| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 68 | Low | 85.3 | Confident | 170 Ų | 170 | 93.9 Ų | 93.9 | 84% | 0.837 | 48% | 0.481 | S | S | * | . | 0 | 141.8 | 0 | -75.3 | 170.8 | 68 | 0 | 0 | 108.5 | N5 V6 L9 | M1-N5 HydrophobicContact CE-CB 4.17Å; M1-V6 HydrophobicContact CB-CG2 3.7Å; M1-V6 HydrophobicContact CE-CG2 4.15Å; M1-V6 HydrophobicContact SD-CG2 4.42Å; M1-L9 HydrophobicContact CE-CD2 4.31Å | |||
| 2 | K | 80.6 | Confident | 86.1 | Confident | 151 Ų | 151 | 92.8 Ų | 92.8 | 66% | 0.657 | 48% | 0.475 | S | S | * | . | trans | -58 | 141.3 | 172.5 | -66.4 | -174.5 | 176.8 | -174.7 | 0 | 109.6 | Q4 N5 V6 | K2-Q4 PolarHBondContact O-N 3.34Å; K2-Q4 VanDerWaalsContact O-N 3.13Å; K2-N5 PolarHBondContact O-N 3.48Å; K2-V6 PolarHBondContact O-N 3.02Å | ||
| 3 | K | 82.1 | Confident | 87 | Confident | 110 Ų | 110 | 91.8 Ų | 91.8 | 48% | 0.478 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -52.1 | -37 | 179.1 | -68.5 | 175.2 | -169.4 | 148 | 0 | 111.6 | V6 R7 D257 | K3-V6 PolarHBondContact O-N 3.37Å; K3-R7 WeakPolarHBondContact O-CB 3.07Å; K3-R7 PolarHBondContact O-N 3.23Å; K3-D257 IonicContact NZ-OD1 2.7Å; K3-D257 PolarHBondContact NZ-OD1 2.69Å |
| 4 | Q | 77.1 | Confident | 87.7 | Confident | 77 Ų | 77 | 90.8 Ų | 90.8 | 36% | 0.36 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59 | -48 | 174.7 | -175.5 | 174.7 | 23.8 | 0 | 0 | 113.5 | K2 V6 R7 T8 E254 | K2-Q4 PolarHBondContact O-N 3.34Å; K2-Q4 VanDerWaalsContact O-N 3.13Å; Q4-V6 VanDerWaalsContact C-N 3.28Å; Q4-V6 PolarHBondContact O-N 3.17Å; Q4-R7 PolarHBondContact O-N 3.06Å; Q4-T8 PolarHBondContact O-N 2.63Å; Q4-T8 PolarHBondContact O-OG1 3.42Å; Q4-T8 VanDerWaalsContact O-OG1 3.07Å; Q4-E254 PolarHBondContact NE2-OE1 3.16Å |
| 5 | N | 87.8 | Confident | 88.3 | Confident | 86 Ų | 86 | 90.3 Ų | 90.3 | 46% | 0.46 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.7 | -37.3 | 179.1 | -67.1 | -2.7 | 0 | 0 | 0 | 111.1 | M1 K2 T8 L9 | M1-N5 HydrophobicContact CE-CB 4.17Å; K2-N5 PolarHBondContact O-N 3.48Å; N5-T8 PolarHBondContact O-N 3.28Å; N5-L9 WeakPolarHBondContact O-CB 3.39Å; N5-L9 PolarHBondContact O-N 3.39Å |
| 6 | V | 90.5 | Very high | 88.8 | Confident | 73 Ų | 73 | 92.9 Ų | 92.9 | 44% | 0.442 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.4 | -45.1 | 174.8 | 179.5 | 0 | 0 | 0 | 0 | 110.4 | M1 K2 K3 Q4 L9 A10 | M1-V6 HydrophobicContact CB-CG2 3.7Å; M1-V6 HydrophobicContact CE-CG2 4.15Å; M1-V6 HydrophobicContact SD-CG2 4.42Å; K2-V6 PolarHBondContact O-N 3.02Å; K3-V6 PolarHBondContact O-N 3.37Å; Q4-V6 VanDerWaalsContact C-N 3.28Å; Q4-V6 PolarHBondContact O-N 3.17Å; V6-L9 PolarHBondContact O-N 3.08Å; V6-A10 WeakPolarHBondContact O-CB 3.34Å; V6-A10 PolarHBondContact O-N 3.29Å |
| 7 | R | 87.2 | Confident | 89.4 | Confident | 47 Ų | 47 | 91.6 Ų | 91.6 | 18% | 0.177 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -61.1 | -45.2 | 175.9 | -179 | 174.8 | 62.1 | -148.3 | 1.4 | 112 | K3 Q4 A10 L11 N250 D253 | K3-R7 WeakPolarHBondContact O-CB 3.07Å; K3-R7 PolarHBondContact O-N 3.23Å; Q4-R7 PolarHBondContact O-N 3.06Å; R7-A10 PolarHBondContact O-N 3.21Å; R7-L11 HydrophobicContact CG-CD1 4.37Å; R7-L11 WeakPolarHBondContact O-CG 3.47Å; R7-L11 PolarHBondContact O-N 3.34Å; R7-N250 WeakPolarHBondContact CD-OD1 3.45Å; R7-N250 PolarHBondContact NE-OD1 3.14Å; R7-N250 VanDerWaalsContact NE-OD1 3.07Å; R7-N250 PolarHBondContact NH1-OD1 3.21Å; R7-N250 VanDerWaalsContact NH2-CG 3.27Å; R7-N250 PolarHBondContact NH2-OD1 3.05Å; R7-D253 IonicContact NH1-OD2 2.59Å; R7-D253 PolarHBondContact NH1-OD2 3.49Å; R7-D253 VanDerWaalsContact NH1-OD2 3.08Å |
| 8 | T | 87.4 | Confident | 89.9 | Confident | 70 Ų | 70 | 96.6 Ų | 96.6 | 43% | 0.429 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.4 | -46.5 | 177.6 | -58.4 | 0 | 0 | 0 | 0 | 111.4 | Q4 N5 A10 L11 I12 | Q4-T8 PolarHBondContact O-N 2.63Å; Q4-T8 PolarHBondContact O-OG1 3.42Å; Q4-T8 VanDerWaalsContact O-OG1 3.07Å; N5-T8 PolarHBondContact O-N 3.28Å; T8-A10 VanDerWaalsContact C-N 3.34Å; T8-A10 PolarHBondContact O-N 2.99Å; T8-L11 PolarHBondContact O-N 3.09Å; T8-I12 HydrophobicContact CG2-CD1 4.13Å; T8-I12 WeakPolarHBondContact O-CG1 3.29Å; T8-I12 PolarHBondContact O-N 3.05Å |
| 9 | L | 92.7 | Very high | 90.3 | Very high | 93 Ų | 93 | 97.1 Ų | 97.1 | 49% | 0.487 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63 | -42.1 | 176.7 | -175.8 | 66.5 | 0 | 0 | 0 | 111.4 | M1 N5 V6 L11 I12 V13 | M1-L9 HydrophobicContact CE-CD2 4.31Å; N5-L9 WeakPolarHBondContact O-CB 3.39Å; N5-L9 PolarHBondContact O-N 3.39Å; V6-L9 PolarHBondContact O-N 3.08Å; L9-L11 PolarHBondContact O-N 3.34Å; L9-I12 PolarHBondContact O-N 3.34Å; L9-V13 WeakPolarHBondContact O-CG2 3.28Å; L9-V13 PolarHBondContact O-N 3.43Å |
| 10 | A | 93.6 | Very high | 90.7 | Very high | 48 Ų | 48 | 98.4 Ų | 98.4 | 40% | 0.397 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61 | -43.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | V6 R7 T8 V13 C14 | V6-A10 WeakPolarHBondContact O-CB 3.34Å; V6-A10 PolarHBondContact O-N 3.29Å; R7-A10 PolarHBondContact O-N 3.21Å; T8-A10 VanDerWaalsContact C-N 3.34Å; T8-A10 PolarHBondContact O-N 2.99Å; A10-V13 PolarHBondContact O-N 2.94Å; A10-C14 VanDerWaalsContact O-CB 3.3Å; A10-C14 WeakPolarHBondContact O-CB 3.5Å; A10-C14 PolarHBondContact O-N 3.06Å; A10-C14 PolarHBondContact O-SG 2.59Å |
| 11 | L | 91.6 | Very high | 91.1 | Very high | 108 Ų | 108 | 98.2 Ų | 98.2 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.7 | -44.9 | 174.8 | -75.5 | 171.7 | 0 | 0 | 0 | 111.8 | R7 T8 L9 C14 T15 | R7-L11 HydrophobicContact CG-CD1 4.37Å; R7-L11 WeakPolarHBondContact O-CG 3.47Å; R7-L11 PolarHBondContact O-N 3.34Å; T8-L11 PolarHBondContact O-N 3.09Å; L9-L11 PolarHBondContact O-N 3.34Å; L11-C14 PolarHBondContact O-N 3.41Å; L11-T15 WeakPolarHBondContact O-CB 3.44Å; L11-T15 PolarHBondContact O-N 2.98Å; L11-T15 PolarHBondContact O-OG1 3.04Å |
| 12 | I | 95 | Very high | 92.5 | Very high | 81 Ų | 81 | 91.2 Ų | 91.2 | 42% | 0.415 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59.3 | -50.2 | 176.7 | -68.3 | 166.7 | 0 | 0 | 0 | 110.5 | T8 L9 C14 T15 F16 | T8-I12 HydrophobicContact CG2-CD1 4.13Å; T8-I12 WeakPolarHBondContact O-CG1 3.29Å; T8-I12 PolarHBondContact O-N 3.05Å; L9-I12 PolarHBondContact O-N 3.34Å; I12-C14 PolarHBondContact O-N 3.21Å; I12-T15 PolarHBondContact O-N 3.2Å; I12-F16 HydrophobicContact CG2-CD2 3.66Å; I12-F16 HydrophobicContact CG2-CE2 3.63Å; I12-F16 VanDerWaalsContact O-CD2 3.27Å; I12-F16 WeakPolarHBondContact O-CD2 3.36Å; I12-F16 PolarHBondContact O-N 3.48Å |
| 13 | V | 97.3 | Very high | 93.4 | Very high | 79 Ų | 79 | 86.9 Ų | 86.9 | 48% | 0.479 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 178.8 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | L9 A10 T15 F16 T17 | L9-V13 WeakPolarHBondContact O-CG2 3.28Å; L9-V13 PolarHBondContact O-N 3.43Å; A10-V13 PolarHBondContact O-N 2.94Å; V13-T15 VanDerWaalsContact C-N 3.34Å; V13-T15 PolarHBondContact O-N 3.42Å; V13-F16 PolarHBondContact O-N 2.99Å; V13-T17 HydrophobicContact CG1-CG2 4.39Å; V13-T17 WeakPolarHBondContact O-CG2 3.47Å; V13-T17 PolarHBondContact O-N 3.04Å; V13-T17 PolarHBondContact O-OG1 3.21Å; V13-T17 VanDerWaalsContact O-OG1 3.12Å |
| 14 | C | 96.8 | Very high | 94.2 | Very high | 78 Ų | 78 | 84.6 Ų | 84.6 | 53% | 0.527 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.6 | -39.7 | 176.4 | -74 | 0 | 0 | 0 | 0 | 112.7 | A10 L11 I12 T17 Y18 | A10-C14 VanDerWaalsContact O-CB 3.3Å; A10-C14 WeakPolarHBondContact O-CB 3.5Å; A10-C14 PolarHBondContact O-N 3.06Å; A10-C14 PolarHBondContact O-SG 2.59Å; L11-C14 PolarHBondContact O-N 3.41Å; I12-C14 PolarHBondContact O-N 3.21Å; C14-T17 WeakPolarHBondContact CA-OG1 3.48Å; C14-T17 PolarHBondContact O-OG1 3.19Å; C14-Y18 WeakPolarHBondContact O-CB 3.23Å; C14-Y18 PolarHBondContact O-N 3.02Å |
| 15 | T | 96.1 | Very high | 95.2 | Very high | 83 Ų | 83 | 84.5 Ų | 84.5 | 51% | 0.509 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67 | -44.1 | 176.7 | -59.9 | 0 | 0 | 0 | 0 | 111.3 | L11 I12 V13 Y18 L19 | L11-T15 WeakPolarHBondContact O-CB 3.44Å; L11-T15 PolarHBondContact O-N 2.98Å; L11-T15 PolarHBondContact O-OG1 3.04Å; I12-T15 PolarHBondContact O-N 3.2Å; V13-T15 VanDerWaalsContact C-N 3.34Å; V13-T15 PolarHBondContact O-N 3.42Å; T15-Y18 PolarHBondContact O-N 2.89Å; T15-L19 HydrophobicContact CG2-CD1 4.43Å; T15-L19 WeakPolarHBondContact O-CG 3.37Å; T15-L19 PolarHBondContact O-N 2.95Å |
| 16 | F | 97.8 | Very high | 95.7 | Very high | 132 Ų | 132 | 87.1 Ų | 87.1 | 58% | 0.579 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.2 | -42.4 | 176.7 | -83.8 | -68.4 | 0 | 0 | 0 | 112.4 | I12 V13 Y18 L19 L20 | I12-F16 HydrophobicContact CG2-CD2 3.66Å; I12-F16 HydrophobicContact CG2-CE2 3.63Å; I12-F16 VanDerWaalsContact O-CD2 3.27Å; I12-F16 WeakPolarHBondContact O-CD2 3.36Å; I12-F16 PolarHBondContact O-N 3.48Å; V13-F16 PolarHBondContact O-N 2.99Å; F16-Y18 VanDerWaalsContact C-N 3.34Å; F16-L19 PolarHBondContact O-N 3.39Å; F16-L20 WeakPolarHBondContact O-CG 3.38Å; F16-L20 PolarHBondContact O-N 3.36Å |
| 17 | T | 98.1 | Very high | 96 | Very high | 71 Ų | 71 | 88.6 Ų | 88.6 | 44% | 0.436 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.7 | -38.4 | 175.5 | 56 | 0 | 0 | 0 | 0 | 111.7 | V13 C14 L19 L20 V21 | V13-T17 HydrophobicContact CG1-CG2 4.39Å; V13-T17 WeakPolarHBondContact O-CG2 3.47Å; V13-T17 PolarHBondContact O-N 3.04Å; V13-T17 PolarHBondContact O-OG1 3.21Å; V13-T17 VanDerWaalsContact O-OG1 3.12Å; C14-T17 WeakPolarHBondContact CA-OG1 3.48Å; C14-T17 PolarHBondContact O-OG1 3.19Å; T17-L19 VanDerWaalsContact C-N 3.34Å; T17-L19 PolarHBondContact O-N 3.19Å; T17-L20 PolarHBondContact O-N 3.5Å; T17-V21 WeakPolarHBondContact O-CG2 3.35Å; T17-V21 PolarHBondContact O-N 2.94Å |
| 18 | Y | 98 | Very high | 96.6 | Very high | 181 Ų | 181 | 90.2 Ų | 90.2 | 71% | 0.71 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.9 | -41.3 | 174 | -172.6 | -97.5 | 0 | 0 | 0 | 112.1 | C14 T15 F16 G22 | C14-Y18 WeakPolarHBondContact O-CB 3.23Å; C14-Y18 PolarHBondContact O-N 3.02Å; T15-Y18 PolarHBondContact O-N 2.89Å; F16-Y18 VanDerWaalsContact C-N 3.34Å; Y18-G22 PolarHBondContact O-N 3.22Å |
| 19 | L | 98.3 | Very high | 97 | Very high | 107 Ų | 107 | 92.4 Ų | 92.4 | 56% | 0.56 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.3 | -42.6 | 174.4 | -72.5 | 171.8 | 0 | 0 | 0 | 112.4 | T15 F16 T17 G22 A23 | T15-L19 HydrophobicContact CG2-CD1 4.43Å; T15-L19 WeakPolarHBondContact O-CG 3.37Å; T15-L19 PolarHBondContact O-N 2.95Å; F16-L19 PolarHBondContact O-N 3.39Å; T17-L19 VanDerWaalsContact C-N 3.34Å; T17-L19 PolarHBondContact O-N 3.19Å; L19-G22 PolarHBondContact O-N 3.19Å; L19-A23 WeakPolarHBondContact O-CB 3.28Å; L19-A23 PolarHBondContact O-N 2.98Å |
| 20 | L | 98.4 | Very high | 97.3 | Very high | 123 Ų | 123 | 92.8 Ų | 92.8 | 64% | 0.644 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.2 | -44.1 | 177.8 | -71.7 | 172.2 | 0 | 0 | 0 | 112 | F16 T17 A23 A24 | F16-L20 WeakPolarHBondContact O-CG 3.38Å; F16-L20 PolarHBondContact O-N 3.36Å; T17-L20 PolarHBondContact O-N 3.5Å; L20-A23 PolarHBondContact O-N 3.45Å; L20-A24 PolarHBondContact O-N 2.82Å |
| 21 | V | 98.5 | Very high | 97.4 | Very high | 95 Ų | 95 | 92.2 Ų | 92.2 | 58% | 0.576 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.2 | -45.4 | 174.8 | 172.8 | 0 | 0 | 0 | 0 | 110.3 | T17 A23 A24 V25 | T17-V21 WeakPolarHBondContact O-CG2 3.35Å; T17-V21 PolarHBondContact O-N 2.94Å; V21-A23 PolarHBondContact O-N 2.96Å; V21-A24 PolarHBondContact O-N 3.42Å; V21-V25 HydrophobicContact CG1-CG2 4.43Å; V21-V25 WeakPolarHBondContact O-CG2 3.23Å; V21-V25 PolarHBondContact O-N 3.29Å |
| 22 | G | 98.2 | Very high | 97.7 | Very high | 22 Ų | 22 | 91.7 Ų | 91.7 | 23% | 0.227 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -57.9 | -47.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y18 L19 A24 V25 F26 | Y18-G22 PolarHBondContact O-N 3.22Å; L19-G22 PolarHBondContact O-N 3.19Å; G22-A24 PolarHBondContact O-N 2.9Å; G22-V25 PolarHBondContact O-N 3.39Å; G22-F26 WeakPolarHBondContact O-CD2 3.4Å; G22-F26 PolarHBondContact O-N 3.47Å |
| 23 | A | 98.4 | Very high | 97.7 | Very high | 61 Ų | 61 | 90.8 Ų | 90.8 | 50% | 0.504 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.4 | -44.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L19 L20 V21 F26 D27 | L19-A23 WeakPolarHBondContact O-CB 3.28Å; L19-A23 PolarHBondContact O-N 2.98Å; L20-A23 PolarHBondContact O-N 3.45Å; V21-A23 PolarHBondContact O-N 2.96Å; A23-F26 PolarHBondContact O-N 3.43Å; A23-D27 VanDerWaalsContact O-CB 3.27Å; A23-D27 WeakPolarHBondContact O-CB 3.32Å; A23-D27 PolarHBondContact O-N 3.37Å |
| 24 | A | 98.5 | Very high | 97.7 | Very high | 62 Ų | 62 | 92.9 Ų | 92.9 | 51% | 0.512 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.4 | -40.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | L20 V21 G22 A28 | L20-A24 PolarHBondContact O-N 2.82Å; V21-A24 PolarHBondContact O-N 3.42Å; G22-A24 PolarHBondContact O-N 2.9Å; A24-A28 WeakPolarHBondContact O-CB 3.23Å; A24-A28 PolarHBondContact O-N 2.72Å; A24-A28 VanDerWaalsContact O-N 3.08Å |
| 25 | V | 98.4 | Very high | 97.7 | Very high | 75 Ų | 75 | 94.2 Ų | 94.2 | 46% | 0.455 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -69.2 | -44.7 | 178 | 172.8 | 0 | 0 | 0 | 0 | 111.2 | V21 G22 A28 L29 | V21-V25 HydrophobicContact CG1-CG2 4.43Å; V21-V25 WeakPolarHBondContact O-CG2 3.23Å; V21-V25 PolarHBondContact O-N 3.29Å; G22-V25 PolarHBondContact O-N 3.39Å; V25-A28 PolarHBondContact O-N 3.44Å; V25-L29 HydrophobicContact CG1-CD1 3.7Å; V25-L29 HydrophobicContact CG1-CG 4.36Å; V25-L29 WeakPolarHBondContact O-CB 3.39Å; V25-L29 VanDerWaalsContact O-CG 3.25Å; V25-L29 WeakPolarHBondContact O-CG 3.31Å; V25-L29 PolarHBondContact O-N 3.49Å |
| 26 | F | 98.3 | Very high | 97.7 | Very high | 141 Ų | 141 | 97.7 Ų | 97.7 | 62% | 0.618 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.3 | -39.6 | 177.9 | -74.8 | -58.7 | 0 | 0 | 0 | 112.5 | G22 A23 A28 L29 E30 | G22-F26 WeakPolarHBondContact O-CD2 3.4Å; G22-F26 PolarHBondContact O-N 3.47Å; A23-F26 PolarHBondContact O-N 3.43Å; F26-A28 PolarHBondContact O-N 2.85Å; F26-L29 PolarHBondContact O-N 3.31Å; F26-E30 WeakPolarHBondContact O-CB 3.42Å; F26-E30 PolarHBondContact O-N 3.1Å |
| 27 | D | 98.3 | Very high | 97.6 | Very high | 104 Ų | 104 | 96.7 Ų | 96.7 | 56% | 0.556 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.1 | -46.5 | 172.9 | -178.7 | 49.8 | 0 | 0 | 0 | 111.1 | A23 L29 S31 | A23-D27 VanDerWaalsContact O-CB 3.27Å; A23-D27 WeakPolarHBondContact O-CB 3.32Å; A23-D27 PolarHBondContact O-N 3.37Å; D27-L29 VanDerWaalsContact C-N 3.29Å; D27-L29 PolarHBondContact O-N 2.91Å; D27-S31 WeakPolarHBondContact CA-OG 3.45Å; D27-S31 WeakPolarHBondContact O-CB 3.39Å; D27-S31 PolarHBondContact O-N 2.89Å; D27-S31 VanDerWaalsContact O-N 3.15Å; D27-S31 PolarHBondContact O-OG 3.13Å; D27-S31 WeakPolarHBondContact OD1-CB 3.4Å; D27-S31 PolarHBondContact OD1-OG 2.85Å |
| 28 | A | 98.1 | Very high | 97.5 | Very high | 80 Ų | 80 | 101.2 Ų | 101.2 | 66% | 0.661 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.9 | -29 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | A24 V25 F26 | A24-A28 WeakPolarHBondContact O-CB 3.23Å; A24-A28 PolarHBondContact O-N 2.72Å; A24-A28 VanDerWaalsContact O-N 3.08Å; V25-A28 PolarHBondContact O-N 3.44Å; F26-A28 PolarHBondContact O-N 2.85Å |
| 29 | L | 97.6 | Very high | 97.5 | Very high | 116 Ų | 116 | 98.6 Ų | 98.6 | 61% | 0.607 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -91.6 | -38.5 | -177.4 | -68 | 174.7 | 0 | 0 | 0 | 113.3 | V25 F26 D27 | V25-L29 HydrophobicContact CG1-CD1 3.7Å; V25-L29 HydrophobicContact CG1-CG 4.36Å; V25-L29 WeakPolarHBondContact O-CB 3.39Å; V25-L29 VanDerWaalsContact O-CG 3.25Å; V25-L29 WeakPolarHBondContact O-CG 3.31Å; V25-L29 PolarHBondContact O-N 3.49Å; F26-L29 PolarHBondContact O-N 3.31Å; D27-L29 VanDerWaalsContact C-N 3.29Å; D27-L29 PolarHBondContact O-N 2.91Å |
| 30 | E | 97.2 | Very high | 97.4 | Very high | 102 Ų | 102 | 98.2 Ų | 98.2 | 48% | 0.477 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -106.6 | -25.2 | -168.3 | -63.9 | -61.4 | 156.2 | 0 | 0 | 114.2 | F26 D32 N33 E34 | F26-E30 WeakPolarHBondContact O-CB 3.42Å; F26-E30 PolarHBondContact O-N 3.1Å; E30-D32 PolarHBondContact O-N 3.5Å; E30-N33 WeakPolarHBondContact O-CB 3.48Å; E30-N33 PolarHBondContact O-N 3.42Å; E30-N33 VanDerWaalsContact O-N 3.08Å; E30-N33 PolarHBondContact OE2-ND2 2.98Å; E30-E34 PolarHBondContact O-N 2.98Å |
| 31 | S | 96.9 | Very high | 97.2 | Very high | 36 Ų | 36 | 96.3 Ų | 96.3 | 25% | 0.252 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.1 | -43.1 | -171.3 | -65.7 | 0 | 0 | 0 | 0 | 113.2 | D27 N33 E34 L35 | D27-S31 WeakPolarHBondContact CA-OG 3.45Å; D27-S31 WeakPolarHBondContact O-CB 3.39Å; D27-S31 PolarHBondContact O-N 2.89Å; D27-S31 VanDerWaalsContact O-N 3.15Å; D27-S31 PolarHBondContact O-OG 3.13Å; D27-S31 WeakPolarHBondContact OD1-CB 3.4Å; D27-S31 PolarHBondContact OD1-OG 2.85Å; S31-N33 VanDerWaalsContact C-N 3.29Å; S31-N33 PolarHBondContact O-N 3.45Å; S31-E34 PolarHBondContact O-N 3.45Å; S31-L35 WeakPolarHBondContact O-CG 3.26Å; S31-L35 PolarHBondContact O-N 2.88Å; S31-L35 VanDerWaalsContact O-N 3.09Å |
| 32 | D | 96.7 | Very high | 97 | Very high | 97 Ų | 97 | 96.5 Ų | 96.5 | 52% | 0.519 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.2 | -36.1 | 174.3 | -86.5 | -2.9 | 0 | 0 | 0 | 112.2 | E30 R36 | E30-D32 PolarHBondContact O-N 3.5Å; D32-R36 WeakPolarHBondContact O-CG 3.23Å; D32-R36 PolarHBondContact O-N 2.92Å; D32-R36 IonicContact OD2-NH2 3.43Å |
| 33 | N | 96.2 | Very high | 96.9 | Very high | 62 Ų | 62 | 100.4 Ų | 100.4 | 33% | 0.332 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -69.7 | -44.9 | 179.4 | -177.5 | 50 | 0 | 0 | 0 | 110.9 | E30 S31 L35 R36 Q37 | E30-N33 WeakPolarHBondContact O-CB 3.48Å; E30-N33 PolarHBondContact O-N 3.42Å; E30-N33 VanDerWaalsContact O-N 3.08Å; E30-N33 PolarHBondContact OE2-ND2 2.98Å; S31-N33 VanDerWaalsContact C-N 3.29Å; S31-N33 PolarHBondContact O-N 3.45Å; N33-L35 PolarHBondContact O-N 3.26Å; N33-R36 PolarHBondContact O-N 3.2Å; N33-Q37 WeakPolarHBondContact O-CB 3.29Å; N33-Q37 WeakPolarHBondContact O-CG 3.22Å; N33-Q37 PolarHBondContact O-N 3.06Å |
| 34 | E | 96.6 | Very high | 96.7 | Very high | 122 Ų | 122 | 101.4 Ų | 101.4 | 57% | 0.57 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -58.2 | -46.6 | 175.2 | -170.7 | -162.9 | -172.3 | 0 | 0 | 111.2 | E30 S31 R36 Q37 R38 | E30-E34 PolarHBondContact O-N 2.98Å; S31-E34 PolarHBondContact O-N 3.45Å; E34-R36 PolarHBondContact O-N 2.84Å; E34-Q37 PolarHBondContact O-N 3.42Å; E34-R38 VanDerWaalsContact O-CB 3.31Å; E34-R38 WeakPolarHBondContact O-CB 3.32Å; E34-R38 PolarHBondContact O-N 3.48Å |
| 35 | L | 97.2 | Very high | 96.5 | Very high | 107 Ų | 107 | 100.3 Ų | 100.3 | 56% | 0.56 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.2 | -45.7 | 178.6 | -73.9 | 172.5 | 0 | 0 | 0 | 111.9 | S31 N33 R38 E39 | S31-L35 WeakPolarHBondContact O-CG 3.26Å; S31-L35 PolarHBondContact O-N 2.88Å; S31-L35 VanDerWaalsContact O-N 3.09Å; N33-L35 PolarHBondContact O-N 3.26Å; L35-R38 PolarHBondContact O-N 2.8Å; L35-E39 WeakPolarHBondContact O-CB 3.33Å; L35-E39 PolarHBondContact O-N 3.29Å |
| 36 | R | 96.9 | Very high | 96.3 | Very high | 155 Ų | 155 | 102.6 Ų | 102.6 | 59% | 0.585 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.6 | -42.9 | 176.8 | -70.7 | 176.6 | -163.4 | 130.9 | 10 | 112 | D32 N33 E34 R38 E39 L40 | D32-R36 WeakPolarHBondContact O-CG 3.23Å; D32-R36 PolarHBondContact O-N 2.92Å; D32-R36 IonicContact OD2-NH2 3.43Å; N33-R36 PolarHBondContact O-N 3.2Å; E34-R36 PolarHBondContact O-N 2.84Å; R36-R38 VanDerWaalsContact C-N 3.33Å; R36-E39 PolarHBondContact O-N 2.96Å; R36-L40 WeakPolarHBondContact O-CB 3.41Å; R36-L40 PolarHBondContact O-N 3.07Å |
| 37 | Q | 95.3 | Very high | 96.2 | Very high | 111 Ų | 111 | 104.5 Ų | 104.5 | 52% | 0.519 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.8 | -40 | 177.5 | -75.5 | -174.8 | -19.8 | 0 | 0 | 111.7 | N33 E34 T41 | N33-Q37 WeakPolarHBondContact O-CB 3.29Å; N33-Q37 WeakPolarHBondContact O-CG 3.22Å; N33-Q37 PolarHBondContact O-N 3.06Å; E34-Q37 PolarHBondContact O-N 3.42Å; Q37-T41 VanDerWaalsContact O-CB 3.3Å; Q37-T41 WeakPolarHBondContact O-CB 3.47Å; Q37-T41 PolarHBondContact O-N 3.21Å; Q37-T41 PolarHBondContact O-OG1 3.13Å |
| 38 | R | 96 | Very high | 96.1 | Very high | 166 Ų | 166 | 102.9 Ų | 102.9 | 63% | 0.626 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.8 | -47.6 | 176 | -175.7 | 175.2 | 179.9 | 174.4 | -1.2 | 111.6 | E34 L35 R36 L40 T41 E42 | E34-R38 VanDerWaalsContact O-CB 3.31Å; E34-R38 WeakPolarHBondContact O-CB 3.32Å; E34-R38 PolarHBondContact O-N 3.48Å; L35-R38 PolarHBondContact O-N 2.8Å; R36-R38 VanDerWaalsContact C-N 3.33Å; R38-L40 PolarHBondContact O-N 2.86Å; R38-T41 PolarHBondContact O-N 3.35Å; R38-E42 WeakPolarHBondContact O-CG 3.47Å; R38-E42 PolarHBondContact O-N 2.84Å |
| 39 | E | 96.9 | Very high | 96 | Very high | 126 Ų | 126 | 100.7 Ų | 100.7 | 59% | 0.589 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -59.4 | -47.9 | 176.4 | -174.7 | 178.7 | -166.8 | 0 | 0 | 111.1 | L35 R36 T41 E42 L43 | L35-E39 WeakPolarHBondContact O-CB 3.33Å; L35-E39 PolarHBondContact O-N 3.29Å; R36-E39 PolarHBondContact O-N 2.96Å; E39-T41 VanDerWaalsContact C-N 3.31Å; E39-T41 PolarHBondContact O-N 2.86Å; E39-E42 PolarHBondContact O-N 3.42Å; E39-L43 HydrophobicContact CG-CD1 4.13Å; E39-L43 HydrophobicContact CG-CG 4.47Å; E39-L43 WeakPolarHBondContact O-CB 3.49Å; E39-L43 VanDerWaalsContact O-CG 3.26Å; E39-L43 WeakPolarHBondContact O-CG 3.2Å; E39-L43 PolarHBondContact O-N 2.92Å |
| 40 | L | 96.2 | Very high | 95.9 | Very high | 99 Ų | 99 | 99.8 Ų | 99.8 | 52% | 0.518 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59.5 | -42.2 | 176.5 | 179.3 | 61.3 | 0 | 0 | 0 | 112 | R36 R38 L43 L44 | R36-L40 WeakPolarHBondContact O-CB 3.41Å; R36-L40 PolarHBondContact O-N 3.07Å; R38-L40 PolarHBondContact O-N 2.86Å; L40-L43 PolarHBondContact O-N 3.5Å; L40-L44 HydrophobicContact CD1-CD1 4.11Å; L40-L44 HydrophobicContact CD1-CG 4.14Å; L40-L44 HydrophobicContact CG-CD1 4.03Å; L40-L44 HydrophobicContact CG-CG 4.45Å; L40-L44 WeakPolarHBondContact O-CB 3.37Å; L40-L44 VanDerWaalsContact O-CG 3.26Å; L40-L44 WeakPolarHBondContact O-CG 3.46Å; L40-L44 PolarHBondContact O-N 3.41Å |
| 41 | T | 94.5 | Very high | 95.9 | Very high | 83 Ų | 83 | 102 Ų | 102 | 51% | 0.509 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.5 | -43.9 | 179.2 | -60.2 | 0 | 0 | 0 | 0 | 111.3 | Q37 R38 E39 L44 R45 | Q37-T41 VanDerWaalsContact O-CB 3.3Å; Q37-T41 WeakPolarHBondContact O-CB 3.47Å; Q37-T41 PolarHBondContact O-N 3.21Å; Q37-T41 PolarHBondContact O-OG1 3.13Å; R38-T41 PolarHBondContact O-N 3.35Å; E39-T41 VanDerWaalsContact C-N 3.31Å; E39-T41 PolarHBondContact O-N 2.86Å; T41-L44 PolarHBondContact O-N 3.08Å; T41-R45 VanDerWaalsContact O-CB 3.24Å; T41-R45 WeakPolarHBondContact O-CB 3.31Å; T41-R45 PolarHBondContact O-N 3.09Å |
| 42 | E | 94.8 | Very high | 95.8 | Very high | 100 Ų | 100 | 107.2 Ų | 107.2 | 47% | 0.467 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.6 | -40.9 | 176.1 | -71.7 | -57.8 | 147 | 0 | 0 | 112.2 | R38 E39 R45 H46 | R38-E42 WeakPolarHBondContact O-CG 3.47Å; R38-E42 PolarHBondContact O-N 2.84Å; E39-E42 PolarHBondContact O-N 3.42Å; E42-R45 WeakPolarHBondContact O-CB 3.11Å; E42-R45 PolarHBondContact O-N 3.1Å; E42-H46 WeakPolarHBondContact O-CB 3.47Å; E42-H46 PolarHBondContact O-N 3.31Å |
| 43 | L | 96.1 | Very high | 95.8 | Very high | 104 Ų | 104 | 110 Ų | 110 | 55% | 0.545 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 174.5 | -72.6 | 175.1 | 0 | 0 | 0 | 111.8 | E39 L40 H46 R47 | E39-L43 HydrophobicContact CG-CD1 4.13Å; E39-L43 HydrophobicContact CG-CG 4.47Å; E39-L43 WeakPolarHBondContact O-CB 3.49Å; E39-L43 VanDerWaalsContact O-CG 3.26Å; E39-L43 WeakPolarHBondContact O-CG 3.2Å; E39-L43 PolarHBondContact O-N 2.92Å; L40-L43 PolarHBondContact O-N 3.5Å; L43-H46 PolarHBondContact O-N 3.33Å; L43-R47 VanDerWaalsContact O-CB 3.31Å; L43-R47 WeakPolarHBondContact O-CB 3.33Å; L43-R47 PolarHBondContact O-N 3.07Å |
| 44 | L | 94.7 | Very high | 95.8 | Very high | 82 Ų | 82 | 108.5 Ų | 108.5 | 43% | 0.429 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.2 | -41.9 | 177.1 | -73 | 175 | 0 | 0 | 0 | 111.8 | L40 T41 R47 I48 | L40-L44 HydrophobicContact CD1-CD1 4.11Å; L40-L44 HydrophobicContact CD1-CG 4.14Å; L40-L44 HydrophobicContact CG-CD1 4.03Å; L40-L44 HydrophobicContact CG-CG 4.45Å; L40-L44 WeakPolarHBondContact O-CB 3.37Å; L40-L44 VanDerWaalsContact O-CG 3.26Å; L40-L44 WeakPolarHBondContact O-CG 3.46Å; L40-L44 PolarHBondContact O-N 3.41Å; T41-L44 PolarHBondContact O-N 3.08Å; L44-R47 PolarHBondContact O-N 2.88Å; L44-I48 WeakPolarHBondContact O-CB 3.34Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.42Å; L44-I48 PolarHBondContact O-N 3.41Å |
| 45 | R | 94.1 | Very high | 95.7 | Very high | 38 Ų | 38 | 105.2 Ų | 105.2 | 14% | 0.143 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -54.2 | -54 | 172.9 | 169.8 | 179.5 | 179.7 | 117.6 | 5.5 | 110.4 | T41 E42 R47 I48 M49 Y59 E63 | T41-R45 VanDerWaalsContact O-CB 3.24Å; T41-R45 WeakPolarHBondContact O-CB 3.31Å; T41-R45 PolarHBondContact O-N 3.09Å; E42-R45 WeakPolarHBondContact O-CB 3.11Å; E42-R45 PolarHBondContact O-N 3.1Å; R45-R47 PolarHBondContact O-N 3.37Å; R45-I48 PolarHBondContact O-N 3.41Å; R45-M49 HydrophobicContact CG-SD 4.06Å; R45-M49 WeakPolarHBondContact O-CG 3.46Å; R45-M49 PolarHBondContact O-N 3.37Å; R45-Y59 HydrophobicContact CG-CD1 4.42Å; R45-Y59 HydrophobicContact CG-CE1 3.86Å; R45-Y59 HydrophobicContact CG-CE2 4.12Å; R45-Y59 VanDerWaalsContact CZ-CE1 3.48Å; R45-E63 IonicContact NH1-OE1 3.95Å; R45-E63 IonicContact NH1-OE2 3.34Å; R45-E63 PolarHBondContact NH1-OE2 3.32Å |
