93-I95 PolarHBondContact O-N 2.98Å | ||
| 94 | A | 33.5 | Very low | 34.8 | Very low | 91 Ų | 91 | 138.1 Ų | 138.1 | 75% | 0.752 | 75% | 0.748 | S | S | * | * | trans | -56 | 66.8 | 130.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | H96 | A94-H96 PolarHBondContact O-N 3.37Š| ||
| 95 | I | 38.1 | Very low | 34.9 | Very low | 123 Ų | 123 | 139.6 Ų | 139.6 | 63% | 0.631 | 74% | 0.743 | S | S | * | * | trans | -65.4 | 104.8 | 155.4 | -73.5 | 156.3 | 0 | 0 | 0 | 102.7 | N93 H97 | N93-I95 HydrophobicContact CB-CD1 3.88Å; N93-I95 HydrophobicContact CB-CG1 3.85Å; N93-I95 PolarHBondContact O-N 2.98Å; I95-H97 VanDerWaalsContact C-N 3.29Å; I95-H97 PolarHBondContact O-N 3.33Å | ||
| 96 | H | 32.6 | Very low | 34.7 | Very low | 144 Ų | 144 | 141.3 Ų | 141.3 | 67% | 0.667 | 74% | 0.739 | S | S | * | * | trans | -39.2 | 99.8 | 168.4 | -78.6 | -91.4 | 0 | 0 | 0 | 108.2 | A94 H98 | A94-H96 PolarHBondContact O-N 3.37Å; H96-H98 PolarHBondContact O-N 3.47Å | ||
| 97 | H | 32.7 | Very low | 34.7 | Very low | 179 Ų | 179 | 138.1 Ų | 138.1 | 83% | 0.829 | 73% | 0.732 | S | S | * | * | trans | -57.8 | 90.2 | 145.4 | -71.6 | -75 | 0 | 0 | 0 | 103.4 | I95 S99 | I95-H97 VanDerWaalsContact C-N 3.29Å; I95-H97 PolarHBondContact O-N 3.33Å; H97-S99 PolarHBondContact O-N 3.33Å | ||
| 98 | H | 34.1 | Very low | 34.4 | Very low | 151 Ų | 151 | 139.9 Ų | 139.9 | 70% | 0.699 | 73% | 0.734 | S | S | * | * | trans | -57.3 | 85 | 142.8 | -64.2 | -72.2 | 0 | 0 | 0 | 103.6 | H96 L100 | H96-H98 PolarHBondContact O-N 3.47Å; H98-L100 PolarHBondContact O-N 2.98Å | ||
| 99 | S | 32.8 | Very low | 34.5 | Very low | 103 Ų | 103 | 141.4 Ų | 141.4 | 72% | 0.72 | 73% | 0.732 | S | S | * | * | trans | -46.2 | 85.7 | 144.3 | 46.4 | 0 | 0 | 0 | 0 | 104.8 | H97 S101 | H97-S99 PolarHBondContact O-N 3.33Å; S99-S101 VanDerWaalsContact C-N 3.31Å; S99-S101 PolarHBondContact O-N 2.96Å | ||
| 100 | L | 35 | Very low | 34 | Very low | 151 Ų | 151 | 140.9 Ų | 140.9 | 79% | 0.791 | 73% | 0.733 | S | S | * | * | trans | -45.2 | 115 | 151 | -88.4 | 104.2 | 0 | 0 | 0 | 103 | H98 R102 | H98-L100 PolarHBondContact O-N 2.98Å; L100-R102 PolarHBondContact O-N 3.02Å | ||
| 101 | S | 36.5 | Very low | 33.8 | Very low | 108 Ų | 108 | 140.2 Ų | 140.2 | 76% | 0.755 | 73% | 0.733 | S | S | * | * | trans | -44.6 | 103.6 | 169.6 | 49.9 | 0 | 0 | 0 | 0 | 105.2 | S99 Q103 | S99-S101 VanDerWaalsContact C-N 3.31Å; S99-S101 PolarHBondContact O-N 2.96Å; S101-Q103 PolarHBondContact O-N 2.76Å | ||
| 102 | R | 33.2 | Very low | 34 | Very low | 216 Ų | 216 | 135.8 Ų | 135.8 | 82% | 0.815 | 72% | 0.722 | S | S | * | * | trans | -59.2 | 100.1 | 174.7 | -87.6 | -175.4 | 174.9 | -166.4 | -1.2 | 103.8 | L100 T104 | L100-R102 PolarHBondContact O-N 3.02Å; R102-T104 HydrophobicContact CB-CG2 3.96Å; R102-T104 HydrophobicContact CG-CG2 4.37Å; R102-T104 PolarHBondContact O-N 2.72Å; R102-T104 PolarHBondContact O-OG1 2.74Å | ||
| 103 | Q | 31.7 | Very low | 34.1 | Very low | 162 Ų | 162 | 138.8 Ų | 138.8 | 76% | 0.757 | 73% | 0.732 | S | S | * | * | trans | -70.4 | 66.3 | 160.2 | -160.8 | 176.7 | 11.4 | 0 | 0 | 105.1 | S101 D105 | S101-Q103 PolarHBondContact O-N 2.76Å; Q103-D105 PolarHBondContact O-N 3.25Å | ||
| 104 | T | 36.6 | Very low | 34.3 | Very low | 75 Ų | 75 | 140.6 Ų | 140.6 | 46% | 0.46 | 74% | 0.737 | S | S | . | * | trans | -85.8 | 23.9 | 174 | 28.6 | 0 | 0 | 0 | 0 | 110.9 | R102 F106 | R102-T104 HydrophobicContact CB-CG2 3.96Å; R102-T104 HydrophobicContact CG-CG2 4.37Å; R102-T104 PolarHBondContact O-N 2.72Å; R102-T104 PolarHBondContact O-OG1 2.74Å; T104-F106 VanDerWaalsContact C-N 3.3Å; T104-F106 PolarHBondContact O-N 2.95Å | ||
| 105 | D | 38.3 | Very low | 34.3 | Very low | 127 Ų | 127 | 141.6 Ų | 141.6 | 68% | 0.679 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -82.4 | -5.4 | 179.8 | -69.5 | -19.7 | 0 | 0 | 0 | 113.3 | Q103 | Q103-D105 PolarHBondContact O-N 3.25Š|
| 106 | F | 32.7 | Very low | 34.1 | Very low | 170 Ų | 170 | 147.8 Ų | 147.8 | 75% | 0.746 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -113 | -3.3 | -175.6 | -82.5 | -78.6 | 0 | 0 | 0 | 116.8 | T104 | T104-F106 VanDerWaalsContact C-N 3.3Å; T104-F106 PolarHBondContact O-N 2.95Å |
| 107 | V | 37.2 | Very low | 33.9 | Very low | 122 Ų | 122 | 146.8 Ų | 146.8 | 74% | 0.739 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -102.6 | -9.4 | -178.2 | -173.7 | 0 | 0 | 0 | 0 | 113.3 | ||
| 108 | N | 32 | Very low | 33.6 | Very low | 135 Ų | 135 | 145 Ų | 145 | 72% | 0.722 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -95.7 | 6.8 | -179.4 | -73.9 | -16.1 | 0 | 0 | 0 | 115.3 | ||
| 109 | Q | 35.5 | Very low | 33.5 | Very low | 166 Ų | 166 | 148 Ų | 148 | 78% | 0.776 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -98.1 | 7.6 | -177.9 | -87.8 | -174.9 | 12 | 0 | 0 | 116.1 | ||
| 110 | C | 31 | Very low | 33.3 | Very low | 120 Ų | 120 | 146.7 Ų | 146.7 | 81% | 0.811 | 76% | 0.76 | S | S | * | * | trans | -132.4 | 25.9 | 178.9 | -62.5 | 0 | 0 | 0 | 0 | 114.7 | P112 | C110-P112 WeakPolarHBondContact O-CD 3.49Š| ||
| 111 | L | 30.8 | Very low | 33 | Very low | 144 Ų | 144 | 145.8 Ų | 145.8 | 75% | 0.754 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -89.3 | 116.5 | 159.1 | -82.9 | 165.6 | 0 | 0 | 0 | 107.9 | E113 | L111-E113 PolarHBondContact O-N 2.65Š|
| 112 | P | 34.9 | Very low | 32.6 | Very low | 106 Ų | 106 | 146.2 Ų | 146.2 | 69% | 0.688 | 76% | 0.76 | S | S | * | * | trans | -60.6 | 115.3 | 177.3 | 23.6 | -30.6 | 0 | 0 | 0 | 108.5 | C110 E114 | C110-P112 WeakPolarHBondContact O-CD 3.49Å; P112-E114 PolarHBondContact O-N 2.85Å | ||
| 113 | E | 36 | Very low | 32.7 | Very low | 202 Ų | 202 | 142.3 Ų | 142.3 | 94% | 0.944 | 76% | 0.761 | S | S | * | * | trans | -66.6 | 71.4 | 168.4 | -79.4 | -174.6 | 142.5 | 0 | 0 | 109.4 | L111 | L111-E113 PolarHBondContact O-N 2.65Š| ||
| 114 | E | 35.1 | Very low | 32.7 | Very low | 157 Ų | 157 | 140.9 Ų | 140.9 | 73% | 0.734 | 76% | 0.758 | S | S | * | * | trans | -104.4 | 125.4 | 159.9 | -72.9 | -169.8 | 162 | 0 | 0 | 107.8 | P112 | P112-E114 PolarHBondContact O-N 2.85Š| ||
| 115 | T | 34.6 | Very low | 32.7 | Very low | 113 Ų | 113 | 144.2 Ų | 144.2 | 69% | 0.693 | 77% | 0.773 | S | S | * | * | S | Bend | trans | 99.9 | 22.3 | 155 | 71.8 | 0 | 0 | 0 | 0 | 122.2 | ||
| 116 | W | 31.9 | Very low | 32.5 | Very low | 252 Ų | 252 | 145.3 Ų | 145.3 | 96% | 0.955 | 78% | 0.779 | S | S | * | * | trans | -114.5 | 67.3 | 160.8 | -71.2 | 72.2 | 0 | 0 | 0 | 112.9 | ||||
| 117 | N | 28.8 | Very low | 32.4 | Very low | 124 Ų | 124 | 143.5 Ų | 143.5 | 66% | 0.663 | 78% | 0.777 | S | S | * | * | trans | 19.4 | 115.3 | 139.5 | -70.8 | -39 | 0 | 0 | 0 | 118.9 | ||||
| 118 | N | 27.1 | Very low | 32.6 | Very low | 142 Ų | 142 | 142.5 Ų | 142.5 | 76% | 0.759 | 77% | 0.773 | S | S | * | * | 51.7 | 69.6 | 124.8 | -60.3 | -42.7 | 0 | 0 | 0 | 117.7 | |||||
| 119 | F | 32.1 | Very low | 33 | Very low | 214 Ų | 214 | 145.5 Ų | 145.5 | 94% | 0.939 | 78% | 0.78 | S | S | * | * | trans | -149.1 | 116.5 | 149.8 | -81.3 | -77 | 0 | 0 | 0 | 110.5 | ||||
| 120 | G | 27.3 | Very low | 33.2 | Very low | 75 Ų | 75 | 142.4 Ų | 142.4 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | trans | 103.9 | 95.7 | 157.6 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 121 | T | 28.9 | Very low | 33.7 | Very low | 132 Ų | 132 | 142.2 Ų | 142.2 | 81% | 0.81 | 77% | 0.771 | S | S | * | * | trans | -22.9 | 153.3 | 162.7 | 36.1 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 122 | P | 29.8 | Very low | 34.2 | Very low | 116 Ų | 116 | 142 Ų | 142 | 75% | 0.753 | 77% | 0.77 | S | S | * | * | trans | -81 | 131.8 | -166.5 | 34.2 | -33.8 | 0 | 0 | 0 | 112 | ||||
| 123 | V | 34.1 | Very low | 35 | Very low | 135 Ų | 135 | 140.8 Ų | 140.8 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -108.2 | 108.1 | 161.9 | 173.7 | 0 | 0 | 0 | 0 | 106.7 | N125 | V123-N125 PolarHBondContact O-N 2.97Š| ||
| 124 | N | 31.5 | Very low | 35.6 | Very low | 132 Ų | 132 | 140.9 Ų | 140.9 | 71% | 0.706 | 76% | 0.762 | S | S | * | * | trans | -37.5 | 122 | 165.2 | -68 | -19.8 | 0 | 0 | 0 | 110.7 | ||||
| 125 | N | 36.1 | Very low | 36.6 | Very low | 144 Ų | 144 | 140.6 Ų | 140.6 | 77% | 0.77 | 76% | 0.761 | S | S | * | * | trans | -153.7 | 111.7 | 142.1 | -85.8 | -34.9 | 0 | 0 | 0 | 107.4 | V123 D127 | V123-N125 PolarHBondContact O-N 2.97Å; N125-D127 PolarHBondContact O-N 3.08Å | ||
| 126 | D | 34.8 | Very low | 37.6 | Very low | 151 Ų | 151 | 139.4 Ų | 139.4 | 81% | 0.807 | 76% | 0.755 | S | S | * | * | trans | -69.4 | 67.1 | 179.6 | -62.5 | -65.5 | 0 | 0 | 0 | 112 | P128 | D126-P128 WeakPolarHBondContact O-CD 3.43Š| ||
| 127 | D | 31.8 | Very low | 39.1 | Very low | 131 Ų | 131 | 135.2 Ų | 135.2 | 70% | 0.701 | 75% | 0.749 | S | S | * | * | trans | -102.7 | 84 | 164.2 | -80.1 | -34.3 | 0 | 0 | 0 | 109.3 | N125 F129 | N125-D127 PolarHBondContact O-N 3.08Å; D127-F129 PolarHBondContact O-N 2.98Å | ||
| 128 | P | 40.8 | Very low | 40.6 | Very low | 101 Ų | 101 | 137.2 Ų | 137.2 | 66% | 0.656 | 75% | 0.753 | S | S | * | * | trans | -62.4 | 108.4 | 162.5 | 27.3 | -30.1 | 0 | 0 | 0 | 106.1 | D126 V130 | D126-P128 WeakPolarHBondContact O-CD 3.43Å; P128-V130 HydrophobicContact CB-CG2 4.33Å; P128-V130 PolarHBondContact O-N 3.06Å | ||
| 129 | F | 40.7 | Very low | 42.3 | Very low | 199 Ų | 199 | 135.3 Ų | 135.3 | 87% | 0.873 | 75% | 0.748 | S | S | * | * | trans | -60 | 80.8 | 165 | -78.5 | -90.2 | 0 | 0 | 0 | 108.1 | D127 C131 | D127-F129 PolarHBondContact O-N 2.98Å; F129-C131 VanDerWaalsContact C-N 3.34Å; F129-C131 PolarHBondContact O-N 2.88Å | ||
| 130 | V | 40.1 | Very low | 43.8 | Very low | 101 Ų | 101 | 130 Ų | 130 | 61% | 0.612 | 74% | 0.735 | S | S | * | * | trans | -71.1 | 99.4 | 166.5 | 179 | 0 | 0 | 0 | 0 | 104.3 | P128 N132 | P128-V130 HydrophobicContact CB-CG2 4.33Å; P128-V130 PolarHBondContact O-N 3.06Å; V130-N132 PolarHBondContact O-N 3.43Å | ||
| 131 | C | 39.7 | Very low | 45.2 | Very low | 115 Ų | 115 | 131.4 Ų | 131.4 | 78% | 0.777 | 73% | 0.73 | S | S | * | * | trans | -56.7 | 85.7 | 166.3 | -88.7 | 0 | 0 | 0 | 0 | 108.4 | F129 S133 | F129-C131 VanDerWaalsContact C-N 3.34Å; F129-C131 PolarHBondContact O-N 2.88Å; C131-S133 PolarHBondContact O-N 2.67Å | ||
| 132 | N | 43 | Very low | 46.3 | Very low | 139 Ų | 139 | 131 Ų | 131 | 74% | 0.743 | 73% | 0.728 | S | S | * | * | trans | -81.9 | 33.7 | 177.6 | -117.2 | -10.2 | 0 | 0 | 0 | 110.5 | V130 K134 | V130-N132 PolarHBondContact O-N 3.43Å; N132-K134 PolarHBondContact O-N 3.11Å | ||
| 133 | S | 50 | Low | 47.6 | Very low | 82 Ų | 82 | 135 Ų | 135 | 57% | 0.573 | 73% | 0.729 | S | S | * | * | trans | -70.3 | 99 | 171.9 | 52.4 | 0 | 0 | 0 | 0 | 107.3 | C131 E135 | C131-S133 PolarHBondContact O-N 2.67Å; S133-E135 PolarHBondContact O-N 2.96Å | ||
| 134 | K | 49.6 | Very low | 48.5 | Very low | 204 Ų | 204 | 134.8 Ų | 134.8 | 89% | 0.887 | 73% | 0.728 | S | S | * | * | trans | -62.4 | 25.5 | 165.1 | -66.6 | -173.9 | 174.7 | -177 | 0 | 112.8 | N132 | N132-K134 PolarHBondContact O-N 3.11Š| ||
