| 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 | 64.6 | Low | 77.9 | Confident | 186 Ų | 186 | 129 Ų | 129 | 92% | 0.916 | 63% | 0.632 | S | S | * | * | 0 | -35.5 | 0 | -147.3 | 168.5 | 76.2 | 0 | 0 | 114.1 | |||||
| 2 | M | 78.8 | Confident | 78.3 | Confident | 164 Ų | 164 | 123.3 Ų | 123.3 | 81% | 0.808 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -63.9 | -39.2 | 179.2 | -68.2 | -168.7 | -166.1 | 0 | 0 | 114.3 | M4 K5 M6 | M2-M4 PolarHBondContact O-N 3.04Å; M2-K5 PolarHBondContact O-N 3.15Å; M2-M6 PolarHBondContact O-N 3.45Å; M2-M6 VanDerWaalsContact O-N 3.09Å |
| 3 | M | 76.8 | Confident | 78.6 | Confident | 144 Ų | 144 | 124.6 Ų | 124.6 | 71% | 0.709 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -59 | -43.5 | 179.6 | -90.5 | -164.3 | -88.7 | 0 | 0 | 113.2 | K5 M6 I7 | M3-K5 VanDerWaalsContact C-N 3.32Å; M3-K5 PolarHBondContact O-N 3.06Å; M3-M6 HydrophobicContact CG-CE 4.26Å; M3-M6 PolarHBondContact O-N 3.06Å; M3-I7 WeakPolarHBondContact O-CG1 3.41Å; M3-I7 PolarHBondContact O-N 2.95Å |
| 4 | M | 77.8 | Confident | 79.1 | Confident | 153 Ų | 153 | 120.9 Ų | 120.9 | 75% | 0.754 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.7 | -38.1 | 178.1 | -75.6 | -177.1 | 164.8 | 0 | 0 | 112.4 | M2 I7 M8 | M2-M4 PolarHBondContact O-N 3.04Å; M4-I7 PolarHBondContact O-N 3.11Å; M4-M8 WeakPolarHBondContact O-CB 3.43Å; M4-M8 PolarHBondContact O-N 3.19Å |
| 5 | K | 79.4 | Confident | 79.6 | Confident | 125 Ų | 125 | 119.2 Ų | 119.2 | 54% | 0.543 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -64.7 | -41.5 | 175.5 | -70.9 | -174 | 174.4 | -175.1 | 0 | 111.7 | M2 M3 M8 I9 | M2-K5 PolarHBondContact O-N 3.15Å; M3-K5 VanDerWaalsContact C-N 3.32Å; M3-K5 PolarHBondContact O-N 3.06Å; K5-M8 PolarHBondContact O-N 3.16Å; K5-I9 WeakPolarHBondContact O-CD1 3.49Å; K5-I9 VanDerWaalsContact O-CG1 3.25Å; K5-I9 WeakPolarHBondContact O-CG1 3.17Å; K5-I9 PolarHBondContact O-N 3Å |
| 6 | M | 78.7 | Confident | 79.9 | Confident | 112 Ų | 112 | 119.9 Ų | 119.9 | 55% | 0.552 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64.2 | -43.8 | 176.8 | -69.6 | -165.5 | -57.7 | 0 | 0 | 112.1 | M2 M3 M8 I9 M10 | M2-M6 PolarHBondContact O-N 3.45Å; M2-M6 VanDerWaalsContact O-N 3.09Å; M3-M6 HydrophobicContact CG-CE 4.26Å; M3-M6 PolarHBondContact O-N 3.06Å; M6-M8 PolarHBondContact O-N 2.99Å; M6-I9 PolarHBondContact O-N 2.81Å; M6-M10 WeakPolarHBondContact O-CG 3.44Å; M6-M10 PolarHBondContact O-N 2.78Å |
| 7 | I | 79 | Confident | 80.2 | Confident | 87 Ų | 87 | 116.9 Ų | 116.9 | 45% | 0.446 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -60.1 | -47.7 | 177.4 | -66.5 | 166.3 | 0 | 0 | 0 | 110.4 | M3 M4 I9 M10 M11 | M3-I7 WeakPolarHBondContact O-CG1 3.41Å; M3-I7 PolarHBondContact O-N 2.95Å; M4-I7 PolarHBondContact O-N 3.11Å; I7-I9 VanDerWaalsContact C-N 3.33Å; I7-I9 PolarHBondContact O-N 3.36Å; I7-M10 HydrophobicContact CG1-CE 4.33Å; I7-M10 PolarHBondContact O-N 3.28Å; I7-M11 HydrophobicContact CG2-CG 4.42Å; I7-M11 HydrophobicContact CG2-SD 4.14Å; I7-M11 WeakPolarHBondContact O-CG 3.49Å; I7-M11 PolarHBondContact O-N 2.78Å |
| 8 | M | 79.9 | Confident | 80.6 | Confident | 120 Ų | 120 | 115.7 Ų | 115.7 | 59% | 0.591 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -60.1 | -41.9 | 178.4 | -169 | -179.3 | 70.6 | 0 | 0 | 112.1 | M4 K5 M6 M10 M11 C12 | M4-M8 WeakPolarHBondContact O-CB 3.43Å; M4-M8 PolarHBondContact O-N 3.19Å; K5-M8 PolarHBondContact O-N 3.16Å; M6-M8 PolarHBondContact O-N 2.99Å; M8-M10 PolarHBondContact O-N 2.94Å; M8-M11 PolarHBondContact O-N 2.88Å; M8-C12 WeakPolarHBondContact O-CB 3.38Å; M8-C12 PolarHBondContact O-N 2.97Å; M8-C12 PolarHBondContact O-SG 3.24Å |
| 9 | I | 81.4 | Confident | 81 | Confident | 89 Ų | 89 | 114.6 Ų | 114.6 | 46% | 0.456 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -63.4 | -42.1 | 176.4 | -68.4 | 163.6 | 0 | 0 | 0 | 111.4 | K5 M6 I7 C12 K13 | K5-I9 WeakPolarHBondContact O-CD1 3.49Å; K5-I9 VanDerWaalsContact O-CG1 3.25Å; K5-I9 WeakPolarHBondContact O-CG1 3.17Å; K5-I9 PolarHBondContact O-N 3Å; M6-I9 PolarHBondContact O-N 2.81Å; I7-I9 VanDerWaalsContact C-N 3.33Å; I7-I9 PolarHBondContact O-N 3.36Å; I9-C12 PolarHBondContact O-N 3.45Å; I9-K13 HydrophobicContact CG2-CD 4.27Å; I9-K13 WeakPolarHBondContact O-CG 3.21Å; I9-K13 PolarHBondContact O-N 3.31Å |
| 10 | M | 79.6 | Confident | 81.4 | Confident | 120 Ų | 120 | 114.2 Ų | 114.2 | 59% | 0.591 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.2 | -42.3 | 177 | -69.5 | -170.5 | -55.7 | 0 | 0 | 111.9 | M6 I7 M8 K13 S14 | M6-M10 WeakPolarHBondContact O-CG 3.44Å; M6-M10 PolarHBondContact O-N 2.78Å; I7-M10 HydrophobicContact CG1-CE 4.33Å; I7-M10 PolarHBondContact O-N 3.28Å; M8-M10 PolarHBondContact O-N 2.94Å; M10-K13 PolarHBondContact O-N 3.02Å; M10-S14 WeakPolarHBondContact O-CB 3.26Å; M10-S14 PolarHBondContact O-N 3.08Å |
| 11 | M | 81.2 | Confident | 81.7 | Confident | 119 Ų | 119 | 117 Ų | 117 | 59% | 0.586 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.7 | -45.1 | 175.8 | -67.3 | -175.5 | 86.2 | 0 | 0 | 111.2 | I7 M8 K13 S14 I15 | I7-M11 HydrophobicContact CG2-CG 4.42Å; I7-M11 HydrophobicContact CG2-SD 4.14Å; I7-M11 WeakPolarHBondContact O-CG 3.49Å; I7-M11 PolarHBondContact O-N 2.78Å; M8-M11 PolarHBondContact O-N 2.88Å; M11-K13 VanDerWaalsContact C-N 3.33Å; M11-K13 PolarHBondContact O-N 2.89Å; M11-S14 PolarHBondContact O-N 3.08Å; M11-I15 VanDerWaalsContact O-CG1 3.29Å; M11-I15 WeakPolarHBondContact O-CG1 2.99Å; M11-I15 PolarHBondContact O-N 3.1Å |
| 12 | C | 82.9 | Confident | 82.9 | Confident | 60 Ų | 60 | 114.7 Ų | 114.7 | 41% | 0.405 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.5 | -39.6 | 176.4 | -72.4 | 0 | 0 | 0 | 0 | 112.5 | M8 I9 H16 | M8-C12 WeakPolarHBondContact O-CB 3.38Å; M8-C12 PolarHBondContact O-N 2.97Å; M8-C12 PolarHBondContact O-SG 3.24Å; I9-C12 PolarHBondContact O-N 3.45Å; C12-H16 WeakPolarHBondContact O-CB 2.89Å; C12-H16 PolarHBondContact O-N 2.84Å; C12-H16 PolarHBondContact O-ND1 3.11Å |