| 46 | H | 94.7 | Very high | 95.6 | Very high | 123 Ų | 123 | 105 Ų | 105 | 57% | 0.569 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.4 | -45.1 | 179.3 | -175.8 | 69 | 0 | 0 | 0 | 111.8 | E42 L43 I48 M49 V50 | E42-H46 WeakPolarHBondContact O-CB 3.47Å; E42-H46 PolarHBondContact O-N 3.31Å; L43-H46 PolarHBondContact O-N 3.33Å; H46-I48 VanDerWaalsContact C-N 3.34Å; H46-I48 PolarHBondContact O-N 3.3Å; H46-M49 PolarHBondContact O-N 3.39Å; H46-V50 WeakPolarHBondContact O-CG2 3.14Å; H46-V50 PolarHBondContact O-N 3.19Å |
| 47 | R | 95.7 | Very high | 95.5 | Very high | 182 Ų | 182 | 107.5 Ų | 107.5 | 69% | 0.687 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.7 | -42.6 | 178.6 | -169 | 178.3 | -162.6 | 175.5 | 6.2 | 112.5 | L43 L44 R45 K51 | L43-R47 VanDerWaalsContact O-CB 3.31Å; L43-R47 WeakPolarHBondContact O-CB 3.33Å; L43-R47 PolarHBondContact O-N 3.07Å; L44-R47 PolarHBondContact O-N 2.88Å; R45-R47 PolarHBondContact O-N 3.37Å; R47-K51 WeakPolarHBondContact O-CB 3.49Å; R47-K51 PolarHBondContact O-N 3Å |
| 48 | I | 95.2 | Very high | 95.5 | Very high | 70 Ų | 70 | 106.7 Ų | 106.7 | 36% | 0.359 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.7 | -46.1 | 177.2 | -71.7 | 170.2 | 0 | 0 | 0 | 110.2 | L44 R45 H46 V50 K51 Y52 I54 Y59 | L44-I48 WeakPolarHBondContact O-CB 3.34Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.42Å; L44-I48 PolarHBondContact O-N 3.41Å; R45-I48 PolarHBondContact O-N 3.41Å; H46-I48 VanDerWaalsContact C-N 3.34Å; H46-I48 PolarHBondContact O-N 3.3Å; I48-V50 VanDerWaalsContact C-N 3.35Å; I48-V50 PolarHBondContact O-N 2.9Å; I48-K51 PolarHBondContact O-N 3.49Å; I48-Y52 HydrophobicContact CG2-CD2 3.97Å; I48-Y52 HydrophobicContact CG2-CE2 4.47Å; I48-Y52 WeakPolarHBondContact O-CD2 3.27Å; I48-Y52 PolarHBondContact O-N 3.48Å; I48-I54 HydrophobicContact CG2-CD1 4.32Å; I48-Y59 HydrophobicContact CG2-CE2 4.48Å |
| 49 | M | 95.6 | Very high | 95.4 | Very high | 33 Ų | 33 | 100.6 Ų | 100.6 | 16% | 0.163 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -58.7 | -45.3 | 179.3 | -73.3 | 179.3 | 63.2 | 0 | 0 | 112 | R45 H46 N53 I54 E56 Y59 | R45-M49 HydrophobicContact CG-SD 4.06Å; R45-M49 WeakPolarHBondContact O-CG 3.46Å; R45-M49 PolarHBondContact O-N 3.37Å; H46-M49 PolarHBondContact O-N 3.39Å; M49-N53 CarbonylContact O-C 3.57Å; M49-N53 VanDerWaalsContact O-CA 3.31Å; M49-N53 WeakPolarHBondContact O-CA 3.3Å; M49-N53 PolarHBondContact O-N 3.35Å; M49-I54 PolarHBondContact O-N 2.86Å; M49-E56 HydrophobicContact CE-CB 3.99Å; M49-E56 HydrophobicContact CE-CG 4.34Å; M49-Y59 HydrophobicContact CG-CD2 3.62Å; M49-Y59 HydrophobicContact CG-CE2 4.27Å; M49-Y59 HydrophobicContact CG-CG 4.06Å; M49-Y59 HydrophobicContact SD-CD2 4.18Å; M49-Y59 HydrophobicContact SD-CG 4.06Å |
| 50 | V | 96.1 | Very high | 95.3 | Very high | 98 Ų | 98 | 101.7 Ų | 101.7 | 59% | 0.594 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -68.9 | -47.3 | 177.7 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | H46 I48 Y52 N53 | H46-V50 WeakPolarHBondContact O-CG2 3.14Å; H46-V50 PolarHBondContact O-N 3.19Å; I48-V50 VanDerWaalsContact C-N 3.35Å; I48-V50 PolarHBondContact O-N 2.9Å; V50-Y52 VanDerWaalsContact C-N 3.28Å; V50-Y52 PolarHBondContact O-N 2.91Å; V50-N53 PolarHBondContact O-N 3.35Å |
| 51 | K | 97 | Very high | 95.2 | Very high | 148 Ų | 148 | 101.2 Ų | 101.2 | 64% | 0.643 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -59.3 | -38 | -177.3 | -179.4 | 178.8 | 179.1 | -171.5 | 0 | 112.8 | R47 I48 | R47-K51 WeakPolarHBondContact O-CB 3.49Å; R47-K51 PolarHBondContact O-N 3Å; I48-K51 PolarHBondContact O-N 3.49Å |
| 52 | Y | 96.1 | Very high | 95.2 | Very high | 145 Ų | 145 | 101.2 Ų | 101.2 | 57% | 0.569 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.7 | 8 | -176.5 | -63.5 | -74 | 0 | 0 | 0 | 113.5 | I48 V50 I54 | I48-Y52 HydrophobicContact CG2-CD2 3.97Å; I48-Y52 HydrophobicContact CG2-CE2 4.47Å; I48-Y52 WeakPolarHBondContact O-CD2 3.27Å; I48-Y52 PolarHBondContact O-N 3.48Å; V50-Y52 VanDerWaalsContact C-N 3.28Å; V50-Y52 PolarHBondContact O-N 2.91Å; Y52-I54 VanDerWaalsContact C-N 3.29Å; Y52-I54 PolarHBondContact O-N 2.99Å |
| 53 | N | 96.7 | Very high | 95.1 | Very high | 156 Ų | 156 | 100.6 Ų | 100.6 | 83% | 0.834 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.8 | 45.3 | -178.8 | -165 | 35.4 | 0 | 0 | 0 | 113.2 | M49 V50 | M49-N53 CarbonylContact O-C 3.57Å; M49-N53 VanDerWaalsContact O-CA 3.31Å; M49-N53 WeakPolarHBondContact O-CA 3.3Å; M49-N53 PolarHBondContact O-N 3.35Å; V50-N53 PolarHBondContact O-N 3.35Å |
| 54 | I | 95.5 | Very high | 95 | Very high | 31 Ų | 31 | 98 Ų | 98 | 16% | 0.159 | 46% | 0.461 | C | S | . | . | trans | -91.6 | 126.9 | -177.2 | -58.9 | 171.1 | 0 | 0 | 0 | 109.1 | I48 M49 Y52 D58 M62 | I48-I54 HydrophobicContact CG2-CD1 4.32Å; M49-I54 PolarHBondContact O-N 2.86Å; Y52-I54 VanDerWaalsContact C-N 3.29Å; Y52-I54 PolarHBondContact O-N 2.99Å; I54-D58 HydrophobicContact CG2-CB 3.78Å; I54-M62 HydrophobicContact CD1-CE 3.93Å | ||
| 55 | S | 95.6 | Very high | 94.9 | Very high | 53 Ų | 53 | 98.2 Ų | 98.2 | 37% | 0.371 | 47% | 0.466 | S | S | . | . | trans | -68.4 | 156.1 | 174.7 | 82.6 | 0 | 0 | 0 | 0 | 111.5 | R57 D58 Y59 | S55-R57 PolarHBondContact O-N 2.86Å; S55-D58 WeakPolarHBondContact CB-OD2 3.38Å; S55-D58 PolarHBondContact O-N 3.03Å; S55-D58 VanDerWaalsContact O-N 3.14Å; S55-D58 PolarHBondContact OG-N 3.29Å; S55-D58 PolarHBondContact OG-OD2 3.26Å; S55-Y59 PolarHBondContact O-N 3.27Å | ||
| 56 | E | 94.2 | Very high | 94.8 | Very high | 101 Ų | 101 | 100.4 Ų | 100.4 | 47% | 0.472 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60 | -32.9 | 178.8 | -162.8 | -170.3 | 159.6 | 0 | 0 | 112.6 | M49 R60 | M49-E56 HydrophobicContact CE-CB 3.99Å; M49-E56 HydrophobicContact CE-CG 4.34Å; E56-R60 WeakPolarHBondContact O-CG 3.4Å; E56-R60 PolarHBondContact O-N 3.41Å; E56-R60 VanDerWaalsContact O-N 3.12Å; E56-R60 IonicContact OE1-CZ 3.34Å; E56-R60 IonicContact OE1-NE 2.85Å; E56-R60 PolarHBondContact OE1-NE 3Å; E56-R60 IonicContact OE1-NH2 3.21Å; E56-R60 PolarHBondContact OE1-NH2 2.86Å |
| 57 | R | 94.6 | Very high | 94.5 | Very high | 209 Ų | 209 | 98.8 Ų | 98.8 | 79% | 0.789 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -66.8 | -45.9 | 176.1 | -66.2 | -177.7 | -177.2 | 178.3 | 1.5 | 111.1 | S55 Y59 R60 V61 | S55-R57 PolarHBondContact O-N 2.86Å; R57-Y59 VanDerWaalsContact C-N 3.33Å; R57-Y59 PolarHBondContact O-N 2.83Å; R57-R60 PolarHBondContact O-N 3.28Å; R57-V61 WeakPolarHBondContact O-CG2 3.38Å; R57-V61 PolarHBondContact O-N 3.37Å; R57-V61 VanDerWaalsContact O-N 3.07Å |
| 58 | D | 95.3 | Very high | 94.1 | Very high | 93 Ų | 93 | 97.6 Ų | 97.6 | 50% | 0.497 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.5 | -38.5 | -179.9 | -60.3 | -37 | 0 | 0 | 0 | 111.2 | I54 S55 V61 M62 | I54-D58 HydrophobicContact CG2-CB 3.78Å; S55-D58 WeakPolarHBondContact CB-OD2 3.38Å; S55-D58 PolarHBondContact O-N 3.03Å; S55-D58 VanDerWaalsContact O-N 3.14Å; S55-D58 PolarHBondContact OG-N 3.29Å; S55-D58 PolarHBondContact OG-OD2 3.26Å; D58-V61 PolarHBondContact O-N 2.98Å; D58-M62 WeakPolarHBondContact O-CB 3.41Å; D58-M62 PolarHBondContact O-N 3.44Å |
| 59 | Y | 94.6 | Very high | 93.7 | Very high | 39 Ų | 39 | 96.1 Ų | 96.1 | 15% | 0.153 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -60.9 | -46 | 174.6 | -171.3 | -83.2 | 0 | 0 | 0 | 111.5 | R45 I48 M49 S55 R57 V61 M62 E63 | R45-Y59 HydrophobicContact CG-CD1 4.42Å; R45-Y59 HydrophobicContact CG-CE1 3.86Å; R45-Y59 HydrophobicContact CG-CE2 4.12Å; R45-Y59 VanDerWaalsContact CZ-CE1 3.48Å; I48-Y59 HydrophobicContact CG2-CE2 4.48Å; M49-Y59 HydrophobicContact CG-CD2 3.62Å; M49-Y59 HydrophobicContact CG-CE2 4.27Å; M49-Y59 HydrophobicContact CG-CG 4.06Å; M49-Y59 HydrophobicContact SD-CD2 4.18Å; M49-Y59 HydrophobicContact SD-CG 4.06Å; S55-Y59 PolarHBondContact O-N 3.27Å; R57-Y59 VanDerWaalsContact C-N 3.33Å; R57-Y59 PolarHBondContact O-N 2.83Å; Y59-V61 VanDerWaalsContact C-N 3.32Å; Y59-V61 PolarHBondContact O-N 3.24Å; Y59-M62 WeakPolarHBondContact O-CB 3.18Å; Y59-M62 PolarHBondContact O-N 2.84Å; Y59-E63 HydrophobicContact CD1-CB 4.49Å; Y59-E63 HydrophobicContact CE1-CB 4.34Å; Y59-E63 VanDerWaalsContact O-CB 3.29Å; Y59-E63 WeakPolarHBondContact O-CB 3.2Å; Y59-E63 PolarHBondContact O-N 3.12Å |
| 60 | R | 94.1 | Very high | 93.2 | Very high | 148 Ų | 148 | 99.1 Ų | 99.1 | 56% | 0.558 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.1 | -38.2 | 177.3 | -71.5 | 178.3 | -169 | -152.7 | 5.1 | 112.4 | E56 R57 S64 | E56-R60 WeakPolarHBondContact O-CG 3.4Å; E56-R60 PolarHBondContact O-N 3.41Å; E56-R60 VanDerWaalsContact O-N 3.12Å; E56-R60 IonicContact OE1-CZ 3.34Å; E56-R60 IonicContact OE1-NE 2.85Å; E56-R60 PolarHBondContact OE1-NE 3Å; E56-R60 IonicContact OE1-NH2 3.21Å; E56-R60 PolarHBondContact OE1-NH2 2.86Å; R57-R60 PolarHBondContact O-N 3.28Å; R60-S64 WeakPolarHBondContact O-CB 3.4Å; R60-S64 PolarHBondContact O-N 3.37Å |
| 61 | V | 95 | Very high | 92.5 | Very high | 89 Ų | 89 | 96.9 Ų | 96.9 | 54% | 0.539 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.3 | -48 | 174.1 | 173.4 | 0 | 0 | 0 | 0 | 110.1 | R57 D58 Y59 E63 S64 V65 | R57-V61 WeakPolarHBondContact O-CG2 3.38Å; R57-V61 PolarHBondContact O-N 3.37Å; R57-V61 VanDerWaalsContact O-N 3.07Å; D58-V61 PolarHBondContact O-N 2.98Å; Y59-V61 VanDerWaalsContact C-N 3.32Å; Y59-V61 PolarHBondContact O-N 3.24Å; V61-E63 PolarHBondContact O-N 3.48Å; V61-S64 WeakPolarHBondContact O-CB 3.31Å; V61-S64 PolarHBondContact O-N 3.25Å; V61-S64 VanDerWaalsContact O-N 3.16Å; V61-S64 PolarHBondContact O-OG 3.02Å; V61-V65 WeakPolarHBondContact O-CG2 3.28Å; V61-V65 PolarHBondContact O-N 3.39Å |
| 62 | M | 93.7 | Very high | 91.7 | Very high | 84 Ų | 84 | 96.9 Ų | 96.9 | 41% | 0.414 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -58.8 | -47.7 | 178.1 | -172.4 | -179.4 | -55.8 | 0 | 0 | 112 | I54 D58 Y59 S64 V65 I66 | I54-M62 HydrophobicContact CD1-CE 3.93Å; D58-M62 WeakPolarHBondContact O-CB 3.41Å; D58-M62 PolarHBondContact O-N 3.44Å; Y59-M62 WeakPolarHBondContact O-CB 3.18Å; Y59-M62 PolarHBondContact O-N 2.84Å; M62-S64 VanDerWaalsContact C-N 3.32Å; M62-S64 PolarHBondContact O-N 3.39Å; M62-V65 PolarHBondContact O-N 2.81Å; M62-V65 VanDerWaalsContact O-N 3.13Å; M62-I66 HydrophobicContact CG-CD1 3.96Å; M62-I66 VanDerWaalsContact O-CG1 3.31Å; M62-I66 WeakPolarHBondContact O-CG1 3.34Å; M62-I66 PolarHBondContact O-N 3.22Å |
| 63 | E | 92.8 | Very high | 90.8 | Very high | 86 Ų | 86 | 97.7 Ų | 97.7 | 40% | 0.402 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -54.5 | -47.4 | 173.7 | -179.5 | 172.3 | -144.6 | 0 | 0 | 111 | R45 Y59 V61 V65 I66 V67 | R45-E63 IonicContact NH1-OE1 3.95Å; R45-E63 IonicContact NH1-OE2 3.34Å; R45-E63 PolarHBondContact NH1-OE2 3.32Å; Y59-E63 HydrophobicContact CD1-CB 4.49Å; Y59-E63 HydrophobicContact CE1-CB 4.34Å; Y59-E63 VanDerWaalsContact O-CB 3.29Å; Y59-E63 WeakPolarHBondContact O-CB 3.2Å; Y59-E63 PolarHBondContact O-N 3.12Å; V61-E63 PolarHBondContact O-N 3.48Å; E63-V65 VanDerWaalsContact C-N 3.32Å; E63-V65 PolarHBondContact O-N 2.9Å; E63-I66 PolarHBondContact O-N 3.35Å; E63-V67 WeakPolarHBondContact O-CG2 3.27Å; E63-V67 PolarHBondContact O-N 2.91Å |
| 64 | S | 92.8 | Very high | 90 | Very high | 49 Ų | 49 | 90.6 Ų | 90.6 | 34% | 0.343 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.1 | -35.5 | 177.6 | 83.4 | 0 | 0 | 0 | 0 | 113.5 | R60 V61 M62 K68 | R60-S64 WeakPolarHBondContact O-CB 3.4Å; R60-S64 PolarHBondContact O-N 3.37Å; V61-S64 WeakPolarHBondContact O-CB 3.31Å; V61-S64 PolarHBondContact O-N 3.25Å; V61-S64 VanDerWaalsContact O-N 3.16Å; V61-S64 PolarHBondContact O-OG 3.02Å; M62-S64 VanDerWaalsContact C-N 3.32Å; M62-S64 PolarHBondContact O-N 3.39Å; S64-K68 WeakPolarHBondContact O-CB 3.31Å; S64-K68 VanDerWaalsContact O-CG 3.27Å; S64-K68 WeakPolarHBondContact O-CG 3.46Å; S64-K68 PolarHBondContact O-N 3.28Å; S64-K68 VanDerWaalsContact O-N 3.16Å |
| 65 | V | 93.2 | Very high | 89.4 | Confident | 88 Ų | 88 | 90.4 Ų | 90.4 | 53% | 0.533 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -71.1 | -43.4 | 176.6 | 172.4 | 0 | 0 | 0 | 0 | 110.1 | V61 M62 E63 K68 S69 | V61-V65 WeakPolarHBondContact O-CG2 3.28Å; V61-V65 PolarHBondContact O-N 3.39Å; M62-V65 PolarHBondContact O-N 2.81Å; M62-V65 VanDerWaalsContact O-N 3.13Å; E63-V65 VanDerWaalsContact C-N 3.32Å; E63-V65 PolarHBondContact O-N 2.9Å; V65-K68 PolarHBondContact O-N 3.28Å; V65-S69 WeakPolarHBondContact O-CB 3.47Å; V65-S69 PolarHBondContact O-N 3.31Å; V65-S69 PolarHBondContact O-OG 3.25Å |
| 66 | I | 92 | Very high | 88.8 | Confident | 84 Ų | 84 | 96 Ų | 96 | 43% | 0.431 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59 | -53.3 | 177.2 | -70.7 | 166.8 | 0 | 0 | 0 | 109.6 | M62 E63 K68 S69 I70 | M62-I66 HydrophobicContact CG-CD1 3.96Å; M62-I66 VanDerWaalsContact O-CG1 3.31Å; M62-I66 WeakPolarHBondContact O-CG1 3.34Å; M62-I66 PolarHBondContact O-N 3.22Å; E63-I66 PolarHBondContact O-N 3.35Å; I66-K68 VanDerWaalsContact C-N 3.32Å; I66-K68 PolarHBondContact O-N 3.43Å; I66-S69 WeakPolarHBondContact O-CB 3.42Å; I66-S69 PolarHBondContact O-N 2.8Å; I66-S69 PolarHBondContact O-OG 3.48Å; I66-I70 WeakPolarHBondContact O-CG1 3.31Å; I66-I70 PolarHBondContact O-N 2.79Å |
| 67 | V | 89.4 | Confident | 88.4 | Confident | 89 Ų | 89 | 91.8 Ų | 91.8 | 54% | 0.539 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -57.8 | -44.2 | -179.6 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | E63 S69 I70 | E63-V67 WeakPolarHBondContact O-CG2 3.27Å; E63-V67 PolarHBondContact O-N 2.91Å; V67-S69 VanDerWaalsContact C-N 3.27Å; V67-S69 PolarHBondContact O-N 3.34Å; V67-I70 PolarHBondContact O-N 3.4Å |
| 68 | K | 87.4 | Confident | 88.2 | Confident | 156 Ų | 156 | 88.3 Ų | 88.3 | 68% | 0.678 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -66.7 | -26.3 | 176.3 | -74.1 | 175.2 | -178.6 | 173.6 | 0 | 113.5 | S64 V65 I66 H72 | S64-K68 WeakPolarHBondContact O-CB 3.31Å; S64-K68 VanDerWaalsContact O-CG 3.27Å; S64-K68 WeakPolarHBondContact O-CG 3.46Å; S64-K68 PolarHBondContact O-N 3.28Å; S64-K68 VanDerWaalsContact O-N 3.16Å; V65-K68 PolarHBondContact O-N 3.28Å; I66-K68 VanDerWaalsContact C-N 3.32Å; I66-K68 PolarHBondContact O-N 3.43Å; K68-H72 PolarHBondContact O-CD2 2.96Å |
| 69 | S | 87.1 | Confident | 88.1 | Confident | 39 Ų | 39 | 90 Ų | 90 | 27% | 0.273 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -81.1 | -20.6 | -179.8 | 76.5 | 0 | 0 | 0 | 0 | 114 | V65 I66 V67 H72 K73 | V65-S69 WeakPolarHBondContact O-CB 3.47Å; V65-S69 PolarHBondContact O-N 3.31Å; V65-S69 PolarHBondContact O-OG 3.25Å; I66-S69 WeakPolarHBondContact O-CB 3.42Å; I66-S69 PolarHBondContact O-N 2.8Å; I66-S69 PolarHBondContact O-OG 3.48Å; V67-S69 VanDerWaalsContact C-N 3.27Å; V67-S69 PolarHBondContact O-N 3.34Å; S69-H72 WeakPolarHBondContact O-CB 3.45Å; S69-H72 PolarHBondContact O-N 3.15Å; S69-K73 PolarHBondContact O-N 3.2Å |
| 70 | I | 84.5 | Confident | 87.9 | Confident | 97 Ų | 97 | 96.5 Ų | 96.5 | 50% | 0.497 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -47.8 | -54.8 | -177.2 | -65.4 | 172.3 | 0 | 0 | 0 | 112.9 | I66 V67 H72 K73 | I66-I70 WeakPolarHBondContact O-CG1 3.31Å; I66-I70 PolarHBondContact O-N 2.79Å; V67-I70 PolarHBondContact O-N 3.4Å; I70-H72 PolarHBondContact O-N 3.09Å; I70-K73 WeakPolarHBondContact O-CB 3.22Å; I70-K73 PolarHBondContact O-N 2.85Å; I70-K73 VanDerWaalsContact O-N 3.1Å |
| 71 | P | 80.3 | Confident | 87.8 | Confident | 51 Ų | 51 | 90.9 Ų | 90.9 | 33% | 0.331 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.8 | -22.4 | -178 | 26 | -36.1 | 0 | 0 | 0 | 113.4 | ||
| 72 | H | 80.1 | Confident | 87.6 | Confident | 148 Ų | 148 | 86.9 Ų | 86.9 | 69% | 0.685 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -79.9 | -21.8 | 177.7 | -62.7 | -65.7 | 0 | 0 | 0 | 112.8 | K68 S69 I70 A74 G75 | K68-H72 PolarHBondContact O-CD2 2.96Å; S69-H72 WeakPolarHBondContact O-CB 3.45Å; S69-H72 PolarHBondContact O-N 3.15Å; I70-H72 PolarHBondContact O-N 3.09Å; H72-A74 PolarHBondContact O-N 3.18Å; H72-G75 PolarHBondContact O-N 2.77Å; H72-G75 VanDerWaalsContact O-N 3.17Å |
| 73 | K | 78.8 | Confident | 87.6 | Confident | 162 Ų | 162 | 84.6 Ų | 84.6 | 70% | 0.704 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -64.3 | -29.3 | 176.8 | -69.4 | -174.4 | 176.6 | -178.2 | 0 | 112.6 | S69 I70 G75 | S69-K73 PolarHBondContact O-N 3.2Å; I70-K73 WeakPolarHBondContact O-CB 3.22Å; I70-K73 PolarHBondContact O-N 2.85Å; I70-K73 VanDerWaalsContact O-N 3.1Å; K73-G75 PolarHBondContact O-N 3.33Å |
| 74 | A | 78.2 | Confident | 87.7 | Confident | 7 Ų | 7 | 84.9 Ų | 84.9 | 6% | 0.058 | 43% | 0.425 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77 | 1.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | H72 Q77 Q209 | H72-A74 PolarHBondContact O-N 3.18Å; A74-Q77 PolarHBondContact O-NE2 3Å; A74-Q77 VanDerWaalsContact O-NE2 3.14Å; A74-Q209 VanDerWaalsContact CA-O 3.27Å; A74-Q209 WeakPolarHBondContact CA-O 3.44Å; A74-Q209 HydrophobicContact CB-CB 4.12Å; A74-Q209 VanDerWaalsContact CB-O 3.23Å; A74-Q209 WeakPolarHBondContact CB-O 3.5Å |
| 75 | G | 83.2 | Confident | 87.7 | Confident | 27 Ų | 27 | 82.6 Ų | 82.6 | 28% | 0.278 | 41% | 0.409 | S | S | . | . | trans | 87.5 | -161.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | H72 K73 Q77 | H72-G75 PolarHBondContact O-N 2.77Å; H72-G75 VanDerWaalsContact O-N 3.17Å; K73-G75 PolarHBondContact O-N 3.33Å; G75-Q77 PolarHBondContact O-N 2.89Å | ||
| 76 | Y | 83.2 | Confident | 87.8 | Confident | 170 Ų | 170 | 79.9 Ų | 79.9 | 67% | 0.667 | 39% | 0.39 | S | S | * | . | trans | -77.5 | 89.3 | -171.6 | -63.6 | -75.2 | 0 | 0 | 0 | 113.5 | W78 Q215 | Y76-W78 VanDerWaalsContact C-N 3.34Å; Y76-W78 PolarHBondContact O-N 3.31Å; Y76-Q215 PolarHBondContact O-NE2 3.46Å | ||
| 77 | Q | 86.9 | Confident | 88.1 | Confident | 12 Ų | 12 | 77 Ų | 77 | 6% | 0.056 | 38% | 0.377 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.9 | -23.8 | -177.4 | -59.8 | -59 | -47.7 | 0 | 0 | 115.2 | A74 G75 G82 S99 | A74-Q77 PolarHBondContact O-NE2 3Å; A74-Q77 VanDerWaalsContact O-NE2 3.14Å; G75-Q77 PolarHBondContact O-N 2.89Å; Q77-G82 CarbonylContact O-C 3.33Å; Q77-G82 VanDerWaalsContact O-CA 3.23Å; Q77-G82 WeakPolarHBondContact O-CA 3.35Å; Q77-S99 WeakPolarHBondContact CB-OG 3.4Å; Q77-S99 WeakPolarHBondContact CG-OG 3.37Å |
| 78 | W | 90.5 | Very high | 88.4 | Confident | 137 Ų | 137 | 73.1 Ų | 73.1 | 52% | 0.519 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.9 | 25 | -173.9 | -67.7 | 104.3 | 0 | 0 | 0 | 114.7 | Y76 F86 | Y76-W78 VanDerWaalsContact C-N 3.34Å; Y76-W78 PolarHBondContact O-N 3.31Å; W78-F86 AromaticContact CH2-CD1 3.69Å; W78-F86 HydrophobicContact CH2-CD1 3.69Å; W78-F86 AromaticContact CH2-CD2 3.99Å; W78-F86 HydrophobicContact CH2-CD2 3.99Å; W78-F86 AromaticContact CH2-CE1 3.83Å; W78-F86 HydrophobicContact CH2-CE1 3.83Å; W78-F86 HydrophobicContact CH2-CE2 4.12Å; W78-F86 AromaticContact CH2-CG 3.78Å; W78-F86 HydrophobicContact CH2-CG 3.78Å; W78-F86 HydrophobicContact CH2-CZ 4.05Å; W78-F86 HydrophobicContact CZ3-CB 4.48Å; W78-F86 AromaticContact CZ3-CD1 3.74Å; W78-F86 HydrophobicContact CZ3-CD1 3.74Å; W78-F86 HydrophobicContact CZ3-CE1 4.17Å; W78-F86 HydrophobicContact CZ3-CG 4.04Å |
| 79 | K | 91.3 | Very high | 88.8 | Confident | 129 Ų | 129 | 66 Ų | 66 | 56% | 0.561 | 32% | 0.323 | S | S | * | . | S | Bend | trans | -83.6 | 169.4 | 162.4 | -62.7 | -61.7 | -175.5 | 179.3 | 0 | 109.8 | A81 G82 A83 | K79-A81 VanDerWaalsContact C-N 3.32Å; K79-A81 PolarHBondContact O-N 2.95Å; K79-A81 VanDerWaalsContact O-N 3.16Å; K79-G82 PolarHBondContact O-N 3.33Å; K79-A83 WeakPolarHBondContact O-CB 3.2Å; K79-A83 PolarHBondContact O-N 3.02Å |
| 80 | F | 91.4 | Very high | 89.3 | Confident | 174 Ų | 174 | 65.2 Ų | 65.2 | 76% | 0.763 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -49.6 | -46.4 | -172.4 | -176.6 | -96.6 | 0 | 0 | 0 | 114 | G82 A83 F84 | F80-G82 PolarHBondContact O-N 2.92Å; F80-A83 PolarHBondContact O-N 2.95Å; F80-F84 VanDerWaalsContact O-CB 3.29Å; F80-F84 WeakPolarHBondContact O-CB 3.41Å; F80-F84 PolarHBondContact O-N 3.45Å |
| 81 | A | 91.1 | Very high | 89.9 | Confident | 31 Ų | 31 | 62.1 Ų | 62.1 | 26% | 0.256 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | K79 F84 Y85 | K79-A81 VanDerWaalsContact C-N 3.32Å; K79-A81 PolarHBondContact O-N 2.95Å; K79-A81 VanDerWaalsContact O-N 3.16Å; A81-F84 PolarHBondContact O-N 3.42Å; A81-Y85 WeakPolarHBondContact O-CB 3.21Å; A81-Y85 PolarHBondContact O-N 2.84Å |
| 82 | G | 91.6 | Very high | 90.6 | Very high | 5 Ų | 5 | 60 Ų | 60 | 5% | 0.052 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -73.8 | -35.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q77 K79 F80 F84 Y85 F86 | Q77-G82 CarbonylContact O-C 3.33Å; Q77-G82 VanDerWaalsContact O-CA 3.23Å; Q77-G82 WeakPolarHBondContact O-CA 3.35Å; K79-G82 PolarHBondContact O-N 3.33Å; F80-G82 PolarHBondContact O-N 2.92Å; G82-F84 VanDerWaalsContact C-N 3.32Å; G82-F84 PolarHBondContact O-N 3.28Å; G82-Y85 PolarHBondContact O-N 3.39Å; G82-F86 WeakPolarHBondContact O-CB 3.38Å; G82-F86 PolarHBondContact O-N 3.35Å |
| 83 | A | 94.2 | Very high | 91.4 | Very high | 35 Ų | 35 | 56 Ų | 56 | 29% | 0.289 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.5 | -38.6 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | K79 F80 S87 | K79-A83 WeakPolarHBondContact O-CB 3.2Å; K79-A83 PolarHBondContact O-N 3.02Å; F80-A83 PolarHBondContact O-N 2.95Å; A83-S87 WeakPolarHBondContact O-CB 3.36Å; A83-S87 PolarHBondContact O-N 3.33Å; A83-S87 PolarHBondContact O-OG 2.94Å |
| 84 | F | 94.2 | Very high | 92.3 | Very high | 92 Ų | 92 | 48.5 Ų | 48.5 | 40% | 0.404 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -66.7 | -45.2 | 174.4 | -173 | -90.5 | 0 | 0 | 0 | 111.4 | F80 A81 G82 S87 T88 L225 | F80-F84 VanDerWaalsContact O-CB 3.29Å; F80-F84 WeakPolarHBondContact O-CB 3.41Å; F80-F84 PolarHBondContact O-N 3.45Å; A81-F84 PolarHBondContact O-N 3.42Å; G82-F84 VanDerWaalsContact C-N 3.32Å; G82-F84 PolarHBondContact O-N 3.28Å; F84-S87 WeakPolarHBondContact CA-OG 3.29Å; F84-S87 PolarHBondContact O-N 3.44Å; F84-S87 PolarHBondContact O-OG 3.42Å; F84-T88 PolarHBondContact O-N 3.27Å; F84-T88 PolarHBondContact O-OG1 3.44Å; F84-L225 HydrophobicContact CD1-CD1 3.57Å; F84-L225 HydrophobicContact CD1-CD2 4.01Å; F84-L225 HydrophobicContact CD1-CG 4.44Å; F84-L225 HydrophobicContact CE1-CD1 3.66Å; F84-L225 HydrophobicContact CE1-CD2 3.98Å; F84-L225 HydrophobicContact CE1-CG 4.37Å |
| 85 | Y | 93.8 | Very high | 93.1 | Very high | 1 Ų | 1 | 50.5 Ų | 50.5 | 0% | 0.004 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.7 | -48.9 | 174.2 | -173.6 | -112.3 | 0 | 0 | 0 | 111.5 | A81 G82 S87 T88 T89 Y96 H98 V206 L208 L225 I228 | A81-Y85 WeakPolarHBondContact O-CB 3.21Å; A81-Y85 PolarHBondContact O-N 2.84Å; G82-Y85 PolarHBondContact O-N 3.39Å; Y85-S87 PolarHBondContact O-N 3.37Å; Y85-T88 WeakPolarHBondContact O-CB 3.3Å; Y85-T88 PolarHBondContact O-N 3.35Å; Y85-T88 VanDerWaalsContact O-N 3.15Å; Y85-T89 HydrophobicContact CE1-CG2 4.44Å; Y85-T89 WeakPolarHBondContact O-CG2 3.43Å; Y85-T89 PolarHBondContact O-N 3.29Å; Y85-Y96 HydrophobicContact CE1-CD2 4.36Å; Y85-Y96 HydrophobicContact CE1-CE2 4.36Å; Y85-Y96 AromaticContact CZ-CE2 3.88Å; Y85-Y96 WeakPolarHBondContact OH-CE2 3.34Å; Y85-H98 AromaticContact CD1-CE1 3.89Å; Y85-H98 AromaticContact CD1-NE2 3.76Å; Y85-H98 AromaticContact CE1-CE1 3.5Å; Y85-H98 VanDerWaalsContact CE1-CE1 3.5Å; Y85-H98 WeakPolarHBondContact CE1-CE1 3.49Å; Y85-H98 AromaticContact CE1-NE2 3.66Å; Y85-V206 HydrophobicContact CE1-CG1 4.13Å; Y85-L208 HydrophobicContact CD2-CD1 4.09Å; Y85-L208 HydrophobicContact CE2-CD1 4.07Å; Y85-L225 HydrophobicContact CD2-CD2 3.83Å; Y85-I228 HydrophobicContact CE2-CD1 3.9Å |
| 86 | F | 95.2 | Very high | 93.7 | Very high | 31 Ų | 31 | 49.6 Ų | 49.6 | 14% | 0.136 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -57.6 | -44.7 | 173.2 | 173.2 | -97.6 | 0 | 0 | 0 | 112.4 | W78 G82 T88 T89 V90 S99 P101 | W78-F86 AromaticContact CH2-CD1 3.69Å; W78-F86 HydrophobicContact CH2-CD1 3.69Å; W78-F86 AromaticContact CH2-CD2 3.99Å; W78-F86 HydrophobicContact CH2-CD2 3.99Å; W78-F86 AromaticContact CH2-CE1 3.83Å; W78-F86 HydrophobicContact CH2-CE1 3.83Å; W78-F86 HydrophobicContact CH2-CE2 4.12Å; W78-F86 AromaticContact CH2-CG 3.78Å; W78-F86 HydrophobicContact CH2-CG 3.78Å; W78-F86 HydrophobicContact CH2-CZ 4.05Å; W78-F86 HydrophobicContact CZ3-CB 4.48Å; W78-F86 AromaticContact CZ3-CD1 3.74Å; W78-F86 HydrophobicContact CZ3-CD1 3.74Å; W78-F86 HydrophobicContact CZ3-CE1 4.17Å; W78-F86 HydrophobicContact CZ3-CG 4.04Å; G82-F86 WeakPolarHBondContact O-CB 3.38Å; G82-F86 PolarHBondContact O-N 3.35Å; F86-T88 PolarHBondContact O-N 2.88Å; F86-T89 PolarHBondContact O-N 3.27Å; F86-T89 PolarHBondContact O-OG1 2.92Å; F86-V90 HydrophobicContact CD1-CG2 4.36Å; F86-V90 HydrophobicContact CD2-CG2 4.49Å; F86-V90 HydrophobicContact CE1-CG2 3.84Å; F86-V90 HydrophobicContact CE2-CG2 3.99Å; F86-V90 HydrophobicContact CZ-CG2 3.62Å; F86-V90 WeakPolarHBondContact O-CG2 3.48Å; F86-V90 PolarHBondContact O-N 3.31Å; F86-V90 VanDerWaalsContact O-N 3.08Å; F86-S99 WeakPolarHBondContact CD2-O 3.37Å; F86-S99 WeakPolarHBondContact CE2-O 3.49Å; F86-P101 HydrophobicContact CZ-CG 4.38Å |
| 87 | S | 96.9 | Very high | 94.2 | Very high | 25 Ų | 25 | 43.9 Ų | 43.9 | 18% | 0.175 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.6 | -34.6 | 178.4 | 75.4 | 0 | 0 | 0 | 0 | 112.3 | A83 F84 Y85 I91 | A83-S87 WeakPolarHBondContact O-CB 3.36Å; A83-S87 PolarHBondContact O-N 3.33Å; A83-S87 PolarHBondContact O-OG 2.94Å; F84-S87 WeakPolarHBondContact CA-OG 3.29Å; F84-S87 PolarHBondContact O-N 3.44Å; F84-S87 PolarHBondContact O-OG 3.42Å; Y85-S87 PolarHBondContact O-N 3.37Å; S87-I91 WeakPolarHBondContact O-CG1 3.35Å; S87-I91 PolarHBondContact O-N 3.1Å |
