| 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 | 41.5 | Very low | 59.4 | Low | 238 Ų | 238 | 152.2 Ų | 152.2 | 100% | 1.172 | 72% | 0.716 | S | S | * | * | 0 | 109.8 | 0 | -70.1 | -177.1 | -177.7 | 0 | 0 | 107.8 | I3 | M1-I3 PolarHBondContact O-N 3.03Š| |||
| 2 | T | 55.9 | Low | 60 | Low | 147 Ų | 147 | 154.4 Ų | 154.4 | 90% | 0.902 | 72% | 0.715 | S | S | * | * | trans | -82.2 | 106.2 | 174.2 | 2 | 0 | 0 | 0 | 0 | 107.5 | K4 | T2-K4 PolarHBondContact O-N 3.49Å; T2-K4 VanDerWaalsContact O-N 3.07Å | ||
| 3 | I | 60.1 | Low | 60.9 | Low | 155 Ų | 155 | 147.8 Ų | 147.8 | 80% | 0.795 | 69% | 0.688 | S | S | * | * | trans | -61.3 | 114.2 | 174.2 | -61.4 | 176 | 0 | 0 | 0 | 106.4 | M1 E5 | M1-I3 PolarHBondContact O-N 3.03Å; I3-E5 VanDerWaalsContact C-N 3.31Å; I3-E5 PolarHBondContact O-N 3.03Å | ||
| 4 | K | 61.5 | Low | 61.8 | Low | 174 Ų | 174 | 144 Ų | 144 | 76% | 0.757 | 68% | 0.683 | S | S | * | * | trans | -72.8 | 93.9 | 174.3 | -140.1 | -179.1 | -171.8 | -178.3 | 0 | 105.7 | T2 R6 L41 | T2-K4 PolarHBondContact O-N 3.49Å; T2-K4 VanDerWaalsContact O-N 3.07Å; K4-R6 PolarHBondContact O-N 2.79Å; K4-R6 VanDerWaalsContact O-N 3.13Å; K4-L41 VanDerWaalsContact NZ-CD1 3.25Å | ||
| 5 | E | 58.5 | Low | 62.6 | Low | 159 Ų | 159 | 142.7 Ų | 142.7 | 74% | 0.743 | 68% | 0.681 | S | S | * | * | trans | -52.3 | 122.8 | 175 | -79 | -175.9 | 154.8 | 0 | 0 | 108.8 | I3 K7 | I3-E5 VanDerWaalsContact C-N 3.31Å; I3-E5 PolarHBondContact O-N 3.03Å; E5-K7 PolarHBondContact O-N 2.97Å | ||
| 6 | R | 59.9 | Low | 63.1 | Low | 213 Ų | 213 | 138.5 Ų | 138.5 | 80% | 0.804 | 66% | 0.657 | S | S | * | * | trans | -71.9 | 91.4 | 174.6 | -155.8 | -175.9 | -160.6 | -176.3 | 7.4 | 105.6 | K4 H8 D9 | K4-R6 PolarHBondContact O-N 2.79Å; K4-R6 VanDerWaalsContact O-N 3.13Å; R6-H8 PolarHBondContact O-N 3.14Å; R6-D9 IonicContact NH1-OD2 3.61Å | ||
| 7 | K | 59.7 | Low | 63.8 | Low | 165 Ų | 165 | 136.1 Ų | 136.1 | 72% | 0.717 | 66% | 0.658 | S | S | * | * | trans | -58.6 | -26.1 | -155.5 | -116 | -172.1 | -179.7 | -172.1 | 0 | 115 | E5 | E5-K7 PolarHBondContact O-N 2.97Š| ||
| 8 | H | 58 | Low | 64.7 | Low | 107 Ų | 107 | 136.7 Ų | 136.7 | 50% | 0.495 | 66% | 0.664 | S | S | . | * | trans | -149.4 | 92.7 | -177.6 | -56.5 | -67 | 0 | 0 | 0 | 110.6 | R6 Y10 D31 | R6-H8 PolarHBondContact O-N 3.14Å; H8-Y10 VanDerWaalsContact C-N 3.31Å; H8-Y10 PolarHBondContact O-N 3.36Å; H8-D31 IonicContact CD2-OD2 3.52Å; H8-D31 IonicContact NE2-OD1 3.95Å; H8-D31 IonicContact NE2-OD2 3.7Å | ||
| 9 | D | 65.5 | Low | 65.4 | Low | 73 Ų | 73 | 131.1 Ų | 131.1 | 39% | 0.39 | 64% | 0.64 | S | S | . | * | trans | -96 | 71.1 | 160.8 | -140.9 | -20 | 0 | 0 | 0 | 107.3 | R6 L11 Y12 | R6-D9 IonicContact NH1-OD2 3.61Å; D9-L11 PolarHBondContact O-N 3.15Å; D9-Y12 PolarHBondContact O-N 3.28Å; D9-Y12 VanDerWaalsContact O-N 3.13Å | ||
| 10 | Y | 66.2 | Low | 66.2 | Low | 130 Ų | 130 | 127.5 Ų | 127.5 | 51% | 0.51 | 63% | 0.629 | S | S | . | * | G | 310 helix | trans | -57.9 | -18.9 | -174.5 | 55.8 | -94.7 | 0 | 0 | 0 | 113 | H8 Y12 D13 Y16 | H8-Y10 VanDerWaalsContact C-N 3.31Å; H8-Y10 PolarHBondContact O-N 3.36Å; Y10-Y12 PolarHBondContact O-N 3.24Å; Y10-Y12 VanDerWaalsContact O-N 3.13Å; Y10-D13 PolarHBondContact O-N 3.29Å; Y10-Y16 HydrophobicContact CD2-CD1 4.14Å; Y10-Y16 AromaticContact CD2-CE1 3.66Å; Y10-Y16 HydrophobicContact CD2-CE1 3.66Å; Y10-Y16 HydrophobicContact CD2-CE2 4.04Å; Y10-Y16 AromaticContact CD2-CZ 3.58Å; Y10-Y16 HydrophobicContact CE2-CE1 4.46Å; Y10-Y16 HydrophobicContact CG-CD2 4.3Å; Y10-Y16 HydrophobicContact CG-CE1 4.36Å; Y10-Y16 AromaticContact CG-CE2 4Å; Y10-Y16 HydrophobicContact CG-CE2 4Å; Y10-Y16 WeakPolarHBondContact O-CB 3.45Å; Y10-Y16 WeakPolarHBondContact O-CD1 3.35Å |
| 11 | L | 66.6 | Low | 66.9 | Low | 113 Ų | 113 | 125.2 Ų | 125.2 | 59% | 0.592 | 63% | 0.631 | S | S | * | * | G | 310 helix | trans | -56.2 | -27.7 | 176.3 | -170.8 | 63.2 | 0 | 0 | 0 | 112.6 | D9 | D9-L11 PolarHBondContact O-N 3.15Š|
| 12 | Y | 66.2 | Low | 68.9 | Low | 179 Ų | 179 | 117 Ų | 117 | 70% | 0.702 | 60% | 0.6 | S | S | * | * | G | 310 helix | trans | -118 | 8.2 | -177 | -55.2 | -70 | 0 | 0 | 0 | 114 | D9 Y10 P14 | D9-Y12 PolarHBondContact O-N 3.28Å; D9-Y12 VanDerWaalsContact O-N 3.13Å; Y10-Y12 PolarHBondContact O-N 3.24Å; Y10-Y12 VanDerWaalsContact O-N 3.13Å; Y12-P14 WeakPolarHBondContact O-CD 3.44Å |