| 13 | K | 82.2 | Confident | 83.4 | Confident | 141 Ų | 141 | 110.1 Ų | 110.1 | 61% | 0.613 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66.1 | -41.3 | 175.7 | -75.8 | 178.8 | 177.2 | -175.3 | 0 | 111.9 | I9 M10 M11 H16 C17 | I9-K13 HydrophobicContact CG2-CD 4.27Å; I9-K13 WeakPolarHBondContact O-CG 3.21Å; I9-K13 PolarHBondContact O-N 3.31Å; M10-K13 PolarHBondContact O-N 3.02Å; M11-K13 VanDerWaalsContact C-N 3.33Å; M11-K13 PolarHBondContact O-N 2.89Å; K13-H16 PolarHBondContact O-N 3.2Å; K13-C17 PolarHBondContact O-N 3.37Å |
| 14 | S | 84.9 | Confident | 83.9 | Confident | 73 Ų | 73 | 107.2 Ų | 107.2 | 51% | 0.51 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.5 | -46.2 | 176 | 179.1 | 0 | 0 | 0 | 0 | 111.4 | M10 M11 H16 C17 V18 | M10-S14 WeakPolarHBondContact O-CB 3.26Å; M10-S14 PolarHBondContact O-N 3.08Å; M11-S14 PolarHBondContact O-N 3.08Å; S14-H16 PolarHBondContact O-N 3.1Å; S14-C17 PolarHBondContact O-N 2.63Å; S14-V18 WeakPolarHBondContact O-CG2 3.25Å; S14-V18 PolarHBondContact O-N 3.2Å |
| 15 | I | 86.5 | Confident | 84.3 | Confident | 95 Ų | 95 | 101.1 Ų | 101.1 | 49% | 0.487 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.1 | -45.8 | 177.5 | -66.4 | 164.3 | 0 | 0 | 0 | 110.9 | M11 C17 V18 I19 | M11-I15 VanDerWaalsContact O-CG1 3.29Å; M11-I15 WeakPolarHBondContact O-CG1 2.99Å; M11-I15 PolarHBondContact O-N 3.1Å; I15-C17 PolarHBondContact O-N 2.96Å; I15-V18 PolarHBondContact O-N 3.07Å; I15-I19 HydrophobicContact CG2-CD1 3.73Å; I15-I19 HydrophobicContact CG2-CG1 4.41Å; I15-I19 WeakPolarHBondContact O-CG1 3.48Å; I15-I19 PolarHBondContact O-N 3.05Å |
| 16 | H | 85 | Confident | 84.6 | Confident | 131 Ų | 131 | 98.9 Ų | 98.9 | 61% | 0.606 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61 | -42 | 177.1 | -80.2 | 107.5 | 0 | 0 | 0 | 112.5 | C12 K13 S14 I19 L20 | C12-H16 WeakPolarHBondContact O-CB 2.89Å; C12-H16 PolarHBondContact O-N 2.84Å; C12-H16 PolarHBondContact O-ND1 3.11Å; K13-H16 PolarHBondContact O-N 3.2Å; S14-H16 PolarHBondContact O-N 3.1Å; H16-I19 PolarHBondContact O-N 2.75Å; H16-L20 WeakPolarHBondContact O-CB 3.3Å; H16-L20 PolarHBondContact O-N 3.01Å |
| 17 | C | 85.5 | Confident | 84.9 | Confident | 68 Ų | 68 | 98 Ų | 98 | 46% | 0.459 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61 | -46.2 | 175.9 | -79.6 | 0 | 0 | 0 | 0 | 111.3 | K13 S14 I15 I19 L20 Y21 | K13-C17 PolarHBondContact O-N 3.37Å; S14-C17 PolarHBondContact O-N 2.63Å; I15-C17 PolarHBondContact O-N 2.96Å; C17-I19 PolarHBondContact O-N 2.71Å; C17-L20 PolarHBondContact O-N 2.82Å; C17-Y21 HydrophobicContact CB-CD2 4.48Å; C17-Y21 HydrophobicContact CB-CE2 4.39Å; C17-Y21 WeakPolarHBondContact O-CD2 3.39Å; C17-Y21 PolarHBondContact O-N 3.11Å |
| 18 | V | 86.4 | Confident | 85.1 | Confident | 96 Ų | 96 | 97.7 Ų | 97.7 | 58% | 0.582 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.5 | -45.1 | 179.9 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | S14 I15 L20 Y21 F22 | S14-V18 WeakPolarHBondContact O-CG2 3.25Å; S14-V18 PolarHBondContact O-N 3.2Å; I15-V18 PolarHBondContact O-N 3.07Å; V18-L20 VanDerWaalsContact C-N 3.35Å; V18-L20 PolarHBondContact O-N 3.12Å; V18-Y21 PolarHBondContact O-N 3.15Å; V18-F22 WeakPolarHBondContact O-CB 3.45Å; V18-F22 PolarHBondContact O-N 3.26Å |
| 19 | I | 88.7 | Confident | 85.1 | Confident | 94 Ų | 94 | 96.3 Ų | 96.3 | 48% | 0.482 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.4 | -44 | 177.3 | -65.8 | 168.9 | 0 | 0 | 0 | 110.6 | I15 H16 C17 F22 V23 | I15-I19 HydrophobicContact CG2-CD1 3.73Å; I15-I19 HydrophobicContact CG2-CG1 4.41Å; I15-I19 WeakPolarHBondContact O-CG1 3.48Å; I15-I19 PolarHBondContact O-N 3.05Å; H16-I19 PolarHBondContact O-N 2.75Å; C17-I19 PolarHBondContact O-N 2.71Å; I19-F22 PolarHBondContact O-N 2.75Å; I19-V23 HydrophobicContact CG2-CG2 4.29Å; I19-V23 VanDerWaalsContact O-CG2 3.32Å; I19-V23 WeakPolarHBondContact O-CG2 3.48Å; I19-V23 PolarHBondContact O-N 2.86Å |
| 20 | L | 89 | Confident | 84.8 | Confident | 106 Ų | 106 | 96.7 Ų | 96.7 | 56% | 0.555 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61 | -47.7 | 179.5 | -168.5 | 84.3 | 0 | 0 | 0 | 111.3 | H16 C17 V18 F22 V23 I24 | H16-L20 WeakPolarHBondContact O-CB 3.3Å; H16-L20 PolarHBondContact O-N 3.01Å; C17-L20 PolarHBondContact O-N 2.82Å; V18-L20 VanDerWaalsContact C-N 3.35Å; V18-L20 PolarHBondContact O-N 3.12Å; L20-F22 VanDerWaalsContact C-N 3.32Å; L20-F22 PolarHBondContact O-N 3.36Å; L20-V23 PolarHBondContact O-N 3.45Å; L20-I24 HydrophobicContact CD2-CD1 4.23Å; L20-I24 HydrophobicContact CG-CD1 3.94Å; L20-I24 WeakPolarHBondContact O-CB 3.46Å; L20-I24 VanDerWaalsContact O-CG1 3.26Å; L20-I24 WeakPolarHBondContact O-CG1 3.34Å; L20-I24 PolarHBondContact O-N 3.09Å |
| 21 | Y | 88.3 | Confident | 84.6 | Confident | 173 Ų | 173 | 94.1 Ų | 94.1 | 68% | 0.678 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.8 | -38.5 | 176.8 | -76.8 | -64.2 | 0 | 0 | 0 | 112.3 | C17 V18 G25 | C17-Y21 HydrophobicContact CB-CD2 4.48Å; C17-Y21 HydrophobicContact CB-CE2 4.39Å; C17-Y21 WeakPolarHBondContact O-CD2 3.39Å; C17-Y21 PolarHBondContact O-N 3.11Å; V18-Y21 PolarHBondContact O-N 3.15Å; Y21-G25 PolarHBondContact O-N 3.31Å |
| 22 | F | 88.3 | Confident | 84 | Confident | 138 Ų | 138 | 90.5 Ų | 90.5 | 61% | 0.605 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.9 | -45.4 | 176.4 | -173.9 | -102.7 | 0 | 0 | 0 | 111.9 | V18 I19 L20 G25 L26 | V18-F22 WeakPolarHBondContact O-CB 3.45Å; V18-F22 PolarHBondContact O-N 3.26Å; I19-F22 PolarHBondContact O-N 2.75Å; L20-F22 VanDerWaalsContact C-N 3.32Å; L20-F22 PolarHBondContact O-N 3.36Å; F22-G25 PolarHBondContact O-N 3.07Å; F22-L26 HydrophobicContact CD1-CD1 3.87Å; F22-L26 HydrophobicContact CD1-CG 4.45Å; F22-L26 HydrophobicContact CE1-CD1 3.43Å; F22-L26 VanDerWaalsContact CE1-CD1 3.43Å; F22-L26 HydrophobicContact CE1-CG 4.17Å; F22-L26 HydrophobicContact CZ-CD1 3.99Å; F22-L26 HydrophobicContact CZ-CG 4.36Å; F22-L26 WeakPolarHBondContact O-CG 3.26Å; F22-L26 PolarHBondContact O-N 2.74Å |