| 88 | T | 95.8 | Very high | 94.3 | Very high | 7 Ų | 7 | 44.8 Ų | 44.8 | 4% | 0.043 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -66.6 | -46.6 | 175.6 | -56.9 | 0 | 0 | 0 | 0 | 110.3 | F84 Y85 F86 V90 I91 T92 L225 L229 | F84-T88 PolarHBondContact O-N 3.27Å; F84-T88 PolarHBondContact O-OG1 3.44Å; Y85-T88 WeakPolarHBondContact O-CB 3.3Å; Y85-T88 PolarHBondContact O-N 3.35Å; Y85-T88 VanDerWaalsContact O-N 3.15Å; F86-T88 PolarHBondContact O-N 2.88Å; T88-V90 VanDerWaalsContact C-N 3.26Å; T88-V90 PolarHBondContact O-N 2.9Å; T88-I91 WeakPolarHBondContact O-CG1 3.48Å; T88-I91 PolarHBondContact O-N 3.44Å; T88-T92 HydrophobicContact CG2-CG2 4.09Å; T88-T92 VanDerWaalsContact O-CB 3.32Å; T88-T92 WeakPolarHBondContact O-CB 3.43Å; T88-T92 VanDerWaalsContact O-CG2 3.26Å; T88-T92 WeakPolarHBondContact O-CG2 3.41Å; T88-T92 PolarHBondContact O-N 3.2Å; T88-T92 PolarHBondContact O-OG1 3.31Å; T88-L225 HydrophobicContact CG2-CD2 4.37Å; T88-L229 HydrophobicContact CG2-CD2 4.16Å |
| 89 | T | 96 | Very high | 94.2 | Very high | 6 Ų | 6 | 38.8 Ų | 38.8 | 4% | 0.037 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.9 | -28.2 | -179.4 | 62.8 | 0 | 0 | 0 | 0 | 113 | Y85 F86 T92 T93 I94 G95 Y96 | Y85-T89 HydrophobicContact CE1-CG2 4.44Å; Y85-T89 WeakPolarHBondContact O-CG2 3.43Å; Y85-T89 PolarHBondContact O-N 3.29Å; F86-T89 PolarHBondContact O-N 3.27Å; F86-T89 PolarHBondContact O-OG1 2.92Å; T89-T92 WeakPolarHBondContact CA-OG1 3.31Å; T89-T93 PolarHBondContact O-N 3.43Å; T89-I94 PolarHBondContact O-N 2.86Å; T89-I94 VanDerWaalsContact O-N 3.09Å; T89-G95 PolarHBondContact O-N 3.37Å; T89-G95 VanDerWaalsContact O-N 3.14Å; T89-Y96 HydrophobicContact CG2-CD2 3.61Å; T89-Y96 HydrophobicContact CG2-CE2 3.75Å |
| 90 | V | 97.5 | Very high | 94.3 | Very high | 22 Ų | 22 | 36.9 Ų | 36.9 | 13% | 0.133 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -70.5 | -53.2 | 174.2 | 172.8 | 0 | 0 | 0 | 0 | 111.5 | F86 T88 T92 T93 Y113 A114 | F86-V90 HydrophobicContact CD1-CG2 4.36Å; F86-V90 HydrophobicContact CD2-CG2 4.49Å; F86-V90 HydrophobicContact CE1-CG2 3.84Å; F86-V90 HydrophobicContact CE2-CG2 3.99Å; F86-V90 HydrophobicContact CZ-CG2 3.62Å; F86-V90 WeakPolarHBondContact O-CG2 3.48Å; F86-V90 PolarHBondContact O-N 3.31Å; F86-V90 VanDerWaalsContact O-N 3.08Å; T88-V90 VanDerWaalsContact C-N 3.26Å; T88-V90 PolarHBondContact O-N 2.9Å; V90-T92 VanDerWaalsContact C-N 3.32Å; V90-T92 PolarHBondContact O-N 3.41Å; V90-T93 PolarHBondContact O-N 2.91Å; V90-Y113 HydrophobicContact CB-CD1 4.48Å; V90-Y113 HydrophobicContact CB-CE1 4.42Å; V90-Y113 HydrophobicContact CG1-CD1 3.92Å; V90-Y113 HydrophobicContact CG1-CE1 4.27Å; V90-A114 HydrophobicContact CG1-CB 3.89Å |
| 91 | I | 97.3 | Very high | 94.5 | Very high | 33 Ų | 33 | 29.8 Ų | 29.8 | 17% | 0.169 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -72.2 | -26.9 | -175.7 | 66.3 | -176.5 | 0 | 0 | 0 | 113.1 | S87 T88 T93 Y113 T121 | S87-I91 WeakPolarHBondContact O-CG1 3.35Å; S87-I91 PolarHBondContact O-N 3.1Å; T88-I91 WeakPolarHBondContact O-CG1 3.48Å; T88-I91 PolarHBondContact O-N 3.44Å; I91-T93 VanDerWaalsContact C-N 3.28Å; I91-Y113 HydrophobicContact CG2-CD1 4.22Å; I91-Y113 HydrophobicContact CG2-CE1 3.39Å; I91-T121 WeakPolarHBondContact CB-OG1 3.47Å; I91-T121 HydrophobicContact CG1-CG2 4.49Å; I91-T121 WeakPolarHBondContact O-CG2 3.39Å |
| 92 | T | 96 | Very high | 94.6 | Very high | 5 Ų | 5 | 32.7 Ų | 32.7 | 3% | 0.031 | 22% | 0.22 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | 1.6 | 175.5 | 57.9 | 0 | 0 | 0 | 0 | 113.3 | T88 T89 V90 I94 T121 F125 T199 L232 | T88-T92 HydrophobicContact CG2-CG2 4.09Å; T88-T92 VanDerWaalsContact O-CB 3.32Å; T88-T92 WeakPolarHBondContact O-CB 3.43Å; T88-T92 VanDerWaalsContact O-CG2 3.26Å; T88-T92 WeakPolarHBondContact O-CG2 3.41Å; T88-T92 PolarHBondContact O-N 3.2Å; T88-T92 PolarHBondContact O-OG1 3.31Å; T89-T92 WeakPolarHBondContact CA-OG1 3.31Å; V90-T92 VanDerWaalsContact C-N 3.32Å; V90-T92 PolarHBondContact O-N 3.41Å; T92-I94 PolarHBondContact O-N 3.41Å; T92-I94 WeakPolarHBondContact OG1-CD1 3.43Å; T92-I94 WeakPolarHBondContact OG1-CG1 3.3Å; T92-T121 HydrophobicContact CG2-CG2 4.35Å; T92-F125 HydrophobicContact CG2-CE2 4.1Å; T92-F125 HydrophobicContact CG2-CZ 4.13Å; T92-T199 VanDerWaalsContact O-CG2 3.29Å; T92-T199 WeakPolarHBondContact O-CG2 3.47Å; T92-L232 HydrophobicContact CG2-CD1 3.49Å; T92-L232 VanDerWaalsContact CG2-CD1 3.49Å |
| 93 | T | 96.8 | Very high | 94.8 | Very high | 66 Ų | 66 | 36.9 Ų | 36.9 | 41% | 0.405 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.8 | 18.4 | -178.2 | 68.3 | 0 | 0 | 0 | 0 | 115.4 | T89 V90 I91 I118 | T89-T93 PolarHBondContact O-N 3.43Å; V90-T93 PolarHBondContact O-N 2.91Å; I91-T93 VanDerWaalsContact C-N 3.28Å; T93-I118 HydrophobicContact CG2-CB 4.42Å; T93-I118 HydrophobicContact CG2-CD1 3.76Å; T93-I118 HydrophobicContact CG2-CG1 3.76Å; T93-I118 HydrophobicContact CG2-CG2 3.8Å |
| 94 | I | 96.9 | Very high | 95 | Very high | 4 Ų | 4 | 41.3 Ų | 41.3 | 2% | 0.021 | 27% | 0.269 | C | S | . | . | trans | -69.3 | -52.3 | 175.6 | -61.1 | 167.1 | 0 | 0 | 0 | 110.2 | T89 T92 Y96 T196 T199 G201 I228 L232 | T89-I94 PolarHBondContact O-N 2.86Å; T89-I94 VanDerWaalsContact O-N 3.09Å; T92-I94 PolarHBondContact O-N 3.41Å; T92-I94 WeakPolarHBondContact OG1-CD1 3.43Å; T92-I94 WeakPolarHBondContact OG1-CG1 3.3Å; I94-Y96 HydrophobicContact CG2-CD1 3.88Å; I94-Y96 HydrophobicContact CG2-CD2 4.15Å; I94-Y96 HydrophobicContact CG2-CE1 3.59Å; I94-Y96 HydrophobicContact CG2-CE2 3.85Å; I94-Y96 HydrophobicContact CG2-CG 4.15Å; I94-Y96 PolarHBondContact O-N 2.94Å; I94-T196 HydrophobicContact CD1-CG2 4.11Å; I94-T199 HydrophobicContact CG1-CG2 4.22Å; I94-G201 WeakPolarHBondContact O-CA 3.46Å; I94-I228 HydrophobicContact CD1-CG2 3.66Å; I94-L232 HydrophobicContact CD1-CD1 4.22Å | ||
| 95 | G | 95.8 | Very high | 95.2 | Very high | 48 Ų | 48 | 39.4 Ų | 39.4 | 50% | 0.495 | 28% | 0.275 | S | S | . | . | trans | 61.1 | 41.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | T89 G97 | T89-G95 PolarHBondContact O-N 3.37Å; T89-G95 VanDerWaalsContact O-N 3.14Å; G95-G97 PolarHBondContact O-N 3.19Å | ||
| 96 | Y | 95.1 | Very high | 95.3 | Very high | 8 Ų | 8 | 40.4 Ų | 40.4 | 3% | 0.031 | 29% | 0.285 | C | S | . | . | trans | -46.6 | -24.5 | -178.7 | -62.5 | -60.7 | 0 | 0 | 0 | 118 | Y85 T89 I94 H98 Y192 T196 G201 G203 V206 | Y85-Y96 HydrophobicContact CE1-CD2 4.36Å; Y85-Y96 HydrophobicContact CE1-CE2 4.36Å; Y85-Y96 AromaticContact CZ-CE2 3.88Å; Y85-Y96 WeakPolarHBondContact OH-CE2 3.34Å; T89-Y96 HydrophobicContact CG2-CD2 3.61Å; T89-Y96 HydrophobicContact CG2-CE2 3.75Å; I94-Y96 HydrophobicContact CG2-CD1 3.88Å; I94-Y96 HydrophobicContact CG2-CD2 4.15Å; I94-Y96 HydrophobicContact CG2-CE1 3.59Å; I94-Y96 HydrophobicContact CG2-CE2 3.85Å; I94-Y96 HydrophobicContact CG2-CG 4.15Å; I94-Y96 PolarHBondContact O-N 2.94Å; Y96-H98 VanDerWaalsContact CB-ND1 3.35Å; Y96-H98 WeakPolarHBondContact CB-ND1 3.08Å; Y96-H98 PolarHBondContact O-N 3.37Å; Y96-Y192 HydrophobicContact CE1-CE2 4.11Å; Y96-Y192 PolarHBondContact OH-OH 3.35Å; Y96-T196 WeakPolarHBondContact OH-CB 3.34Å; Y96-T196 WeakPolarHBondContact OH-CG2 3.34Å; Y96-T196 PolarHBondContact OH-OG1 2.91Å; Y96-G201 VanDerWaalsContact CA-O 3.32Å; Y96-G201 WeakPolarHBondContact CA-O 3.32Å; Y96-G203 VanDerWaalsContact O-CA 3.28Å; Y96-G203 WeakPolarHBondContact O-CA 3.35Å; Y96-V206 HydrophobicContact CD1-CG2 4.1Å; Y96-V206 HydrophobicContact CD2-CG1 4.15Å; Y96-V206 HydrophobicContact CE2-CG1 4.5Å; Y96-V206 HydrophobicContact CG-CG1 4.37Å; Y96-V206 HydrophobicContact CG-CG2 4Å | ||
| 97 | G | 93.1 | Very high | 95.5 | Very high | 50 Ų | 50 | 44.1 Ų | 44.1 | 52% | 0.515 | 30% | 0.301 | S | S | . | . | trans | 74.8 | -6.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | G95 S99 | G95-G97 PolarHBondContact O-N 3.19Å; G97-S99 PolarHBondContact O-N 3.16Å | ||
| 98 | H | 89.5 | Confident | 95.5 | Very high | 31 Ų | 31 | 44.8 Ų | 44.8 | 14% | 0.144 | 31% | 0.309 | C | S | . | . | S | Bend | trans | -59 | -29.5 | 174.9 | 68.5 | -79.1 | 0 | 0 | 0 | 113.5 | Y85 Y96 V206 Q209 | Y85-H98 AromaticContact CD1-CE1 3.89Å; Y85-H98 AromaticContact CD1-NE2 3.76Å; Y85-H98 AromaticContact CE1-CE1 3.5Å; Y85-H98 VanDerWaalsContact CE1-CE1 3.5Å; Y85-H98 WeakPolarHBondContact CE1-CE1 3.49Å; Y85-H98 AromaticContact CE1-NE2 3.66Å; Y96-H98 VanDerWaalsContact CB-ND1 3.35Å; Y96-H98 WeakPolarHBondContact CB-ND1 3.08Å; Y96-H98 PolarHBondContact O-N 3.37Å; H98-V206 HydrophobicContact CB-CG2 4.2Å; H98-Q209 PolarHBondContact CD2-NE2 3.34Å; H98-Q209 VanDerWaalsContact CD2-NE2 3.3Å |
| 99 | S | 89.3 | Confident | 95.6 | Very high | 12 Ų | 12 | 51.1 Ų | 51.1 | 8% | 0.084 | 34% | 0.336 | C | S | . | . | S | Bend | trans | -132.7 | 123.9 | 172.7 | -72.1 | 0 | 0 | 0 | 0 | 109.8 | Q77 F86 G97 | Q77-S99 WeakPolarHBondContact CB-OG 3.4Å; Q77-S99 WeakPolarHBondContact CG-OG 3.37Å; F86-S99 WeakPolarHBondContact CD2-O 3.37Å; F86-S99 WeakPolarHBondContact CE2-O 3.49Å; G97-S99 PolarHBondContact O-N 3.16Å |
| 100 | T | 93.3 | Very high | 95.7 | Very high | 88 Ų | 88 | 52.1 Ų | 52.1 | 54% | 0.54 | 34% | 0.342 | S | S | . | . | trans | -133.8 | 148.5 | -179.7 | 58.9 | 0 | 0 | 0 | 0 | 111.5 | A102 | T100-A102 PolarHBondContact O-N 3.33Å; T100-A102 VanDerWaalsContact O-N 3.13Å | ||
| 101 | P | 95.1 | Very high | 95.8 | Very high | 25 Ų | 25 | 57.5 Ų | 57.5 | 16% | 0.162 | 37% | 0.368 | C | S | . | . | trans | -67.2 | 113.6 | 180 | 25.2 | -32.3 | 0 | 0 | 0 | 110.6 | F86 K107 C110 | F86-P101 HydrophobicContact CZ-CG 4.38Å; P101-K107 HydrophobicContact CB-CG 4.18Å; P101-K107 HydrophobicContact CG-CG 4.06Å; P101-K107 WeakPolarHBondContact O-CE 3.34Å; P101-K107 VanDerWaalsContact O-CG 3.27Å; P101-K107 WeakPolarHBondContact O-CG 3.44Å; P101-C110 HydrophobicContact CG-CB 4.24Å | ||
| 102 | A | 92.5 | Very high | 95.8 | Very high | 92 Ų | 92 | 63.2 Ų | 63.2 | 76% | 0.76 | 39% | 0.392 | S | S | * | . | trans | -81 | -28.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | T100 | T100-A102 PolarHBondContact O-N 3.33Å; T100-A102 VanDerWaalsContact O-N 3.13Å | ||
| 103 | T | 96.5 | Very high | 95.9 | Very high | 93 Ų | 93 | 66.6 Ų | 66.6 | 57% | 0.571 | 41% | 0.405 | S | S | * | . | S | Bend | trans | -83.3 | 150.3 | -176 | 65.2 | 0 | 0 | 0 | 0 | 111.9 | G105 G106 K107 | T103-G105 VanDerWaalsContact C-N 3.3Å; T103-G105 PolarHBondContact O-N 2.85Å; T103-G106 PolarHBondContact O-N 3.11Å; T103-G106 PolarHBondContact OG1-N 2.99Å; T103-K107 WeakPolarHBondContact O-CG 3.49Å; T103-K107 PolarHBondContact O-N 2.89Å |
| 104 | V | 97.8 | Very high | 95.9 | Very high | 129 Ų | 129 | 64.5 Ų | 64.5 | 78% | 0.782 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -58.7 | -43.9 | 176.4 | -179.8 | 0 | 0 | 0 | 0 | 111 | K107 A108 | V104-K107 PolarHBondContact O-N 3.45Å; V104-A108 PolarHBondContact O-N 3.12Å |
| 105 | G | 98.1 | Very high | 96 | Very high | 52 Ų | 52 | 70.5 Ų | 70.5 | 54% | 0.536 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.1 | -42.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | T103 K107 A108 F109 | T103-G105 VanDerWaalsContact C-N 3.3Å; T103-G105 PolarHBondContact O-N 2.85Å; G105-K107 PolarHBondContact O-N 3.17Å; G105-A108 PolarHBondContact O-N 3.41Å; G105-F109 WeakPolarHBondContact O-CB 3.35Å; G105-F109 PolarHBondContact O-N 2.93Å |
| 106 | G | 97.4 | Very high | 96 | Very high | 21 Ų | 21 | 71.6 Ų | 71.6 | 22% | 0.216 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -63.9 | -39.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | T103 C110 | T103-G106 PolarHBondContact O-N 3.11Å; T103-G106 PolarHBondContact OG1-N 2.99Å; G106-C110 VanDerWaalsContact O-CB 3.26Å; G106-C110 WeakPolarHBondContact O-CB 3.33Å; G106-C110 PolarHBondContact O-N 3.38Å |
| 107 | K | 98.1 | Very high | 96.1 | Very high | 109 Ų | 109 | 71.6 Ų | 71.6 | 47% | 0.474 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.7 | -47.7 | 175.4 | -70.3 | 178.8 | -177.8 | -173.1 | 0 | 111.7 | P101 T103 V104 G105 C110 M111 | P101-K107 HydrophobicContact CB-CG 4.18Å; P101-K107 HydrophobicContact CG-CG 4.06Å; P101-K107 WeakPolarHBondContact O-CE 3.34Å; P101-K107 VanDerWaalsContact O-CG 3.27Å; P101-K107 WeakPolarHBondContact O-CG 3.44Å; T103-K107 WeakPolarHBondContact O-CG 3.49Å; T103-K107 PolarHBondContact O-N 2.89Å; V104-K107 PolarHBondContact O-N 3.45Å; G105-K107 PolarHBondContact O-N 3.17Å; K107-C110 WeakPolarHBondContact O-CB 3.41Å; K107-C110 PolarHBondContact O-N 2.92Å; K107-M111 WeakPolarHBondContact O-CG 3.29Å; K107-M111 PolarHBondContact O-N 2.9Å; K107-M111 VanDerWaalsContact O-N 3.13Å |
| 108 | A | 98.2 | Very high | 96.3 | Very high | 40 Ų | 40 | 71.6 Ų | 71.6 | 33% | 0.331 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.2 | -47 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | V104 G105 C110 M111 F112 | V104-A108 PolarHBondContact O-N 3.12Å; G105-A108 PolarHBondContact O-N 3.41Å; A108-C110 VanDerWaalsContact C-N 3.34Å; A108-C110 PolarHBondContact O-N 2.98Å; A108-M111 PolarHBondContact O-N 3.05Å; A108-F112 WeakPolarHBondContact O-CD2 3.27Å; A108-F112 PolarHBondContact O-N 3.36Å |
| 109 | F | 98.1 | Very high | 96.7 | Very high | 139 Ų | 139 | 73.4 Ų | 73.4 | 61% | 0.61 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -58.9 | -44.6 | 175.8 | 178.8 | -99 | 0 | 0 | 0 | 111.9 | G105 M111 F112 Y113 | G105-F109 WeakPolarHBondContact O-CB 3.35Å; G105-F109 PolarHBondContact O-N 2.93Å; F109-M111 VanDerWaalsContact C-N 3.29Å; F109-M111 PolarHBondContact O-N 2.94Å; F109-F112 PolarHBondContact O-N 2.99Å; F109-Y113 HydrophobicContact CE1-CD2 4.3Å; F109-Y113 HydrophobicContact CE1-CG 4.25Å; F109-Y113 HydrophobicContact CZ-CD2 4.17Å; F109-Y113 WeakPolarHBondContact O-CB 3.49Å; F109-Y113 PolarHBondContact O-N 2.87Å |
| 110 | C | 98.1 | Very high | 97 | Very high | 27 Ų | 27 | 78.8 Ų | 78.8 | 18% | 0.182 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -58.3 | -38.9 | 177.8 | -171.8 | 0 | 0 | 0 | 0 | 112.6 | P101 G106 K107 A108 A114 | P101-C110 HydrophobicContact CG-CB 4.24Å; G106-C110 VanDerWaalsContact O-CB 3.26Å; G106-C110 WeakPolarHBondContact O-CB 3.33Å; G106-C110 PolarHBondContact O-N 3.38Å; K107-C110 WeakPolarHBondContact O-CB 3.41Å; K107-C110 PolarHBondContact O-N 2.92Å; A108-C110 VanDerWaalsContact C-N 3.34Å; A108-C110 PolarHBondContact O-N 2.98Å; C110-A114 VanDerWaalsContact O-CB 3.27Å; C110-A114 WeakPolarHBondContact O-CB 3.26Å; C110-A114 PolarHBondContact O-N 3.43Å |
| 111 | M | 97.9 | Very high | 97.1 | Very high | 136 Ų | 136 | 75.2 Ų | 75.2 | 67% | 0.67 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -63.2 | -49.6 | 177 | -67 | 170.4 | -175 | 0 | 0 | 111.7 | K107 A108 F109 A114 L115 | K107-M111 WeakPolarHBondContact O-CG 3.29Å; K107-M111 PolarHBondContact O-N 2.9Å; K107-M111 VanDerWaalsContact O-N 3.13Å; A108-M111 PolarHBondContact O-N 3.05Å; F109-M111 VanDerWaalsContact C-N 3.29Å; F109-M111 PolarHBondContact O-N 2.94Å; M111-A114 PolarHBondContact O-N 3.1Å; M111-L115 PolarHBondContact O-N 3.15Å; M111-L115 VanDerWaalsContact O-N 3.11Å |
| 112 | F | 97.9 | Very high | 97 | Very high | 153 Ų | 153 | 79 Ų | 79 | 67% | 0.671 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -67.4 | -38 | 178.2 | -70.8 | -69.4 | 0 | 0 | 0 | 112.4 | A108 F109 L115 A116 | A108-F112 WeakPolarHBondContact O-CD2 3.27Å; A108-F112 PolarHBondContact O-N 3.36Å; F109-F112 PolarHBondContact O-N 2.99Å; F112-L115 PolarHBondContact O-N 2.87Å; F112-A116 PolarHBondContact O-N 2.87Å |
| 113 | Y | 98.3 | Very high | 97.1 | Very high | 76 Ų | 76 | 79.1 Ų | 79.1 | 30% | 0.298 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.5 | -44.6 | 176.8 | -177.9 | -105.2 | 0 | 0 | 0 | 111.7 | V90 I91 F109 G117 | V90-Y113 HydrophobicContact CB-CD1 4.48Å; V90-Y113 HydrophobicContact CB-CE1 4.42Å; V90-Y113 HydrophobicContact CG1-CD1 3.92Å; V90-Y113 HydrophobicContact CG1-CE1 4.27Å; I91-Y113 HydrophobicContact CG2-CD1 4.22Å; I91-Y113 HydrophobicContact CG2-CE1 3.39Å; F109-Y113 HydrophobicContact CE1-CD2 4.3Å; F109-Y113 HydrophobicContact CE1-CG 4.25Å; F109-Y113 HydrophobicContact CZ-CD2 4.17Å; F109-Y113 WeakPolarHBondContact O-CB 3.49Å; F109-Y113 PolarHBondContact O-N 2.87Å; Y113-G117 WeakPolarHBondContact O-CA 3.4Å; Y113-G117 PolarHBondContact O-N 2.98Å |
| 114 | A | 97.9 | Very high | 97 | Very high | 21 Ų | 21 | 78.3 Ų | 78.3 | 17% | 0.174 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -65.4 | -40 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | V90 C110 M111 A116 G117 I118 | V90-A114 HydrophobicContact CG1-CB 3.89Å; C110-A114 VanDerWaalsContact O-CB 3.27Å; C110-A114 WeakPolarHBondContact O-CB 3.26Å; C110-A114 PolarHBondContact O-N 3.43Å; M111-A114 PolarHBondContact O-N 3.1Å; A114-A116 VanDerWaalsContact C-N 3.32Å; A114-A116 PolarHBondContact O-N 3.24Å; A114-G117 PolarHBondContact O-N 2.91Å; A114-I118 HydrophobicContact CB-CD1 4Å; A114-I118 WeakPolarHBondContact O-CB 3.32Å; A114-I118 VanDerWaalsContact O-CG1 3.3Å; A114-I118 WeakPolarHBondContact O-CG1 3.49Å; A114-I118 PolarHBondContact O-N 3.43Å |
| 115 | L | 97.4 | Very high | 96.8 | Very high | 131 Ų | 131 | 72.9 Ų | 72.9 | 69% | 0.686 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -57.1 | -42.9 | -179.9 | -179 | 65.4 | 0 | 0 | 0 | 112.7 | M111 F112 P119 | M111-L115 PolarHBondContact O-N 3.15Å; M111-L115 VanDerWaalsContact O-N 3.11Å; F112-L115 PolarHBondContact O-N 2.87Å; L115-P119 WeakPolarHBondContact O-CD 3.31Å; L115-P119 WeakPolarHBondContact O-CG 3.47Å |
| 116 | A | 96.5 | Very high | 96.4 | Very high | 70 Ų | 70 | 73.8 Ų | 73.8 | 58% | 0.579 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -87.3 | -36.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | F112 A114 L120 | F112-A116 PolarHBondContact O-N 2.87Å; A114-A116 VanDerWaalsContact C-N 3.32Å; A114-A116 PolarHBondContact O-N 3.24Å; A116-L120 WeakPolarHBondContact O-CB 3.34Å; A116-L120 PolarHBondContact O-N 3.47Å |
| 117 | G | 97.5 | Very high | 96.2 | Very high | 9 Ų | 9 | 75.6 Ų | 75.6 | 9% | 0.093 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -69.5 | -43.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y113 A114 L120 T121 | Y113-G117 WeakPolarHBondContact O-CA 3.4Å; Y113-G117 PolarHBondContact O-N 2.98Å; A114-G117 PolarHBondContact O-N 2.91Å; G117-L120 PolarHBondContact O-N 3.36Å; G117-T121 WeakPolarHBondContact O-CB 3.46Å; G117-T121 PolarHBondContact O-N 2.88Å; G117-T121 PolarHBondContact O-OG1 3.49Å; G117-T121 VanDerWaalsContact O-OG1 3.1Å |
| 118 | I | 97.1 | Very high | 96 | Very high | 50 Ų | 50 | 74.1 Ų | 74.1 | 26% | 0.256 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.5 | -51.4 | -176.6 | -63.8 | 166.4 | 0 | 0 | 0 | 111.5 | T93 A114 L120 T121 L122 | T93-I118 HydrophobicContact CG2-CB 4.42Å; T93-I118 HydrophobicContact CG2-CD1 3.76Å; T93-I118 HydrophobicContact CG2-CG1 3.76Å; T93-I118 HydrophobicContact CG2-CG2 3.8Å; A114-I118 HydrophobicContact CB-CD1 4Å; A114-I118 WeakPolarHBondContact O-CB 3.32Å; A114-I118 VanDerWaalsContact O-CG1 3.3Å; A114-I118 WeakPolarHBondContact O-CG1 3.49Å; A114-I118 PolarHBondContact O-N 3.43Å; I118-L120 VanDerWaalsContact C-N 3.32Å; I118-L120 PolarHBondContact O-N 3.18Å; I118-T121 PolarHBondContact O-N 3.12Å; I118-L122 HydrophobicContact CG2-CD1 3.98Å; I118-L122 HydrophobicContact CG2-CG 4.33Å; I118-L122 WeakPolarHBondContact O-CG 3.25Å; I118-L122 PolarHBondContact O-N 3.27Å |
| 119 | P | 97 | Very high | 95.7 | Very high | 69 Ų | 69 | 72.2 Ų | 72.2 | 45% | 0.448 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -59.4 | -41.3 | 176.6 | -24.4 | 34.9 | 0 | 0 | 0 | 113 | L115 L122 V123 | L115-P119 WeakPolarHBondContact O-CD 3.31Å; L115-P119 WeakPolarHBondContact O-CG 3.47Å; P119-L122 PolarHBondContact O-N 3.31Å; P119-V123 WeakPolarHBondContact O-CG2 3.39Å; P119-V123 PolarHBondContact O-N 3.38Å |
| 120 | L | 96.5 | Very high | 95.3 | Very high | 125 Ų | 125 | 70 Ų | 70 | 65% | 0.654 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -61.2 | -46 | 177.7 | 179.9 | 65.7 | 0 | 0 | 0 | 111.4 | A116 G117 I118 V123 M124 | A116-L120 WeakPolarHBondContact O-CB 3.34Å; A116-L120 PolarHBondContact O-N 3.47Å; G117-L120 PolarHBondContact O-N 3.36Å; I118-L120 VanDerWaalsContact C-N 3.32Å; I118-L120 PolarHBondContact O-N 3.18Å; L120-V123 PolarHBondContact O-N 2.84Å; L120-M124 WeakPolarHBondContact O-CB 3.47Å; L120-M124 PolarHBondContact O-N 3.23Å |
| 121 | T | 95.2 | Very high | 95.1 | Very high | 12 Ų | 12 | 76.3 Ų | 76.3 | 7% | 0.074 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -67.6 | -38.3 | 178.9 | -65.7 | 0 | 0 | 0 | 0 | 112.2 | I91 T92 G117 I118 M124 F125 | I91-T121 WeakPolarHBondContact CB-OG1 3.47Å; I91-T121 HydrophobicContact CG1-CG2 4.49Å; I91-T121 WeakPolarHBondContact O-CG2 3.39Å; T92-T121 HydrophobicContact CG2-CG2 4.35Å; G117-T121 WeakPolarHBondContact O-CB 3.46Å; G117-T121 PolarHBondContact O-N 2.88Å; G117-T121 PolarHBondContact O-OG1 3.49Å; G117-T121 VanDerWaalsContact O-OG1 3.1Å; I118-T121 PolarHBondContact O-N 3.12Å; T121-M124 HydrophobicContact CG2-CE 4.27Å; T121-M124 WeakPolarHBondContact O-CB 3.45Å; T121-M124 PolarHBondContact O-N 3.03Å; T121-F125 HydrophobicContact CG2-CD2 3.6Å; T121-F125 HydrophobicContact CG2-CE2 3.28Å; T121-F125 HydrophobicContact CG2-CZ 4.11Å; T121-F125 WeakPolarHBondContact O-CD2 3.19Å; T121-F125 PolarHBondContact O-N 3.5Å |
| 122 | L | 93.3 | Very high | 94.8 | Very high | 105 Ų | 105 | 71.7 Ų | 71.7 | 55% | 0.55 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60.4 | -49.1 | 173.5 | -73.6 | 173 | 0 | 0 | 0 | 111.5 | I118 P119 M124 F125 Q126 | I118-L122 HydrophobicContact CG2-CD1 3.98Å; I118-L122 HydrophobicContact CG2-CG 4.33Å; I118-L122 WeakPolarHBondContact O-CG 3.25Å; I118-L122 PolarHBondContact O-N 3.27Å; P119-L122 PolarHBondContact O-N 3.31Å; L122-M124 VanDerWaalsContact C-N 3.32Å; L122-M124 PolarHBondContact O-N 3.43Å; L122-F125 PolarHBondContact O-N 2.88Å; L122-Q126 WeakPolarHBondContact O-CG 3.5Å; L122-Q126 PolarHBondContact O-N 3.34Å |
| 123 | V | 93.9 | Very high | 94.5 | Very high | 94 Ų | 94 | 64.9 Ų | 64.9 | 57% | 0.57 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -62 | -40.3 | 177.1 | 173.2 | 0 | 0 | 0 | 0 | 111.4 | P119 L120 Q126 S127 | P119-V123 WeakPolarHBondContact O-CG2 3.39Å; P119-V123 PolarHBondContact O-N 3.38Å; L120-V123 PolarHBondContact O-N 2.84Å; V123-Q126 PolarHBondContact O-N 3.45Å; V123-S127 WeakPolarHBondContact O-CB 3.27Å; V123-S127 PolarHBondContact O-N 3.2Å; V123-S127 PolarHBondContact O-OG 2.89Å |
| 124 | M | 94.6 | Very high | 94.2 | Very high | 76 Ų | 76 | 65.2 Ų | 65.2 | 37% | 0.374 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -59.9 | -51.1 | 175.4 | -178.6 | -159.2 | 73.2 | 0 | 0 | 111.3 | L120 T121 L122 Q126 S127 I128 | L120-M124 WeakPolarHBondContact O-CB 3.47Å; L120-M124 PolarHBondContact O-N 3.23Å; T121-M124 HydrophobicContact CG2-CE 4.27Å; T121-M124 WeakPolarHBondContact O-CB 3.45Å; T121-M124 PolarHBondContact O-N 3.03Å; L122-M124 VanDerWaalsContact C-N 3.32Å; L122-M124 PolarHBondContact O-N 3.43Å; M124-Q126 VanDerWaalsContact C-N 3.32Å; M124-Q126 PolarHBondContact O-N 3.28Å; M124-S127 PolarHBondContact O-N 3.02Å; M124-I128 HydrophobicContact CG-CD1 3.71Å; M124-I128 HydrophobicContact CG-CG1 4.42Å; M124-I128 VanDerWaalsContact O-CG1 3.29Å; M124-I128 WeakPolarHBondContact O-CG1 3.48Å; M124-I128 PolarHBondContact O-N 3.28Å; M124-I128 HydrophobicContact SD-CD1 4.34Å |
| 125 | F | 93.7 | Very high | 93.9 | Very high | 16 Ų | 16 | 69 Ų | 69 | 7% | 0.07 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -65.6 | -32.8 | 179.9 | -76.4 | -46.1 | 0 | 0 | 0 | 113.3 | T92 T121 L122 G129 L229 L232 T233 S236 | T92-F125 HydrophobicContact CG2-CE2 4.1Å; T92-F125 HydrophobicContact CG2-CZ 4.13Å; T121-F125 HydrophobicContact CG2-CD2 3.6Å; T121-F125 HydrophobicContact CG2-CE2 3.28Å; T121-F125 HydrophobicContact CG2-CZ 4.11Å; T121-F125 WeakPolarHBondContact O-CD2 3.19Å; T121-F125 PolarHBondContact O-N 3.5Å; L122-F125 PolarHBondContact O-N 2.88Å; F125-G129 WeakPolarHBondContact O-CA 3.39Å; F125-G129 PolarHBondContact O-N 3.47Å; F125-L229 HydrophobicContact CZ-CD2 4.34Å; F125-L232 HydrophobicContact CD1-CB 4.35Å; F125-L232 HydrophobicContact CE1-CB 3.7Å; F125-L232 HydrophobicContact CE2-CB 3.94Å; F125-L232 HydrophobicContact CE2-CD1 3.91Å; F125-L232 HydrophobicContact CZ-CB 3.46Å; F125-L232 VanDerWaalsContact CZ-CB 3.46Å; F125-L232 HydrophobicContact CZ-CD1 3.64Å; F125-L232 HydrophobicContact CZ-CG 4.23Å; F125-T233 WeakPolarHBondContact CD1-OG1 3.46Å; F125-S236 PolarHBondContact O-OG 3.33Å; F125-S236 VanDerWaalsContact O-OG 3.05Å |
| 126 | Q | 90.1 | Very high | 93.6 | Very high | 71 Ų | 71 | 63.3 Ų | 63.3 | 33% | 0.332 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -65.5 | -51.1 | 172.2 | -71.9 | -64.5 | -57.5 | 0 | 0 | 110.9 | L122 V123 M124 I128 G129 E130 S236 N240 | L122-Q126 WeakPolarHBondContact O-CG 3.5Å; L122-Q126 PolarHBondContact O-N 3.34Å; V123-Q126 PolarHBondContact O-N 3.45Å; M124-Q126 VanDerWaalsContact C-N 3.32Å; M124-Q126 PolarHBondContact O-N 3.28Å; Q126-I128 PolarHBondContact O-N 3.39Å; Q126-G129 PolarHBondContact O-N 3.4Å; Q126-G129 VanDerWaalsContact O-N 3.15Å; Q126-E130 WeakPolarHBondContact O-CG 3.5Å; Q126-E130 PolarHBondContact O-N 3.28Å; Q126-S236 PolarHBondContact NE2-OG 3.34Å; Q126-N240 PolarHBondContact OE1-OD1 3.46Å |
| 127 | S | 92.6 | Very high | 93.3 | Very high | 59 Ų | 59 | 60.4 Ų | 60.4 | 41% | 0.413 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.1 | -47.2 | -179.5 | -58.6 | 0 | 0 | 0 | 0 | 112 | V123 M124 R131 | V123-S127 WeakPolarHBondContact O-CB 3.27Å; V123-S127 PolarHBondContact O-N 3.2Å; V123-S127 PolarHBondContact O-OG 2.89Å; M124-S127 PolarHBondContact O-N 3.02Å; S127-R131 VanDerWaalsContact O-CG 3.3Å; S127-R131 WeakPolarHBondContact O-CG 3.49Å; S127-R131 PolarHBondContact O-N 3.47Å |
| 128 | I | 94 | Very high | 92.9 | Very high | 77 Ų | 77 | 66.4 Ų | 66.4 | 40% | 0.395 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -68.5 | -39.2 | 178 | -59.2 | 171.7 | 0 | 0 | 0 | 110.2 | M124 Q126 E130 R131 L132 T233 | M124-I128 HydrophobicContact CG-CD1 3.71Å; M124-I128 HydrophobicContact CG-CG1 4.42Å; M124-I128 VanDerWaalsContact O-CG1 3.29Å; M124-I128 WeakPolarHBondContact O-CG1 3.48Å; M124-I128 PolarHBondContact O-N 3.28Å; M124-I128 HydrophobicContact SD-CD1 4.34Å; Q126-I128 PolarHBondContact O-N 3.39Å; I128-E130 PolarHBondContact O-N 3.48Å; I128-R131 PolarHBondContact O-N 2.91Å; I128-L132 WeakPolarHBondContact O-CB 3.26Å; I128-L132 PolarHBondContact O-N 2.94Å; I128-T233 HydrophobicContact CB-CG2 3.97Å; I128-T233 HydrophobicContact CG2-CG2 3.34Å |