| 135 | E | 55 | Low | 49 | Very low | 151 Ų | 151 | 136.7 Ų | 136.7 | 71% | 0.706 | 73% | 0.733 | S | S | * | * | trans | -82.8 | 122 | 178.4 | -160.5 | 165.3 | -155.9 | 0 | 0 | 107.1 | S133 I137 | S133-E135 PolarHBondContact O-N 2.96Å; E135-I137 PolarHBondContact O-N 2.94Å | ||
| 136 | P | 56.1 | Low | 49.5 | Very low | 88 Ų | 88 | 135.4 Ų | 135.4 | 57% | 0.571 | 73% | 0.733 | S | S | * | * | trans | -59.7 | 112 | 174.4 | 23 | -29.9 | 0 | 0 | 0 | 107.8 | F138 | P136-F138 VanDerWaalsContact C-N 3.33Å; P136-F138 HydrophobicContact CB-CE2 4.4Å; P136-F138 HydrophobicContact CG-CE2 3.94Å; P136-F138 HydrophobicContact CG-CZ 4.37Å; P136-F138 VanDerWaalsContact O-CD2 3.28Å; P136-F138 WeakPolarHBondContact O-CD2 3.43Å; P136-F138 PolarHBondContact O-N 2.84Å | ||
| 137 | I | 63.6 | Low | 49.7 | Very low | 164 Ų | 164 | 130.9 Ų | 130.9 | 84% | 0.841 | 72% | 0.722 | S | S | * | * | trans | -65.2 | 100.1 | 170.8 | -59.1 | 171.6 | 0 | 0 | 0 | 105.6 | E135 | E135-I137 PolarHBondContact O-N 2.94Š| ||
| 138 | F | 59.7 | Low | 50.3 | Low | 166 Ų | 166 | 133.1 Ų | 133.1 | 73% | 0.728 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 129.7 | 170.8 | -74.5 | -85.3 | 0 | 0 | 0 | 107.7 | P136 | P136-F138 VanDerWaalsContact C-N 3.33Å; P136-F138 HydrophobicContact CB-CE2 4.4Å; P136-F138 HydrophobicContact CG-CE2 3.94Å; P136-F138 HydrophobicContact CG-CZ 4.37Å; P136-F138 VanDerWaalsContact O-CD2 3.28Å; P136-F138 WeakPolarHBondContact O-CD2 3.43Å; P136-F138 PolarHBondContact O-N 2.84Å |
| 139 | P | 64.3 | Low | 50.5 | Low | 101 Ų | 101 | 135.9 Ų | 135.9 | 66% | 0.656 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 142.6 | 168.7 | 25.2 | -31.6 | 0 | 0 | 0 | 108.2 | ||
| 140 | P | 62.2 | Low | 50.2 | Low | 103 Ų | 103 | 136.7 Ų | 136.7 | 67% | 0.669 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 149.6 | 175.4 | 24.1 | -33.2 | 0 | 0 | 0 | 109.4 | T142 | P140-T142 PolarHBondContact O-N 2.98Š|
| 141 | P | 58 | Low | 50 | Low | 105 Ų | 105 | 140.4 Ų | 140.4 | 68% | 0.682 | 75% | 0.751 | S | S | * | * | trans | -53.8 | 110.7 | 178.7 | 19.9 | -30.3 | 0 | 0 | 0 | 109.2 | Y143 | P141-Y143 PolarHBondContact O-N 2.92Š| ||
| 142 | T | 52.2 | Low | 49.9 | Very low | 124 Ų | 124 | 141 Ų | 141 | 76% | 0.761 | 75% | 0.754 | S | S | * | * | trans | -68.3 | 102.7 | 173.8 | -44.9 | 0 | 0 | 0 | 0 | 106.6 | P140 T144 | P140-T142 PolarHBondContact O-N 2.98Å; T142-T144 PolarHBondContact O-N 3.19Å; T142-T144 VanDerWaalsContact O-N 3.08Å | ||
| 143 | Y | 55.3 | Low | 49.6 | Very low | 199 Ų | 199 | 137.2 Ų | 137.2 | 78% | 0.78 | 75% | 0.747 | S | S | * | * | trans | -58.4 | 117.4 | 163 | -67.7 | -82.9 | 0 | 0 | 0 | 106.2 | P141 E145 | P141-Y143 PolarHBondContact O-N 2.92Å; Y143-E145 PolarHBondContact O-N 3.08Å | ||
| 144 | T | 54.1 | Low | 48.9 | Very low | 130 Ų | 130 | 141.3 Ų | 141.3 | 80% | 0.798 | 76% | 0.761 | S | S | * | * | trans | -62 | 109.2 | 168.7 | -50.1 | 0 | 0 | 0 | 0 | 104.8 | T142 P146 | T142-T144 PolarHBondContact O-N 3.19Å; T142-T144 VanDerWaalsContact O-N 3.08Å; T144-P146 VanDerWaalsContact O-N 3.15Å | ||
| 145 | E | 42.3 | Very low | 48.3 | Very low | 172 Ų | 172 | 140 Ų | 140 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | -50.6 | 127.2 | 169.2 | -84.2 | -161.7 | 157.4 | 0 | 0 | 106.6 | Y143 G147 | Y143-E145 PolarHBondContact O-N 3.08Å; E145-G147 PolarHBondContact O-N 2.85Å | ||
| 146 | P | 46.6 | Very low | 47.3 | Very low | 117 Ų | 117 | 139.7 Ų | 139.7 | 76% | 0.76 | 77% | 0.766 | S | S | * | * | trans | -52.3 | 111.5 | 178.5 | -22.1 | 30.3 | 0 | 0 | 0 | 107.4 | T144 L148 | T144-P146 VanDerWaalsContact O-N 3.15Å; P146-L148 PolarHBondContact O-N 2.86Å; P146-L148 VanDerWaalsContact O-N 3.12Å | ||
| 147 | G | 39.2 | Very low | 46.4 | Very low | 56 Ų | 56 | 143.1 Ų | 143.1 | 58% | 0.577 | 78% | 0.78 | S | S | * | * | trans | -51.2 | 128.2 | 174 | 0 | 0 | 0 | 0 | 0 | 106.9 | E145 N149 Y150 | E145-G147 PolarHBondContact O-N 2.85Å; G147-N149 PolarHBondContact O-N 2.97Å; G147-Y150 PolarHBondContact O-N 3.02Å | ||
| 148 | L | 44.6 | Very low | 44.9 | Very low | 179 Ų | 179 | 140.4 Ų | 140.4 | 94% | 0.937 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | 12.8 | -172.2 | -76.6 | 166.2 | 0 | 0 | 0 | 115.8 | P146 | P146-L148 PolarHBondContact O-N 2.86Å; P146-L148 VanDerWaalsContact O-N 3.12Å |
| 149 | N | 43.4 | Very low | 43.6 | Very low | 159 Ų | 159 | 137.6 Ų | 137.6 | 85% | 0.85 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.7 | 11.2 | -175.6 | -62.9 | -28.3 | 0 | 0 | 0 | 114.1 | G147 | G147-N149 PolarHBondContact O-N 2.97Š|
| 150 | Y | 35.7 | Very low | 42.1 | Very low | 216 Ų | 216 | 142.7 Ų | 142.7 | 85% | 0.847 | 77% | 0.772 | S | S | * | * | trans | -94.5 | 102.7 | 169.7 | -111.5 | -90.2 | 0 | 0 | 0 | 110.5 | G147 P152 | G147-Y150 PolarHBondContact O-N 3.02Å; Y150-P152 WeakPolarHBondContact O-CD 3.47Å | ||
| 151 | E | 35.5 | Very low | 40.6 | Very low | 178 Ų | 178 | 145 Ų | 145 | 83% | 0.832 | 77% | 0.774 | S | S | * | * | trans | -60 | 117.2 | 171.1 | -159.6 | -166 | -156.9 | 0 | 0 | 109.2 | G153 | E151-G153 PolarHBondContact O-N 3.2Š| ||
| 152 | P | 37.8 | Very low | 39.4 | Very low | 129 Ų | 129 | 147.9 Ų | 147.9 | 84% | 0.838 | 78% | 0.782 | S | S | * | * | trans | -82.1 | 85.7 | -174.5 | 31 | -30.6 | 0 | 0 | 0 | 109.9 | Y150 | Y150-P152 WeakPolarHBondContact O-CD 3.47Š| ||
| 153 | G | 37 | Very low | 38.3 | Very low | 58 Ų | 58 | 151.8 Ų | 151.8 | 60% | 0.598 | 78% | 0.783 | S | S | * | * | trans | -88.1 | 125.8 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | E151 | E151-G153 PolarHBondContact O-N 3.2Š| ||
| 154 | I | 35.5 | Very low | 37.1 | Very low | 169 Ų | 169 | 148.6 Ų | 148.6 | 87% | 0.867 | 78% | 0.78 | S | S | * | * | S | Bend | trans | 93.5 | 22.7 | 157.2 | -40.9 | 152.9 | 0 | 0 | 0 | 117.1 | ||
| 155 | L | 36.1 | Very low | 35.8 | Very low | 175 Ų | 175 | 145.6 Ų | 145.6 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | trans | -114.9 | 19.8 | 168 | -84.6 | 169.1 | 0 | 0 | 0 | 114.9 | ||||
| 156 | D | 34.2 | Very low | 35.2 | Very low | 145 Ų | 145 | 144.7 Ų | 144.7 | 78% | 0.775 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | 5 | -175.9 | -112.3 | -6 | 0 | 0 | 0 | 115.8 | ||
| 157 | D | 36.9 | Very low | 34.3 | Very low | 160 Ų | 160 | 146.3 Ų | 146.3 | 86% | 0.856 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.2 | 5.3 | -174.1 | -78.8 | -8.4 | 0 | 0 | 0 | 115.4 | ||
| 158 | C | 32.2 | Very low | 33.7 | Very low | 107 Ų | 107 | 148.8 Ų | 148.8 | 72% | 0.723 | 79% | 0.786 | S | S | * | * | trans | -106.5 | 61.2 | 165.1 | -72.6 | 0 | 0 | 0 | 0 | 109.7 | W160 | C158-W160 PolarHBondContact O-N 3.42Š| ||
| 159 | L | 32 | Very low | 32.9 | Very low | 107 Ų | 107 | 146.4 Ų | 146.4 | 56% | 0.56 | 78% | 0.779 | S | S | * | * | trans | -48.5 | 104.8 | 165.3 | -88.1 | 154.8 | 0 | 0 | 0 | 109.4 | E161 | L159-E161 HydrophobicContact CB-CB 4.45Å; L159-E161 HydrophobicContact CD2-CB 4.25Å; L159-E161 HydrophobicContact CD2-CG 3.65Å; L159-E161 PolarHBondContact O-N 2.98Å | ||
| 160 | W | 32.5 | Very low | 32 | Very low | 208 Ų | 208 | 146.2 Ų | 146.2 | 79% | 0.788 | 78% | 0.777 | S | S | * | * | G | 310 helix | trans | -63.6 | 3.5 | 167.6 | -79 | 76.8 | 0 | 0 | 0 | 112.8 | C158 I162 W163 | C158-W160 PolarHBondContact O-N 3.42Å; W160-I162 PolarHBondContact O-N 3.47Å; W160-I162 VanDerWaalsContact O-N 3.12Å; W160-W163 HydrophobicContact CZ3-CE3 4.4Å; W160-W163 PolarHBondContact O-N 2.01Å |
| 161 | E | 30.7 | Very low | 31.5 | Very low | 152 Ų | 152 | 145.7 Ų | 145.7 | 71% | 0.71 | 78% | 0.782 | S | S | * | * | G | 310 helix | trans | -66 | -9.8 | -179.4 | -71.5 | -168.5 | 166.6 | 0 | 0 | 114.2 | L159 W163 | L159-E161 HydrophobicContact CB-CB 4.45Å; L159-E161 HydrophobicContact CD2-CB 4.25Å; L159-E161 HydrophobicContact CD2-CG 3.65Å; L159-E161 PolarHBondContact O-N 2.98Å; E161-W163 PolarHBondContact O-N 3.42Å |
| 162 | I | 34.6 | Very low | 31 | Very low | 165 Ų | 165 | 141.3 Ų | 141.3 | 85% | 0.846 | 77% | 0.771 | S | S | * | * | G | 310 helix | trans | -75.3 | -11.3 | 174.3 | -51.4 | 179 | 0 | 0 | 0 | 111.9 | W160 | W160-I162 PolarHBondContact O-N 3.47Å; W160-I162 VanDerWaalsContact O-N 3.12Å |
| 163 | W | 28.1 | Very low | 30.4 | Very low | 206 Ų | 206 | 144.1 Ų | 144.1 | 78% | 0.78 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -78.1 | -23.1 | -178.1 | -152.9 | -70.8 | 0 | 0 | 0 | 114.1 | W160 E161 G165 | W160-W163 HydrophobicContact CZ3-CE3 4.4Å; W160-W163 PolarHBondContact O-N 2.01Å; E161-W163 PolarHBondContact O-N 3.42Å; W163-G165 PolarHBondContact O-N 3.19Å |
| 164 | N | 29.7 | Very low | 29.9 | Very low | 133 Ų | 133 | 150.1 Ų | 150.1 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | trans | -98 | 91.7 | -178 | -69.9 | -15.6 | 0 | 0 | 0 | 110.4 | D166 | N164-D166 PolarHBondContact O-N 3.25Š| ||
| 165 | G | 26.8 | Very low | 29.3 | Very low | 67 Ų | 67 | 151 Ų | 151 | 69% | 0.691 | 79% | 0.786 | S | S | * | * | trans | -67.1 | 41 | 174 | 0 | 0 | 0 | 0 | 0 | 115.2 | W163 N167 | W163-G165 PolarHBondContact O-N 3.19Å; G165-N167 PolarHBondContact O-N 2.94Å | ||
| 166 | D | 30.5 | Very low | 28.8 | Very low | 152 Ų | 152 | 152.4 Ų | 152.4 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -87.6 | 90.6 | 170.7 | -75.8 | -20.9 | 0 | 0 | 0 | 109.2 | N164 | N164-D166 PolarHBondContact O-N 3.25Š| ||
| 167 | N | 27.7 | Very low | 28.4 | Very low | 152 Ų | 152 | 156.8 Ų | 156.8 | 81% | 0.813 | 79% | 0.79 | S | S | * | * | trans | -52.8 | 138.5 | 163.3 | -78.9 | -55.5 | 0 | 0 | 0 | 110.4 | G165 | G165-N167 PolarHBondContact O-N 2.94Š| ||
| 168 | S | 25.6 | Very low | 27.7 | Very low | 108 Ų | 108 | 155 Ų | 155 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | trans | 102.1 | 127.4 | 157 | 81.8 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 169 | V | 27.4 | Very low | 27.4 | Very low | 129 Ų | 129 | 154.8 Ų | 154.8 | 78% | 0.782 | 78% | 0.782 | S | S | * | * | trans | 77.2 | 84.2 | 159.9 | -159.3 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 170 | L | 26 | Very low | 27 | Very low | 154 Ų | 154 | 159 Ų | 159 | 81% | 0.806 | 80% | 0.799 | S | S | * | * | -172.6 | 83.2 | 125.6 | -94.9 | 157.3 | 0 | 0 | 0 | 109.4 | S172 | L170-S172 VanDerWaalsContact C-N 3.32Å; L170-S172 PolarHBondContact O-N 3.45Å | |||
| 171 | Q | 24.2 | Very low | 26.7 | Very low | 205 Ų | 205 | 153.6 Ų | 153.6 | 96% | 0.958 | 79% | 0.789 | S | S | * | * | trans | -61.7 | 99.9 | 149.2 | -80.6 | 178.7 | -11.8 | 0 | 0 | 106.9 | ||||
| 172 | S | 24.8 | Very low | 26.4 | Very low | 86 Ų | 86 | 151.8 Ų | 151.8 | 60% | 0.601 | 79% | 0.793 | S | S | * | * | trans | -129.5 | 133.4 | 159.6 | 91.3 | 0 | 0 | 0 | 0 | 109.4 | L170 H174 | L170-S172 VanDerWaalsContact C-N 3.32Å; L170-S172 PolarHBondContact O-N 3.45Å; S172-H174 PolarHBondContact O-N 3.44Å | ||
| 173 | Q | 25.4 | Very low | 25.9 | Very low | 189 Ų | 189 | 153.7 Ų | 153.7 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | trans | -64.4 | 107.9 | -166.1 | -59.9 | 178.5 | -4.3 | 0 | 0 | 111.2 | ||||
