| 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 | 48.2 | Very low | 71.9 | Confident | 201 Ų | 201 | 86.1 Ų | 86.1 | 99% | 0.99 | 50% | 0.499 | S | S | * | . | 0 | -24.6 | 0 | -119.6 | 170.5 | -153.5 | 0 | 0 | 114.4 | |||||
| 2 | A | 56.7 | Low | 73 | Confident | 84 Ų | 84 | 90.7 Ų | 90.7 | 69% | 0.694 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.5 | -40 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | I4 K5 A6 | A2-I4 VanDerWaalsContact C-N 3.35Å; A2-I4 PolarHBondContact O-N 3.03Å; A2-K5 PolarHBondContact O-N 3.33Å; A2-A6 PolarHBondContact O-N 3.13Å |
| 3 | G | 63.9 | Low | 73.9 | Confident | 33 Ų | 33 | 84.7 Ų | 84.7 | 34% | 0.34 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.4 | -35.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | A6 L7 | G3-A6 PolarHBondContact O-N 2.85Å; G3-L7 WeakPolarHBondContact O-CB 3.41Å; G3-L7 VanDerWaalsContact O-CG 3.27Å; G3-L7 WeakPolarHBondContact O-CG 3.2Å; G3-L7 PolarHBondContact O-N 2.91Å |
| 4 | I | 73.5 | Confident | 74.4 | Confident | 107 Ų | 107 | 79.9 Ų | 79.9 | 55% | 0.549 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -66.3 | -42.1 | 179.2 | -65.3 | 163 | 0 | 0 | 0 | 110.8 | A2 A6 L7 I8 | A2-I4 VanDerWaalsContact C-N 3.35Å; A2-I4 PolarHBondContact O-N 3.03Å; I4-A6 VanDerWaalsContact C-N 3.34Å; I4-A6 PolarHBondContact O-N 2.91Å; I4-L7 PolarHBondContact O-N 3.45Å; I4-I8 HydrophobicContact CG2-CD1 3.83Å; I4-I8 WeakPolarHBondContact O-CD1 3.06Å; I4-I8 VanDerWaalsContact O-CG1 3.23Å; I4-I8 WeakPolarHBondContact O-CG1 3.44Å; I4-I8 PolarHBondContact O-N 3.37Å |
| 5 | K | 69.9 | Low | 75.1 | Confident | 158 Ų | 158 | 78.5 Ų | 78.5 | 69% | 0.687 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -65.2 | -40.1 | 178.2 | -64 | -168.1 | 178.4 | -149.3 | 0 | 111.4 | A2 I8 S9 | A2-K5 PolarHBondContact O-N 3.33Å; K5-I8 PolarHBondContact O-N 3.3Å; K5-S9 PolarHBondContact O-N 3.32Å; K5-S9 VanDerWaalsContact O-N 3.1Å |
| 6 | A | 74.3 | Confident | 75.7 | Confident | 17 Ų | 17 | 78.4 Ų | 78.4 | 14% | 0.14 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -62.9 | -48.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | A2 G3 I4 I8 S9 L10 V119 | A2-A6 PolarHBondContact O-N 3.13Å; G3-A6 PolarHBondContact O-N 2.85Å; I4-A6 VanDerWaalsContact C-N 3.34Å; I4-A6 PolarHBondContact O-N 2.91Å; A6-I8 VanDerWaalsContact C-N 3.3Å; A6-I8 PolarHBondContact O-N 3.49Å; A6-S9 PolarHBondContact O-N 3.5Å; A6-S9 VanDerWaalsContact O-N 3.09Å; A6-S9 PolarHBondContact O-OG 3Å; A6-L10 WeakPolarHBondContact O-CB 3.38Å; A6-L10 WeakPolarHBondContact O-CD1 3.42Å; A6-L10 PolarHBondContact O-N 2.74Å; A6-V119 HydrophobicContact CB-CG1 3.86Å; A6-V119 HydrophobicContact CB-CG2 4.14Å |
| 7 | L | 77.3 | Confident | 76.1 | Confident | 74 Ų | 74 | 73.8 Ų | 73.8 | 39% | 0.387 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -57.5 | -40 | 177.7 | -76.5 | 170.3 | 0 | 0 | 0 | 113.3 | G3 I4 L10 S11 F116 F120 | G3-L7 WeakPolarHBondContact O-CB 3.41Å; G3-L7 VanDerWaalsContact O-CG 3.27Å; G3-L7 WeakPolarHBondContact O-CG 3.2Å; G3-L7 PolarHBondContact O-N 2.91Å; I4-L7 PolarHBondContact O-N 3.45Å; L7-L10 PolarHBondContact O-N 2.93Å; L7-S11 WeakPolarHBondContact O-CB 3.48Å; L7-S11 PolarHBondContact O-N 3.19Å; L7-S11 PolarHBondContact O-OG 3.01Å; L7-F116 HydrophobicContact CD2-CE2 4.38Å; L7-F120 HydrophobicContact CD1-CZ 4.13Å; L7-F120 HydrophobicContact CD2-CE2 3.67Å; L7-F120 HydrophobicContact CD2-CZ 3.59Å; L7-F120 HydrophobicContact CG-CE2 4.16Å; L7-F120 HydrophobicContact CG-CZ 3.82Å |
| 8 | I | 83.4 | Confident | 76.1 | Confident | 89 Ų | 89 | 74.3 Ų | 74.3 | 46% | 0.456 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.7 | -49 | 175.3 | -66.9 | 162.7 | 0 | 0 | 0 | 109.7 | I4 K5 A6 L10 S11 F12 | I4-I8 HydrophobicContact CG2-CD1 3.83Å; I4-I8 WeakPolarHBondContact O-CD1 3.06Å; I4-I8 VanDerWaalsContact O-CG1 3.23Å; I4-I8 WeakPolarHBondContact O-CG1 3.44Å; I4-I8 PolarHBondContact O-N 3.37Å; K5-I8 PolarHBondContact O-N 3.3Å; A6-I8 VanDerWaalsContact C-N 3.3Å; A6-I8 PolarHBondContact O-N 3.49Å; I8-L10 VanDerWaalsContact C-N 3.29Å; I8-L10 PolarHBondContact O-N 3.43Å; I8-S11 PolarHBondContact O-N 2.96Å; I8-F12 HydrophobicContact CG2-CD2 3.88Å; I8-F12 HydrophobicContact CG2-CE2 3.95Å; I8-F12 WeakPolarHBondContact O-CD2 3.39Å; I8-F12 PolarHBondContact O-N 3.44Å |
| 9 | S | 79.6 | Confident | 76.4 | Confident | 73 Ų | 73 | 76.5 Ų | 76.5 | 51% | 0.51 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.5 | -37.2 | 179.6 | 72.6 | 0 | 0 | 0 | 0 | 113 | K5 A6 F12 G13 | K5-S9 PolarHBondContact O-N 3.32Å; K5-S9 VanDerWaalsContact O-N 3.1Å; A6-S9 PolarHBondContact O-N 3.5Å; A6-S9 VanDerWaalsContact O-N 3.09Å; A6-S9 PolarHBondContact O-OG 3Å; S9-F12 PolarHBondContact O-N 3.41Å; S9-G13 PolarHBondContact O-N 3.1Å |
| 10 | L | 79.6 | Confident | 76.5 | Confident | 27 Ų | 27 | 76.2 Ų | 76.2 | 14% | 0.141 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64.2 | -46.8 | 175.8 | -98.4 | 136.7 | 0 | 0 | 0 | 112 | A6 L7 I8 F12 G13 G14 T112 F116 | A6-L10 WeakPolarHBondContact O-CB 3.38Å; A6-L10 WeakPolarHBondContact O-CD1 3.42Å; A6-L10 PolarHBondContact O-N 2.74Å; L7-L10 PolarHBondContact O-N 2.93Å; I8-L10 VanDerWaalsContact C-N 3.29Å; I8-L10 PolarHBondContact O-N 3.43Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 3.32Å; L10-G13 PolarHBondContact O-N 3.45Å; L10-G14 PolarHBondContact O-N 3.25Å; L10-T112 WeakPolarHBondContact CD2-O 3.41Å; L10-F116 HydrophobicContact CD2-CB 3.62Å; L10-F116 HydrophobicContact CD2-CD2 4.35Å; L10-F116 HydrophobicContact CD2-CG 4.49Å |
| 11 | S | 84 | Confident | 76.4 | Confident | 84 Ų | 84 | 73 Ų | 73 | 59% | 0.587 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -61.1 | -41.6 | 176.6 | -59.9 | 0 | 0 | 0 | 0 | 111.8 | L7 I8 G14 A15 | L7-S11 WeakPolarHBondContact O-CB 3.48Å; L7-S11 PolarHBondContact O-N 3.19Å; L7-S11 PolarHBondContact O-OG 3.01Å; I8-S11 PolarHBondContact O-N 2.96Å; S11-G14 PolarHBondContact O-N 3.01Å; S11-A15 WeakPolarHBondContact O-CB 3.22Å; S11-A15 PolarHBondContact O-N 3.49Å |
| 12 | F | 85.8 | Confident | 77.6 | Confident | 141 Ų | 141 | 68.2 Ų | 68.2 | 62% | 0.618 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -63.1 | -43.6 | 175 | -92.8 | -82.1 | 0 | 0 | 0 | 112.1 | I8 S9 L10 G14 A15 I16 | I8-F12 HydrophobicContact CG2-CD2 3.88Å; I8-F12 HydrophobicContact CG2-CE2 3.95Å; I8-F12 WeakPolarHBondContact O-CD2 3.39Å; I8-F12 PolarHBondContact O-N 3.44Å; S9-F12 PolarHBondContact O-N 3.41Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 3.32Å; F12-G14 PolarHBondContact O-N 2.9Å; F12-A15 PolarHBondContact O-N 3.05Å; F12-I16 WeakPolarHBondContact O-CD1 3.48Å; F12-I16 VanDerWaalsContact O-CG1 3.25Å; F12-I16 WeakPolarHBondContact O-CG1 3.46Å; F12-I16 PolarHBondContact O-N 3.43Å |
| 13 | G | 84.2 | Confident | 78.3 | Confident | 13 Ų | 13 | 67.5 Ų | 67.5 | 13% | 0.134 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -61.1 | -43.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S9 L10 A15 I16 G17 V108 | S9-G13 PolarHBondContact O-N 3.1Å; L10-G13 PolarHBondContact O-N 3.45Å; G13-A15 PolarHBondContact O-N 2.58Å; G13-I16 PolarHBondContact O-N 3.3Å; G13-G17 PolarHBondContact O-N 3.49Å; G13-V108 WeakPolarHBondContact O-CG1 3.15Å |
| 14 | G | 81.3 | Confident | 78.5 | Confident | 18 Ų | 18 | 66 Ų | 66 | 19% | 0.186 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L10 S11 F12 I16 G17 L18 | L10-G14 PolarHBondContact O-N 3.25Å; S11-G14 PolarHBondContact O-N 3.01Å; F12-G14 PolarHBondContact O-N 2.9Å; G14-I16 PolarHBondContact O-N 2.97Å; G14-G17 PolarHBondContact O-N 3.3Å; G14-L18 WeakPolarHBondContact O-CG 3.25Å; G14-L18 PolarHBondContact O-N 3.43Å |
| 15 | A | 84.4 | Confident | 78.1 | Confident | 58 Ų | 58 | 61.5 Ų | 61.5 | 48% | 0.479 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.6 | -41.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S11 F12 G13 L18 M19 | S11-A15 WeakPolarHBondContact O-CB 3.22Å; S11-A15 PolarHBondContact O-N 3.49Å; F12-A15 PolarHBondContact O-N 3.05Å; G13-A15 PolarHBondContact O-N 2.58Å; A15-L18 PolarHBondContact O-N 3.35Å; A15-M19 WeakPolarHBondContact O-CB 3.16Å; A15-M19 PolarHBondContact O-N 3Å |
| 16 | I | 85.4 | Confident | 77.7 | Confident | 77 Ų | 77 | 57.5 Ų | 57.5 | 40% | 0.395 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63.4 | -43.4 | 175.8 | -70.3 | 164.8 | 0 | 0 | 0 | 110.8 | F12 G13 G14 M19 F20 V108 | F12-I16 WeakPolarHBondContact O-CD1 3.48Å; F12-I16 VanDerWaalsContact O-CG1 3.25Å; F12-I16 WeakPolarHBondContact O-CG1 3.46Å; F12-I16 PolarHBondContact O-N 3.43Å; G13-I16 PolarHBondContact O-N 3.3Å; G14-I16 PolarHBondContact O-N 2.97Å; I16-M19 WeakPolarHBondContact O-CB 3.48Å; I16-M19 PolarHBondContact O-N 2.99Å; I16-F20 HydrophobicContact CG2-CD2 3.7Å; I16-F20 HydrophobicContact CG2-CE2 3.27Å; I16-F20 HydrophobicContact CG2-CZ 4.18Å; I16-F20 WeakPolarHBondContact O-CD2 3.47Å; I16-F20 PolarHBondContact O-N 3.29Å; I16-V108 HydrophobicContact CG2-CG1 4.5Å |
| 17 | G | 81.6 | Confident | 76.9 | Confident | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -61 | -44.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | G13 G14 M19 F20 L21 | G13-G17 PolarHBondContact O-N 3.49Å; G14-G17 PolarHBondContact O-N 3.3Å; G17-M19 VanDerWaalsContact C-N 3.35Å; G17-F20 PolarHBondContact O-N 3.12Å; G17-L21 PolarHBondContact O-N 3.36Å; G17-L21 VanDerWaalsContact O-N 3.11Å |
