| 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 | 32.7 | Very low | 45.9 | Very low | 243 Ų | 243 | 113 Ų | 113 | 100% | 1.197 | 62% | 0.623 | S | S | * | * | 0 | 131.6 | 0 | -80.6 | 167 | 163.9 | 0 | 0 | 107 | E3 | M1-E3 PolarHBondContact O-N 3.19Å; M1-E3 VanDerWaalsContact O-N 3.11Å | |||
| 2 | S | 45.9 | Very low | 46.5 | Very low | 124 Ų | 124 | 104.6 Ų | 104.6 | 87% | 0.867 | 58% | 0.578 | S | S | * | * | trans | -58.2 | 110.5 | -175.9 | -51.8 | 0 | 0 | 0 | 0 | 110.2 | N4 | S2-N4 VanDerWaalsContact C-N 3.29Å; S2-N4 PolarHBondContact O-N 3.33Å | ||
| 3 | E | 39.3 | Very low | 46.6 | Very low | 170 Ų | 170 | 105.8 Ų | 105.8 | 79% | 0.794 | 58% | 0.583 | S | S | * | * | trans | -70.1 | 98.8 | 168.6 | -156.1 | 166.9 | 96 | 0 | 0 | 105.9 | M1 S5 | M1-E3 PolarHBondContact O-N 3.19Å; M1-E3 VanDerWaalsContact O-N 3.11Å; E3-S5 PolarHBondContact O-N 3.25Å | ||
| 4 | N | 41.6 | Very low | 46.7 | Very low | 119 Ų | 119 | 104.5 Ų | 104.5 | 64% | 0.636 | 59% | 0.585 | S | S | * | * | trans | -64.3 | 82 | 162.5 | -179.4 | 82.7 | 0 | 0 | 0 | 105.3 | S2 T6 | S2-N4 VanDerWaalsContact C-N 3.29Å; S2-N4 PolarHBondContact O-N 3.33Å; N4-T6 PolarHBondContact O-N 2.78Å | ||
| 5 | S | 43.7 | Very low | 46.8 | Very low | 89 Ų | 89 | 105.3 Ų | 105.3 | 62% | 0.622 | 60% | 0.6 | S | S | * | * | trans | -59.1 | 97 | 169.8 | -56.7 | 0 | 0 | 0 | 0 | 105.4 | E3 F7 | E3-S5 PolarHBondContact O-N 3.25Å; S5-F7 VanDerWaalsContact C-N 3.25Å; S5-F7 PolarHBondContact O-N 3.17Å | ||
| 6 | T | 52.5 | Low | 46.9 | Very low | 109 Ų | 109 | 105.2 Ų | 105.2 | 67% | 0.669 | 59% | 0.588 | S | S | * | * | trans | -54.6 | 100.1 | 169.2 | -62.6 | 0 | 0 | 0 | 0 | 105 | N4 S8 | N4-T6 PolarHBondContact O-N 2.78Å; T6-S8 PolarHBondContact O-N 2.78Å | ||
| 7 | F | 49.4 | Very low | 46.9 | Very low | 54 Ų | 54 | 107.4 Ų | 107.4 | 24% | 0.237 | 59% | 0.59 | C | S | . | * | trans | -65.8 | 101.1 | -179.5 | -175.6 | -95.7 | 0 | 0 | 0 | 106.6 | S5 Y16 A26 T29 C30 | S5-F7 VanDerWaalsContact C-N 3.25Å; S5-F7 PolarHBondContact O-N 3.17Å; F7-Y16 HydrophobicContact CE2-CE1 4.48Å; F7-A26 HydrophobicContact CD2-CB 4.22Å; F7-A26 HydrophobicContact CE2-CB 3.65Å; F7-A26 HydrophobicContact CZ-CB 4.02Å; F7-T29 HydrophobicContact CD1-CG2 3.53Å; F7-T29 HydrophobicContact CE1-CG2 4.1Å; F7-T29 HydrophobicContact CG-CG2 4.43Å; F7-C30 HydrophobicContact CE1-CB 3.93Å; F7-C30 HydrophobicContact CZ-CB 3.93Å | ||
| 8 | S | 47 | Very low | 47 | Very low | 57 Ų | 57 | 102.2 Ų | 102.2 | 40% | 0.399 | 56% | 0.563 | S | S | . | * | trans | -79.7 | 139.1 | 179 | -71.4 | 0 | 0 | 0 | 0 | 109 | T6 E10 D11 | T6-S8 PolarHBondContact O-N 2.78Å; S8-E10 PolarHBondContact O-N 2.73Å; S8-E10 VanDerWaalsContact O-N 3.16Å; S8-D11 WeakPolarHBondContact O-CB 3.35Å; S8-D11 PolarHBondContact O-N 3.11Å | ||