| 13 | D | 71.6 | Confident | 70.2 | Confident | 69 Ų | 69 | 113.4 Ų | 113.4 | 37% | 0.369 | 58% | 0.576 | S | S | . | * | trans | -85.9 | 117.1 | 177 | -173.4 | -9.9 | 0 | 0 | 0 | 110.1 | Y10 L15 Y16 S17 | Y10-D13 PolarHBondContact O-N 3.29Å; D13-L15 PolarHBondContact O-N 3.05Å; D13-L15 WeakPolarHBondContact OD1-CB 3.44Å; D13-L15 PolarHBondContact OD1-N 2.69Å; D13-Y16 VanDerWaalsContact O-CB 3.31Å; D13-Y16 WeakPolarHBondContact O-CB 3.27Å; D13-Y16 PolarHBondContact O-N 2.97Å; D13-S17 PolarHBondContact O-N 3.38Å | ||
| 14 | P | 74.4 | Confident | 71.2 | Confident | 94 Ų | 94 | 107.8 Ų | 107.8 | 61% | 0.61 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -58.4 | -33.3 | 176 | -21.7 | 33.1 | 0 | 0 | 0 | 112.6 | Y12 Y16 S17 L18 | Y12-P14 WeakPolarHBondContact O-CD 3.44Å; P14-Y16 VanDerWaalsContact C-N 3.28Å; P14-Y16 PolarHBondContact O-N 3.05Å; P14-S17 PolarHBondContact O-N 3.37Å; P14-L18 WeakPolarHBondContact O-CG 3.14Å; P14-L18 PolarHBondContact O-N 2.76Å |
| 15 | L | 72.8 | Confident | 72.3 | Confident | 124 Ų | 124 | 106.5 Ų | 106.5 | 65% | 0.649 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -69.1 | -30.3 | 177.7 | -62.3 | 175.6 | 0 | 0 | 0 | 111.5 | D13 S17 L18 S19 | D13-L15 PolarHBondContact O-N 3.05Å; D13-L15 WeakPolarHBondContact OD1-CB 3.44Å; D13-L15 PolarHBondContact OD1-N 2.69Å; L15-S17 VanDerWaalsContact C-N 3.34Å; L15-L18 PolarHBondContact O-N 2.91Å; L15-S19 WeakPolarHBondContact O-CB 3.47Å; L15-S19 PolarHBondContact O-N 3.31Å; L15-S19 VanDerWaalsContact O-N 3.09Å; L15-S19 PolarHBondContact O-OG 3.07Å |
| 16 | Y | 71.5 | Confident | 73.5 | Confident | 76 Ų | 76 | 108 Ų | 108 | 30% | 0.298 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.6 | -39.2 | 173.1 | -171.1 | -94.8 | 0 | 0 | 0 | 111.4 | Y10 D13 P14 L18 S19 H24 | Y10-Y16 HydrophobicContact CD2-CD1 4.14Å; Y10-Y16 AromaticContact CD2-CE1 3.66Å; Y10-Y16 HydrophobicContact CD2-CE1 3.66Å; Y10-Y16 HydrophobicContact CD2-CE2 4.04Å; Y10-Y16 AromaticContact CD2-CZ 3.58Å; Y10-Y16 HydrophobicContact CE2-CE1 4.46Å; Y10-Y16 HydrophobicContact CG-CD2 4.3Å; Y10-Y16 HydrophobicContact CG-CE1 4.36Å; Y10-Y16 AromaticContact CG-CE2 4Å; Y10-Y16 HydrophobicContact CG-CE2 4Å; Y10-Y16 WeakPolarHBondContact O-CB 3.45Å; Y10-Y16 WeakPolarHBondContact O-CD1 3.35Å; D13-Y16 VanDerWaalsContact O-CB 3.31Å; D13-Y16 WeakPolarHBondContact O-CB 3.27Å; D13-Y16 PolarHBondContact O-N 2.97Å; P14-Y16 VanDerWaalsContact C-N 3.28Å; P14-Y16 PolarHBondContact O-N 3.05Å; Y16-L18 VanDerWaalsContact C-N 3.3Å; Y16-L18 PolarHBondContact O-N 3.2Å; Y16-S19 VanDerWaalsContact CA-OG 3.25Å; Y16-S19 WeakPolarHBondContact CA-OG 2.96Å; Y16-S19 PolarHBondContact O-N 3.21Å; Y16-S19 PolarHBondContact O-OG 3.03Å; Y16-H24 AromaticContact CD1-CE1 3.79Å; Y16-H24 AromaticContact CD2-CD2 3.72Å; Y16-H24 AromaticContact CD2-CE1 3.89Å; Y16-H24 AromaticContact CD2-NE2 3.54Å; Y16-H24 AromaticContact CE1-CE1 3.4Å; Y16-H24 VanDerWaalsContact CE1-CE1 3.4Å; Y16-H24 WeakPolarHBondContact CE1-CE1 3.43Å; Y16-H24 AromaticContact CE1-ND1 3.79Å; Y16-H24 HydrophobicContact CE2-CB 4.2Å; Y16-H24 AromaticContact CE2-CD2 3.54Å; Y16-H24 AromaticContact CE2-CE1 3.56Å; Y16-H24 AromaticContact CE2-CG 3.51Å; Y16-H24 AromaticContact CE2-ND1 3.54Å; Y16-H24 AromaticContact CE2-NE2 3.57Å; Y16-H24 AromaticContact CG-NE2 3.79Å; Y16-H24 AromaticContact CZ-CE1 3.29Å; Y16-H24 AromaticContact CZ-CG 3.74Å; Y16-H24 AromaticContact CZ-ND1 3.24Å; Y16-H24 AromaticContact CZ-NE2 3.8Å; Y16-H24 PolarHBondContact O-CE1 3.27Å; Y16-H24 PolarHBondContact O-NE2 3.03Å; Y16-H24 PolarHBondContact OH-ND1 3.35Å |
| 17 | S | 75.5 | Confident | 74.5 | Confident | 97 Ų | 97 | 101.9 Ų | 101.9 | 68% | 0.678 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -69.4 | -28.1 | 178.3 | -62.5 | 0 | 0 | 0 | 0 | 113.3 | D13 P14 L15 | D13-S17 PolarHBondContact O-N 3.38Å; P14-S17 PolarHBondContact O-N 3.37Å; L15-S17 VanDerWaalsContact C-N 3.34Å |
| 18 | L | 78.5 | Confident | 75.5 | Confident | 147 Ų | 147 | 95.9 Ų | 95.9 | 77% | 0.77 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -88.2 | -14.7 | 178.7 | -64.9 | 176 | 0 | 0 | 0 | 113.7 | P14 L15 Y16 | P14-L18 WeakPolarHBondContact O-CG 3.14Å; P14-L18 PolarHBondContact O-N 2.76Å; L15-L18 PolarHBondContact O-N 2.91Å; Y16-L18 VanDerWaalsContact C-N 3.3Å; Y16-L18 PolarHBondContact O-N 3.2Å |