| 174 | H | 26.6 | Very low | 25.7 | Very low | 183 Ų | 183 | 150.2 Ų | 150.2 | 85% | 0.847 | 79% | 0.793 | S | S | * | * | trans | -116 | 113.4 | 154.2 | -91.1 | -77.4 | 0 | 0 | 0 | 110 | S172 K176 | S172-H174 PolarHBondContact O-N 3.44Å; H174-K176 PolarHBondContact O-N 2.92Å | ||
| 175 | Q | 24.1 | Very low | 25.5 | Very low | 189 Ų | 189 | 147.5 Ų | 147.5 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | trans | -48.3 | 129.1 | -177.8 | -77.4 | 167.5 | -32.9 | 0 | 0 | 111.8 | R177 | Q175-R177 PolarHBondContact O-N 3.27Š| ||
| 176 | K | 25.5 | Very low | 25.4 | Very low | 204 Ų | 204 | 150.2 Ų | 150.2 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | trans | -46.7 | 95.3 | 164.6 | -68.8 | 172.4 | 175.1 | 178.6 | 0 | 110.6 | H174 T178 | H174-K176 PolarHBondContact O-N 2.92Å; K176-T178 PolarHBondContact O-N 2.98Å | ||
| 177 | R | 24.4 | Very low | 25.1 | Very low | 237 Ų | 237 | 150 Ų | 150 | 89% | 0.894 | 80% | 0.795 | S | S | * | * | trans | -90.9 | 92.1 | 155.9 | -129.6 | -179.6 | -172 | -179.2 | 2.2 | 105.6 | Q175 P179 | Q175-R177 PolarHBondContact O-N 3.27Å; R177-P179 WeakPolarHBondContact O-CD 3.29Å; R177-P179 VanDerWaalsContact O-N 3.12Å | ||
| 178 | T | 23.1 | Very low | 25.1 | Very low | 123 Ų | 123 | 151 Ų | 151 | 76% | 0.755 | 79% | 0.792 | S | S | * | * | trans | -55.7 | 111.5 | 177.1 | -10.6 | 0 | 0 | 0 | 0 | 108.4 | K176 Q180 | K176-T178 PolarHBondContact O-N 2.98Å; T178-Q180 PolarHBondContact O-N 3.28Å; T178-Q180 VanDerWaalsContact O-N 3.16Å | ||
| 179 | P | 26.8 | Very low | 25 | Very low | 102 Ų | 102 | 153.3 Ų | 153.3 | 66% | 0.662 | 80% | 0.795 | S | S | * | * | trans | -69.2 | 113.6 | 168.4 | -9 | 26.7 | 0 | 0 | 0 | 106 | R177 T181 | R177-P179 WeakPolarHBondContact O-CD 3.29Å; R177-P179 VanDerWaalsContact O-N 3.12Å; P179-T181 PolarHBondContact O-N 3.39Å | ||
| 180 | Q | 22.6 | Very low | 25 | Very low | 196 Ų | 196 | 156.4 Ų | 156.4 | 92% | 0.916 | 79% | 0.793 | S | S | * | * | trans | -69.8 | 70.7 | 163.8 | -78.9 | -174.5 | -28.8 | 0 | 0 | 108.2 | T178 | T178-Q180 PolarHBondContact O-N 3.28Å; T178-Q180 VanDerWaalsContact O-N 3.16Å | ||
| 181 | T | 26.1 | Very low | 24.9 | Very low | 93 Ų | 93 | 155 Ų | 155 | 57% | 0.571 | 80% | 0.797 | S | S | * | * | trans | -98 | 100.5 | 165.1 | 22.8 | 0 | 0 | 0 | 0 | 106.9 | P179 Y183 | P179-T181 PolarHBondContact O-N 3.39Å; T181-Y183 WeakPolarHBondContact O-CD2 3.18Å; T181-Y183 PolarHBondContact O-N 2.91Å | ||
| 182 | S | 23.4 | Very low | 24.9 | Very low | 115 Ų | 115 | 147.7 Ų | 147.7 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | -57.5 | 83 | 165.8 | 43.4 | 0 | 0 | 0 | 0 | 109.5 | T184 | S182-T184 PolarHBondContact O-N 2.96Å; S182-T184 VanDerWaalsContact O-N 3.08Å | ||
| 183 | Y | 25.1 | Very low | 24.9 | Very low | 204 Ų | 204 | 151.4 Ų | 151.4 | 80% | 0.8 | 79% | 0.789 | S | S | * | * | trans | -68.7 | 99.3 | 161.4 | -81.3 | -90.5 | 0 | 0 | 0 | 106.7 | T181 A185 | T181-Y183 WeakPolarHBondContact O-CD2 3.18Å; T181-Y183 PolarHBondContact O-N 2.91Å; Y183-A185 PolarHBondContact O-N 2.96Å | ||
| 184 | T | 24.5 | Very low | 24.9 | Very low | 133 Ų | 133 | 148.9 Ų | 148.9 | 82% | 0.816 | 79% | 0.787 | S | S | * | * | trans | -55.9 | 96.1 | 154.1 | 22.5 | 0 | 0 | 0 | 0 | 106.5 | S182 C186 | S182-T184 PolarHBondContact O-N 2.96Å; S182-T184 VanDerWaalsContact O-N 3.08Å; T184-C186 PolarHBondContact O-N 2.81Å | ||
| 185 | A | 24.3 | Very low | 25.1 | Very low | 77 Ų | 77 | 144.7 Ų | 144.7 | 64% | 0.636 | 78% | 0.776 | S | S | * | * | trans | -57.9 | 119.8 | 171.4 | 0 | 0 | 0 | 0 | 0 | 107.2 | Y183 D187 | Y183-A185 PolarHBondContact O-N 2.96Å; A185-D187 VanDerWaalsContact C-N 3.34Å; A185-D187 PolarHBondContact O-N 2.7Å | ||
| 186 | C | 25.3 | Very low | 25 | Very low | 124 Ų | 124 | 140.8 Ų | 140.8 | 84% | 0.838 | 77% | 0.769 | S | S | * | * | trans | -61.1 | 102 | 167.8 | -63.6 | 0 | 0 | 0 | 0 | 107 | T184 K188 | T184-C186 PolarHBondContact O-N 2.81Å; C186-K188 PolarHBondContact O-N 3.1Å | ||
| 187 | D | 24.7 | Very low | 25 | Very low | 148 Ų | 148 | 140.7 Ų | 140.7 | 79% | 0.791 | 77% | 0.769 | S | S | * | * | trans | -56.3 | 111.5 | 175.7 | -83 | -34.6 | 0 | 0 | 0 | 108.6 | A185 I189 | A185-D187 VanDerWaalsContact C-N 3.34Å; A185-D187 PolarHBondContact O-N 2.7Å; D187-I189 VanDerWaalsContact C-N 3.34Å; D187-I189 PolarHBondContact O-N 2.86Å | ||
| 188 | K | 26.2 | Very low | 25.1 | Very low | 171 Ų | 171 | 136.6 Ų | 136.6 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | trans | -64.7 | 95.1 | 171.4 | -71.3 | 176.7 | 176.3 | 177 | 0 | 107.4 | C186 Y190 | C186-K188 PolarHBondContact O-N 3.1Å; K188-Y190 HydrophobicContact CB-CD2 3.98Å; K188-Y190 HydrophobicContact CB-CE2 4.36Å; K188-Y190 HydrophobicContact CD-CD2 4.5Å; K188-Y190 HydrophobicContact CD-CE2 4.07Å; K188-Y190 PolarHBondContact O-N 3.12Å | ||
| 189 | I | 25.4 | Very low | 25.2 | Very low | 158 Ų | 158 | 140.8 Ų | 140.8 | 81% | 0.81 | 77% | 0.767 | S | S | * | * | trans | -70.8 | 85 | 163.7 | -55.1 | 175.1 | 0 | 0 | 0 | 106 | D187 S191 | D187-I189 VanDerWaalsContact C-N 3.34Å; D187-I189 PolarHBondContact O-N 2.86Å; I189-S191 PolarHBondContact O-N 2.71Å; I189-S191 VanDerWaalsContact O-N 3.11Å | ||
| 190 | Y | 26.3 | Very low | 25.2 | Very low | 193 Ų | 193 | 142.3 Ų | 142.3 | 76% | 0.757 | 77% | 0.77 | S | S | * | * | trans | -64.6 | 103.6 | 167.5 | -104.7 | -91 | 0 | 0 | 0 | 107.5 | K188 G192 | K188-Y190 HydrophobicContact CB-CD2 3.98Å; K188-Y190 HydrophobicContact CB-CE2 4.36Å; K188-Y190 HydrophobicContact CD-CD2 4.5Å; K188-Y190 HydrophobicContact CD-CE2 4.07Å; K188-Y190 PolarHBondContact O-N 3.12Å; Y190-G192 VanDerWaalsContact C-N 3.27Å; Y190-G192 PolarHBondContact O-N 3.12Å | ||
| 191 | S | 23.6 | Very low | 25.3 | Very low | 125 Ų | 125 | 137 Ų | 137 | 87% | 0.874 | 77% | 0.767 | S | S | * | * | trans | -66.3 | 89.4 | 162.5 | -74.8 | 0 | 0 | 0 | 0 | 108.6 | I189 | I189-S191 PolarHBondContact O-N 2.71Å; I189-S191 VanDerWaalsContact O-N 3.11Å | ||
| 192 | G | 23.7 | Very low | 25.4 | Very low | 51 Ų | 51 | 137 Ų | 137 | 53% | 0.526 | 78% | 0.777 | S | S | . | * | trans | -153.5 | 81 | 177.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | Y190 T194 | Y190-G192 VanDerWaalsContact C-N 3.27Å; Y190-G192 PolarHBondContact O-N 3.12Å; G192-T194 PolarHBondContact O-N 3.08Å | ||
| 193 | D | 24.6 | Very low | 25.6 | Very low | 165 Ų | 165 | 142.7 Ų | 142.7 | 88% | 0.882 | 78% | 0.781 | S | S | * | * | trans | 24.7 | 92.5 | 150.2 | -61.6 | -30.3 | 0 | 0 | 0 | 117 | ||||
| 194 | T | 26.3 | Very low | 25.8 | Very low | 136 Ų | 136 | 141.8 Ų | 141.8 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | trans | -163.3 | 149.4 | 144.8 | 13.6 | 0 | 0 | 0 | 0 | 110.4 | G192 | G192-T194 PolarHBondContact O-N 3.08Š| ||
| 195 | P | 29.9 | Very low | 25.9 | Very low | 95 Ų | 95 | 143 Ų | 143 | 62% | 0.617 | 78% | 0.778 | S | S | * | * | trans | -92.2 | 146.9 | -135.1 | 34.5 | -36.9 | 0 | 0 | 0 | 115 | F197 | P195-F197 PolarHBondContact O-N 2.73Å; P195-F197 VanDerWaalsContact O-N 3.1Å | ||
| 196 | S | 22.4 | Very low | 26.2 | Very low | 106 Ų | 106 | 144.9 Ų | 144.9 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | trans | 18.8 | 76.1 | 149.8 | 66.8 | 0 | 0 | 0 | 0 | 117.1 | I198 | S196-I198 PolarHBondContact O-N 2.78Š| ||
| 197 | F | 25.8 | Very low | 26.3 | Very low | 202 Ų | 202 | 147.7 Ų | 147.7 | 89% | 0.886 | 78% | 0.778 | S | S | * | * | trans | -79.5 | 99.1 | 153.8 | -87.6 | -87.9 | 0 | 0 | 0 | 108.3 | P195 Y199 | P195-F197 PolarHBondContact O-N 2.73Å; P195-F197 VanDerWaalsContact O-N 3.1Å; F197-Y199 PolarHBondContact O-N 3.3Å | ||
| 198 | I | 26.8 | Very low | 26.5 | Very low | 151 Ų | 151 | 152.7 Ų | 152.7 | 77% | 0.774 | 79% | 0.785 | S | S | * | * | trans | -65.9 | 86.2 | 163.4 | -57.3 | 173.1 | 0 | 0 | 0 | 106.1 | S196 | S196-I198 PolarHBondContact O-N 2.78Š| ||
| 199 | Y | 25.8 | Very low | 26.5 | Very low | 211 Ų | 211 | 149.1 Ų | 149.1 | 83% | 0.827 | 78% | 0.782 | S | S | * | * | trans | -94.8 | 107.1 | 167.2 | -155 | -97.3 | 0 | 0 | 0 | 108.5 | F197 | F197-Y199 PolarHBondContact O-N 3.3Š| ||
| 200 | N | 27.1 | Very low | 26.6 | Very low | 135 Ų | 135 | 153 Ų | 153 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | trans | -50.7 | 146 | 177.5 | -88.5 | -31.7 | 0 | 0 | 0 | 112.2 | A202 | N200-A202 PolarHBondContact O-N 3.06Š| ||
| 201 | G | 24.6 | Very low | 26.7 | Very low | 84 Ų | 84 | 149.2 Ų | 149.2 | 87% | 0.866 | 78% | 0.78 | S | S | * | * | trans | -45.4 | 124.4 | -169.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 202 | A | 28.3 | Very low | 26.9 | Very low | 92 Ų | 92 | 150.5 Ų | 150.5 | 76% | 0.76 | 78% | 0.776 | S | S | * | * | trans | -125.3 | 93.9 | 155.1 | 0 | 0 | 0 | 0 | 0 | 107.9 | N200 | N200-A202 PolarHBondContact O-N 3.06Š| ||
| 203 | R | 26.6 | Very low | 27.1 | Very low | 236 Ų | 236 | 154 Ų | 154 | 89% | 0.891 | 79% | 0.787 | S | S | * | * | trans | -4.2 | 128 | 164.4 | -64 | 176.5 | 175.8 | -136 | -1.6 | 117.1 | K205 | R203-K205 PolarHBondContact O-N 3.24Š| ||
| 204 | E | 28.6 | Very low | 27.3 | Very low | 185 Ų | 185 | 151.7 Ų | 151.7 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | trans | -29.1 | 119.5 | 151.6 | -65.1 | 171.1 | 142.1 | 0 | 0 | 112.4 | ||||
| 205 | K | 28.2 | Very low | 27.5 | Very low | 158 Ų | 158 | 151.9 Ų | 151.9 | 69% | 0.687 | 78% | 0.78 | S | S | * | * | trans | -119.5 | 97.8 | 151.9 | -78.8 | -171.8 | 177.8 | -178.9 | 0 | 107.3 | R203 Y207 | R203-K205 PolarHBondContact O-N 3.24Å; K205-Y207 VanDerWaalsContact C-N 3.3Å; K205-Y207 HydrophobicContact CB-CD2 3.86Å; K205-Y207 HydrophobicContact CB-CE2 3.87Å; K205-Y207 HydrophobicContact CD-CE2 3.79Å; K205-Y207 HydrophobicContact CG-CE2 4.48Å; K205-Y207 PolarHBondContact O-N 3.43Å | ||
| 206 | P | 29 | Very low | 27.4 | Very low | 117 Ų | 117 | 153.4 Ų | 153.4 | 76% | 0.76 | 78% | 0.783 | S | S | * | * | trans | -69 | 91.4 | 170.4 | 27 | -30.3 | 0 | 0 | 0 | 108.6 | W208 | P206-W208 PolarHBondContact O-N 2.93Š| ||
| 207 | Y | 28.9 | Very low | 27.6 | Very low | 183 Ų | 183 | 155.7 Ų | 155.7 | 72% | 0.718 | 79% | 0.785 | S | S | * | * | trans | -76.3 | 71.7 | 171.6 | -90.4 | -88.2 | 0 | 0 | 0 | 110 | K205 | K205-Y207 VanDerWaalsContact C-N 3.3Å; K205-Y207 HydrophobicContact CB-CD2 3.86Å; K205-Y207 HydrophobicContact CB-CE2 3.87Å; K205-Y207 HydrophobicContact CD-CE2 3.79Å; K205-Y207 HydrophobicContact CG-CE2 4.48Å; K205-Y207 PolarHBondContact O-N 3.43Å | ||
| 208 | W | 28.6 | Very low | 27.7 | Very low | 252 Ų | 252 | 154 Ų | 154 | 96% | 0.955 | 78% | 0.777 | S | S | * | * | trans | -135.8 | 59.1 | 153 | -63.7 | 97.2 | 0 | 0 | 0 | 106.9 | P206 R210 | P206-W208 PolarHBondContact O-N 2.93Å; W208-R210 PolarHBondContact O-N 3.01Å | ||
| 209 | S | 26.3 | Very low | 27.7 | Very low | 96 Ų | 96 | 155 Ų | 155 | 67% | 0.671 | 78% | 0.779 | S | S | * | * | trans | -72.2 | 125.9 | 168.3 | -152.9 | 0 | 0 | 0 | 0 | 107.7 | D211 | S209-D211 VanDerWaalsContact C-N 3.29Å; S209-D211 PolarHBondContact O-N 3.49Å; S209-D211 PolarHBondContact OG-OD2 3.28Å | ||