| 9 | P | 50.2 | Low | 46.8 | Very low | 49 Ų | 49 | 104.1 Ų | 104.1 | 32% | 0.318 | 57% | 0.567 | S | S | . | * | G | 310 helix | trans | -63.5 | -21.5 | -179 | 28.4 | -38.8 | 0 | 0 | 0 | 114.2 | D11 C12 F33 | P9-D11 PolarHBondContact O-N 3.46Å; P9-C12 VanDerWaalsContact O-CB 3.24Å; P9-C12 WeakPolarHBondContact O-CB 3.38Å; P9-C12 PolarHBondContact O-N 3.45Å; P9-F33 HydrophobicContact CB-CB 4.38Å; P9-F33 HydrophobicContact CB-CD1 3.1Å; P9-F33 HydrophobicContact CB-CD2 3.83Å; P9-F33 HydrophobicContact CB-CE1 3.07Å; P9-F33 HydrophobicContact CB-CE2 3.81Å; P9-F33 HydrophobicContact CB-CG 3.49Å; P9-F33 VanDerWaalsContact CB-CG 3.49Å; P9-F33 HydrophobicContact CB-CZ 3.45Å; P9-F33 VanDerWaalsContact CB-CZ 3.45Å; P9-F33 HydrophobicContact CG-CD1 4.02Å; P9-F33 HydrophobicContact CG-CD2 4.35Å; P9-F33 HydrophobicContact CG-CE1 3.46Å; P9-F33 VanDerWaalsContact CG-CE1 3.46Å; P9-F33 HydrophobicContact CG-CE2 3.85Å; P9-F33 HydrophobicContact CG-CG 4.43Å; P9-F33 HydrophobicContact CG-CZ 3.37Å |
| 10 | E | 50.9 | Low | 46.8 | Very low | 169 Ų | 169 | 102.8 Ų | 102.8 | 79% | 0.79 | 57% | 0.57 | S | S | * | * | G | 310 helix | trans | -68.6 | -19.1 | 173.5 | -56.8 | -173.8 | 100.4 | 0 | 0 | 112.6 | S8 C12 N13 | S8-E10 PolarHBondContact O-N 2.73Å; S8-E10 VanDerWaalsContact O-N 3.16Å; E10-C12 PolarHBondContact O-N 3.1Å; E10-N13 WeakPolarHBondContact O-CB 3.44Å; E10-N13 PolarHBondContact O-N 3.16Å |
| 11 | D | 51.7 | Low | 46.8 | Very low | 60 Ų | 60 | 102.3 Ų | 102.3 | 32% | 0.321 | 57% | 0.574 | S | S | . | * | G | 310 helix | trans | -74.9 | -15.3 | 172 | -156 | -124.7 | 0 | 0 | 0 | 111.3 | S8 P9 N13 Y16 | S8-D11 WeakPolarHBondContact O-CB 3.35Å; S8-D11 PolarHBondContact O-N 3.11Å; P9-D11 PolarHBondContact O-N 3.46Å; D11-N13 PolarHBondContact O-N 3.43Å; D11-Y16 WeakPolarHBondContact O-CB 3.43Å; D11-Y16 WeakPolarHBondContact OD1-CE1 3.47Å; D11-Y16 WeakPolarHBondContact OD1-CE2 2.91Å; D11-Y16 PolarHBondContact OD1-OH 2.8Å; D11-Y16 WeakPolarHBondContact OD2-CE2 3.1Å |
| 12 | C | 52.5 | Low | 47.4 | Very low | 12 Ų | 12 | 95.5 Ų | 95.5 | 8% | 0.081 | 54% | 0.542 | C | S | . | . | G | 310 helix | trans | -85.3 | 31 | 170 | -168.9 | 0 | 0 | 0 | 0 | 110.9 | P9 E10 C30 C34 | P9-C12 VanDerWaalsContact O-CB 3.24Å; P9-C12 WeakPolarHBondContact O-CB 3.38Å; P9-C12 PolarHBondContact O-N 3.45Å; E10-C12 PolarHBondContact O-N 3.1Å; C12-C30 HydrophobicContact CB-CB 4.01Å; C12-C30 WeakPolarHBondContact CB-SG 3.33Å; C12-C30 WeakPolarHBondContact SG-CB 3.45Å; C12-C30 CovalentContact SG-SG 2.03Å; C12-C30 PolarHBondContact SG-SG 3.31Å; C12-C34 PolarHBondContact SG-SG 3.21Å |
| 13 | N | 47.8 | Very low | 47.5 | Very low | 120 Ų | 120 | 91.7 Ų | 91.7 | 64% | 0.642 | 51% | 0.512 | S | S | * | . | S | Bend | trans | -78.4 | 149.2 | 170.5 | -165.9 | 9.1 | 0 | 0 | 0 | 109.5 | E10 D11 S15 Y16 | E10-N13 WeakPolarHBondContact O-CB 3.44Å; E10-N13 PolarHBondContact O-N 3.16Å; D11-N13 PolarHBondContact O-N 3.43Å; N13-S15 PolarHBondContact O-N 2.76Å; N13-Y16 PolarHBondContact O-N 3.32Å |
| 14 | S | 48.7 | Very low | 48.1 | Very low | 88 Ų | 88 | 94.2 Ų | 94.2 | 62% | 0.615 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.4 | -0.2 | -167.3 | -165.7 | 0 | 0 | 0 | 0 | 117.4 | ||
| 15 | S | 47.4 | Very low | 48.5 | Very low | 117 Ų | 117 | 98 Ų | 98 | 82% | 0.818 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115 | -2.1 | 177.2 | -66.2 | 0 | 0 | 0 | 0 | 114.3 | N13 K17 | N13-S15 PolarHBondContact O-N 2.76Å; S15-K17 PolarHBondContact O-N 3.38Å |