| 23 | V | 89.2 | Confident | 83 | Confident | 69 Ų | 69 | 93.3 Ų | 93.3 | 42% | 0.418 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.6 | -43.8 | 178.1 | 173.3 | 0 | 0 | 0 | 0 | 111.3 | I19 L20 G25 L26 I27 | I19-V23 HydrophobicContact CG2-CG2 4.29Å; I19-V23 VanDerWaalsContact O-CG2 3.32Å; I19-V23 WeakPolarHBondContact O-CG2 3.48Å; I19-V23 PolarHBondContact O-N 2.86Å; L20-V23 PolarHBondContact O-N 3.45Å; V23-G25 VanDerWaalsContact C-N 3.31Å; V23-G25 PolarHBondContact O-N 3.35Å; V23-L26 PolarHBondContact O-N 2.82Å; V23-I27 HydrophobicContact CG1-CD1 3.86Å; V23-I27 VanDerWaalsContact O-CG1 3.31Å; V23-I27 WeakPolarHBondContact O-CG1 3.21Å; V23-I27 PolarHBondContact O-N 3.3Å |
| 24 | I | 88.4 | Confident | 82.2 | Confident | 83 Ų | 83 | 95.2 Ų | 95.2 | 43% | 0.426 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.9 | -43.4 | 176 | -68 | 167.2 | 0 | 0 | 0 | 110.3 | L20 L26 I27 T28 | L20-I24 HydrophobicContact CD2-CD1 4.23Å; L20-I24 HydrophobicContact CG-CD1 3.94Å; L20-I24 WeakPolarHBondContact O-CB 3.46Å; L20-I24 VanDerWaalsContact O-CG1 3.26Å; L20-I24 WeakPolarHBondContact O-CG1 3.34Å; L20-I24 PolarHBondContact O-N 3.09Å; I24-L26 PolarHBondContact O-N 3.42Å; I24-I27 PolarHBondContact O-N 2.77Å; I24-T28 HydrophobicContact CG2-CG2 4.42Å; I24-T28 WeakPolarHBondContact O-CG2 3.33Å; I24-T28 PolarHBondContact O-N 2.91Å; I24-T28 PolarHBondContact O-OG1 3.09Å |
| 25 | G | 85.1 | Confident | 81.2 | Confident | 25 Ų | 25 | 97.8 Ų | 97.8 | 26% | 0.258 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.4 | -41.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y21 F22 V23 T28 I29 | Y21-G25 PolarHBondContact O-N 3.31Å; F22-G25 PolarHBondContact O-N 3.07Å; V23-G25 VanDerWaalsContact C-N 3.31Å; V23-G25 PolarHBondContact O-N 3.35Å; G25-T28 WeakPolarHBondContact CA-OG1 3.43Å; G25-T28 PolarHBondContact O-N 3.31Å; G25-T28 PolarHBondContact O-OG1 3.46Å; G25-I29 WeakPolarHBondContact O-CB 3.32Å; G25-I29 WeakPolarHBondContact O-CD1 3.45Å; G25-I29 WeakPolarHBondContact O-CG1 3.37Å; G25-I29 PolarHBondContact O-N 2.81Å |
| 26 | L | 85.6 | Confident | 79.6 | Confident | 78 Ų | 78 | 99.6 Ų | 99.6 | 41% | 0.408 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.9 | -39.6 | 175.2 | -72.4 | 176.5 | 0 | 0 | 0 | 112.2 | F22 V23 I24 N30 | F22-L26 HydrophobicContact CD1-CD1 3.87Å; F22-L26 HydrophobicContact CD1-CG 4.45Å; F22-L26 HydrophobicContact CE1-CD1 3.43Å; F22-L26 VanDerWaalsContact CE1-CD1 3.43Å; F22-L26 HydrophobicContact CE1-CG 4.17Å; F22-L26 HydrophobicContact CZ-CD1 3.99Å; F22-L26 HydrophobicContact CZ-CG 4.36Å; F22-L26 WeakPolarHBondContact O-CG 3.26Å; F22-L26 PolarHBondContact O-N 2.74Å; V23-L26 PolarHBondContact O-N 2.82Å; I24-L26 PolarHBondContact O-N 3.42Å; L26-N30 WeakPolarHBondContact O-CB 3.31Å; L26-N30 VanDerWaalsContact O-CG 3.28Å; L26-N30 PolarHBondContact O-N 3.29Å; L26-N30 PolarHBondContact O-ND2 3.34Å |
| 27 | I | 86 | Confident | 77.8 | Confident | 94 Ų | 94 | 95 Ų | 95 | 48% | 0.482 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66 | -43.2 | 177 | -67.5 | 166.1 | 0 | 0 | 0 | 110.2 | V23 I24 N30 C31 | V23-I27 HydrophobicContact CG1-CD1 3.86Å; V23-I27 VanDerWaalsContact O-CG1 3.31Å; V23-I27 WeakPolarHBondContact O-CG1 3.21Å; V23-I27 PolarHBondContact O-N 3.3Å; I24-I27 PolarHBondContact O-N 2.77Å; I27-N30 PolarHBondContact O-N 2.88Å; I27-C31 VanDerWaalsContact O-CB 3.3Å; I27-C31 WeakPolarHBondContact O-CB 3.3Å; I27-C31 PolarHBondContact O-N 3.36Å; I27-C31 PolarHBondContact O-SG 3.38Å |
| 28 | T | 83.5 | Confident | 76 | Confident | 80 Ų | 80 | 99.2 Ų | 99.2 | 49% | 0.491 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67 | -38.8 | 178.6 | 51.5 | 0 | 0 | 0 | 0 | 112.1 | I24 G25 C31 A32 | I24-T28 HydrophobicContact CG2-CG2 4.42Å; I24-T28 WeakPolarHBondContact O-CG2 3.33Å; I24-T28 PolarHBondContact O-N 2.91Å; I24-T28 PolarHBondContact O-OG1 3.09Å; G25-T28 WeakPolarHBondContact CA-OG1 3.43Å; G25-T28 PolarHBondContact O-N 3.31Å; G25-T28 PolarHBondContact O-OG1 3.46Å; T28-C31 PolarHBondContact O-N 3.25Å; T28-A32 VanDerWaalsContact O-CB 3.26Å; T28-A32 WeakPolarHBondContact O-CB 3.39Å; T28-A32 PolarHBondContact O-N 3.49Å |
| 29 | I | 79 | Confident | 74 | Confident | 90 Ų | 90 | 101.1 Ų | 101.1 | 46% | 0.462 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.6 | -49.5 | 172.7 | -68 | 164.6 | 0 | 0 | 0 | 110.2 | G25 C31 A32 E33 | G25-I29 WeakPolarHBondContact O-CB 3.32Å; G25-I29 WeakPolarHBondContact O-CD1 3.45Å; G25-I29 WeakPolarHBondContact O-CG1 3.37Å; G25-I29 PolarHBondContact O-N 2.81Å; I29-C31 VanDerWaalsContact C-N 3.3Å; I29-C31 PolarHBondContact O-N 3.35Å; I29-A32 CarbonylContact O-C 3.22Å; I29-A32 PolarHBondContact O-N 3.15Å; I29-A32 VanDerWaalsContact O-N 3.15Å; I29-E33 HydrophobicContact CG2-CG 4.34Å; I29-E33 WeakPolarHBondContact O-CB 3.49Å; I29-E33 WeakPolarHBondContact O-CG 3.33Å; I29-E33 PolarHBondContact O-N 3.27Å |
| 30 | N | 75.6 | Confident | 71.6 | Confident | 98 Ų | 98 | 104.1 Ų | 104.1 | 52% | 0.524 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.3 | -37.9 | 178.1 | -76.5 | -22.3 | 0 | 0 | 0 | 112.4 | L26 I27 Y34 | L26-N30 WeakPolarHBondContact O-CB 3.31Å; L26-N30 VanDerWaalsContact O-CG 3.28Å; L26-N30 PolarHBondContact O-N 3.29Å; L26-N30 PolarHBondContact O-ND2 3.34Å; I27-N30 PolarHBondContact O-N 2.88Å; N30-Y34 VanDerWaalsContact O-CB 3.3Å; N30-Y34 WeakPolarHBondContact O-CB 3.26Å; N30-Y34 PolarHBondContact O-N 2.82Å |
| 31 | C | 74.9 | Confident | 69.2 | Low | 65 Ų | 65 | 104.4 Ų | 104.4 | 44% | 0.439 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -69.8 | -38.1 | 175.3 | -75.5 | 0 | 0 | 0 | 0 | 111.9 | I27 T28 I29 Y34 N35 | I27-C31 VanDerWaalsContact O-CB 3.3Å; I27-C31 WeakPolarHBondContact O-CB 3.3Å; I27-C31 PolarHBondContact O-N 3.36Å; I27-C31 PolarHBondContact O-SG 3.38Å; T28-C31 PolarHBondContact O-N 3.25Å; I29-C31 VanDerWaalsContact C-N 3.3Å; I29-C31 PolarHBondContact O-N 3.35Å; C31-Y34 PolarHBondContact O-N 2.92Å; C31-N35 WeakPolarHBondContact O-CB 3.29Å; C31-N35 PolarHBondContact O-N 3.44Å; C31-N35 PolarHBondContact O-ND2 2.98Å |