| 19 | S | 79.6 | Confident | 76.5 | Confident | 30 Ų | 30 | 93.9 Ų | 93.9 | 21% | 0.21 | 50% | 0.503 | C | S | . | . | S | Bend | trans | -85.6 | 150.7 | -178.3 | 34.3 | 0 | 0 | 0 | 0 | 111.6 | L15 Y16 H24 | L15-S19 WeakPolarHBondContact O-CB 3.47Å; L15-S19 PolarHBondContact O-N 3.31Å; L15-S19 VanDerWaalsContact O-N 3.09Å; L15-S19 PolarHBondContact O-OG 3.07Å; Y16-S19 VanDerWaalsContact CA-OG 3.25Å; Y16-S19 WeakPolarHBondContact CA-OG 2.96Å; Y16-S19 PolarHBondContact O-N 3.21Å; Y16-S19 PolarHBondContact O-OG 3.03Å; S19-H24 PolarHBondContact O-NE2 3.48Å; S19-H24 PolarHBondContact OG-CD2 3.33Å; S19-H24 VanDerWaalsContact OG-CD2 3.29Å; S19-H24 PolarHBondContact OG-NE2 2.82Å |
| 20 | S | 80.7 | Confident | 77.2 | Confident | 59 Ų | 59 | 97.7 Ų | 97.7 | 41% | 0.413 | 52% | 0.516 | S | S | . | . | trans | -76.9 | 160.2 | 177.6 | 71.6 | 0 | 0 | 0 | 0 | 111.1 | A22 D23 H24 | S20-A22 PolarHBondContact O-N 2.87Å; S20-A22 VanDerWaalsContact O-N 3.12Å; S20-D23 WeakPolarHBondContact CB-OD2 3.48Å; S20-D23 PolarHBondContact N-OD2 3.13Å; S20-D23 WeakPolarHBondContact O-CB 3.43Å; S20-D23 PolarHBondContact O-N 3.14Å; S20-D23 VanDerWaalsContact OG-CG 3.32Å; S20-D23 PolarHBondContact OG-N 3.35Å; S20-D23 PolarHBondContact OG-OD2 2.89Å; S20-H24 PolarHBondContact O-CD2 2.63Å; S20-H24 PolarHBondContact O-N 2.93Å; S20-H24 VanDerWaalsContact O-N 3.13Å | ||
| 21 | A | 81.8 | Confident | 77.5 | Confident | 81 Ų | 81 | 94.3 Ų | 94.3 | 67% | 0.669 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -55.3 | -31.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | H24 E25 | A21-H24 WeakPolarHBondContact O-CB 3.4Å; A21-H24 PolarHBondContact O-N 3.24Å; A21-E25 PolarHBondContact O-N 3Å |
| 22 | A | 83.3 | Confident | 77.8 | Confident | 65 Ų | 65 | 94.9 Ų | 94.9 | 54% | 0.537 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.2 | -36.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | S20 H24 E25 R26 | S20-A22 PolarHBondContact O-N 2.87Å; S20-A22 VanDerWaalsContact O-N 3.12Å; A22-H24 VanDerWaalsContact C-N 3.32Å; A22-E25 PolarHBondContact O-N 3.14Å; A22-R26 PolarHBondContact O-N 2.99Å; A22-R26 VanDerWaalsContact O-N 3.07Å |
| 23 | D | 83.2 | Confident | 78.2 | Confident | 72 Ų | 72 | 90 Ų | 90 | 39% | 0.385 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.5 | -38.6 | 174.3 | -61.7 | -51.9 | 0 | 0 | 0 | 110.7 | S20 R26 I27 | S20-D23 WeakPolarHBondContact CB-OD2 3.48Å; S20-D23 PolarHBondContact N-OD2 3.13Å; S20-D23 WeakPolarHBondContact O-CB 3.43Å; S20-D23 PolarHBondContact O-N 3.14Å; S20-D23 VanDerWaalsContact OG-CG 3.32Å; S20-D23 PolarHBondContact OG-N 3.35Å; S20-D23 PolarHBondContact OG-OD2 2.89Å; D23-R26 PolarHBondContact O-N 2.87Å; D23-I27 VanDerWaalsContact O-CG1 3.32Å; D23-I27 WeakPolarHBondContact O-CG1 3.32Å; D23-I27 PolarHBondContact O-N 3.18Å |
| 24 | H | 80.8 | Confident | 77.9 | Confident | 37 Ų | 37 | 88.4 Ų | 88.4 | 17% | 0.171 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -62.9 | -43.4 | 176.5 | -60.4 | 175.8 | 0 | 0 | 0 | 111.4 | Y16 S19 S20 A21 A22 R26 I27 A28 | Y16-H24 AromaticContact CD1-CE1 3.79Å; Y16-H24 AromaticContact CD2-CD2 3.72Å; Y16-H24 AromaticContact CD2-CE1 3.89Å; Y16-H24 AromaticContact CD2-NE2 3.54Å; Y16-H24 AromaticContact CE1-CE1 3.4Å; Y16-H24 VanDerWaalsContact CE1-CE1 3.4Å; Y16-H24 WeakPolarHBondContact CE1-CE1 3.43Å; Y16-H24 AromaticContact CE1-ND1 3.79Å; Y16-H24 HydrophobicContact CE2-CB 4.2Å; Y16-H24 AromaticContact CE2-CD2 3.54Å; Y16-H24 AromaticContact CE2-CE1 3.56Å; Y16-H24 AromaticContact CE2-CG 3.51Å; Y16-H24 AromaticContact CE2-ND1 3.54Å; Y16-H24 AromaticContact CE2-NE2 3.57Å; Y16-H24 AromaticContact CG-NE2 3.79Å; Y16-H24 AromaticContact CZ-CE1 3.29Å; Y16-H24 AromaticContact CZ-CG 3.74Å; Y16-H24 AromaticContact CZ-ND1 3.24Å; Y16-H24 AromaticContact CZ-NE2 3.8Å; Y16-H24 PolarHBondContact O-CE1 3.27Å; Y16-H24 PolarHBondContact O-NE2 3.03Å; Y16-H24 PolarHBondContact OH-ND1 3.35Å; S19-H24 PolarHBondContact O-NE2 3.48Å; S19-H24 PolarHBondContact OG-CD2 3.33Å; S19-H24 VanDerWaalsContact OG-CD2 3.29Å; S19-H24 PolarHBondContact OG-NE2 2.82Å; S20-H24 PolarHBondContact O-CD2 2.63Å; S20-H24 PolarHBondContact O-N 2.93Å; S20-H24 VanDerWaalsContact O-N 3.13Å; A21-H24 WeakPolarHBondContact O-CB 3.4Å; A21-H24 PolarHBondContact O-N 3.24Å; A22-H24 VanDerWaalsContact C-N 3.32Å; H24-R26 VanDerWaalsContact C-N 3.33Å; H24-R26 PolarHBondContact O-N 3.15Å; H24-I27 PolarHBondContact O-N 3.16Å; H24-A28 VanDerWaalsContact O-CB 3.32Å; H24-A28 WeakPolarHBondContact O-CB 3.41Å; H24-A28 PolarHBondContact O-N 3.46Å |