| 16 | Y | 48.3 | Very low | 48.8 | Very low | 103 Ų | 103 | 94.3 Ų | 94.3 | 40% | 0.404 | 49% | 0.494 | S | S | . | . | trans | -80.7 | 107 | 176.1 | -168.8 | -98.1 | 0 | 0 | 0 | 109.9 | F7 D11 N13 P18 | F7-Y16 HydrophobicContact CE2-CE1 4.48Å; D11-Y16 WeakPolarHBondContact O-CB 3.43Å; D11-Y16 WeakPolarHBondContact OD1-CE1 3.47Å; D11-Y16 WeakPolarHBondContact OD1-CE2 2.91Å; D11-Y16 PolarHBondContact OD1-OH 2.8Å; D11-Y16 WeakPolarHBondContact OD2-CE2 3.1Å; N13-Y16 PolarHBondContact O-N 3.32Å; Y16-P18 HydrophobicContact CD1-CB 4.23Å; Y16-P18 HydrophobicContact CD1-CG 3.83Å; Y16-P18 HydrophobicContact CE1-CB 3.74Å; Y16-P18 HydrophobicContact CE1-CG 3.84Å; Y16-P18 VanDerWaalsContact O-CD 3.3Å; Y16-P18 WeakPolarHBondContact O-CD 3.27Å | ||
| 17 | K | 47.7 | Very low | 48.9 | Very low | 142 Ų | 142 | 89.1 Ų | 89.1 | 62% | 0.617 | 46% | 0.462 | S | S | * | . | trans | -91.9 | 101 | 167.5 | -74.7 | 178.5 | 175.6 | 174.3 | 0 | 107.3 | S15 H19 G55 | S15-K17 PolarHBondContact O-N 3.38Å; K17-H19 PolarHBondContact O-N 2.91Å; K17-G55 WeakPolarHBondContact CE-O 3.33Å; K17-G55 PolarHBondContact NZ-O 2.92Å | ||
| 18 | P | 47.8 | Very low | 49.1 | Very low | 15 Ų | 15 | 92.1 Ų | 92.1 | 10% | 0.097 | 48% | 0.476 | C | S | . | . | trans | -63.7 | 137.7 | 175.1 | -4.8 | 18 | 0 | 0 | 0 | 108.3 | Y16 A20 L23 A26 | Y16-P18 HydrophobicContact CD1-CB 4.23Å; Y16-P18 HydrophobicContact CD1-CG 3.83Å; Y16-P18 HydrophobicContact CE1-CB 3.74Å; Y16-P18 HydrophobicContact CE1-CG 3.84Å; Y16-P18 VanDerWaalsContact O-CD 3.3Å; Y16-P18 WeakPolarHBondContact O-CD 3.27Å; P18-A20 PolarHBondContact O-N 3.47Å; P18-L23 HydrophobicContact CB-CD1 3.98Å; P18-L23 HydrophobicContact CG-CD1 3.73Å; P18-A26 HydrophobicContact CB-CB 4.34Å | ||
| 19 | H | 44.4 | Very low | 49.6 | Very low | 138 Ų | 138 | 92.1 Ų | 92.1 | 64% | 0.639 | 47% | 0.473 | S | S | * | . | trans | -53.3 | 133.1 | 167.5 | -167.5 | -100 | 0 | 0 | 0 | 108.8 | K17 S21 N22 L23 | K17-H19 PolarHBondContact O-N 2.91Å; H19-S21 PolarHBondContact ND1-OG 3.49Å; H19-S21 PolarHBondContact O-N 2.93Å; H19-N22 WeakPolarHBondContact O-CA 3.23Å; H19-N22 PolarHBondContact O-N 3.13Å; H19-L23 PolarHBondContact O-N 3.15Å | ||
| 20 | A | 46.3 | Very low | 49.9 | Very low | 77 Ų | 77 | 90.1 Ų | 90.1 | 64% | 0.636 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -50.2 | -33.1 | -168.4 | 0 | 0 | 0 | 0 | 0 | 114 | P18 N22 L23 | P18-A20 PolarHBondContact O-N 3.47Å; A20-N22 VanDerWaalsContact C-N 3.29Å; A20-N22 PolarHBondContact O-N 3.31Å; A20-L23 WeakPolarHBondContact O-CB 3.19Å; A20-L23 PolarHBondContact O-N 3.46Å |
| 21 | S | 47.3 | Very low | 50.3 | Low | 93 Ų | 93 | 82.2 Ų | 82.2 | 65% | 0.65 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -64 | -29.5 | 176.6 | -41.6 | 0 | 0 | 0 | 0 | 114 | H19 | H19-S21 PolarHBondContact ND1-OG 3.49Å; H19-S21 PolarHBondContact O-N 2.93Å |
| 22 | N | 44.4 | Very low | 50.4 | Low | 100 Ų | 100 | 83.9 Ų | 83.9 | 54% | 0.535 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -93.9 | -11.9 | 177 | -67.5 | -21.7 | 0 | 0 | 0 | 112.3 | H19 A20 R24 R25 A26 | H19-N22 WeakPolarHBondContact O-CA 3.23Å; H19-N22 PolarHBondContact O-N 3.13Å; A20-N22 VanDerWaalsContact C-N 3.29Å; A20-N22 PolarHBondContact O-N 3.31Å; N22-R24 VanDerWaalsContact C-N 3.29Å; N22-R24 PolarHBondContact O-N 3.23Å; N22-R25 PolarHBondContact O-N 2.01Å; N22-R25 VanDerWaalsContact O-N 3.15Å; N22-A26 WeakPolarHBondContact O-CB 3.11Å; N22-A26 PolarHBondContact O-N 3.5Å |