| 32 | A | 68.9 | Low | 66.8 | Low | 44 Ų | 44 | 100.7 Ų | 100.7 | 36% | 0.364 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.2 | -43.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | T28 I29 Y34 N35 E36 | T28-A32 VanDerWaalsContact O-CB 3.26Å; T28-A32 WeakPolarHBondContact O-CB 3.39Å; T28-A32 PolarHBondContact O-N 3.49Å; I29-A32 CarbonylContact O-C 3.22Å; I29-A32 PolarHBondContact O-N 3.15Å; I29-A32 VanDerWaalsContact O-N 3.15Å; A32-Y34 VanDerWaalsContact C-N 3.3Å; A32-Y34 PolarHBondContact O-N 2.97Å; A32-N35 PolarHBondContact O-N 3.43Å; A32-E36 WeakPolarHBondContact O-CA 3.36Å; A32-E36 VanDerWaalsContact O-CB 3.25Å; A32-E36 WeakPolarHBondContact O-CB 3.32Å; A32-E36 PolarHBondContact O-N 2.83Å |
| 33 | E | 62.6 | Low | 64.4 | Low | 118 Ų | 118 | 102.7 Ų | 102.7 | 55% | 0.551 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.5 | -33.9 | 172 | -72 | -177.4 | -177.3 | 0 | 0 | 111.9 | I29 G37 | I29-E33 HydrophobicContact CG2-CG 4.34Å; I29-E33 WeakPolarHBondContact O-CB 3.49Å; I29-E33 WeakPolarHBondContact O-CG 3.33Å; I29-E33 PolarHBondContact O-N 3.27Å; E33-G37 CarbonylContact O-C 3.58Å; E33-G37 WeakPolarHBondContact O-CA 3.05Å; E33-G37 PolarHBondContact O-N 2.96Å |
| 34 | Y | 65.4 | Low | 61.9 | Low | 182 Ų | 182 | 104.2 Ų | 104.2 | 71% | 0.714 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -71.1 | -40 | 175.6 | -165.3 | -95.1 | 0 | 0 | 0 | 111.8 | N30 C31 A32 | N30-Y34 VanDerWaalsContact O-CB 3.3Å; N30-Y34 WeakPolarHBondContact O-CB 3.26Å; N30-Y34 PolarHBondContact O-N 2.82Å; C31-Y34 PolarHBondContact O-N 2.92Å; A32-Y34 VanDerWaalsContact C-N 3.3Å; A32-Y34 PolarHBondContact O-N 2.97Å |
| 35 | N | 62.5 | Low | 59.4 | Low | 127 Ų | 127 | 106.5 Ų | 106.5 | 68% | 0.679 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -79.4 | -33.9 | -179.2 | -73.9 | -26.3 | 0 | 0 | 0 | 113.2 | C31 A32 | C31-N35 WeakPolarHBondContact O-CB 3.29Å; C31-N35 PolarHBondContact O-N 3.44Å; C31-N35 PolarHBondContact O-ND2 2.98Å; A32-N35 PolarHBondContact O-N 3.43Å |
| 36 | E | 54.4 | Low | 57.1 | Low | 132 Ų | 132 | 111 Ų | 111 | 62% | 0.617 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -101.5 | -4.1 | 179.7 | -61.9 | -167.4 | 166.6 | 0 | 0 | 113.3 | A32 L39 Y40 | A32-E36 WeakPolarHBondContact O-CA 3.36Å; A32-E36 VanDerWaalsContact O-CB 3.25Å; A32-E36 WeakPolarHBondContact O-CB 3.32Å; A32-E36 PolarHBondContact O-N 2.83Å; E36-L39 CarbonylContact O-C 3.59Å; E36-L39 VanDerWaalsContact O-CA 3.26Å; E36-L39 WeakPolarHBondContact O-CA 3.49Å; E36-L39 WeakPolarHBondContact O-CB 3.49Å; E36-L39 PolarHBondContact O-N 3.28Å; E36-Y40 PolarHBondContact O-N 3.34Å |
| 37 | G | 46.1 | Very low | 54.6 | Low | 34 Ų | 34 | 114 Ų | 114 | 35% | 0.351 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -126.8 | -2.7 | -159.4 | 0 | 0 | 0 | 0 | 0 | 117.9 | E33 L39 Y40 | E33-G37 CarbonylContact O-C 3.58Å; E33-G37 WeakPolarHBondContact O-CA 3.05Å; E33-G37 PolarHBondContact O-N 2.96Å; G37-L39 PolarHBondContact O-N 2.91Å; G37-L39 VanDerWaalsContact O-N 3.09Å; G37-Y40 PolarHBondContact O-N 2.89Å |
| 38 | L | 48.6 | Very low | 52.1 | Low | 158 Ų | 158 | 112.7 Ų | 112.7 | 83% | 0.827 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.8 | -11.7 | 132.9 | -107.4 | 156.3 | 0 | 0 | 0 | 111.2 | ||
| 39 | L | 43.6 | Very low | 49.9 | Very low | 136 Ų | 136 | 117.3 Ų | 117.3 | 71% | 0.712 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.8 | 2.4 | -176.8 | -82.8 | 155.6 | 0 | 0 | 0 | 116.1 | E36 G37 | E36-L39 CarbonylContact O-C 3.59Å; E36-L39 VanDerWaalsContact O-CA 3.26Å; E36-L39 WeakPolarHBondContact O-CA 3.49Å; E36-L39 WeakPolarHBondContact O-CB 3.49Å; E36-L39 PolarHBondContact O-N 3.28Å; G37-L39 PolarHBondContact O-N 2.91Å; G37-L39 VanDerWaalsContact O-N 3.09Å |
| 40 | Y | 38.8 | Very low | 47.7 | Very low | 156 Ų | 156 | 120.8 Ų | 120.8 | 61% | 0.612 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -145.8 | 39.9 | -173.8 | -113.8 | -82.7 | 0 | 0 | 0 | 117.6 | E36 G37 | E36-Y40 PolarHBondContact O-N 3.34Å; G37-Y40 PolarHBondContact O-N 2.89Å |
| 41 | N | 38.4 | Very low | 46 | Very low | 112 Ų | 112 | 127 Ų | 127 | 60% | 0.599 | 63% | 0.633 | S | S | * | * | S | Bend | trans | -165.6 | 42.7 | 143.5 | -107.2 | -26.9 | 0 | 0 | 0 | 116.4 | R43 | N41-R43 PolarHBondContact O-N 3.33Š|
| 42 | S | 37.9 | Very low | 44.2 | Very low | 96 Ų | 96 | 131.4 Ų | 131.4 | 67% | 0.671 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | 16.8 | 149.3 | 52.7 | 0 | 0 | 0 | 0 | 112.5 | ||
| 43 | R | 38.8 | Very low | 42.8 | Very low | 180 Ų | 180 | 134.8 Ų | 134.8 | 68% | 0.679 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.1 | -7.4 | -174.7 | -83.3 | -173.4 | 172 | -178.6 | -1 | 116.1 | N41 | N41-R43 PolarHBondContact O-N 3.33Š|
| 44 | S | 36.7 | Very low | 41.7 | Very low | 101 Ų | 101 | 135.2 Ų | 135.2 | 71% | 0.706 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -126.8 | -5 | 172.3 | 56.9 | 0 | 0 | 0 | 0 | 114.5 | ||
| 45 | N | 34.6 | Very low | 40.6 | Very low | 131 Ų | 131 | 134.1 Ų | 134.1 | 70% | 0.701 | 67% | 0.669 | S | S | * | * | trans | -113.8 | 50.9 | 157.4 | -129.4 | -15.6 | 0 | 0 | 0 | 108.8 | L47 | N45-L47 PolarHBondContact O-N 3.15Š| ||
| 46 | I | 37.2 | Very low | 39.6 | Very low | 118 Ų | 118 | 135.6 Ų | 135.6 | 61% | 0.605 | 67% | 0.672 | S | S | * | * | trans | -63.5 | 76.1 | 150.7 | -56.2 | 165.5 | 0 | 0 | 0 | 104.1 | S48 | I46-S48 PolarHBondContact O-N 3.26Š| ||
| 47 | L | 33.2 | Very low | 38.9 | Very low | 142 Ų | 142 | 135.5 Ų | 135.5 | 74% | 0.743 | 67% | 0.669 | S | S | * | * | trans | -47.6 | 100.3 | 136 | -88.2 | 167.1 | 0 | 0 | 0 | 101.1 | N45 K49 | N45-L47 PolarHBondContact O-N 3.15Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 3.44Å | ||