| 210 | R | 26.8 | Very low | 27.7 | Very low | 240 Ų | 240 | 153.7 Ų | 153.7 | 91% | 0.906 | 78% | 0.78 | S | S | * | * | trans | -92.7 | 62.7 | -170.1 | -168.7 | -172.6 | -175.4 | 177.9 | 1.4 | 108.4 | W208 | W208-R210 PolarHBondContact O-N 3.01Š| ||
| 211 | D | 28.2 | Very low | 27.6 | Very low | 114 Ų | 114 | 153 Ų | 153 | 61% | 0.61 | 78% | 0.781 | S | S | * | * | trans | -133.5 | 133.7 | -177.8 | -56.7 | -59.6 | 0 | 0 | 0 | 109.9 | S209 | S209-D211 VanDerWaalsContact C-N 3.29Å; S209-D211 PolarHBondContact O-N 3.49Å; S209-D211 PolarHBondContact OG-OD2 3.28Å | ||
| 212 | D | 27.7 | Very low | 27.7 | Very low | 151 Ų | 151 | 156.8 Ų | 156.8 | 81% | 0.807 | 78% | 0.78 | S | S | * | * | trans | 85.2 | 36.8 | 156.4 | -51.8 | -24.1 | 0 | 0 | 0 | 121 | ||||
| 213 | V | 29.6 | Very low | 27.6 | Very low | 125 Ų | 125 | 157.3 Ų | 157.3 | 76% | 0.758 | 78% | 0.778 | S | S | * | * | trans | -97.9 | 85.7 | 148.3 | -167.9 | 0 | 0 | 0 | 0 | 108.5 | L215 | V213-L215 HydrophobicContact CG1-CD1 3.75Å; V213-L215 PolarHBondContact O-N 3.06Å | ||
| 214 | S | 27.7 | Very low | 27.4 | Very low | 117 Ų | 117 | 157.5 Ų | 157.5 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -59.1 | 78.9 | 160.8 | 57.1 | 0 | 0 | 0 | 0 | 108.7 | D216 | S214-D216 PolarHBondContact O-N 3.38Š| ||
| 215 | L | 30.3 | Very low | 27.3 | Very low | 140 Ų | 140 | 155.9 Ų | 155.9 | 73% | 0.733 | 78% | 0.775 | S | S | * | * | trans | -71.9 | 104 | 170.2 | -138.8 | 83.8 | 0 | 0 | 0 | 105.9 | V213 I217 | V213-L215 HydrophobicContact CG1-CD1 3.75Å; V213-L215 PolarHBondContact O-N 3.06Å; L215-I217 WeakPolarHBondContact O-CG1 3.37Å; L215-I217 PolarHBondContact O-N 3.44Å | ||
| 216 | D | 27.9 | Very low | 27.2 | Very low | 127 Ų | 127 | 152.2 Ų | 152.2 | 68% | 0.679 | 77% | 0.774 | S | S | * | * | trans | -40.5 | 98.9 | 174.4 | -159.7 | 10.7 | 0 | 0 | 0 | 109.2 | S214 K218 | S214-D216 PolarHBondContact O-N 3.38Å; D216-K218 PolarHBondContact O-N 2.91Å | ||
| 217 | I | 26.9 | Very low | 27 | Very low | 153 Ų | 153 | 149.6 Ų | 149.6 | 79% | 0.785 | 77% | 0.768 | S | S | * | * | trans | -72.3 | 68.6 | 177.1 | -57 | 170.7 | 0 | 0 | 0 | 105.7 | L215 Q219 | L215-I217 WeakPolarHBondContact O-CG1 3.37Å; L215-I217 PolarHBondContact O-N 3.44Å; I217-Q219 VanDerWaalsContact C-N 3.27Å; I217-Q219 PolarHBondContact O-N 2.81Å | ||
| 218 | K | 28.4 | Very low | 26.8 | Very low | 166 Ų | 166 | 150.4 Ų | 150.4 | 72% | 0.722 | 77% | 0.771 | S | S | * | * | trans | -67.6 | 102.3 | 159.5 | -80.6 | -173.8 | -179.3 | 176.5 | 0 | 105.4 | D216 Q220 | D216-K218 PolarHBondContact O-N 2.91Å; K218-Q220 PolarHBondContact O-N 3.1Å | ||
| 219 | Q | 26.6 | Very low | 26.7 | Very low | 174 Ų | 174 | 146 Ų | 146 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | trans | -38.3 | 76.8 | 165.8 | -64.1 | 164.8 | -4.6 | 0 | 0 | 111.1 | I217 T221 | I217-Q219 VanDerWaalsContact C-N 3.27Å; I217-Q219 PolarHBondContact O-N 2.81Å; Q219-T221 PolarHBondContact O-N 2.76Å | ||
| 220 | Q | 25.7 | Very low | 26.7 | Very low | 183 Ų | 183 | 148.1 Ų | 148.1 | 86% | 0.855 | 77% | 0.77 | S | S | * | * | trans | -76 | 87.8 | 153.7 | -84.9 | -173.2 | -9.5 | 0 | 0 | 105 | K218 L222 | K218-Q220 PolarHBondContact O-N 3.1Å; Q220-L222 PolarHBondContact O-N 3.03Å | ||
| 221 | T | 24.6 | Very low | 26.8 | Very low | 120 Ų | 120 | 141.5 Ų | 141.5 | 74% | 0.736 | 76% | 0.757 | S | S | * | * | trans | -40.9 | 102.9 | 165.2 | -54 | 0 | 0 | 0 | 0 | 107.7 | Q219 S223 | Q219-T221 PolarHBondContact O-N 2.76Å; T221-S223 PolarHBondContact O-N 3.19Å | ||
| 222 | L | 28 | Very low | 26.9 | Very low | 164 Ų | 164 | 142.8 Ų | 142.8 | 86% | 0.859 | 77% | 0.769 | S | S | * | * | trans | -57.2 | 106.4 | 174.8 | -143.4 | 92.3 | 0 | 0 | 0 | 105.8 | Q220 R224 | Q220-L222 PolarHBondContact O-N 3.03Å; L222-R224 VanDerWaalsContact C-N 3.35Å; L222-R224 PolarHBondContact O-N 3.06Å | ||
| 223 | S | 24.9 | Very low | 26.9 | Very low | 103 Ų | 103 | 141.5 Ų | 141.5 | 72% | 0.72 | 77% | 0.767 | S | S | * | * | trans | -58.5 | 104.7 | 175.9 | -36.5 | 0 | 0 | 0 | 0 | 106.6 | T221 I225 | T221-S223 PolarHBondContact O-N 3.19Å; S223-I225 PolarHBondContact O-N 3.24Å | ||
| 224 | R | 22.2 | Very low | 26.7 | Very low | 239 Ų | 239 | 143.5 Ų | 143.5 | 90% | 0.902 | 77% | 0.768 | S | S | * | * | trans | -66.6 | 80.8 | -178.7 | -165.6 | -173.5 | -154.2 | -174.8 | 6.4 | 107.9 | L222 A226 | L222-R224 VanDerWaalsContact C-N 3.35Å; L222-R224 PolarHBondContact O-N 3.06Å; R224-A226 PolarHBondContact O-N 3.39Å | ||
| 225 | I | 26.2 | Very low | 26.7 | Very low | 151 Ų | 151 | 143.5 Ų | 143.5 | 77% | 0.774 | 77% | 0.765 | S | S | * | * | trans | -70.5 | 102.5 | 168.5 | -59.5 | 174.7 | 0 | 0 | 0 | 105.8 | S223 | S223-I225 PolarHBondContact O-N 3.24Š| ||
| 226 | A | 26.8 | Very low | 26.7 | Very low | 82 Ų | 82 | 148.4 Ų | 148.4 | 68% | 0.678 | 77% | 0.774 | S | S | * | * | trans | -67.7 | 133.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | R224 | R224-A226 PolarHBondContact O-N 3.39Š| ||
| 227 | G | 24.8 | Very low | 26.8 | Very low | 61 Ų | 61 | 148.9 Ų | 148.9 | 63% | 0.629 | 78% | 0.776 | S | S | * | * | trans | 83.4 | 46.2 | 137.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 228 | Y | 23.9 | Very low | 26.8 | Very low | 200 Ų | 200 | 147 Ų | 147 | 78% | 0.784 | 78% | 0.777 | S | S | * | * | trans | -112.4 | 85.8 | 151.1 | -70.1 | -76.8 | 0 | 0 | 0 | 109.7 | L230 | Y228-L230 PolarHBondContact O-N 2.75Š| ||
| 229 | N | 26.8 | Very low | 26.8 | Very low | 160 Ų | 160 | 148.4 Ų | 148.4 | 86% | 0.856 | 78% | 0.779 | S | S | * | * | trans | -66.8 | 83.2 | 159.6 | -68.5 | -50.4 | 0 | 0 | 0 | 107.2 | P231 | N229-P231 VanDerWaalsContact O-CD 3.28Å; N229-P231 WeakPolarHBondContact O-CD 3.35Å | ||
| 230 | L | 26.4 | Very low | 27.1 | Very low | 141 Ų | 141 | 149.6 Ų | 149.6 | 74% | 0.738 | 78% | 0.776 | S | S | * | * | trans | -69.1 | 120.3 | 165.6 | -103.6 | 85.7 | 0 | 0 | 0 | 107.3 | Y228 V232 | Y228-L230 PolarHBondContact O-N 2.75Å; L230-V232 PolarHBondContact O-N 3.19Å | ||
| 231 | P | 29.6 | Very low | 27.2 | Very low | 100 Ų | 100 | 149.5 Ų | 149.5 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | trans | -59.1 | 132 | 169.6 | 24.2 | -30.4 | 0 | 0 | 0 | 108.1 | N229 T233 | N229-P231 VanDerWaalsContact O-CD 3.28Å; N229-P231 WeakPolarHBondContact O-CD 3.35Å; P231-T233 PolarHBondContact O-N 2.91Å | ||
| 232 | V | 29.5 | Very low | 27.6 | Very low | 141 Ų | 141 | 152.3 Ų | 152.3 | 86% | 0.855 | 78% | 0.783 | S | S | * | * | trans | -66.2 | 81.9 | 171.8 | -176.8 | 0 | 0 | 0 | 0 | 107.1 | L230 Q234 | L230-V232 PolarHBondContact O-N 3.19Å; V232-Q234 VanDerWaalsContact C-N 3.33Å; V232-Q234 PolarHBondContact O-N 3.23Å | ||
| 233 | T | 27.5 | Very low | 27.7 | Very low | 125 Ų | 125 | 152.8 Ų | 152.8 | 77% | 0.767 | 78% | 0.781 | S | S | * | * | trans | -71.2 | 96.4 | 170.4 | 31.2 | 0 | 0 | 0 | 0 | 107.1 | P231 | P231-T233 PolarHBondContact O-N 2.91Š| ||
| 234 | Q | 26.3 | Very low | 27.8 | Very low | 167 Ų | 167 | 154.1 Ų | 154.1 | 78% | 0.78 | 79% | 0.79 | S | S | * | * | trans | -48.5 | 135.2 | 162.1 | -103 | 176.5 | -15.7 | 0 | 0 | 108.6 | V232 R236 | V232-Q234 VanDerWaalsContact C-N 3.33Å; V232-Q234 PolarHBondContact O-N 3.23Å; Q234-R236 VanDerWaalsContact C-N 3.32Å; Q234-R236 PolarHBondContact O-N 3.04Å | ||
| 235 | P | 26.6 | Very low | 28.1 | Very low | 117 Ų | 117 | 147.7 Ų | 147.7 | 76% | 0.76 | 78% | 0.777 | S | S | * | * | trans | -67.6 | 95.9 | 177.3 | 27.7 | -30.4 | 0 | 0 | 0 | 107.3 | D237 | P235-D237 PolarHBondContact O-N 3.47Š| ||
| 236 | R | 30.7 | Very low | 28.1 | Very low | 243 Ų | 243 | 145.9 Ų | 145.9 | 92% | 0.917 | 78% | 0.778 | S | S | * | * | trans | -76.8 | 119.9 | 161.8 | -110.2 | -168.8 | -178 | -166.8 | 2 | 106.1 | Q234 S238 | Q234-R236 VanDerWaalsContact C-N 3.32Å; Q234-R236 PolarHBondContact O-N 3.04Å; R236-S238 PolarHBondContact O-N 3.38Å | ||
| 237 | D | 30.4 | Very low | 28.2 | Very low | 136 Ų | 136 | 152.5 Ų | 152.5 | 73% | 0.727 | 79% | 0.787 | S | S | * | * | trans | -44.4 | 128 | -175.5 | -59.9 | -53.9 | 0 | 0 | 0 | 111.9 | P235 Y239 | P235-D237 PolarHBondContact O-N 3.47Å; D237-Y239 PolarHBondContact O-N 2.9Å | ||
| 238 | S | 26.9 | Very low | 28.2 | Very low | 113 Ų | 113 | 152.5 Ų | 152.5 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | trans | -47.7 | 90.9 | 175.2 | 42.9 | 0 | 0 | 0 | 0 | 112.5 | R236 | R236-S238 PolarHBondContact O-N 3.38Š| ||
| 239 | Y | 29.5 | Very low | 28.3 | Very low | 197 Ų | 197 | 151.6 Ų | 151.6 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | trans | -111.5 | 93.4 | 156.7 | -76.9 | -89.9 | 0 | 0 | 0 | 109.1 | D237 | D237-Y239 PolarHBondContact O-N 2.9Š| ||
| 240 | W | 31.3 | Very low | 28.4 | Very low | 199 Ų | 199 | 149.3 Ų | 149.3 | 75% | 0.754 | 78% | 0.784 | S | S | * | * | trans | 61.1 | 92 | 146.2 | -59.3 | 88.3 | 0 | 0 | 0 | 116.9 | K242 | W240-K242 PolarHBondContact O-N 2.91Š| ||
| 241 | L | 28.6 | Very low | 28.7 | Very low | 181 Ų | 181 | 151.8 Ų | 151.8 | 95% | 0.948 | 79% | 0.792 | S | S | * | * | 0 | 73.5 | 118.9 | -135.1 | 88.6 | 0 | 0 | 0 | 114.7 | |||||
| 242 | K | 32.1 | Very low | 28.5 | Very low | 179 Ų | 179 | 154.9 Ų | 154.9 | 78% | 0.778 | 80% | 0.797 | S | S | * | * | trans | -141.5 | 82.2 | 164.8 | -85.2 | -169.9 | 179.2 | 179.7 | 0 | 107.3 | W240 | W240-K242 PolarHBondContact O-N 2.91Š| ||
| 243 | Q | 30.6 | Very low | 28.3 | Very low | 174 Ų | 174 | 154.2 Ų | 154.2 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | trans | 171.3 | 101.2 | 135 | -91.9 | 169.9 | 27 | 0 | 0 | 106.3 | T245 | Q243-T245 PolarHBondContact O-N 3.18Å; Q243-T245 PolarHBondContact O-OG1 3.37Å | ||
| 244 | S | 26.3 | Very low | 28.3 | Very low | 131 Ų | 131 | 156.4 Ų | 156.4 | 92% | 0.916 | 79% | 0.794 | S | S | * | * | trans | -64.3 | 80.3 | 165.1 | -3.9 | 0 | 0 | 0 | 0 | 107.5 | S246 | S244-S246 VanDerWaalsContact C-N 3.31Å; S244-S246 PolarHBondContact O-N 3.06Å; S244-S246 VanDerWaalsContact O-N 3.08Å | ||
| 245 | T | 28.8 | Very low | 28.3 | Very low | 103 Ų | 103 | 157.3 Ų | 157.3 | 63% | 0.632 | 80% | 0.796 | S | S | * | * | trans | -73.7 | 96.6 | 162.7 | 18.8 | 0 | 0 | 0 | 0 | 106.4 | Q243 Y247 | Q243-T245 PolarHBondContact O-N 3.18Å; Q243-T245 PolarHBondContact O-OG1 3.37Å; T245-Y247 PolarHBondContact O-N 2.9Å | ||
| 246 | S | 26.7 | Very low | 28.4 | Very low | 114 Ų | 114 | 158 Ų | 158 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | trans | -47.3 | 109.9 | 164.2 | 177.1 | 0 | 0 | 0 | 0 | 108 | S244 G248 | S244-S246 VanDerWaalsContact C-N 3.31Å; S244-S246 PolarHBondContact O-N 3.06Å; S244-S246 VanDerWaalsContact O-N 3.08Å; S246-G248 PolarHBondContact O-N 2.84Å | ||
| 247 | Y | 29.2 | Very low | 28 | Very low | 221 Ų | 221 | 152.3 Ų | 152.3 | 87% | 0.867 | 79% | 0.785 | S | S | * | * | trans | -66.8 | 91.5 | 168.6 | -73.7 | -87.4 | 0 | 0 | 0 | 106.8 | T245 E249 | T245-Y247 PolarHBondContact O-N 2.9Å; Y247-E249 PolarHBondContact O-N 3.37Å | ||
| 248 | G | 25 | Very low | 27.9 | Very low | 61 Ų | 61 | 157 Ų | 157 | 63% | 0.629 | 79% | 0.793 | S | S | * | * | trans | -59.2 | 132 | 161.1 | 0 | 0 | 0 | 0 | 0 | 107.9 | S246 | S246-G248 PolarHBondContact O-N 2.84Š| ||