| 23 | L | 49.5 | Very low | 50.6 | Low | 45 Ų | 45 | 89.2 Ų | 89.2 | 24% | 0.236 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -61.4 | -31.5 | -176.1 | -152.5 | 104.7 | 0 | 0 | 0 | 113.3 | P18 H19 A20 G27 | P18-L23 HydrophobicContact CB-CD1 3.98Å; P18-L23 HydrophobicContact CG-CD1 3.73Å; H19-L23 PolarHBondContact O-N 3.15Å; A20-L23 WeakPolarHBondContact O-CB 3.19Å; A20-L23 PolarHBondContact O-N 3.46Å; L23-G27 WeakPolarHBondContact O-CA 3.14Å; L23-G27 PolarHBondContact O-N 3.05Å |
| 24 | R | 50.2 | Low | 50.8 | Low | 222 Ų | 222 | 86.5 Ų | 86.5 | 84% | 0.838 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -72.2 | -30.3 | 178.7 | -60 | -172.3 | 93.9 | -177.8 | 7.8 | 113 | N22 | N22-R24 VanDerWaalsContact C-N 3.29Å; N22-R24 PolarHBondContact O-N 3.23Å |
| 25 | R | 50 | Low | 50.9 | Low | 200 Ų | 200 | 83.2 Ų | 83.2 | 76% | 0.755 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -93.8 | -44.9 | -179.3 | -165.8 | 172.1 | 172.5 | -170.7 | -4.7 | 111 | N22 T29 | N22-R25 PolarHBondContact O-N 2.01Å; N22-R25 VanDerWaalsContact O-N 3.15Å; R25-T29 PolarHBondContact O-N 3.48Å; R25-T29 PolarHBondContact O-OG1 2.75Å |
| 26 | A | 51.6 | Low | 50.8 | Low | 10 Ų | 10 | 80.1 Ų | 80.1 | 8% | 0.083 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -67.3 | -39.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | F7 P18 N22 K28 T29 C30 | F7-A26 HydrophobicContact CD2-CB 4.22Å; F7-A26 HydrophobicContact CE2-CB 3.65Å; F7-A26 HydrophobicContact CZ-CB 4.02Å; P18-A26 HydrophobicContact CB-CB 4.34Å; N22-A26 WeakPolarHBondContact O-CB 3.11Å; N22-A26 PolarHBondContact O-N 3.5Å; A26-K28 PolarHBondContact O-N 2.83Å; A26-T29 PolarHBondContact O-N 3.49Å; A26-C30 WeakPolarHBondContact O-CB 3.01Å; A26-C30 PolarHBondContact O-N 3.46Å |
| 27 | G | 54.4 | Low | 50.5 | Low | 0 Ų | 0 | 85 Ų | 85 | 0% | 0 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L23 T29 C30 C31 | L23-G27 WeakPolarHBondContact O-CA 3.14Å; L23-G27 PolarHBondContact O-N 3.05Å; G27-T29 PolarHBondContact O-N 2.95Å; G27-C30 PolarHBondContact O-N 2.85Å; G27-C31 VanDerWaalsContact O-CB 3.24Å; G27-C31 WeakPolarHBondContact O-CB 3.24Å; G27-C31 PolarHBondContact O-N 3.31Å; G27-C31 PolarHBondContact O-SG 2.91Å |
| 28 | K | 53.8 | Low | 50.2 | Low | 118 Ų | 118 | 82 Ų | 82 | 51% | 0.513 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60 | -47.9 | 174.8 | -167 | -172.1 | 171.1 | -172.2 | 0 | 111.6 | A26 C31 E32 | A26-K28 PolarHBondContact O-N 2.83Å; K28-C31 PolarHBondContact O-N 3.22Å; K28-E32 WeakPolarHBondContact CE-OE2 3.32Å; K28-E32 WeakPolarHBondContact CG-OE2 3.48Å; K28-E32 WeakPolarHBondContact O-CB 3.21Å; K28-E32 VanDerWaalsContact O-CG 3.29Å; K28-E32 WeakPolarHBondContact O-CG 3.29Å; K28-E32 PolarHBondContact O-N 3.26Å |
| 29 | T | 56.4 | Low | 49.9 | Very low | 56 Ų | 56 | 87.1 Ų | 87.1 | 34% | 0.344 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -69.9 | -38.7 | -179.4 | -53.4 | 0 | 0 | 0 | 0 | 113.1 | F7 R25 A26 G27 E32 F33 | F7-T29 HydrophobicContact CD1-CG2 3.53Å; F7-T29 HydrophobicContact CE1-CG2 4.1Å; F7-T29 HydrophobicContact CG-CG2 4.43Å; R25-T29 PolarHBondContact O-N 3.48Å; R25-T29 PolarHBondContact O-OG1 2.75Å; A26-T29 PolarHBondContact O-N 3.49Å; G27-T29 PolarHBondContact O-N 2.95Å; T29-E32 PolarHBondContact O-N 2.76Å; T29-F33 VanDerWaalsContact O-CB 3.27Å; T29-F33 WeakPolarHBondContact O-CB 3.37Å; T29-F33 PolarHBondContact O-N 3.15Å |