| 18 | L | 76.9 | Confident | 75.7 | Confident | 83 Ų | 83 | 62.6 Ų | 62.6 | 44% | 0.435 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -66.8 | -35.8 | 175.7 | -70.2 | 174.8 | 0 | 0 | 0 | 112.4 | G14 A15 L21 M22 I109 | G14-L18 WeakPolarHBondContact O-CG 3.25Å; G14-L18 PolarHBondContact O-N 3.43Å; A15-L18 PolarHBondContact O-N 3.35Å; L18-L21 WeakPolarHBondContact O-CB 3.34Å; L18-L21 PolarHBondContact O-N 3.11Å; L18-M22 PolarHBondContact O-N 2.87Å; L18-I109 HydrophobicContact CD2-CD1 4.35Å |
| 19 | M | 82.3 | Confident | 74.3 | Confident | 116 Ų | 116 | 63.9 Ų | 63.9 | 57% | 0.571 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -61.4 | -48.3 | 173.8 | -179 | -174.7 | 174.5 | 0 | 0 | 110.6 | A15 I16 G17 L21 M22 L23 | A15-M19 WeakPolarHBondContact O-CB 3.16Å; A15-M19 PolarHBondContact O-N 3Å; I16-M19 WeakPolarHBondContact O-CB 3.48Å; I16-M19 PolarHBondContact O-N 2.99Å; G17-M19 VanDerWaalsContact C-N 3.35Å; M19-L21 VanDerWaalsContact C-N 3.29Å; M19-L21 PolarHBondContact O-N 3.38Å; M19-M22 PolarHBondContact O-N 3.47Å; M19-M22 VanDerWaalsContact O-N 3.12Å; M19-L23 HydrophobicContact CE-CD1 3.76Å; M19-L23 HydrophobicContact CG-CD1 3.48Å; M19-L23 VanDerWaalsContact CG-CD1 3.48Å; M19-L23 WeakPolarHBondContact O-CD1 3.37Å; M19-L23 PolarHBondContact O-N 2.89Å; M19-L23 HydrophobicContact SD-CD1 4.47Å |
| 20 | F | 77.4 | Confident | 73.2 | Confident | 70 Ų | 70 | 62.1 Ų | 62.1 | 31% | 0.307 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.1 | -37.3 | 177.1 | -73.1 | -53.3 | 0 | 0 | 0 | 113.1 | I16 G17 L23 G24 L101 | I16-F20 HydrophobicContact CG2-CD2 3.7Å; I16-F20 HydrophobicContact CG2-CE2 3.27Å; I16-F20 HydrophobicContact CG2-CZ 4.18Å; I16-F20 WeakPolarHBondContact O-CD2 3.47Å; I16-F20 PolarHBondContact O-N 3.29Å; G17-F20 PolarHBondContact O-N 3.12Å; F20-L23 PolarHBondContact O-N 2.96Å; F20-G24 PolarHBondContact O-N 3.36Å; F20-G24 VanDerWaalsContact O-N 3.1Å; F20-L101 HydrophobicContact CB-CD2 4.13Å; F20-L101 HydrophobicContact CD1-CD2 3.46Å; F20-L101 VanDerWaalsContact CD1-CD2 3.46Å; F20-L101 HydrophobicContact CE1-CD2 4.28Å; F20-L101 HydrophobicContact CG-CD2 4.21Å |
| 21 | L | 74 | Confident | 71.7 | Confident | 9 Ų | 9 | 66.2 Ų | 66.2 | 5% | 0.047 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62.1 | -45 | 173.3 | -169 | 74.7 | 0 | 0 | 0 | 111.4 | G17 L18 M19 G24 C25 L38 L39 V102 | G17-L21 PolarHBondContact O-N 3.36Å; G17-L21 VanDerWaalsContact O-N 3.11Å; L18-L21 WeakPolarHBondContact O-CB 3.34Å; L18-L21 PolarHBondContact O-N 3.11Å; M19-L21 VanDerWaalsContact C-N 3.29Å; M19-L21 PolarHBondContact O-N 3.38Å; L21-G24 PolarHBondContact O-N 3.36Å; L21-C25 PolarHBondContact O-N 3.25Å; L21-L38 HydrophobicContact CD1-CB 4.34Å; L21-L38 HydrophobicContact CD1-CD1 4.01Å; L21-L39 HydrophobicContact CD2-CD1 4.3Å; L21-V102 HydrophobicContact CD1-CG1 4.03Å; L21-V102 HydrophobicContact CD1-CG2 4.19Å |
| 22 | M | 74.3 | Confident | 70.5 | Confident | 102 Ų | 102 | 67.6 Ų | 67.6 | 50% | 0.502 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -65.2 | -41.1 | 177 | -86.7 | -67.8 | 168.8 | 0 | 0 | 112.6 | L18 M19 G24 C25 A26 | L18-M22 PolarHBondContact O-N 2.87Å; M19-M22 PolarHBondContact O-N 3.47Å; M19-M22 VanDerWaalsContact O-N 3.12Å; M22-G24 PolarHBondContact O-N 3.34Å; M22-C25 PolarHBondContact O-N 2.82Å; M22-C25 VanDerWaalsContact O-N 3.11Å; M22-A26 WeakPolarHBondContact O-CB 3.16Å; M22-A26 PolarHBondContact O-N 3.11Å |
| 23 | L | 70.3 | Confident | 69.2 | Low | 69 Ų | 69 | 68.4 Ų | 68.4 | 36% | 0.361 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.4 | -31.9 | 174.4 | -87.5 | 94.1 | 0 | 0 | 0 | 112.5 | M19 F20 C25 L101 | M19-L23 HydrophobicContact CE-CD1 3.76Å; M19-L23 HydrophobicContact CG-CD1 3.48Å; M19-L23 VanDerWaalsContact CG-CD1 3.48Å; M19-L23 WeakPolarHBondContact O-CD1 3.37Å; M19-L23 PolarHBondContact O-N 2.89Å; M19-L23 HydrophobicContact SD-CD1 4.47Å; F20-L23 PolarHBondContact O-N 2.96Å; L23-C25 VanDerWaalsContact C-N 3.3Å; L23-C25 PolarHBondContact O-N 3.23Å; L23-L101 HydrophobicContact CB-CD2 4.28Å |
| 24 | G | 68.4 | Low | 67.9 | Low | 1 Ų | 1 | 74.8 Ų | 74.8 | 1% | 0.01 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -66.7 | -26.8 | 174 | 0 | 0 | 0 | 0 | 0 | 114.3 | F20 L21 M22 A98 | F20-G24 PolarHBondContact O-N 3.36Å; F20-G24 VanDerWaalsContact O-N 3.1Å; L21-G24 PolarHBondContact O-N 3.36Å; M22-G24 PolarHBondContact O-N 3.34Å; G24-A98 WeakPolarHBondContact O-CB 3.25Å |
| 25 | C | 65.1 | Low | 66.8 | Low | 13 Ų | 13 | 74 Ų | 74 | 9% | 0.088 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -97.4 | -31.6 | 177.9 | -77.7 | 0 | 0 | 0 | 0 | 114.2 | L21 M22 L23 P35 | L21-C25 PolarHBondContact O-N 3.25Å; M22-C25 PolarHBondContact O-N 2.82Å; M22-C25 VanDerWaalsContact O-N 3.11Å; L23-C25 VanDerWaalsContact C-N 3.3Å; L23-C25 PolarHBondContact O-N 3.23Å; C25-P35 VanDerWaalsContact SG-CB 3.55Å; C25-P35 WeakPolarHBondContact SG-CG 3.24Å |
| 26 | A | 61.4 | Low | 65.8 | Low | 74 Ų | 74 | 74.8 Ų | 74.8 | 61% | 0.612 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -95.6 | -7.4 | -165.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | M22 | M22-A26 WeakPolarHBondContact O-CB 3.16Å; M22-A26 PolarHBondContact O-N 3.11Å |
| 27 | L | 59.1 | Low | 64.7 | Low | 83 Ų | 83 | 76.5 Ų | 76.5 | 44% | 0.435 | 39% | 0.387 | S | S | . | . | S | Bend | trans | -68.2 | 132.7 | 172.4 | -131.5 | 68.1 | 0 | 0 | 0 | 108.9 | V29 Y30 | L27-V29 PolarHBondContact O-N 3.34Å; L27-Y30 HydrophobicContact CB-CD2 3.72Å; L27-Y30 HydrophobicContact CB-CE2 4.42Å; L27-Y30 HydrophobicContact CD2-CD2 4.05Å; L27-Y30 HydrophobicContact CD2-CE2 3.91Å; L27-Y30 PolarHBondContact O-N 3.22Å |
| 28 | P | 50.6 | Low | 63.8 | Low | 114 Ų | 114 | 76.6 Ų | 76.6 | 74% | 0.74 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | -7.9 | -178 | 23.8 | -34.7 | 0 | 0 | 0 | 114.8 | ||
| 29 | V | 54.6 | Low | 63.2 | Low | 116 Ų | 116 | 75.4 Ų | 75.4 | 70% | 0.703 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.2 | -20.6 | 173.2 | -178.1 | 0 | 0 | 0 | 0 | 111.9 | L27 | L27-V29 PolarHBondContact O-N 3.34Š|
| 30 | Y | 55.8 | Low | 62.3 | Low | 37 Ų | 37 | 75.2 Ų | 75.2 | 15% | 0.145 | 38% | 0.377 | C | S | . | . | trans | -116.4 | 37.9 | -169.8 | -66.8 | -80.8 | 0 | 0 | 0 | 112.6 | L27 K32 I94 A95 G97 A98 | L27-Y30 HydrophobicContact CB-CD2 3.72Å; L27-Y30 HydrophobicContact CB-CE2 4.42Å; L27-Y30 HydrophobicContact CD2-CD2 4.05Å; L27-Y30 HydrophobicContact CD2-CE2 3.91Å; L27-Y30 PolarHBondContact O-N 3.22Å; Y30-K32 WeakPolarHBondContact O-CA 3.49Å; Y30-K32 PolarHBondContact O-N 3.1Å; Y30-I94 HydrophobicContact CD1-CG2 4.39Å; Y30-A95 HydrophobicContact CD1-CB 4.17Å; Y30-A95 HydrophobicContact CE1-CB 3.32Å; Y30-G97 WeakPolarHBondContact OH-CA 3.23Å; Y30-A98 HydrophobicContact CD1-CB 3.41Å; Y30-A98 VanDerWaalsContact CD1-CB 3.41Å; Y30-A98 HydrophobicContact CD2-CB 4.17Å; Y30-A98 HydrophobicContact CE1-CB 3.26Å; Y30-A98 HydrophobicContact CE2-CB 4.14Å; Y30-A98 HydrophobicContact CG-CB 3.88Å; Y30-A98 PolarHBondContact OH-N 3.46Å | ||
| 31 | D | 50.1 | Low | 61.5 | Low | 113 Ų | 113 | 73.5 Ų | 73.5 | 60% | 0.604 | 37% | 0.37 | S | S | * | . | trans | -58.3 | 61.4 | -176.1 | -150.5 | -67.8 | 0 | 0 | 0 | 114 | ||||
| 32 | K | 57.9 | Low | 60.8 | Low | 113 Ų | 113 | 74.8 Ų | 74.8 | 49% | 0.491 | 37% | 0.374 | S | S | . | . | trans | -152.2 | 92.8 | -163.2 | -65.3 | -68.5 | -179.7 | 177.2 | 0 | 106.2 | Y30 W34 P35 V93 | Y30-K32 WeakPolarHBondContact O-CA 3.49Å; Y30-K32 PolarHBondContact O-N 3.1Å; K32-W34 PolarHBondContact O-N 3.38Å; K32-W34 VanDerWaalsContact O-N 3.11Å; K32-P35 WeakPolarHBondContact O-CD 3.33Å; K32-V93 VanDerWaalsContact CG-O 3.26Å; K32-V93 WeakPolarHBondContact CG-O 3.06Å | ||
| 33 | Y | 57.5 | Low | 60.1 | Low | 158 Ų | 158 | 75.1 Ų | 75.1 | 62% | 0.62 | 38% | 0.377 | S | S | * | . | trans | -73.5 | 8.1 | 178.8 | -55.7 | -89.5 | 0 | 0 | 0 | 113.7 | L36 | Y33-L36 HydrophobicContact CD1-CD1 4.43Å; Y33-L36 WeakPolarHBondContact O-CB 3.41Å; Y33-L36 PolarHBondContact O-N 3.08Å | ||
| 34 | W | 57.3 | Low | 59.5 | Low | 146 Ų | 146 | 74.3 Ų | 74.3 | 55% | 0.553 | 37% | 0.373 | S | S | * | . | G | 310 helix | trans | -59.4 | -32.9 | 177.1 | -105.4 | 82.7 | 0 | 0 | 0 | 116 | K32 L36 F37 F88 V93 | K32-W34 PolarHBondContact O-N 3.38Å; K32-W34 VanDerWaalsContact O-N 3.11Å; W34-L36 PolarHBondContact O-N 2.97Å; W34-L36 VanDerWaalsContact O-N 3.17Å; W34-F37 PolarHBondContact O-N 3.37Å; W34-F88 AromaticContact CD2-CE1 3.99Å; W34-F88 HydrophobicContact CD2-CE1 3.99Å; W34-F88 HydrophobicContact CD2-CE2 4.47Å; W34-F88 AromaticContact CD2-CZ 3.99Å; W34-F88 HydrophobicContact CD2-CZ 3.99Å; W34-F88 AromaticContact CE3-CD1 3.97Å; W34-F88 HydrophobicContact CE3-CD1 3.97Å; W34-F88 HydrophobicContact CE3-CD2 4.36Å; W34-F88 AromaticContact CE3-CE1 3.09Å; W34-F88 HydrophobicContact CE3-CE1 3.09Å; W34-F88 AromaticContact CE3-CE2 3.52Å; W34-F88 HydrophobicContact CE3-CE2 3.52Å; W34-F88 AromaticContact CE3-CZ 2.84Å; W34-F88 HydrophobicContact CE3-CZ 2.84Å; W34-F88 AromaticContact CH2-CE1 3.74Å; W34-F88 HydrophobicContact CH2-CE1 3.74Å; W34-F88 HydrophobicContact CH2-CZ 4.14Å; W34-F88 HydrophobicContact CZ3-CD1 4.1Å; W34-F88 AromaticContact CZ3-CE1 2.96Å; W34-F88 HydrophobicContact CZ3-CE1 2.96Å; W34-F88 HydrophobicContact CZ3-CE2 4.07Å; W34-F88 AromaticContact CZ3-CZ 2.96Å; W34-F88 HydrophobicContact CZ3-CZ 2.96Å; W34-V93 HydrophobicContact CB-CG1 4.1Å; W34-V93 HydrophobicContact CG-CG1 4.09Å |