| 249 | E | 25.1 | Very low | 27.8 | Very low | 181 Ų | 181 | 159 Ų | 159 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | -45.7 | 140.6 | 174.2 | -115.3 | -165.5 | 142.6 | 0 | 0 | 111 | Y247 E251 | Y247-E249 PolarHBondContact O-N 3.37Å; E249-E251 PolarHBondContact O-N 3.1Å | ||
| 250 | P | 29.6 | Very low | 27.8 | Very low | 112 Ų | 112 | 156.7 Ų | 156.7 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -71 | 92.2 | -178.2 | 28.9 | -32.8 | 0 | 0 | 0 | 109.9 | H252 | P250-H252 PolarHBondContact O-N 2.96Š| ||
| 251 | E | 31.6 | Very low | 27.6 | Very low | 193 Ų | 193 | 157.5 Ų | 157.5 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | trans | -61.6 | 126.5 | 165.6 | -73.1 | -133.6 | 161.6 | 0 | 0 | 109.6 | E249 | E249-E251 PolarHBondContact O-N 3.1Š| ||
| 252 | H | 26.5 | Very low | 27.5 | Very low | 164 Ų | 164 | 155.8 Ų | 155.8 | 76% | 0.759 | 78% | 0.784 | S | S | * | * | trans | -62.7 | 136.6 | -174.9 | -69.9 | -100.1 | 0 | 0 | 0 | 112.3 | P250 | P250-H252 PolarHBondContact O-N 2.96Š| ||
| 253 | L | 25 | Very low | 27.2 | Very low | 127 Ų | 127 | 153.1 Ų | 153.1 | 67% | 0.665 | 79% | 0.788 | S | S | * | * | trans | 58 | 103.6 | 139.8 | -63.5 | 166.6 | 0 | 0 | 0 | 118.4 | F255 | L253-F255 HydrophobicContact CD2-CD2 4.17Å; L253-F255 HydrophobicContact CD2-CE2 3.81Å | ||
| 254 | L | 27.4 | Very low | 26.9 | Very low | 172 Ų | 172 | 153.9 Ų | 153.9 | 90% | 0.901 | 79% | 0.792 | S | S | * | * | trans | -139.1 | 104.3 | 133.5 | -79.5 | 179.3 | 0 | 0 | 0 | 110.2 | V256 | L254-V256 PolarHBondContact O-N 3.05Š| ||
| 255 | F | 26.2 | Very low | 26.9 | Very low | 186 Ų | 186 | 155 Ų | 155 | 82% | 0.816 | 79% | 0.787 | S | S | * | * | trans | -55.9 | 112.9 | 163 | -81.1 | -98.3 | 0 | 0 | 0 | 109.6 | L253 | L253-F255 HydrophobicContact CD2-CD2 4.17Å; L253-F255 HydrophobicContact CD2-CE2 3.81Å | ||
| 256 | V | 29 | Very low | 26.8 | Very low | 130 Ų | 130 | 159 Ų | 159 | 79% | 0.788 | 80% | 0.799 | S | S | * | * | trans | -123.2 | 89.4 | 158 | -174.5 | 0 | 0 | 0 | 0 | 108 | L254 R258 | L254-V256 PolarHBondContact O-N 3.05Å; V256-R258 PolarHBondContact O-N 2.85Å | ||
| 257 | N | 23.1 | Very low | 26.8 | Very low | 125 Ų | 125 | 158.1 Ų | 158.1 | 67% | 0.668 | 79% | 0.793 | S | S | * | * | trans | -67.3 | 113.8 | 164.7 | -178.9 | 3 | 0 | 0 | 0 | 108.7 | ||||
| 258 | R | 28.1 | Very low | 26.7 | Very low | 233 Ų | 233 | 155 Ų | 155 | 88% | 0.879 | 79% | 0.79 | S | S | * | * | trans | -152.7 | 112.3 | 152.9 | -111.6 | -176.9 | -167.3 | -176.9 | 3.9 | 110.8 | V256 | V256-R258 PolarHBondContact O-N 2.85Š| ||
| 259 | H | 25.2 | Very low | 26.6 | Very low | 157 Ų | 157 | 157.2 Ų | 157.2 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | -50.9 | 130.4 | 162.3 | -58.9 | -78.3 | 0 | 0 | 0 | 111.9 | ||||
| 260 | D | 29.5 | Very low | 26.5 | Very low | 148 Ų | 148 | 155.1 Ų | 155.1 | 79% | 0.791 | 80% | 0.795 | S | S | * | * | trans | -172.2 | 99.4 | 144.4 | -93 | -30.2 | 0 | 0 | 0 | 107.4 | ||||
| 261 | R | 26.1 | Very low | 26.3 | Very low | 215 Ų | 215 | 155.9 Ų | 155.9 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | 65.7 | 113.8 | 92.6 | -80 | -163.9 | 174 | -153.3 | 0.5 | 114.5 | |||||
| 262 | L | 26.4 | Very low | 25.8 | Very low | 145 Ų | 145 | 157.7 Ų | 157.7 | 76% | 0.759 | 80% | 0.796 | S | S | * | * | trans | 57.3 | 113.5 | 144.9 | -71.7 | 89.5 | 0 | 0 | 0 | 117.6 | ||||
| 263 | S | 25.4 | Very low | 25.8 | Very low | 123 Ų | 123 | 156.4 Ų | 156.4 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | 167.5 | 138.9 | 103.3 | 41.3 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 264 | H | 24.4 | Very low | 25.8 | Very low | 191 Ų | 191 | 155.3 Ų | 155.3 | 88% | 0.884 | 80% | 0.797 | S | S | * | * | trans | -64 | 127.4 | 173.8 | -72.4 | -58.3 | 0 | 0 | 0 | 111.4 | ||||
| 265 | D | 27.7 | Very low | 25.8 | Very low | 154 Ų | 154 | 155.7 Ų | 155.7 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | trans | -163.1 | 79.3 | 143.4 | -110.5 | -18.3 | 0 | 0 | 0 | 107.7 | S267 | D265-S267 PolarHBondContact O-N 2.61Š| ||
| 266 | E | 25.8 | Very low | 25.7 | Very low | 187 Ų | 187 | 151.9 Ų | 151.9 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | trans | -68.8 | 82.9 | 160 | -88.8 | -174.9 | 151.4 | 0 | 0 | 107.2 | L268 | E266-L268 PolarHBondContact O-N 2.74Š| ||
| 267 | S | 26.8 | Very low | 25.6 | Very low | 96 Ų | 96 | 150.7 Ų | 150.7 | 67% | 0.671 | 78% | 0.783 | S | S | * | * | trans | -61.1 | 90.3 | 161.6 | 41.5 | 0 | 0 | 0 | 0 | 107.3 | D265 C269 | D265-S267 PolarHBondContact O-N 2.61Å; S267-C269 VanDerWaalsContact C-N 3.27Å; S267-C269 PolarHBondContact O-N 2.77Å; S267-C269 PolarHBondContact O-SG 3.05Å; S267-C269 VanDerWaalsContact O-SG 3.41Å | ||
| 268 | L | 26.7 | Very low | 25.7 | Very low | 154 Ų | 154 | 152.4 Ų | 152.4 | 81% | 0.806 | 79% | 0.793 | S | S | * | * | trans | -57.2 | 96.2 | 167 | -78.1 | 163.4 | 0 | 0 | 0 | 107.5 | E266 T270 | E266-L268 PolarHBondContact O-N 2.74Å; L268-T270 PolarHBondContact O-N 3.03Å | ||
| 269 | C | 22.9 | Very low | 25.5 | Very low | 108 Ų | 108 | 148.4 Ų | 148.4 | 73% | 0.73 | 79% | 0.788 | S | S | * | * | trans | -54.2 | 101.8 | 172.9 | -55.4 | 0 | 0 | 0 | 0 | 108.3 | S267 V271 | S267-C269 VanDerWaalsContact C-N 3.27Å; S267-C269 PolarHBondContact O-N 2.77Å; S267-C269 PolarHBondContact O-SG 3.05Å; S267-C269 VanDerWaalsContact O-SG 3.41Å; C269-V271 PolarHBondContact O-N 2.7Å | ||
| 270 | T | 22.3 | Very low | 25.4 | Very low | 138 Ų | 138 | 148.3 Ų | 148.3 | 85% | 0.847 | 79% | 0.793 | S | S | * | * | trans | -70.6 | 81.9 | 170.8 | 23.1 | 0 | 0 | 0 | 0 | 107.6 | L268 R272 | L268-T270 PolarHBondContact O-N 3.03Å; T270-R272 VanDerWaalsContact C-N 3.32Å; T270-R272 PolarHBondContact O-N 3.41Å | ||
| 271 | V | 25.9 | Very low | 25.1 | Very low | 128 Ų | 128 | 146.4 Ų | 146.4 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -72.9 | 96.2 | 169.5 | -180 | 0 | 0 | 0 | 0 | 107.4 | C269 N273 | C269-V271 PolarHBondContact O-N 2.7Å; V271-N273 PolarHBondContact O-N 2.82Å | ||
| 272 | R | 22.6 | Very low | 24.9 | Very low | 231 Ų | 231 | 141 Ų | 141 | 87% | 0.872 | 78% | 0.781 | S | S | * | * | trans | -52.7 | 101.5 | 172.7 | -171.8 | 177 | -173.5 | 170.4 | 1.2 | 109.4 | T270 S274 | T270-R272 VanDerWaalsContact C-N 3.32Å; T270-R272 PolarHBondContact O-N 3.41Å; R272-S274 PolarHBondContact O-N 3.3Å | ||
| 273 | N | 24.5 | Very low | 24.7 | Very low | 137 Ų | 137 | 139.1 Ų | 139.1 | 73% | 0.733 | 78% | 0.779 | S | S | * | * | trans | -83.5 | 111.8 | 179.3 | -146.6 | -5.2 | 0 | 0 | 0 | 108.8 | V271 F275 | V271-N273 PolarHBondContact O-N 2.82Å; N273-F275 PolarHBondContact O-N 2.92Å | ||
| 274 | S | 25.5 | Very low | 24.6 | Very low | 103 Ų | 103 | 144.6 Ų | 144.6 | 72% | 0.72 | 78% | 0.781 | S | S | * | * | trans | -77 | 19.8 | -169.9 | -51.4 | 0 | 0 | 0 | 0 | 115.4 | R272 | R272-S274 PolarHBondContact O-N 3.3Š| ||
| 275 | F | 28 | Very low | 24.5 | Very low | 180 Ų | 180 | 142.3 Ų | 142.3 | 79% | 0.789 | 78% | 0.775 | S | S | * | * | trans | -125.3 | 76.7 | -177.9 | -69.6 | -81.1 | 0 | 0 | 0 | 111 | N273 P277 | N273-F275 PolarHBondContact O-N 2.92Å; F275-P277 WeakPolarHBondContact O-CD 3.43Å | ||
| 276 | S | 23.1 | Very low | 24.3 | Very low | 106 Ų | 106 | 138 Ų | 138 | 74% | 0.741 | 77% | 0.767 | S | S | * | * | trans | -102.9 | 96 | 159.6 | -71.3 | 0 | 0 | 0 | 0 | 108.7 | N278 | S276-N278 PolarHBondContact O-N 3.19Š| ||
| 277 | P | 27.8 | Very low | 24.2 | Very low | 106 Ų | 106 | 136.2 Ų | 136.2 | 69% | 0.688 | 76% | 0.763 | S | S | * | * | trans | -72.1 | 120.2 | 156 | 27.8 | -23 | 0 | 0 | 0 | 107.2 | F275 L279 | F275-P277 WeakPolarHBondContact O-CD 3.43Å; P277-L279 VanDerWaalsContact C-N 3.29Å; P277-L279 PolarHBondContact O-N 2.95Å | ||
| 278 | N | 24.6 | Very low | 24.1 | Very low | 161 Ų | 161 | 136 Ų | 136 | 86% | 0.861 | 76% | 0.762 | S | S | * | * | trans | -53.9 | 83.9 | 174.6 | -73.9 | -48 | 0 | 0 | 0 | 111.7 | S276 | S276-N278 PolarHBondContact O-N 3.19Š| ||
| 279 | L | 24.5 | Very low | 24 | Very low | 148 Ų | 148 | 136.8 Ų | 136.8 | 78% | 0.775 | 77% | 0.766 | S | S | * | * | trans | -103 | 81.3 | 162.6 | -88.8 | 158.1 | 0 | 0 | 0 | 107.5 | P277 V281 | P277-L279 VanDerWaalsContact C-N 3.29Å; P277-L279 PolarHBondContact O-N 2.95Å; L279-V281 PolarHBondContact O-N 2.78Å | ||
| 280 | N | 22.7 | Very low | 24.2 | Very low | 156 Ų | 156 | 139 Ų | 139 | 83% | 0.834 | 77% | 0.77 | S | S | * | * | trans | -70.2 | 74.1 | 170.9 | -156.7 | 6 | 0 | 0 | 0 | 108 | S282 | N280-S282 VanDerWaalsContact C-N 3.28Å; N280-S282 PolarHBondContact O-N 3.31Å | ||
| 281 | V | 23.5 | Very low | 24.2 | Very low | 107 Ų | 107 | 137.9 Ų | 137.9 | 65% | 0.648 | 76% | 0.763 | S | S | * | * | trans | -76.8 | 90.9 | 170.7 | -176.3 | 0 | 0 | 0 | 0 | 106.4 | L279 C283 | L279-V281 PolarHBondContact O-N 2.78Å; V281-C283 VanDerWaalsContact C-N 3.28Å; V281-C283 PolarHBondContact O-N 3.44Å | ||
| 282 | S | 22.5 | Very low | 24.1 | Very low | 101 Ų | 101 | 138.7 Ų | 138.7 | 71% | 0.706 | 76% | 0.763 | S | S | * | * | trans | -64.7 | 92.7 | 167.1 | -177.1 | 0 | 0 | 0 | 0 | 107.9 | N280 R284 | N280-S282 VanDerWaalsContact C-N 3.28Å; N280-S282 PolarHBondContact O-N 3.31Å; S282-R284 VanDerWaalsContact C-N 3.29Å; S282-R284 PolarHBondContact O-N 3.44Å | ||
| 283 | C | 22.2 | Very low | 24.1 | Very low | 107 Ų | 107 | 135.6 Ų | 135.6 | 72% | 0.723 | 76% | 0.758 | S | S | * | * | trans | -66.7 | 94 | 167.1 | -65.7 | 0 | 0 | 0 | 0 | 107.3 | V281 N285 | V281-C283 VanDerWaalsContact C-N 3.28Å; V281-C283 PolarHBondContact O-N 3.44Å; C283-N285 PolarHBondContact O-N 2.96Å | ||
| 284 | R | 22 | Very low | 24.1 | Very low | 238 Ų | 238 | 137.5 Ų | 137.5 | 90% | 0.898 | 77% | 0.765 | S | S | * | * | trans | -65.5 | 101.3 | 172.7 | -163.1 | 175.8 | -174.8 | -162.9 | 1.1 | 107.3 | S282 G286 | S282-R284 VanDerWaalsContact C-N 3.29Å; S282-R284 PolarHBondContact O-N 3.44Å; R284-G286 PolarHBondContact O-N 3.44Å | ||
| 285 | N | 23.2 | Very low | 24.2 | Very low | 143 Ų | 143 | 138.8 Ų | 138.8 | 77% | 0.765 | 76% | 0.763 | S | S | * | * | trans | -67.6 | 78 | 178.9 | -157.3 | 13.8 | 0 | 0 | 0 | 109.2 | C283 N287 | C283-N285 PolarHBondContact O-N 2.96Å; N285-N287 PolarHBondContact O-N 2.76Å | ||
| 286 | G | 23.5 | Very low | 23.9 | Very low | 62 Ų | 62 | 134 Ų | 134 | 64% | 0.639 | 75% | 0.753 | S | S | * | * | trans | -94.3 | 74 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | R284 S288 | R284-G286 PolarHBondContact O-N 3.44Å; G286-S288 PolarHBondContact O-N 2.83Å | ||
| 287 | N | 23.5 | Very low | 24 | Very low | 150 Ų | 150 | 139.9 Ų | 139.9 | 80% | 0.802 | 76% | 0.76 | S | S | * | * | trans | -63.2 | 90.9 | 158.4 | -78.9 | -14.3 | 0 | 0 | 0 | 108.2 | N285 | N285-N287 PolarHBondContact O-N 2.76Š| ||
| 288 | S | 23.9 | Very low | 23.8 | Very low | 92 Ų | 92 | 139.1 Ų | 139.1 | 64% | 0.643 | 76% | 0.758 | S | S | * | * | trans | -139.5 | 95.8 | 161.6 | 64 | 0 | 0 | 0 | 0 | 109.5 | G286 L290 | G286-S288 PolarHBondContact O-N 2.83Å; S288-L290 PolarHBondContact O-N 2.79Å | ||
| 289 | L | 25.2 | Very low | 23.9 | Very low | 170 Ų | 170 | 136.7 Ų | 136.7 | 89% | 0.89 | 75% | 0.751 | S | S | * | * | trans | -38.5 | 95.5 | 152.7 | -70.7 | 138.9 | 0 | 0 | 0 | 110.6 | ||||