| 30 | C | 57.5 | Low | 50.1 | Low | 8 Ų | 8 | 87.9 Ų | 87.9 | 5% | 0.054 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -67.8 | -39.1 | 175.7 | -179.3 | 0 | 0 | 0 | 0 | 110.6 | F7 C12 A26 G27 F33 C34 | F7-C30 HydrophobicContact CE1-CB 3.93Å; F7-C30 HydrophobicContact CZ-CB 3.93Å; C12-C30 HydrophobicContact CB-CB 4.01Å; C12-C30 WeakPolarHBondContact CB-SG 3.33Å; C12-C30 WeakPolarHBondContact SG-CB 3.45Å; C12-C30 CovalentContact SG-SG 2.03Å; C12-C30 PolarHBondContact SG-SG 3.31Å; A26-C30 WeakPolarHBondContact O-CB 3.01Å; A26-C30 PolarHBondContact O-N 3.46Å; G27-C30 PolarHBondContact O-N 2.85Å; C30-F33 PolarHBondContact O-N 3.46Å; C30-C34 VanDerWaalsContact O-CB 3.23Å; C30-C34 WeakPolarHBondContact O-CB 3.16Å; C30-C34 PolarHBondContact O-N 2.69Å |
| 31 | C | 57.7 | Low | 50 | Low | 2 Ų | 2 | 91.7 Ų | 91.7 | 1% | 0.014 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -67.9 | -45.3 | 171.3 | -60.1 | 0 | 0 | 0 | 0 | 112.4 | G27 K28 F33 M35 C47 | G27-C31 VanDerWaalsContact O-CB 3.24Å; G27-C31 WeakPolarHBondContact O-CB 3.24Å; G27-C31 PolarHBondContact O-N 3.31Å; G27-C31 PolarHBondContact O-SG 2.91Å; K28-C31 PolarHBondContact O-N 3.22Å; C31-F33 PolarHBondContact O-N 2.03Å; C31-M35 VanDerWaalsContact O-CA 3.27Å; C31-M35 WeakPolarHBondContact O-CA 3.05Å; C31-M35 WeakPolarHBondContact O-CB 3.24Å; C31-M35 PolarHBondContact O-N 3.45Å; C31-C47 WeakPolarHBondContact CA-SG 3.09Å; C31-C47 HydrophobicContact CB-CB 3.81Å; C31-C47 WeakPolarHBondContact CB-SG 3.48Å; C31-C47 WeakPolarHBondContact SG-CB 3.41Å; C31-C47 CovalentContact SG-SG 2.01Å; C31-C47 PolarHBondContact SG-SG 3.27Å |
| 32 | E | 55.5 | Low | 49.9 | Very low | 95 Ų | 95 | 90.3 Ų | 90.3 | 44% | 0.444 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.7 | -30.6 | 176.6 | -75.2 | -178.7 | 113.9 | 0 | 0 | 112 | K28 T29 G36 | K28-E32 WeakPolarHBondContact CE-OE2 3.32Å; K28-E32 WeakPolarHBondContact CG-OE2 3.48Å; K28-E32 WeakPolarHBondContact O-CB 3.21Å; K28-E32 VanDerWaalsContact O-CG 3.29Å; K28-E32 WeakPolarHBondContact O-CG 3.29Å; K28-E32 PolarHBondContact O-N 3.26Å; T29-E32 PolarHBondContact O-N 2.76Å; E32-G36 WeakPolarHBondContact O-CA 3.27Å; E32-G36 PolarHBondContact O-N 2.69Å |
| 33 | F | 56.4 | Low | 50.1 | Low | 125 Ų | 125 | 89.4 Ų | 89.4 | 55% | 0.548 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -86.2 | -48.3 | 179 | -147.9 | -78.2 | 0 | 0 | 0 | 113.3 | P9 T29 C30 C31 G36 | P9-F33 HydrophobicContact CB-CB 4.38Å; P9-F33 HydrophobicContact CB-CD1 3.1Å; P9-F33 HydrophobicContact CB-CD2 3.83Å; P9-F33 HydrophobicContact CB-CE1 3.07Å; P9-F33 HydrophobicContact CB-CE2 3.81Å; P9-F33 HydrophobicContact CB-CG 3.49Å; P9-F33 VanDerWaalsContact CB-CG 3.49Å; P9-F33 HydrophobicContact CB-CZ 3.45Å; P9-F33 VanDerWaalsContact CB-CZ 3.45Å; P9-F33 HydrophobicContact CG-CD1 4.02Å; P9-F33 HydrophobicContact CG-CD2 4.35Å; P9-F33 HydrophobicContact CG-CE1 3.46Å; P9-F33 VanDerWaalsContact CG-CE1 3.46Å; P9-F33 HydrophobicContact CG-CE2 3.85Å; P9-F33 HydrophobicContact CG-CG 4.43Å; P9-F33 HydrophobicContact CG-CZ 3.37Å; T29-F33 VanDerWaalsContact O-CB 3.27Å; T29-F33 WeakPolarHBondContact O-CB 3.37Å; T29-F33 PolarHBondContact O-N 3.15Å; C30-F33 PolarHBondContact O-N 3.46Å; C31-F33 PolarHBondContact O-N 2.03Å; F33-G36 PolarHBondContact O-N 2.91Å |