| 25 | E | 83.8 | Confident | 77.4 | Confident | 146 Ų | 146 | 88 Ų | 88 | 68% | 0.682 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62.3 | -40.1 | 175.9 | -174 | 177.4 | -163.8 | 0 | 0 | 111.9 | A21 A22 A28 S29 | A21-E25 PolarHBondContact O-N 3Å; A22-E25 PolarHBondContact O-N 3.14Å; E25-A28 PolarHBondContact O-N 2.86Å; E25-S29 WeakPolarHBondContact O-CB 3.45Å; E25-S29 PolarHBondContact O-N 2.85Å; E25-S29 PolarHBondContact O-OG 2.87Å |
| 26 | R | 84 | Confident | 77 | Confident | 192 Ų | 192 | 87.3 Ų | 87.3 | 73% | 0.725 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.7 | -39.5 | 176.6 | -169.3 | 178.7 | -179.3 | -171 | 1.1 | 112.4 | A22 D23 H24 S29 K30 | A22-R26 PolarHBondContact O-N 2.99Å; A22-R26 VanDerWaalsContact O-N 3.07Å; D23-R26 PolarHBondContact O-N 2.87Å; H24-R26 VanDerWaalsContact C-N 3.33Å; H24-R26 PolarHBondContact O-N 3.15Å; R26-S29 WeakPolarHBondContact CA-OG 3.34Å; R26-S29 PolarHBondContact O-OG 3.41Å; R26-K30 WeakPolarHBondContact O-CB 3.35Å; R26-K30 PolarHBondContact O-N 2.94Å |
| 27 | I | 80.9 | Confident | 76.6 | Confident | 83 Ų | 83 | 92 Ų | 92 | 43% | 0.426 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.8 | -47.3 | 176.1 | -66.5 | 164.7 | 0 | 0 | 0 | 109.8 | D23 H24 S29 K30 D31 | D23-I27 VanDerWaalsContact O-CG1 3.32Å; D23-I27 WeakPolarHBondContact O-CG1 3.32Å; D23-I27 PolarHBondContact O-N 3.18Å; H24-I27 PolarHBondContact O-N 3.16Å; I27-S29 PolarHBondContact O-N 3.42Å; I27-K30 WeakPolarHBondContact O-CB 3.33Å; I27-K30 PolarHBondContact O-N 2.9Å; I27-K30 VanDerWaalsContact O-N 3.15Å; I27-D31 PolarHBondContact O-N 2.94Å |
| 28 | A | 80.2 | Confident | 75.9 | Confident | 39 Ų | 39 | 94 Ų | 94 | 32% | 0.322 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59 | -46.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | H24 E25 K30 D31 H32 | H24-A28 VanDerWaalsContact O-CB 3.32Å; H24-A28 WeakPolarHBondContact O-CB 3.41Å; H24-A28 PolarHBondContact O-N 3.46Å; E25-A28 PolarHBondContact O-N 2.86Å; A28-K30 VanDerWaalsContact C-N 3.33Å; A28-K30 PolarHBondContact O-N 2.84Å; A28-D31 PolarHBondContact O-N 2.68Å; A28-D31 VanDerWaalsContact O-N 3.16Å; A28-H32 WeakPolarHBondContact O-CB 3.32Å; A28-H32 PolarHBondContact O-CD2 2.95Å; A28-H32 PolarHBondContact O-N 3.01Å |
| 29 | S | 79.8 | Confident | 75.2 | Confident | 65 Ų | 65 | 94.6 Ų | 94.6 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.4 | -39.6 | 176.7 | 54.5 | 0 | 0 | 0 | 0 | 112.6 | E25 R26 I27 H32 S33 | E25-S29 WeakPolarHBondContact O-CB 3.45Å; E25-S29 PolarHBondContact O-N 2.85Å; E25-S29 PolarHBondContact O-OG 2.87Å; R26-S29 WeakPolarHBondContact CA-OG 3.34Å; R26-S29 PolarHBondContact O-OG 3.41Å; I27-S29 PolarHBondContact O-N 3.42Å; S29-H32 PolarHBondContact O-N 2.88Å; S29-S33 PolarHBondContact O-N 3.49Å |
| 30 | K | 80.7 | Confident | 74.6 | Confident | 154 Ų | 154 | 101.2 Ų | 101.2 | 67% | 0.67 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.5 | -43.8 | 172.8 | -174.6 | -177.5 | 178.1 | -174.2 | 0 | 111.4 | R26 I27 A28 S33 G34 | R26-K30 WeakPolarHBondContact O-CB 3.35Å; R26-K30 PolarHBondContact O-N 2.94Å; I27-K30 WeakPolarHBondContact O-CB 3.33Å; I27-K30 PolarHBondContact O-N 2.9Å; I27-K30 VanDerWaalsContact O-N 3.15Å; A28-K30 VanDerWaalsContact C-N 3.33Å; A28-K30 PolarHBondContact O-N 2.84Å; K30-S33 WeakPolarHBondContact O-CB 3.37Å; K30-S33 PolarHBondContact O-N 2.96Å; K30-S33 PolarHBondContact O-OG 3.28Å; K30-G34 PolarHBondContact O-N 3.07Å |
| 31 | D | 72.9 | Confident | 73.8 | Confident | 59 Ų | 59 | 103.3 Ų | 103.3 | 32% | 0.316 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -67.1 | -41.6 | 179.1 | -70.5 | -16.9 | 0 | 0 | 0 | 111.6 | H8 I27 A28 S33 G34 I35 | H8-D31 IonicContact CD2-OD2 3.52Å; H8-D31 IonicContact NE2-OD1 3.95Å; H8-D31 IonicContact NE2-OD2 3.7Å; I27-D31 PolarHBondContact O-N 2.94Å; A28-D31 PolarHBondContact O-N 2.68Å; A28-D31 VanDerWaalsContact O-N 3.16Å; D31-S33 VanDerWaalsContact C-N 3.28Å; D31-S33 PolarHBondContact O-N 3.3Å; D31-G34 CarbonylContact O-C 3.57Å; D31-G34 WeakPolarHBondContact O-CA 3.41Å; D31-G34 PolarHBondContact O-N 3.45Å; D31-I35 WeakPolarHBondContact O-CG1 3.5Å; D31-I35 PolarHBondContact O-N 3.13Å |
| 32 | H | 72.4 | Confident | 73 | Confident | 125 Ų | 125 | 106.4 Ų | 106.4 | 58% | 0.579 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -58.3 | -39.5 | 173.1 | -75.1 | -60 | 0 | 0 | 0 | 112.3 | A28 S29 G34 I35 | A28-H32 WeakPolarHBondContact O-CB 3.32Å; A28-H32 PolarHBondContact O-CD2 2.95Å; A28-H32 PolarHBondContact O-N 3.01Å; S29-H32 PolarHBondContact O-N 2.88Å; H32-G34 PolarHBondContact O-N 3.44Å; H32-I35 PolarHBondContact O-N 3.13Å; H32-I35 VanDerWaalsContact O-N 3.14Å |