| 129 | G | 91.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60 | -41.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | F125 Q126 L132 N133 | F125-G129 WeakPolarHBondContact O-CA 3.39Å; F125-G129 PolarHBondContact O-N 3.47Å; Q126-G129 PolarHBondContact O-N 3.4Å; Q126-G129 VanDerWaalsContact O-N 3.15Å; G129-L132 PolarHBondContact O-N 2.91Å; G129-N133 WeakPolarHBondContact O-CB 3.32Å; G129-N133 PolarHBondContact O-N 3.05Å; G129-N133 PolarHBondContact O-ND2 3.46Å |
| 130 | E | 90.7 | Very high | 92.2 | Very high | 94 Ų | 94 | 64.2 Ų | 64.2 | 44% | 0.439 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 173.7 | -72.7 | 177 | -178.2 | 0 | 0 | 112.8 | Q126 I128 N133 T134 N240 | Q126-E130 WeakPolarHBondContact O-CG 3.5Å; Q126-E130 PolarHBondContact O-N 3.28Å; I128-E130 PolarHBondContact O-N 3.48Å; E130-N133 PolarHBondContact O-N 2.85Å; E130-T134 PolarHBondContact O-N 3.35Å; E130-T134 PolarHBondContact O-OG1 3.33Å; E130-N240 VanDerWaalsContact CG-ND2 3.31Å; E130-N240 WeakPolarHBondContact CG-ND2 3.49Å |
| 131 | R | 93.1 | Very high | 91.8 | Very high | 158 Ų | 158 | 64.1 Ų | 64.1 | 60% | 0.596 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -65.9 | -41.6 | 176.9 | -61.2 | -65.9 | 166 | 176 | -2.6 | 110.9 | S127 I128 T134 I135 | S127-R131 VanDerWaalsContact O-CG 3.3Å; S127-R131 WeakPolarHBondContact O-CG 3.49Å; S127-R131 PolarHBondContact O-N 3.47Å; I128-R131 PolarHBondContact O-N 2.91Å; R131-T134 WeakPolarHBondContact O-CB 3.4Å; R131-T134 PolarHBondContact O-N 3.03Å; R131-I135 WeakPolarHBondContact O-CG1 3.26Å; R131-I135 PolarHBondContact O-N 3.41Å |
| 132 | L | 92.6 | Very high | 91.4 | Very high | 39 Ų | 39 | 65.3 Ų | 65.3 | 20% | 0.204 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.7 | -46.2 | 174.7 | -173.7 | 66.1 | 0 | 0 | 0 | 111.1 | I128 G129 T134 I135 V136 T233 V234 A237 | I128-L132 WeakPolarHBondContact O-CB 3.26Å; I128-L132 PolarHBondContact O-N 2.94Å; G129-L132 PolarHBondContact O-N 2.91Å; L132-T134 VanDerWaalsContact C-N 3.29Å; L132-T134 PolarHBondContact O-N 2.82Å; L132-I135 WeakPolarHBondContact O-CB 3.38Å; L132-I135 PolarHBondContact O-N 2.92Å; L132-I135 VanDerWaalsContact O-N 3.16Å; L132-V136 WeakPolarHBondContact O-CG2 3.49Å; L132-V136 PolarHBondContact O-N 3.22Å; L132-T233 HydrophobicContact CD2-CG2 4.43Å; L132-V234 HydrophobicContact CD2-CG2 3.95Å; L132-A237 HydrophobicContact CD2-CB 4.07Å |
| 133 | N | 91 | Very high | 91.2 | Very high | 11 Ų | 11 | 65.8 Ų | 65.8 | 6% | 0.059 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60 | -38.1 | 175.2 | -78.8 | -23.6 | 0 | 0 | 0 | 112.3 | G129 E130 V136 A137 L159 A237 L241 | G129-N133 WeakPolarHBondContact O-CB 3.32Å; G129-N133 PolarHBondContact O-N 3.05Å; G129-N133 PolarHBondContact O-ND2 3.46Å; E130-N133 PolarHBondContact O-N 2.85Å; N133-V136 PolarHBondContact O-N 2.85Å; N133-A137 WeakPolarHBondContact O-CB 3.42Å; N133-A137 PolarHBondContact O-N 3.32Å; N133-L159 HydrophobicContact CB-CD2 4.19Å; N133-A237 PolarHBondContact ND2-O 3.43Å; N133-L241 WeakPolarHBondContact ND2-CG 3.3Å |
| 134 | T | 91.2 | Very high | 90.8 | Very high | 82 Ų | 82 | 64.5 Ų | 64.5 | 50% | 0.503 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 174.5 | -58.4 | 0 | 0 | 0 | 0 | 111.7 | E130 R131 L132 A137 F138 | E130-T134 PolarHBondContact O-N 3.35Å; E130-T134 PolarHBondContact O-OG1 3.33Å; R131-T134 WeakPolarHBondContact O-CB 3.4Å; R131-T134 PolarHBondContact O-N 3.03Å; L132-T134 VanDerWaalsContact C-N 3.29Å; L132-T134 PolarHBondContact O-N 2.82Å; T134-A137 PolarHBondContact O-N 2.93Å; T134-F138 WeakPolarHBondContact O-CB 3.26Å; T134-F138 PolarHBondContact O-N 3.31Å |
| 135 | I | 92 | Very high | 90.4 | Very high | 100 Ų | 100 | 70.4 Ų | 70.4 | 51% | 0.513 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.8 | -47.2 | 175.7 | -68 | 164.9 | 0 | 0 | 0 | 110.1 | R131 L132 A137 F138 S139 | R131-I135 WeakPolarHBondContact O-CG1 3.26Å; R131-I135 PolarHBondContact O-N 3.41Å; L132-I135 WeakPolarHBondContact O-CB 3.38Å; L132-I135 PolarHBondContact O-N 2.92Å; L132-I135 VanDerWaalsContact O-N 3.16Å; I135-A137 VanDerWaalsContact C-N 3.33Å; I135-A137 PolarHBondContact O-N 3.49Å; I135-F138 WeakPolarHBondContact O-CB 3.42Å; I135-F138 PolarHBondContact O-N 3.37Å; I135-S139 PolarHBondContact O-N 3.42Å; I135-S139 PolarHBondContact O-OG 3.1Å; I135-S139 VanDerWaalsContact O-OG 3.1Å |
| 136 | V | 91.3 | Very high | 90.1 | Very high | 13 Ų | 13 | 75.2 Ų | 75.2 | 8% | 0.079 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -60.1 | -44.4 | 176.7 | 173.7 | 0 | 0 | 0 | 0 | 110.7 | L132 N133 F138 S139 I140 L159 V162 I166 | L132-V136 WeakPolarHBondContact O-CG2 3.49Å; L132-V136 PolarHBondContact O-N 3.22Å; N133-V136 PolarHBondContact O-N 2.85Å; V136-F138 VanDerWaalsContact C-N 3.31Å; V136-F138 PolarHBondContact O-N 3Å; V136-S139 PolarHBondContact O-N 3Å; V136-I140 HydrophobicContact CG1-CD1 3.82Å; V136-I140 HydrophobicContact CG1-CG1 4.35Å; V136-I140 VanDerWaalsContact O-CG1 3.26Å; V136-I140 WeakPolarHBondContact O-CG1 3.29Å; V136-I140 PolarHBondContact O-N 3.25Å; V136-L159 HydrophobicContact CB-CD1 3.89Å; V136-L159 HydrophobicContact CG1-CD1 3.55Å; V136-V162 HydrophobicContact CG1-CB 4.12Å; V136-V162 HydrophobicContact CG1-CG1 3.49Å; V136-V162 VanDerWaalsContact CG1-CG1 3.49Å; V136-I166 HydrophobicContact CG2-CD1 3.91Å |
| 137 | A | 89.9 | Confident | 89.9 | Confident | 9 Ų | 9 | 75.2 Ų | 75.2 | 7% | 0.074 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63.3 | -36.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | N133 T134 I135 R141 L159 | N133-A137 WeakPolarHBondContact O-CB 3.42Å; N133-A137 PolarHBondContact O-N 3.32Å; T134-A137 PolarHBondContact O-N 2.93Å; I135-A137 VanDerWaalsContact C-N 3.33Å; I135-A137 PolarHBondContact O-N 3.49Å; A137-R141 VanDerWaalsContact O-CG 3.28Å; A137-R141 WeakPolarHBondContact O-CG 3.46Å; A137-R141 PolarHBondContact O-N 3.36Å; A137-R141 VanDerWaalsContact O-N 3.1Å; A137-R141 PolarHBondContact O-NE 3.17Å; A137-L159 HydrophobicContact CB-CD1 4.36Å |
| 138 | F | 90.4 | Very high | 89.3 | Confident | 134 Ų | 134 | 75.5 Ų | 75.5 | 59% | 0.588 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -66.2 | -46.6 | 173.2 | 179.2 | -95.6 | 0 | 0 | 0 | 111.4 | T134 I135 V136 I140 R141 A142 | T134-F138 WeakPolarHBondContact O-CB 3.26Å; T134-F138 PolarHBondContact O-N 3.31Å; I135-F138 WeakPolarHBondContact O-CB 3.42Å; I135-F138 PolarHBondContact O-N 3.37Å; V136-F138 VanDerWaalsContact C-N 3.31Å; V136-F138 PolarHBondContact O-N 3Å; F138-I140 PolarHBondContact O-N 3.13Å; F138-R141 WeakPolarHBondContact O-CB 3.34Å; F138-R141 PolarHBondContact O-N 3.22Å; F138-R141 VanDerWaalsContact O-N 3.12Å; F138-A142 PolarHBondContact O-N 3.44Å |
| 139 | S | 90.2 | Very high | 88.4 | Confident | 53 Ų | 53 | 75 Ų | 75 | 37% | 0.371 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -59.8 | -44 | 176.8 | -63 | 0 | 0 | 0 | 0 | 112.1 | I135 V136 R141 A142 I143 | I135-S139 PolarHBondContact O-N 3.42Å; I135-S139 PolarHBondContact O-OG 3.1Å; I135-S139 VanDerWaalsContact O-OG 3.1Å; V136-S139 PolarHBondContact O-N 3Å; S139-R141 VanDerWaalsContact C-N 3.33Å; S139-R141 PolarHBondContact O-N 3.19Å; S139-A142 PolarHBondContact O-N 2.85Å; S139-I143 VanDerWaalsContact O-CG1 3.26Å; S139-I143 WeakPolarHBondContact O-CG1 3.31Å; S139-I143 PolarHBondContact O-N 3.39Å |
| 140 | I | 88.5 | Confident | 87.3 | Confident | 21 Ų | 21 | 84.9 Ų | 84.9 | 11% | 0.108 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -60.4 | -43.6 | 174.6 | -67.1 | 165.8 | 0 | 0 | 0 | 110.5 | V136 F138 I143 R144 V154 L159 V162 | V136-I140 HydrophobicContact CG1-CD1 3.82Å; V136-I140 HydrophobicContact CG1-CG1 4.35Å; V136-I140 VanDerWaalsContact O-CG1 3.26Å; V136-I140 WeakPolarHBondContact O-CG1 3.29Å; V136-I140 PolarHBondContact O-N 3.25Å; F138-I140 PolarHBondContact O-N 3.13Å; I140-I143 PolarHBondContact O-N 2.78Å; I140-R144 HydrophobicContact CG2-CG 4.37Å; I140-R144 VanDerWaalsContact O-CB 3.29Å; I140-R144 WeakPolarHBondContact O-CB 3.1Å; I140-R144 WeakPolarHBondContact O-CG 3.49Å; I140-R144 PolarHBondContact O-N 3.1Å; I140-V154 HydrophobicContact CB-CG2 4.37Å; I140-V154 HydrophobicContact CD1-CG1 4.23Å; I140-V154 HydrophobicContact CG2-CG1 4.37Å; I140-V154 HydrophobicContact CG2-CG2 3.92Å; I140-L159 HydrophobicContact CD1-CD1 4.46Å; I140-V162 HydrophobicContact CD1-CB 4.25Å; I140-V162 HydrophobicContact CD1-CG1 4.47Å; I140-V162 HydrophobicContact CD1-CG2 3.88Å; I140-V162 HydrophobicContact CG1-CG2 4.43Å |
| 141 | R | 87.3 | Confident | 86.1 | Confident | 123 Ų | 123 | 88.3 Ų | 88.3 | 46% | 0.464 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 177 | -76.1 | 178.7 | -114.1 | 174.2 | -7.1 | 111.9 | A137 F138 S139 R145 V154 | A137-R141 VanDerWaalsContact O-CG 3.28Å; A137-R141 WeakPolarHBondContact O-CG 3.46Å; A137-R141 PolarHBondContact O-N 3.36Å; A137-R141 VanDerWaalsContact O-N 3.1Å; A137-R141 PolarHBondContact O-NE 3.17Å; F138-R141 WeakPolarHBondContact O-CB 3.34Å; F138-R141 PolarHBondContact O-N 3.22Å; F138-R141 VanDerWaalsContact O-N 3.12Å; S139-R141 VanDerWaalsContact C-N 3.33Å; S139-R141 PolarHBondContact O-N 3.19Å; R141-R145 VanDerWaalsContact O-CB 3.31Å; R141-R145 WeakPolarHBondContact O-CB 3.35Å; R141-R145 PolarHBondContact O-N 2.96Å; R141-V154 HydrophobicContact CG-CG2 3.63Å |
| 142 | A | 88.2 | Confident | 84.8 | Confident | 36 Ų | 36 | 89.4 Ų | 89.4 | 30% | 0.298 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -64 | -49 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | F138 S139 R144 R145 C146 | F138-A142 PolarHBondContact O-N 3.44Å; S139-A142 PolarHBondContact O-N 2.85Å; A142-R144 PolarHBondContact O-N 2.87Å; A142-R145 WeakPolarHBondContact O-CB 3.34Å; A142-R145 PolarHBondContact O-N 3.09Å; A142-C146 PolarHBondContact O-N 3.47Å; A142-C146 PolarHBondContact O-SG 2.91Å; A142-C146 VanDerWaalsContact O-SG 3.32Å |
| 143 | I | 88.2 | Confident | 84 | Confident | 116 Ų | 116 | 93.1 Ų | 93.1 | 60% | 0.595 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.4 | -46.2 | 177.5 | -66.4 | 164.9 | 0 | 0 | 0 | 110.8 | S139 I140 R145 C146 A147 | S139-I143 VanDerWaalsContact O-CG1 3.26Å; S139-I143 WeakPolarHBondContact O-CG1 3.31Å; S139-I143 PolarHBondContact O-N 3.39Å; I140-I143 PolarHBondContact O-N 2.78Å; I143-R145 VanDerWaalsContact C-N 3.28Å; I143-R145 PolarHBondContact O-N 3.39Å; I143-C146 PolarHBondContact O-N 2.89Å; I143-A147 WeakPolarHBondContact O-CB 3.37Å; I143-A147 PolarHBondContact O-N 3.45Å |
| 144 | R | 86.5 | Confident | 83.4 | Confident | 67 Ų | 67 | 94.3 Ų | 94.3 | 25% | 0.253 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.3 | -32.7 | 177.8 | -79.5 | -174.5 | -176.8 | 178.5 | 4.6 | 113.3 | I140 A142 G148 T149 T153 S158 | I140-R144 HydrophobicContact CG2-CG 4.37Å; I140-R144 VanDerWaalsContact O-CB 3.29Å; I140-R144 WeakPolarHBondContact O-CB 3.1Å; I140-R144 WeakPolarHBondContact O-CG 3.49Å; I140-R144 PolarHBondContact O-N 3.1Å; A142-R144 PolarHBondContact O-N 2.87Å; R144-G148 PolarHBondContact O-N 2.89Å; R144-T149 WeakPolarHBondContact CA-OG1 3.31Å; R144-T149 VanDerWaalsContact CB-OG1 3.27Å; R144-T149 WeakPolarHBondContact CB-OG1 3.27Å; R144-T149 PolarHBondContact O-N 3.2Å; R144-T149 VanDerWaalsContact O-N 3.12Å; R144-T149 PolarHBondContact O-OG1 2.97Å; R144-T153 PolarHBondContact NH1-O 3.47Å; R144-S158 PolarHBondContact NH2-OG 3.04Å |
| 145 | R | 84.8 | Confident | 83 | Confident | 199 Ų | 199 | 93.3 Ų | 93.3 | 75% | 0.751 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -68.4 | -44.5 | 173.9 | -172.4 | -179.2 | -65.1 | 166 | -1.7 | 110.8 | R141 A142 I143 A147 G148 | R141-R145 VanDerWaalsContact O-CB 3.31Å; R141-R145 WeakPolarHBondContact O-CB 3.35Å; R141-R145 PolarHBondContact O-N 2.96Å; A142-R145 WeakPolarHBondContact O-CB 3.34Å; A142-R145 PolarHBondContact O-N 3.09Å; I143-R145 VanDerWaalsContact C-N 3.28Å; I143-R145 PolarHBondContact O-N 3.39Å; R145-A147 VanDerWaalsContact C-N 3.31Å; R145-A147 PolarHBondContact O-N 2.81Å; R145-G148 PolarHBondContact O-N 3.33Å |
| 146 | C | 87.6 | Confident | 82.6 | Confident | 118 Ų | 118 | 95.3 Ų | 95.3 | 80% | 0.797 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.9 | -34.9 | 174.8 | -62.9 | 0 | 0 | 0 | 0 | 112.3 | A142 I143 G148 | A142-C146 PolarHBondContact O-N 3.47Å; A142-C146 PolarHBondContact O-SG 2.91Å; A142-C146 VanDerWaalsContact O-SG 3.32Å; I143-C146 PolarHBondContact O-N 2.89Å; C146-G148 VanDerWaalsContact C-N 3.27Å; C146-G148 PolarHBondContact O-N 3.5Å |
| 147 | A | 86.6 | Confident | 82.1 | Confident | 71 Ų | 71 | 99 Ų | 99 | 59% | 0.587 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.6 | 3.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | I143 R145 T149 | I143-A147 WeakPolarHBondContact O-CB 3.37Å; I143-A147 PolarHBondContact O-N 3.45Å; R145-A147 VanDerWaalsContact C-N 3.31Å; R145-A147 PolarHBondContact O-N 2.81Å; A147-T149 HydrophobicContact CB-CG2 4.45Å; A147-T149 PolarHBondContact O-N 3.31Å |
| 148 | G | 79 | Confident | 82 | Confident | 64 Ų | 64 | 100.3 Ų | 100.3 | 66% | 0.66 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.5 | 16.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | R144 R145 C146 | R144-G148 PolarHBondContact O-N 2.89Å; R145-G148 PolarHBondContact O-N 3.33Å; C146-G148 VanDerWaalsContact C-N 3.27Å; C146-G148 PolarHBondContact O-N 3.5Å |
| 149 | T | 76.4 | Confident | 81.8 | Confident | 67 Ų | 67 | 94.7 Ų | 94.7 | 41% | 0.411 | 51% | 0.506 | S | S | . | . | trans | -74.3 | 132.6 | -175.2 | 52 | 0 | 0 | 0 | 0 | 112.7 | R144 A147 K151 | R144-T149 WeakPolarHBondContact CA-OG1 3.31Å; R144-T149 VanDerWaalsContact CB-OG1 3.27Å; R144-T149 WeakPolarHBondContact CB-OG1 3.27Å; R144-T149 PolarHBondContact O-N 3.2Å; R144-T149 VanDerWaalsContact O-N 3.12Å; R144-T149 PolarHBondContact O-OG1 2.97Å; A147-T149 HydrophobicContact CB-CG2 4.45Å; A147-T149 PolarHBondContact O-N 3.31Å; T149-K151 VanDerWaalsContact C-N 3.3Å; T149-K151 PolarHBondContact O-N 2.9Å | ||
| 150 | K | 67.2 | Low | 81.6 | Confident | 207 Ų | 207 | 93.5 Ų | 93.5 | 90% | 0.9 | 50% | 0.496 | S | S | * | . | S | Bend | trans | -67.5 | -24.2 | -178.8 | -65.5 | -175.6 | 179.9 | -179.3 | 0 | 113.8 | K152 | K150-K152 PolarHBondContact O-N 3.23Š|
| 151 | K | 67 | Low | 81.6 | Confident | 167 Ų | 167 | 98.3 Ų | 98.3 | 73% | 0.726 | 52% | 0.52 | S | S | * | . | trans | -83.7 | 93.8 | -178.3 | -71.8 | -173.8 | 178.9 | -179.5 | 0 | 111.5 | T149 | T149-K151 VanDerWaalsContact C-N 3.3Å; T149-K151 PolarHBondContact O-N 2.9Å | ||
| 152 | K | 64.9 | Low | 81.8 | Confident | 181 Ų | 181 | 94.9 Ų | 94.9 | 79% | 0.787 | 51% | 0.512 | S | S | * | . | trans | -78.3 | -14 | 179.1 | -64.8 | -179.2 | -178.1 | 176.1 | 0 | 114.3 | K150 | K150-K152 PolarHBondContact O-N 3.23Š| ||
| 153 | T | 75.7 | Confident | 81.9 | Confident | 117 Ų | 117 | 93.4 Ų | 93.4 | 72% | 0.718 | 50% | 0.5 | S | S | * | . | trans | -83.5 | 128.6 | -179.3 | 53.5 | 0 | 0 | 0 | 0 | 111.2 | R144 | R144-T153 PolarHBondContact NH1-O 3.47Š| ||
| 154 | V | 79 | Confident | 81.9 | Confident | 36 Ų | 36 | 90.5 Ų | 90.5 | 22% | 0.218 | 49% | 0.49 | C | S | . | . | trans | -91.2 | 113.4 | 172.7 | -178.9 | 0 | 0 | 0 | 0 | 107.1 | I140 R141 | I140-V154 HydrophobicContact CB-CG2 4.37Å; I140-V154 HydrophobicContact CD1-CG1 4.23Å; I140-V154 HydrophobicContact CG2-CG1 4.37Å; I140-V154 HydrophobicContact CG2-CG2 3.92Å; R141-V154 HydrophobicContact CG-CG2 3.63Å | ||
| 155 | S | 83.5 | Confident | 82.1 | Confident | 61 Ų | 61 | 91 Ų | 91 | 43% | 0.427 | 50% | 0.501 | S | S | . | . | trans | -73.6 | 146.5 | 175.3 | 175.5 | 0 | 0 | 0 | 0 | 110.4 | T157 S158 L159 | S155-T157 PolarHBondContact O-N 3.04Å; S155-T157 PolarHBondContact OG-N 2.99Å; S155-S158 WeakPolarHBondContact O-CB 3.45Å; S155-S158 PolarHBondContact O-N 3.21Å; S155-L159 PolarHBondContact O-N 3.36Å; S155-L159 VanDerWaalsContact O-N 3.09Å | ||
| 156 | H | 81.6 | Confident | 82.5 | Confident | 142 Ų | 142 | 84.4 Ų | 84.4 | 66% | 0.657 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -53.4 | -34.6 | 171.8 | -72.5 | -91.3 | 0 | 0 | 0 | 112 | L159 T160 | H156-L159 PolarHBondContact O-N 2.89Å; H156-T160 WeakPolarHBondContact O-CB 3.33Å; H156-T160 PolarHBondContact O-N 2.67Å; H156-T160 PolarHBondContact O-OG1 3.49Å |
| 157 | T | 82.8 | Confident | 82.8 | Confident | 89 Ų | 89 | 79.7 Ų | 79.7 | 55% | 0.546 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.7 | -43 | 174.9 | -44.8 | 0 | 0 | 0 | 0 | 111.7 | S155 L159 T160 M161 | S155-T157 PolarHBondContact O-N 3.04Å; S155-T157 PolarHBondContact OG-N 2.99Å; T157-L159 VanDerWaalsContact C-N 3.32Å; T157-L159 PolarHBondContact O-N 2.97Å; T157-T160 PolarHBondContact O-N 3.49Å; T157-M161 WeakPolarHBondContact O-CB 3.49Å; T157-M161 VanDerWaalsContact O-CG 3.25Å; T157-M161 WeakPolarHBondContact O-CG 3.41Å; T157-M161 PolarHBondContact O-N 3Å |
| 158 | S | 86.2 | Confident | 83.1 | Confident | 37 Ų | 37 | 80.9 Ų | 80.9 | 26% | 0.259 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.2 | -40.2 | 177.2 | -58.8 | 0 | 0 | 0 | 0 | 111.4 | R144 S155 M161 V162 | R144-S158 PolarHBondContact NH2-OG 3.04Å; S155-S158 WeakPolarHBondContact O-CB 3.45Å; S155-S158 PolarHBondContact O-N 3.21Å; S158-M161 PolarHBondContact O-N 3.41Å; S158-V162 WeakPolarHBondContact O-CG2 2.97Å; S158-V162 PolarHBondContact O-N 3.08Å |
| 159 | L | 86.9 | Confident | 83.9 | Confident | 17 Ų | 17 | 83 Ų | 83 | 9% | 0.089 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -65.7 | -44.2 | 178.2 | -173.7 | 62.4 | 0 | 0 | 0 | 111.3 | N133 V136 A137 I140 S155 H156 T157 M161 V162 A163 L241 | N133-L159 HydrophobicContact CB-CD2 4.19Å; V136-L159 HydrophobicContact CB-CD1 3.89Å; V136-L159 HydrophobicContact CG1-CD1 3.55Å; A137-L159 HydrophobicContact CB-CD1 4.36Å; I140-L159 HydrophobicContact CD1-CD1 4.46Å; S155-L159 PolarHBondContact O-N 3.36Å; S155-L159 VanDerWaalsContact O-N 3.09Å; H156-L159 PolarHBondContact O-N 2.89Å; T157-L159 VanDerWaalsContact C-N 3.32Å; T157-L159 PolarHBondContact O-N 2.97Å; L159-M161 PolarHBondContact O-N 2.9Å; L159-V162 PolarHBondContact O-N 3.45Å; L159-A163 WeakPolarHBondContact O-CB 3.33Å; L159-A163 PolarHBondContact O-N 3.29Å; L159-L241 HydrophobicContact CB-CD1 4.3Å; L159-L241 HydrophobicContact CD2-CD1 3.9Å; L159-L241 HydrophobicContact CD2-CD2 3.6Å; L159-L241 HydrophobicContact CD2-CG 4.41Å; L159-L241 HydrophobicContact CG-CD1 3.63Å; L159-L241 HydrophobicContact CG-CD2 4.28Å |
| 160 | T | 85.9 | Confident | 84.8 | Confident | 28 Ų | 28 | 80.9 Ų | 80.9 | 17% | 0.172 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -60.6 | -46.4 | 176.1 | -52.6 | 0 | 0 | 0 | 0 | 110.9 | H156 T157 V162 A163 S164 L242 | H156-T160 WeakPolarHBondContact O-CB 3.33Å; H156-T160 PolarHBondContact O-N 2.67Å; H156-T160 PolarHBondContact O-OG1 3.49Å; T157-T160 PolarHBondContact O-N 3.49Å; T160-V162 VanDerWaalsContact C-N 3.34Å; T160-V162 PolarHBondContact O-N 3.08Å; T160-A163 PolarHBondContact O-N 3.42Å; T160-S164 WeakPolarHBondContact O-CB 3.34Å; T160-S164 PolarHBondContact O-N 3.34Å; T160-S164 PolarHBondContact O-OG 2.93Å; T160-L242 HydrophobicContact CG2-CD2 3.89Å; T160-L242 HydrophobicContact CG2-CG 4.34Å |
| 161 | M | 88.5 | Confident | 86.2 | Confident | 122 Ų | 122 | 72.3 Ų | 72.3 | 60% | 0.601 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -60.4 | -41.4 | 177.3 | -71.3 | -64.2 | -69.3 | 0 | 0 | 112.5 | T157 S158 L159 T165 | T157-M161 WeakPolarHBondContact O-CB 3.49Å; T157-M161 VanDerWaalsContact O-CG 3.25Å; T157-M161 WeakPolarHBondContact O-CG 3.41Å; T157-M161 PolarHBondContact O-N 3Å; S158-M161 PolarHBondContact O-N 3.41Å; L159-M161 PolarHBondContact O-N 2.9Å; M161-T165 PolarHBondContact O-N 2.95Å; M161-T165 PolarHBondContact O-OG1 3.21Å |
| 162 | V | 91.3 | Very high | 87.6 | Confident | 51 Ų | 51 | 66 Ų | 66 | 31% | 0.309 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -69.6 | -42.6 | 178 | 173.9 | 0 | 0 | 0 | 0 | 111.3 | V136 I140 S158 L159 T160 S164 T165 I166 | V136-V162 HydrophobicContact CG1-CB 4.12Å; V136-V162 HydrophobicContact CG1-CG1 3.49Å; V136-V162 VanDerWaalsContact CG1-CG1 3.49Å; I140-V162 HydrophobicContact CD1-CB 4.25Å; I140-V162 HydrophobicContact CD1-CG1 4.47Å; I140-V162 HydrophobicContact CD1-CG2 3.88Å; I140-V162 HydrophobicContact CG1-CG2 4.43Å; S158-V162 WeakPolarHBondContact O-CG2 2.97Å; S158-V162 PolarHBondContact O-N 3.08Å; L159-V162 PolarHBondContact O-N 3.45Å; T160-V162 VanDerWaalsContact C-N 3.34Å; T160-V162 PolarHBondContact O-N 3.08Å; V162-S164 VanDerWaalsContact C-N 3.34Å; V162-S164 PolarHBondContact O-N 3.06Å; V162-T165 PolarHBondContact O-N 3.26Å; V162-I166 HydrophobicContact CG1-CD1 3.87Å; V162-I166 HydrophobicContact CG1-CG1 4.38Å; V162-I166 VanDerWaalsContact O-CG1 3.31Å; V162-I166 WeakPolarHBondContact O-CG1 3.27Å; V162-I166 PolarHBondContact O-N 3.49Å |
| 163 | A | 89.3 | Confident | 89 | Confident | 5 Ų | 5 | 60.4 Ų | 60.4 | 4% | 0.041 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -59.8 | -44.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L159 T160 T165 I166 G167 A238 L241 | L159-A163 WeakPolarHBondContact O-CB 3.33Å; L159-A163 PolarHBondContact O-N 3.29Å; T160-A163 PolarHBondContact O-N 3.42Å; A163-T165 PolarHBondContact O-N 3.47Å; A163-I166 PolarHBondContact O-N 2.71Å; A163-G167 PolarHBondContact O-N 2.84Å; A163-A238 HydrophobicContact CB-CB 4.22Å; A163-L241 HydrophobicContact CB-CD1 4.27Å |
| 164 | S | 88.7 | Confident | 90 | Very high | 55 Ų | 55 | 54.9 Ų | 54.9 | 39% | 0.385 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 174.3 | -60.3 | 0 | 0 | 0 | 0 | 112.1 | T160 V162 G167 T168 | T160-S164 WeakPolarHBondContact O-CB 3.34Å; T160-S164 PolarHBondContact O-N 3.34Å; T160-S164 PolarHBondContact O-OG 2.93Å; V162-S164 VanDerWaalsContact C-N 3.34Å; V162-S164 PolarHBondContact O-N 3.06Å; S164-G167 PolarHBondContact O-N 3.32Å; S164-T168 PolarHBondContact O-N 3.23Å; S164-T168 PolarHBondContact O-OG1 3.43Å; S164-T168 VanDerWaalsContact O-OG1 3.08Å |
| 165 | T | 92.2 | Very high | 90.9 | Very high | 78 Ų | 78 | 53.1 Ų | 53.1 | 48% | 0.479 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.5 | -42.3 | 176.4 | -60.3 | 0 | 0 | 0 | 0 | 112.2 | M161 V162 A163 G167 T168 I169 | M161-T165 PolarHBondContact O-N 2.95Å; M161-T165 PolarHBondContact O-OG1 3.21Å; V162-T165 PolarHBondContact O-N 3.26Å; A163-T165 PolarHBondContact O-N 3.47Å; T165-G167 VanDerWaalsContact C-N 3.31Å; T165-G167 PolarHBondContact O-N 2.87Å; T165-T168 PolarHBondContact O-N 3.31Å; T165-I169 HydrophobicContact CG2-CD1 3.92Å; T165-I169 VanDerWaalsContact O-CG1 3.29Å; T165-I169 WeakPolarHBondContact O-CG1 3.37Å; T165-I169 PolarHBondContact O-N 2.6Å |
| 166 | I | 93.2 | Very high | 91.5 | Very high | 60 Ų | 60 | 56.1 Ų | 56.1 | 31% | 0.308 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -61.1 | -43.8 | 174.4 | -67.3 | 167 | 0 | 0 | 0 | 110 | V136 V162 A163 I169 L170 V234 | V136-I166 HydrophobicContact CG2-CD1 3.91Å; V162-I166 HydrophobicContact CG1-CD1 3.87Å; V162-I166 HydrophobicContact CG1-CG1 4.38Å; V162-I166 VanDerWaalsContact O-CG1 3.31Å; V162-I166 WeakPolarHBondContact O-CG1 3.27Å; V162-I166 PolarHBondContact O-N 3.49Å; A163-I166 PolarHBondContact O-N 2.71Å; I166-I169 PolarHBondContact O-N 2.99Å; I166-L170 WeakPolarHBondContact O-CB 3.33Å; I166-L170 PolarHBondContact O-N 3.08Å; I166-V234 HydrophobicContact CG2-CG1 4.06Å; I166-V234 HydrophobicContact CG2-CG2 4.39Å |
| 167 | G | 93.2 | Very high | 92.2 | Very high | 18 Ų | 18 | 50.1 Ų | 50.1 | 19% | 0.186 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -58.6 | -46.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A163 S164 T165 L170 M171 | A163-G167 PolarHBondContact O-N 2.84Å; S164-G167 PolarHBondContact O-N 3.32Å; T165-G167 VanDerWaalsContact C-N 3.31Å; T165-G167 PolarHBondContact O-N 2.87Å; G167-L170 PolarHBondContact O-N 3.03Å; G167-M171 WeakPolarHBondContact O-CB 3.48Å; G167-M171 PolarHBondContact O-N 3.23Å |
| 168 | T | 92.9 | Very high | 92.8 | Very high | 97 Ų | 97 | 45.9 Ų | 45.9 | 60% | 0.595 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -63.6 | -42.6 | 177.5 | -56.8 | 0 | 0 | 0 | 0 | 112.2 | S164 T165 M171 A172 | S164-T168 PolarHBondContact O-N 3.23Å; S164-T168 PolarHBondContact O-OG1 3.43Å; S164-T168 VanDerWaalsContact O-OG1 3.08Å; T165-T168 PolarHBondContact O-N 3.31Å; T168-M171 PolarHBondContact O-N 2.85Å; T168-A172 WeakPolarHBondContact O-CB 3.45Å; T168-A172 PolarHBondContact O-N 3.43Å |
| 169 | I | 95.5 | Very high | 93.3 | Very high | 108 Ų | 108 | 47.1 Ų | 47.1 | 55% | 0.554 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -64.6 | -42 | 176.4 | -67.9 | 167.1 | 0 | 0 | 0 | 110.6 | T165 I166 M171 A172 S173 | T165-I169 HydrophobicContact CG2-CD1 3.92Å; T165-I169 VanDerWaalsContact O-CG1 3.29Å; T165-I169 WeakPolarHBondContact O-CG1 3.37Å; T165-I169 PolarHBondContact O-N 2.6Å; I166-I169 PolarHBondContact O-N 2.99Å; I169-M171 VanDerWaalsContact C-N 3.33Å; I169-M171 PolarHBondContact O-N 3.45Å; I169-A172 PolarHBondContact O-N 3.14Å; I169-S173 WeakPolarHBondContact O-CB 3.15Å; I169-S173 PolarHBondContact O-N 3.06Å; I169-S173 PolarHBondContact O-OG 3.24Å |
| 170 | L | 95.7 | Very high | 93.7 | Very high | 22 Ų | 22 | 53.3 Ų | 53.3 | 12% | 0.115 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.5 | -44.3 | 176.2 | -178.4 | 67.4 | 0 | 0 | 0 | 111.1 | I166 G167 S173 G174 F227 F230 V234 | I166-L170 WeakPolarHBondContact O-CB 3.33Å; I166-L170 PolarHBondContact O-N 3.08Å; G167-L170 PolarHBondContact O-N 3.03Å; L170-S173 WeakPolarHBondContact CA-OG 3.4Å; L170-S173 PolarHBondContact O-N 3.15Å; L170-S173 PolarHBondContact O-OG 3.38Å; L170-S173 VanDerWaalsContact O-OG 3.04Å; L170-G174 PolarHBondContact O-N 2.8Å; L170-F227 HydrophobicContact CD1-CD2 4.21Å; L170-F227 HydrophobicContact CD1-CE2 3.95Å; L170-F227 HydrophobicContact CG-CE2 4.06Å; L170-F230 HydrophobicContact CD1-CD1 3.89Å; L170-F230 HydrophobicContact CD1-CE1 4.09Å; L170-F230 HydrophobicContact CD2-CD1 4Å; L170-F230 HydrophobicContact CD2-CE1 4.28Å; L170-V234 HydrophobicContact CD2-CB 4.18Å; L170-V234 HydrophobicContact CD2-CG2 4.08Å |