| 34 | C | 51.5 | Low | 50.1 | Low | 62 Ų | 62 | 90.7 Ų | 90.7 | 42% | 0.419 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -68.1 | -40.2 | 175.4 | -84.1 | 0 | 0 | 0 | 0 | 112.3 | C12 C30 | C12-C34 PolarHBondContact SG-SG 3.21Å; C30-C34 VanDerWaalsContact O-CB 3.23Å; C30-C34 WeakPolarHBondContact O-CB 3.16Å; C30-C34 PolarHBondContact O-N 2.69Å |
| 35 | M | 50.2 | Low | 50.1 | Low | 19 Ų | 19 | 85.2 Ų | 85.2 | 9% | 0.094 | 43% | 0.432 | C | S | . | . | S | Bend | trans | -89.7 | -1.7 | 174 | -60.1 | -159.9 | 167.6 | 0 | 0 | 113.2 | C31 F37 L38 Y39 L42 H46 C47 | C31-M35 VanDerWaalsContact O-CA 3.27Å; C31-M35 WeakPolarHBondContact O-CA 3.05Å; C31-M35 WeakPolarHBondContact O-CB 3.24Å; C31-M35 PolarHBondContact O-N 3.45Å; M35-F37 PolarHBondContact O-N 3.23Å; M35-F37 VanDerWaalsContact O-N 3.11Å; M35-L38 HydrophobicContact CB-CB 4.46Å; M35-L38 CarbonylContact O-C 3.24Å; M35-L38 VanDerWaalsContact O-C 3.24Å; M35-L38 WeakPolarHBondContact O-CA 3.22Å; M35-L38 PolarHBondContact O-N 3.49Å; M35-Y39 HydrophobicContact CB-CD2 3.96Å; M35-Y39 HydrophobicContact CB-CE2 4.39Å; M35-Y39 WeakPolarHBondContact O-CA 3.11Å; M35-Y39 WeakPolarHBondContact O-CB 3.48Å; M35-Y39 WeakPolarHBondContact O-CD2 3.3Å; M35-Y39 PolarHBondContact O-N 3.05Å; M35-L42 HydrophobicContact CE-CB 3.9Å; M35-L42 HydrophobicContact CE-CD1 4.46Å; M35-L42 HydrophobicContact SD-CB 4.08Å; M35-H46 HydrophobicContact CE-CB 4.26Å; M35-C47 HydrophobicContact CE-CB 3.9Å; M35-C47 HydrophobicContact SD-CB 4.33Å |
| 36 | G | 45.6 | Very low | 50.2 | Low | 52 Ų | 52 | 80.9 Ų | 80.9 | 54% | 0.536 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -25.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113 | E32 F33 | E32-G36 WeakPolarHBondContact O-CA 3.27Å; E32-G36 PolarHBondContact O-N 2.69Å; F33-G36 PolarHBondContact O-N 2.91Å |
| 37 | F | 43.2 | Very low | 50.2 | Low | 206 Ų | 206 | 80.8 Ų | 80.8 | 90% | 0.904 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | -9.2 | 170.7 | -98.8 | -93.6 | 0 | 0 | 0 | 114.7 | M35 | M35-F37 PolarHBondContact O-N 3.23Å; M35-F37 VanDerWaalsContact O-N 3.11Å |
| 38 | L | 40.3 | Very low | 50.2 | Low | 80 Ų | 80 | 85.6 Ų | 85.6 | 42% | 0.419 | 44% | 0.437 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -136.1 | 15.3 | -166.7 | -137.9 | 66.1 | 0 | 0 | 0 | 112.8 | M35 D40 Q41 L42 | M35-L38 HydrophobicContact CB-CB 4.46Å; M35-L38 CarbonylContact O-C 3.24Å; M35-L38 VanDerWaalsContact O-C 3.24Å; M35-L38 WeakPolarHBondContact O-CA 3.22Å; M35-L38 PolarHBondContact O-N 3.49Å; L38-D40 PolarHBondContact O-N 3.39Å; L38-Q41 PolarHBondContact O-N 3.35Å; L38-L42 HydrophobicContact CD2-CD1 3.21Å; L38-L42 HydrophobicContact CG-CD1 3.81Å; L38-L42 PolarHBondContact O-N 2.95Å |
| 39 | Y | 42.6 | Very low | 50 | Low | 122 Ų | 122 | 84.9 Ų | 84.9 | 48% | 0.478 | 44% | 0.439 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72 | -12.7 | -177.8 | -127 | -90.8 | 0 | 0 | 0 | 112 | M35 N44 | M35-Y39 HydrophobicContact CB-CD2 3.96Å; M35-Y39 HydrophobicContact CB-CE2 4.39Å; M35-Y39 WeakPolarHBondContact O-CA 3.11Å; M35-Y39 WeakPolarHBondContact O-CB 3.48Å; M35-Y39 WeakPolarHBondContact O-CD2 3.3Å; M35-Y39 PolarHBondContact O-N 3.05Å; Y39-N44 PolarHBondContact OH-ND2 2.93Å; Y39-N44 VanDerWaalsContact OH-ND2 3.1Å |