| 35 | P | 59.5 | Low | 59 | Low | 3 Ų | 3 | 75.6 Ų | 75.6 | 2% | 0.019 | 38% | 0.382 | C | S | . | . | G | 310 helix | trans | -65 | -17.4 | 177.2 | -7.4 | 17.3 | 0 | 0 | 0 | 113.3 | C25 K32 F37 L38 I94 V102 | C25-P35 VanDerWaalsContact SG-CB 3.55Å; C25-P35 WeakPolarHBondContact SG-CG 3.24Å; K32-P35 WeakPolarHBondContact O-CD 3.33Å; P35-F37 PolarHBondContact O-N 2.89Å; P35-F37 VanDerWaalsContact O-N 3.12Å; P35-L38 WeakPolarHBondContact O-CB 3.08Å; P35-L38 PolarHBondContact O-N 3.05Å; P35-I94 HydrophobicContact CB-CD1 4.27Å; P35-I94 HydrophobicContact CG-CD1 3.6Å; P35-I94 HydrophobicContact CG-CG1 4.27Å; P35-V102 HydrophobicContact CB-CG2 4.44Å |
| 36 | L | 61.8 | Low | 58.5 | Low | 73 Ų | 73 | 78 Ų | 78 | 38% | 0.382 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -62.1 | -16.9 | 175.7 | -108.3 | 153.2 | 0 | 0 | 0 | 113.1 | Y33 W34 L38 L39 | Y33-L36 HydrophobicContact CD1-CD1 4.43Å; Y33-L36 WeakPolarHBondContact O-CB 3.41Å; Y33-L36 PolarHBondContact O-N 3.08Å; W34-L36 PolarHBondContact O-N 2.97Å; W34-L36 VanDerWaalsContact O-N 3.17Å; L36-L38 PolarHBondContact O-N 3.31Å; L36-L39 HydrophobicContact CD2-CB 4.11Å; L36-L39 HydrophobicContact CD2-CD1 4.09Å; L36-L39 HydrophobicContact CD2-CD2 4.5Å; L36-L39 HydrophobicContact CD2-CG 4.47Å; L36-L39 WeakPolarHBondContact O-CB 3.26Å; L36-L39 PolarHBondContact O-N 3.26Å |
| 37 | F | 62.2 | Low | 58.2 | Low | 113 Ų | 113 | 77.7 Ų | 77.7 | 50% | 0.496 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61.9 | -25.3 | 172 | -158.2 | -96 | 0 | 0 | 0 | 112.4 | W34 P35 L39 F40 F41 L84 | W34-F37 PolarHBondContact O-N 3.37Å; P35-F37 PolarHBondContact O-N 2.89Å; P35-F37 VanDerWaalsContact O-N 3.12Å; F37-L39 PolarHBondContact O-N 3.43Å; F37-F40 VanDerWaalsContact O-CB 3.25Å; F37-F40 WeakPolarHBondContact O-CB 3.39Å; F37-F40 PolarHBondContact O-N 3.27Å; F37-F40 VanDerWaalsContact O-N 3.11Å; F37-F41 HydrophobicContact CD1-CD2 4.14Å; F37-F41 AromaticContact CD1-CE2 3.67Å; F37-F41 HydrophobicContact CD1-CE2 3.67Å; F37-F41 HydrophobicContact CE1-CD2 4.35Å; F37-F41 AromaticContact CE1-CE2 3.58Å; F37-F41 HydrophobicContact CE1-CE2 3.58Å; F37-F41 HydrophobicContact CE1-CZ 4.31Å; F37-L84 HydrophobicContact CD1-CD1 4.09Å; F37-L84 HydrophobicContact CE1-CD1 4.49Å |
| 38 | L | 63.3 | Low | 57.8 | Low | 3 Ų | 3 | 74.5 Ų | 74.5 | 2% | 0.016 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.9 | -27.2 | 172.5 | -72.3 | 164.7 | 0 | 0 | 0 | 112.6 | L21 P35 L36 F40 F41 Y42 A81 V102 | L21-L38 HydrophobicContact CD1-CB 4.34Å; L21-L38 HydrophobicContact CD1-CD1 4.01Å; P35-L38 WeakPolarHBondContact O-CB 3.08Å; P35-L38 PolarHBondContact O-N 3.05Å; L36-L38 PolarHBondContact O-N 3.31Å; L38-F40 PolarHBondContact O-N 2.89Å; L38-F41 WeakPolarHBondContact O-CB 3.49Å; L38-F41 PolarHBondContact O-N 2.99Å; L38-F41 VanDerWaalsContact O-N 3.11Å; L38-Y42 VanDerWaalsContact O-CD2 3.23Å; L38-Y42 WeakPolarHBondContact O-CD2 3.39Å; L38-Y42 PolarHBondContact O-N 3.49Å; L38-A81 HydrophobicContact CD2-CB 4.01Å; L38-A81 VanDerWaalsContact CD2-O 3.31Å; L38-A81 WeakPolarHBondContact CD2-O 3.38Å; L38-V102 HydrophobicContact CD1-CG1 3.24Å |
| 39 | L | 64.1 | Low | 58 | Low | 57 Ų | 57 | 74.2 Ų | 74.2 | 30% | 0.298 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -64.4 | -31 | 174.8 | -150.2 | 120.8 | 0 | 0 | 0 | 111 | L21 L36 F37 Y42 I43 | L21-L39 HydrophobicContact CD2-CD1 4.3Å; L36-L39 HydrophobicContact CD2-CB 4.11Å; L36-L39 HydrophobicContact CD2-CD1 4.09Å; L36-L39 HydrophobicContact CD2-CD2 4.5Å; L36-L39 HydrophobicContact CD2-CG 4.47Å; L36-L39 WeakPolarHBondContact O-CB 3.26Å; L36-L39 PolarHBondContact O-N 3.26Å; F37-L39 PolarHBondContact O-N 3.43Å; L39-Y42 PolarHBondContact O-N 3.41Å; L39-I43 HydrophobicContact CD2-CD1 3.99Å; L39-I43 VanDerWaalsContact O-CG1 3.31Å; L39-I43 WeakPolarHBondContact O-CG1 3.35Å; L39-I43 PolarHBondContact O-N 3.3Å |
| 40 | F | 64.1 | Low | 57.9 | Low | 113 Ų | 113 | 72.7 Ų | 72.7 | 50% | 0.496 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.7 | -43.2 | 171.5 | -167.9 | -94.4 | 0 | 0 | 0 | 111.4 | F37 L38 Y42 I43 L44 | F37-F40 VanDerWaalsContact O-CB 3.25Å; F37-F40 WeakPolarHBondContact O-CB 3.39Å; F37-F40 PolarHBondContact O-N 3.27Å; F37-F40 VanDerWaalsContact O-N 3.11Å; L38-F40 PolarHBondContact O-N 2.89Å; F40-Y42 VanDerWaalsContact C-N 3.29Å; F40-Y42 PolarHBondContact O-N 2.9Å; F40-I43 CarbonylContact O-C 3.55Å; F40-I43 PolarHBondContact O-N 2.9Å; F40-L44 HydrophobicContact CE1-CD1 3.91Å; F40-L44 HydrophobicContact CE1-CD2 4.33Å; F40-L44 HydrophobicContact CZ-CD1 4.22Å; F40-L44 WeakPolarHBondContact O-CB 3.37Å; F40-L44 PolarHBondContact O-N 2.89Å |
| 41 | F | 61 | Low | 57.8 | Low | 34 Ų | 34 | 73.2 Ų | 73.2 | 15% | 0.149 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63.6 | -33.8 | 173.7 | -77 | -81.3 | 0 | 0 | 0 | 112.6 | F37 L38 L44 S45 I77 L84 | F37-F41 HydrophobicContact CD1-CD2 4.14Å; F37-F41 AromaticContact CD1-CE2 3.67Å; F37-F41 HydrophobicContact CD1-CE2 3.67Å; F37-F41 HydrophobicContact CE1-CD2 4.35Å; F37-F41 AromaticContact CE1-CE2 3.58Å; F37-F41 HydrophobicContact CE1-CE2 3.58Å; F37-F41 HydrophobicContact CE1-CZ 4.31Å; L38-F41 WeakPolarHBondContact O-CB 3.49Å; L38-F41 PolarHBondContact O-N 2.99Å; L38-F41 VanDerWaalsContact O-N 3.11Å; F41-L44 CarbonylContact O-C 3.55Å; F41-L44 PolarHBondContact O-N 3.29Å; F41-S45 PolarHBondContact O-N 3.45Å; F41-I77 HydrophobicContact CB-CG2 4.46Å; F41-I77 HydrophobicContact CD1-CG1 4.44Å; F41-I77 HydrophobicContact CD1-CG2 4.16Å; F41-L84 HydrophobicContact CD2-CD1 4.03Å; F41-L84 HydrophobicContact CE2-CD1 3.23Å; F41-L84 HydrophobicContact CZ-CD1 3.83Å |
| 42 | Y | 59.6 | Low | 57.6 | Low | 36 Ų | 36 | 70.3 Ų | 70.3 | 14% | 0.141 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -69 | -36.9 | 172.1 | -78.7 | -58.5 | 0 | 0 | 0 | 113.2 | L38 L39 F40 L44 S45 P46 N106 I109 | L38-Y42 VanDerWaalsContact O-CD2 3.23Å; L38-Y42 WeakPolarHBondContact O-CD2 3.39Å; L38-Y42 PolarHBondContact O-N 3.49Å; L39-Y42 PolarHBondContact O-N 3.41Å; F40-Y42 VanDerWaalsContact C-N 3.29Å; F40-Y42 PolarHBondContact O-N 2.9Å; Y42-L44 VanDerWaalsContact C-N 3.27Å; Y42-S45 VanDerWaalsContact O-CB 3.23Å; Y42-S45 WeakPolarHBondContact O-CB 3.41Å; Y42-S45 PolarHBondContact O-N 3.02Å; Y42-P46 WeakPolarHBondContact O-CD 3.38Å; Y42-N106 WeakPolarHBondContact OH-CA 3.31Å; Y42-N106 PolarHBondContact OH-OD1 2.9Å; Y42-I109 HydrophobicContact CD1-CD1 4.45Å; Y42-I109 HydrophobicContact CD1-CG2 3.9Å; Y42-I109 HydrophobicContact CD2-CD1 4.49Å; Y42-I109 HydrophobicContact CE1-CB 3.7Å; Y42-I109 HydrophobicContact CE1-CD1 3.73Å; Y42-I109 HydrophobicContact CE1-CG1 4.27Å; Y42-I109 HydrophobicContact CE1-CG2 3.21Å; Y42-I109 HydrophobicContact CE2-CD1 3.74Å; Y42-I109 WeakPolarHBondContact OH-CB 3.21Å; Y42-I109 VanDerWaalsContact OH-CD1 3.3Å; Y42-I109 WeakPolarHBondContact OH-CD1 3.5Å |
| 43 | I | 59.6 | Low | 57.3 | Low | 108 Ų | 108 | 73.9 Ų | 73.9 | 55% | 0.554 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -71.7 | -24.2 | 172.3 | -68.6 | 167.8 | 0 | 0 | 0 | 111.7 | L39 F40 P46 | L39-I43 HydrophobicContact CD2-CD1 3.99Å; L39-I43 VanDerWaalsContact O-CG1 3.31Å; L39-I43 WeakPolarHBondContact O-CG1 3.35Å; L39-I43 PolarHBondContact O-N 3.3Å; F40-I43 CarbonylContact O-C 3.55Å; F40-I43 PolarHBondContact O-N 2.9Å; I43-P46 VanDerWaalsContact C-CD 3.47Å; I43-P46 WeakPolarHBondContact O-CD 3.39Å; I43-P46 WeakPolarHBondContact O-CG 2.94Å |
| 44 | L | 56.9 | Low | 56.9 | Low | 53 Ų | 53 | 76.3 Ų | 76.3 | 28% | 0.277 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -82.5 | -23.3 | 172.2 | -129.9 | 68.9 | 0 | 0 | 0 | 112.8 | F40 F41 Y42 P46 I47 I77 | F40-L44 HydrophobicContact CE1-CD1 3.91Å; F40-L44 HydrophobicContact CE1-CD2 4.33Å; F40-L44 HydrophobicContact CZ-CD1 4.22Å; F40-L44 WeakPolarHBondContact O-CB 3.37Å; F40-L44 PolarHBondContact O-N 2.89Å; F41-L44 CarbonylContact O-C 3.55Å; F41-L44 PolarHBondContact O-N 3.29Å; Y42-L44 VanDerWaalsContact C-N 3.27Å; L44-P46 VanDerWaalsContact C-CD 3.46Å; L44-P46 VanDerWaalsContact C-N 3.34Å; L44-I47 HydrophobicContact CB-CD1 4.5Å; L44-I47 HydrophobicContact CD1-CD1 3.68Å; L44-I47 HydrophobicContact CD2-CD1 4.5Å; L44-I47 HydrophobicContact CG-CD1 3.55Å; L44-I47 HydrophobicContact CG-CG1 4.35Å; L44-I47 WeakPolarHBondContact O-CB 3.4Å; L44-I47 WeakPolarHBondContact O-CG1 3.48Å; L44-I47 PolarHBondContact O-N 3.32Å; L44-I77 HydrophobicContact CB-CD1 4.44Å |
| 45 | S | 58.5 | Low | 56.5 | Low | 28 Ų | 28 | 71.3 Ų | 71.3 | 20% | 0.196 | 34% | 0.344 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55 | -30.7 | 173.7 | -175.1 | 0 | 0 | 0 | 0 | 115.7 | F41 Y42 I47 P48 | F41-S45 PolarHBondContact O-N 3.45Å; Y42-S45 VanDerWaalsContact O-CB 3.23Å; Y42-S45 WeakPolarHBondContact O-CB 3.41Å; Y42-S45 PolarHBondContact O-N 3.02Å; S45-I47 PolarHBondContact O-N 2.85Å; S45-P48 WeakPolarHBondContact O-CD 3.49Å; S45-P48 WeakPolarHBondContact O-CG 3.43Å |
| 46 | P | 53.9 | Low | 56 | Low | 62 Ų | 62 | 76.1 Ų | 76.1 | 40% | 0.403 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -71.4 | -8.5 | 171.9 | 23.8 | -36.1 | 0 | 0 | 0 | 114.5 | Y42 I43 L44 Y49 C50 | Y42-P46 WeakPolarHBondContact O-CD 3.38Å; I43-P46 VanDerWaalsContact C-CD 3.47Å; I43-P46 WeakPolarHBondContact O-CD 3.39Å; I43-P46 WeakPolarHBondContact O-CG 2.94Å; L44-P46 VanDerWaalsContact C-CD 3.46Å; L44-P46 VanDerWaalsContact C-N 3.34Å; P46-Y49 WeakPolarHBondContact O-CB 3.43Å; P46-Y49 PolarHBondContact O-N 3.1Å; P46-C50 PolarHBondContact O-N 3.4Å |