| 48 | S | 34.3 | Very low | 38.7 | Very low | 67 Ų | 67 | 141.6 Ų | 141.6 | 47% | 0.469 | 69% | 0.688 | S | S | . | * | trans | -38.8 | 110.1 | 175.1 | 53.8 | 0 | 0 | 0 | 0 | 103.6 | I46 R50 | I46-S48 PolarHBondContact O-N 3.26Å; S48-R50 PolarHBondContact O-N 2.93Å; S48-R50 WeakPolarHBondContact OG-CG 3.36Å | ||
| 49 | K | 36.3 | Very low | 38.1 | Very low | 177 Ų | 177 | 140.9 Ų | 140.9 | 77% | 0.77 | 68% | 0.676 | S | S | * | * | trans | -64.3 | 78 | 155.5 | -78.7 | -171 | 177.9 | -178 | 0 | 101.4 | L47 W51 | L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 3.44Å; K49-W51 PolarHBondContact O-N 2.96Å | ||
| 50 | R | 34 | Very low | 38.5 | Very low | 163 Ų | 163 | 142.5 Ų | 142.5 | 62% | 0.615 | 69% | 0.685 | S | S | * | * | trans | -59.9 | 96.4 | 160.2 | -88.8 | 179.1 | -174.5 | -159.9 | -1.3 | 99.7 | S48 Y52 | S48-R50 PolarHBondContact O-N 2.93Å; S48-R50 WeakPolarHBondContact OG-CG 3.36Å; R50-Y52 HydrophobicContact CB-CD2 3.73Å; R50-Y52 HydrophobicContact CB-CE2 3.51Å; R50-Y52 HydrophobicContact CB-CG 4.39Å; R50-Y52 VanDerWaalsContact CD-CZ 3.43Å; R50-Y52 WeakPolarHBondContact CD-OH 3.47Å; R50-Y52 HydrophobicContact CG-CE2 4.3Å; R50-Y52 PolarHBondContact NH1-OH 3.43Å; R50-Y52 WeakPolarHBondContact O-CD2 3.48Å; R50-Y52 PolarHBondContact O-N 3.44Å | ||
| 51 | W | 38 | Very low | 38.7 | Very low | 229 Ų | 229 | 142.6 Ų | 142.6 | 87% | 0.867 | 69% | 0.691 | S | S | * | * | trans | -58.5 | 84.1 | 151.5 | -64.3 | 90.2 | 0 | 0 | 0 | 103.9 | K49 | K49-W51 PolarHBondContact O-N 2.96Š| ||
| 52 | Y | 38.3 | Very low | 38.9 | Very low | 156 Ų | 156 | 143.2 Ų | 143.2 | 61% | 0.612 | 70% | 0.701 | S | S | * | * | trans | -61 | 127.4 | 162.4 | -75.3 | -79.8 | 0 | 0 | 0 | 104.1 | R50 V54 | R50-Y52 HydrophobicContact CB-CD2 3.73Å; R50-Y52 HydrophobicContact CB-CE2 3.51Å; R50-Y52 HydrophobicContact CB-CG 4.39Å; R50-Y52 VanDerWaalsContact CD-CZ 3.43Å; R50-Y52 WeakPolarHBondContact CD-OH 3.47Å; R50-Y52 HydrophobicContact CG-CE2 4.3Å; R50-Y52 PolarHBondContact NH1-OH 3.43Å; R50-Y52 WeakPolarHBondContact O-CD2 3.48Å; R50-Y52 PolarHBondContact O-N 3.44Å; Y52-V54 PolarHBondContact O-N 2.95Å | ||
| 53 | P | 38.3 | Very low | 39.1 | Very low | 116 Ų | 116 | 144.6 Ų | 144.6 | 75% | 0.753 | 70% | 0.701 | S | S | * | * | trans | -54.8 | 114 | 167.8 | 23.1 | -29.5 | 0 | 0 | 0 | 105.3 | K55 | P53-K55 PolarHBondContact O-N 2.92Š| ||
| 54 | V | 41.2 | Very low | 39.1 | Very low | 126 Ų | 126 | 144.6 Ų | 144.6 | 76% | 0.764 | 71% | 0.708 | S | S | * | * | trans | -60.6 | 99.1 | 165 | 177.8 | 0 | 0 | 0 | 0 | 102.8 | Y52 E56 | Y52-V54 PolarHBondContact O-N 2.95Å; V54-E56 PolarHBondContact O-N 3.26Å | ||
| 55 | K | 41.8 | Very low | 39.3 | Very low | 160 Ų | 160 | 146.5 Ų | 146.5 | 70% | 0.696 | 71% | 0.709 | S | S | * | * | trans | -58.6 | 105.7 | 156.2 | -89.4 | -175.3 | 172.9 | -176.3 | 0 | 103.1 | P53 F57 | P53-K55 PolarHBondContact O-N 2.92Å; K55-F57 HydrophobicContact CB-CD2 3.93Å; K55-F57 HydrophobicContact CB-CE2 3.65Å; K55-F57 HydrophobicContact CB-CZ 4.24Å; K55-F57 HydrophobicContact CD-CE2 4.33Å; K55-F57 HydrophobicContact CD-CZ 4.14Å; K55-F57 WeakPolarHBondContact O-CD2 3.39Å; K55-F57 PolarHBondContact O-N 2.93Å | ||
| 56 | E | 40.3 | Very low | 39.4 | Very low | 157 Ų | 157 | 149.2 Ų | 149.2 | 73% | 0.734 | 72% | 0.715 | S | S | * | * | trans | -57.9 | 91.5 | 164.2 | -71.8 | 170.6 | 176 | 0 | 0 | 105.5 | V54 H58 | V54-E56 PolarHBondContact O-N 3.26Å; E56-H58 VanDerWaalsContact C-N 3.28Å; E56-H58 PolarHBondContact O-N 3.49Å; E56-H58 VanDerWaalsContact O-N 3.15Å | ||
| 57 | F | 40.2 | Very low | 39.5 | Very low | 130 Ų | 130 | 152.1 Ų | 152.1 | 57% | 0.57 | 72% | 0.723 | S | S | * | * | trans | -76.9 | 95 | 164.7 | -73.1 | -85.6 | 0 | 0 | 0 | 105.1 | K55 Y59 | K55-F57 HydrophobicContact CB-CD2 3.93Å; K55-F57 HydrophobicContact CB-CE2 3.65Å; K55-F57 HydrophobicContact CB-CZ 4.24Å; K55-F57 HydrophobicContact CD-CE2 4.33Å; K55-F57 HydrophobicContact CD-CZ 4.14Å; K55-F57 WeakPolarHBondContact O-CD2 3.39Å; K55-F57 PolarHBondContact O-N 2.93Å; F57-Y59 HydrophobicContact CB-CD2 3.52Å; F57-Y59 HydrophobicContact CB-CE2 3.31Å; F57-Y59 AromaticContact CD1-CE2 3.65Å; F57-Y59 HydrophobicContact CD1-CE2 3.65Å; F57-Y59 AromaticContact CD1-CZ 3.73Å; F57-Y59 WeakPolarHBondContact CD1-OH 3.37Å; F57-Y59 HydrophobicContact CG-CD2 4.35Å; F57-Y59 AromaticContact CG-CE2 3.64Å; F57-Y59 HydrophobicContact CG-CE2 3.64Å; F57-Y59 PolarHBondContact O-N 3.46Å | ||
| 58 | H | 42.7 | Very low | 39.5 | Very low | 162 Ų | 162 | 156.2 Ų | 156.2 | 75% | 0.75 | 73% | 0.728 | S | S | * | * | trans | -62.6 | 96.8 | 156.4 | -67.4 | -75.7 | 0 | 0 | 0 | 106.4 | E56 | E56-H58 VanDerWaalsContact C-N 3.28Å; E56-H58 PolarHBondContact O-N 3.49Å; E56-H58 VanDerWaalsContact O-N 3.15Å | ||
| 59 | Y | 36.4 | Very low | 39.4 | Very low | 143 Ų | 143 | 159.1 Ų | 159.1 | 56% | 0.561 | 75% | 0.745 | S | S | * | * | trans | -99 | 124 | 162.1 | -74.9 | -71 | 0 | 0 | 0 | 106.5 | F57 E61 L63 | F57-Y59 HydrophobicContact CB-CD2 3.52Å; F57-Y59 HydrophobicContact CB-CE2 3.31Å; F57-Y59 AromaticContact CD1-CE2 3.65Å; F57-Y59 HydrophobicContact CD1-CE2 3.65Å; F57-Y59 AromaticContact CD1-CZ 3.73Å; F57-Y59 WeakPolarHBondContact CD1-OH 3.37Å; F57-Y59 HydrophobicContact CG-CD2 4.35Å; F57-Y59 AromaticContact CG-CE2 3.64Å; F57-Y59 HydrophobicContact CG-CE2 3.64Å; F57-Y59 PolarHBondContact O-N 3.46Å; Y59-E61 PolarHBondContact O-N 3.44Å; Y59-E61 VanDerWaalsContact O-N 3.16Å; Y59-L63 HydrophobicContact CD2-CD1 3.72Å; Y59-L63 HydrophobicContact CE2-CD1 4.11Å; Y59-L63 HydrophobicContact CG-CD1 4.27Å | ||
| 60 | D | 52.2 | Low | 39.6 | Very low | 171 Ų | 171 | 157.6 Ų | 157.6 | 91% | 0.914 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -70.2 | -0.1 | 175.4 | -67.5 | -42.5 | 0 | 0 | 0 | 112.6 | ||