| 33 | S | 73.8 | Confident | 72.1 | Confident | 77 Ų | 77 | 104.7 Ų | 104.7 | 54% | 0.538 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.9 | -30.6 | 173.8 | 82.7 | 0 | 0 | 0 | 0 | 112.6 | S29 K30 D31 | S29-S33 PolarHBondContact O-N 3.49Å; K30-S33 WeakPolarHBondContact O-CB 3.37Å; K30-S33 PolarHBondContact O-N 2.96Å; K30-S33 PolarHBondContact O-OG 3.28Å; D31-S33 VanDerWaalsContact C-N 3.28Å; D31-S33 PolarHBondContact O-N 3.3Å |
| 34 | G | 66.6 | Low | 71.4 | Confident | 34 Ų | 34 | 107.6 Ų | 107.6 | 35% | 0.351 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -73.7 | -31.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | K30 D31 H32 S36 K37 | K30-G34 PolarHBondContact O-N 3.07Å; D31-G34 CarbonylContact O-C 3.57Å; D31-G34 WeakPolarHBondContact O-CA 3.41Å; D31-G34 PolarHBondContact O-N 3.45Å; H32-G34 PolarHBondContact O-N 3.44Å; G34-S36 VanDerWaalsContact C-N 3.26Å; G34-S36 PolarHBondContact O-N 3.04Å; G34-K37 WeakPolarHBondContact O-CB 3.41Å; G34-K37 PolarHBondContact O-N 3.34Å |
| 35 | I | 63.2 | Low | 70.8 | Confident | 85 Ų | 85 | 112.4 Ų | 112.4 | 44% | 0.436 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.7 | -31.8 | 178.9 | -64.6 | 169.8 | 0 | 0 | 0 | 111.6 | D31 H32 K37 M38 | D31-I35 WeakPolarHBondContact O-CG1 3.5Å; D31-I35 PolarHBondContact O-N 3.13Å; H32-I35 PolarHBondContact O-N 3.13Å; H32-I35 VanDerWaalsContact O-N 3.14Å; I35-K37 PolarHBondContact O-N 2.85Å; I35-K37 VanDerWaalsContact O-N 3.14Å; I35-M38 HydrophobicContact CB-SD 4.46Å; I35-M38 HydrophobicContact CG1-SD 4.15Å; I35-M38 HydrophobicContact CG2-SD 4.37Å; I35-M38 VanDerWaalsContact O-CB 3.27Å; I35-M38 WeakPolarHBondContact O-CB 3.31Å; I35-M38 PolarHBondContact O-N 2.95Å |
| 36 | S | 64.5 | Low | 70 | Confident | 110 Ų | 110 | 110.4 Ų | 110.4 | 77% | 0.769 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.1 | -32 | 172.7 | 144.4 | 0 | 0 | 0 | 0 | 112.6 | G34 | G34-S36 VanDerWaalsContact C-N 3.26Å; G34-S36 PolarHBondContact O-N 3.04Å |
| 37 | K | 62.7 | Low | 69.4 | Low | 176 Ų | 176 | 105.7 Ų | 105.7 | 77% | 0.765 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86 | -7.4 | 176.8 | -57.7 | -178 | -177.2 | 178.8 | 0 | 113.4 | G34 I35 Q39 | G34-K37 WeakPolarHBondContact O-CB 3.41Å; G34-K37 PolarHBondContact O-N 3.34Å; I35-K37 PolarHBondContact O-N 2.85Å; I35-K37 VanDerWaalsContact O-N 3.14Å; K37-Q39 PolarHBondContact O-N 2.83Å |
| 38 | M | 60.9 | Low | 69 | Low | 138 Ų | 138 | 104.4 Ų | 104.4 | 68% | 0.68 | 54% | 0.536 | S | S | * | . | trans | -69.4 | 99.7 | 174 | -70.3 | -175.1 | 166.3 | 0 | 0 | 107.8 | I35 K40 | I35-M38 HydrophobicContact CB-SD 4.46Å; I35-M38 HydrophobicContact CG1-SD 4.15Å; I35-M38 HydrophobicContact CG2-SD 4.37Å; I35-M38 VanDerWaalsContact O-CB 3.27Å; I35-M38 WeakPolarHBondContact O-CB 3.31Å; I35-M38 PolarHBondContact O-N 2.95Å; M38-K40 PolarHBondContact O-N 3.12Å | ||
| 39 | Q | 64.2 | Low | 68.5 | Low | 160 Ų | 160 | 106.9 Ų | 106.9 | 75% | 0.748 | 55% | 0.551 | S | S | * | * | trans | -50 | 134.9 | 167.4 | -66.7 | -175.8 | -6.8 | 0 | 0 | 107.8 | K37 L41 | K37-Q39 PolarHBondContact O-N 2.83Å; Q39-L41 PolarHBondContact O-N 3.3Å | ||
| 40 | K | 66.2 | Low | 68.2 | Low | 169 Ų | 169 | 112.4 Ų | 112.4 | 74% | 0.735 | 57% | 0.569 | S | S | * | * | trans | -61.1 | 88.6 | 170.7 | -175.6 | 179.4 | -178.1 | -177 | 0 | 106.8 | M38 F42 | M38-K40 PolarHBondContact O-N 3.12Å; K40-F42 PolarHBondContact O-N 3.01Å | ||
| 41 | L | 64.6 | Low | 68 | Low | 102 Ų | 102 | 109 Ų | 109 | 53% | 0.534 | 56% | 0.558 | S | S | . | * | trans | -55.9 | -34.1 | -167.8 | -76.1 | 168.5 | 0 | 0 | 0 | 110.6 | K4 Q39 | K4-L41 VanDerWaalsContact NZ-CD1 3.25Å; Q39-L41 PolarHBondContact O-N 3.3Å | ||
| 42 | F | 63.7 | Low | 67.9 | Low | 147 Ų | 147 | 112.4 Ų | 112.4 | 65% | 0.645 | 58% | 0.583 | S | S | * | * | trans | -148.9 | 132.7 | 176.1 | -53.8 | -80 | 0 | 0 | 0 | 111 | K40 L47 | K40-F42 PolarHBondContact O-N 3.01Å; F42-L47 HydrophobicContact CB-CD1 3.36Å; F42-L47 HydrophobicContact CB-CG 3.95Å; F42-L47 HydrophobicContact CD1-CG 4.48Å; F42-L47 HydrophobicContact CG-CD1 4.21Å; F42-L47 HydrophobicContact CG-CG 4.32Å | ||
| 43 | S | 66.3 | Low | 68.2 | Low | 28 Ų | 28 | 113.9 Ų | 113.9 | 20% | 0.196 | 59% | 0.593 | C | S | . | * | trans | -77.5 | 126.2 | 159.6 | -172.5 | 0 | 0 | 0 | 0 | 107.3 | Q45 N46 L47 | S43-Q45 PolarHBondContact O-N 3.2Å; S43-N46 WeakPolarHBondContact O-CA 3.49Å; S43-N46 PolarHBondContact O-N 3.19Å; S43-L47 WeakPolarHBondContact O-CD1 3.4Å; S43-L47 PolarHBondContact O-N 3.4Å | ||