| 47 | I | 55.3 | Low | 55.4 | Low | 68 Ų | 68 | 79.3 Ų | 79.3 | 35% | 0.349 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59.5 | -49.3 | 176.1 | -64.1 | -172.7 | 0 | 0 | 0 | 112.2 | L44 S45 Y49 C50 I51 L73 | L44-I47 HydrophobicContact CB-CD1 4.5Å; L44-I47 HydrophobicContact CD1-CD1 3.68Å; L44-I47 HydrophobicContact CD2-CD1 4.5Å; L44-I47 HydrophobicContact CG-CD1 3.55Å; L44-I47 HydrophobicContact CG-CG1 4.35Å; L44-I47 WeakPolarHBondContact O-CB 3.4Å; L44-I47 WeakPolarHBondContact O-CG1 3.48Å; L44-I47 PolarHBondContact O-N 3.32Å; S45-I47 PolarHBondContact O-N 2.85Å; I47-Y49 VanDerWaalsContact C-N 3.26Å; I47-Y49 PolarHBondContact O-N 3.34Å; I47-C50 PolarHBondContact O-N 2.94Å; I47-I51 HydrophobicContact CG2-CD1 3.77Å; I47-I51 VanDerWaalsContact O-CG1 3.28Å; I47-I51 WeakPolarHBondContact O-CG1 3.39Å; I47-I51 PolarHBondContact O-N 3.24Å; I47-L73 HydrophobicContact CG2-CD2 4.28Å |
| 48 | P | 50.3 | Low | 54.6 | Low | 16 Ų | 16 | 79.3 Ų | 79.3 | 10% | 0.104 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -62.4 | -30.4 | 174 | 20.5 | -33.3 | 0 | 0 | 0 | 113.6 | S45 I51 S52 T74 | S45-P48 WeakPolarHBondContact O-CD 3.49Å; S45-P48 WeakPolarHBondContact O-CG 3.43Å; P48-I51 PolarHBondContact O-N 3.48Å; P48-S52 PolarHBondContact O-N 2.88Å; P48-S52 PolarHBondContact O-OG 3.09Å; P48-T74 VanDerWaalsContact CB-OG1 3.28Å; P48-T74 WeakPolarHBondContact CB-OG1 3.41Å; P48-T74 HydrophobicContact CG-CG2 4.24Å |
| 49 | Y | 54.3 | Low | 53.8 | Low | 109 Ų | 109 | 84.8 Ų | 84.8 | 43% | 0.427 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -71 | -38 | 175.8 | -173.9 | -100.9 | 0 | 0 | 0 | 112.7 | P46 I47 I51 S52 R53 F116 | P46-Y49 WeakPolarHBondContact O-CB 3.43Å; P46-Y49 PolarHBondContact O-N 3.1Å; I47-Y49 VanDerWaalsContact C-N 3.26Å; I47-Y49 PolarHBondContact O-N 3.34Å; Y49-I51 VanDerWaalsContact C-N 3.3Å; Y49-S52 PolarHBondContact O-OG 2.89Å; Y49-R53 PolarHBondContact O-N 3.37Å; Y49-F116 AromaticContact CE2-CE1 3.84Å; Y49-F116 HydrophobicContact CE2-CE1 3.84Å; Y49-F116 HydrophobicContact CE2-CZ 4.29Å |
| 50 | C | 54.1 | Low | 53.4 | Low | 83 Ų | 83 | 88.5 Ų | 88.5 | 56% | 0.561 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -67.9 | -31.1 | 172.8 | -76.3 | 0 | 0 | 0 | 0 | 112.4 | P46 I47 R54 | P46-C50 PolarHBondContact O-N 3.4Å; I47-C50 PolarHBondContact O-N 2.94Å; C50-R54 PolarHBondContact O-N 3.34Å |
| 51 | I | 51.7 | Low | 52.9 | Low | 48 Ų | 48 | 88 Ų | 88 | 25% | 0.246 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -76.2 | -44.7 | 177.4 | -64.7 | 164.7 | 0 | 0 | 0 | 110.5 | I47 P48 Y49 R53 R54 V55 C66 A70 | I47-I51 HydrophobicContact CG2-CD1 3.77Å; I47-I51 VanDerWaalsContact O-CG1 3.28Å; I47-I51 WeakPolarHBondContact O-CG1 3.39Å; I47-I51 PolarHBondContact O-N 3.24Å; P48-I51 PolarHBondContact O-N 3.48Å; Y49-I51 VanDerWaalsContact C-N 3.3Å; I51-R53 PolarHBondContact O-N 2.64Å; I51-R54 PolarHBondContact O-N 3.11Å; I51-R54 VanDerWaalsContact O-N 3.07Å; I51-V55 HydrophobicContact CG2-CG2 4.13Å; I51-V55 WeakPolarHBondContact O-CB 3.23Å; I51-V55 VanDerWaalsContact O-CG2 3.26Å; I51-V55 WeakPolarHBondContact O-CG2 3.48Å; I51-V55 PolarHBondContact O-N 2.7Å; I51-C66 VanDerWaalsContact CG2-SG 3.57Å; I51-A70 HydrophobicContact CG2-CB 4.21Å |
| 52 | S | 47.6 | Very low | 52.4 | Low | 52 Ų | 52 | 89.4 Ų | 89.4 | 36% | 0.364 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.7 | -35.3 | 176.4 | 64 | 0 | 0 | 0 | 0 | 112.3 | P48 Y49 V55 | P48-S52 PolarHBondContact O-N 2.88Å; P48-S52 PolarHBondContact O-OG 3.09Å; Y49-S52 PolarHBondContact O-OG 2.89Å; S52-V55 PolarHBondContact O-N 3.32Å |
| 53 | R | 50.3 | Low | 52.3 | Low | 188 Ų | 188 | 89.2 Ų | 89.2 | 71% | 0.709 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -74.7 | -21.3 | 177.3 | -145.1 | 173 | 97.1 | 143.1 | 4.9 | 114.4 | Y49 I51 | Y49-R53 PolarHBondContact O-N 3.37Å; I51-R53 PolarHBondContact O-N 2.64Å |
| 54 | R | 50.1 | Low | 52.3 | Low | 210 Ų | 210 | 88.8 Ų | 88.8 | 79% | 0.792 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -87.7 | -25.2 | 171.6 | -90.9 | -172.1 | 168 | 170.3 | -2.6 | 113 | C50 I51 V56 D57 | C50-R54 PolarHBondContact O-N 3.34Å; I51-R54 PolarHBondContact O-N 3.11Å; I51-R54 VanDerWaalsContact O-N 3.07Å; R54-V56 VanDerWaalsContact C-N 3.32Å; R54-V56 PolarHBondContact O-N 3.44Å; R54-D57 PolarHBondContact O-N 2.96Å |
| 55 | V | 48.3 | Very low | 52.7 | Low | 40 Ų | 40 | 89.1 Ų | 89.1 | 24% | 0.242 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -72.3 | -22.4 | -178.6 | 161.8 | 0 | 0 | 0 | 0 | 113.1 | I51 S52 D57 S63 C66 | I51-V55 HydrophobicContact CG2-CG2 4.13Å; I51-V55 WeakPolarHBondContact O-CB 3.23Å; I51-V55 VanDerWaalsContact O-CG2 3.26Å; I51-V55 WeakPolarHBondContact O-CG2 3.48Å; I51-V55 PolarHBondContact O-N 2.7Å; S52-V55 PolarHBondContact O-N 3.32Å; V55-D57 PolarHBondContact O-N 3.49Å; V55-S63 WeakPolarHBondContact CG1-OG 3.43Å; V55-C66 HydrophobicContact CG2-CB 4.26Å |
| 56 | V | 49.4 | Very low | 52.8 | Low | 105 Ų | 105 | 90.1 Ų | 90.1 | 64% | 0.636 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -20.7 | 174.5 | 169.7 | 0 | 0 | 0 | 0 | 112.5 | R54 | R54-V56 VanDerWaalsContact C-N 3.32Å; R54-V56 PolarHBondContact O-N 3.44Å |
| 57 | D | 49.3 | Very low | 53.2 | Low | 139 Ų | 139 | 92.7 Ų | 92.7 | 74% | 0.743 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.5 | -13.5 | -175.5 | -86.8 | -57.8 | 0 | 0 | 0 | 115.2 | R54 V55 | R54-D57 PolarHBondContact O-N 2.96Å; V55-D57 PolarHBondContact O-N 3.49Å |
| 58 | D | 44.2 | Very low | 53.8 | Low | 114 Ų | 114 | 95.8 Ų | 95.8 | 61% | 0.61 | 52% | 0.515 | S | S | * | . | S | Bend | trans | -136.5 | 96.7 | -169.9 | -143.8 | -96.2 | 0 | 0 | 0 | 115.5 | ||
| 59 | T | 47 | Very low | 54.7 | Low | 118 Ų | 118 | 100.6 Ų | 100.6 | 72% | 0.724 | 54% | 0.539 | S | S | * | . | trans | 6.4 | 115.6 | 156.4 | -48.1 | 0 | 0 | 0 | 0 | 121.2 | S61 | T59-S61 PolarHBondContact O-N 3.39Š| ||
| 60 | D | 55.9 | Low | 55.3 | Low | 135 Ų | 135 | 96.1 Ų | 96.1 | 72% | 0.722 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.2 | -35 | 144.4 | -118.9 | -104.8 | 0 | 0 | 0 | 124.5 | ||
| 61 | S | 53.3 | Low | 56.1 | Low | 102 Ų | 102 | 96.3 Ų | 96.3 | 71% | 0.713 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.5 | -37.9 | -175.2 | -70.9 | 0 | 0 | 0 | 0 | 115 | T59 S63 | T59-S61 PolarHBondContact O-N 3.39Å; S61-S63 VanDerWaalsContact C-N 3.31Å |
| 62 | A | 51.6 | Low | 57.2 | Low | 64 Ų | 64 | 101.6 Ų | 101.6 | 53% | 0.529 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -73.7 | -26.9 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | N64 A65 C66 | A62-N64 PolarHBondContact O-N 3Å; A62-A65 PolarHBondContact O-N 3.28Å; A62-C66 WeakPolarHBondContact O-CB 3.36Å; A62-C66 PolarHBondContact O-N 3.48Å |
| 63 | S | 57.7 | Low | 58.5 | Low | 31 Ų | 31 | 103 Ų | 103 | 22% | 0.217 | 54% | 0.544 | C | S | . | . | H | α-helix | trans | -59.5 | -42.1 | 179.6 | -177.4 | 0 | 0 | 0 | 0 | 112.9 | V55 S61 C66 K67 | V55-S63 WeakPolarHBondContact CG1-OG 3.43Å; S61-S63 VanDerWaalsContact C-N 3.31Å; S63-C66 PolarHBondContact O-N 3.45Å; S63-K67 WeakPolarHBondContact O-CB 3.29Å; S63-K67 PolarHBondContact O-N 3.49Å |
| 64 | N | 59.3 | Low | 59.4 | Low | 100 Ų | 100 | 96.2 Ų | 96.2 | 54% | 0.535 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.4 | -44.1 | 179.5 | -76 | -41.4 | 0 | 0 | 0 | 112.6 | A62 K67 E68 | A62-N64 PolarHBondContact O-N 3Å; N64-K67 PolarHBondContact O-N 3.34Å; N64-E68 WeakPolarHBondContact O-CB 3.44Å; N64-E68 WeakPolarHBondContact O-CG 3.31Å; N64-E68 PolarHBondContact O-N 3.21Å |
| 65 | A | 64.3 | Low | 60.7 | Low | 59 Ų | 59 | 89.6 Ų | 89.6 | 49% | 0.488 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.7 | -39.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A62 L69 | A62-A65 PolarHBondContact O-N 3.28Å; A65-L69 WeakPolarHBondContact O-CB 3.08Å; A65-L69 VanDerWaalsContact O-CG 3.26Å; A65-L69 WeakPolarHBondContact O-CG 3.39Å; A65-L69 PolarHBondContact O-N 3.38Å |
| 66 | C | 61.9 | Low | 62.1 | Low | 49 Ų | 49 | 89.2 Ų | 89.2 | 33% | 0.331 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -70 | -36.2 | 178.3 | -152.9 | 0 | 0 | 0 | 0 | 111.8 | I51 V55 A62 S63 A70 | I51-C66 VanDerWaalsContact CG2-SG 3.57Å; V55-C66 HydrophobicContact CG2-CB 4.26Å; A62-C66 WeakPolarHBondContact O-CB 3.36Å; A62-C66 PolarHBondContact O-N 3.48Å; S63-C66 PolarHBondContact O-N 3.45Å; C66-A70 VanDerWaalsContact O-CB 3.25Å; C66-A70 WeakPolarHBondContact O-CB 3.4Å; C66-A70 PolarHBondContact O-N 3.49Å |
| 67 | K | 61.2 | Low | 63.5 | Low | 116 Ų | 116 | 84.9 Ų | 84.9 | 50% | 0.504 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.3 | -48.1 | 173.2 | 178 | 178.7 | 168.2 | -176.6 | 0 | 112 | S63 N64 L69 A70 I71 | S63-K67 WeakPolarHBondContact O-CB 3.29Å; S63-K67 PolarHBondContact O-N 3.49Å; N64-K67 PolarHBondContact O-N 3.34Å; K67-L69 VanDerWaalsContact C-N 3.34Å; K67-L69 PolarHBondContact O-N 2.92Å; K67-A70 PolarHBondContact O-N 3.38Å; K67-I71 HydrophobicContact CG-CD1 3.97Å; K67-I71 VanDerWaalsContact O-CG1 3.28Å; K67-I71 WeakPolarHBondContact O-CG1 3.38Å; K67-I71 PolarHBondContact O-N 3.25Å |
| 68 | E | 68.3 | Low | 65 | Low | 134 Ų | 134 | 80.3 Ų | 80.3 | 63% | 0.626 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -59.2 | -44.8 | 175.1 | -73.7 | -76 | 134.6 | 0 | 0 | 111.2 | N64 I71 F72 | N64-E68 WeakPolarHBondContact O-CB 3.44Å; N64-E68 WeakPolarHBondContact O-CG 3.31Å; N64-E68 PolarHBondContact O-N 3.21Å; E68-I71 PolarHBondContact O-N 3.02Å; E68-F72 WeakPolarHBondContact O-CB 3.22Å; E68-F72 PolarHBondContact O-N 2.83Å |
| 69 | L | 69.9 | Low | 66.9 | Low | 116 Ų | 116 | 80.2 Ų | 80.2 | 61% | 0.607 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -64.4 | -40.8 | 175.5 | -75.6 | 174.4 | 0 | 0 | 0 | 112.6 | A65 K67 F72 L73 | A65-L69 WeakPolarHBondContact O-CB 3.08Å; A65-L69 VanDerWaalsContact O-CG 3.26Å; A65-L69 WeakPolarHBondContact O-CG 3.39Å; A65-L69 PolarHBondContact O-N 3.38Å; K67-L69 VanDerWaalsContact C-N 3.34Å; K67-L69 PolarHBondContact O-N 2.92Å; L69-F72 PolarHBondContact O-N 3.31Å; L69-L73 VanDerWaalsContact O-CB 3.25Å; L69-L73 WeakPolarHBondContact O-CB 3.49Å; L69-L73 PolarHBondContact O-N 3.49Å |