| 290 | L | 26.3 | Very low | 24 | Very low | 156 Ų | 156 | 137.8 Ų | 137.8 | 82% | 0.817 | 75% | 0.752 | S | S | * | * | trans | -135.7 | 86 | 161 | -78.9 | 174.4 | 0 | 0 | 0 | 108.3 | S288 | S288-L290 PolarHBondContact O-N 2.79Š| ||
| 291 | T | 23.1 | Very low | 24.1 | Very low | 114 Ų | 114 | 139.1 Ų | 139.1 | 70% | 0.699 | 75% | 0.75 | S | S | * | * | trans | -42.5 | 137.9 | 154.2 | -28.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 292 | N | 23.6 | Very low | 24.1 | Very low | 145 Ų | 145 | 139.1 Ų | 139.1 | 78% | 0.775 | 75% | 0.754 | S | S | * | * | trans | 69.5 | 81.8 | 165 | -55.5 | -26.7 | 0 | 0 | 0 | 117.4 | ||||
| 293 | Q | 23.7 | Very low | 24.2 | Very low | 166 Ų | 166 | 140.1 Ų | 140.1 | 78% | 0.776 | 76% | 0.756 | S | S | * | * | trans | -121.3 | 88.1 | 139.4 | -73 | -157.1 | 16.4 | 0 | 0 | 109.3 | N295 | Q293-N295 PolarHBondContact O-N 2.84Å; Q293-N295 PolarHBondContact OE1-ND2 3.15Å; Q293-N295 VanDerWaalsContact OE1-ND2 3.17Å | ||
| 294 | M | 22.8 | Very low | 24.4 | Very low | 177 Ų | 177 | 139.4 Ų | 139.4 | 87% | 0.872 | 75% | 0.752 | S | S | * | * | trans | -64.4 | 84.2 | 150.1 | -85.8 | -166.4 | 152.4 | 0 | 0 | 107.7 | ||||
| 295 | N | 28.1 | Very low | 24.5 | Very low | 129 Ų | 129 | 136.5 Ų | 136.5 | 69% | 0.69 | 76% | 0.755 | S | S | * | * | trans | -101.5 | 87.5 | 161.5 | -77.5 | -2.7 | 0 | 0 | 0 | 107.7 | Q293 | Q293-N295 PolarHBondContact O-N 2.84Å; Q293-N295 PolarHBondContact OE1-ND2 3.15Å; Q293-N295 VanDerWaalsContact OE1-ND2 3.17Å | ||
| 296 | S | 22.8 | Very low | 24.6 | Very low | 81 Ų | 81 | 133.5 Ų | 133.5 | 57% | 0.566 | 75% | 0.745 | S | S | * | * | trans | -59.7 | 152.5 | 155.5 | -49 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 297 | Y | 23.9 | Very low | 24.6 | Very low | 228 Ų | 228 | 134.3 Ų | 134.3 | 89% | 0.894 | 75% | 0.753 | S | S | * | * | trans | 77.2 | 122.5 | 175 | -48.1 | -80.2 | 0 | 0 | 0 | 113.7 | ||||
| 298 | S | 23.8 | Very low | 24.8 | Very low | 91 Ų | 91 | 135.5 Ų | 135.5 | 64% | 0.636 | 75% | 0.748 | S | S | * | * | cis | -157.8 | 140.6 | 36.4 | 179.7 | 0 | 0 | 0 | 0 | 109.7 | E300 | S298-E300 PolarHBondContact O-N 3.41Š| ||
| 299 | P | 26.4 | Very low | 24.8 | Very low | 110 Ų | 110 | 139.1 Ų | 139.1 | 71% | 0.714 | 75% | 0.754 | S | S | * | * | trans | -70.7 | 93.9 | 167.6 | 28.9 | -29.8 | 0 | 0 | 0 | 108.5 | F301 | P299-F301 PolarHBondContact O-N 2.93Š| ||
| 300 | E | 27.4 | Very low | 25.1 | Very low | 170 Ų | 170 | 138.2 Ų | 138.2 | 79% | 0.794 | 75% | 0.75 | S | S | * | * | trans | -64.3 | 106.9 | 169.6 | -75 | -177.7 | 166.5 | 0 | 0 | 108.6 | S298 C302 | S298-E300 PolarHBondContact O-N 3.41Å; E300-C302 VanDerWaalsContact C-N 3.28Å; E300-C302 PolarHBondContact O-N 2.96Å | ||
| 301 | F | 24.5 | Very low | 25.1 | Very low | 184 Ų | 184 | 136.1 Ų | 136.1 | 81% | 0.807 | 74% | 0.743 | S | S | * | * | trans | -53.4 | 87.8 | 165.3 | -91.9 | -104.1 | 0 | 0 | 0 | 109.8 | P299 T303 | P299-F301 PolarHBondContact O-N 2.93Å; F301-T303 VanDerWaalsContact C-N 3.33Å; F301-T303 HydrophobicContact CD1-CG2 4.28Å; F301-T303 PolarHBondContact O-N 3.5Å | ||
| 302 | C | 24 | Very low | 25.3 | Very low | 108 Ų | 108 | 134.3 Ų | 134.3 | 73% | 0.73 | 75% | 0.748 | S | S | * | * | trans | -90.6 | 79.9 | 160.6 | -77.9 | 0 | 0 | 0 | 0 | 108.1 | E300 S304 | E300-C302 VanDerWaalsContact C-N 3.28Å; E300-C302 PolarHBondContact O-N 2.96Å; C302-S304 PolarHBondContact O-N 2.74Å | ||
| 303 | T | 23.9 | Very low | 25.6 | Very low | 121 Ų | 121 | 132 Ų | 132 | 74% | 0.742 | 74% | 0.743 | S | S | * | * | trans | -67.3 | 72 | 160.9 | 43.9 | 0 | 0 | 0 | 0 | 109.1 | F301 N305 | F301-T303 VanDerWaalsContact C-N 3.33Å; F301-T303 HydrophobicContact CD1-CG2 4.28Å; F301-T303 PolarHBondContact O-N 3.5Å; T303-N305 PolarHBondContact O-N 3.01Å | ||
| 304 | S | 26.4 | Very low | 26 | Very low | 93 Ų | 93 | 129.6 Ų | 129.6 | 65% | 0.65 | 74% | 0.744 | S | S | * | * | trans | -97.3 | 88.7 | 169.4 | -60.3 | 0 | 0 | 0 | 0 | 107.1 | C302 S306 | C302-S304 PolarHBondContact O-N 2.74Å; S304-S306 PolarHBondContact O-N 2.96Å | ||
| 305 | N | 24.2 | Very low | 26.6 | Very low | 176 Ų | 176 | 129.6 Ų | 129.6 | 94% | 0.941 | 74% | 0.739 | S | S | * | * | trans | -56.5 | 79.9 | 159.4 | -88.4 | -16.4 | 0 | 0 | 0 | 108.7 | T303 | T303-N305 PolarHBondContact O-N 3.01Š| ||
| 306 | S | 25.5 | Very low | 27.2 | Very low | 80 Ų | 80 | 129.7 Ų | 129.7 | 56% | 0.559 | 74% | 0.74 | S | S | * | * | trans | -104.6 | 104.5 | 157.8 | 54.4 | 0 | 0 | 0 | 0 | 106.4 | S304 Y308 | S304-S306 PolarHBondContact O-N 2.96Å; S306-Y308 WeakPolarHBondContact O-CD1 3.36Å; S306-Y308 PolarHBondContact O-N 2.68Å | ||
| 307 | G | 23.9 | Very low | 27.9 | Very low | 79 Ų | 79 | 135 Ų | 135 | 81% | 0.814 | 76% | 0.755 | S | S | * | * | trans | -58.2 | 95.3 | 164.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | E309 | G307-E309 PolarHBondContact O-N 2.91Š| ||
| 308 | Y | 28 | Very low | 28.7 | Very low | 176 Ų | 176 | 126.9 Ų | 126.9 | 69% | 0.69 | 73% | 0.727 | S | S | * | * | trans | -74.4 | 90.5 | 156.2 | 40.5 | -86.3 | 0 | 0 | 0 | 105.3 | S306 L310 | S306-Y308 WeakPolarHBondContact O-CD1 3.36Å; S306-Y308 PolarHBondContact O-N 2.68Å; Y308-L310 HydrophobicContact CD2-CD1 4.08Å; Y308-L310 HydrophobicContact CD2-CG 4.26Å; Y308-L310 HydrophobicContact CE2-CD1 4.39Å; Y308-L310 PolarHBondContact O-N 3.01Å | ||
| 309 | E | 23 | Very low | 29.2 | Very low | 167 Ų | 167 | 127.9 Ų | 127.9 | 78% | 0.78 | 73% | 0.725 | S | S | * | * | trans | -45.1 | 99.1 | 145.4 | -79.9 | 178.9 | 134.3 | 0 | 0 | 106.4 | G307 T311 | G307-E309 PolarHBondContact O-N 2.91Å; E309-T311 HydrophobicContact CB-CG2 4.43Å; E309-T311 PolarHBondContact O-N 3.49Å | ||
| 310 | L | 30.9 | Very low | 30.2 | Very low | 151 Ų | 151 | 127.6 Ų | 127.6 | 79% | 0.791 | 72% | 0.723 | S | S | * | * | trans | -68.4 | 73.4 | 161.3 | -84 | 151.3 | 0 | 0 | 0 | 106 | Y308 G312 | Y308-L310 HydrophobicContact CD2-CD1 4.08Å; Y308-L310 HydrophobicContact CD2-CG 4.26Å; Y308-L310 HydrophobicContact CE2-CD1 4.39Å; Y308-L310 PolarHBondContact O-N 3.01Å; L310-G312 PolarHBondContact O-N 2.86Å | ||
| 311 | T | 27.6 | Very low | 30.9 | Very low | 112 Ų | 112 | 126.1 Ų | 126.1 | 69% | 0.687 | 72% | 0.72 | S | S | * | * | trans | -47.6 | 113.2 | 156.7 | 39.2 | 0 | 0 | 0 | 0 | 105.5 | E309 S313 | E309-T311 HydrophobicContact CB-CG2 4.43Å; E309-T311 PolarHBondContact O-N 3.49Å; T311-S313 PolarHBondContact O-N 3.48Å | ||
| 312 | G | 26.9 | Very low | 31.7 | Very low | 77 Ų | 77 | 121.7 Ų | 121.7 | 79% | 0.794 | 70% | 0.704 | S | S | * | * | trans | -56.3 | 92 | 179.9 | 0 | 0 | 0 | 0 | 0 | 109 | L310 S314 | L310-G312 PolarHBondContact O-N 2.86Å; G312-S314 PolarHBondContact O-N 2.83Å | ||
| 313 | S | 29.2 | Very low | 32.5 | Very low | 95 Ų | 95 | 120 Ų | 120 | 66% | 0.664 | 69% | 0.69 | S | S | * | * | trans | -66.1 | 108.2 | 173.6 | -179.2 | 0 | 0 | 0 | 0 | 106 | T311 K315 | T311-S313 PolarHBondContact O-N 3.48Å; S313-K315 PolarHBondContact O-N 2.85Å | ||
| 314 | S | 33.9 | Very low | 33.5 | Very low | 116 Ų | 116 | 118.8 Ų | 118.8 | 81% | 0.811 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.4 | 32.9 | -178 | 49.4 | 0 | 0 | 0 | 0 | 114 | G312 | G312-S314 PolarHBondContact O-N 2.83Š|
| 315 | K | 35.4 | Very low | 34.1 | Very low | 177 Ų | 177 | 117.4 Ų | 117.4 | 77% | 0.77 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.3 | 1.1 | -173 | -90.8 | -177 | 175.1 | 177.2 | 0 | 116.5 | S313 | S313-K315 PolarHBondContact O-N 2.85Š|
| 316 | N | 39.7 | Very low | 34.5 | Very low | 131 Ų | 131 | 116.6 Ų | 116.6 | 70% | 0.701 | 66% | 0.659 | S | S | * | * | trans | -105.4 | 75.6 | 172.1 | -71.6 | -8.9 | 0 | 0 | 0 | 109.9 | I318 | N316-I318 HydrophobicContact CB-CD1 3.93Å; N316-I318 HydrophobicContact CB-CG1 3.97Å; N316-I318 PolarHBondContact O-N 2.88Å | ||
| 317 | H | 37.2 | Very low | 35.1 | Very low | 192 Ų | 192 | 117.8 Ų | 117.8 | 89% | 0.889 | 67% | 0.665 | S | S | * | * | trans | -66.8 | 63.6 | 151.8 | -83.4 | -58.9 | 0 | 0 | 0 | 108.6 | ||||
| 318 | I | 41.7 | Very low | 35.7 | Very low | 59 Ų | 59 | 119.1 Ų | 119.1 | 30% | 0.303 | 66% | 0.662 | S | S | . | * | trans | -83 | 118.9 | 166.2 | -64 | 171.9 | 0 | 0 | 0 | 104.3 | N316 L322 V323 | N316-I318 HydrophobicContact CB-CD1 3.93Å; N316-I318 HydrophobicContact CB-CG1 3.97Å; N316-I318 PolarHBondContact O-N 2.88Å; I318-L322 HydrophobicContact CG2-CB 3.61Å; I318-V323 HydrophobicContact CB-CG2 4.04Å; I318-V323 HydrophobicContact CG2-CG2 3.74Å | ||
| 319 | N | 33.9 | Very low | 36.3 | Very low | 112 Ų | 112 | 117.5 Ų | 117.5 | 60% | 0.599 | 67% | 0.67 | S | S | * | * | trans | -45.6 | 133.5 | 171.1 | -103.9 | -33.8 | 0 | 0 | 0 | 108.6 | I321 L322 V323 | N319-I321 PolarHBondContact O-N 3.31Å; N319-L322 WeakPolarHBondContact O-CA 3.5Å; N319-L322 PolarHBondContact O-N 3.32Å; N319-V323 PolarHBondContact O-N 2.92Å | ||
| 320 | P | 46.8 | Very low | 36.8 | Very low | 104 Ų | 104 | 112.1 Ų | 112.1 | 68% | 0.675 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -56.2 | -25.4 | -177 | 17.8 | -29.5 | 0 | 0 | 0 | 113.1 | L322 V323 | P320-L322 VanDerWaalsContact C-N 3.27Å; P320-L322 PolarHBondContact O-N 3.5Å; P320-V323 PolarHBondContact O-N 3.47Å |
| 321 | I | 42.5 | Very low | 36.8 | Very low | 139 Ų | 139 | 109.5 Ų | 109.5 | 71% | 0.713 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -63.5 | -31.6 | 172.6 | -55.6 | 174.7 | 0 | 0 | 0 | 112.2 | N319 S324 | N319-I321 PolarHBondContact O-N 3.31Å; I321-S324 PolarHBondContact O-OG 3.08Å; I321-S324 VanDerWaalsContact O-OG 3.06Å |
| 322 | L | 41.6 | Very low | 37 | Very low | 91 Ų | 91 | 111.1 Ų | 111.1 | 48% | 0.476 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -93.3 | -12.7 | 177.7 | -64.4 | 177.8 | 0 | 0 | 0 | 113.1 | I318 N319 P320 S324 T325 | I318-L322 HydrophobicContact CG2-CB 3.61Å; N319-L322 WeakPolarHBondContact O-CA 3.5Å; N319-L322 PolarHBondContact O-N 3.32Å; P320-L322 VanDerWaalsContact C-N 3.27Å; P320-L322 PolarHBondContact O-N 3.5Å; L322-S324 PolarHBondContact O-N 3.4Å; L322-T325 VanDerWaalsContact C-OG1 3.28Å; L322-T325 VanDerWaalsContact CA-OG1 3.29Å; L322-T325 WeakPolarHBondContact CA-OG1 3.34Å; L322-T325 PolarHBondContact O-N 3.44Å; L322-T325 PolarHBondContact O-OG1 2.83Å |
| 323 | V | 40.9 | Very low | 37.1 | Very low | 71 Ų | 71 | 115.1 Ų | 115.1 | 43% | 0.43 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -63.9 | -33.2 | 173.3 | 174 | 0 | 0 | 0 | 0 | 110.2 | I318 N319 P320 T325 Y326 | I318-V323 HydrophobicContact CB-CG2 4.04Å; I318-V323 HydrophobicContact CG2-CG2 3.74Å; N319-V323 PolarHBondContact O-N 2.92Å; P320-V323 PolarHBondContact O-N 3.47Å; V323-T325 PolarHBondContact O-N 2.93Å; V323-Y326 PolarHBondContact O-N 3.16Å; V323-Y326 VanDerWaalsContact O-O 3.1Å |
| 324 | S | 43.6 | Very low | 37.1 | Very low | 97 Ų | 97 | 117.8 Ų | 117.8 | 68% | 0.678 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.5 | -11.4 | 173.3 | 65 | 0 | 0 | 0 | 0 | 114.2 | I321 L322 | I321-S324 PolarHBondContact O-OG 3.08Å; I321-S324 VanDerWaalsContact O-OG 3.06Å; L322-S324 PolarHBondContact O-N 3.4Å |