| 44 | F | 67.7 | Low | 68.2 | Low | 133 Ų | 133 | 113.7 Ų | 113.7 | 58% | 0.583 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -51.6 | -33.4 | 179 | -170.6 | -106.7 | 0 | 0 | 0 | 112.7 | N46 F48 Y54 | F44-N46 VanDerWaalsContact C-N 3.28Å; F44-N46 PolarHBondContact O-N 3.45Å; F44-F48 HydrophobicContact CD2-CE2 4.01Å; F44-F48 HydrophobicContact CE1-CE2 4.2Å; F44-F48 AromaticContact CE2-CE2 3.57Å; F44-F48 HydrophobicContact CE2-CE2 3.57Å; F44-F48 HydrophobicContact CE2-CZ 4.14Å; F44-F48 HydrophobicContact CG-CE2 4.5Å; F44-F48 AromaticContact CZ-CE2 3.68Å; F44-F48 HydrophobicContact CZ-CE2 3.68Å; F44-F48 HydrophobicContact CZ-CZ 4.39Å; F44-Y54 WeakPolarHBondContact CE1-OH 3.4Å |
| 45 | Q | 67.3 | Low | 68.3 | Low | 138 Ų | 138 | 122.8 Ų | 122.8 | 65% | 0.645 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -61.9 | -31.3 | 174.2 | -67.4 | 178 | -10.1 | 0 | 0 | 113.6 | S43 | S43-Q45 PolarHBondContact O-N 3.2Å |
| 46 | N | 68.4 | Low | 68.6 | Low | 105 Ų | 105 | 122.3 Ų | 122.3 | 56% | 0.561 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -89.7 | -26.2 | -176.2 | -66.1 | 17 | 0 | 0 | 0 | 112.9 | S43 F44 F48 S49 | S43-N46 WeakPolarHBondContact O-CA 3.49Å; S43-N46 PolarHBondContact O-N 3.19Å; F44-N46 VanDerWaalsContact C-N 3.28Å; F44-N46 PolarHBondContact O-N 3.45Å; N46-F48 PolarHBondContact O-N 3.29Å; N46-F48 VanDerWaalsContact O-N 3.14Å; N46-S49 WeakPolarHBondContact O-CB 3.25Å; N46-S49 PolarHBondContact O-N 3.13Å; N46-S49 VanDerWaalsContact O-N 3.15Å; N46-S49 PolarHBondContact O-OG 3.09Å |
| 47 | L | 71 | Confident | 68.9 | Low | 92 Ų | 92 | 125.8 Ų | 125.8 | 48% | 0.482 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -56.3 | -33.2 | -178.8 | -85.1 | 103.2 | 0 | 0 | 0 | 112.5 | F42 S43 | F42-L47 HydrophobicContact CB-CD1 3.36Å; F42-L47 HydrophobicContact CB-CG 3.95Å; F42-L47 HydrophobicContact CD1-CG 4.48Å; F42-L47 HydrophobicContact CG-CD1 4.21Å; F42-L47 HydrophobicContact CG-CG 4.32Å; S43-L47 WeakPolarHBondContact O-CD1 3.4Å; S43-L47 PolarHBondContact O-N 3.4Å |
| 48 | F | 71.9 | Confident | 69.4 | Low | 57 Ų | 57 | 124.5 Ų | 124.5 | 25% | 0.25 | 61% | 0.605 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -110.3 | 14 | -175.2 | -50.5 | -72 | 0 | 0 | 0 | 112.6 | F44 N46 E50 I51 Y54 | F44-F48 HydrophobicContact CD2-CE2 4.01Å; F44-F48 HydrophobicContact CE1-CE2 4.2Å; F44-F48 AromaticContact CE2-CE2 3.57Å; F44-F48 HydrophobicContact CE2-CE2 3.57Å; F44-F48 HydrophobicContact CE2-CZ 4.14Å; F44-F48 HydrophobicContact CG-CE2 4.5Å; F44-F48 AromaticContact CZ-CE2 3.68Å; F44-F48 HydrophobicContact CZ-CE2 3.68Å; F44-F48 HydrophobicContact CZ-CZ 4.39Å; N46-F48 PolarHBondContact O-N 3.29Å; N46-F48 VanDerWaalsContact O-N 3.14Å; F48-E50 PolarHBondContact O-N 2.71Å; F48-I51 HydrophobicContact CB-CD1 4.47Å; F48-I51 HydrophobicContact CD1-CD1 3.86Å; F48-I51 PolarHBondContact O-N 3.25Å; F48-Y54 HydrophobicContact CB-CD1 3.32Å; F48-Y54 HydrophobicContact CB-CD2 3.92Å; F48-Y54 HydrophobicContact CB-CE1 3.8Å; F48-Y54 HydrophobicContact CB-CE2 4.34Å; F48-Y54 HydrophobicContact CB-CG 3.37Å; F48-Y54 HydrophobicContact CD1-CD2 4.36Å; F48-Y54 HydrophobicContact CD2-CD1 4.01Å; F48-Y54 HydrophobicContact CD2-CD2 4.09Å; F48-Y54 AromaticContact CD2-CE1 3.57Å; F48-Y54 HydrophobicContact CD2-CE1 3.57Å; F48-Y54 AromaticContact CD2-CE2 3.67Å; F48-Y54 HydrophobicContact CD2-CE2 3.67Å; F48-Y54 HydrophobicContact CD2-CG 4.24Å; F48-Y54 AromaticContact CD2-CZ 3.39Å; F48-Y54 HydrophobicContact CE2-CE1 4.5Å; F48-Y54 HydrophobicContact CE2-CE2 4.06Å; F48-Y54 AromaticContact CE2-CZ 3.91Å; F48-Y54 AromaticContact CG-CD1 3.93Å; F48-Y54 HydrophobicContact CG-CD1 3.93Å; F48-Y54 AromaticContact CG-CD2 3.86Å; F48-Y54 HydrophobicContact CG-CD2 3.86Å; F48-Y54 AromaticContact CG-CE1 4Å; F48-Y54 HydrophobicContact CG-CE1 4Å; F48-Y54 AromaticContact CG-CE2 3.93Å; F48-Y54 HydrophobicContact CG-CE2 3.93Å; F48-Y54 AromaticContact CG-CG 3.85Å; F48-Y54 HydrophobicContact CG-CG 3.85Å; F48-Y54 AromaticContact CG-CZ 4Å |
| 49 | S | 69 | Low | 70 | Confident | 90 Ų | 90 | 124.8 Ų | 124.8 | 63% | 0.629 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.1 | -28.9 | 179.1 | 58.2 | 0 | 0 | 0 | 0 | 112.8 | N46 I51 | N46-S49 WeakPolarHBondContact O-CB 3.25Å; N46-S49 PolarHBondContact O-N 3.13Å; N46-S49 VanDerWaalsContact O-N 3.15Å; N46-S49 PolarHBondContact O-OG 3.09Å; S49-I51 VanDerWaalsContact C-N 3.29Å; S49-I51 PolarHBondContact O-N 3.22Å |