| 171 | M | 95.1 | Very high | 94 | Very high | 27 Ų | 27 | 57.5 Ų | 57.5 | 13% | 0.133 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.4 | -47.1 | 177.6 | -163 | 68.8 | 71.6 | 0 | 0 | 111.6 | G167 T168 I169 G174 A175 L190 C193 F194 L197 | G167-M171 WeakPolarHBondContact O-CB 3.48Å; G167-M171 PolarHBondContact O-N 3.23Å; T168-M171 PolarHBondContact O-N 2.85Å; I169-M171 VanDerWaalsContact C-N 3.33Å; I169-M171 PolarHBondContact O-N 3.45Å; M171-G174 PolarHBondContact O-N 2.87Å; M171-A175 VanDerWaalsContact O-CB 3.32Å; M171-A175 WeakPolarHBondContact O-CB 3.37Å; M171-A175 PolarHBondContact O-N 2.97Å; M171-L190 HydrophobicContact CG-CD1 3.7Å; M171-C193 HydrophobicContact CG-CB 4.27Å; M171-C193 HydrophobicContact SD-CB 3.21Å; M171-C193 WeakPolarHBondContact SD-CB 3.26Å; M171-F194 HydrophobicContact CE-CB 4.45Å; M171-F194 HydrophobicContact CE-CD2 4.36Å; M171-F194 HydrophobicContact SD-CB 4.36Å; M171-F194 PolarHBondContact SD-N 2.9Å; M171-F194 VanDerWaalsContact SD-N 3.37Å; M171-L197 HydrophobicContact CE-CB 4.08Å; M171-L197 HydrophobicContact CE-CD1 3.72Å; M171-L197 HydrophobicContact CE-CG 4.34Å; M171-L197 HydrophobicContact SD-CD1 4.02Å |
| 172 | A | 96.3 | Very high | 94.2 | Very high | 36 Ų | 36 | 52 Ų | 52 | 30% | 0.298 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -66 | -42.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | T168 I169 A175 Y176 Y186 | T168-A172 WeakPolarHBondContact O-CB 3.45Å; T168-A172 PolarHBondContact O-N 3.43Å; I169-A172 PolarHBondContact O-N 3.14Å; A172-A175 PolarHBondContact O-N 2.86Å; A172-Y176 PolarHBondContact O-N 3.2Å; A172-Y186 PolarHBondContact O-OH 3.43Å |
| 173 | S | 96.3 | Very high | 94.3 | Very high | 62 Ų | 62 | 56.7 Ų | 56.7 | 43% | 0.434 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -68 | -38.4 | 176.9 | 57.3 | 0 | 0 | 0 | 0 | 112.5 | I169 L170 Y176 A177 | I169-S173 WeakPolarHBondContact O-CB 3.15Å; I169-S173 PolarHBondContact O-N 3.06Å; I169-S173 PolarHBondContact O-OG 3.24Å; L170-S173 WeakPolarHBondContact CA-OG 3.4Å; L170-S173 PolarHBondContact O-N 3.15Å; L170-S173 PolarHBondContact O-OG 3.38Å; L170-S173 VanDerWaalsContact O-OG 3.04Å; S173-Y176 PolarHBondContact O-N 3.49Å; S173-A177 PolarHBondContact O-N 3.36Å |
| 174 | G | 96.2 | Very high | 94.6 | Very high | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.01 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.6 | -51.2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112 | L170 M171 Y176 A177 F178 | L170-G174 PolarHBondContact O-N 2.8Å; M171-G174 PolarHBondContact O-N 2.87Å; G174-Y176 VanDerWaalsContact C-N 3.28Å; G174-Y176 PolarHBondContact O-N 3.38Å; G174-A177 WeakPolarHBondContact O-CB 3.32Å; G174-A177 PolarHBondContact O-N 2.91Å; G174-F178 WeakPolarHBondContact O-CD2 3.39Å; G174-F178 PolarHBondContact O-N 3.37Å |
| 175 | A | 97.2 | Very high | 95 | Very high | 0 Ų | 0 | 61.8 Ų | 61.8 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -56.3 | -43.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | M171 A172 A177 F178 H179 Y186 S189 L190 | M171-A175 VanDerWaalsContact O-CB 3.32Å; M171-A175 WeakPolarHBondContact O-CB 3.37Å; M171-A175 PolarHBondContact O-N 2.97Å; A172-A175 PolarHBondContact O-N 2.86Å; A175-A177 PolarHBondContact O-N 3.34Å; A175-F178 PolarHBondContact O-N 2.88Å; A175-H179 WeakPolarHBondContact O-CB 3.28Å; A175-H179 PolarHBondContact O-N 3.49Å; A175-Y186 HydrophobicContact CB-CD2 4.29Å; A175-Y186 HydrophobicContact CB-CE2 3.73Å; A175-S189 WeakPolarHBondContact O-CB 3.33Å; A175-L190 HydrophobicContact CB-CB 3.95Å; A175-L190 HydrophobicContact CB-CD1 3.94Å |
| 176 | Y | 97.3 | Very high | 95.2 | Very high | 124 Ų | 124 | 62.8 Ų | 62.8 | 49% | 0.486 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.9 | -40.9 | 175.5 | -179.7 | -104.3 | 0 | 0 | 0 | 112.5 | A172 S173 G174 R180 | A172-Y176 PolarHBondContact O-N 3.2Å; S173-Y176 PolarHBondContact O-N 3.49Å; G174-Y176 VanDerWaalsContact C-N 3.28Å; G174-Y176 PolarHBondContact O-N 3.38Å; Y176-R180 HydrophobicContact CE1-CG 4.37Å; Y176-R180 HydrophobicContact CE2-CG 4.46Å; Y176-R180 WeakPolarHBondContact O-CG 3.21Å; Y176-R180 PolarHBondContact O-N 3.34Å; Y176-R180 PolarHBondContact OH-NE 3.06Å; Y176-R180 PolarHBondContact OH-NH2 2.96Å |
| 177 | A | 96.1 | Very high | 95.4 | Very high | 15 Ų | 15 | 65.7 Ų | 65.7 | 12% | 0.124 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -65.2 | -48.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | S173 G174 A175 H179 R180 F181 F223 | S173-A177 PolarHBondContact O-N 3.36Å; G174-A177 WeakPolarHBondContact O-CB 3.32Å; G174-A177 PolarHBondContact O-N 2.91Å; A175-A177 PolarHBondContact O-N 3.34Å; A177-H179 PolarHBondContact O-N 2.93Å; A177-R180 PolarHBondContact O-N 3.49Å; A177-R180 VanDerWaalsContact O-N 3.14Å; A177-F181 HydrophobicContact CB-CD2 4.44Å; A177-F181 WeakPolarHBondContact O-CD2 3.43Å; A177-F181 PolarHBondContact O-N 2.99Å; A177-F223 HydrophobicContact CB-CE1 3.78Å; A177-F223 HydrophobicContact CB-CE2 4.45Å; A177-F223 HydrophobicContact CB-CZ 3.42Å; A177-F223 VanDerWaalsContact CB-CZ 3.42Å |
| 178 | F | 95.5 | Very high | 95.6 | Very high | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -66.9 | -35.6 | 179.2 | -70.2 | -67.6 | 0 | 0 | 0 | 112.7 | G174 A175 R180 F181 E182 W184 Y192 C193 A207 Y220 F223 F227 | G174-F178 WeakPolarHBondContact O-CD2 3.39Å; G174-F178 PolarHBondContact O-N 3.37Å; A175-F178 PolarHBondContact O-N 2.88Å; F178-R180 VanDerWaalsContact C-N 3.25Å; F178-R180 PolarHBondContact O-N 2.89Å; F178-F181 PolarHBondContact O-N 3.31Å; F178-E182 WeakPolarHBondContact O-CB 3.29Å; F178-E182 PolarHBondContact O-N 3.28Å; F178-W184 HydrophobicContact CB-CE3 4.48Å; F178-W184 HydrophobicContact CB-CZ3 4.49Å; F178-Y192 HydrophobicContact CD1-CD1 4.49Å; F178-Y192 AromaticContact CD1-CE1 3.91Å; F178-Y192 HydrophobicContact CD1-CE1 3.91Å; F178-Y192 AromaticContact CD2-CD1 3.98Å; F178-Y192 HydrophobicContact CD2-CD1 3.98Å; F178-Y192 AromaticContact CD2-CE1 3.74Å; F178-Y192 HydrophobicContact CD2-CE1 3.74Å; F178-Y192 AromaticContact CE1-CE1 3.86Å; F178-Y192 HydrophobicContact CE1-CE1 3.86Å; F178-Y192 HydrophobicContact CE2-CD1 4.35Å; F178-Y192 AromaticContact CE2-CE1 3.71Å; F178-Y192 HydrophobicContact CE2-CE1 3.71Å; F178-Y192 HydrophobicContact CG-CD1 4.08Å; F178-Y192 AromaticContact CG-CE1 3.86Å; F178-Y192 HydrophobicContact CG-CE1 3.86Å; F178-Y192 AromaticContact CZ-CE1 3.77Å; F178-Y192 HydrophobicContact CZ-CE1 3.77Å; F178-C193 VanDerWaalsContact CD2-SG 3.51Å; F178-A207 HydrophobicContact CD1-CB 3.95Å; F178-A207 HydrophobicContact CE1-CB 3.62Å; F178-Y220 HydrophobicContact CD1-CE2 4.43Å; F178-Y220 WeakPolarHBondContact CD1-OH 3.32Å; F178-Y220 HydrophobicContact CE1-CE2 4.24Å; F178-F223 HydrophobicContact CZ-CE1 4.27Å; F178-F227 AromaticContact CE2-CD1 3.6Å; F178-F227 HydrophobicContact CE2-CD1 3.6Å; F178-F227 AromaticContact CE2-CE1 3.69Å; F178-F227 HydrophobicContact CE2-CE1 3.69Å; F178-F227 HydrophobicContact CE2-CG 4.13Å; F178-F227 HydrophobicContact CE2-CZ 4.29Å; F178-F227 AromaticContact CZ-CD1 3.96Å; F178-F227 HydrophobicContact CZ-CD1 3.96Å; F178-F227 HydrophobicContact CZ-CE1 4.45Å; F178-F227 HydrophobicContact CZ-CG 4.43Å |
| 179 | H | 96.1 | Very high | 95.9 | Very high | 64 Ų | 64 | 62.1 Ų | 62.1 | 30% | 0.296 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -53.9 | -44.7 | 170.1 | 168.9 | 65.7 | 0 | 0 | 0 | 111.3 | A175 A177 Q183 W184 Y186 S189 | A175-H179 WeakPolarHBondContact O-CB 3.28Å; A175-H179 PolarHBondContact O-N 3.49Å; A177-H179 PolarHBondContact O-N 2.93Å; H179-Q183 VanDerWaalsContact O-CA 3.3Å; H179-Q183 WeakPolarHBondContact O-CA 3.35Å; H179-Q183 PolarHBondContact O-N 2.97Å; H179-Q183 VanDerWaalsContact O-N 3.13Å; H179-W184 PolarHBondContact CE1-O 3.15Å; H179-W184 PolarHBondContact ND1-O 3.34Å; H179-Y186 HydrophobicContact CB-CD2 4.48Å; H179-S189 VanDerWaalsContact CA-OG 3.3Å; H179-S189 WeakPolarHBondContact CA-OG 3.48Å; H179-S189 PolarHBondContact N-OG 2.84Å |
| 180 | R | 94.8 | Very high | 96 | Very high | 147 Ų | 147 | 59.8 Ų | 59.8 | 56% | 0.555 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -72.4 | -42.5 | 179 | -68.9 | -67.1 | -165 | 145.9 | 1.1 | 113.4 | Y176 A177 F178 Q183 | Y176-R180 HydrophobicContact CE1-CG 4.37Å; Y176-R180 HydrophobicContact CE2-CG 4.46Å; Y176-R180 WeakPolarHBondContact O-CG 3.21Å; Y176-R180 PolarHBondContact O-N 3.34Å; Y176-R180 PolarHBondContact OH-NE 3.06Å; Y176-R180 PolarHBondContact OH-NH2 2.96Å; A177-R180 PolarHBondContact O-N 3.49Å; A177-R180 VanDerWaalsContact O-N 3.14Å; F178-R180 VanDerWaalsContact C-N 3.25Å; F178-R180 PolarHBondContact O-N 2.89Å; R180-Q183 PolarHBondContact O-NE2 2.57Å |
| 181 | F | 92.8 | Very high | 96 | Very high | 116 Ų | 116 | 62.6 Ų | 62.6 | 51% | 0.509 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -78.3 | -44.1 | -176.1 | -76.2 | -66.7 | 0 | 0 | 0 | 112.9 | A177 F178 Y220 F223 | A177-F181 HydrophobicContact CB-CD2 4.44Å; A177-F181 WeakPolarHBondContact O-CD2 3.43Å; A177-F181 PolarHBondContact O-N 2.99Å; F178-F181 PolarHBondContact O-N 3.31Å; F181-Y220 HydrophobicContact CB-CD2 4.18Å; F181-Y220 HydrophobicContact CB-CE1 4.18Å; F181-Y220 HydrophobicContact CB-CE2 3.56Å; F181-Y220 AromaticContact CD1-CD2 3.95Å; F181-Y220 HydrophobicContact CD1-CD2 3.95Å; F181-Y220 HydrophobicContact CD1-CE2 4.2Å; F181-Y220 HydrophobicContact CD1-CG 4.28Å; F181-Y220 AromaticContact CD2-CD2 3.87Å; F181-Y220 HydrophobicContact CD2-CD2 3.87Å; F181-Y220 AromaticContact CD2-CE2 3.66Å; F181-Y220 HydrophobicContact CD2-CE2 3.66Å; F181-Y220 HydrophobicContact CE1-CD2 4.29Å; F181-Y220 HydrophobicContact CE2-CD2 4.23Å; F181-Y220 HydrophobicContact CE2-CE2 4.42Å; F181-Y220 AromaticContact CG-CD2 3.74Å; F181-Y220 HydrophobicContact CG-CD2 3.74Å; F181-Y220 AromaticContact CG-CE2 3.55Å; F181-Y220 HydrophobicContact CG-CE2 3.55Å; F181-Y220 HydrophobicContact CG-CG 4.43Å; F181-Y220 HydrophobicContact CZ-CD2 4.43Å; F181-F223 HydrophobicContact CE2-CD1 4.41Å; F181-F223 HydrophobicContact CE2-CE1 4.42Å |
| 182 | E | 92.4 | Very high | 96.2 | Very high | 5 Ų | 5 | 61.4 Ų | 61.4 | 2% | 0.023 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -93.2 | -9.9 | -175.3 | -63.9 | -66.8 | 160 | 0 | 0 | 113.4 | F178 W184 A207 L208 K210 Y220 | F178-E182 WeakPolarHBondContact O-CB 3.29Å; F178-E182 PolarHBondContact O-N 3.28Å; E182-W184 HydrophobicContact CB-CD2 3.44Å; E182-W184 VanDerWaalsContact CB-CD2 3.44Å; E182-W184 VanDerWaalsContact CB-CE2 3.47Å; E182-W184 HydrophobicContact CB-CE3 3.82Å; E182-W184 HydrophobicContact CB-CG 3.86Å; E182-W184 HydrophobicContact CB-CH2 4.23Å; E182-W184 HydrophobicContact CB-CZ2 3.89Å; E182-W184 HydrophobicContact CB-CZ3 4.2Å; E182-W184 HydrophobicContact CG-CD2 4.11Å; E182-W184 HydrophobicContact CG-CE3 4.1Å; E182-W184 HydrophobicContact CG-CH2 3.82Å; E182-W184 HydrophobicContact CG-CZ2 3.81Å; E182-W184 HydrophobicContact CG-CZ3 3.96Å; E182-W184 PolarHBondContact O-N 3.04Å; E182-A207 WeakPolarHBondContact OE1-CA 3.4Å; E182-L208 PolarHBondContact OE1-N 3.5Å; E182-K210 PolarHBondContact O-NZ 3.5Å; E182-Y220 VanDerWaalsContact CG-OH 3.31Å; E182-Y220 WeakPolarHBondContact CG-OH 3.09Å; E182-Y220 VanDerWaalsContact OE1-CE1 3.28Å; E182-Y220 WeakPolarHBondContact OE1-CE1 3.46Å; E182-Y220 PolarHBondContact OE1-OH 2.97Å |
| 183 | Q | 93.7 | Very high | 96.2 | Very high | 150 Ų | 150 | 59.7 Ų | 59.7 | 70% | 0.701 | 28% | 0.275 | S | S | * | . | trans | 58 | 36 | -176 | -54.8 | -69.3 | -46.5 | 0 | 0 | 112.3 | H179 R180 | H179-Q183 VanDerWaalsContact O-CA 3.3Å; H179-Q183 WeakPolarHBondContact O-CA 3.35Å; H179-Q183 PolarHBondContact O-N 2.97Å; H179-Q183 VanDerWaalsContact O-N 3.13Å; R180-Q183 PolarHBondContact O-NE2 2.57Å | ||
| 184 | W | 95.4 | Very high | 96.2 | Very high | 31 Ų | 31 | 62 Ų | 62 | 12% | 0.117 | 28% | 0.277 | C | S | . | . | trans | -86.3 | 165.5 | 171 | -62.1 | -31.1 | 0 | 0 | 0 | 110.7 | F178 H179 E182 D188 Y192 Y205 | F178-W184 HydrophobicContact CB-CE3 4.48Å; F178-W184 HydrophobicContact CB-CZ3 4.49Å; H179-W184 PolarHBondContact CE1-O 3.15Å; H179-W184 PolarHBondContact ND1-O 3.34Å; E182-W184 HydrophobicContact CB-CD2 3.44Å; E182-W184 VanDerWaalsContact CB-CD2 3.44Å; E182-W184 VanDerWaalsContact CB-CE2 3.47Å; E182-W184 HydrophobicContact CB-CE3 3.82Å; E182-W184 HydrophobicContact CB-CG 3.86Å; E182-W184 HydrophobicContact CB-CH2 4.23Å; E182-W184 HydrophobicContact CB-CZ2 3.89Å; E182-W184 HydrophobicContact CB-CZ3 4.2Å; E182-W184 HydrophobicContact CG-CD2 4.11Å; E182-W184 HydrophobicContact CG-CE3 4.1Å; E182-W184 HydrophobicContact CG-CH2 3.82Å; E182-W184 HydrophobicContact CG-CZ2 3.81Å; E182-W184 HydrophobicContact CG-CZ3 3.96Å; E182-W184 PolarHBondContact O-N 3.04Å; W184-D188 HydrophobicContact CB-CB 4.23Å; W184-Y192 HydrophobicContact CH2-CD2 4.4Å; W184-Y192 HydrophobicContact CH2-CG 4.35Å; W184-Y192 AromaticContact CZ3-CD1 3.82Å; W184-Y192 HydrophobicContact CZ3-CD1 3.82Å; W184-Y192 HydrophobicContact CZ3-CD2 4.23Å; W184-Y192 HydrophobicContact CZ3-CE1 4.35Å; W184-Y192 AromaticContact CZ3-CG 3.74Å; W184-Y192 HydrophobicContact CZ3-CG 3.74Å; W184-Y205 AromaticContact CD2-CD1 3.72Å; W184-Y205 HydrophobicContact CD2-CD1 3.72Å; W184-Y205 HydrophobicContact CD2-CE1 4.25Å; W184-Y205 AromaticContact CE2-CD1 3.69Å; W184-Y205 HydrophobicContact CE3-CD1 4.04Å; W184-Y205 HydrophobicContact CG-CD1 4.12Å; W184-Y205 HydrophobicContact CG-CE1 4.16Å; W184-Y205 HydrophobicContact CH2-CD1 4.29Å; W184-Y205 HydrophobicContact CZ2-CD1 4.01Å; W184-Y205 HydrophobicContact CZ3-CD1 4.31Å | ||
| 185 | E | 97.1 | Very high | 96.3 | Very high | 136 Ų | 136 | 62.5 Ų | 62.5 | 64% | 0.636 | 28% | 0.279 | S | S | * | . | trans | -64.2 | 154.5 | 167.1 | -62.9 | -164.4 | 161.6 | 0 | 0 | 110.7 | L187 D188 S189 | E185-L187 VanDerWaalsContact C-N 3.26Å; E185-L187 PolarHBondContact O-N 2.85Å; E185-D188 HydrophobicContact CB-CB 4.43Å; E185-D188 PolarHBondContact O-N 2.81Å; E185-S189 WeakPolarHBondContact O-CB 3.39Å; E185-S189 PolarHBondContact O-N 3.48Å; E185-S189 PolarHBondContact O-OG 2.96Å | ||
| 186 | Y | 97.3 | Very high | 96.3 | Very high | 100 Ų | 100 | 62.5 Ų | 62.5 | 39% | 0.392 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.9 | -36.6 | -179.3 | 179.9 | -96.7 | 0 | 0 | 0 | 111.6 | A172 A175 H179 S189 L190 | A172-Y186 PolarHBondContact O-OH 3.43Å; A175-Y186 HydrophobicContact CB-CD2 4.29Å; A175-Y186 HydrophobicContact CB-CE2 3.73Å; H179-Y186 HydrophobicContact CB-CD2 4.48Å; Y186-S189 PolarHBondContact O-N 3.45Å; Y186-L190 WeakPolarHBondContact O-CB 3.43Å; Y186-L190 PolarHBondContact O-N 3.34Å |
| 187 | L | 97.4 | Very high | 96.2 | Very high | 121 Ų | 121 | 56.8 Ų | 56.8 | 63% | 0.634 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -64 | -46.4 | 176.8 | -176.6 | 63 | 0 | 0 | 0 | 111.4 | E185 S189 L190 Y191 | E185-L187 VanDerWaalsContact C-N 3.26Å; E185-L187 PolarHBondContact O-N 2.85Å; L187-S189 VanDerWaalsContact C-N 3.27Å; L187-S189 PolarHBondContact O-N 3.36Å; L187-L190 WeakPolarHBondContact O-CB 3.48Å; L187-L190 PolarHBondContact O-N 2.95Å; L187-L190 VanDerWaalsContact O-N 3.14Å; L187-Y191 WeakPolarHBondContact O-CB 3.13Å; L187-Y191 PolarHBondContact O-N 2.93Å |
| 188 | D | 97.3 | Very high | 96.1 | Very high | 40 Ų | 40 | 58.3 Ų | 58.3 | 21% | 0.214 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.9 | -39.9 | 174.8 | -67.5 | -2.1 | 0 | 0 | 0 | 111.9 | W184 E185 L190 Y191 Y192 Y205 | W184-D188 HydrophobicContact CB-CB 4.23Å; E185-D188 HydrophobicContact CB-CB 4.43Å; E185-D188 PolarHBondContact O-N 2.81Å; D188-L190 VanDerWaalsContact C-N 3.34Å; D188-Y191 PolarHBondContact O-N 3.35Å; D188-Y192 WeakPolarHBondContact O-CB 3.39Å; D188-Y192 PolarHBondContact O-N 3.13Å; D188-Y205 HydrophobicContact CB-CD1 4.34Å; D188-Y205 HydrophobicContact CB-CE1 3.65Å; D188-Y205 PolarHBondContact OD2-OH 2.95Å |
| 189 | S | 97.5 | Very high | 96.1 | Very high | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -66.6 | -38 | 176.9 | -55.3 | 0 | 0 | 0 | 0 | 111.7 | A175 H179 E185 Y186 L187 C193 | A175-S189 WeakPolarHBondContact O-CB 3.33Å; H179-S189 VanDerWaalsContact CA-OG 3.3Å; H179-S189 WeakPolarHBondContact CA-OG 3.48Å; H179-S189 PolarHBondContact N-OG 2.84Å; E185-S189 WeakPolarHBondContact O-CB 3.39Å; E185-S189 PolarHBondContact O-N 3.48Å; E185-S189 PolarHBondContact O-OG 2.96Å; Y186-S189 PolarHBondContact O-N 3.45Å; L187-S189 VanDerWaalsContact C-N 3.27Å; L187-S189 PolarHBondContact O-N 3.36Å; S189-C193 PolarHBondContact O-N 3.48Å; S189-C193 PolarHBondContact O-SG 3.46Å |
| 190 | L | 97.6 | Very high | 96.2 | Very high | 59 Ų | 59 | 61.8 Ų | 61.8 | 31% | 0.309 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -67.1 | -44.3 | 174.6 | -173.9 | 71.6 | 0 | 0 | 0 | 111.2 | M171 A175 Y186 L187 D188 C193 F194 | M171-L190 HydrophobicContact CG-CD1 3.7Å; A175-L190 HydrophobicContact CB-CB 3.95Å; A175-L190 HydrophobicContact CB-CD1 3.94Å; Y186-L190 WeakPolarHBondContact O-CB 3.43Å; Y186-L190 PolarHBondContact O-N 3.34Å; L187-L190 WeakPolarHBondContact O-CB 3.48Å; L187-L190 PolarHBondContact O-N 2.95Å; L187-L190 VanDerWaalsContact O-N 3.14Å; D188-L190 VanDerWaalsContact C-N 3.34Å; L190-C193 PolarHBondContact O-N 3.43Å; L190-F194 WeakPolarHBondContact O-CB 3.47Å; L190-F194 PolarHBondContact O-N 2.86Å |
| 191 | Y | 97.6 | Very high | 96.2 | Very high | 80 Ų | 80 | 55 Ų | 55 | 31% | 0.314 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -58.6 | -48.8 | 174.1 | 166.3 | -98.6 | 0 | 0 | 0 | 111.3 | L187 D188 C193 F194 I195 F202 D204 Y205 | L187-Y191 WeakPolarHBondContact O-CB 3.13Å; L187-Y191 PolarHBondContact O-N 2.93Å; D188-Y191 PolarHBondContact O-N 3.35Å; Y191-C193 PolarHBondContact O-N 3Å; Y191-F194 PolarHBondContact O-N 3.21Å; Y191-F194 VanDerWaalsContact O-N 3.15Å; Y191-I195 HydrophobicContact CD2-CG1 3.85Å; Y191-I195 HydrophobicContact CE1-CG1 4.28Å; Y191-I195 HydrophobicContact CE2-CD1 3.99Å; Y191-I195 HydrophobicContact CE2-CG1 3.48Å; Y191-I195 VanDerWaalsContact CE2-CG1 3.48Å; Y191-I195 HydrophobicContact CG-CG1 4.4Å; Y191-I195 WeakPolarHBondContact O-CB 3.48Å; Y191-I195 WeakPolarHBondContact O-CG1 3.47Å; Y191-I195 PolarHBondContact O-N 3.06Å; Y191-F202 WeakPolarHBondContact OH-CD2 3.5Å; Y191-D204 WeakPolarHBondContact CE1-OD2 2.98Å; Y191-D204 VanDerWaalsContact CZ-OD2 3.26Å; Y191-D204 PolarHBondContact OH-OD2 3.41Å; Y191-Y205 HydrophobicContact CD1-CD2 4.08Å; Y191-Y205 HydrophobicContact CD1-CE2 4.45Å; Y191-Y205 AromaticContact CE1-CD2 3.95Å; Y191-Y205 HydrophobicContact CE1-CD2 3.95Å; Y191-Y205 HydrophobicContact CE1-CE2 4.42Å |
| 192 | Y | 97.5 | Very high | 96.4 | Very high | 3 Ų | 3 | 55.8 Ų | 55.8 | 1% | 0.012 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -54.8 | -49.1 | 174.2 | 163.9 | -106 | 0 | 0 | 0 | 111.8 | Y96 F178 W184 D188 F194 T196 Y205 A207 | Y96-Y192 HydrophobicContact CE1-CE2 4.11Å; Y96-Y192 PolarHBondContact OH-OH 3.35Å; F178-Y192 HydrophobicContact CD1-CD1 4.49Å; F178-Y192 AromaticContact CD1-CE1 3.91Å; F178-Y192 HydrophobicContact CD1-CE1 3.91Å; F178-Y192 AromaticContact CD2-CD1 3.98Å; F178-Y192 HydrophobicContact CD2-CD1 3.98Å; F178-Y192 AromaticContact CD2-CE1 3.74Å; F178-Y192 HydrophobicContact CD2-CE1 3.74Å; F178-Y192 AromaticContact CE1-CE1 3.86Å; F178-Y192 HydrophobicContact CE1-CE1 3.86Å; F178-Y192 HydrophobicContact CE2-CD1 4.35Å; F178-Y192 AromaticContact CE2-CE1 3.71Å; F178-Y192 HydrophobicContact CE2-CE1 3.71Å; F178-Y192 HydrophobicContact CG-CD1 4.08Å; F178-Y192 AromaticContact CG-CE1 3.86Å; F178-Y192 HydrophobicContact CG-CE1 3.86Å; F178-Y192 AromaticContact CZ-CE1 3.77Å; F178-Y192 HydrophobicContact CZ-CE1 3.77Å; W184-Y192 HydrophobicContact CH2-CD2 4.4Å; W184-Y192 HydrophobicContact CH2-CG 4.35Å; W184-Y192 AromaticContact CZ3-CD1 3.82Å; W184-Y192 HydrophobicContact CZ3-CD1 3.82Å; W184-Y192 HydrophobicContact CZ3-CD2 4.23Å; W184-Y192 HydrophobicContact CZ3-CE1 4.35Å; W184-Y192 AromaticContact CZ3-CG 3.74Å; W184-Y192 HydrophobicContact CZ3-CG 3.74Å; D188-Y192 WeakPolarHBondContact O-CB 3.39Å; D188-Y192 PolarHBondContact O-N 3.13Å; Y192-F194 VanDerWaalsContact C-N 3.32Å; Y192-F194 PolarHBondContact O-N 2.83Å; Y192-T196 VanDerWaalsContact CE2-OG1 3.29Å; Y192-T196 WeakPolarHBondContact CE2-OG1 3.5Å; Y192-T196 WeakPolarHBondContact O-CB 3.29Å; Y192-T196 PolarHBondContact O-N 3.43Å; Y192-T196 PolarHBondContact O-OG1 2.82Å; Y192-Y205 VanDerWaalsContact CD2-O 3.24Å; Y192-Y205 WeakPolarHBondContact CD2-O 3.32Å; Y192-A207 HydrophobicContact CE1-CB 4.26Å; Y192-A207 VanDerWaalsContact OH-CB 3.32Å; Y192-A207 WeakPolarHBondContact OH-CB 3.25Å |
| 193 | C | 97.3 | Very high | 96.5 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.9 | -40.9 | 179.3 | -65.2 | 0 | 0 | 0 | 0 | 111.2 | M171 F178 S189 L190 Y191 T196 L197 F227 | M171-C193 HydrophobicContact CG-CB 4.27Å; M171-C193 HydrophobicContact SD-CB 3.21Å; M171-C193 WeakPolarHBondContact SD-CB 3.26Å; F178-C193 VanDerWaalsContact CD2-SG 3.51Å; S189-C193 PolarHBondContact O-N 3.48Å; S189-C193 PolarHBondContact O-SG 3.46Å; L190-C193 PolarHBondContact O-N 3.43Å; Y191-C193 PolarHBondContact O-N 3Å; C193-T196 PolarHBondContact O-N 2.72Å; C193-L197 WeakPolarHBondContact O-CB 3.23Å; C193-L197 VanDerWaalsContact O-CG 3.28Å; C193-L197 WeakPolarHBondContact O-CG 3.41Å; C193-L197 PolarHBondContact O-N 3.31Å; C193-F227 HydrophobicContact CB-CE1 4.43Å; C193-F227 HydrophobicContact CB-CZ 4.27Å |
| 194 | F | 96.6 | Very high | 96.5 | Very high | 110 Ų | 110 | 53.7 Ų | 53.7 | 48% | 0.482 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -64.6 | -52.8 | 179.6 | -176.5 | -93.1 | 0 | 0 | 0 | 111.9 | M171 L190 Y191 Y192 T196 L197 T198 | M171-F194 HydrophobicContact CE-CB 4.45Å; M171-F194 HydrophobicContact CE-CD2 4.36Å; M171-F194 HydrophobicContact SD-CB 4.36Å; M171-F194 PolarHBondContact SD-N 2.9Å; M171-F194 VanDerWaalsContact SD-N 3.37Å; L190-F194 WeakPolarHBondContact O-CB 3.47Å; L190-F194 PolarHBondContact O-N 2.86Å; Y191-F194 PolarHBondContact O-N 3.21Å; Y191-F194 VanDerWaalsContact O-N 3.15Å; Y192-F194 VanDerWaalsContact C-N 3.32Å; Y192-F194 PolarHBondContact O-N 2.83Å; F194-T196 VanDerWaalsContact C-N 3.26Å; F194-T196 PolarHBondContact O-N 2.86Å; F194-L197 PolarHBondContact O-N 2.72Å; F194-T198 HydrophobicContact CD1-CG2 4.37Å; F194-T198 HydrophobicContact CD2-CG2 4.45Å; F194-T198 HydrophobicContact CE1-CG2 4.07Å; F194-T198 HydrophobicContact CE2-CG2 4.16Å; F194-T198 HydrophobicContact CZ-CG2 3.96Å; F194-T198 WeakPolarHBondContact O-CB 3.33Å; F194-T198 VanDerWaalsContact O-CG2 3.31Å; F194-T198 WeakPolarHBondContact O-CG2 3.33Å; F194-T198 PolarHBondContact O-N 3.44Å; F194-T198 PolarHBondContact O-OG1 2.9Å |
| 195 | I | 97.1 | Very high | 96.5 | Very high | 11 Ų | 11 | 55.3 Ų | 55.3 | 6% | 0.056 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.8 | -33.5 | 179 | -66.5 | -56.1 | 0 | 0 | 0 | 111.8 | Y191 T198 I200 G201 F202 | Y191-I195 HydrophobicContact CD2-CG1 3.85Å; Y191-I195 HydrophobicContact CE1-CG1 4.28Å; Y191-I195 HydrophobicContact CE2-CD1 3.99Å; Y191-I195 HydrophobicContact CE2-CG1 3.48Å; Y191-I195 VanDerWaalsContact CE2-CG1 3.48Å; Y191-I195 HydrophobicContact CG-CG1 4.4Å; Y191-I195 WeakPolarHBondContact O-CB 3.48Å; Y191-I195 WeakPolarHBondContact O-CG1 3.47Å; Y191-I195 PolarHBondContact O-N 3.06Å; I195-T198 WeakPolarHBondContact CA-OG1 3.43Å; I195-T198 PolarHBondContact O-OG1 3.15Å; I195-I200 HydrophobicContact CD1-CB 4.36Å; I195-I200 HydrophobicContact CD1-CD1 3.88Å; I195-I200 HydrophobicContact CD1-CG2 4.34Å; I195-I200 HydrophobicContact CG2-CB 4.04Å; I195-I200 HydrophobicContact CG2-CG2 4.16Å; I195-I200 PolarHBondContact O-N 3.13Å; I195-G201 PolarHBondContact O-N 3.3Å; I195-F202 HydrophobicContact CD1-CD2 3.96Å; I195-F202 HydrophobicContact CD1-CE2 3.66Å; I195-F202 HydrophobicContact CG1-CD2 4.14Å; I195-F202 HydrophobicContact CG1-CE2 4.33Å; I195-F202 HydrophobicContact CG2-CB 4.39Å; I195-F202 HydrophobicContact CG2-CD2 3.74Å; I195-F202 HydrophobicContact CG2-CE2 4.44Å; I195-F202 HydrophobicContact CG2-CG 4.28Å |
| 196 | T | 97.1 | Very high | 96.3 | Very high | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -69.2 | -52.8 | 175.2 | -65.7 | 0 | 0 | 0 | 0 | 112 | I94 Y96 Y192 C193 F194 T198 T199 I228 | I94-T196 HydrophobicContact CD1-CG2 4.11Å; Y96-T196 WeakPolarHBondContact OH-CB 3.34Å; Y96-T196 WeakPolarHBondContact OH-CG2 3.34Å; Y96-T196 PolarHBondContact OH-OG1 2.91Å; Y192-T196 VanDerWaalsContact CE2-OG1 3.29Å; Y192-T196 WeakPolarHBondContact CE2-OG1 3.5Å; Y192-T196 WeakPolarHBondContact O-CB 3.29Å; Y192-T196 PolarHBondContact O-N 3.43Å; Y192-T196 PolarHBondContact O-OG1 2.82Å; C193-T196 PolarHBondContact O-N 2.72Å; F194-T196 VanDerWaalsContact C-N 3.26Å; F194-T196 PolarHBondContact O-N 2.86Å; T196-T198 VanDerWaalsContact C-N 3.3Å; T196-T198 PolarHBondContact O-N 3.5Å; T196-T199 PolarHBondContact O-N 3.04Å; T196-I228 HydrophobicContact CG2-CD1 4.4Å; T196-I228 HydrophobicContact CG2-CG1 3.95Å |
| 197 | L | 95.6 | Very high | 96.1 | Very high | 4 Ų | 4 | 44.5 Ų | 44.5 | 2% | 0.021 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -77.2 | -16.5 | -174 | -63.9 | -174.4 | 0 | 0 | 0 | 113.4 | M171 C193 F194 T199 F227 L232 V235 | M171-L197 HydrophobicContact CE-CB 4.08Å; M171-L197 HydrophobicContact CE-CD1 3.72Å; M171-L197 HydrophobicContact CE-CG 4.34Å; M171-L197 HydrophobicContact SD-CD1 4.02Å; C193-L197 WeakPolarHBondContact O-CB 3.23Å; C193-L197 VanDerWaalsContact O-CG 3.28Å; C193-L197 WeakPolarHBondContact O-CG 3.41Å; C193-L197 PolarHBondContact O-N 3.31Å; F194-L197 PolarHBondContact O-N 2.72Å; L197-T199 VanDerWaalsContact C-N 3.28Å; L197-F227 HydrophobicContact CD1-CE1 4.24Å; L197-F227 HydrophobicContact CD1-CZ 4.03Å; L197-F227 HydrophobicContact CD2-CE1 4.35Å; L197-F227 HydrophobicContact CG-CE1 4.4Å; L197-L232 HydrophobicContact CD2-CG 4.35Å; L197-L232 WeakPolarHBondContact O-CD2 3.38Å; L197-V235 HydrophobicContact CB-CG2 4.16Å |