| 61 | E | 42.8 | Very low | 39.6 | Very low | 158 Ų | 158 | 158.6 Ų | 158.6 | 74% | 0.738 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -129.2 | 137.9 | -176.6 | -66.9 | -177.2 | 167.1 | 0 | 0 | 111.8 | Y59 L63 | Y59-E61 PolarHBondContact O-N 3.44Å; Y59-E61 VanDerWaalsContact O-N 3.16Å; E61-L63 PolarHBondContact O-N 2.99Å |
| 62 | P | 41.1 | Very low | 39.5 | Very low | 125 Ų | 125 | 155.9 Ų | 155.9 | 81% | 0.812 | 75% | 0.754 | S | S | * | * | trans | -64.5 | 117.8 | 176.3 | 25.6 | -31.4 | 0 | 0 | 0 | 110.5 | E64 | P62-E64 PolarHBondContact O-N 3.26Å; P62-E64 VanDerWaalsContact O-N 3.1Å | ||
| 63 | L | 43.2 | Very low | 39.3 | Very low | 125 Ų | 125 | 157.8 Ų | 157.8 | 65% | 0.654 | 77% | 0.767 | S | S | * | * | trans | -65 | 106.6 | 174.2 | -109.7 | 130.3 | 0 | 0 | 0 | 110.6 | Y59 E61 I65 | Y59-L63 HydrophobicContact CD2-CD1 3.72Å; Y59-L63 HydrophobicContact CE2-CD1 4.11Å; Y59-L63 HydrophobicContact CG-CD1 4.27Å; E61-L63 PolarHBondContact O-N 2.99Å; L63-I65 PolarHBondContact O-N 3.44Å | ||
| 64 | E | 38.6 | Very low | 39.1 | Very low | 179 Ų | 179 | 160.5 Ų | 160.5 | 84% | 0.836 | 77% | 0.767 | S | S | * | * | trans | -69 | 93.9 | 169.3 | -73.8 | -168.8 | 162.3 | 0 | 0 | 111 | P62 K66 | P62-E64 PolarHBondContact O-N 3.26Å; P62-E64 VanDerWaalsContact O-N 3.1Å; E64-K66 PolarHBondContact O-N 3.04Å; E64-K66 VanDerWaalsContact O-N 3.08Å | ||
| 65 | I | 41.3 | Very low | 38.5 | Very low | 141 Ų | 141 | 164.6 Ų | 164.6 | 72% | 0.723 | 77% | 0.769 | S | S | * | * | trans | -80.7 | 92.6 | 175.4 | -54.3 | 174.3 | 0 | 0 | 0 | 109.5 | L63 K67 | L63-I65 PolarHBondContact O-N 3.44Å; I65-K67 PolarHBondContact O-N 2.93Å | ||
| 66 | K | 35.8 | Very low | 38.2 | Very low | 189 Ų | 189 | 165.9 Ų | 165.9 | 82% | 0.822 | 77% | 0.77 | S | S | * | * | trans | -61.9 | 104.3 | 163.6 | -88.3 | 179.5 | 177.7 | 169.4 | 0 | 109.9 | E64 R68 | E64-K66 PolarHBondContact O-N 3.04Å; E64-K66 VanDerWaalsContact O-N 3.08Å; K66-R68 PolarHBondContact O-N 3.5Å; K66-R68 VanDerWaalsContact O-N 3.07Å | ||
| 67 | K | 38.7 | Very low | 37.9 | Very low | 178 Ų | 178 | 165.8 Ų | 165.8 | 77% | 0.774 | 77% | 0.767 | S | S | * | * | trans | -59.7 | 104.5 | 174.7 | -73.2 | 176 | 178.6 | 169.4 | 0 | 110.8 | I65 | I65-K67 PolarHBondContact O-N 2.93Š| ||
| 68 | R | 33.6 | Very low | 37.7 | Very low | 229 Ų | 229 | 165.5 Ų | 165.5 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | trans | -77.6 | 136.1 | 156.8 | -73.6 | -171.7 | -174 | -175.4 | 2.6 | 108.9 | K66 L70 | K66-R68 PolarHBondContact O-N 3.5Å; K66-R68 VanDerWaalsContact O-N 3.07Å; R68-L70 PolarHBondContact O-N 3.3Å | ||
| 69 | P | 33.8 | Very low | 37.4 | Very low | 127 Ų | 127 | 163.8 Ų | 163.8 | 83% | 0.825 | 78% | 0.779 | S | S | * | * | trans | -78.8 | 91.1 | -176.9 | 31.4 | -31.6 | 0 | 0 | 0 | 109.8 | ||||
| 70 | L | 38.4 | Very low | 37.5 | Very low | 146 Ų | 146 | 165.1 Ų | 165.1 | 76% | 0.764 | 79% | 0.788 | S | S | * | * | trans | -81.4 | 113.7 | 158.7 | -93.6 | 153.5 | 0 | 0 | 0 | 107.5 | R68 F72 | R68-L70 PolarHBondContact O-N 3.3Å; L70-F72 VanDerWaalsContact C-N 3.26Å; L70-F72 HydrophobicContact CD2-CE2 4.45Å; L70-F72 PolarHBondContact O-N 2.97Å | ||
| 71 | M | 34.3 | Very low | 36.9 | Very low | 183 Ų | 183 | 164.2 Ų | 164.2 | 90% | 0.901 | 78% | 0.778 | S | S | * | * | trans | -58.9 | 83.2 | 173.3 | -73.7 | -175.3 | 175.6 | 0 | 0 | 110.6 | ||||
| 72 | F | 36.1 | Very low | 36.8 | Very low | 173 Ų | 173 | 164 Ų | 164 | 76% | 0.759 | 78% | 0.775 | S | S | * | * | trans | -134.1 | 127.6 | 159.6 | -75.4 | -80.6 | 0 | 0 | 0 | 107.3 | L70 K74 | L70-F72 VanDerWaalsContact C-N 3.26Å; L70-F72 HydrophobicContact CD2-CE2 4.45Å; L70-F72 PolarHBondContact O-N 2.97Å; F72-K74 PolarHBondContact O-N 2.82Å | ||
| 73 | H | 34.3 | Very low | 36.7 | Very low | 195 Ų | 195 | 165.2 Ų | 165.2 | 90% | 0.903 | 77% | 0.77 | S | S | * | * | trans | -43.5 | 116.2 | -177.4 | -76.2 | 10.9 | 0 | 0 | 0 | 111.1 | R75 | H73-R75 PolarHBondContact O-N 3.42Š| ||
| 74 | K | 33.5 | Very low | 36.6 | Very low | 173 Ų | 173 | 167 Ų | 167 | 75% | 0.752 | 77% | 0.769 | S | S | * | * | trans | -61.7 | 90.8 | 178.8 | -70.8 | 174.9 | 174.5 | 173.9 | 0 | 109.9 | F72 W76 | F72-K74 PolarHBondContact O-N 2.82Å; K74-W76 HydrophobicContact CD-CZ2 4.27Å; K74-W76 PolarHBondContact O-N 3.23Å | ||
| 75 | R | 28.7 | Very low | 36.7 | Very low | 212 Ų | 212 | 166.7 Ų | 166.7 | 80% | 0.8 | 77% | 0.773 | S | S | * | * | trans | -83.1 | 99 | 152.1 | -102.8 | -178.2 | 171.1 | 177.4 | -3 | 107.2 | H73 F77 | H73-R75 PolarHBondContact O-N 3.42Å; R75-F77 HydrophobicContact CB-CD2 4.44Å; R75-F77 HydrophobicContact CB-CE2 3.95Å; R75-F77 PolarHBondContact O-N 2.93Å | ||
| 76 | W | 36.2 | Very low | 36.9 | Very low | 188 Ų | 188 | 162 Ų | 162 | 71% | 0.712 | 76% | 0.759 | S | S | * | * | trans | -72.2 | 112.9 | 166.9 | -65.1 | 86.9 | 0 | 0 | 0 | 107.7 | K74 | K74-W76 HydrophobicContact CD-CZ2 4.27Å; K74-W76 PolarHBondContact O-N 3.23Å | ||
| 77 | F | 33.9 | Very low | 37.2 | Very low | 155 Ų | 155 | 159.2 Ų | 159.2 | 68% | 0.68 | 76% | 0.76 | S | S | * | * | trans | -91.1 | 133.7 | 165.5 | -72.1 | -84.8 | 0 | 0 | 0 | 108 | R75 V79 | R75-F77 HydrophobicContact CB-CD2 4.44Å; R75-F77 HydrophobicContact CB-CE2 3.95Å; R75-F77 PolarHBondContact O-N 2.93Å; F77-V79 PolarHBondContact O-N 3.4Å; F77-V79 VanDerWaalsContact O-N 3.09Å | ||
| 78 | P | 36.8 | Very low | 37.3 | Very low | 123 Ų | 123 | 156.2 Ų | 156.2 | 80% | 0.799 | 75% | 0.752 | S | S | * | * | trans | -65.9 | 113.4 | 175.9 | 26.3 | -30.3 | 0 | 0 | 0 | 108.3 | K80 | P78-K80 PolarHBondContact O-N 3.36Å; P78-K80 VanDerWaalsContact O-N 3.15Å | ||
| 79 | V | 37 | Very low | 37.7 | Very low | 127 Ų | 127 | 153.6 Ų | 153.6 | 77% | 0.77 | 75% | 0.75 | S | S | * | * | trans | -72.3 | 103.9 | 167.4 | -178.3 | 0 | 0 | 0 | 0 | 105.7 | F77 E81 | F77-V79 PolarHBondContact O-N 3.4Å; F77-V79 VanDerWaalsContact O-N 3.09Å; V79-E81 PolarHBondContact O-N 3.41Å; V79-E81 VanDerWaalsContact O-N 3.12Å | ||