| 50 | E | 74.7 | Confident | 70.4 | Confident | 181 Ų | 181 | 120.9 Ų | 120.9 | 85% | 0.846 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -13.3 | 174.2 | -62.7 | -178.3 | -174.3 | 0 | 0 | 113.5 | F48 P52 | F48-E50 PolarHBondContact O-N 2.71Å; E50-P52 WeakPolarHBondContact O-CD 3.49Å |
| 51 | I | 75.3 | Confident | 70.4 | Confident | 84 Ų | 84 | 118.6 Ų | 118.6 | 43% | 0.431 | 59% | 0.594 | S | S | . | * | trans | -96.8 | 102.1 | -179.1 | -53.2 | -176.9 | 0 | 0 | 0 | 108.7 | F48 S49 I53 Y54 | F48-I51 HydrophobicContact CB-CD1 4.47Å; F48-I51 HydrophobicContact CD1-CD1 3.86Å; F48-I51 PolarHBondContact O-N 3.25Å; S49-I51 VanDerWaalsContact C-N 3.29Å; S49-I51 PolarHBondContact O-N 3.22Å; I51-I53 HydrophobicContact CG2-CB 4.4Å; I51-I53 PolarHBondContact O-N 3.24Å; I51-Y54 PolarHBondContact O-N 3.47Å | ||
| 52 | P | 71.9 | Confident | 69.8 | Low | 130 Ų | 130 | 118 Ų | 118 | 84% | 0.844 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -19.6 | -176.5 | 20.7 | -31.6 | 0 | 0 | 0 | 114.3 | E50 | E50-P52 WeakPolarHBondContact O-CD 3.49Š|
| 53 | I | 79.3 | Confident | 69.3 | Low | 155 Ų | 155 | 122.5 Ų | 122.5 | 80% | 0.795 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -19.7 | -179.8 | -58.2 | 173.1 | 0 | 0 | 0 | 111.7 | I51 R55 | I51-I53 HydrophobicContact CG2-CB 4.4Å; I51-I53 PolarHBondContact O-N 3.24Å; I53-R55 PolarHBondContact O-N 3.31Å |
| 54 | Y | 72.2 | Confident | 68.4 | Low | 73 Ų | 73 | 126.5 Ų | 126.5 | 29% | 0.286 | 64% | 0.637 | S | S | . | * | trans | -75.8 | 114.2 | -175.7 | -176.1 | -93.6 | 0 | 0 | 0 | 111.3 | F44 F48 I51 P56 | F44-Y54 WeakPolarHBondContact CE1-OH 3.4Å; F48-Y54 HydrophobicContact CB-CD1 3.32Å; F48-Y54 HydrophobicContact CB-CD2 3.92Å; F48-Y54 HydrophobicContact CB-CE1 3.8Å; F48-Y54 HydrophobicContact CB-CE2 4.34Å; F48-Y54 HydrophobicContact CB-CG 3.37Å; F48-Y54 HydrophobicContact CD1-CD2 4.36Å; F48-Y54 HydrophobicContact CD2-CD1 4.01Å; F48-Y54 HydrophobicContact CD2-CD2 4.09Å; F48-Y54 AromaticContact CD2-CE1 3.57Å; F48-Y54 HydrophobicContact CD2-CE1 3.57Å; F48-Y54 AromaticContact CD2-CE2 3.67Å; F48-Y54 HydrophobicContact CD2-CE2 3.67Å; F48-Y54 HydrophobicContact CD2-CG 4.24Å; F48-Y54 AromaticContact CD2-CZ 3.39Å; F48-Y54 HydrophobicContact CE2-CE1 4.5Å; F48-Y54 HydrophobicContact CE2-CE2 4.06Å; F48-Y54 AromaticContact CE2-CZ 3.91Å; F48-Y54 AromaticContact CG-CD1 3.93Å; F48-Y54 HydrophobicContact CG-CD1 3.93Å; F48-Y54 AromaticContact CG-CD2 3.86Å; F48-Y54 HydrophobicContact CG-CD2 3.86Å; F48-Y54 AromaticContact CG-CE1 4Å; F48-Y54 HydrophobicContact CG-CE1 4Å; F48-Y54 AromaticContact CG-CE2 3.93Å; F48-Y54 HydrophobicContact CG-CE2 3.93Å; F48-Y54 AromaticContact CG-CG 3.85Å; F48-Y54 HydrophobicContact CG-CG 3.85Å; F48-Y54 AromaticContact CG-CZ 4Å; I51-Y54 PolarHBondContact O-N 3.47Å; Y54-P56 HydrophobicContact CE1-CB 4.24Å | ||
| 55 | R | 70.3 | Confident | 68 | Low | 225 Ų | 225 | 126.5 Ų | 126.5 | 85% | 0.849 | 65% | 0.647 | S | S | * | * | trans | -103.1 | 124.4 | 165.8 | -71.6 | -172.4 | -176.1 | -167.3 | 1.8 | 109.2 | I53 Y57 | I53-R55 PolarHBondContact O-N 3.31Å; R55-Y57 PolarHBondContact O-N 3.03Å | ||
| 56 | P | 68 | Low | 67.6 | Low | 75 Ų | 75 | 128.1 Ų | 128.1 | 49% | 0.487 | 66% | 0.655 | S | S | . | * | trans | -61.2 | 134.4 | 173.5 | 25.1 | -31.8 | 0 | 0 | 0 | 109.7 | Y54 I58 | Y54-P56 HydrophobicContact CE1-CB 4.24Å; P56-I58 PolarHBondContact O-N 2.87Å | ||
| 57 | Y | 71.3 | Confident | 67 | Low | 184 Ų | 184 | 133 Ų | 133 | 72% | 0.722 | 67% | 0.671 | S | S | * | * | trans | -69.4 | 112.8 | 173 | -174.8 | -99.2 | 0 | 0 | 0 | 109 | R55 F59 | R55-Y57 PolarHBondContact O-N 3.03Å; Y57-F59 HydrophobicContact CD1-CD2 4.03Å; Y57-F59 AromaticContact CE1-CD2 3.7Å; Y57-F59 HydrophobicContact CE1-CD2 3.7Å; Y57-F59 HydrophobicContact CE1-CE2 4.21Å; Y57-F59 HydrophobicContact CE1-CG 4.33Å; Y57-F59 PolarHBondContact O-N 3.4Å | ||
| 58 | I | 72.8 | Confident | 66.6 | Low | 149 Ų | 149 | 134.3 Ų | 134.3 | 76% | 0.764 | 68% | 0.683 | S | S | * | * | trans | -78.3 | 103.9 | 171.6 | -58.4 | 172.9 | 0 | 0 | 0 | 105.8 | P56 | P56-I58 PolarHBondContact O-N 2.87Š| ||