| 70 | A | 65.8 | Low | 68.6 | Low | 15 Ų | 15 | 76.9 Ų | 76.9 | 12% | 0.124 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -63.3 | -44.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | I51 C66 K67 L73 T74 | I51-A70 HydrophobicContact CG2-CB 4.21Å; C66-A70 VanDerWaalsContact O-CB 3.25Å; C66-A70 WeakPolarHBondContact O-CB 3.4Å; C66-A70 PolarHBondContact O-N 3.49Å; K67-A70 PolarHBondContact O-N 3.38Å; A70-L73 PolarHBondContact O-N 3.1Å; A70-T74 WeakPolarHBondContact O-CB 3.08Å; A70-T74 PolarHBondContact O-N 2.89Å; A70-T74 PolarHBondContact O-OG1 3.03Å |
| 71 | I | 70.4 | Confident | 69.6 | Low | 88 Ų | 88 | 70.5 Ų | 70.5 | 45% | 0.451 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -61.6 | -49 | 176.1 | -66.5 | 162.8 | 0 | 0 | 0 | 109.7 | K67 E68 L73 T74 T75 | K67-I71 HydrophobicContact CG-CD1 3.97Å; K67-I71 VanDerWaalsContact O-CG1 3.28Å; K67-I71 WeakPolarHBondContact O-CG1 3.38Å; K67-I71 PolarHBondContact O-N 3.25Å; E68-I71 PolarHBondContact O-N 3.02Å; I71-L73 VanDerWaalsContact C-N 3.33Å; I71-L73 PolarHBondContact O-N 2.99Å; I71-T74 PolarHBondContact O-N 3.04Å; I71-T75 PolarHBondContact O-N 2.99Å; I71-T75 PolarHBondContact O-OG1 3.37Å |
| 72 | F | 76.3 | Confident | 71 | Confident | 159 Ų | 159 | 68 Ų | 68 | 70% | 0.697 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -56.6 | -45.7 | 178.2 | -177.3 | -99.3 | 0 | 0 | 0 | 112.5 | E68 L69 T75 G76 | E68-F72 WeakPolarHBondContact O-CB 3.22Å; E68-F72 PolarHBondContact O-N 2.83Å; L69-F72 PolarHBondContact O-N 3.31Å; F72-T75 PolarHBondContact O-N 3.31Å; F72-G76 PolarHBondContact O-N 3.2Å |
| 73 | L | 73.6 | Confident | 72.5 | Confident | 80 Ų | 80 | 66.1 Ų | 66.1 | 42% | 0.419 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -69 | -37.9 | -179.8 | -160.5 | 129.6 | 0 | 0 | 0 | 111.5 | I47 L69 A70 I71 G76 I77 | I47-L73 HydrophobicContact CG2-CD2 4.28Å; L69-L73 VanDerWaalsContact O-CB 3.25Å; L69-L73 WeakPolarHBondContact O-CB 3.49Å; L69-L73 PolarHBondContact O-N 3.49Å; A70-L73 PolarHBondContact O-N 3.1Å; I71-L73 VanDerWaalsContact C-N 3.33Å; I71-L73 PolarHBondContact O-N 2.99Å; L73-G76 PolarHBondContact O-N 3.2Å; L73-I77 HydrophobicContact CD2-CD1 3.65Å; L73-I77 HydrophobicContact CD2-CG1 4.49Å; L73-I77 VanDerWaalsContact O-CG1 3.26Å; L73-I77 WeakPolarHBondContact O-CG1 3.45Å; L73-I77 PolarHBondContact O-N 3.02Å |
| 74 | T | 70.3 | Confident | 73.4 | Confident | 46 Ų | 46 | 66.1 Ų | 66.1 | 28% | 0.282 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -65.6 | -46 | 176 | -45.4 | 0 | 0 | 0 | 0 | 110.8 | P48 A70 I71 G76 I77 V78 | P48-T74 VanDerWaalsContact CB-OG1 3.28Å; P48-T74 WeakPolarHBondContact CB-OG1 3.41Å; P48-T74 HydrophobicContact CG-CG2 4.24Å; A70-T74 WeakPolarHBondContact O-CB 3.08Å; A70-T74 PolarHBondContact O-N 2.89Å; A70-T74 PolarHBondContact O-OG1 3.03Å; I71-T74 PolarHBondContact O-N 3.04Å; T74-G76 VanDerWaalsContact C-N 3.33Å; T74-G76 PolarHBondContact O-N 2.88Å; T74-I77 PolarHBondContact O-N 3.25Å; T74-V78 WeakPolarHBondContact O-CG2 3.26Å; T74-V78 PolarHBondContact O-N 3.34Å |
| 75 | T | 76.4 | Confident | 74.1 | Confident | 71 Ų | 71 | 61.5 Ų | 61.5 | 44% | 0.436 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.3 | -40.8 | 175.3 | -54 | 0 | 0 | 0 | 0 | 111.2 | I71 F72 V78 I79 | I71-T75 PolarHBondContact O-N 2.99Å; I71-T75 PolarHBondContact O-OG1 3.37Å; F72-T75 PolarHBondContact O-N 3.31Å; T75-V78 PolarHBondContact O-N 3.23Å; T75-I79 HydrophobicContact CG2-CD1 3.77Å; T75-I79 HydrophobicContact CG2-CG1 4.4Å; T75-I79 WeakPolarHBondContact O-CB 3.39Å; T75-I79 VanDerWaalsContact O-CG1 3.24Å; T75-I79 WeakPolarHBondContact O-CG1 3.35Å; T75-I79 PolarHBondContact O-N 2.95Å |
| 76 | G | 79.1 | Confident | 74.9 | Confident | 32 Ų | 32 | 62.7 Ų | 62.7 | 33% | 0.33 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -60.9 | -42.3 | 174 | 0 | 0 | 0 | 0 | 0 | 113.3 | F72 L73 T74 S80 | F72-G76 PolarHBondContact O-N 3.2Å; L73-G76 PolarHBondContact O-N 3.2Å; T74-G76 VanDerWaalsContact C-N 3.33Å; T74-G76 PolarHBondContact O-N 2.88Å; G76-S80 VanDerWaalsContact O-CB 3.25Å; G76-S80 WeakPolarHBondContact O-CB 3.25Å; G76-S80 PolarHBondContact O-N 2.82Å; G76-S80 PolarHBondContact O-OG 2.86Å |
| 77 | I | 78.4 | Confident | 75.8 | Confident | 14 Ų | 14 | 65.5 Ų | 65.5 | 7% | 0.072 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.1 | -45.1 | 175.1 | -72 | 167.5 | 0 | 0 | 0 | 110.8 | F41 L44 L73 T74 S80 A81 | F41-I77 HydrophobicContact CB-CG2 4.46Å; F41-I77 HydrophobicContact CD1-CG1 4.44Å; F41-I77 HydrophobicContact CD1-CG2 4.16Å; L44-I77 HydrophobicContact CB-CD1 4.44Å; L73-I77 HydrophobicContact CD2-CD1 3.65Å; L73-I77 HydrophobicContact CD2-CG1 4.49Å; L73-I77 VanDerWaalsContact O-CG1 3.26Å; L73-I77 WeakPolarHBondContact O-CG1 3.45Å; L73-I77 PolarHBondContact O-N 3.02Å; T74-I77 PolarHBondContact O-N 3.25Å; I77-S80 PolarHBondContact O-N 2.81Å; I77-A81 WeakPolarHBondContact O-CB 3.01Å; I77-A81 PolarHBondContact O-N 3.19Å |
| 78 | V | 80.4 | Confident | 76.4 | Confident | 44 Ų | 44 | 60.6 Ų | 60.6 | 27% | 0.267 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60 | -52.2 | 178.6 | 175.3 | 0 | 0 | 0 | 0 | 110.4 | T74 T75 S80 A81 F82 F110 | T74-V78 WeakPolarHBondContact O-CG2 3.26Å; T74-V78 PolarHBondContact O-N 3.34Å; T75-V78 PolarHBondContact O-N 3.23Å; V78-S80 VanDerWaalsContact C-N 3.29Å; V78-S80 PolarHBondContact O-N 3.39Å; V78-A81 PolarHBondContact O-N 3.21Å; V78-F82 HydrophobicContact CG1-CD2 4.01Å; V78-F82 HydrophobicContact CG1-CE2 3.9Å; V78-F82 WeakPolarHBondContact O-CD2 3.33Å; V78-F82 PolarHBondContact O-N 3.44Å; V78-F110 HydrophobicContact CB-CE1 4.05Å; V78-F110 HydrophobicContact CB-CZ 4.07Å; V78-F110 HydrophobicContact CG1-CD1 4.43Å; V78-F110 HydrophobicContact CG1-CD2 4.39Å; V78-F110 HydrophobicContact CG1-CE1 4.23Å; V78-F110 HydrophobicContact CG1-CE2 4.18Å; V78-F110 HydrophobicContact CG1-CZ 4.12Å; V78-F110 HydrophobicContact CG2-CD1 3.78Å; V78-F110 HydrophobicContact CG2-CE1 3.37Å; V78-F110 HydrophobicContact CG2-CZ 3.92Å |
| 79 | I | 84.8 | Confident | 76.7 | Confident | 112 Ų | 112 | 54.5 Ų | 54.5 | 57% | 0.574 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -60.5 | -41.9 | 179.7 | -65.8 | 166.5 | 0 | 0 | 0 | 110.3 | T75 A81 F82 G83 | T75-I79 HydrophobicContact CG2-CD1 3.77Å; T75-I79 HydrophobicContact CG2-CG1 4.4Å; T75-I79 WeakPolarHBondContact O-CB 3.39Å; T75-I79 VanDerWaalsContact O-CG1 3.24Å; T75-I79 WeakPolarHBondContact O-CG1 3.35Å; T75-I79 PolarHBondContact O-N 2.95Å; I79-A81 PolarHBondContact O-N 3.39Å; I79-F82 PolarHBondContact O-N 3.48Å; I79-G83 PolarHBondContact O-N 3.03Å |
| 80 | S | 81.6 | Confident | 77.1 | Confident | 47 Ų | 47 | 58.4 Ų | 58.4 | 33% | 0.329 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.2 | -40.2 | 178.2 | -60.6 | 0 | 0 | 0 | 0 | 112.3 | G76 I77 V78 F82 G83 L84 | G76-S80 VanDerWaalsContact O-CB 3.25Å; G76-S80 WeakPolarHBondContact O-CB 3.25Å; G76-S80 PolarHBondContact O-N 2.82Å; G76-S80 PolarHBondContact O-OG 2.86Å; I77-S80 PolarHBondContact O-N 2.81Å; V78-S80 VanDerWaalsContact C-N 3.29Å; V78-S80 PolarHBondContact O-N 3.39Å; S80-F82 VanDerWaalsContact C-N 3.28Å; S80-F82 PolarHBondContact O-N 2.9Å; S80-G83 PolarHBondContact O-N 3.28Å; S80-L84 WeakPolarHBondContact O-CB 3.37Å; S80-L84 PolarHBondContact O-N 3.23Å |
| 81 | A | 78.2 | Confident | 77.6 | Confident | 2 Ų | 2 | 60.6 Ų | 60.6 | 2% | 0.017 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.8 | -32.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L38 I77 V78 I79 P85 N106 F110 | L38-A81 HydrophobicContact CD2-CB 4.01Å; L38-A81 VanDerWaalsContact CD2-O 3.31Å; L38-A81 WeakPolarHBondContact CD2-O 3.38Å; I77-A81 WeakPolarHBondContact O-CB 3.01Å; I77-A81 PolarHBondContact O-N 3.19Å; V78-A81 PolarHBondContact O-N 3.21Å; I79-A81 PolarHBondContact O-N 3.39Å; A81-P85 WeakPolarHBondContact O-CD 3.3Å; A81-P85 WeakPolarHBondContact O-CG 3.44Å; A81-N106 PolarHBondContact O-ND2 3.36Å; A81-F110 HydrophobicContact CB-CE2 3.88Å; A81-F110 HydrophobicContact CB-CZ 3.74Å |
| 82 | F | 82.3 | Confident | 77.5 | Confident | 50 Ų | 50 | 65.1 Ų | 65.1 | 22% | 0.219 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -84.2 | -34.7 | 173.3 | -73.3 | -72.2 | 0 | 0 | 0 | 113.4 | V78 I79 S80 P85 I86 L103 N106 V107 F110 | V78-F82 HydrophobicContact CG1-CD2 4.01Å; V78-F82 HydrophobicContact CG1-CE2 3.9Å; V78-F82 WeakPolarHBondContact O-CD2 3.33Å; V78-F82 PolarHBondContact O-N 3.44Å; I79-F82 PolarHBondContact O-N 3.48Å; S80-F82 VanDerWaalsContact C-N 3.28Å; S80-F82 PolarHBondContact O-N 2.9Å; F82-P85 WeakPolarHBondContact O-CD 3.23Å; F82-P85 WeakPolarHBondContact O-CG 3.48Å; F82-I86 VanDerWaalsContact O-CD1 3.24Å; F82-I86 WeakPolarHBondContact O-CD1 3.48Å; F82-I86 WeakPolarHBondContact O-CG1 3.24Å; F82-L103 HydrophobicContact CD1-CD2 3.7Å; F82-L103 HydrophobicContact CD1-CG 4.31Å; F82-L103 HydrophobicContact CE1-CD2 4.05Å; F82-N106 HydrophobicContact CD1-CB 4.25Å; F82-N106 HydrophobicContact CE1-CB 3.65Å; F82-N106 HydrophobicContact CZ-CB 3.87Å; F82-V107 HydrophobicContact CE1-CG2 3.99Å; F82-V107 HydrophobicContact CZ-CG2 4.12Å; F82-F110 HydrophobicContact CD2-CD2 4.4Å; F82-F110 HydrophobicContact CD2-CE2 4.08Å; F82-F110 AromaticContact CE2-CD2 3.38Å; F82-F110 HydrophobicContact CE2-CD2 3.38Å; F82-F110 AromaticContact CE2-CE2 3.47Å; F82-F110 HydrophobicContact CE2-CE2 3.47Å; F82-F110 VanDerWaalsContact CE2-CE2 3.47Å; F82-F110 HydrophobicContact CE2-CG 4.44Å; F82-F110 AromaticContact CZ-CD2 3.62Å; F82-F110 HydrophobicContact CZ-CD2 3.62Å; F82-F110 AromaticContact CZ-CE2 3.99Å; F82-F110 HydrophobicContact CZ-CE2 3.99Å |