| 198 | T | 94.2 | Very high | 95.8 | Very high | 48 Ų | 48 | 38.8 Ų | 38.8 | 29% | 0.294 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.3 | 1.9 | 167.7 | 54.2 | 0 | 0 | 0 | 0 | 113 | F194 I195 T196 I200 | F194-T198 HydrophobicContact CD1-CG2 4.37Å; F194-T198 HydrophobicContact CD2-CG2 4.45Å; F194-T198 HydrophobicContact CE1-CG2 4.07Å; F194-T198 HydrophobicContact CE2-CG2 4.16Å; F194-T198 HydrophobicContact CZ-CG2 3.96Å; F194-T198 WeakPolarHBondContact O-CB 3.33Å; F194-T198 VanDerWaalsContact O-CG2 3.31Å; F194-T198 WeakPolarHBondContact O-CG2 3.33Å; F194-T198 PolarHBondContact O-N 3.44Å; F194-T198 PolarHBondContact O-OG1 2.9Å; I195-T198 WeakPolarHBondContact CA-OG1 3.43Å; I195-T198 PolarHBondContact O-OG1 3.15Å; T196-T198 VanDerWaalsContact C-N 3.3Å; T196-T198 PolarHBondContact O-N 3.5Å; T198-I200 PolarHBondContact O-N 3.04Å; T198-I200 WeakPolarHBondContact OG1-CD1 3.26Å |
| 199 | T | 96 | Very high | 95.3 | Very high | 53 Ų | 53 | 38.6 Ų | 38.6 | 33% | 0.325 | 19% | 0.193 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 59.2 | 22.6 | -179.1 | 66.7 | 0 | 0 | 0 | 0 | 114.4 | T92 I94 T196 L197 L232 | T92-T199 VanDerWaalsContact O-CG2 3.29Å; T92-T199 WeakPolarHBondContact O-CG2 3.47Å; I94-T199 HydrophobicContact CG1-CG2 4.22Å; T196-T199 PolarHBondContact O-N 3.04Å; L197-T199 VanDerWaalsContact C-N 3.28Å; T199-L232 HydrophobicContact CG2-CD2 3.51Å |
| 200 | I | 97 | Very high | 94.6 | Very high | 84 Ų | 84 | 43 Ų | 43 | 43% | 0.431 | 21% | 0.212 | S | C | . | . | trans | -75.3 | -49.1 | 174 | -64.3 | 171.4 | 0 | 0 | 0 | 109.7 | I195 T198 F202 | I195-I200 HydrophobicContact CD1-CB 4.36Å; I195-I200 HydrophobicContact CD1-CD1 3.88Å; I195-I200 HydrophobicContact CD1-CG2 4.34Å; I195-I200 HydrophobicContact CG2-CB 4.04Å; I195-I200 HydrophobicContact CG2-CG2 4.16Å; I195-I200 PolarHBondContact O-N 3.13Å; T198-I200 PolarHBondContact O-N 3.04Å; T198-I200 WeakPolarHBondContact OG1-CD1 3.26Å; I200-F202 HydrophobicContact CG2-CD1 3.91Å; I200-F202 HydrophobicContact CG2-CD2 3.92Å; I200-F202 HydrophobicContact CG2-CE1 3.57Å; I200-F202 HydrophobicContact CG2-CE2 3.6Å; I200-F202 HydrophobicContact CG2-CG 4.08Å; I200-F202 HydrophobicContact CG2-CZ 3.41Å; I200-F202 VanDerWaalsContact CG2-CZ 3.41Å; I200-F202 PolarHBondContact O-N 2.89Å | ||
| 201 | G | 96.1 | Very high | 93.7 | Very high | 4 Ų | 4 | 46.8 Ų | 46.8 | 4% | 0.041 | 23% | 0.233 | C | C | . | . | trans | 53.5 | 55 | 170.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | I94 Y96 I195 G203 | I94-G201 WeakPolarHBondContact O-CA 3.46Å; Y96-G201 VanDerWaalsContact CA-O 3.32Å; Y96-G201 WeakPolarHBondContact CA-O 3.32Å; I195-G201 PolarHBondContact O-N 3.3Å; G201-G203 PolarHBondContact O-N 3.39Å | ||
| 202 | F | 95.9 | Very high | 92.8 | Very high | 132 Ų | 132 | 43.4 Ų | 43.4 | 58% | 0.579 | 22% | 0.223 | S | C | * | . | trans | -56.1 | -34.4 | 178.6 | -66.8 | -55.2 | 0 | 0 | 0 | 114.3 | Y191 I195 I200 | Y191-F202 WeakPolarHBondContact OH-CD2 3.5Å; I195-F202 HydrophobicContact CD1-CD2 3.96Å; I195-F202 HydrophobicContact CD1-CE2 3.66Å; I195-F202 HydrophobicContact CG1-CD2 4.14Å; I195-F202 HydrophobicContact CG1-CE2 4.33Å; I195-F202 HydrophobicContact CG2-CB 4.39Å; I195-F202 HydrophobicContact CG2-CD2 3.74Å; I195-F202 HydrophobicContact CG2-CE2 4.44Å; I195-F202 HydrophobicContact CG2-CG 4.28Å; I200-F202 HydrophobicContact CG2-CD1 3.91Å; I200-F202 HydrophobicContact CG2-CD2 3.92Å; I200-F202 HydrophobicContact CG2-CE1 3.57Å; I200-F202 HydrophobicContact CG2-CE2 3.6Å; I200-F202 HydrophobicContact CG2-CG 4.08Å; I200-F202 HydrophobicContact CG2-CZ 3.41Å; I200-F202 VanDerWaalsContact CG2-CZ 3.41Å; I200-F202 PolarHBondContact O-N 2.89Å | ||
| 203 | G | 94.2 | Very high | 92.2 | Very high | 23 Ų | 23 | 43.6 Ų | 43.6 | 24% | 0.237 | 23% | 0.225 | C | C | . | . | S | Bend | trans | 83.9 | 8.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y96 G201 V206 | Y96-G203 VanDerWaalsContact O-CA 3.28Å; Y96-G203 WeakPolarHBondContact O-CA 3.35Å; G201-G203 PolarHBondContact O-N 3.39Å; G203-V206 WeakPolarHBondContact O-CG2 3.15Å |
| 204 | D | 94 | Very high | 91.5 | Very high | 88 Ų | 88 | 43.9 Ų | 43.9 | 47% | 0.471 | 23% | 0.227 | S | C | . | . | S | Bend | trans | -62.9 | -41.2 | 166.1 | 52.3 | -10.9 | 0 | 0 | 0 | 112.1 | Y191 | Y191-D204 WeakPolarHBondContact CE1-OD2 2.98Å; Y191-D204 VanDerWaalsContact CZ-OD2 3.26Å; Y191-D204 PolarHBondContact OH-OD2 3.41Å |
| 205 | Y | 95.1 | Very high | 90.8 | Very high | 65 Ų | 65 | 42.3 Ų | 42.3 | 26% | 0.255 | 22% | 0.221 | S | C | . | . | S | Bend | trans | -115.1 | 125.8 | 168.3 | -70.1 | -99.2 | 0 | 0 | 0 | 110.1 | W184 D188 Y191 Y192 | W184-Y205 AromaticContact CD2-CD1 3.72Å; W184-Y205 HydrophobicContact CD2-CD1 3.72Å; W184-Y205 HydrophobicContact CD2-CE1 4.25Å; W184-Y205 AromaticContact CE2-CD1 3.69Å; W184-Y205 HydrophobicContact CE3-CD1 4.04Å; W184-Y205 HydrophobicContact CG-CD1 4.12Å; W184-Y205 HydrophobicContact CG-CE1 4.16Å; W184-Y205 HydrophobicContact CH2-CD1 4.29Å; W184-Y205 HydrophobicContact CZ2-CD1 4.01Å; W184-Y205 HydrophobicContact CZ3-CD1 4.31Å; D188-Y205 HydrophobicContact CB-CD1 4.34Å; D188-Y205 HydrophobicContact CB-CE1 3.65Å; D188-Y205 PolarHBondContact OD2-OH 2.95Å; Y191-Y205 HydrophobicContact CD1-CD2 4.08Å; Y191-Y205 HydrophobicContact CD1-CE2 4.45Å; Y191-Y205 AromaticContact CE1-CD2 3.95Å; Y191-Y205 HydrophobicContact CE1-CD2 3.95Å; Y191-Y205 HydrophobicContact CE1-CE2 4.42Å; Y192-Y205 VanDerWaalsContact CD2-O 3.24Å; Y192-Y205 WeakPolarHBondContact CD2-O 3.32Å |
| 206 | V | 94.1 | Very high | 90.3 | Very high | 10 Ų | 10 | 48.2 Ų | 48.2 | 6% | 0.061 | 25% | 0.248 | C | C | . | . | trans | -140.2 | 123 | 178.1 | -173.9 | 0 | 0 | 0 | 0 | 109 | Y85 Y96 H98 G203 Q209 | Y85-V206 HydrophobicContact CE1-CG1 4.13Å; Y96-V206 HydrophobicContact CD1-CG2 4.1Å; Y96-V206 HydrophobicContact CD2-CG1 4.15Å; Y96-V206 HydrophobicContact CE2-CG1 4.5Å; Y96-V206 HydrophobicContact CG-CG1 4.37Å; Y96-V206 HydrophobicContact CG-CG2 4Å; H98-V206 HydrophobicContact CB-CG2 4.2Å; G203-V206 WeakPolarHBondContact O-CG2 3.15Å; V206-Q209 HydrophobicContact CB-CG 3.83Å; V206-Q209 HydrophobicContact CG1-CG 3.89Å; V206-Q209 WeakPolarHBondContact O-CG 3.28Å | ||
| 207 | A | 92.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | 160.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | F178 E182 Y192 Q209 | F178-A207 HydrophobicContact CD1-CB 3.95Å; F178-A207 HydrophobicContact CE1-CB 3.62Å; E182-A207 WeakPolarHBondContact OE1-CA 3.4Å; Y192-A207 HydrophobicContact CE1-CB 4.26Å; Y192-A207 VanDerWaalsContact OH-CB 3.32Å; Y192-A207 WeakPolarHBondContact OH-CB 3.25Å; A207-Q209 PolarHBondContact O-N 2.88Å |
| 208 | L | 90.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 56.4 Ų | 56.4 | 0% | 0 | 30% | 0.297 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 70.4 | 9.7 | 176.1 | -46.1 | 164.9 | 0 | 0 | 0 | 114.4 | Y85 E182 L214 Y220 V221 | Y85-L208 HydrophobicContact CD2-CD1 4.09Å; Y85-L208 HydrophobicContact CE2-CD1 4.07Å; E182-L208 PolarHBondContact OE1-N 3.5Å; L208-L214 HydrophobicContact CB-CD1 3.46Å; L208-L214 VanDerWaalsContact CB-CD1 3.46Å; L208-L214 WeakPolarHBondContact O-CD1 3.29Å; L208-Y220 HydrophobicContact CD2-CD1 3.3Å; L208-Y220 HydrophobicContact CD2-CD2 4.47Å; L208-Y220 HydrophobicContact CD2-CE1 3.39Å; L208-Y220 HydrophobicContact CD2-CG 3.87Å; L208-Y220 HydrophobicContact CG-CE1 4.27Å; L208-V221 HydrophobicContact CD1-CG1 4.43Å; L208-V221 HydrophobicContact CD1-CG2 4.32Å; L208-V221 HydrophobicContact CD2-CB 4.41Å; L208-V221 HydrophobicContact CD2-CG2 3.91Å |
| 209 | Q | 87.2 | Confident | 89.5 | Confident | 36 Ų | 36 | 63 Ų | 63 | 17% | 0.168 | 32% | 0.321 | C | S | . | . | trans | -88.2 | -17.3 | -179 | -63.8 | -57.8 | -66.4 | 0 | 0 | 114.2 | A74 H98 V206 A207 | A74-Q209 VanDerWaalsContact CA-O 3.27Å; A74-Q209 WeakPolarHBondContact CA-O 3.44Å; A74-Q209 HydrophobicContact CB-CB 4.12Å; A74-Q209 VanDerWaalsContact CB-O 3.23Å; A74-Q209 WeakPolarHBondContact CB-O 3.5Å; H98-Q209 PolarHBondContact CD2-NE2 3.34Å; H98-Q209 VanDerWaalsContact CD2-NE2 3.3Å; V206-Q209 HydrophobicContact CB-CG 3.83Å; V206-Q209 HydrophobicContact CG1-CG 3.89Å; V206-Q209 WeakPolarHBondContact O-CG 3.28Å; A207-Q209 PolarHBondContact O-N 2.88Å | ||
| 210 | K | 83.8 | Confident | 89.3 | Confident | 92 Ų | 92 | 61.2 Ų | 61.2 | 40% | 0.4 | 31% | 0.309 | S | S | . | . | S | Bend | trans | -86.3 | 144.3 | -179.3 | -66.9 | -177.3 | 179.1 | 178.2 | 0 | 112.2 | E182 G212 A213 | E182-K210 PolarHBondContact O-NZ 3.5Å; K210-G212 PolarHBondContact O-N 2.82Å; K210-A213 VanDerWaalsContact O-CB 3.29Å; K210-A213 WeakPolarHBondContact O-CB 3.24Å; K210-A213 PolarHBondContact O-N 2.82Å |
| 211 | D | 78.4 | Confident | 89 | Confident | 139 Ų | 139 | 57.8 Ų | 57.8 | 74% | 0.743 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 24.4 | 168.9 | -53.1 | -43.5 | 0 | 0 | 0 | 116.6 | A213 Q216 | D211-A213 VanDerWaalsContact C-N 3.28Å; D211-A213 PolarHBondContact O-N 3.38Å; D211-Q216 PolarHBondContact O-NE2 2.62Å |
| 212 | G | 79.1 | Confident | 88.9 | Confident | 10 Ų | 10 | 59.7 Ų | 59.7 | 10% | 0.103 | 31% | 0.307 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 64.9 | 32.5 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113 | K210 L214 Q215 Q216 | K210-G212 PolarHBondContact O-N 2.82Å; G212-L214 PolarHBondContact O-N 3.42Å; G212-Q215 PolarHBondContact O-N 3.09Å; G212-Q215 PolarHBondContact O-OE1 2.84Å; G212-Q215 VanDerWaalsContact O-OE1 3.07Å; G212-Q216 PolarHBondContact O-N 3.43Å |
| 213 | A | 84 | Confident | 88.8 | Confident | 7 Ų | 7 | 57 Ų | 57 | 6% | 0.058 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -51.5 | -31.4 | 180 | 0 | 0 | 0 | 0 | 0 | 113.4 | K210 D211 Q215 N217 Y220 | K210-A213 VanDerWaalsContact O-CB 3.29Å; K210-A213 WeakPolarHBondContact O-CB 3.24Å; K210-A213 PolarHBondContact O-N 2.82Å; D211-A213 VanDerWaalsContact C-N 3.28Å; D211-A213 PolarHBondContact O-N 3.38Å; A213-Q215 PolarHBondContact O-N 3.46Å; A213-N217 PolarHBondContact O-N 3.4Å; A213-Y220 HydrophobicContact CB-CD1 4.33Å |
| 214 | L | 83.5 | Confident | 88.8 | Confident | 6 Ų | 6 | 55.9 Ų | 55.9 | 3% | 0.031 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -53 | -37.5 | 174.3 | -98.9 | 76 | 0 | 0 | 0 | 113.5 | L208 G212 | L208-L214 HydrophobicContact CB-CD1 3.46Å; L208-L214 VanDerWaalsContact CB-CD1 3.46Å; L208-L214 WeakPolarHBondContact O-CD1 3.29Å; G212-L214 PolarHBondContact O-N 3.42Å |
| 215 | Q | 82.2 | Confident | 88.8 | Confident | 77 Ų | 77 | 52.5 Ų | 52.5 | 36% | 0.36 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -100.7 | -36.4 | -178 | -56.4 | 83.8 | 20.7 | 0 | 0 | 112 | Y76 G212 A213 | Y76-Q215 PolarHBondContact O-NE2 3.46Å; G212-Q215 PolarHBondContact O-N 3.09Å; G212-Q215 PolarHBondContact O-OE1 2.84Å; G212-Q215 VanDerWaalsContact O-OE1 3.07Å; A213-Q215 PolarHBondContact O-N 3.46Å |
| 216 | Q | 85.8 | Confident | 88.8 | Confident | 135 Ų | 135 | 55 Ų | 55 | 63% | 0.631 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -82.5 | -30.6 | -171.6 | -61.9 | -174.7 | 27.8 | 0 | 0 | 112.9 | D211 G212 P218 | D211-Q216 PolarHBondContact O-NE2 2.62Å; G212-Q216 PolarHBondContact O-N 3.43Å; Q216-P218 WeakPolarHBondContact O-CD 3.11Å |
| 217 | N | 88.6 | Confident | 88.9 | Confident | 85 Ų | 85 | 55.1 Ų | 55.1 | 46% | 0.455 | 28% | 0.282 | S | S | . | . | trans | -125.4 | 69.3 | -169.5 | -68 | -35.7 | 0 | 0 | 0 | 112.5 | A213 K219 Y220 V221 | A213-N217 PolarHBondContact O-N 3.4Å; N217-K219 PolarHBondContact O-N 3.46Å; N217-K219 VanDerWaalsContact O-N 3.15Å; N217-Y220 PolarHBondContact O-N 3.04Å; N217-V221 PolarHBondContact O-N 3.08Å; N217-V221 VanDerWaalsContact O-N 3.1Å | ||
| 218 | P | 88.6 | Confident | 89 | Confident | 90 Ų | 90 | 55.1 Ų | 55.1 | 58% | 0.584 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -60.4 | -29.5 | -178.2 | 24.4 | -34.6 | 0 | 0 | 0 | 113.4 | Q216 V221 A222 | Q216-P218 WeakPolarHBondContact O-CD 3.11Å; P218-V221 PolarHBondContact O-N 3.33Å; P218-A222 WeakPolarHBondContact O-CB 3.41Å; P218-A222 PolarHBondContact O-N 3.04Å |
| 219 | K | 91.6 | Very high | 89.2 | Confident | 188 Ų | 188 | 58.2 Ų | 58.2 | 82% | 0.817 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -63.3 | -41.1 | 174.3 | -65.5 | -178.1 | -177.7 | 176.8 | 0 | 112 | N217 A222 F223 | N217-K219 PolarHBondContact O-N 3.46Å; N217-K219 VanDerWaalsContact O-N 3.15Å; K219-A222 PolarHBondContact O-N 3.37Å; K219-F223 WeakPolarHBondContact O-CB 3.37Å; K219-F223 PolarHBondContact O-N 3.39Å |
| 220 | Y | 92.5 | Very high | 89.6 | Confident | 14 Ų | 14 | 61.2 Ų | 61.2 | 6% | 0.055 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -70.6 | -41.9 | 178.3 | 179.7 | -138.3 | 0 | 0 | 0 | 110.8 | F178 F181 E182 L208 A213 N217 A222 F223 S224 | F178-Y220 HydrophobicContact CD1-CE2 4.43Å; F178-Y220 WeakPolarHBondContact CD1-OH 3.32Å; F178-Y220 HydrophobicContact CE1-CE2 4.24Å; F181-Y220 HydrophobicContact CB-CD2 4.18Å; F181-Y220 HydrophobicContact CB-CE1 4.18Å; F181-Y220 HydrophobicContact CB-CE2 3.56Å; F181-Y220 AromaticContact CD1-CD2 3.95Å; F181-Y220 HydrophobicContact CD1-CD2 3.95Å; F181-Y220 HydrophobicContact CD1-CE2 4.2Å; F181-Y220 HydrophobicContact CD1-CG 4.28Å; F181-Y220 AromaticContact CD2-CD2 3.87Å; F181-Y220 HydrophobicContact CD2-CD2 3.87Å; F181-Y220 AromaticContact CD2-CE2 3.66Å; F181-Y220 HydrophobicContact CD2-CE2 3.66Å; F181-Y220 HydrophobicContact CE1-CD2 4.29Å; F181-Y220 HydrophobicContact CE2-CD2 4.23Å; F181-Y220 HydrophobicContact CE2-CE2 4.42Å; F181-Y220 AromaticContact CG-CD2 3.74Å; F181-Y220 HydrophobicContact CG-CD2 3.74Å; F181-Y220 AromaticContact CG-CE2 3.55Å; F181-Y220 HydrophobicContact CG-CE2 3.55Å; F181-Y220 HydrophobicContact CG-CG 4.43Å; F181-Y220 HydrophobicContact CZ-CD2 4.43Å; E182-Y220 VanDerWaalsContact CG-OH 3.31Å; E182-Y220 WeakPolarHBondContact CG-OH 3.09Å; E182-Y220 VanDerWaalsContact OE1-CE1 3.28Å; E182-Y220 WeakPolarHBondContact OE1-CE1 3.46Å; E182-Y220 PolarHBondContact OE1-OH 2.97Å; L208-Y220 HydrophobicContact CD2-CD1 3.3Å; L208-Y220 HydrophobicContact CD2-CD2 4.47Å; L208-Y220 HydrophobicContact CD2-CE1 3.39Å; L208-Y220 HydrophobicContact CD2-CG 3.87Å; L208-Y220 HydrophobicContact CG-CE1 4.27Å; A213-Y220 HydrophobicContact CB-CD1 4.33Å; N217-Y220 PolarHBondContact O-N 3.04Å; Y220-A222 VanDerWaalsContact C-N 3.33Å; Y220-A222 PolarHBondContact O-N 2.99Å; Y220-F223 HydrophobicContact CD2-CD1 4.09Å; Y220-F223 HydrophobicContact CE2-CD1 4.15Å; Y220-F223 WeakPolarHBondContact O-CB 3.32Å; Y220-F223 PolarHBondContact O-N 3.09Å; Y220-S224 WeakPolarHBondContact CE2-OG 3.41Å; Y220-S224 PolarHBondContact O-N 3.16Å; Y220-S224 PolarHBondContact O-OG 2.78Å; Y220-S224 VanDerWaalsContact O-OG 3.09Å |
| 221 | V | 92 | Very high | 90.1 | Very high | 12 Ų | 12 | 56.9 Ų | 56.9 | 7% | 0.073 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -54.7 | -48.5 | 172.3 | 177.6 | 0 | 0 | 0 | 0 | 111.2 | L208 N217 P218 S224 L225 | L208-V221 HydrophobicContact CD1-CG1 4.43Å; L208-V221 HydrophobicContact CD1-CG2 4.32Å; L208-V221 HydrophobicContact CD2-CB 4.41Å; L208-V221 HydrophobicContact CD2-CG2 3.91Å; N217-V221 PolarHBondContact O-N 3.08Å; N217-V221 VanDerWaalsContact O-N 3.1Å; P218-V221 PolarHBondContact O-N 3.33Å; V221-S224 PolarHBondContact O-N 3.37Å; V221-L225 HydrophobicContact CG1-CD1 3.85Å; V221-L225 WeakPolarHBondContact O-CG 3.36Å; V221-L225 PolarHBondContact O-N 3.49Å |
| 222 | A | 93 | Very high | 90.9 | Very high | 44 Ų | 44 | 50.7 Ų | 50.7 | 36% | 0.364 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | P218 K219 Y220 S224 L225 I226 | P218-A222 WeakPolarHBondContact O-CB 3.41Å; P218-A222 PolarHBondContact O-N 3.04Å; K219-A222 PolarHBondContact O-N 3.37Å; Y220-A222 VanDerWaalsContact C-N 3.33Å; Y220-A222 PolarHBondContact O-N 2.99Å; A222-S224 PolarHBondContact O-N 3.18Å; A222-L225 PolarHBondContact O-N 3.5Å; A222-I226 WeakPolarHBondContact O-CB 3.42Å; A222-I226 WeakPolarHBondContact O-CD1 3.49Å; A222-I226 VanDerWaalsContact O-CG1 3.23Å; A222-I226 WeakPolarHBondContact O-CG1 3.23Å; A222-I226 PolarHBondContact O-N 3.05Å |
| 223 | F | 94.4 | Very high | 91.6 | Very high | 75 Ų | 75 | 50.8 Ų | 50.8 | 33% | 0.329 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -56.7 | -50.1 | 175 | 168.4 | -96.2 | 0 | 0 | 0 | 111.8 | A177 F178 F181 K219 Y220 L225 I226 F227 | A177-F223 HydrophobicContact CB-CE1 3.78Å; A177-F223 HydrophobicContact CB-CE2 4.45Å; A177-F223 HydrophobicContact CB-CZ 3.42Å; A177-F223 VanDerWaalsContact CB-CZ 3.42Å; F178-F223 HydrophobicContact CZ-CE1 4.27Å; F181-F223 HydrophobicContact CE2-CD1 4.41Å; F181-F223 HydrophobicContact CE2-CE1 4.42Å; K219-F223 WeakPolarHBondContact O-CB 3.37Å; K219-F223 PolarHBondContact O-N 3.39Å; Y220-F223 HydrophobicContact CD2-CD1 4.09Å; Y220-F223 HydrophobicContact CE2-CD1 4.15Å; Y220-F223 WeakPolarHBondContact O-CB 3.32Å; Y220-F223 PolarHBondContact O-N 3.09Å; F223-L225 PolarHBondContact O-N 3.29Å; F223-I226 PolarHBondContact O-N 3.48Å; F223-F227 VanDerWaalsContact O-CB 3.32Å; F223-F227 WeakPolarHBondContact O-CB 3.46Å; F223-F227 PolarHBondContact O-N 3.04Å |
| 224 | S | 94.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.5 | -42.3 | -179.3 | -56.1 | 0 | 0 | 0 | 0 | 112.1 | Y220 V221 A222 F227 I228 | Y220-S224 WeakPolarHBondContact CE2-OG 3.41Å; Y220-S224 PolarHBondContact O-N 3.16Å; Y220-S224 PolarHBondContact O-OG 2.78Å; Y220-S224 VanDerWaalsContact O-OG 3.09Å; V221-S224 PolarHBondContact O-N 3.37Å; A222-S224 PolarHBondContact O-N 3.18Å; S224-F227 PolarHBondContact O-N 2.89Å; S224-I228 VanDerWaalsContact O-CG1 3.26Å; S224-I228 WeakPolarHBondContact O-CG1 3.4Å; S224-I228 PolarHBondContact O-N 3.3Å |
| 225 | L | 94.2 | Very high | 92.5 | Very high | 18 Ų | 18 | 52.2 Ų | 52.2 | 9% | 0.094 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65.7 | -45.6 | 177.6 | -72.5 | 165.4 | 0 | 0 | 0 | 112.2 | F84 Y85 T88 V221 A222 F223 F227 I228 L229 | F84-L225 HydrophobicContact CD1-CD1 3.57Å; F84-L225 HydrophobicContact CD1-CD2 4.01Å; F84-L225 HydrophobicContact CD1-CG 4.44Å; F84-L225 HydrophobicContact CE1-CD1 3.66Å; F84-L225 HydrophobicContact CE1-CD2 3.98Å; F84-L225 HydrophobicContact CE1-CG 4.37Å; Y85-L225 HydrophobicContact CD2-CD2 3.83Å; T88-L225 HydrophobicContact CG2-CD2 4.37Å; V221-L225 HydrophobicContact CG1-CD1 3.85Å; V221-L225 WeakPolarHBondContact O-CG 3.36Å; V221-L225 PolarHBondContact O-N 3.49Å; A222-L225 PolarHBondContact O-N 3.5Å; F223-L225 PolarHBondContact O-N 3.29Å; L225-F227 VanDerWaalsContact C-N 3.32Å; L225-F227 PolarHBondContact O-N 3.47Å; L225-I228 PolarHBondContact O-N 2.91Å; L225-L229 WeakPolarHBondContact O-CB 2.95Å; L225-L229 WeakPolarHBondContact O-CG 3.45Å; L225-L229 PolarHBondContact O-N 3.44Å |
| 226 | I | 95 | Very high | 92.9 | Very high | 116 Ų | 116 | 49.3 Ų | 49.3 | 60% | 0.595 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -62.2 | -43.4 | 177 | -69.5 | 166.7 | 0 | 0 | 0 | 110 | A222 F223 L229 F230 | A222-I226 WeakPolarHBondContact O-CB 3.42Å; A222-I226 WeakPolarHBondContact O-CD1 3.49Å; A222-I226 VanDerWaalsContact O-CG1 3.23Å; A222-I226 WeakPolarHBondContact O-CG1 3.23Å; A222-I226 PolarHBondContact O-N 3.05Å; F223-I226 PolarHBondContact O-N 3.48Å; I226-L229 PolarHBondContact O-N 3.41Å; I226-F230 WeakPolarHBondContact O-CB 3.45Å; I226-F230 PolarHBondContact O-N 3.36Å |
| 227 | F | 95.9 | Very high | 93.1 | Very high | 13 Ų | 13 | 42.9 Ų | 42.9 | 6% | 0.057 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.7 | -48.7 | 176.7 | 175.4 | -94.4 | 0 | 0 | 0 | 111.7 | L170 F178 C193 L197 F223 S224 L225 G231 | L170-F227 HydrophobicContact CD1-CD2 4.21Å; L170-F227 HydrophobicContact CD1-CE2 3.95Å; L170-F227 HydrophobicContact CG-CE2 4.06Å; F178-F227 AromaticContact CE2-CD1 3.6Å; F178-F227 HydrophobicContact CE2-CD1 3.6Å; F178-F227 AromaticContact CE2-CE1 3.69Å; F178-F227 HydrophobicContact CE2-CE1 3.69Å; F178-F227 HydrophobicContact CE2-CG 4.13Å; F178-F227 HydrophobicContact CE2-CZ 4.29Å; F178-F227 AromaticContact CZ-CD1 3.96Å; F178-F227 HydrophobicContact CZ-CD1 3.96Å; F178-F227 HydrophobicContact CZ-CE1 4.45Å; F178-F227 HydrophobicContact CZ-CG 4.43Å; C193-F227 HydrophobicContact CB-CE1 4.43Å; C193-F227 HydrophobicContact CB-CZ 4.27Å; L197-F227 HydrophobicContact CD1-CE1 4.24Å; L197-F227 HydrophobicContact CD1-CZ 4.03Å; L197-F227 HydrophobicContact CD2-CE1 4.35Å; L197-F227 HydrophobicContact CG-CE1 4.4Å; F223-F227 VanDerWaalsContact O-CB 3.32Å; F223-F227 WeakPolarHBondContact O-CB 3.46Å; F223-F227 PolarHBondContact O-N 3.04Å; S224-F227 PolarHBondContact O-N 2.89Å; L225-F227 VanDerWaalsContact C-N 3.32Å; L225-F227 PolarHBondContact O-N 3.47Å; F227-G231 WeakPolarHBondContact O-CA 3.42Å; F227-G231 PolarHBondContact O-N 3.22Å |
| 228 | I | 95.3 | Very high | 93.2 | Very high | 1 Ų | 1 | 39.5 Ų | 39.5 | 1% | 0.005 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.4 | -50.9 | 179 | -69.1 | 166.9 | 0 | 0 | 0 | 110.5 | Y85 I94 T196 S224 L225 G231 L232 | Y85-I228 HydrophobicContact CE2-CD1 3.9Å; I94-I228 HydrophobicContact CD1-CG2 3.66Å; T196-I228 HydrophobicContact CG2-CD1 4.4Å; T196-I228 HydrophobicContact CG2-CG1 3.95Å; S224-I228 VanDerWaalsContact O-CG1 3.26Å; S224-I228 WeakPolarHBondContact O-CG1 3.4Å; S224-I228 PolarHBondContact O-N 3.3Å; L225-I228 PolarHBondContact O-N 2.91Å; I228-G231 PolarHBondContact O-N 2.83Å; I228-L232 HydrophobicContact CG2-CD1 3.9Å; I228-L232 HydrophobicContact CG2-CG 4.43Å; I228-L232 WeakPolarHBondContact O-CB 3.44Å; I228-L232 VanDerWaalsContact O-CG 3.26Å; I228-L232 WeakPolarHBondContact O-CG 3.32Å; I228-L232 PolarHBondContact O-N 3.47Å |
| 229 | L | 94.7 | Very high | 93.1 | Very high | 65 Ų | 65 | 39.7 Ų | 39.7 | 34% | 0.34 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -64.8 | -43.6 | -177.5 | -68.2 | 175 | 0 | 0 | 0 | 112.4 | T88 F125 L225 I226 T233 | T88-L229 HydrophobicContact CG2-CD2 4.16Å; F125-L229 HydrophobicContact CZ-CD2 4.34Å; L225-L229 WeakPolarHBondContact O-CB 2.95Å; L225-L229 WeakPolarHBondContact O-CG 3.45Å; L225-L229 PolarHBondContact O-N 3.44Å; I226-L229 PolarHBondContact O-N 3.41Å; L229-T233 WeakPolarHBondContact O-CB 3.12Å; L229-T233 PolarHBondContact O-N 2.88Å; L229-T233 VanDerWaalsContact O-N 3.1Å; L229-T233 PolarHBondContact O-OG1 3.14Å |
| 230 | F | 94.7 | Very high | 92.8 | Very high | 99 Ų | 99 | 31.3 Ų | 31.3 | 43% | 0.434 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -68.6 | -40.4 | 177.3 | -175.7 | -108.2 | 0 | 0 | 0 | 111.5 | L170 I226 T233 V234 | L170-F230 HydrophobicContact CD1-CD1 3.89Å; L170-F230 HydrophobicContact CD1-CE1 4.09Å; L170-F230 HydrophobicContact CD2-CD1 4Å; L170-F230 HydrophobicContact CD2-CE1 4.28Å; I226-F230 WeakPolarHBondContact O-CB 3.45Å; I226-F230 PolarHBondContact O-N 3.36Å; F230-T233 VanDerWaalsContact O-CB 3.3Å; F230-T233 WeakPolarHBondContact O-CB 3.42Å; F230-T233 PolarHBondContact O-N 3.32Å; F230-V234 HydrophobicContact CD1-CG2 4.32Å; F230-V234 HydrophobicContact CE1-CG2 3.92Å; F230-V234 HydrophobicContact CE2-CG2 4.45Å; F230-V234 HydrophobicContact CZ-CG2 3.99Å; F230-V234 WeakPolarHBondContact O-CG2 3.35Å; F230-V234 PolarHBondContact O-N 2.88Å |
| 231 | G | 95.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -65.7 | -43.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | F227 I228 T233 V234 V235 | F227-G231 WeakPolarHBondContact O-CA 3.42Å; F227-G231 PolarHBondContact O-N 3.22Å; I228-G231 PolarHBondContact O-N 2.83Å; G231-T233 PolarHBondContact O-N 2.98Å; G231-V234 PolarHBondContact O-N 3.38Å; G231-V235 WeakPolarHBondContact O-CG2 3.3Å; G231-V235 PolarHBondContact O-N 3.33Å |
| 232 | L | 94.9 | Very high | 92 | Very high | 10 Ų | 10 | 33.9 Ų | 33.9 | 5% | 0.052 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -61.8 | -35.2 | 172.4 | -71.1 | 174.6 | 0 | 0 | 0 | 111.6 | T92 I94 F125 L197 T199 I228 S236 | T92-L232 HydrophobicContact CG2-CD1 3.49Å; T92-L232 VanDerWaalsContact CG2-CD1 3.49Å; I94-L232 HydrophobicContact CD1-CD1 4.22Å; F125-L232 HydrophobicContact CD1-CB 4.35Å; F125-L232 HydrophobicContact CE1-CB 3.7Å; F125-L232 HydrophobicContact CE2-CB 3.94Å; F125-L232 HydrophobicContact CE2-CD1 3.91Å; F125-L232 HydrophobicContact CZ-CB 3.46Å; F125-L232 VanDerWaalsContact CZ-CB 3.46Å; F125-L232 HydrophobicContact CZ-CD1 3.64Å; F125-L232 HydrophobicContact CZ-CG 4.23Å; L197-L232 HydrophobicContact CD2-CG 4.35Å; L197-L232 WeakPolarHBondContact O-CD2 3.38Å; T199-L232 HydrophobicContact CG2-CD2 3.51Å; I228-L232 HydrophobicContact CG2-CD1 3.9Å; I228-L232 HydrophobicContact CG2-CG 4.43Å; I228-L232 WeakPolarHBondContact O-CB 3.44Å; I228-L232 VanDerWaalsContact O-CG 3.26Å; I228-L232 WeakPolarHBondContact O-CG 3.32Å; I228-L232 PolarHBondContact O-N 3.47Å; L232-S236 WeakPolarHBondContact O-CB 3.21Å; L232-S236 PolarHBondContact O-N 2.95Å |
| 233 | T | 93.6 | Very high | 91.5 | Very high | 11 Ų | 11 | 35.2 Ų | 35.2 | 7% | 0.067 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -63.7 | -44.6 | 174 | -59.4 | 0 | 0 | 0 | 0 | 111.9 | F125 I128 L132 L229 F230 G231 S236 A237 | F125-T233 WeakPolarHBondContact CD1-OG1 3.46Å; I128-T233 HydrophobicContact CB-CG2 3.97Å; I128-T233 HydrophobicContact CG2-CG2 3.34Å; L132-T233 HydrophobicContact CD2-CG2 4.43Å; L229-T233 WeakPolarHBondContact O-CB 3.12Å; L229-T233 PolarHBondContact O-N 2.88Å; L229-T233 VanDerWaalsContact O-N 3.1Å; L229-T233 PolarHBondContact O-OG1 3.14Å; F230-T233 VanDerWaalsContact O-CB 3.3Å; F230-T233 WeakPolarHBondContact O-CB 3.42Å; F230-T233 PolarHBondContact O-N 3.32Å; G231-T233 PolarHBondContact O-N 2.98Å; T233-S236 PolarHBondContact O-N 3.43Å; T233-A237 WeakPolarHBondContact O-CB 3.47Å; T233-A237 PolarHBondContact O-N 3.43Å |
| 234 | V | 93.3 | Very high | 90.6 | Very high | 4 Ų | 4 | 35.3 Ų | 35.3 | 2% | 0.024 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.1 | -44.7 | 178.4 | 173 | 0 | 0 | 0 | 0 | 111.2 | L132 I166 L170 F230 G231 A237 A238 | L132-V234 HydrophobicContact CD2-CG2 3.95Å; I166-V234 HydrophobicContact CG2-CG1 4.06Å; I166-V234 HydrophobicContact CG2-CG2 4.39Å; L170-V234 HydrophobicContact CD2-CB 4.18Å; L170-V234 HydrophobicContact CD2-CG2 4.08Å; F230-V234 HydrophobicContact CD1-CG2 4.32Å; F230-V234 HydrophobicContact CE1-CG2 3.92Å; F230-V234 HydrophobicContact CE2-CG2 4.45Å; F230-V234 HydrophobicContact CZ-CG2 3.99Å; F230-V234 WeakPolarHBondContact O-CG2 3.35Å; F230-V234 PolarHBondContact O-N 2.88Å; G231-V234 PolarHBondContact O-N 3.38Å; V234-A237 WeakPolarHBondContact O-CB 3.2Å; V234-A237 PolarHBondContact O-N 3.37Å; V234-A238 PolarHBondContact O-N 2.7Å |