| 80 | K | 38.2 | Very low | 38.2 | Very low | 171 Ų | 171 | 153 Ų | 153 | 74% | 0.743 | 74% | 0.744 | S | S | * | * | trans | -67 | 105.3 | 161.4 | -98.2 | -176.5 | 173.1 | -177.9 | 0 | 106.4 | P78 F82 | P78-K80 PolarHBondContact O-N 3.36Å; P78-K80 VanDerWaalsContact O-N 3.15Å; K80-F82 HydrophobicContact CB-CD2 4.4Å; K80-F82 HydrophobicContact CB-CE2 4.07Å; K80-F82 WeakPolarHBondContact O-CD2 3.37Å; K80-F82 PolarHBondContact O-N 2.94Å; K80-F82 VanDerWaalsContact O-N 3.11Å | ||
| 81 | E | 39.6 | Very low | 38.3 | Very low | 151 Ų | 151 | 154.9 Ų | 154.9 | 71% | 0.706 | 75% | 0.746 | S | S | * | * | trans | -64.1 | 105.4 | 167.2 | -69.3 | 173.1 | 178.9 | 0 | 0 | 107.4 | V79 H83 | V79-E81 PolarHBondContact O-N 3.41Å; V79-E81 VanDerWaalsContact O-N 3.12Å; E81-H83 PolarHBondContact O-N 2.99Å | ||
| 82 | F | 40.2 | Very low | 38.7 | Very low | 154 Ų | 154 | 155.7 Ų | 155.7 | 68% | 0.675 | 74% | 0.744 | S | S | * | * | trans | -80.7 | 96.8 | 168.6 | -77.3 | -90.6 | 0 | 0 | 0 | 107.2 | K80 Y84 | K80-F82 HydrophobicContact CB-CD2 4.4Å; K80-F82 HydrophobicContact CB-CE2 4.07Å; K80-F82 WeakPolarHBondContact O-CD2 3.37Å; K80-F82 PolarHBondContact O-N 2.94Å; K80-F82 VanDerWaalsContact O-N 3.11Å; F82-Y84 HydrophobicContact CB-CD2 4.29Å; F82-Y84 HydrophobicContact CB-CE2 4.01Å | ||
| 83 | H | 39.7 | Very low | 38.9 | Very low | 151 Ų | 151 | 158.6 Ų | 158.6 | 70% | 0.699 | 75% | 0.75 | S | S | * | * | trans | -78.2 | 116.6 | 160 | -67.1 | -8.8 | 0 | 0 | 0 | 107.3 | E81 | E81-H83 PolarHBondContact O-N 2.99Š| ||
| 84 | Y | 39.2 | Very low | 39.2 | Very low | 163 Ų | 163 | 154 Ų | 154 | 64% | 0.639 | 74% | 0.737 | S | S | * | * | trans | -92.6 | 115.3 | 169.4 | -82.9 | -86.5 | 0 | 0 | 0 | 108 | F82 G86 L88 | F82-Y84 HydrophobicContact CB-CD2 4.29Å; F82-Y84 HydrophobicContact CB-CE2 4.01Å; Y84-G86 PolarHBondContact O-N 2.94Å; Y84-L88 HydrophobicContact CD1-CD1 3.76Å; Y84-L88 HydrophobicContact CD2-CD1 4.4Å; Y84-L88 HydrophobicContact CE1-CD1 3.94Å; Y84-L88 HydrophobicContact CG-CD1 4.01Å | ||
| 85 | D | 42.1 | Very low | 39.6 | Very low | 172 Ų | 172 | 153.6 Ų | 153.6 | 92% | 0.92 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -77.6 | 56.2 | 175.6 | -70 | -37.3 | 0 | 0 | 0 | 111.6 | ||
| 86 | G | 45.2 | Very low | 40.2 | Very low | 42 Ų | 42 | 152.8 Ų | 152.8 | 43% | 0.433 | 74% | 0.738 | S | S | . | * | S | Bend | trans | 164.8 | 158.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y84 L88 | Y84-G86 PolarHBondContact O-N 2.94Å; G86-L88 PolarHBondContact O-N 2.97Å; G86-L88 VanDerWaalsContact O-N 3.1Å |
| 87 | P | 41.9 | Very low | 40.3 | Very low | 131 Ų | 131 | 152 Ų | 152 | 85% | 0.851 | 74% | 0.736 | S | S | * | * | trans | -61.3 | 116.8 | 177 | 25 | -31.3 | 0 | 0 | 0 | 109.5 | E89 | P87-E89 PolarHBondContact O-N 3.32Å; P87-E89 VanDerWaalsContact O-N 3.08Å | ||
| 88 | L | 41.7 | Very low | 40.2 | Very low | 114 Ų | 114 | 151.5 Ų | 151.5 | 60% | 0.597 | 74% | 0.741 | S | S | * | * | trans | -68.7 | 104.8 | 174.2 | -148.4 | 91.2 | 0 | 0 | 0 | 107.9 | Y84 G86 V90 | Y84-L88 HydrophobicContact CD1-CD1 3.76Å; Y84-L88 HydrophobicContact CD2-CD1 4.4Å; Y84-L88 HydrophobicContact CE1-CD1 3.94Å; Y84-L88 HydrophobicContact CG-CD1 4.01Å; G86-L88 PolarHBondContact O-N 2.97Å; G86-L88 VanDerWaalsContact O-N 3.1Å; L88-V90 VanDerWaalsContact C-N 3.34Å; L88-V90 HydrophobicContact CD2-CG2 4.31Å; L88-V90 PolarHBondContact O-N 3.32Å | ||
| 89 | E | 42.1 | Very low | 40.3 | Very low | 174 Ų | 174 | 154.9 Ų | 154.9 | 81% | 0.813 | 74% | 0.743 | S | S | * | * | trans | -67.9 | 93.2 | 171.3 | -78.8 | -169.7 | 165.2 | 0 | 0 | 109.6 | P87 K91 | P87-E89 PolarHBondContact O-N 3.32Å; P87-E89 VanDerWaalsContact O-N 3.08Å; E89-K91 PolarHBondContact O-N 3.46Å | ||
| 90 | V | 44.3 | Very low | 40.3 | Very low | 116 Ų | 116 | 160.8 Ų | 160.8 | 70% | 0.703 | 75% | 0.751 | S | S | * | * | trans | -74 | 91.5 | 175.2 | -172.5 | 0 | 0 | 0 | 0 | 108.8 | L88 K92 | L88-V90 VanDerWaalsContact C-N 3.34Å; L88-V90 HydrophobicContact CD2-CG2 4.31Å; L88-V90 PolarHBondContact O-N 3.32Å; V90-K92 PolarHBondContact O-N 3.04Å | ||
| 91 | K | 40 | Very low | 40.1 | Very low | 185 Ų | 185 | 164.5 Ų | 164.5 | 80% | 0.804 | 76% | 0.761 | S | S | * | * | trans | -63.6 | 109.2 | 163.6 | -75.9 | -173.7 | 178.7 | 177.3 | 0 | 108.5 | E89 R93 | E89-K91 PolarHBondContact O-N 3.46Å; K91-R93 PolarHBondContact O-N 3.48Å | ||
| 92 | K | 42.4 | Very low | 39.9 | Very low | 199 Ų | 199 | 162.2 Ų | 162.2 | 87% | 0.865 | 76% | 0.761 | S | S | * | * | trans | -52.4 | 114.2 | 171.5 | -79.7 | 177.8 | 177.8 | 172.7 | 0 | 108.8 | V90 | V90-K92 PolarHBondContact O-N 3.04Š| ||
| 93 | R | 39 | Very low | 39.8 | Very low | 235 Ų | 235 | 161.2 Ų | 161.2 | 89% | 0.887 | 77% | 0.77 | S | S | * | * | trans | -63 | 131.8 | 170.6 | -75.2 | -174.6 | 180 | -174.2 | -0.3 | 108.8 | K91 K95 | K91-R93 PolarHBondContact O-N 3.48Å; R93-K95 PolarHBondContact O-N 3.18Å | ||
| 94 | P | 42.4 | Very low | 39.6 | Very low | 97 Ų | 97 | 160 Ų | 160 | 63% | 0.63 | 77% | 0.773 | S | S | * | * | trans | -60.1 | 136.1 | 172.7 | 23.1 | -30.5 | 0 | 0 | 0 | 109.7 | F96 | P94-F96 HydrophobicContact CG-CE2 4.09Å; P94-F96 WeakPolarHBondContact O-CD2 3.44Å; P94-F96 PolarHBondContact O-N 3.38Å | ||
| 95 | K | 40.5 | Very low | 39.6 | Very low | 166 Ų | 166 | 160.9 Ų | 160.9 | 72% | 0.722 | 78% | 0.78 | S | S | * | * | trans | -60.5 | 99.4 | 176.8 | -92.2 | 172.6 | 161.1 | -171 | 0 | 109.6 | R93 Y97 | R93-K95 PolarHBondContact O-N 3.18Å; K95-Y97 HydrophobicContact CB-CD2 4.01Å; K95-Y97 HydrophobicContact CB-CE2 3.76Å; K95-Y97 HydrophobicContact CD-CE2 3.69Å; K95-Y97 HydrophobicContact CG-CE2 4.2Å; K95-Y97 PolarHBondContact NZ-OH 3.5Å; K95-Y97 PolarHBondContact O-N 3.45Å; K95-Y97 VanDerWaalsContact O-N 3.11Å | ||