| 83 | G | 81.4 | Confident | 77.1 | Confident | 24 Ų | 24 | 59.4 Ų | 59.4 | 25% | 0.247 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -70.9 | -42.2 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | I79 S80 I86 I87 | I79-G83 PolarHBondContact O-N 3.03Å; S80-G83 PolarHBondContact O-N 3.28Å; G83-I86 PolarHBondContact O-N 2.65Å; G83-I87 WeakPolarHBondContact O-CD1 3.25Å; G83-I87 VanDerWaalsContact O-CG1 3.29Å; G83-I87 WeakPolarHBondContact O-CG1 3.11Å; G83-I87 PolarHBondContact O-N 2.9Å |
| 84 | L | 78 | Confident | 77 | Confident | 31 Ų | 31 | 55.9 Ų | 55.9 | 16% | 0.162 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -54.4 | -52.5 | -179.9 | -101.9 | 154.9 | 0 | 0 | 0 | 115 | F37 F41 S80 I86 I87 F88 | F37-L84 HydrophobicContact CD1-CD1 4.09Å; F37-L84 HydrophobicContact CE1-CD1 4.49Å; F41-L84 HydrophobicContact CD2-CD1 4.03Å; F41-L84 HydrophobicContact CE2-CD1 3.23Å; F41-L84 HydrophobicContact CZ-CD1 3.83Å; S80-L84 WeakPolarHBondContact O-CB 3.37Å; S80-L84 PolarHBondContact O-N 3.23Å; L84-I86 VanDerWaalsContact C-N 3.27Å; L84-I86 PolarHBondContact O-N 2.96Å; L84-I87 PolarHBondContact O-N 3.11Å; L84-F88 HydrophobicContact CB-CE2 4.42Å; L84-F88 HydrophobicContact CD2-CE1 3.98Å; L84-F88 HydrophobicContact CD2-CE2 3.51Å; L84-F88 HydrophobicContact CD2-CZ 3.07Å; L84-F88 HydrophobicContact CG-CZ 4.44Å; L84-F88 WeakPolarHBondContact O-CD2 3.27Å; L84-F88 WeakPolarHBondContact O-CG 3.32Å; L84-F88 PolarHBondContact O-N 3.03Å; L84-F88 VanDerWaalsContact O-N 3.08Å |
| 85 | P | 74.4 | Confident | 77.3 | Confident | 3 Ų | 3 | 56.1 Ų | 56.1 | 2% | 0.019 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.2 | -33.6 | 179.3 | 22.5 | -32.3 | 0 | 0 | 0 | 112.5 | A81 F82 F88 A89 C99 V102 | A81-P85 WeakPolarHBondContact O-CD 3.3Å; A81-P85 WeakPolarHBondContact O-CG 3.44Å; F82-P85 WeakPolarHBondContact O-CD 3.23Å; F82-P85 WeakPolarHBondContact O-CG 3.48Å; P85-F88 PolarHBondContact O-N 3.25Å; P85-A89 PolarHBondContact O-N 3.17Å; P85-C99 PolarHBondContact O-SG 3.41Å; P85-V102 HydrophobicContact CB-CB 4.46Å; P85-V102 HydrophobicContact CB-CG1 3.89Å; P85-V102 HydrophobicContact CG-CG1 4.11Å |
| 86 | I | 80 | Confident | 77.2 | Confident | 84 Ų | 84 | 61.4 Ų | 61.4 | 43% | 0.431 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -66.6 | -41.2 | 177.3 | -62.4 | 168.4 | 0 | 0 | 0 | 110.8 | F82 G83 L84 A89 R90 L103 | F82-I86 VanDerWaalsContact O-CD1 3.24Å; F82-I86 WeakPolarHBondContact O-CD1 3.48Å; F82-I86 WeakPolarHBondContact O-CG1 3.24Å; G83-I86 PolarHBondContact O-N 2.65Å; L84-I86 VanDerWaalsContact C-N 3.27Å; L84-I86 PolarHBondContact O-N 2.96Å; I86-A89 PolarHBondContact O-N 2.69Å; I86-R90 PolarHBondContact O-N 3.24Å; I86-R90 VanDerWaalsContact O-N 3.1Å; I86-L103 HydrophobicContact CG1-CD1 4.31Å |
| 87 | I | 81.7 | Confident | 77.1 | Confident | 107 Ų | 107 | 61.7 Ų | 61.7 | 55% | 0.549 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65 | -40.8 | 177.2 | -65 | 159 | 0 | 0 | 0 | 110.4 | G83 L84 R90 A91 | G83-I87 WeakPolarHBondContact O-CD1 3.25Å; G83-I87 VanDerWaalsContact O-CG1 3.29Å; G83-I87 WeakPolarHBondContact O-CG1 3.11Å; G83-I87 PolarHBondContact O-N 2.9Å; L84-I87 PolarHBondContact O-N 3.11Å; I87-R90 PolarHBondContact O-N 2.94Å; I87-A91 WeakPolarHBondContact O-CB 3.17Å; I87-A91 PolarHBondContact O-N 3.36Å |
| 88 | F | 73.1 | Confident | 76.9 | Confident | 13 Ų | 13 | 61 Ų | 61 | 6% | 0.057 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -68 | -35.5 | 175.9 | -64.2 | -30.1 | 0 | 0 | 0 | 114.3 | W34 L84 P85 R90 A91 E92 V93 I94 | W34-F88 AromaticContact CD2-CE1 3.99Å; W34-F88 HydrophobicContact CD2-CE1 3.99Å; W34-F88 HydrophobicContact CD2-CE2 4.47Å; W34-F88 AromaticContact CD2-CZ 3.99Å; W34-F88 HydrophobicContact CD2-CZ 3.99Å; W34-F88 AromaticContact CE3-CD1 3.97Å; W34-F88 HydrophobicContact CE3-CD1 3.97Å; W34-F88 HydrophobicContact CE3-CD2 4.36Å; W34-F88 AromaticContact CE3-CE1 3.09Å; W34-F88 HydrophobicContact CE3-CE1 3.09Å; W34-F88 AromaticContact CE3-CE2 3.52Å; W34-F88 HydrophobicContact CE3-CE2 3.52Å; W34-F88 AromaticContact CE3-CZ 2.84Å; W34-F88 HydrophobicContact CE3-CZ 2.84Å; W34-F88 AromaticContact CH2-CE1 3.74Å; W34-F88 HydrophobicContact CH2-CE1 3.74Å; W34-F88 HydrophobicContact CH2-CZ 4.14Å; W34-F88 HydrophobicContact CZ3-CD1 4.1Å; W34-F88 AromaticContact CZ3-CE1 2.96Å; W34-F88 HydrophobicContact CZ3-CE1 2.96Å; W34-F88 HydrophobicContact CZ3-CE2 4.07Å; W34-F88 AromaticContact CZ3-CZ 2.96Å; W34-F88 HydrophobicContact CZ3-CZ 2.96Å; L84-F88 HydrophobicContact CB-CE2 4.42Å; L84-F88 HydrophobicContact CD2-CE1 3.98Å; L84-F88 HydrophobicContact CD2-CE2 3.51Å; L84-F88 HydrophobicContact CD2-CZ 3.07Å; L84-F88 HydrophobicContact CG-CZ 4.44Å; L84-F88 WeakPolarHBondContact O-CD2 3.27Å; L84-F88 WeakPolarHBondContact O-CG 3.32Å; L84-F88 PolarHBondContact O-N 3.03Å; L84-F88 VanDerWaalsContact O-N 3.08Å; P85-F88 PolarHBondContact O-N 3.25Å; F88-R90 VanDerWaalsContact C-N 3.25Å; F88-R90 PolarHBondContact O-N 3.33Å; F88-A91 PolarHBondContact O-N 3.32Å; F88-E92 PolarHBondContact O-N 3.37Å; F88-V93 HydrophobicContact CB-CB 4.29Å; F88-V93 PolarHBondContact O-N 3.12Å; F88-I94 HydrophobicContact CB-CB 4.33Å; F88-I94 HydrophobicContact CB-CD1 3.53Å; F88-I94 HydrophobicContact CB-CG1 3.95Å; F88-I94 HydrophobicContact CD2-CD1 3.6Å; F88-I94 HydrophobicContact CG-CD1 3.94Å; F88-I94 PolarHBondContact O-N 3.24Å |
| 89 | A | 75.1 | Confident | 76.8 | Confident | 6 Ų | 6 | 59.2 Ų | 59.2 | 5% | 0.05 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.8 | -36.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | P85 I86 E92 C99 | P85-A89 PolarHBondContact O-N 3.17Å; I86-A89 PolarHBondContact O-N 2.69Å; A89-E92 PolarHBondContact O-N 2.98Å; A89-C99 HydrophobicContact CB-CB 4.01Å |
| 90 | R | 77.3 | Confident | 76.7 | Confident | 199 Ų | 199 | 56.4 Ų | 56.4 | 75% | 0.751 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -75.9 | -28.6 | 175.3 | -74.6 | -66.9 | -67.4 | -128.9 | -3.5 | 114.1 | I86 I87 F88 E92 | I86-R90 PolarHBondContact O-N 3.24Å; I86-R90 VanDerWaalsContact O-N 3.1Å; I87-R90 PolarHBondContact O-N 2.94Å; F88-R90 VanDerWaalsContact C-N 3.25Å; F88-R90 PolarHBondContact O-N 3.33Å; R90-E92 PolarHBondContact O-N 2.93Å |
| 91 | A | 77.6 | Confident | 76.7 | Confident | 61 Ų | 61 | 56.6 Ų | 56.6 | 50% | 0.504 | 30% | 0.303 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | 6.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | I87 F88 V93 | I87-A91 WeakPolarHBondContact O-CB 3.17Å; I87-A91 PolarHBondContact O-N 3.36Å; F88-A91 PolarHBondContact O-N 3.32Å; A91-V93 HydrophobicContact CB-CG2 3.85Å; A91-V93 PolarHBondContact O-N 2.94Å |
| 92 | E | 68.3 | Low | 76.8 | Confident | 183 Ų | 183 | 56.6 Ų | 56.6 | 86% | 0.855 | 30% | 0.303 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.1 | 22.7 | -175.5 | -54.8 | -162.4 | 126.3 | 0 | 0 | 113.9 | F88 A89 R90 | F88-E92 PolarHBondContact O-N 3.37Å; A89-E92 PolarHBondContact O-N 2.98Å; R90-E92 PolarHBondContact O-N 2.93Å |
| 93 | V | 67.2 | Low | 76.9 | Confident | 38 Ų | 38 | 56.9 Ų | 56.9 | 23% | 0.23 | 31% | 0.307 | C | S | . | . | S | Bend | trans | -80.1 | -29.6 | 177.6 | -179.7 | 0 | 0 | 0 | 0 | 110.6 | K32 W34 F88 A91 | K32-V93 VanDerWaalsContact CG-O 3.26Å; K32-V93 WeakPolarHBondContact CG-O 3.06Å; W34-V93 HydrophobicContact CB-CG1 4.1Å; W34-V93 HydrophobicContact CG-CG1 4.09Å; F88-V93 HydrophobicContact CB-CB 4.29Å; F88-V93 PolarHBondContact O-N 3.12Å; A91-V93 HydrophobicContact CB-CG2 3.85Å; A91-V93 PolarHBondContact O-N 2.94Å |
| 94 | I | 70.9 | Confident | 77.2 | Confident | 7 Ų | 7 | 59.1 Ų | 59.1 | 4% | 0.036 | 32% | 0.316 | C | S | . | . | S | Bend | trans | -133.6 | 133.8 | 179.9 | -60.5 | 168.9 | 0 | 0 | 0 | 107.8 | Y30 P35 F88 A98 | Y30-I94 HydrophobicContact CD1-CG2 4.39Å; P35-I94 HydrophobicContact CB-CD1 4.27Å; P35-I94 HydrophobicContact CG-CD1 3.6Å; P35-I94 HydrophobicContact CG-CG1 4.27Å; F88-I94 HydrophobicContact CB-CB 4.33Å; F88-I94 HydrophobicContact CB-CD1 3.53Å; F88-I94 HydrophobicContact CB-CG1 3.95Å; F88-I94 HydrophobicContact CD2-CD1 3.6Å; F88-I94 HydrophobicContact CG-CD1 3.94Å; F88-I94 PolarHBondContact O-N 3.24Å; I94-A98 HydrophobicContact CG2-CB 3.43Å; I94-A98 VanDerWaalsContact CG2-CB 3.43Å |
| 95 | A | 75.9 | Confident | 77.4 | Confident | 51 Ų | 51 | 57.7 Ų | 57.7 | 42% | 0.421 | 31% | 0.308 | S | S | . | . | trans | -74.8 | 155.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y30 G97 A98 C99 | Y30-A95 HydrophobicContact CD1-CB 4.17Å; Y30-A95 HydrophobicContact CE1-CB 3.32Å; A95-G97 PolarHBondContact O-N 3.26Å; A95-A98 PolarHBondContact O-N 3.27Å; A95-C99 PolarHBondContact O-N 3.15Å | ||
| 96 | W | 75.9 | Confident | 77.9 | Confident | 182 Ų | 182 | 57.6 Ų | 57.6 | 69% | 0.689 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -53.9 | -31.8 | -172.2 | -75.3 | 87.5 | 0 | 0 | 0 | 114.8 | C99 A100 | W96-C99 WeakPolarHBondContact O-CB 3.45Å; W96-C99 PolarHBondContact O-N 2.72Å; W96-A100 PolarHBondContact O-N 3.34Å |
| 97 | G | 76.6 | Confident | 78.1 | Confident | 38 Ų | 38 | 57.8 Ų | 57.8 | 39% | 0.392 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.1 | -45 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y30 A95 C99 A100 L101 | Y30-G97 WeakPolarHBondContact OH-CA 3.23Å; A95-G97 PolarHBondContact O-N 3.26Å; G97-C99 VanDerWaalsContact C-N 3.34Å; G97-A100 PolarHBondContact O-N 2.9Å; G97-L101 PolarHBondContact O-N 2.7Å; G97-L101 VanDerWaalsContact O-N 3.13Å |