| 40 | D | 47.8 | Very low | 49.6 | Very low | 153 Ų | 153 | 88.5 Ų | 88.5 | 82% | 0.818 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.7 | -18.5 | 174.3 | -165.5 | -112.2 | 0 | 0 | 0 | 112.8 | L38 | L38-D40 PolarHBondContact O-N 3.39Š|
| 41 | Q | 43.6 | Very low | 49.4 | Very low | 157 Ų | 157 | 89.8 Ų | 89.8 | 73% | 0.734 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -130.5 | -10.4 | -168.3 | -89.2 | 176 | 78.7 | 0 | 0 | 117.3 | L38 | L38-Q41 PolarHBondContact O-N 3.35Š|
| 42 | L | 44.8 | Very low | 49 | Very low | 65 Ų | 65 | 93 Ų | 93 | 34% | 0.34 | 48% | 0.48 | S | S | . | . | trans | -129.6 | 129.9 | -176.8 | -83.8 | 148.6 | 0 | 0 | 0 | 113.9 | M35 L38 H46 | M35-L42 HydrophobicContact CE-CB 3.9Å; M35-L42 HydrophobicContact CE-CD1 4.46Å; M35-L42 HydrophobicContact SD-CB 4.08Å; L38-L42 HydrophobicContact CD2-CD1 3.21Å; L38-L42 HydrophobicContact CG-CD1 3.81Å; L38-L42 PolarHBondContact O-N 2.95Å; L42-H46 HydrophobicContact CD2-CB 4.47Å | ||
| 43 | P | 49.4 | Very low | 48.2 | Very low | 80 Ų | 80 | 92 Ų | 92 | 52% | 0.519 | 48% | 0.483 | S | S | . | . | trans | -67.6 | 138.9 | 172.7 | 26.7 | -30.5 | 0 | 0 | 0 | 109.9 | T45 H46 | P43-T45 PolarHBondContact O-N 3.16Å; P43-H46 PolarHBondContact O-N 2.92Å | ||
| 44 | N | 50 | Low | 47.6 | Very low | 72 Ų | 72 | 91 Ų | 91 | 39% | 0.385 | 49% | 0.489 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -44.5 | -22 | -180 | -98.5 | -106.9 | 0 | 0 | 0 | 114.7 | Y39 H46 Y48 | Y39-N44 PolarHBondContact OH-ND2 2.93Å; Y39-N44 VanDerWaalsContact OH-ND2 3.1Å; N44-H46 PolarHBondContact O-N 3.38Å; N44-Y48 WeakPolarHBondContact O-CD2 2.89Å |
| 45 | T | 49.9 | Very low | 47 | Very low | 108 Ų | 108 | 93.9 Ų | 93.9 | 66% | 0.663 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -60.8 | -34.8 | -179.7 | -44.4 | 0 | 0 | 0 | 0 | 114.2 | P43 C47 | P43-T45 PolarHBondContact O-N 3.16Å; T45-C47 PolarHBondContact O-N 3.21Å |
| 46 | H | 51 | Low | 46.8 | Very low | 109 Ų | 109 | 97.7 Ų | 97.7 | 51% | 0.505 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -73.9 | -24.6 | -176.2 | -86.4 | -90.3 | 0 | 0 | 0 | 114 | M35 L42 P43 N44 D49 W50 | M35-H46 HydrophobicContact CE-CB 4.26Å; L42-H46 HydrophobicContact CD2-CB 4.47Å; P43-H46 PolarHBondContact O-N 2.92Å; N44-H46 PolarHBondContact O-N 3.38Å; H46-D49 PolarHBondContact O-N 2.79Å; H46-W50 PolarHBondContact O-N 3.3Å; H46-W50 VanDerWaalsContact O-N 3.16Å |
| 47 | C | 53.3 | Low | 46.9 | Very low | 7 Ų | 7 | 100.1 Ų | 100.1 | 5% | 0.047 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -73.9 | -37 | -178 | -175.7 | 0 | 0 | 0 | 0 | 112.2 | C31 M35 T45 D49 L51 | C31-C47 WeakPolarHBondContact CA-SG 3.09Å; C31-C47 HydrophobicContact CB-CB 3.81Å; C31-C47 WeakPolarHBondContact CB-SG 3.48Å; C31-C47 WeakPolarHBondContact SG-CB 3.41Å; C31-C47 CovalentContact SG-SG 2.01Å; C31-C47 PolarHBondContact SG-SG 3.27Å; M35-C47 HydrophobicContact CE-CB 3.9Å; M35-C47 HydrophobicContact SD-CB 4.33Å; T45-C47 PolarHBondContact O-N 3.21Å; C47-D49 VanDerWaalsContact C-N 3.34Å; C47-L51 WeakPolarHBondContact O-CG 3.17Å; C47-L51 PolarHBondContact O-N 3.4Å |