| 96 | F | 41 | Very low | 39.6 | Very low | 195 Ų | 195 | 160.6 Ų | 160.6 | 86% | 0.855 | 77% | 0.774 | S | S | * | * | trans | -77.9 | 91.6 | 165.7 | -81.6 | -85.9 | 0 | 0 | 0 | 108.8 | P94 | P94-F96 HydrophobicContact CG-CE2 4.09Å; P94-F96 WeakPolarHBondContact O-CD2 3.44Å; P94-F96 PolarHBondContact O-N 3.38Å | ||
| 97 | Y | 38 | Very low | 39.2 | Very low | 171 Ų | 171 | 166.4 Ų | 166.4 | 67% | 0.671 | 79% | 0.787 | S | S | * | * | trans | -70.3 | 127.6 | 160.1 | -71.8 | -85.4 | 0 | 0 | 0 | 108.7 | K95 | K95-Y97 HydrophobicContact CB-CD2 4.01Å; K95-Y97 HydrophobicContact CB-CE2 3.76Å; K95-Y97 HydrophobicContact CD-CE2 3.69Å; K95-Y97 HydrophobicContact CG-CE2 4.2Å; K95-Y97 PolarHBondContact NZ-OH 3.5Å; K95-Y97 PolarHBondContact O-N 3.45Å; K95-Y97 VanDerWaalsContact O-N 3.11Å | ||
| 98 | D | 33.7 | Very low | 39 | Very low | 145 Ų | 145 | 167.2 Ų | 167.2 | 78% | 0.775 | 78% | 0.78 | S | S | * | * | trans | 35.2 | 104 | 158.6 | -66.2 | -33.6 | 0 | 0 | 0 | 117.9 | ||||
| 99 | K | 38.7 | Very low | 38.9 | Very low | 193 Ų | 193 | 171.7 Ų | 171.7 | 84% | 0.839 | 79% | 0.79 | S | S | * | * | trans | -162.9 | 130.1 | 137 | -101.3 | 148.1 | -161.3 | -170 | 0 | 110.3 | W101 | K99-W101 PolarHBondContact O-N 2.99Š| ||
| 100 | R | 35.9 | Very low | 39.4 | Very low | 252 Ų | 252 | 171 Ų | 171 | 95% | 0.951 | 79% | 0.792 | S | S | * | * | trans | -49 | 123.6 | -179.2 | -65.9 | 168.3 | 177 | -166.3 | -1.6 | 110.5 | ||||
| 101 | W | 35 | Very low | 39.3 | Very low | 248 Ų | 248 | 173.4 Ų | 173.4 | 94% | 0.939 | 80% | 0.795 | S | S | * | * | trans | -80.5 | 119.3 | 178.4 | -73.1 | 68 | 0 | 0 | 0 | 110.1 | K99 | K99-W101 PolarHBondContact O-N 2.99Š| ||
| 102 | S | 34.5 | Very low | 39.8 | Very low | 103 Ų | 103 | 170.4 Ų | 170.4 | 72% | 0.72 | 80% | 0.795 | S | S | * | * | trans | -130.3 | 145.8 | 154.6 | -68.3 | 0 | 0 | 0 | 0 | 107.4 | V104 | S102-V104 PolarHBondContact O-N 3.04Š| ||
| 103 | P | 37.4 | Very low | 40.1 | Very low | 133 Ų | 133 | 168.3 Ų | 168.3 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -80.1 | 121.7 | -150.8 | 31.8 | -34.2 | 0 | 0 | 0 | 111.8 | ||||
| 104 | V | 36.9 | Very low | 40.5 | Very low | 126 Ų | 126 | 165.8 Ų | 165.8 | 76% | 0.764 | 79% | 0.79 | S | S | * | * | trans | -96 | 120.6 | 170.2 | -178.1 | 0 | 0 | 0 | 0 | 107.6 | S102 E106 | S102-V104 PolarHBondContact O-N 3.04Å; V104-E106 PolarHBondContact O-N 3.29Å | ||
| 105 | K | 39.1 | Very low | 40.6 | Very low | 181 Ų | 181 | 167.5 Ų | 167.5 | 79% | 0.787 | 80% | 0.798 | S | S | * | * | trans | -45 | 120 | 166.8 | -77.4 | 175.1 | 170.2 | 178.3 | 0 | 109.2 | F107 | K105-F107 WeakPolarHBondContact O-CD2 3.25Å; K105-F107 PolarHBondContact O-N 3.01Å; K105-F107 VanDerWaalsContact O-N 3.11Å | ||
| 106 | E | 41.5 | Very low | 40.6 | Very low | 167 Ų | 167 | 170.8 Ų | 170.8 | 78% | 0.78 | 81% | 0.806 | S | S | * | * | trans | -66.2 | 108.7 | 172.2 | -71.5 | 177.2 | 172.8 | 0 | 0 | 108.7 | V104 H108 | V104-E106 PolarHBondContact O-N 3.29Å; E106-H108 PolarHBondContact O-N 3.39Å; E106-H108 IonicContact OE2-CE1 3.97Å | ||
| 107 | F | 37.4 | Very low | 40.8 | Very low | 163 Ų | 163 | 175 Ų | 175 | 72% | 0.715 | 82% | 0.824 | S | S | * | * | trans | -73.1 | 113.2 | 164.7 | -77 | -94.6 | 0 | 0 | 0 | 107.6 | K105 Y109 | K105-F107 WeakPolarHBondContact O-CD2 3.25Å; K105-F107 PolarHBondContact O-N 3.01Å; K105-F107 VanDerWaalsContact O-N 3.11Å; F107-Y109 HydrophobicContact CB-CE2 4.36Å | ||
| 108 | H | 38.1 | Very low | 41 | Very low | 149 Ų | 149 | 175.2 Ų | 175.2 | 69% | 0.69 | 83% | 0.831 | S | S | * | * | trans | -78.6 | 122.3 | 164.7 | -68.4 | 17.3 | 0 | 0 | 0 | 107.2 | E106 | E106-H108 PolarHBondContact O-N 3.39Å; E106-H108 IonicContact OE2-CE1 3.97Å | ||
| 109 | Y | 39.8 | Very low | 41.3 | Very low | 208 Ų | 208 | 176.7 Ų | 176.7 | 82% | 0.816 | 83% | 0.834 | S | S | * | * | trans | -94.3 | 129.6 | 163.3 | -75.6 | -83.5 | 0 | 0 | 0 | 107.4 | F107 E111 | F107-Y109 HydrophobicContact CB-CE2 4.36Å; Y109-E111 PolarHBondContact O-N 3.2Å | ||
| 110 | D | 52.5 | Low | 41.5 | Very low | 158 Ų | 158 | 175.8 Ų | 175.8 | 85% | 0.845 | 83% | 0.834 | S | S | * | * | S | Bend | trans | -79 | 12 | -169.3 | -76.3 | -39.5 | 0 | 0 | 0 | 115.2 | ||
| 111 | E | 41.7 | Very low | 41.8 | Very low | 168 Ų | 168 | 171.4 Ų | 171.4 | 79% | 0.785 | 83% | 0.827 | S | S | * | * | trans | -129.9 | 120.7 | -176.7 | -69.2 | -172.8 | 171.1 | 0 | 0 | 112.8 | Y109 I113 | Y109-E111 PolarHBondContact O-N 3.2Å; E111-I113 PolarHBondContact O-N 3.39Å | ||
| 112 | P | 49.9 | Very low | 42.3 | Very low | 122 Ų | 122 | 166.6 Ų | 166.6 | 79% | 0.792 | 82% | 0.82 | S | S | * | * | trans | -69.9 | 119.8 | 174 | 27.2 | -30.1 | 0 | 0 | 0 | 109.7 | E114 | P112-E114 PolarHBondContact O-N 3.21Š| ||
| 113 | I | 50.1 | Low | 42.8 | Very low | 155 Ų | 155 | 170.8 Ų | 170.8 | 80% | 0.795 | 83% | 0.827 | S | S | * | * | trans | -73.5 | 109.8 | 171.2 | -61.3 | 167.9 | 0 | 0 | 0 | 107.8 | E111 V115 | E111-I113 PolarHBondContact O-N 3.39Å; I113-V115 PolarHBondContact O-N 3.09Å | ||
| 114 | E | 45.9 | Very low | 43.2 | Very low | 182 Ų | 182 | 173.5 Ų | 173.5 | 85% | 0.85 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 116.3 | 170.1 | -72.3 | -173.5 | 158.5 | 0 | 0 | 110.4 | P112 | P112-E114 PolarHBondContact O-N 3.21Š|
| 115 | V | 45.2 | Very low | 43.6 | Very low | 133 Ų | 133 | 177.2 Ų | 177.2 | 81% | 0.806 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -100.9 | 116.3 | 165.9 | -168 | 0 | 0 | 0 | 0 | 107.5 | I113 | I113-V115 PolarHBondContact O-N 3.09Š|
| 116 | R | 39.4 | Very low | 44 | Very low | 234 Ų | 234 | 176.8 Ų | 176.8 | 88% | 0.883 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 144.2 | 178.1 | -73.1 | -177.1 | 176 | -174.4 | -1.3 | 110.9 | ||
| 117 | K | 46.8 | Very low | 44.2 | Very low | 283 Ų | 283 | 177.7 Ų | 177.7 | 100% | 1.23 | 84% | 0.837 | S | S | * | * | trans | -44.2 | 0 | -174.9 | -76.4 | -178.1 | 177.5 | 179.2 | 0 | 115.2 |
Retrieved 117 of 117 residues in 24.2 ms
(Link to these results)