| 98 | A | 74.6 | Confident | 78.3 | Confident | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -68.8 | -34.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | G24 Y30 I94 A95 A100 L101 V102 | G24-A98 WeakPolarHBondContact O-CB 3.25Å; Y30-A98 HydrophobicContact CD1-CB 3.41Å; Y30-A98 VanDerWaalsContact CD1-CB 3.41Å; Y30-A98 HydrophobicContact CD2-CB 4.17Å; Y30-A98 HydrophobicContact CE1-CB 3.26Å; Y30-A98 HydrophobicContact CE2-CB 4.14Å; Y30-A98 HydrophobicContact CG-CB 3.88Å; Y30-A98 PolarHBondContact OH-N 3.46Å; I94-A98 HydrophobicContact CG2-CB 3.43Å; I94-A98 VanDerWaalsContact CG2-CB 3.43Å; A95-A98 PolarHBondContact O-N 3.27Å; A98-A100 VanDerWaalsContact C-N 3.32Å; A98-A100 PolarHBondContact O-N 3.3Å; A98-L101 PolarHBondContact O-N 3.34Å; A98-V102 WeakPolarHBondContact O-CB 3.32Å; A98-V102 WeakPolarHBondContact O-CG2 3.38Å; A98-V102 PolarHBondContact O-N 3.02Å |
| 99 | C | 78.2 | Confident | 78.8 | Confident | 5 Ų | 5 | 54.8 Ų | 54.8 | 3% | 0.034 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -58.9 | -43.2 | 172.8 | -169.6 | 0 | 0 | 0 | 0 | 111.8 | P85 A89 A95 W96 G97 V102 L103 | P85-C99 PolarHBondContact O-SG 3.41Å; A89-C99 HydrophobicContact CB-CB 4.01Å; A95-C99 PolarHBondContact O-N 3.15Å; W96-C99 WeakPolarHBondContact O-CB 3.45Å; W96-C99 PolarHBondContact O-N 2.72Å; G97-C99 VanDerWaalsContact C-N 3.34Å; C99-V102 PolarHBondContact O-N 3.33Å; C99-L103 WeakPolarHBondContact O-CB 3.16Å; C99-L103 PolarHBondContact O-N 2.85Å |
| 100 | A | 82.8 | Confident | 79 | Confident | 53 Ų | 53 | 55.8 Ų | 55.8 | 44% | 0.438 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -66.1 | -40.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | W96 G97 A98 L103 T104 | W96-A100 PolarHBondContact O-N 3.34Å; G97-A100 PolarHBondContact O-N 2.9Å; A98-A100 VanDerWaalsContact C-N 3.32Å; A98-A100 PolarHBondContact O-N 3.3Å; A100-L103 PolarHBondContact O-N 3.11Å; A100-T104 WeakPolarHBondContact O-CB 3.1Å; A100-T104 PolarHBondContact O-N 3Å; A100-T104 PolarHBondContact O-OG1 3.46Å |
| 101 | L | 80.9 | Confident | 79.3 | Confident | 51 Ų | 51 | 48.2 Ų | 48.2 | 27% | 0.267 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.6 | -45.6 | 174.4 | -98.4 | 153.5 | 0 | 0 | 0 | 111.9 | F20 L23 G97 A98 T104 G105 | F20-L101 HydrophobicContact CB-CD2 4.13Å; F20-L101 HydrophobicContact CD1-CD2 3.46Å; F20-L101 VanDerWaalsContact CD1-CD2 3.46Å; F20-L101 HydrophobicContact CE1-CD2 4.28Å; F20-L101 HydrophobicContact CG-CD2 4.21Å; L23-L101 HydrophobicContact CB-CD2 4.28Å; G97-L101 PolarHBondContact O-N 2.7Å; G97-L101 VanDerWaalsContact O-N 3.13Å; A98-L101 PolarHBondContact O-N 3.34Å; L101-T104 PolarHBondContact O-N 2.89Å; L101-G105 PolarHBondContact O-N 3.47Å |
| 102 | V | 81 | Confident | 79.3 | Confident | 2 Ų | 2 | 46.5 Ų | 46.5 | 1% | 0.012 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -66.2 | -43.8 | 178 | 173.6 | 0 | 0 | 0 | 0 | 111.3 | L21 P35 L38 P85 A98 C99 T104 G105 N106 | L21-V102 HydrophobicContact CD1-CG1 4.03Å; L21-V102 HydrophobicContact CD1-CG2 4.19Å; P35-V102 HydrophobicContact CB-CG2 4.44Å; L38-V102 HydrophobicContact CD1-CG1 3.24Å; P85-V102 HydrophobicContact CB-CB 4.46Å; P85-V102 HydrophobicContact CB-CG1 3.89Å; P85-V102 HydrophobicContact CG-CG1 4.11Å; A98-V102 WeakPolarHBondContact O-CB 3.32Å; A98-V102 WeakPolarHBondContact O-CG2 3.38Å; A98-V102 PolarHBondContact O-N 3.02Å; C99-V102 PolarHBondContact O-N 3.33Å; V102-T104 VanDerWaalsContact C-N 3.33Å; V102-T104 PolarHBondContact O-N 3.41Å; V102-G105 PolarHBondContact O-N 2.83Å; V102-N106 PolarHBondContact O-N 3.18Å |
| 103 | L | 84.1 | Confident | 79.7 | Confident | 56 Ų | 56 | 39.9 Ų | 39.9 | 29% | 0.293 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -59.3 | -44.1 | 174.5 | -105.1 | 134.7 | 0 | 0 | 0 | 111.7 | F82 I86 C99 A100 N106 V107 | F82-L103 HydrophobicContact CD1-CD2 3.7Å; F82-L103 HydrophobicContact CD1-CG 4.31Å; F82-L103 HydrophobicContact CE1-CD2 4.05Å; I86-L103 HydrophobicContact CG1-CD1 4.31Å; C99-L103 WeakPolarHBondContact O-CB 3.16Å; C99-L103 PolarHBondContact O-N 2.85Å; A100-L103 PolarHBondContact O-N 3.11Å; L103-N106 PolarHBondContact O-N 2.93Å; L103-V107 WeakPolarHBondContact O-CG2 3.4Å; L103-V107 PolarHBondContact O-N 3.41Å |
| 104 | T | 86.6 | Confident | 80 | Confident | 71 Ų | 71 | 43.8 Ų | 43.8 | 44% | 0.436 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.2 | -44.7 | 178 | -54.6 | 0 | 0 | 0 | 0 | 110.9 | A100 L101 V102 N106 V107 V108 | A100-T104 WeakPolarHBondContact O-CB 3.1Å; A100-T104 PolarHBondContact O-N 3Å; A100-T104 PolarHBondContact O-OG1 3.46Å; L101-T104 PolarHBondContact O-N 2.89Å; V102-T104 VanDerWaalsContact C-N 3.33Å; V102-T104 PolarHBondContact O-N 3.41Å; T104-N106 VanDerWaalsContact C-N 3.33Å; T104-N106 PolarHBondContact O-N 2.88Å; T104-V107 PolarHBondContact O-N 2.87Å; T104-V108 WeakPolarHBondContact O-CG2 3.15Å; T104-V108 PolarHBondContact O-N 3.37Å |
| 105 | G | 82.9 | Confident | 80.4 | Confident | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.01 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -58 | -44.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | L101 V102 V107 V108 I109 | L101-G105 PolarHBondContact O-N 3.47Å; V102-G105 PolarHBondContact O-N 2.83Å; G105-V107 PolarHBondContact O-N 2.91Å; G105-V108 PolarHBondContact O-N 3.28Å; G105-I109 WeakPolarHBondContact O-CG1 3.4Å; G105-I109 PolarHBondContact O-N 3.36Å |
| 106 | N | 84.8 | Confident | 80.3 | Confident | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.005 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 176.1 | -74.9 | -16 | 0 | 0 | 0 | 112.5 | Y42 A81 F82 V102 L103 T104 V108 I109 F110 | Y42-N106 WeakPolarHBondContact OH-CA 3.31Å; Y42-N106 PolarHBondContact OH-OD1 2.9Å; A81-N106 PolarHBondContact O-ND2 3.36Å; F82-N106 HydrophobicContact CD1-CB 4.25Å; F82-N106 HydrophobicContact CE1-CB 3.65Å; F82-N106 HydrophobicContact CZ-CB 3.87Å; V102-N106 PolarHBondContact O-N 3.18Å; L103-N106 PolarHBondContact O-N 2.93Å; T104-N106 VanDerWaalsContact C-N 3.33Å; T104-N106 PolarHBondContact O-N 2.88Å; N106-V108 VanDerWaalsContact C-N 3.31Å; N106-V108 PolarHBondContact O-N 2.6Å; N106-I109 PolarHBondContact O-N 2.87Å; N106-F110 HydrophobicContact CB-CD2 4.28Å; N106-F110 HydrophobicContact CB-CE2 4.19Å; N106-F110 WeakPolarHBondContact O-CB 3.28Å; N106-F110 WeakPolarHBondContact O-CD2 3.28Å; N106-F110 PolarHBondContact O-N 3.2Å |
| 107 | V | 85.5 | Confident | 80 | Confident | 88 Ų | 88 | 41.2 Ų | 41.2 | 53% | 0.533 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -59 | -44 | 175.6 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | F82 L103 T104 G105 G111 | F82-V107 HydrophobicContact CE1-CG2 3.99Å; F82-V107 HydrophobicContact CZ-CG2 4.12Å; L103-V107 WeakPolarHBondContact O-CG2 3.4Å; L103-V107 PolarHBondContact O-N 3.41Å; T104-V107 PolarHBondContact O-N 2.87Å; G105-V107 PolarHBondContact O-N 2.91Å; V107-G111 PolarHBondContact O-N 3.43Å |
| 108 | V | 85.4 | Confident | 79.7 | Confident | 43 Ų | 43 | 45.6 Ų | 45.6 | 26% | 0.261 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -63.8 | -45.2 | 178.3 | 175.7 | 0 | 0 | 0 | 0 | 110.9 | G13 I16 T104 G105 N106 G111 T112 | G13-V108 WeakPolarHBondContact O-CG1 3.15Å; I16-V108 HydrophobicContact CG2-CG1 4.5Å; T104-V108 WeakPolarHBondContact O-CG2 3.15Å; T104-V108 PolarHBondContact O-N 3.37Å; G105-V108 PolarHBondContact O-N 3.28Å; N106-V108 VanDerWaalsContact C-N 3.31Å; N106-V108 PolarHBondContact O-N 2.6Å; V108-G111 PolarHBondContact O-N 2.91Å; V108-T112 WeakPolarHBondContact O-CG2 3.26Å; V108-T112 PolarHBondContact O-N 2.9Å; V108-T112 PolarHBondContact O-OG1 2.99Å |
| 109 | I | 82.4 | Confident | 79.4 | Confident | 15 Ų | 15 | 47.9 Ų | 47.9 | 8% | 0.077 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -69.8 | -45.1 | -177.7 | -60.3 | 170.5 | 0 | 0 | 0 | 111.4 | L18 Y42 G105 N106 G111 T112 I113 | L18-I109 HydrophobicContact CD2-CD1 4.35Å; Y42-I109 HydrophobicContact CD1-CD1 4.45Å; Y42-I109 HydrophobicContact CD1-CG2 3.9Å; Y42-I109 HydrophobicContact CD2-CD1 4.49Å; Y42-I109 HydrophobicContact CE1-CB 3.7Å; Y42-I109 HydrophobicContact CE1-CD1 3.73Å; Y42-I109 HydrophobicContact CE1-CG1 4.27Å; Y42-I109 HydrophobicContact CE1-CG2 3.21Å; Y42-I109 HydrophobicContact CE2-CD1 3.74Å; Y42-I109 WeakPolarHBondContact OH-CB 3.21Å; Y42-I109 VanDerWaalsContact OH-CD1 3.3Å; Y42-I109 WeakPolarHBondContact OH-CD1 3.5Å; G105-I109 WeakPolarHBondContact O-CG1 3.4Å; G105-I109 PolarHBondContact O-N 3.36Å; N106-I109 PolarHBondContact O-N 2.87Å; I109-G111 VanDerWaalsContact C-N 3.27Å; I109-G111 PolarHBondContact O-N 3.38Å; I109-T112 WeakPolarHBondContact CA-OG1 3.2Å; I109-T112 PolarHBondContact O-N 3.27Å; I109-T112 VanDerWaalsContact O-N 3.1Å; I109-T112 PolarHBondContact O-OG1 3.39Å; I109-I113 HydrophobicContact CG2-CD1 4.06Å; I109-I113 HydrophobicContact CG2-CG1 4.46Å; I109-I113 WeakPolarHBondContact O-CG1 3.21Å; I109-I113 PolarHBondContact O-N 3.19Å |