| 325 | T | 40.5 | Very low | 36.8 | Very low | 63 Ų | 63 | 118.4 Ų | 118.4 | 39% | 0.387 | 67% | 0.665 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.1 | -14.2 | 174.7 | 25.3 | 0 | 0 | 0 | 0 | 114.3 | L322 V323 | L322-T325 VanDerWaalsContact C-OG1 3.28Å; L322-T325 VanDerWaalsContact CA-OG1 3.29Å; L322-T325 WeakPolarHBondContact CA-OG1 3.34Å; L322-T325 PolarHBondContact O-N 3.44Å; L322-T325 PolarHBondContact O-OG1 2.83Å; V323-T325 PolarHBondContact O-N 2.93Å |
| 326 | Y | 32.6 | Very low | 36.5 | Very low | 159 Ų | 159 | 117.7 Ų | 117.7 | 62% | 0.624 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -116.3 | 112.4 | 177.3 | -66.3 | -79.8 | 0 | 0 | 0 | 109.7 | V323 S328 | V323-Y326 PolarHBondContact O-N 3.16Å; V323-Y326 VanDerWaalsContact O-O 3.1Å; Y326-S328 PolarHBondContact O-N 2.82Å; Y326-S328 VanDerWaalsContact O-N 3.1Å |
| 327 | P | 36.6 | Very low | 35.9 | Very low | 105 Ų | 105 | 122.7 Ų | 122.7 | 68% | 0.682 | 67% | 0.673 | S | S | * | * | trans | -58 | 122.9 | 169.4 | 22.9 | -29.6 | 0 | 0 | 0 | 107.9 | V329 | P327-V329 PolarHBondContact O-N 3.34Å; P327-V329 VanDerWaalsContact O-N 3.1Å | ||
| 328 | S | 38.3 | Very low | 35.7 | Very low | 108 Ų | 108 | 118.9 Ų | 118.9 | 76% | 0.755 | 67% | 0.668 | S | S | * | * | trans | -61 | 115.1 | 163.4 | -62.2 | 0 | 0 | 0 | 0 | 105.7 | Y326 G330 | Y326-S328 PolarHBondContact O-N 2.82Å; Y326-S328 VanDerWaalsContact O-N 3.1Å; S328-G330 PolarHBondContact O-N 3.01Å | ||
| 329 | V | 38.6 | Very low | 35.4 | Very low | 141 Ų | 141 | 120.3 Ų | 120.3 | 86% | 0.855 | 69% | 0.689 | S | S | * | * | trans | -73 | 73.6 | 173.9 | -163.1 | 0 | 0 | 0 | 0 | 106.6 | P327 | P327-V329 PolarHBondContact O-N 3.34Å; P327-V329 VanDerWaalsContact O-N 3.1Å | ||
| 330 | G | 34.4 | Very low | 35.6 | Very low | 54 Ų | 54 | 122.9 Ų | 122.9 | 56% | 0.557 | 70% | 0.701 | S | S | * | * | trans | -73.5 | 120.5 | 170.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | S328 D332 | S328-G330 PolarHBondContact O-N 3.01Å; G330-D332 PolarHBondContact O-N 2.75Å | ||
| 331 | S | 29.9 | Very low | 35.3 | Very low | 96 Ų | 96 | 123 Ų | 123 | 67% | 0.671 | 69% | 0.691 | S | S | * | * | trans | -69.3 | 51.9 | 179.1 | -44.9 | 0 | 0 | 0 | 0 | 112.2 | I333 | S331-I333 PolarHBondContact O-N 3.5Š| ||
| 332 | D | 32.5 | Very low | 35.3 | Very low | 146 Ų | 146 | 120 Ų | 120 | 78% | 0.781 | 68% | 0.676 | S | S | * | * | trans | -91.2 | 95.3 | 173.9 | -74.4 | -30.3 | 0 | 0 | 0 | 108.6 | G330 H334 | G330-D332 PolarHBondContact O-N 2.75Å; D332-H334 PolarHBondContact O-N 2.84Å | ||
| 333 | I | 29.8 | Very low | 35.4 | Very low | 162 Ų | 162 | 118.2 Ų | 118.2 | 83% | 0.831 | 67% | 0.67 | S | S | * | * | trans | -67.5 | 68.2 | 168.1 | -50.7 | 166.5 | 0 | 0 | 0 | 107.2 | S331 | S331-I333 PolarHBondContact O-N 3.5Š| ||
| 334 | H | 27.9 | Very low | 35.7 | Very low | 151 Ų | 151 | 119.9 Ų | 119.9 | 70% | 0.699 | 68% | 0.677 | S | S | * | * | trans | -113.1 | 109.3 | 163.7 | -86.6 | -0.8 | 0 | 0 | 0 | 108 | D332 H336 | D332-H334 PolarHBondContact O-N 2.84Å; H334-H336 PolarHBondContact O-N 3.02Å | ||
| 335 | S | 27.4 | Very low | 35.8 | Very low | 128 Ų | 128 | 121.9 Ų | 121.9 | 90% | 0.895 | 68% | 0.675 | S | S | * | * | trans | -63.8 | 69.1 | 178.2 | -158.3 | 0 | 0 | 0 | 0 | 109.6 | R337 | S335-R337 VanDerWaalsContact C-N 3.31Å; S335-R337 PolarHBondContact O-N 2.85Å; S335-R337 VanDerWaalsContact O-N 3.08Å | ||
| 336 | H | 30.9 | Very low | 35.8 | Very low | 163 Ų | 163 | 121.3 Ų | 121.3 | 76% | 0.755 | 67% | 0.673 | S | S | * | * | trans | -77.5 | 94.5 | 164.9 | -79.4 | -73.3 | 0 | 0 | 0 | 106.9 | H334 S338 | H334-H336 PolarHBondContact O-N 3.02Å; H336-S338 PolarHBondContact O-N 3.08Å; H336-S338 VanDerWaalsContact O-N 3.12Å | ||
| 337 | R | 27.1 | Very low | 36.1 | Very low | 235 Ų | 235 | 122 Ų | 122 | 89% | 0.887 | 68% | 0.68 | S | S | * | * | trans | -27.7 | 115.9 | 155.7 | -173.8 | -178.5 | -165.1 | -164.4 | 3.4 | 108.6 | S335 A339 | S335-R337 VanDerWaalsContact C-N 3.31Å; S335-R337 PolarHBondContact O-N 2.85Å; S335-R337 VanDerWaalsContact O-N 3.08Å; R337-A339 VanDerWaalsContact C-N 3.26Å; R337-A339 PolarHBondContact O-N 3.26Å | ||
| 338 | S | 32.7 | Very low | 36 | Very low | 112 Ų | 112 | 126.5 Ų | 126.5 | 78% | 0.783 | 68% | 0.683 | S | S | * | * | trans | -53.6 | 89.8 | 179.4 | -51 | 0 | 0 | 0 | 0 | 109.6 | H336 I340 | H336-S338 PolarHBondContact O-N 3.08Å; H336-S338 VanDerWaalsContact O-N 3.12Å; S338-I340 PolarHBondContact O-N 2.89Å; S338-I340 VanDerWaalsContact O-N 3.12Å | ||
| 339 | A | 34.4 | Very low | 35.8 | Very low | 89 Ų | 89 | 125.7 Ų | 125.7 | 74% | 0.736 | 68% | 0.678 | S | S | * | * | trans | -63.9 | 114.2 | 163.3 | 0 | 0 | 0 | 0 | 0 | 104.2 | R337 F341 | R337-A339 VanDerWaalsContact C-N 3.26Å; R337-A339 PolarHBondContact O-N 3.26Å; A339-F341 VanDerWaalsContact C-N 3.28Å; A339-F341 PolarHBondContact O-N 2.99Å | ||
| 340 | I | 38.3 | Very low | 35.7 | Very low | 166 Ų | 166 | 128.4 Ų | 128.4 | 85% | 0.851 | 67% | 0.674 | S | S | * | * | trans | -57.6 | 102.4 | 170.4 | -63.3 | 166.7 | 0 | 0 | 0 | 104.5 | S338 D342 | S338-I340 PolarHBondContact O-N 2.89Å; S338-I340 VanDerWaalsContact O-N 3.12Å; I340-D342 PolarHBondContact O-N 3.01Å | ||
| 341 | F | 41.4 | Very low | 35.7 | Very low | 108 Ų | 108 | 136.5 Ų | 136.5 | 47% | 0.474 | 69% | 0.689 | S | S | . | * | trans | -69.6 | 113.6 | -176.6 | -167.8 | -91.2 | 0 | 0 | 0 | 107.1 | I25 C28 A339 P343 | I25-F341 HydrophobicContact CG1-CD1 4.37Å; I25-F341 HydrophobicContact CG1-CE1 4.46Å; I25-F341 HydrophobicContact CG2-CD1 4.39Å; I25-F341 HydrophobicContact CG2-CE1 4.27Å; C28-F341 HydrophobicContact CB-CE1 4.43Å; C28-F341 HydrophobicContact CB-CZ 4.19Å; A339-F341 VanDerWaalsContact C-N 3.28Å; A339-F341 PolarHBondContact O-N 2.99Å; F341-P343 VanDerWaalsContact O-CD 3.29Å; F341-P343 WeakPolarHBondContact O-CD 3.42Å | ||
| 342 | D | 42.4 | Very low | 35.7 | Very low | 74 Ų | 74 | 137.5 Ų | 137.5 | 40% | 0.396 | 69% | 0.688 | S | S | . | * | trans | -87 | 110.4 | 173.1 | -173.7 | -7.5 | 0 | 0 | 0 | 108.1 | I340 N344 E345 | I340-D342 PolarHBondContact O-N 3.01Å; D342-N344 PolarHBondContact O-N 3.33Å; D342-N344 VanDerWaalsContact OD1-CB 3.28Å; D342-N344 WeakPolarHBondContact OD1-CB 3.5Å; D342-N344 PolarHBondContact OD1-N 3.32Å; D342-N344 PolarHBondContact OD1-ND2 3Å; D342-E345 HydrophobicContact CB-CG 4.43Å; D342-E345 PolarHBondContact O-N 3.35Å | ||
| 343 | P | 43.5 | Very low | 35.5 | Very low | 54 Ų | 54 | 136.4 Ų | 136.4 | 35% | 0.351 | 69% | 0.69 | S | S | . | * | G | 310 helix | trans | -59.6 | -16.5 | 178.1 | 23.9 | -32.6 | 0 | 0 | 0 | 113 | F341 E345 C346 | F341-P343 VanDerWaalsContact O-CD 3.29Å; F341-P343 WeakPolarHBondContact O-CD 3.42Å; P343-E345 VanDerWaalsContact C-N 3.28Å; P343-E345 PolarHBondContact O-N 3.11Å; P343-C346 WeakPolarHBondContact O-CB 3.3Å; P343-C346 PolarHBondContact O-N 3.47Å; P343-C346 PolarHBondContact O-SG 2.94Å; P343-C346 VanDerWaalsContact O-SG 3.42Å |
| 344 | N | 46 | Very low | 35.5 | Very low | 107 Ų | 107 | 133.7 Ų | 133.7 | 57% | 0.572 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -72.1 | -19.5 | 174.9 | -60.2 | -56.1 | 0 | 0 | 0 | 113.5 | D342 C346 F347 | D342-N344 PolarHBondContact O-N 3.33Å; D342-N344 VanDerWaalsContact OD1-CB 3.28Å; D342-N344 WeakPolarHBondContact OD1-CB 3.5Å; D342-N344 PolarHBondContact OD1-N 3.32Å; D342-N344 PolarHBondContact OD1-ND2 3Å; N344-C346 PolarHBondContact O-N 3.37Å; N344-F347 PolarHBondContact O-N 3.26Å |
| 345 | E | 46.1 | Very low | 35.6 | Very low | 138 Ų | 138 | 131 Ų | 131 | 65% | 0.645 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -65.8 | -25.8 | 174.7 | -76.3 | -168.5 | 156.7 | 0 | 0 | 112.1 | D342 P343 F347 R348 | D342-E345 HydrophobicContact CB-CG 4.43Å; D342-E345 PolarHBondContact O-N 3.35Å; P343-E345 VanDerWaalsContact C-N 3.28Å; P343-E345 PolarHBondContact O-N 3.11Å; E345-F347 PolarHBondContact O-N 3.47Å; E345-R348 PolarHBondContact O-N 3.3Å; E345-R348 VanDerWaalsContact O-N 3.08Å |
| 346 | C | 40.5 | Very low | 35.6 | Very low | 51 Ų | 51 | 134.7 Ų | 134.7 | 35% | 0.345 | 68% | 0.675 | S | S | . | * | G | 310 helix | trans | -62.6 | -26.5 | 174.8 | -49.6 | 0 | 0 | 0 | 0 | 113.2 | C28 P343 N344 | C28-C346 HydrophobicContact CB-CB 3.99Å; C28-C346 WeakPolarHBondContact CB-SG 3.28Å; C28-C346 WeakPolarHBondContact SG-CB 3.47Å; C28-C346 CovalentContact SG-SG 2.01Å; C28-C346 PolarHBondContact SG-SG 3.11Å; P343-C346 WeakPolarHBondContact O-CB 3.3Å; P343-C346 PolarHBondContact O-N 3.47Å; P343-C346 PolarHBondContact O-SG 2.94Å; P343-C346 VanDerWaalsContact O-SG 3.42Å; N344-C346 PolarHBondContact O-N 3.37Å |
| 347 | F | 38.9 | Very low | 35.5 | Very low | 175 Ų | 175 | 134.2 Ų | 134.2 | 77% | 0.768 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -87.8 | -5.5 | 178.9 | -68.6 | -77 | 0 | 0 | 0 | 113.2 | N344 E345 S349 | N344-F347 PolarHBondContact O-N 3.26Å; E345-F347 PolarHBondContact O-N 3.47Å; F347-S349 PolarHBondContact O-N 2.95Å |
| 348 | R | 34.2 | Very low | 35.7 | Very low | 198 Ų | 198 | 128.7 Ų | 128.7 | 75% | 0.747 | 67% | 0.667 | S | S | * | * | trans | -75.7 | 78.4 | 164.7 | -94.2 | -175.6 | 162.4 | -161.7 | -4.7 | 108.5 | E345 Y350 | E345-R348 PolarHBondContact O-N 3.3Å; E345-R348 VanDerWaalsContact O-N 3.08Å; R348-Y350 PolarHBondContact O-N 2.77Å | ||
| 349 | S | 34.2 | Very low | 35.6 | Very low | 92 Ų | 92 | 129.1 Ų | 129.1 | 64% | 0.643 | 67% | 0.67 | S | S | * | * | trans | -52 | 109.4 | 155.7 | -58.9 | 0 | 0 | 0 | 0 | 107.1 | F347 Y351 | F347-S349 PolarHBondContact O-N 2.95Å; S349-Y351 VanDerWaalsContact C-N 3.31Å; S349-Y351 PolarHBondContact O-N 2.83Å | ||
| 350 | Y | 37.5 | Very low | 35.2 | Very low | 197 Ų | 197 | 128.2 Ų | 128.2 | 77% | 0.773 | 67% | 0.669 | S | S | * | * | trans | -60.5 | 92.9 | 177.1 | -98 | -102.4 | 0 | 0 | 0 | 108.6 | R348 D352 | R348-Y350 PolarHBondContact O-N 2.77Å; Y350-D352 HydrophobicContact CD1-CB 3.96Å; Y350-D352 PolarHBondContact O-N 2.98Å | ||
| 351 | Y | 34.4 | Very low | 34.7 | Very low | 224 Ų | 224 | 125.2 Ų | 125.2 | 88% | 0.878 | 66% | 0.663 | S | S | * | * | trans | -71.4 | 67.5 | 153.2 | -71.6 | -84.4 | 0 | 0 | 0 | 107.9 | S349 | S349-Y351 VanDerWaalsContact C-N 3.31Å; S349-Y351 PolarHBondContact O-N 2.83Å | ||
| 352 | D | 29.7 | Very low | 34 | Very low | 118 Ų | 118 | 127.4 Ų | 127.4 | 63% | 0.631 | 68% | 0.68 | S | S | * | * | trans | -131.4 | 42.9 | 168.3 | -130.1 | -4.3 | 0 | 0 | 0 | 108.5 | Y350 T354 | Y350-D352 HydrophobicContact CD1-CB 3.96Å; Y350-D352 PolarHBondContact O-N 2.98Å; D352-T354 PolarHBondContact O-N 2.91Å | ||
| 353 | C | 28.6 | Very low | 33.2 | Very low | 122 Ų | 122 | 130.7 Ų | 130.7 | 82% | 0.824 | 70% | 0.697 | S | S | * | * | trans | -69.5 | 85.5 | 159.1 | -69 | 0 | 0 | 0 | 0 | 107 | S355 | C353-S355 PolarHBondContact O-N 3.05Š| ||
| 354 | T | 30.1 | Very low | 32.6 | Very low | 106 Ų | 106 | 135.8 Ų | 135.8 | 65% | 0.65 | 72% | 0.721 | S | S | * | * | trans | -50.9 | 107.1 | 160.9 | 40.4 | 0 | 0 | 0 | 0 | 107.7 | D352 Y356 | D352-T354 PolarHBondContact O-N 2.91Å; T354-Y356 VanDerWaalsContact C-N 3.35Å; T354-Y356 PolarHBondContact O-N 3.2Å | ||