| 235 | V | 92.5 | Very high | 89.8 | Confident | 39 Ų | 39 | 44 Ų | 44 | 24% | 0.236 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.2 | -44.7 | 176.1 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | L197 G231 A237 A238 M239 | L197-V235 HydrophobicContact CB-CG2 4.16Å; G231-V235 WeakPolarHBondContact O-CG2 3.3Å; G231-V235 PolarHBondContact O-N 3.33Å; V235-A237 VanDerWaalsContact C-N 3.33Å; V235-A237 PolarHBondContact O-N 2.7Å; V235-A238 PolarHBondContact O-N 3.43Å; V235-M239 HydrophobicContact CG1-CG 4.25Å; V235-M239 WeakPolarHBondContact O-CB 3.34Å; V235-M239 VanDerWaalsContact O-CG 3.31Å; V235-M239 WeakPolarHBondContact O-CG 3.27Å; V235-M239 PolarHBondContact O-N 3.45Å |
| 236 | S | 90.8 | Very high | 89.1 | Confident | 16 Ų | 16 | 49.2 Ų | 49.2 | 11% | 0.112 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -58.8 | -42.6 | 174 | 177.3 | 0 | 0 | 0 | 0 | 112 | F125 Q126 L232 T233 A238 M239 N240 | F125-S236 PolarHBondContact O-OG 3.33Å; F125-S236 VanDerWaalsContact O-OG 3.05Å; Q126-S236 PolarHBondContact NE2-OG 3.34Å; L232-S236 WeakPolarHBondContact O-CB 3.21Å; L232-S236 PolarHBondContact O-N 2.95Å; T233-S236 PolarHBondContact O-N 3.43Å; S236-A238 VanDerWaalsContact C-N 3.34Å; S236-A238 PolarHBondContact O-N 2.95Å; S236-M239 PolarHBondContact O-N 2.84Å; S236-N240 VanDerWaalsContact O-CB 3.31Å; S236-N240 WeakPolarHBondContact O-CB 3.48Å; S236-N240 PolarHBondContact O-N 3.27Å |
| 237 | A | 90.8 | Very high | 88.2 | Confident | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.008 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62 | -41.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L132 N133 T233 V234 V235 L241 | L132-A237 HydrophobicContact CD2-CB 4.07Å; N133-A237 PolarHBondContact ND2-O 3.43Å; T233-A237 WeakPolarHBondContact O-CB 3.47Å; T233-A237 PolarHBondContact O-N 3.43Å; V234-A237 WeakPolarHBondContact O-CB 3.2Å; V234-A237 PolarHBondContact O-N 3.37Å; V235-A237 VanDerWaalsContact C-N 3.33Å; V235-A237 PolarHBondContact O-N 2.7Å; A237-L241 WeakPolarHBondContact O-CG 3.5Å; A237-L241 PolarHBondContact O-N 3.19Å |
| 238 | A | 89.4 | Confident | 87.4 | Confident | 13 Ų | 13 | 50.4 Ų | 50.4 | 11% | 0.107 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -68.8 | -44 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A163 V234 V235 S236 N240 L241 L242 | A163-A238 HydrophobicContact CB-CB 4.22Å; V234-A238 PolarHBondContact O-N 2.7Å; V235-A238 PolarHBondContact O-N 3.43Å; S236-A238 VanDerWaalsContact C-N 3.34Å; S236-A238 PolarHBondContact O-N 2.95Å; A238-N240 VanDerWaalsContact C-N 3.34Å; A238-N240 PolarHBondContact O-N 2.92Å; A238-L241 PolarHBondContact O-N 2.76Å; A238-L242 PolarHBondContact O-N 3.24Å |
| 239 | M | 87.4 | Confident | 86.4 | Confident | 95 Ų | 95 | 54.2 Ų | 54.2 | 47% | 0.468 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 176 | -70.7 | -59.3 | 139.5 | 0 | 0 | 111.6 | V235 S236 L241 L242 V243 | V235-M239 HydrophobicContact CG1-CG 4.25Å; V235-M239 WeakPolarHBondContact O-CB 3.34Å; V235-M239 VanDerWaalsContact O-CG 3.31Å; V235-M239 WeakPolarHBondContact O-CG 3.27Å; V235-M239 PolarHBondContact O-N 3.45Å; S236-M239 PolarHBondContact O-N 2.84Å; M239-L241 VanDerWaalsContact C-N 3.3Å; M239-L241 PolarHBondContact O-N 2.95Å; M239-L242 HydrophobicContact CE-CD1 4.33Å; M239-L242 PolarHBondContact O-N 3.39Å; M239-L242 VanDerWaalsContact O-N 3.15Å; M239-L242 HydrophobicContact SD-CD1 4.38Å; M239-V243 VanDerWaalsContact O-CB 3.31Å; M239-V243 WeakPolarHBondContact O-CB 3.31Å; M239-V243 VanDerWaalsContact O-CG2 3.27Å; M239-V243 WeakPolarHBondContact O-CG2 3.36Å; M239-V243 PolarHBondContact O-N 3.43Å |
| 240 | N | 85.9 | Confident | 85.5 | Confident | 12 Ų | 12 | 53.3 Ų | 53.3 | 6% | 0.064 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -56.3 | -45.4 | 176.5 | -170.2 | 21.8 | 0 | 0 | 0 | 110.9 | Q126 E130 S236 A238 L242 L244 | Q126-N240 PolarHBondContact OE1-OD1 3.46Å; E130-N240 VanDerWaalsContact CG-ND2 3.31Å; E130-N240 WeakPolarHBondContact CG-ND2 3.49Å; S236-N240 VanDerWaalsContact O-CB 3.31Å; S236-N240 WeakPolarHBondContact O-CB 3.48Å; S236-N240 PolarHBondContact O-N 3.27Å; A238-N240 VanDerWaalsContact C-N 3.34Å; A238-N240 PolarHBondContact O-N 2.92Å; N240-L242 PolarHBondContact O-N 3.31Å; N240-L244 WeakPolarHBondContact O-CB 3.41Å; N240-L244 VanDerWaalsContact O-CD1 3.31Å; N240-L244 WeakPolarHBondContact O-CD1 3.27Å; N240-L244 WeakPolarHBondContact O-CG 3.23Å; N240-L244 PolarHBondContact O-N 2.99Å; N240-L244 WeakPolarHBondContact OD1-CD1 3.33Å; N240-L244 WeakPolarHBondContact OD1-CG 3.32Å |
| 241 | L | 85 | Confident | 84.9 | Confident | 15 Ų | 15 | 51.5 Ų | 51.5 | 8% | 0.079 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.6 | -38.1 | 177.7 | -63.6 | 172.1 | 0 | 0 | 0 | 113.4 | N133 L159 A163 A237 A238 M239 R245 | N133-L241 WeakPolarHBondContact ND2-CG 3.3Å; L159-L241 HydrophobicContact CB-CD1 4.3Å; L159-L241 HydrophobicContact CD2-CD1 3.9Å; L159-L241 HydrophobicContact CD2-CD2 3.6Å; L159-L241 HydrophobicContact CD2-CG 4.41Å; L159-L241 HydrophobicContact CG-CD1 3.63Å; L159-L241 HydrophobicContact CG-CD2 4.28Å; A163-L241 HydrophobicContact CB-CD1 4.27Å; A237-L241 WeakPolarHBondContact O-CG 3.5Å; A237-L241 PolarHBondContact O-N 3.19Å; A238-L241 PolarHBondContact O-N 2.76Å; M239-L241 VanDerWaalsContact C-N 3.3Å; M239-L241 PolarHBondContact O-N 2.95Å; L241-R245 PolarHBondContact O-N 3.07Å |
| 242 | L | 82.4 | Confident | 84.1 | Confident | 65 Ų | 65 | 55.8 Ų | 55.8 | 34% | 0.34 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -71.5 | -48.9 | 178.5 | -70.5 | 174.1 | 0 | 0 | 0 | 111.4 | T160 A238 M239 N240 R245 F246 | T160-L242 HydrophobicContact CG2-CD2 3.89Å; T160-L242 HydrophobicContact CG2-CG 4.34Å; A238-L242 PolarHBondContact O-N 3.24Å; M239-L242 HydrophobicContact CE-CD1 4.33Å; M239-L242 PolarHBondContact O-N 3.39Å; M239-L242 VanDerWaalsContact O-N 3.15Å; M239-L242 HydrophobicContact SD-CD1 4.38Å; N240-L242 PolarHBondContact O-N 3.31Å; L242-R245 WeakPolarHBondContact O-CB 3.31Å; L242-R245 PolarHBondContact O-N 3.14Å; L242-F246 WeakPolarHBondContact O-CD2 3.29Å; L242-F246 PolarHBondContact O-N 3.45Å |
| 243 | V | 82.7 | Confident | 83.3 | Confident | 71 Ų | 71 | 57.3 Ų | 57.3 | 43% | 0.43 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.7 | -45.4 | -179.2 | 172.3 | 0 | 0 | 0 | 0 | 110.5 | M239 R245 F246 L247 | M239-V243 VanDerWaalsContact O-CB 3.31Å; M239-V243 WeakPolarHBondContact O-CB 3.31Å; M239-V243 VanDerWaalsContact O-CG2 3.27Å; M239-V243 WeakPolarHBondContact O-CG2 3.36Å; M239-V243 PolarHBondContact O-N 3.43Å; V243-R245 PolarHBondContact O-N 3.06Å; V243-F246 PolarHBondContact O-N 3.17Å; V243-L247 HydrophobicContact CG1-CD1 3.61Å; V243-L247 HydrophobicContact CG1-CG 3.87Å; V243-L247 WeakPolarHBondContact O-CG 3.28Å; V243-L247 PolarHBondContact O-N 3.36Å |
| 244 | L | 74.4 | Confident | 82.6 | Confident | 78 Ų | 78 | 60.8 Ų | 60.8 | 41% | 0.408 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -53.1 | -44.7 | 175.3 | -79.6 | 165.3 | 0 | 0 | 0 | 111 | N240 F246 L247 T248 | N240-L244 WeakPolarHBondContact O-CB 3.41Å; N240-L244 VanDerWaalsContact O-CD1 3.31Å; N240-L244 WeakPolarHBondContact O-CD1 3.27Å; N240-L244 WeakPolarHBondContact O-CG 3.23Å; N240-L244 PolarHBondContact O-N 2.99Å; N240-L244 WeakPolarHBondContact OD1-CD1 3.33Å; N240-L244 WeakPolarHBondContact OD1-CG 3.32Å; L244-F246 VanDerWaalsContact C-N 3.31Å; L244-F246 PolarHBondContact O-N 3.15Å; L244-L247 PolarHBondContact O-N 3.45Å; L244-T248 WeakPolarHBondContact O-CB 3.16Å; L244-T248 WeakPolarHBondContact O-CG2 3.41Å; L244-T248 PolarHBondContact O-N 3.1Å; L244-T248 PolarHBondContact O-OG1 3.02Å |
| 245 | R | 78.4 | Confident | 82.2 | Confident | 181 Ų | 181 | 69.2 Ų | 69.2 | 68% | 0.683 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -61.7 | -37.5 | 179 | -171.3 | -178.8 | -178.6 | -144.9 | -2.1 | 113 | L241 L242 V243 T248 M249 | L241-R245 PolarHBondContact O-N 3.07Å; L242-R245 WeakPolarHBondContact O-CB 3.31Å; L242-R245 PolarHBondContact O-N 3.14Å; V243-R245 PolarHBondContact O-N 3.06Å; R245-T248 PolarHBondContact O-OG1 3.1Å; R245-M249 WeakPolarHBondContact O-CB 3.38Å; R245-M249 PolarHBondContact O-N 3.22Å |
| 246 | F | 78 | Confident | 81.8 | Confident | 128 Ų | 128 | 73.7 Ų | 73.7 | 56% | 0.561 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -77.1 | -39.8 | 177.6 | -76.6 | -68.9 | 0 | 0 | 0 | 112.6 | L242 V243 L244 M249 N250 | L242-F246 WeakPolarHBondContact O-CD2 3.29Å; L242-F246 PolarHBondContact O-N 3.45Å; V243-F246 PolarHBondContact O-N 3.17Å; L244-F246 VanDerWaalsContact C-N 3.31Å; L244-F246 PolarHBondContact O-N 3.15Å; F246-M249 HydrophobicContact CD1-CE 4.39Å; F246-M249 WeakPolarHBondContact O-CB 3.34Å; F246-M249 PolarHBondContact O-N 3.18Å; F246-N250 PolarHBondContact O-N 2.6Å; F246-N250 VanDerWaalsContact O-N 3.1Å; F246-N250 PolarHBondContact O-OD1 3.27Å |
| 247 | L | 77.6 | Confident | 81.4 | Confident | 95 Ų | 95 | 75.4 Ų | 75.4 | 50% | 0.497 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.8 | -44 | 177.9 | -69.4 | -178.8 | 0 | 0 | 0 | 111.3 | V243 L244 M249 N250 T251 | V243-L247 HydrophobicContact CG1-CD1 3.61Å; V243-L247 HydrophobicContact CG1-CG 3.87Å; V243-L247 WeakPolarHBondContact O-CG 3.28Å; V243-L247 PolarHBondContact O-N 3.36Å; L244-L247 PolarHBondContact O-N 3.45Å; L247-M249 VanDerWaalsContact C-N 3.26Å; L247-M249 PolarHBondContact O-N 2.99Å; L247-N250 WeakPolarHBondContact O-CB 3.49Å; L247-N250 PolarHBondContact O-N 2.93Å; L247-N250 VanDerWaalsContact O-N 3.09Å; L247-T251 PolarHBondContact O-N 3.48Å; L247-T251 PolarHBondContact O-OG1 2.93Å |
| 248 | T | 78.4 | Confident | 81.1 | Confident | 59 Ų | 59 | 79.1 Ų | 79.1 | 36% | 0.362 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.3 | -39.9 | 177.2 | 58.2 | 0 | 0 | 0 | 0 | 110.8 | L244 R245 N250 T251 E252 | L244-T248 WeakPolarHBondContact O-CB 3.16Å; L244-T248 WeakPolarHBondContact O-CG2 3.41Å; L244-T248 PolarHBondContact O-N 3.1Å; L244-T248 PolarHBondContact O-OG1 3.02Å; R245-T248 PolarHBondContact O-OG1 3.1Å; T248-N250 VanDerWaalsContact C-N 3.32Å; T248-N250 PolarHBondContact O-N 3.33Å; T248-T251 WeakPolarHBondContact CA-OG1 3.42Å; T248-T251 PolarHBondContact O-N 3.49Å; T248-T251 PolarHBondContact O-OG1 3.37Å; T248-E252 VanDerWaalsContact O-CB 3.29Å; T248-E252 WeakPolarHBondContact O-CB 3.36Å; T248-E252 VanDerWaalsContact O-CG 3.23Å; T248-E252 WeakPolarHBondContact O-CG 3.44Å; T248-E252 PolarHBondContact O-N 3.21Å |
| 249 | M | 73.6 | Confident | 80.9 | Confident | 81 Ų | 81 | 83.9 Ų | 83.9 | 40% | 0.399 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -59.2 | -43.5 | 174.4 | -170.3 | -174.9 | 76.8 | 0 | 0 | 111.6 | R245 F246 L247 E252 D253 | R245-M249 WeakPolarHBondContact O-CB 3.38Å; R245-M249 PolarHBondContact O-N 3.22Å; F246-M249 HydrophobicContact CD1-CE 4.39Å; F246-M249 WeakPolarHBondContact O-CB 3.34Å; F246-M249 PolarHBondContact O-N 3.18Å; L247-M249 VanDerWaalsContact C-N 3.26Å; L247-M249 PolarHBondContact O-N 2.99Å; M249-E252 PolarHBondContact O-N 2.67Å; M249-D253 VanDerWaalsContact O-CG 3.26Å; M249-D253 PolarHBondContact O-N 2.97Å |
| 250 | N | 76.7 | Confident | 80.8 | Confident | 46 Ų | 46 | 84.5 Ų | 84.5 | 25% | 0.246 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 177.4 | -66.6 | -5.2 | 0 | 0 | 0 | 112.6 | R7 F246 L247 T248 E254 | R7-N250 WeakPolarHBondContact CD-OD1 3.45Å; R7-N250 PolarHBondContact NE-OD1 3.14Å; R7-N250 VanDerWaalsContact NE-OD1 3.07Å; R7-N250 PolarHBondContact NH1-OD1 3.21Å; R7-N250 VanDerWaalsContact NH2-CG 3.27Å; R7-N250 PolarHBondContact NH2-OD1 3.05Å; F246-N250 PolarHBondContact O-N 2.6Å; F246-N250 VanDerWaalsContact O-N 3.1Å; F246-N250 PolarHBondContact O-OD1 3.27Å; L247-N250 WeakPolarHBondContact O-CB 3.49Å; L247-N250 PolarHBondContact O-N 2.93Å; L247-N250 VanDerWaalsContact O-N 3.09Å; T248-N250 VanDerWaalsContact C-N 3.32Å; T248-N250 PolarHBondContact O-N 3.33Å; N250-E254 PolarHBondContact O-N 3.35Å; N250-E254 VanDerWaalsContact O-N 3.13Å |
| 251 | T | 81 | Confident | 80.7 | Confident | 62 Ų | 62 | 86.8 Ų | 86.8 | 38% | 0.38 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -71.4 | -34.1 | 179.4 | 54.7 | 0 | 0 | 0 | 0 | 112.7 | L247 T248 E254 R255 | L247-T251 PolarHBondContact O-N 3.48Å; L247-T251 PolarHBondContact O-OG1 2.93Å; T248-T251 WeakPolarHBondContact CA-OG1 3.42Å; T248-T251 PolarHBondContact O-N 3.49Å; T248-T251 PolarHBondContact O-OG1 3.37Å; T251-E254 PolarHBondContact O-N 3.16Å; T251-R255 WeakPolarHBondContact O-CB 3.43Å; T251-R255 VanDerWaalsContact O-CG 3.31Å; T251-R255 WeakPolarHBondContact O-CG 3.31Å; T251-R255 PolarHBondContact O-N 3.35Å |
| 252 | E | 79.6 | Confident | 80.7 | Confident | 90 Ų | 90 | 91.5 Ų | 91.5 | 42% | 0.421 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -66.9 | -40.4 | 175.4 | -77.7 | 176.3 | -155.3 | 0 | 0 | 111 | T248 M249 R255 R256 | T248-E252 VanDerWaalsContact O-CB 3.29Å; T248-E252 WeakPolarHBondContact O-CB 3.36Å; T248-E252 VanDerWaalsContact O-CG 3.23Å; T248-E252 WeakPolarHBondContact O-CG 3.44Å; T248-E252 PolarHBondContact O-N 3.21Å; M249-E252 PolarHBondContact O-N 2.67Å; E252-R255 PolarHBondContact O-N 2.72Å; E252-R256 WeakPolarHBondContact O-CB 3.3Å; E252-R256 VanDerWaalsContact O-CG 3.26Å; E252-R256 WeakPolarHBondContact O-CG 3.35Å; E252-R256 PolarHBondContact O-N 3.32Å; E252-R256 IonicContact OE2-NH2 3.31Å |
| 253 | D | 78.7 | Confident | 80.8 | Confident | 42 Ų | 42 | 94.2 Ų | 94.2 | 23% | 0.225 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -63.5 | -43.6 | 174.3 | -71.6 | -25 | 0 | 0 | 0 | 111.6 | R7 M249 R255 R256 D257 | R7-D253 IonicContact NH1-OD2 2.59Å; R7-D253 PolarHBondContact NH1-OD2 3.49Å; R7-D253 VanDerWaalsContact NH1-OD2 3.08Å; M249-D253 VanDerWaalsContact O-CG 3.26Å; M249-D253 PolarHBondContact O-N 2.97Å; D253-R255 PolarHBondContact O-N 2.82Å; D253-R256 PolarHBondContact O-N 3.22Å; D253-D257 WeakPolarHBondContact O-CB 3.5Å; D253-D257 PolarHBondContact O-N 2.89Å |
| 254 | E | 79 | Confident | 80.8 | Confident | 84 Ų | 84 | 93.5 Ų | 93.5 | 39% | 0.393 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.2 | -44.6 | 176.1 | -76.8 | 179.4 | 171 | 0 | 0 | 111.4 | Q4 N250 T251 R256 D257 V258 | Q4-E254 PolarHBondContact NE2-OE1 3.16Å; N250-E254 PolarHBondContact O-N 3.35Å; N250-E254 VanDerWaalsContact O-N 3.13Å; T251-E254 PolarHBondContact O-N 3.16Å; E254-R256 PolarHBondContact O-N 3.13Å; E254-D257 PolarHBondContact O-N 3.26Å; E254-V258 WeakPolarHBondContact O-CB 3.46Å; E254-V258 VanDerWaalsContact O-CG2 3.23Å; E254-V258 WeakPolarHBondContact O-CG2 3.48Å; E254-V258 PolarHBondContact O-N 3.26Å |
| 255 | R | 84.3 | Confident | 81.2 | Confident | 180 Ų | 180 | 92.3 Ų | 92.3 | 68% | 0.679 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -62.4 | -42.2 | 176.1 | -74 | 175.2 | 178.7 | -174.3 | -2.2 | 112.1 | T251 E252 D253 V258 Q259 | T251-R255 WeakPolarHBondContact O-CB 3.43Å; T251-R255 VanDerWaalsContact O-CG 3.31Å; T251-R255 WeakPolarHBondContact O-CG 3.31Å; T251-R255 PolarHBondContact O-N 3.35Å; E252-R255 PolarHBondContact O-N 2.72Å; D253-R255 PolarHBondContact O-N 2.82Å; R255-V258 PolarHBondContact O-N 2.85Å; R255-Q259 WeakPolarHBondContact O-CB 3.24Å; R255-Q259 VanDerWaalsContact O-CG 3.23Å; R255-Q259 WeakPolarHBondContact O-CG 3.45Å; R255-Q259 PolarHBondContact O-N 3.13Å |
| 256 | R | 82.9 | Confident | 81.2 | Confident | 134 Ų | 134 | 90 Ų | 90 | 51% | 0.506 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -66.1 | -45.9 | 177.1 | -73.9 | 175.6 | -166.3 | 179.3 | 10.6 | 111.9 | E252 D253 E254 V258 Q259 E260 | E252-R256 WeakPolarHBondContact O-CB 3.3Å; E252-R256 VanDerWaalsContact O-CG 3.26Å; E252-R256 WeakPolarHBondContact O-CG 3.35Å; E252-R256 PolarHBondContact O-N 3.32Å; E252-R256 IonicContact OE2-NH2 3.31Å; D253-R256 PolarHBondContact O-N 3.22Å; E254-R256 PolarHBondContact O-N 3.13Å; R256-V258 VanDerWaalsContact C-N 3.28Å; R256-V258 PolarHBondContact O-N 3.36Å; R256-Q259 PolarHBondContact O-N 2.97Å; R256-E260 WeakPolarHBondContact O-CB 3.34Å; R256-E260 WeakPolarHBondContact O-CG 3.29Å; R256-E260 PolarHBondContact O-N 3.41Å |
| 257 | D | 82.7 | Confident | 80.9 | Confident | 52 Ų | 52 | 86.1 Ų | 86.1 | 28% | 0.278 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -63 | -36.6 | 178.6 | -75.4 | -6.1 | 0 | 0 | 0 | 110.8 | K3 D253 E254 A261 | K3-D257 IonicContact NZ-OD1 2.7Å; K3-D257 PolarHBondContact NZ-OD1 2.69Å; D253-D257 WeakPolarHBondContact O-CB 3.5Å; D253-D257 PolarHBondContact O-N 2.89Å; E254-D257 PolarHBondContact O-N 3.26Å; D257-A261 WeakPolarHBondContact O-CB 3.26Å; D257-A261 PolarHBondContact O-N 3Å |
| 258 | V | 84.6 | Confident | 80 | Confident | 78 Ų | 78 | 87.5 Ų | 87.5 | 47% | 0.473 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -66.5 | -47.4 | 172.7 | 169.5 | 0 | 0 | 0 | 0 | 111.2 | E254 R255 R256 E260 A261 H262 | E254-V258 WeakPolarHBondContact O-CB 3.46Å; E254-V258 VanDerWaalsContact O-CG2 3.23Å; E254-V258 WeakPolarHBondContact O-CG2 3.48Å; E254-V258 PolarHBondContact O-N 3.26Å; R255-V258 PolarHBondContact O-N 2.85Å; R256-V258 VanDerWaalsContact C-N 3.28Å; R256-V258 PolarHBondContact O-N 3.36Å; V258-E260 PolarHBondContact O-N 3.16Å; V258-A261 WeakPolarHBondContact O-CB 3.33Å; V258-A261 PolarHBondContact O-N 2.93Å; V258-H262 VanDerWaalsContact CG1-CD2 3.48Å; V258-H262 WeakPolarHBondContact CG1-CD2 3.43Å; V258-H262 PolarHBondContact O-CD2 2.66Å; V258-H262 PolarHBondContact O-N 3.48Å |
| 259 | Q | 86.6 | Confident | 78.7 | Confident | 114 Ų | 114 | 92.7 Ų | 92.7 | 53% | 0.533 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.8 | -43.5 | 176.4 | -76.3 | 174.1 | -15.1 | 0 | 0 | 112.3 | R255 R256 H262 M263 | R255-Q259 WeakPolarHBondContact O-CB 3.24Å; R255-Q259 VanDerWaalsContact O-CG 3.23Å; R255-Q259 WeakPolarHBondContact O-CG 3.45Å; R255-Q259 PolarHBondContact O-N 3.13Å; R256-Q259 PolarHBondContact O-N 2.97Å; Q259-H262 PolarHBondContact O-N 3.47Å; Q259-M263 HydrophobicContact CB-CE 3.99Å; Q259-M263 WeakPolarHBondContact O-CE 3.45Å; Q259-M263 WeakPolarHBondContact O-CG 3.3Å; Q259-M263 PolarHBondContact O-N 3.07Å |
| 260 | E | 84.8 | Confident | 77.7 | Confident | 108 Ų | 108 | 92 Ų | 92 | 51% | 0.505 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.7 | -40.2 | 175.2 | -74.2 | 175.2 | -169 | 0 | 0 | 111.6 | R256 V258 M263 A264 | R256-E260 WeakPolarHBondContact O-CB 3.34Å; R256-E260 WeakPolarHBondContact O-CG 3.29Å; R256-E260 PolarHBondContact O-N 3.41Å; V258-E260 PolarHBondContact O-N 3.16Å; E260-M263 PolarHBondContact O-N 3.3Å; E260-A264 WeakPolarHBondContact O-CB 3.26Å; E260-A264 PolarHBondContact O-N 3.4Å |
| 261 | A | 83.2 | Confident | 76.4 | Confident | 59 Ų | 59 | 96.8 Ų | 96.8 | 49% | 0.488 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.2 | -42 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | D257 V258 A264 A265 | D257-A261 WeakPolarHBondContact O-CB 3.26Å; D257-A261 PolarHBondContact O-N 3Å; V258-A261 WeakPolarHBondContact O-CB 3.33Å; V258-A261 PolarHBondContact O-N 2.93Å; A261-A264 PolarHBondContact O-N 3.3Å; A261-A265 WeakPolarHBondContact O-CB 3.42Å; A261-A265 PolarHBondContact O-N 3.12Å |
| 262 | H | 84.8 | Confident | 74.5 | Confident | 114 Ų | 114 | 100.2 Ų | 100.2 | 53% | 0.528 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.6 | -42 | 174.2 | -75.1 | -70.4 | 0 | 0 | 0 | 112 | V258 Q259 A265 R266 | V258-H262 VanDerWaalsContact CG1-CD2 3.48Å; V258-H262 WeakPolarHBondContact CG1-CD2 3.43Å; V258-H262 PolarHBondContact O-CD2 2.66Å; V258-H262 PolarHBondContact O-N 3.48Å; Q259-H262 PolarHBondContact O-N 3.47Å; H262-A265 PolarHBondContact O-N 3.5Å; H262-R266 WeakPolarHBondContact O-CG 3.36Å; H262-R266 PolarHBondContact O-N 3.34Å; H262-R266 VanDerWaalsContact O-N 3.09Å |
| 263 | M | 84.7 | Confident | 72.7 | Confident | 122 Ų | 122 | 105.5 Ų | 105.5 | 60% | 0.601 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.6 | -41.7 | 175.9 | -74 | -174.6 | -99.7 | 0 | 0 | 112.3 | Q259 E260 R266 G267 | Q259-M263 HydrophobicContact CB-CE 3.99Å; Q259-M263 WeakPolarHBondContact O-CE 3.45Å; Q259-M263 WeakPolarHBondContact O-CG 3.3Å; Q259-M263 PolarHBondContact O-N 3.07Å; E260-M263 PolarHBondContact O-N 3.3Å; M263-R266 PolarHBondContact O-N 2.8Å; M263-G267 PolarHBondContact O-N 3.21Å |
| 264 | A | 83.7 | Confident | 70.6 | Confident | 56 Ų | 56 | 113 Ų | 113 | 46% | 0.463 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.6 | -39.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | E260 A261 G267 L268 | E260-A264 WeakPolarHBondContact O-CB 3.26Å; E260-A264 PolarHBondContact O-N 3.4Å; A261-A264 PolarHBondContact O-N 3.3Å; A264-G267 PolarHBondContact O-N 2.71Å; A264-L268 PolarHBondContact O-N 3.41Å |
| 265 | A | 81.2 | Confident | 68.5 | Low | 54 Ų | 54 | 120.4 Ų | 120.4 | 45% | 0.446 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64.1 | -40.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A261 H262 M269 | A261-A265 WeakPolarHBondContact O-CB 3.42Å; A261-A265 PolarHBondContact O-N 3.12Å; H262-A265 PolarHBondContact O-N 3.5Å; A265-M269 WeakPolarHBondContact O-CG 3.34Å; A265-M269 PolarHBondContact O-N 2.9Å |
| 266 | R | 78.6 | Confident | 66.5 | Low | 133 Ų | 133 | 116.4 Ų | 116.4 | 50% | 0.502 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -64 | -40.9 | 174 | -71.9 | -178.3 | -169.9 | 177.6 | 7.6 | 112.3 | H262 M263 M269 D296 | H262-R266 WeakPolarHBondContact O-CG 3.36Å; H262-R266 PolarHBondContact O-N 3.34Å; H262-R266 VanDerWaalsContact O-N 3.09Å; M263-R266 PolarHBondContact O-N 2.8Å; R266-M269 PolarHBondContact O-N 2.91Å; R266-D296 IonicContact CZ-OD2 3.57Å; R266-D296 VanDerWaalsContact CZ-OD2 3.31Å; R266-D296 IonicContact NH1-OD2 3.73Å; R266-D296 PolarHBondContact NH1-OD2 2.97Å; R266-D296 VanDerWaalsContact NH2-CG 3.27Å; R266-D296 IonicContact NH2-OD1 3.47Å; R266-D296 PolarHBondContact NH2-OD1 3.2Å; R266-D296 IonicContact NH2-OD2 3.08Å; R266-D296 PolarHBondContact NH2-OD2 3.32Å |
| 267 | G | 71.3 | Confident | 64.6 | Low | 45 Ų | 45 | 115.2 Ų | 115.2 | 46% | 0.464 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -66 | -39.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | M263 A264 G270 | M263-G267 PolarHBondContact O-N 3.21Å; A264-G267 PolarHBondContact O-N 2.71Å; G267-G270 PolarHBondContact O-N 3.3Å |
| 268 | L | 59.9 | Low | 62.6 | Low | 124 Ų | 124 | 120.2 Ų | 120.2 | 65% | 0.649 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -69.8 | -32.5 | 177.7 | -85.4 | 158.3 | 0 | 0 | 0 | 113.1 | A264 G270 L271 | A264-L268 PolarHBondContact O-N 3.41Å; L268-G270 PolarHBondContact O-N 2.94Å; L268-L271 PolarHBondContact O-N 3.4Å |
| 269 | M | 50.7 | Low | 60.4 | Low | 168 Ų | 168 | 120.5 Ų | 120.5 | 83% | 0.828 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -65.1 | -21.6 | 172.8 | -72.8 | -112.4 | -170.3 | 0 | 0 | 112.9 | A265 R266 | A265-M269 WeakPolarHBondContact O-CG 3.34Å; A265-M269 PolarHBondContact O-N 2.9Å; R266-M269 PolarHBondContact O-N 2.91Å |
| 270 | G | 52 | Low | 58.3 | Low | 67 Ų | 67 | 119.9 Ų | 119.9 | 69% | 0.691 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -9.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | G267 L268 | G267-G270 PolarHBondContact O-N 3.3Å; L268-G270 PolarHBondContact O-N 2.94Å |
| 271 | L | 49.8 | Very low | 56 | Low | 147 Ų | 147 | 122.4 Ų | 122.4 | 77% | 0.77 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.4 | 6.2 | -172.9 | -86 | 160.1 | 0 | 0 | 0 | 114.6 | L268 | L268-L271 PolarHBondContact O-N 3.4Š|
| 272 | N | 42 | Very low | 53.9 | Low | 133 Ų | 133 | 127.6 Ų | 127.6 | 71% | 0.711 | 71% | 0.71 | S | S | * | * | trans | -100.7 | 128.8 | 178.4 | -89.1 | -23.3 | 0 | 0 | 0 | 112.8 | ||||
| 273 | F | 42.2 | Very low | 51.7 | Low | 201 Ų | 201 | 131.1 Ų | 131.1 | 88% | 0.882 | 72% | 0.724 | S | S | * | * | trans | 87.4 | 89.4 | 173 | -74.6 | -90.7 | 0 | 0 | 0 | 118.9 | ||||
| 274 | Y | 33 | Very low | 49.5 | Very low | 201 Ų | 201 | 130.1 Ų | 130.1 | 79% | 0.788 | 73% | 0.729 | S | S | * | * | trans | -131.1 | 102.8 | 151.2 | -148.9 | -87.9 | 0 | 0 | 0 | 110.3 | P276 | Y274-P276 HydrophobicContact CE1-CG 4.24Š| ||
| 275 | Y | 35.4 | Very low | 47.4 | Very low | 238 Ų | 238 | 137.3 Ų | 137.3 | 93% | 0.933 | 75% | 0.749 | S | S | * | * | trans | -153.8 | 106.6 | 155.9 | -89.3 | -77.4 | 0 | 0 | 0 | 108.4 | ||||
| 276 | P | 42.5 | Very low | 45.4 | Very low | 97 Ų | 97 | 145.2 Ų | 145.2 | 63% | 0.63 | 77% | 0.767 | S | S | * | * | trans | -116.8 | 114.8 | 162.9 | 31.2 | -16.9 | 0 | 0 | 0 | 110.5 | Y274 | Y274-P276 HydrophobicContact CE1-CG 4.24Š| ||
| 277 | S | 42.3 | Very low | 43.5 | Very low | 109 Ų | 109 | 141.3 Ų | 141.3 | 76% | 0.762 | 76% | 0.761 | S | S | * | * | trans | -81.8 | 128 | 152.3 | 45.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 278 | N | 42 | Very low | 42.1 | Very low | 157 Ų | 157 | 143.7 Ų | 143.7 | 84% | 0.84 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 68.1 | 96.6 | 166.2 | -55.9 | -16.2 | 0 | 0 | 0 | 117.7 | ||
| 279 | G | 38.2 | Very low | 41.4 | Very low | 83 Ų | 83 | 141 Ų | 141 | 86% | 0.856 | 77% | 0.766 | S | S | * | * | trans | 56.3 | 82.5 | 131.5 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 280 | A | 42.5 | Very low | 41.2 | Very low | 101 Ų | 101 | 138.2 Ų | 138.2 | 84% | 0.835 | 76% | 0.755 | S | S | * | * | trans | -179.5 | 129 | 133.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | L282 | A280-L282 PolarHBondContact O-N 3.38Š| ||
| 281 | L | 36.2 | Very low | 41.1 | Very low | 162 Ų | 162 | 141 Ų | 141 | 85% | 0.848 | 75% | 0.753 | S | S | * | * | trans | -83.6 | 110.2 | -176.8 | -170.2 | 122.5 | 0 | 0 | 0 | 110.1 | ||||
| 282 | L | 38.8 | Very low | 41 | Very low | 168 Ų | 168 | 138.8 Ų | 138.8 | 88% | 0.88 | 74% | 0.741 | S | S | * | * | trans | -133.5 | 92.2 | 160.6 | -89.1 | 166.9 | 0 | 0 | 0 | 109.6 | A280 S284 | A280-L282 PolarHBondContact O-N 3.38Å; L282-S284 VanDerWaalsContact C-N 3.31Å; L282-S284 PolarHBondContact O-N 3.24Å | ||