| 48 | Y | 52.6 | Low | 47.1 | Very low | 101 Ų | 101 | 94.2 Ų | 94.2 | 40% | 0.396 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -69.7 | -32.3 | 173.9 | -69.4 | -79 | 0 | 0 | 0 | 112.3 | N44 L51 A52 | N44-Y48 WeakPolarHBondContact O-CD2 2.89Å; Y48-L51 PolarHBondContact O-N 2.77Å; Y48-A52 WeakPolarHBondContact O-CB 3.39Å; Y48-A52 PolarHBondContact O-N 3.25Å |
| 49 | D | 51.2 | Low | 47.5 | Very low | 104 Ų | 104 | 95 Ų | 95 | 56% | 0.556 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -68.7 | -38.2 | 177.6 | -163.6 | -105.1 | 0 | 0 | 0 | 112.3 | H46 C47 A52 S53 | H46-D49 PolarHBondContact O-N 2.79Å; C47-D49 VanDerWaalsContact C-N 3.34Å; D49-A52 PolarHBondContact O-N 3.28Å; D49-S53 PolarHBondContact O-N 2.77Å; D49-S53 VanDerWaalsContact O-N 3.15Å; D49-S53 PolarHBondContact O-OG 3.11Å; D49-S53 VanDerWaalsContact O-OG 3.13Å |
| 50 | W | 48.3 | Very low | 47.8 | Very low | 132 Ų | 132 | 93.3 Ų | 93.3 | 50% | 0.5 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.1 | -42.5 | 173.5 | -172.3 | 53.5 | 0 | 0 | 0 | 112.5 | H46 A52 S53 | H46-W50 PolarHBondContact O-N 3.3Å; H46-W50 VanDerWaalsContact O-N 3.16Å; W50-A52 VanDerWaalsContact C-N 3.29Å; W50-A52 PolarHBondContact O-N 2.82Å; W50-S53 PolarHBondContact O-N 3.37Å |
| 51 | L | 52.4 | Low | 47.8 | Very low | 34 Ų | 34 | 89.3 Ų | 89.3 | 18% | 0.178 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -69.1 | -27.3 | 174.6 | -68.5 | 172.4 | 0 | 0 | 0 | 112.9 | C47 Y48 | C47-L51 WeakPolarHBondContact O-CG 3.17Å; C47-L51 PolarHBondContact O-N 3.4Å; Y48-L51 PolarHBondContact O-N 2.77Å |
| 52 | A | 49.4 | Very low | 48.1 | Very low | 71 Ų | 71 | 84.5 Ų | 84.5 | 59% | 0.587 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -85.4 | -9.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y48 D49 W50 P54 | Y48-A52 WeakPolarHBondContact O-CB 3.39Å; Y48-A52 PolarHBondContact O-N 3.25Å; D49-A52 PolarHBondContact O-N 3.28Å; W50-A52 VanDerWaalsContact C-N 3.29Å; W50-A52 PolarHBondContact O-N 2.82Å; A52-P54 WeakPolarHBondContact O-CD 3.08Å |
| 53 | S | 39.1 | Very low | 48.3 | Very low | 73 Ų | 73 | 86 Ų | 86 | 51% | 0.51 | 52% | 0.522 | S | S | . | . | trans | -91.6 | 106.6 | 177.5 | -70.6 | 0 | 0 | 0 | 0 | 110.8 | D49 W50 G55 | D49-S53 PolarHBondContact O-N 2.77Å; D49-S53 VanDerWaalsContact O-N 3.15Å; D49-S53 PolarHBondContact O-OG 3.11Å; D49-S53 VanDerWaalsContact O-OG 3.13Å; W50-S53 PolarHBondContact O-N 3.37Å; S53-G55 PolarHBondContact O-N 2.82Å | ||
| 54 | P | 43.3 | Very low | 48.2 | Very low | 104 Ų | 104 | 86.5 Ų | 86.5 | 68% | 0.675 | 52% | 0.523 | S | S | * | . | trans | -76.2 | 96.5 | 173.1 | 31.9 | -32.2 | 0 | 0 | 0 | 108.8 | A52 | A52-P54 WeakPolarHBondContact O-CD 3.08Š| ||
| 55 | G | 38.1 | Very low | 48.1 | Very low | 123 Ų | 123 | 87.8 Ų | 87.8 | 100% | 1.268 | 54% | 0.535 | S | S | * | . | trans | -60.7 | 0 | 150.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | K17 S53 | K17-G55 WeakPolarHBondContact CE-O 3.33Å; K17-G55 PolarHBondContact NZ-O 2.92Å; S53-G55 PolarHBondContact O-N 2.82Å |
Retrieved 55 of 55 residues in 61.2 ms
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