| 355 | S | 30.2 | Very low | 31.5 | Very low | 93 Ų | 93 | 133.8 Ų | 133.8 | 65% | 0.65 | 73% | 0.726 | S | S | * | * | trans | -57.6 | 97.8 | 174.8 | -177.5 | 0 | 0 | 0 | 0 | 108.2 | C353 H357 | C353-S355 PolarHBondContact O-N 3.05Å; S355-H357 VanDerWaalsContact C-N 3.27Å; S355-H357 PolarHBondContact O-N 3.02Å | ||
| 356 | Y | 27.2 | Very low | 30.5 | Very low | 207 Ų | 207 | 132.8 Ų | 132.8 | 81% | 0.812 | 73% | 0.734 | S | S | * | * | trans | -70.4 | 89 | 170 | -112 | -93.6 | 0 | 0 | 0 | 107 | T354 P358 | T354-Y356 VanDerWaalsContact C-N 3.35Å; T354-Y356 PolarHBondContact O-N 3.2Å; Y356-P358 VanDerWaalsContact O-CD 3.29Å; Y356-P358 WeakPolarHBondContact O-CD 3.35Å | ||
| 357 | H | 28.4 | Very low | 29.8 | Very low | 152 Ų | 152 | 135.2 Ų | 135.2 | 70% | 0.704 | 75% | 0.752 | S | S | * | * | trans | -67 | 119.7 | 166.5 | -91.8 | -82.8 | 0 | 0 | 0 | 108.3 | S355 S359 | S355-H357 VanDerWaalsContact C-N 3.27Å; S355-H357 PolarHBondContact O-N 3.02Å; H357-S359 PolarHBondContact O-N 2.77Å; H357-S359 VanDerWaalsContact O-N 3.07Å | ||
| 358 | P | 30.1 | Very low | 29.3 | Very low | 119 Ų | 119 | 132.4 Ų | 132.4 | 77% | 0.773 | 75% | 0.754 | S | S | * | * | trans | -66.7 | 111.3 | 172.9 | 25.7 | -30.1 | 0 | 0 | 0 | 107.8 | Y356 G360 | Y356-P358 VanDerWaalsContact O-CD 3.29Å; Y356-P358 WeakPolarHBondContact O-CD 3.35Å; P358-G360 VanDerWaalsContact C-N 3.33Å; P358-G360 PolarHBondContact O-N 3.45Å | ||
| 359 | S | 30.9 | Very low | 28.8 | Very low | 122 Ų | 122 | 127.2 Ų | 127.2 | 85% | 0.853 | 76% | 0.762 | S | S | * | * | trans | -57.6 | 98.6 | 170.6 | -61.5 | 0 | 0 | 0 | 0 | 108.8 | H357 S361 | H357-S359 PolarHBondContact O-N 2.77Å; H357-S359 VanDerWaalsContact O-N 3.07Å; S359-S361 PolarHBondContact O-N 3.05Å; S359-S361 VanDerWaalsContact O-N 3.13Å | ||
| 360 | G | 27.1 | Very low | 28.3 | Very low | 69 Ų | 69 | 126.1 Ų | 126.1 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | trans | -58.2 | 113.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | P358 N362 | P358-G360 VanDerWaalsContact C-N 3.33Å; P358-G360 PolarHBondContact O-N 3.45Å; G360-N362 VanDerWaalsContact C-N 3.32Å; G360-N362 PolarHBondContact O-N 3.42Å | ||
| 361 | S | 27 | Very low | 27.8 | Very low | 103 Ų | 103 | 124.4 Ų | 124.4 | 72% | 0.72 | 77% | 0.77 | S | S | * | * | trans | -65.8 | 89 | 171.8 | -177.5 | 0 | 0 | 0 | 0 | 109.1 | S359 | S359-S361 PolarHBondContact O-N 3.05Å; S359-S361 VanDerWaalsContact O-N 3.13Å | ||
| 362 | N | 27.8 | Very low | 27.6 | Very low | 154 Ų | 154 | 120.5 Ų | 120.5 | 82% | 0.824 | 76% | 0.764 | S | S | * | * | trans | -97.7 | 100.8 | 165.1 | -89.5 | -11.7 | 0 | 0 | 0 | 108.6 | G360 N364 | G360-N362 VanDerWaalsContact C-N 3.32Å; G360-N362 PolarHBondContact O-N 3.42Å; N362-N364 PolarHBondContact O-N 3.17Å; N362-N364 VanDerWaalsContact O-N 3.1Å | ||
| 363 | N | 25.8 | Very low | 27.4 | Very low | 143 Ų | 143 | 120.5 Ų | 120.5 | 77% | 0.765 | 77% | 0.773 | S | S | * | * | trans | -54.2 | 106.3 | 162.4 | -73.2 | -40.6 | 0 | 0 | 0 | 109.6 | ||||
| 364 | N | 29.2 | Very low | 27.5 | Very low | 161 Ų | 161 | 119.2 Ų | 119.2 | 86% | 0.861 | 77% | 0.766 | S | S | * | * | trans | -161.4 | 105.1 | 155.6 | -86 | -30.2 | 0 | 0 | 0 | 103.6 | N362 | N362-N364 PolarHBondContact O-N 3.17Å; N362-N364 VanDerWaalsContact O-N 3.1Å | ||
| 365 | G | 23.9 | Very low | 27.4 | Very low | 65 Ų | 65 | 120 Ų | 120 | 67% | 0.67 | 77% | 0.77 | S | S | * | * | 102.9 | 102.8 | 75.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | |||||
| 366 | S | 24.4 | Very low | 27.4 | Very low | 117 Ų | 117 | 119.8 Ų | 119.8 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | 71.7 | 132.6 | 144.1 | -50.9 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 367 | S | 25.8 | Very low | 27.4 | Very low | 103 Ų | 103 | 116.1 Ų | 116.1 | 72% | 0.72 | 76% | 0.763 | S | S | * | * | trans | 70.3 | 103.4 | 146.2 | 76.7 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 368 | S | 28.2 | Very low | 27.3 | Very low | 116 Ų | 116 | 118.5 Ų | 118.5 | 81% | 0.811 | 77% | 0.767 | S | S | * | * | 41.3 | 117 | 123 | 62.5 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 369 | G | 24.5 | Very low | 27.2 | Very low | 88 Ų | 88 | 120.1 Ų | 120.1 | 91% | 0.907 | 77% | 0.765 | S | S | * | * | trans | 102.5 | 131.1 | 139.2 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 370 | G | 24.1 | Very low | 27 | Very low | 69 Ų | 69 | 123.8 Ų | 123.8 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | trans | 127.5 | 84.3 | 162.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | N372 | G370-N372 PolarHBondContact O-N 2.91Å; G370-N372 VanDerWaalsContact O-N 3.13Å | ||
| 371 | D | 26.7 | Very low | 27.1 | Very low | 162 Ų | 162 | 131.7 Ų | 131.7 | 87% | 0.866 | 78% | 0.775 | S | S | * | * | trans | -46.7 | 113.8 | 150.9 | -63.4 | -51.8 | 0 | 0 | 0 | 109.1 | ||||
| 372 | N | 29.3 | Very low | 27.1 | Very low | 141 Ų | 141 | 137.8 Ų | 137.8 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | trans | -148 | 92.5 | 156.4 | -88.6 | -32.4 | 0 | 0 | 0 | 106.8 | G370 S374 | G370-N372 PolarHBondContact O-N 2.91Å; G370-N372 VanDerWaalsContact O-N 3.13Å; N372-S374 PolarHBondContact O-N 3.44Å; N372-S374 PolarHBondContact O-OG 2.86Å | ||
| 373 | S | 26.3 | Very low | 27.2 | Very low | 119 Ų | 119 | 134.5 Ų | 134.5 | 83% | 0.832 | 78% | 0.777 | S | S | * | * | trans | -57.6 | 76.1 | 161.5 | 55.2 | 0 | 0 | 0 | 0 | 109.3 | T375 | S373-T375 VanDerWaalsContact C-N 3.3Å; S373-T375 PolarHBondContact O-N 2.87Å | ||
| 374 | S | 30.7 | Very low | 27.5 | Very low | 95 Ų | 95 | 133.5 Ų | 133.5 | 66% | 0.664 | 77% | 0.771 | S | S | * | * | trans | -92.4 | 77.3 | 171 | -46.5 | 0 | 0 | 0 | 0 | 105.6 | N372 S376 | N372-S374 PolarHBondContact O-N 3.44Å; N372-S374 PolarHBondContact O-OG 2.86Å; S374-S376 PolarHBondContact O-N 3.01Å | ||
| 375 | T | 28.9 | Very low | 27.7 | Very low | 122 Ų | 122 | 132.5 Ų | 132.5 | 75% | 0.748 | 77% | 0.765 | S | S | * | * | trans | -53.9 | 96.6 | 158.6 | 8.8 | 0 | 0 | 0 | 0 | 105.9 | S373 N377 | S373-T375 VanDerWaalsContact C-N 3.3Å; S373-T375 PolarHBondContact O-N 2.87Å; T375-N377 PolarHBondContact O-N 2.9Å | ||
| 376 | S | 28.9 | Very low | 28.1 | Very low | 89 Ų | 89 | 135.8 Ų | 135.8 | 62% | 0.622 | 77% | 0.768 | S | S | * | * | trans | -66.7 | 89.1 | 174 | 54.5 | 0 | 0 | 0 | 0 | 106.9 | S374 Y378 | S374-S376 PolarHBondContact O-N 3.01Å; S376-Y378 PolarHBondContact O-N 2.96Å | ||
| 377 | N | 27.8 | Very low | 28.6 | Very low | 129 Ų | 129 | 135 Ų | 135 | 69% | 0.69 | 76% | 0.762 | S | S | * | * | trans | -60.3 | 85.8 | 164.6 | -82.1 | -23.7 | 0 | 0 | 0 | 107.2 | T375 H379 | T375-N377 PolarHBondContact O-N 2.9Å; N377-H379 PolarHBondContact O-N 2.81Å | ||
| 378 | Y | 25.6 | Very low | 28.9 | Very low | 202 Ų | 202 | 137.2 Ų | 137.2 | 79% | 0.792 | 77% | 0.765 | S | S | * | * | trans | -69 | 87.4 | 161.6 | -81.7 | -83.5 | 0 | 0 | 0 | 106.8 | S376 F380 | S376-Y378 PolarHBondContact O-N 2.96Å; Y378-F380 PolarHBondContact O-N 2.93Å; Y378-F380 VanDerWaalsContact O-N 3.12Å | ||
| 379 | H | 27.6 | Very low | 28.9 | Very low | 154 Ų | 154 | 140.3 Ų | 140.3 | 71% | 0.713 | 77% | 0.766 | S | S | * | * | trans | -58 | 111.9 | 164.9 | -87.5 | -80.9 | 0 | 0 | 0 | 107.7 | N377 Y381 | N377-H379 PolarHBondContact O-N 2.81Å; H379-Y381 PolarHBondContact O-N 2.83Å; H379-Y381 VanDerWaalsContact O-N 3.1Å | ||
| 380 | F | 28.4 | Very low | 29.3 | Very low | 199 Ų | 199 | 144.8 Ų | 144.8 | 87% | 0.873 | 78% | 0.784 | S | S | * | * | trans | -55.1 | 116.4 | 163.3 | -86.5 | -94.7 | 0 | 0 | 0 | 107.8 | Y378 R382 | Y378-F380 PolarHBondContact O-N 2.93Å; Y378-F380 VanDerWaalsContact O-N 3.12Å; F380-R382 VanDerWaalsContact C-N 3.27Å; F380-R382 PolarHBondContact O-N 2.91Å | ||
| 381 | Y | 28.6 | Very low | 29.5 | Very low | 234 Ų | 234 | 148.6 Ų | 148.6 | 92% | 0.918 | 79% | 0.788 | S | S | * | * | trans | -61.5 | 94.3 | 167.1 | -79.9 | -91.1 | 0 | 0 | 0 | 107.7 | H379 A383 | H379-Y381 PolarHBondContact O-N 2.83Å; H379-Y381 VanDerWaalsContact O-N 3.1Å; Y381-A383 PolarHBondContact O-N 2.92Å; Y381-A383 VanDerWaalsContact O-N 3.09Å | ||
| 382 | R | 27.2 | Very low | 29.7 | Very low | 232 Ų | 232 | 147.9 Ų | 147.9 | 88% | 0.875 | 78% | 0.784 | S | S | * | * | trans | -70.4 | 100.6 | 163 | -153.1 | 178.6 | -166 | 176.1 | 3 | 104.6 | F380 D384 | F380-R382 VanDerWaalsContact C-N 3.27Å; F380-R382 PolarHBondContact O-N 2.91Å; R382-D384 PolarHBondContact O-N 3.02Å | ||
| 383 | A | 29.6 | Very low | 29.7 | Very low | 84 Ų | 84 | 148.3 Ų | 148.3 | 69% | 0.694 | 79% | 0.785 | S | S | * | * | trans | -57.6 | 109.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | Y381 L385 | Y381-A383 PolarHBondContact O-N 2.92Å; Y381-A383 VanDerWaalsContact O-N 3.09Å; A383-L385 VanDerWaalsContact C-N 3.35Å; A383-L385 PolarHBondContact O-N 2.84Å | ||
| 384 | D | 31.6 | Very low | 29.9 | Very low | 122 Ų | 122 | 150 Ų | 150 | 65% | 0.652 | 78% | 0.783 | S | S | * | * | trans | -62 | 98.2 | 172.6 | -91.7 | -36 | 0 | 0 | 0 | 108.4 | R382 N386 S387 | R382-D384 PolarHBondContact O-N 3.02Å; D384-N386 PolarHBondContact O-N 3.41Å; D384-S387 PolarHBondContact O-N 2.83Å; D384-S387 PolarHBondContact O-OG 3.42Å | ||
| 385 | L | 33.2 | Very low | 29.9 | Very low | 141 Ų | 141 | 153.4 Ų | 153.4 | 74% | 0.738 | 79% | 0.79 | S | S | * | * | G | 310 helix | trans | -61.6 | -3.2 | 174 | -91 | 156.6 | 0 | 0 | 0 | 113.3 | A383 S387 | A383-L385 VanDerWaalsContact C-N 3.35Å; A383-L385 PolarHBondContact O-N 2.84Å; L385-S387 VanDerWaalsContact C-N 3.29Å; L385-S387 PolarHBondContact O-N 2.93Å |
| 386 | N | 33.1 | Very low | 29.9 | Very low | 134 Ų | 134 | 155.5 Ų | 155.5 | 72% | 0.717 | 79% | 0.793 | S | S | * | * | G | 310 helix | trans | -78.9 | -8.2 | 176.8 | -71.5 | -11.2 | 0 | 0 | 0 | 113.8 | D384 L388 | D384-N386 PolarHBondContact O-N 3.41Å; N386-L388 VanDerWaalsContact C-N 3.32Å |
| 387 | S | 33.9 | Very low | 30 | Very low | 101 Ų | 101 | 160.3 Ų | 160.3 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | G | 310 helix | trans | -83.6 | -2 | 176.3 | 58.4 | 0 | 0 | 0 | 0 | 114.6 | D384 L385 | D384-S387 PolarHBondContact O-N 2.83Å; D384-S387 PolarHBondContact O-OG 3.42Å; L385-S387 VanDerWaalsContact C-N 3.29Å; L385-S387 PolarHBondContact O-N 2.93Å |
| 388 | L | 32.6 | Very low | 30.2 | Very low | 149 Ų | 149 | 162.7 Ų | 162.7 | 78% | 0.78 | 81% | 0.814 | S | S | * | * | G | 310 helix | trans | -101.5 | 8.8 | 177.3 | -90.9 | 159.5 | 0 | 0 | 0 | 114.2 | N386 | N386-L388 VanDerWaalsContact C-N 3.32Š|
| 389 | Q | 28 | Very low | 30.6 | Very low | 180 Ų | 180 | 159.4 Ų | 159.4 | 84% | 0.841 | 82% | 0.816 | S | S | * | * | trans | -108.7 | 77.8 | 165.7 | -80.2 | -177.4 | -18.2 | 0 | 0 | 109.8 | ||||
| 390 | S | 32.9 | Very low | 30.8 | Very low | 183 Ų | 183 | 159.9 Ų | 159.9 | 100% | 1.28 | 83% | 0.825 | S | S | * | * | trans | -132 | 0 | 155.8 | 81 | 0 | 0 | 0 | 0 | 110 |
Retrieved 390 of 390 residues in 106.2 ms
(Link to these results)