| 283 | K | 39.2 | Very low | 41.2 | Very low | 188 Ų | 188 | 136.7 Ų | 136.7 | 82% | 0.817 | 73% | 0.73 | S | S | * | * | trans | -68.7 | 89.5 | 161.9 | -94.8 | 179.4 | 174.7 | 171.7 | 0 | 108.2 | K285 | K283-K285 PolarHBondContact O-N 2.89Š| ||
| 284 | S | 37.3 | Very low | 41.6 | Very low | 101 Ų | 101 | 136 Ų | 136 | 71% | 0.706 | 72% | 0.722 | S | S | * | * | trans | -87.1 | 83.7 | 158.2 | -175.2 | 0 | 0 | 0 | 0 | 108.4 | L282 R286 | L282-S284 VanDerWaalsContact C-N 3.31Å; L282-S284 PolarHBondContact O-N 3.24Å; S284-R286 PolarHBondContact O-N 2.89Å; S284-R286 VanDerWaalsContact O-N 3.17Å | ||
| 285 | K | 39.9 | Very low | 42.5 | Very low | 206 Ų | 206 | 133.3 Ų | 133.3 | 90% | 0.896 | 71% | 0.714 | S | S | * | * | trans | -77.1 | 78.1 | 154.6 | -89.7 | -170.4 | 172.6 | -172.3 | 0 | 106.1 | K283 | K283-K285 PolarHBondContact O-N 2.89Š| ||
| 286 | R | 39.9 | Very low | 43.3 | Very low | 220 Ų | 220 | 124 Ų | 124 | 83% | 0.83 | 68% | 0.681 | S | S | * | * | trans | -104.9 | 119.5 | 165.6 | -151.6 | 165.9 | -166.7 | 167.9 | 2.3 | 108.1 | S284 S288 | S284-R286 PolarHBondContact O-N 2.89Å; S284-R286 VanDerWaalsContact O-N 3.17Å; R286-S288 PolarHBondContact O-N 3.07Å | ||
| 287 | S | 37.6 | Very low | 43.7 | Very low | 51 Ų | 51 | 124.6 Ų | 124.6 | 36% | 0.357 | 68% | 0.675 | S | S | . | * | trans | -53 | 101.1 | -172.3 | -165.2 | 0 | 0 | 0 | 0 | 112.2 | D290 | S287-D290 WeakPolarHBondContact CB-OD2 3.3Å; S287-D290 PolarHBondContact OG-N 3.49Å; S287-D290 VanDerWaalsContact OG-N 3.16Å; S287-D290 PolarHBondContact OG-OD1 2.93Å; S287-D290 PolarHBondContact OG-OD2 3.01Å | ||
| 288 | S | 41.8 | Very low | 44.2 | Very low | 95 Ų | 95 | 125.5 Ų | 125.5 | 66% | 0.664 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -80.3 | -5.8 | 158.9 | -66.4 | 0 | 0 | 0 | 0 | 111.7 | R286 | R286-S288 PolarHBondContact O-N 3.07Š|
| 289 | A | 46.9 | Very low | 44.7 | Very low | 69 Ų | 69 | 124.2 Ų | 124.2 | 57% | 0.57 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -74.2 | -41.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L291 L292 D293 | A289-L291 PolarHBondContact O-N 3.43Å; A289-L292 PolarHBondContact O-N 2.96Å; A289-D293 PolarHBondContact O-N 2.98Å; A289-D293 VanDerWaalsContact O-N 3.08Å |
| 290 | D | 46.3 | Very low | 45.2 | Very low | 109 Ų | 109 | 125.5 Ų | 125.5 | 58% | 0.583 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -73.9 | -21.3 | -174.6 | -61.4 | -30 | 0 | 0 | 0 | 114.4 | S287 | S287-D290 WeakPolarHBondContact CB-OD2 3.3Å; S287-D290 PolarHBondContact OG-N 3.49Å; S287-D290 VanDerWaalsContact OG-N 3.16Å; S287-D290 PolarHBondContact OG-OD1 2.93Å; S287-D290 PolarHBondContact OG-OD2 3.01Å |
| 291 | L | 48.7 | Very low | 45.3 | Very low | 124 Ų | 124 | 125.3 Ų | 125.3 | 65% | 0.649 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -86.2 | -24.6 | 177 | -83.2 | 169.2 | 0 | 0 | 0 | 113 | A289 | A289-L291 PolarHBondContact O-N 3.43Å |
| 292 | L | 47.8 | Very low | 46 | Very low | 101 Ų | 101 | 123.4 Ų | 123.4 | 53% | 0.529 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -85.5 | -35 | 175.1 | -79.7 | 161.9 | 0 | 0 | 0 | 111.6 | A289 R294 F295 D296 | A289-L292 PolarHBondContact O-N 2.96Å; L292-R294 PolarHBondContact O-N 2.83Å; L292-F295 PolarHBondContact O-N 3.2Å; L292-D296 PolarHBondContact O-N 2.94Å |
| 293 | D | 47.3 | Very low | 46.2 | Very low | 90 Ų | 90 | 121.4 Ų | 121.4 | 48% | 0.481 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -57.8 | -33.4 | 173.4 | -124.4 | 24.9 | 0 | 0 | 0 | 111.4 | A289 Q297 | A289-D293 PolarHBondContact O-N 2.98Å; A289-D293 VanDerWaalsContact O-N 3.08Å; D293-Q297 WeakPolarHBondContact O-CB 3.46Å; D293-Q297 PolarHBondContact O-N 3.02Å |
| 294 | R | 50.7 | Low | 46.2 | Very low | 186 Ų | 186 | 115 Ų | 115 | 70% | 0.702 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -68.7 | -33.5 | 176.5 | -113.8 | -178.1 | 171.8 | -165.4 | -4.6 | 114.1 | L292 E298 | L292-R294 PolarHBondContact O-N 2.83Å; R294-E298 PolarHBondContact O-N 2.87Å |
| 295 | F | 51.5 | Low | 46.5 | Very low | 144 Ų | 144 | 117.2 Ų | 117.2 | 63% | 0.632 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -78.3 | -37.8 | 176.7 | -89.1 | -83.7 | 0 | 0 | 0 | 111.5 | L292 E298 E299 | L292-F295 PolarHBondContact O-N 3.2Å; F295-E298 PolarHBondContact O-N 2.62Å; F295-E299 PolarHBondContact O-N 2.82Å |
| 296 | D | 51.6 | Low | 46.5 | Very low | 43 Ų | 43 | 114.3 Ų | 114.3 | 23% | 0.23 | 57% | 0.569 | C | S | . | * | H | α-helix | trans | -68.8 | -35.3 | 176.2 | -67.4 | -44.8 | 0 | 0 | 0 | 112.3 | R266 L292 L300 | R266-D296 IonicContact CZ-OD2 3.57Å; R266-D296 VanDerWaalsContact CZ-OD2 3.31Å; R266-D296 IonicContact NH1-OD2 3.73Å; R266-D296 PolarHBondContact NH1-OD2 2.97Å; R266-D296 VanDerWaalsContact NH2-CG 3.27Å; R266-D296 IonicContact NH2-OD1 3.47Å; R266-D296 PolarHBondContact NH2-OD1 3.2Å; R266-D296 IonicContact NH2-OD2 3.08Å; R266-D296 PolarHBondContact NH2-OD2 3.32Å; L292-D296 PolarHBondContact O-N 2.94Å; D296-L300 VanDerWaalsContact O-CB 3.29Å; D296-L300 WeakPolarHBondContact O-CB 3.38Å; D296-L300 WeakPolarHBondContact O-CD1 3.31Å; D296-L300 VanDerWaalsContact O-CG 3.28Å; D296-L300 WeakPolarHBondContact O-CG 3.43Å; D296-L300 PolarHBondContact O-N 3.14Å |
| 297 | Q | 51.5 | Low | 46.4 | Very low | 109 Ų | 109 | 108 Ų | 108 | 51% | 0.509 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.1 | -40.5 | 177.3 | -145.3 | 98.6 | 16.1 | 0 | 0 | 111.3 | D293 D301 | D293-Q297 WeakPolarHBondContact O-CB 3.46Å; D293-Q297 PolarHBondContact O-N 3.02Å; Q297-D301 VanDerWaalsContact O-CB 3.23Å; Q297-D301 WeakPolarHBondContact O-CB 3.36Å; Q297-D301 PolarHBondContact O-N 3.44Å |
| 298 | E | 53.6 | Low | 46.4 | Very low | 129 Ų | 129 | 109.4 Ų | 109.4 | 60% | 0.603 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -67.3 | -35.8 | 177.9 | -77.7 | 178.6 | 171.5 | 0 | 0 | 112.3 | R294 F295 E302 | R294-E298 PolarHBondContact O-N 2.87Å; F295-E298 PolarHBondContact O-N 2.62Å; E298-E302 PolarHBondContact O-N 3.39Å |
| 299 | E | 51.1 | Low | 46.1 | Very low | 129 Ų | 129 | 109.1 Ų | 109.1 | 60% | 0.603 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -77.5 | -35.5 | 178.6 | -157.5 | 171.4 | 178.1 | 0 | 0 | 112.5 | F295 E303 | F295-E299 PolarHBondContact O-N 2.82Å; E299-E303 PolarHBondContact O-N 2.91Å |
| 300 | L | 48.3 | Very low | 45.5 | Very low | 111 Ų | 111 | 111.6 Ų | 111.6 | 58% | 0.581 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -72.4 | -34.1 | 174.3 | -74.4 | 167.9 | 0 | 0 | 0 | 112.9 | D296 E303 A304 | D296-L300 VanDerWaalsContact O-CB 3.29Å; D296-L300 WeakPolarHBondContact O-CB 3.38Å; D296-L300 WeakPolarHBondContact O-CD1 3.31Å; D296-L300 VanDerWaalsContact O-CG 3.28Å; D296-L300 WeakPolarHBondContact O-CG 3.43Å; D296-L300 PolarHBondContact O-N 3.14Å; L300-E303 PolarHBondContact O-N 3.32Å; L300-A304 VanDerWaalsContact O-CB 3.28Å; L300-A304 WeakPolarHBondContact O-CB 3.31Å; L300-A304 PolarHBondContact O-N 2.97Å |
| 301 | D | 45.9 | Very low | 44.8 | Very low | 97 Ų | 97 | 111.2 Ų | 111.2 | 52% | 0.519 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -70.8 | -35 | 175.5 | -71 | -20.9 | 0 | 0 | 0 | 111 | Q297 E305 | Q297-D301 VanDerWaalsContact O-CB 3.23Å; Q297-D301 WeakPolarHBondContact O-CB 3.36Å; Q297-D301 PolarHBondContact O-N 3.44Å; D301-E305 PolarHBondContact O-N 2.92Å |
| 302 | E | 49.7 | Very low | 44.1 | Very low | 122 Ų | 122 | 110.2 Ų | 110.2 | 57% | 0.57 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.1 | -33.1 | 173 | -86.7 | -162 | 157.4 | 0 | 0 | 113.8 | E298 K306 | E298-E302 PolarHBondContact O-N 3.39Å; E302-K306 PolarHBondContact O-N 3.24Å |
| 303 | E | 44.1 | Very low | 43.3 | Very low | 125 Ų | 125 | 113.1 Ų | 113.1 | 58% | 0.584 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -80.6 | -28.2 | 175.7 | -75.2 | -164.8 | 148 | 0 | 0 | 113.1 | E299 L300 K306 S307 | E299-E303 PolarHBondContact O-N 2.91Å; L300-E303 PolarHBondContact O-N 3.32Å; E303-K306 PolarHBondContact O-N 3.04Å; E303-S307 PolarHBondContact O-N 3.45Å; E303-S307 VanDerWaalsContact O-N 3.1Å; E303-S307 PolarHBondContact O-OG 3.31Å |
| 304 | A | 39.8 | Very low | 42.7 | Very low | 53 Ų | 53 | 113.7 Ų | 113.7 | 44% | 0.438 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -69.4 | -33 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L300 S307 S308 | L300-A304 VanDerWaalsContact O-CB 3.28Å; L300-A304 WeakPolarHBondContact O-CB 3.31Å; L300-A304 PolarHBondContact O-N 2.97Å; A304-S307 PolarHBondContact O-OG 2.92Å; A304-S308 WeakPolarHBondContact O-CB 3.14Å; A304-S308 PolarHBondContact O-N 3.31Å; A304-S308 PolarHBondContact O-OG 2.98Å |
| 305 | E | 41.9 | Very low | 41.9 | Very low | 148 Ų | 148 | 110.6 Ų | 110.6 | 69% | 0.692 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -74.4 | -30.2 | 172.4 | -80.4 | -167.9 | 150.2 | 0 | 0 | 113.2 | D301 S308 S309 | D301-E305 PolarHBondContact O-N 2.92Å; E305-S308 PolarHBondContact O-OG 3.37Å; E305-S309 PolarHBondContact O-OG 3.42Å |
| 306 | K | 41.3 | Very low | 41.2 | Very low | 145 Ų | 145 | 110.7 Ų | 110.7 | 63% | 0.63 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -77.2 | -25.1 | 175.7 | -78.9 | 170.9 | -175.2 | 153.4 | 0 | 113.9 | E302 E303 S309 | E302-K306 PolarHBondContact O-N 3.24Å; E303-K306 PolarHBondContact O-N 3.04Å; K306-S309 PolarHBondContact O-OG 3.39Å |
| 307 | S | 37.1 | Very low | 40.5 | Very low | 87 Ų | 87 | 114.3 Ų | 114.3 | 61% | 0.608 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -93.1 | -14.9 | 178.9 | 56.1 | 0 | 0 | 0 | 0 | 114.2 | E303 A304 | E303-S307 PolarHBondContact O-N 3.45Å; E303-S307 VanDerWaalsContact O-N 3.1Å; E303-S307 PolarHBondContact O-OG 3.31Å; A304-S307 PolarHBondContact O-OG 2.92Å |
| 308 | S | 36.7 | Very low | 39.8 | Very low | 81 Ų | 81 | 117.7 Ų | 117.7 | 57% | 0.566 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -92.9 | -10.4 | 175.3 | 54 | 0 | 0 | 0 | 0 | 114 | A304 E305 | A304-S308 WeakPolarHBondContact O-CB 3.14Å; A304-S308 PolarHBondContact O-N 3.31Å; A304-S308 PolarHBondContact O-OG 2.98Å; E305-S308 PolarHBondContact O-OG 3.37Å |
| 309 | S | 36.8 | Very low | 39.1 | Very low | 89 Ų | 89 | 116.6 Ų | 116.6 | 62% | 0.622 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -94 | 7.9 | -178.9 | 46.2 | 0 | 0 | 0 | 0 | 115.5 | E305 K306 | E305-S309 PolarHBondContact O-OG 3.42Å; K306-S309 PolarHBondContact O-OG 3.39Å |
| 310 | T | 34.4 | Very low | 38.5 | Very low | 122 Ų | 122 | 119.4 Ų | 119.4 | 75% | 0.748 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -123.2 | 51.3 | 170.4 | 50.1 | 0 | 0 | 0 | 0 | 112 | ||
| 311 | S | 31.4 | Very low | 37.9 | Very low | 100 Ų | 100 | 125.5 Ų | 125.5 | 70% | 0.699 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -168.8 | 77.8 | 166.4 | 170 | 0 | 0 | 0 | 0 | 111.5 | ||
| 312 | S | 32.9 | Very low | 37.3 | Very low | 103 Ų | 103 | 125.8 Ų | 125.8 | 72% | 0.72 | 72% | 0.716 | S | S | * | * | trans | 167.9 | 125.5 | 145.8 | 37.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 313 | D | 32 | Very low | 36.8 | Very low | 163 Ų | 163 | 128.1 Ų | 128.1 | 87% | 0.872 | 73% | 0.732 | S | S | * | * | trans | 162.4 | 84.7 | 135.8 | -80.7 | -14.4 | 0 | 0 | 0 | 110.8 | ||||
| 314 | S | 34.2 | Very low | 36.3 | Very low | 101 Ų | 101 | 128 Ų | 128 | 71% | 0.706 | 74% | 0.744 | S | S | * | * | trans | -159.3 | 76.1 | 146.9 | 71.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 315 | C | 34.3 | Very low | 36.3 | Very low | 121 Ų | 121 | 130.1 Ų | 130.1 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | trans | -157.4 | 76.4 | 156.5 | -131.3 | 0 | 0 | 0 | 0 | 109.8 | C317 | C315-C317 PolarHBondContact O-N 2.96Š| ||
| 316 | T | 37.1 | Very low | 36.1 | Very low | 146 Ų | 146 | 130.7 Ų | 130.7 | 90% | 0.896 | 77% | 0.769 | S | S | * | * | trans | -74.8 | 114.6 | 161.9 | 38.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 317 | C | 36.9 | Very low | 35.9 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | -62.1 | 128.5 | 176.7 | -53 | 0 | 0 | 0 | 0 | 112.1 | C315 | C315-C317 PolarHBondContact O-N 2.96Š| ||
| 318 | L | 35.9 | Very low | 35.9 | Very low | 181 Ų | 181 | 135.5 Ų | 135.5 | 95% | 0.948 | 80% | 0.795 | S | S | * | * | trans | -92.8 | 96.7 | 154.2 | -103.8 | 123.7 | 0 | 0 | 0 | 108.2 | ||||
| 319 | S | 38.8 | Very low | 35.9 | Very low | 105 Ų | 105 | 136.3 Ų | 136.3 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | trans | -167.4 | 110.9 | 145.7 | 56.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 320 | K | 38.8 | Very low | 36 | Very low | 189 Ų | 189 | 143.7 Ų | 143.7 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | trans | -40.9 | 133.6 | 162.1 | -66.9 | 169.5 | 172.9 | 178.1 | 0 | 110.1 | ||||
| 321 | W | 34.8 | Very low | 36.3 | Very low | 239 Ų | 239 | 143.6 Ų | 143.6 | 91% | 0.905 | 82% | 0.822 | S | S | * | * | 173.2 | 138.5 | 107 | -93.5 | 83.6 | 0 | 0 | 0 | 108.7 | |||||
| 322 | P | 34.8 | Very low | 36.5 | Very low | 102 Ų | 102 | 150 Ų | 150 | 66% | 0.662 | 83% | 0.833 | S | S | * | * | trans | -98.8 | 155.2 | -158.2 | 37.5 | -30.4 | 0 | 0 | 0 | 112.3 | ||||
| 323 | L | 39.3 | Very low | 36.7 | Very low | 171 Ų | 171 | 152.7 Ų | 152.7 | 90% | 0.895 | 84% | 0.838 | S | S | * | * | trans | 179.1 | 142.4 | 141.4 | -94.2 | 152.4 | 0 | 0 | 0 | 110.6 | ||||
| 324 | C | 34 | Very low | 36.9 | Very low | 123 Ų | 123 | 151.1 Ų | 151.1 | 83% | 0.831 | 83% | 0.834 | S | S | * | * | trans | 77.4 | 83.2 | 177.4 | -65 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 325 | A | 39.2 | Very low | 37 | Very low | 97 Ų | 97 | 152.1 Ų | 152.1 | 80% | 0.802 | 84% | 0.836 | S | S | * | * | 78.5 | 108.6 | 60.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 326 | N | 37.2 | Very low | 37.1 | Very low | 160 Ų | 160 | 156.9 Ų | 156.9 | 86% | 0.856 | 84% | 0.836 | S | S | * | * | trans | 62.4 | 109.3 | 143.1 | -90 | -10.5 | 0 | 0 | 0 | 122.1 | ||||
| 327 | R | 37.7 | Very low | 37.3 | Very low | 254 Ų | 254 | 155.6 Ų | 155.6 | 96% | 0.958 | 83% | 0.831 | S | S | * | * | 164.9 | 116.2 | 118.3 | -87.2 | 172.6 | -162 | -160.7 | 5.6 | 105.3 | |||||
| 328 | G | 36.6 | Very low | 37.6 | Very low | 80 Ų | 80 | 155.6 Ų | 155.6 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | 149.5 | 124.5 | 54.2 | 0 | 0 | 0 | 0 | 0 | 105.3 | |||||
| 329 | A | 37.6 | Very low | 37.7 | Very low | 98 Ų | 98 | 153.5 Ų | 153.5 | 81% | 0.81 | 82% | 0.823 | S | S | * | * | trans | -78.5 | 152.4 | -167.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 330 | R | 38.4 | Very low | 37.7 | Very low | 243 Ų | 243 | 157.4 Ų | 157.4 | 92% | 0.917 | 83% | 0.83 | S | S | * | * | trans | -166.3 | 151.8 | 133 | -101.5 | 167.8 | -165.3 | -153 | 4.5 | 111.3 | ||||
| 331 | P | 40.2 | Very low | 37.6 | Very low | 121 Ų | 121 | 155.1 Ų | 155.1 | 79% | 0.786 | 83% | 0.825 | S | S | * | * | trans | -95.4 | 150.9 | -151.1 | 36.2 | -33.2 | 0 | 0 | 0 | 114.7 | ||||
| 332 | Y | 36.2 | Very low | 37.6 | Very low | 235 Ų | 235 | 150.6 Ų | 150.6 | 92% | 0.922 | 82% | 0.819 | S | S | * | * | trans | -71.7 | 132.1 | 173.4 | -77.1 | -91.1 | 0 | 0 | 0 | 112 | ||||
| 333 | L | 36.1 | Very low | 37.9 | Very low | 159 Ų | 159 | 156.5 Ų | 156.5 | 83% | 0.832 | 83% | 0.828 | S | S | * | * | trans | -108.8 | 118.4 | 172.1 | -138.4 | 149.4 | 0 | 0 | 0 | 107.4 | V335 | L333-V335 HydrophobicContact CD2-CG2 4.4Š| ||
| 334 | V | 36.3 | Very low | 38 | Very low | 129 Ų | 129 | 154.8 Ų | 154.8 | 78% | 0.782 | 82% | 0.819 | S | S | * | * | trans | -80.7 | 120.2 | -178.4 | 174.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 335 | V | 37.3 | Very low | 38.3 | Very low | 123 Ų | 123 | 156.7 Ų | 156.7 | 75% | 0.745 | 82% | 0.82 | S | S | * | * | trans | -127.1 | 122.4 | 167.9 | -176.5 | 0 | 0 | 0 | 0 | 108.7 | L333 | L333-V335 HydrophobicContact CD2-CG2 4.4Š| ||
| 336 | R | 36.8 | Very low | 38.3 | Very low | 221 Ų | 221 | 157.1 Ų | 157.1 | 83% | 0.834 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 136.7 | 174 | -65.1 | -179 | 177.5 | -164.6 | -1 | 109.5 | ||
| 337 | P | 41.1 | Very low | 38.2 | Very low | 119 Ų | 119 | 154.6 Ų | 154.6 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 144.2 | 167.4 | 30.7 | -29.7 | 0 | 0 | 0 | 110.8 | ||
| 338 | P | 41.9 | Very low | 38.4 | Very low | 119 Ų | 119 | 148.2 Ų | 148.2 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 149.4 | -175.8 | 34.5 | -32.6 | 0 | 0 | 0 | 112.8 | ||
| 339 | V | 37.9 | Very low | 38.5 | Very low | 136 Ų | 136 | 150 Ų | 150 | 82% | 0.824 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 126.7 | 161.5 | 171.5 | 0 | 0 | 0 | 0 | 108.4 | ||
| 340 | Q | 38.6 | Very low | 38.7 | Very low | 188 Ų | 188 | 154 Ų | 154 | 88% | 0.879 | 81% | 0.814 | S | S | * | * | trans | -155.1 | 115.2 | 154.7 | -116.2 | 169.2 | 4.3 | 0 | 0 | 112 | ||||
| 341 | I | 38.4 | Very low | 38.7 | Very low | 141 Ų | 141 | 147 Ų | 147 | 72% | 0.723 | 80% | 0.802 | S | S | * | * | trans | -75.8 | 158.4 | 161 | -70 | 166.6 | 0 | 0 | 0 | 107.8 | ||||
| 342 | D | 34.9 | Very low | 38.6 | Very low | 143 Ų | 143 | 148.4 Ų | 148.4 | 77% | 0.765 | 80% | 0.803 | S | S | * | * | trans | 87.6 | 106.6 | 177.4 | -60.4 | -33.9 | 0 | 0 | 0 | 115 | ||||
| 343 | R | 41.1 | Very low | 38.6 | Very low | 227 Ų | 227 | 144.7 Ų | 144.7 | 86% | 0.857 | 80% | 0.798 | S | S | * | * | -179.4 | 123.1 | 124.3 | -98.3 | 171.6 | -172.1 | -160.5 | 3.6 | 113 | |||||
| 344 | L | 40.6 | Very low | 38.7 | Very low | 134 Ų | 134 | 144.1 Ų | 144.1 | 70% | 0.702 | 79% | 0.791 | S | S | * | * | trans | 81.6 | 97.1 | 132.5 | -53.8 | 165.5 | 0 | 0 | 0 | 116.7 | ||||
| 345 | L | 40.2 | Very low | 38.6 | Very low | 164 Ų | 164 | 146.3 Ų | 146.3 | 86% | 0.859 | 80% | 0.795 | S | S | * | * | 67.6 | 111.2 | 75.5 | -66.6 | 175.4 | 0 | 0 | 0 | 114.1 | |||||
| 346 | A | 38.8 | Very low | 38.6 | Very low | 105 Ų | 105 | 143.7 Ų | 143.7 | 87% | 0.868 | 79% | 0.793 | S | S | * | * | 174.6 | 131.6 | 118.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 347 | S | 36.4 | Very low | 38.5 | Very low | 107 Ų | 107 | 141.7 Ų | 141.7 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | trans | -77.4 | -179.5 | -176.8 | 54.7 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 348 | P | 41.2 | Very low | 38.1 | Very low | 120 Ų | 120 | 144.6 Ų | 144.6 | 78% | 0.779 | 80% | 0.803 | S | S | * | * | -146.3 | 169.3 | 89.8 | 34.3 | -14.2 | 0 | 0 | 0 | 115.5 | |||||
| 349 | P | 39.7 | Very low | 37.9 | Very low | 119 Ų | 119 | 145.2 Ų | 145.2 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | -93.3 | 150.5 | -166.1 | 36.5 | -31.6 | 0 | 0 | 0 | 113.5 | ||||
| 350 | L | 40 | Very low | 37.7 | Very low | 181 Ų | 181 | 144.6 Ų | 144.6 | 95% | 0.948 | 81% | 0.807 | S | S | * | * | trans | -116.5 | 104.9 | 167.5 | -87.8 | 161.1 | 0 | 0 | 0 | 109.6 | ||||
| 351 | S | 39.9 | Very low | 37.5 | Very low | 95 Ų | 95 | 146.8 Ų | 146.8 | 66% | 0.664 | 81% | 0.808 | S | S | * | * | trans | -81.7 | 144.2 | 163.6 | 50.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 352 | N | 36.4 | Very low | 37.4 | Very low | 151 Ų | 151 | 148.3 Ų | 148.3 | 81% | 0.807 | 81% | 0.813 | S | S | * | * | trans | 69.7 | 92.8 | 157.5 | -55.2 | -21.3 | 0 | 0 | 0 | 117.9 | ||||
| 353 | L | 37.2 | Very low | 37.3 | Very low | 158 Ų | 158 | 150.3 Ų | 150.3 | 83% | 0.827 | 82% | 0.817 | S | S | * | * | trans | -142.7 | 99.4 | 138.4 | -135.7 | 91.2 | 0 | 0 | 0 | 109.2 | ||||
| 354 | E | 38.3 | Very low | 37.2 | Very low | 146 Ų | 146 | 144.1 Ų | 144.1 | 68% | 0.682 | 82% | 0.815 | S | S | * | * | 52.4 | 108.2 | 128.9 | -65.3 | -170.9 | 120.9 | 0 | 0 | 118.7 | |||||
| 355 | M | 35 | Very low | 37 | Very low | 176 Ų | 176 | 145.1 Ų | 145.1 | 87% | 0.867 | 82% | 0.821 | S | S | * | * | 67.2 | 103.9 | 99.7 | -97.7 | -168.9 | -65.3 | 0 | 0 | 114.1 | |||||
| 356 | G | 37 | Very low | 36.8 | Very low | 68 Ų | 68 | 142.8 Ų | 142.8 | 70% | 0.701 | 82% | 0.818 | S | S | * | * | trans | 169.6 | 103.2 | 163.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 357 | L | 34.3 | Very low | 36.7 | Very low | 178 Ų | 178 | 141 Ų | 141 | 93% | 0.932 | 81% | 0.811 | S | S | * | * | trans | 79.7 | 78.7 | 165.2 | -65.7 | 107.6 | 0 | 0 | 0 | 118.5 | ||||
| 358 | M | 33.2 | Very low | 36.7 | Very low | 180 Ų | 180 | 142.3 Ų | 142.3 | 89% | 0.887 | 82% | 0.816 | S | S | * | * | -86.7 | 163.4 | 128.9 | -98.2 | -150.3 | 166.7 | 0 | 0 | 109.5 | |||||
| 359 | T | 36.5 | Very low | 36.5 | Very low | 133 Ų | 133 | 141.1 Ų | 141.1 | 82% | 0.816 | 82% | 0.816 | S | S | * | * | trans | 86 | 95.2 | 169.1 | 72.5 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 360 | S | 34.4 | Very low | 36.7 | Very low | 123 Ų | 123 | 143.6 Ų | 143.6 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | -165.4 | 91.7 | 126.3 | 60 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 361 | Y | 33.7 | Very low | 36.6 | Very low | 233 Ų | 233 | 141.2 Ų | 141.2 | 91% | 0.914 | 81% | 0.814 | S | S | * | * | trans | -92 | 109.8 | 156.1 | -129.9 | -90.5 | 0 | 0 | 0 | 105 | ||||
| 362 | Q | 37.5 | Very low | 36.6 | Very low | 174 Ų | 174 | 141.9 Ų | 141.9 | 81% | 0.813 | 82% | 0.819 | S | S | * | * | trans | 173.4 | 107.3 | 154.4 | -101.8 | 167.1 | -49.2 | 0 | 0 | 111.7 | ||||
| 363 | Q | 33.1 | Very low | 36.8 | Very low | 184 Ų | 184 | 140.6 Ų | 140.6 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | 62.6 | 96.7 | 116.8 | -148.3 | 156.2 | -12.7 | 0 | 0 | 119.5 | |||||
| 364 | A | 37 | Very low | 37 | Very low | 97 Ų | 97 | 139.2 Ų | 139.2 | 80% | 0.802 | 82% | 0.817 | S | S | * | * | trans | -172.3 | 142.7 | 152.5 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 365 | D | 37 | Very low | 37.1 | Very low | 155 Ų | 155 | 140 Ų | 140 | 83% | 0.829 | 83% | 0.825 | S | S | * | * | cis | -163.7 | 160.8 | -11.1 | -139.4 | -23.7 | 0 | 0 | 0 | 105.6 | ||||
| 366 | S | 36.5 | Very low | 37.2 | Very low | 116 Ų | 116 | 143 Ų | 143 | 81% | 0.811 | 83% | 0.827 | S | S | * | * | trans | -66.8 | 143.9 | -172.1 | 45.2 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 367 | G | 35.6 | Very low | 37.2 | Very low | 68 Ų | 68 | 148 Ų | 148 | 70% | 0.701 | 84% | 0.836 | S | S | * | * | trans | -173.9 | 133.5 | 162.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 368 | P | 37.4 | Very low | 37.7 | Very low | 134 Ų | 134 | 150.9 Ų | 150.9 | 87% | 0.87 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -85 | 122.5 | -161.2 | 32.9 | -32 | 0 | 0 | 0 | 112.6 | ||
| 369 | A | 37.4 | Very low | 38.1 | Very low | 94 Ų | 94 | 152.9 Ų | 152.9 | 78% | 0.777 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 126.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | T371 | A369-T371 PolarHBondContact O-N 3.28Š|
| 370 | I | 43.3 | Very low | 38.3 | Very low | 172 Ų | 172 | 153.5 Ų | 153.5 | 88% | 0.882 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 124.1 | 177.6 | -67.2 | 160.7 | 0 | 0 | 0 | 111 | ||
| 371 | T | 38.5 | Very low | 38.6 | Very low | 130 Ų | 130 | 158.2 Ų | 158.2 | 80% | 0.798 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 123.4 | 175.1 | 46.3 | 0 | 0 | 0 | 0 | 111.7 | A369 | A369-T371 PolarHBondContact O-N 3.28Š|
| 372 | S | 39.5 | Very low | 39 | Very low | 110 Ų | 110 | 158.2 Ų | 158.2 | 77% | 0.769 | 83% | 0.827 | S | S | * | * | trans | -121.6 | 125.5 | 150 | 84.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 373 | P | 39.8 | Very low | 39.1 | Very low | 124 Ų | 124 | 157.8 Ų | 157.8 | 81% | 0.805 | 83% | 0.83 | S | S | * | * | trans | -107 | 108.2 | 174.8 | 32.6 | -21.8 | 0 | 0 | 0 | 110.2 | ||||
| 374 | V | 42.9 | Very low | 39.6 | Very low | 129 Ų | 129 | 154.1 Ų | 154.1 | 78% | 0.782 | 83% | 0.825 | S | S | * | * | trans | -113.4 | 121.7 | 157.6 | -179.8 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 375 | L | 39.7 | Very low | 40.1 | Very low | 161 Ų | 161 | 161.3 Ų | 161.3 | 84% | 0.843 | 85% | 0.848 | S | S | * | * | trans | 107.1 | 91.8 | 175 | -61.4 | 158 | 0 | 0 | 0 | 115.7 | ||||
| 376 | R | 37.2 | Very low | 40.3 | Very low | 241 Ų | 241 | 161.6 Ų | 161.6 | 91% | 0.909 | 85% | 0.849 | S | S | * | * | 167.6 | 118.9 | 120.1 | -94.4 | 173.2 | -154.6 | -145.7 | 4.5 | 108.7 | |||||
| 377 | L | 37.9 | Very low | 40.5 | Very low | 173 Ų | 173 | 164 Ų | 164 | 91% | 0.906 | 85% | 0.851 | S | S | * | * | trans | -163.7 | 94.7 | 139.6 | -102.4 | 154 | 0 | 0 | 0 | 108.6 | ||||
| 378 | R | 42.9 | Very low | 40.8 | Very low | 238 Ų | 238 | 169.3 Ų | 169.3 | 90% | 0.898 | 86% | 0.859 | S | S | * | * | trans | -99.1 | 130.3 | 162.1 | -135.9 | -179.1 | -176.6 | -176.8 | 1 | 105.3 | ||||
| 379 | R | 41.4 | Very low | 41 | Very low | 221 Ų | 221 | 171.4 Ų | 171.4 | 83% | 0.834 | 86% | 0.859 | S | S | * | * | trans | 69.5 | 116.2 | 172.3 | -66.8 | 179.5 | 179.5 | -176.4 | -0.4 | 116.3 | ||||
| 380 | L | 40.8 | Very low | 41.2 | Very low | 147 Ų | 147 | 176.3 Ų | 176.3 | 77% | 0.77 | 86% | 0.864 | S | S | * | * | -172.3 | 130.8 | 111.7 | -93.6 | 159.8 | 0 | 0 | 0 | 111 | |||||
| 381 | R | 40.8 | Very low | 41 | Very low | 222 Ų | 222 | 176.5 Ų | 176.5 | 84% | 0.838 | 86% | 0.862 | S | S | * | * | trans | 61.3 | 109.1 | 147.8 | -71.5 | 174.5 | 179.1 | -178.6 | -1.8 | 118.2 | ||||
| 382 | R | 42.1 | Very low | 41.2 | Very low | 232 Ų | 232 | 179.9 Ų | 179.9 | 88% | 0.875 | 87% | 0.867 | S | S | * | * | 33.6 | 105.6 | 80.3 | -79.8 | -168.5 | -159.5 | -161.3 | 5.2 | 113.1 | |||||
| 383 | L | 40.2 | Very low | 41.4 | Very low | 166 Ų | 166 | 185.2 Ų | 185.2 | 87% | 0.869 | 88% | 0.875 | S | S | * | * | 169.5 | 139.8 | 116.7 | -87.6 | 158 | 0 | 0 | 0 | 111.4 | |||||
| 384 | S | 44.9 | Very low | 41.5 | Very low | 107 Ų | 107 | 190.3 Ų | 190.3 | 75% | 0.748 | 88% | 0.88 | S | S | * | * | trans | 70.6 | 122.3 | 154.1 | 61.5 | 0 | 0 | 0 | 0 | 122 | ||||
| 385 | L | 47.3 | Very low | 41.4 | Very low | 247 Ų | 247 | 195.9 Ų | 195.9 | 100% | 1.293 | 89% | 0.889 | S | S | * | * | trans | 86.7 | 0 | 165.4 | -67.8 | 162.3 | 0 | 0 | 0 | 117.8 |
Retrieved 385 of 385 residues in 92 ms
(Link to these results)