| 59 | F | 75 | Confident | 65.9 | Low | 144 Ų | 144 | 136.4 Ų | 136.4 | 63% | 0.632 | 70% | 0.696 | S | S | * | * | trans | -57.1 | 126.9 | 168.4 | -138.6 | -92.6 | 0 | 0 | 0 | 106.8 | Y57 | Y57-F59 HydrophobicContact CD1-CD2 4.03Å; Y57-F59 AromaticContact CE1-CD2 3.7Å; Y57-F59 HydrophobicContact CE1-CD2 3.7Å; Y57-F59 HydrophobicContact CE1-CE2 4.21Å; Y57-F59 HydrophobicContact CE1-CG 4.33Å; Y57-F59 PolarHBondContact O-N 3.4Å | ||
| 60 | P | 70.6 | Confident | 65.8 | Low | 78 Ų | 78 | 137.8 Ų | 137.8 | 51% | 0.506 | 70% | 0.703 | S | S | . | * | trans | -53.8 | 142.5 | 171.9 | 23.2 | -31.4 | 0 | 0 | 0 | 107.5 | C62 | P60-C62 PolarHBondContact O-N 3.48Š| ||
| 61 | P | 67.2 | Low | 65.5 | Low | 121 Ų | 121 | 135.7 Ų | 135.7 | 79% | 0.786 | 70% | 0.698 | S | S | * | * | trans | -51.6 | 115.7 | -176.5 | 21.4 | -32.1 | 0 | 0 | 0 | 107.7 | R63 | P61-R63 PolarHBondContact O-N 2.89Š| ||
| 62 | C | 52.3 | Low | 64.6 | Low | 89 Ų | 89 | 136.1 Ų | 136.1 | 60% | 0.601 | 71% | 0.708 | S | S | * | * | trans | -50.5 | 118.4 | 166.5 | -67.5 | 0 | 0 | 0 | 0 | 104.3 | P60 C64 | P60-C62 PolarHBondContact O-N 3.48Å; C62-C64 PolarHBondContact O-N 3.33Å | ||
| 63 | R | 52.1 | Low | 64.4 | Low | 242 Ų | 242 | 137.6 Ų | 137.6 | 91% | 0.913 | 73% | 0.732 | S | S | * | * | trans | -57.2 | 95.9 | 167.6 | -83.2 | -171 | 179.3 | -157.1 | 1.4 | 104.8 | P61 V65 | P61-R63 PolarHBondContact O-N 2.89Å; R63-V65 VanDerWaalsContact C-N 3.26Å; R63-V65 PolarHBondContact O-N 3.29Å | ||
| 64 | C | 47.5 | Very low | 63.6 | Low | 112 Ų | 112 | 136.8 Ų | 136.8 | 76% | 0.757 | 73% | 0.728 | S | S | * | * | trans | -57.4 | 105.7 | 164.5 | -65.7 | 0 | 0 | 0 | 0 | 103.3 | C62 Q66 | C62-C64 PolarHBondContact O-N 3.33Å; C64-Q66 VanDerWaalsContact C-N 3.28Å; C64-Q66 PolarHBondContact O-N 3.23Å | ||
| 65 | V | 59.3 | Low | 63.2 | Low | 132 Ų | 132 | 140.1 Ų | 140.1 | 80% | 0.8 | 75% | 0.752 | S | S | * | * | trans | -50.6 | 108 | 163.6 | -178.8 | 0 | 0 | 0 | 0 | 103.4 | R63 K67 | R63-V65 VanDerWaalsContact C-N 3.26Å; R63-V65 PolarHBondContact O-N 3.29Å; V65-K67 PolarHBondContact O-N 2.93Å | ||
| 66 | Q | 59.6 | Low | 62.8 | Low | 173 Ų | 173 | 135.4 Ų | 135.4 | 81% | 0.808 | 75% | 0.746 | S | S | * | * | trans | -53.2 | 117.1 | 174.8 | -77.8 | 176.5 | -18.9 | 0 | 0 | 104.7 | C64 V68 | C64-Q66 VanDerWaalsContact C-N 3.28Å; C64-Q66 PolarHBondContact O-N 3.23Å; Q66-V68 VanDerWaalsContact C-N 3.28Å; Q66-V68 PolarHBondContact O-N 3.39Å | ||
| 67 | K | 56 | Low | 62.5 | Low | 207 Ų | 207 | 138.9 Ų | 138.9 | 90% | 0.9 | 76% | 0.762 | S | S | * | * | trans | -56.6 | 105.9 | 167.2 | -80.9 | -175.1 | 176.3 | -179 | 0 | 104.9 | V65 N69 | V65-K67 PolarHBondContact O-N 2.93Å; K67-N69 PolarHBondContact O-N 2.71Å; K67-N69 VanDerWaalsContact O-N 3.12Å | ||
| 68 | V | 61.7 | Low | 61.9 | Low | 120 Ų | 120 | 136.1 Ų | 136.1 | 73% | 0.727 | 76% | 0.764 | S | S | * | * | trans | -58.7 | 119.7 | 172.7 | -156.1 | 0 | 0 | 0 | 0 | 104.9 | Q66 P70 | Q66-V68 VanDerWaalsContact C-N 3.28Å; Q66-V68 PolarHBondContact O-N 3.39Å; V68-P70 WeakPolarHBondContact O-CD 3.48Å | ||
| 69 | N | 58.7 | Low | 61.2 | Low | 100 Ų | 100 | 135.3 Ų | 135.3 | 54% | 0.535 | 76% | 0.764 | S | S | . | * | trans | -66.1 | 119.2 | 177.7 | -174.5 | -14.1 | 0 | 0 | 0 | 107.1 | K67 N71 S72 | K67-N69 PolarHBondContact O-N 2.71Å; K67-N69 VanDerWaalsContact O-N 3.12Å; N69-N71 PolarHBondContact O-N 3.35Å; N69-N71 PolarHBondContact OD1-N 2.96Å; N69-S72 PolarHBondContact O-N 3.01Å; N69-S72 PolarHBondContact O-OG 3.12Å | ||
| 70 | P | 65.4 | Low | 60.2 | Low | 119 Ų | 119 | 134.6 Ų | 134.6 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.3 | -6.5 | -175.2 | 25.4 | -33.5 | 0 | 0 | 0 | 114 | V68 | V68-P70 WeakPolarHBondContact O-CD 3.48Š|
| 71 | N | 68.8 | Low | 59.4 | Low | 137 Ų | 137 | 139 Ų | 139 | 73% | 0.733 | 79% | 0.794 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | 15.4 | 176.4 | -60.9 | -34.4 | 0 | 0 | 0 | 113.8 | N69 A73 | N69-N71 PolarHBondContact O-N 3.35Å; N69-N71 PolarHBondContact OD1-N 2.96Å; N71-A73 PolarHBondContact O-N 3.43Å |
| 72 | S | 57.6 | Low | 58.8 | Low | 93 Ų | 93 | 140.5 Ų | 140.5 | 65% | 0.65 | 80% | 0.795 | S | S | * | * | trans | -95.1 | 69.5 | 168.4 | 68.5 | 0 | 0 | 0 | 0 | 110.7 | N69 | N69-S72 PolarHBondContact O-N 3.01Å; N69-S72 PolarHBondContact O-OG 3.12Å | ||
| 73 | A | 66.5 | Low | 59.4 | Low | 162 Ų | 162 | 145.2 Ų | 145.2 | 100% | 1.339 | 81% | 0.812 | S | S | * | * | trans | -150 | 0 | 159.4 | 0 | 0 | 0 | 0 | 0 | 107 | N71 | N71-A73 PolarHBondContact O-N 3.43Š|
Retrieved 73 of 73 residues in 41.3 ms
(Link to these results)