| 110 | F | 80 | Confident | 78.6 | Confident | 27 Ų | 27 | 50.9 Ų | 50.9 | 12% | 0.118 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.7 | -36 | 174 | -71.7 | -59.1 | 0 | 0 | 0 | 112.1 | V78 A81 F82 N106 T112 I113 L114 | V78-F110 HydrophobicContact CB-CE1 4.05Å; V78-F110 HydrophobicContact CB-CZ 4.07Å; V78-F110 HydrophobicContact CG1-CD1 4.43Å; V78-F110 HydrophobicContact CG1-CD2 4.39Å; V78-F110 HydrophobicContact CG1-CE1 4.23Å; V78-F110 HydrophobicContact CG1-CE2 4.18Å; V78-F110 HydrophobicContact CG1-CZ 4.12Å; V78-F110 HydrophobicContact CG2-CD1 3.78Å; V78-F110 HydrophobicContact CG2-CE1 3.37Å; V78-F110 HydrophobicContact CG2-CZ 3.92Å; A81-F110 HydrophobicContact CB-CE2 3.88Å; A81-F110 HydrophobicContact CB-CZ 3.74Å; F82-F110 HydrophobicContact CD2-CD2 4.4Å; F82-F110 HydrophobicContact CD2-CE2 4.08Å; F82-F110 AromaticContact CE2-CD2 3.38Å; F82-F110 HydrophobicContact CE2-CD2 3.38Å; F82-F110 AromaticContact CE2-CE2 3.47Å; F82-F110 HydrophobicContact CE2-CE2 3.47Å; F82-F110 VanDerWaalsContact CE2-CE2 3.47Å; F82-F110 HydrophobicContact CE2-CG 4.44Å; F82-F110 AromaticContact CZ-CD2 3.62Å; F82-F110 HydrophobicContact CZ-CD2 3.62Å; F82-F110 AromaticContact CZ-CE2 3.99Å; F82-F110 HydrophobicContact CZ-CE2 3.99Å; N106-F110 HydrophobicContact CB-CD2 4.28Å; N106-F110 HydrophobicContact CB-CE2 4.19Å; N106-F110 WeakPolarHBondContact O-CB 3.28Å; N106-F110 WeakPolarHBondContact O-CD2 3.28Å; N106-F110 PolarHBondContact O-N 3.2Å; F110-T112 VanDerWaalsContact C-N 3.35Å; F110-I113 HydrophobicContact CD1-CD1 4.14Å; F110-I113 PolarHBondContact O-N 3.33Å; F110-L114 WeakPolarHBondContact O-CG 3.32Å; F110-L114 PolarHBondContact O-N 2.91Å |
| 111 | G | 82.6 | Confident | 77.3 | Confident | 40 Ų | 40 | 49.7 Ų | 49.7 | 41% | 0.412 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -60.6 | -41.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V107 V108 I109 L114 G115 | V107-G111 PolarHBondContact O-N 3.43Å; V108-G111 PolarHBondContact O-N 2.91Å; I109-G111 VanDerWaalsContact C-N 3.27Å; I109-G111 PolarHBondContact O-N 3.38Å; G111-L114 PolarHBondContact O-N 2.99Å; G111-G115 PolarHBondContact O-N 3.21Å |
| 112 | T | 78.8 | Confident | 75.8 | Confident | 24 Ų | 24 | 51 Ų | 51 | 15% | 0.147 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.3 | -41.6 | 173.5 | 52.9 | 0 | 0 | 0 | 0 | 112.4 | L10 V108 I109 F110 L114 G115 F116 | L10-T112 WeakPolarHBondContact CD2-O 3.41Å; V108-T112 WeakPolarHBondContact O-CG2 3.26Å; V108-T112 PolarHBondContact O-N 2.9Å; V108-T112 PolarHBondContact O-OG1 2.99Å; I109-T112 WeakPolarHBondContact CA-OG1 3.2Å; I109-T112 PolarHBondContact O-N 3.27Å; I109-T112 VanDerWaalsContact O-N 3.1Å; I109-T112 PolarHBondContact O-OG1 3.39Å; F110-T112 VanDerWaalsContact C-N 3.35Å; T112-L114 VanDerWaalsContact C-N 3.35Å; T112-L114 PolarHBondContact O-N 3.26Å; T112-G115 PolarHBondContact O-N 3.48Å; T112-F116 PolarHBondContact O-N 2.95Å |
| 113 | I | 75.7 | Confident | 74 | Confident | 44 Ų | 44 | 55.1 Ų | 55.1 | 23% | 0.226 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.8 | -45.8 | 176.5 | -66 | 165.4 | 0 | 0 | 0 | 110.4 | I109 F110 F116 F117 | I109-I113 HydrophobicContact CG2-CD1 4.06Å; I109-I113 HydrophobicContact CG2-CG1 4.46Å; I109-I113 WeakPolarHBondContact O-CG1 3.21Å; I109-I113 PolarHBondContact O-N 3.19Å; F110-I113 HydrophobicContact CD1-CD1 4.14Å; F110-I113 PolarHBondContact O-N 3.33Å; I113-F116 WeakPolarHBondContact O-CB 3.48Å; I113-F116 PolarHBondContact O-N 2.97Å; I113-F117 HydrophobicContact CG2-CD2 3.9Å; I113-F117 HydrophobicContact CG2-CE2 3.74Å; I113-F117 VanDerWaalsContact O-CD2 3.25Å; I113-F117 WeakPolarHBondContact O-CD2 3Å; I113-F117 PolarHBondContact O-N 3.4Å |
| 114 | L | 75.3 | Confident | 72.2 | Confident | 120 Ų | 120 | 57.4 Ų | 57.4 | 63% | 0.628 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -62.6 | -41.7 | 174.6 | -74.4 | 170.9 | 0 | 0 | 0 | 112.2 | F110 G111 T112 F116 F117 L118 | F110-L114 WeakPolarHBondContact O-CG 3.32Å; F110-L114 PolarHBondContact O-N 2.91Å; G111-L114 PolarHBondContact O-N 2.99Å; T112-L114 VanDerWaalsContact C-N 3.35Å; T112-L114 PolarHBondContact O-N 3.26Å; L114-F116 VanDerWaalsContact C-N 3.27Å; L114-F116 PolarHBondContact O-N 3.07Å; L114-F117 PolarHBondContact O-N 2.84Å; L114-L118 WeakPolarHBondContact O-CB 3.26Å; L114-L118 PolarHBondContact O-N 3.39Å |
| 115 | G | 78.1 | Confident | 70.2 | Confident | 27 Ų | 27 | 61 Ų | 61 | 28% | 0.278 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.8 | -36.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | G111 T112 L118 V119 | G111-G115 PolarHBondContact O-N 3.21Å; T112-G115 PolarHBondContact O-N 3.48Å; G115-L118 PolarHBondContact O-N 3.44Å; G115-V119 WeakPolarHBondContact O-CB 3.4Å; G115-V119 VanDerWaalsContact O-CG2 3.26Å; G115-V119 WeakPolarHBondContact O-CG2 3.09Å; G115-V119 PolarHBondContact O-N 2.95Å |
| 116 | F | 74.1 | Confident | 68.1 | Low | 57 Ų | 57 | 68.6 Ų | 68.6 | 25% | 0.25 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -64.4 | -49.9 | 173.1 | -174.9 | -94.1 | 0 | 0 | 0 | 110.6 | L7 L10 Y49 T112 I113 L114 L118 V119 F120 | L7-F116 HydrophobicContact CD2-CE2 4.38Å; L10-F116 HydrophobicContact CD2-CB 3.62Å; L10-F116 HydrophobicContact CD2-CD2 4.35Å; L10-F116 HydrophobicContact CD2-CG 4.49Å; Y49-F116 AromaticContact CE2-CE1 3.84Å; Y49-F116 HydrophobicContact CE2-CE1 3.84Å; Y49-F116 HydrophobicContact CE2-CZ 4.29Å; T112-F116 PolarHBondContact O-N 2.95Å; I113-F116 WeakPolarHBondContact O-CB 3.48Å; I113-F116 PolarHBondContact O-N 2.97Å; L114-F116 VanDerWaalsContact C-N 3.27Å; L114-F116 PolarHBondContact O-N 3.07Å; F116-L118 VanDerWaalsContact C-N 3.3Å; F116-L118 PolarHBondContact O-N 3.07Å; F116-V119 PolarHBondContact O-N 2.86Å; F116-F120 HydrophobicContact CD1-CD2 4.3Å; F116-F120 AromaticContact CD2-CD2 3.41Å; F116-F120 HydrophobicContact CD2-CD2 3.41Å; F116-F120 VanDerWaalsContact CD2-CD2 3.41Å; F116-F120 AromaticContact CD2-CE2 3.59Å; F116-F120 HydrophobicContact CD2-CE2 3.59Å; F116-F120 HydrophobicContact CD2-CG 4.44Å; F116-F120 HydrophobicContact CE1-CB 4.28Å; F116-F120 HydrophobicContact CE1-CD2 4.17Å; F116-F120 HydrophobicContact CE1-CG 4.34Å; F116-F120 AromaticContact CE2-CD2 3.27Å; F116-F120 HydrophobicContact CE2-CD2 3.27Å; F116-F120 AromaticContact CE2-CE2 3.34Å; F116-F120 HydrophobicContact CE2-CE2 3.34Å; F116-F120 HydrophobicContact CE2-CG 4Å; F116-F120 HydrophobicContact CE2-CZ 4.12Å; F116-F120 AromaticContact CG-CD2 3.95Å; F116-F120 HydrophobicContact CG-CD2 3.95Å; F116-F120 HydrophobicContact CZ-CB 4.36Å; F116-F120 AromaticContact CZ-CD2 3.68Å; F116-F120 HydrophobicContact CZ-CD2 3.68Å; F116-F120 HydrophobicContact CZ-CE2 4.11Å; F116-F120 AromaticContact CZ-CG 3.95Å; F116-F120 HydrophobicContact CZ-CG 3.95Å; F116-F120 WeakPolarHBondContact O-CB 3.25Å; F116-F120 WeakPolarHBondContact O-CD2 3.25Å; F116-F120 PolarHBondContact O-N 3.27Å |
| 117 | F | 68.8 | Low | 65.9 | Low | 103 Ų | 103 | 71.8 Ų | 71.8 | 45% | 0.452 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61.4 | -36.5 | 176.5 | -82.1 | -69.8 | 0 | 0 | 0 | 113 | I113 L114 G121 | I113-F117 HydrophobicContact CG2-CD2 3.9Å; I113-F117 HydrophobicContact CG2-CE2 3.74Å; I113-F117 VanDerWaalsContact O-CD2 3.25Å; I113-F117 WeakPolarHBondContact O-CD2 3Å; I113-F117 PolarHBondContact O-N 3.4Å; L114-F117 PolarHBondContact O-N 2.84Å; F117-G121 WeakPolarHBondContact O-CA 3.28Å; F117-G121 PolarHBondContact O-N 3.46Å |
| 118 | L | 70.6 | Confident | 63.5 | Low | 129 Ų | 129 | 77.2 Ų | 77.2 | 68% | 0.675 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -71.5 | -43.4 | 178.8 | -159.7 | 159.3 | 0 | 0 | 0 | 110.7 | L114 G115 F116 S122 | L114-L118 WeakPolarHBondContact O-CB 3.26Å; L114-L118 PolarHBondContact O-N 3.39Å; G115-L118 PolarHBondContact O-N 3.44Å; F116-L118 VanDerWaalsContact C-N 3.3Å; F116-L118 PolarHBondContact O-N 3.07Å; L118-S122 WeakPolarHBondContact O-CB 3.49Å; L118-S122 PolarHBondContact O-N 3.47Å |
| 119 | V | 68.7 | Low | 61.1 | Low | 48 Ų | 48 | 84.1 Ų | 84.1 | 29% | 0.291 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -69.3 | -45.1 | 178.5 | 169.5 | 0 | 0 | 0 | 0 | 111.8 | A6 G115 F116 N123 | A6-V119 HydrophobicContact CB-CG1 3.86Å; A6-V119 HydrophobicContact CB-CG2 4.14Å; G115-V119 WeakPolarHBondContact O-CB 3.4Å; G115-V119 VanDerWaalsContact O-CG2 3.26Å; G115-V119 WeakPolarHBondContact O-CG2 3.09Å; G115-V119 PolarHBondContact O-N 2.95Å; F116-V119 PolarHBondContact O-N 2.86Å; V119-N123 PolarHBondContact O-ND2 3.43Å |
| 120 | F | 61.8 | Low | 58.7 | Low | 69 Ų | 69 | 90.9 Ų | 90.9 | 30% | 0.303 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -92 | -34.3 | -175.4 | -73.4 | -85 | 0 | 0 | 0 | 113.4 | L7 F116 N123 D124 | L7-F120 HydrophobicContact CD1-CZ 4.13Å; L7-F120 HydrophobicContact CD2-CE2 3.67Å; L7-F120 HydrophobicContact CD2-CZ 3.59Å; L7-F120 HydrophobicContact CG-CE2 4.16Å; L7-F120 HydrophobicContact CG-CZ 3.82Å; F116-F120 HydrophobicContact CD1-CD2 4.3Å; F116-F120 AromaticContact CD2-CD2 3.41Å; F116-F120 HydrophobicContact CD2-CD2 3.41Å; F116-F120 VanDerWaalsContact CD2-CD2 3.41Å; F116-F120 AromaticContact CD2-CE2 3.59Å; F116-F120 HydrophobicContact CD2-CE2 3.59Å; F116-F120 HydrophobicContact CD2-CG 4.44Å; F116-F120 HydrophobicContact CE1-CB 4.28Å; F116-F120 HydrophobicContact CE1-CD2 4.17Å; F116-F120 HydrophobicContact CE1-CG 4.34Å; F116-F120 AromaticContact CE2-CD2 3.27Å; F116-F120 HydrophobicContact CE2-CD2 3.27Å; F116-F120 AromaticContact CE2-CE2 3.34Å; F116-F120 HydrophobicContact CE2-CE2 3.34Å; F116-F120 HydrophobicContact CE2-CG 4Å; F116-F120 HydrophobicContact CE2-CZ 4.12Å; F116-F120 AromaticContact CG-CD2 3.95Å; F116-F120 HydrophobicContact CG-CD2 3.95Å; F116-F120 HydrophobicContact CZ-CB 4.36Å; F116-F120 AromaticContact CZ-CD2 3.68Å; F116-F120 HydrophobicContact CZ-CD2 3.68Å; F116-F120 HydrophobicContact CZ-CE2 4.11Å; F116-F120 AromaticContact CZ-CG 3.95Å; F116-F120 HydrophobicContact CZ-CG 3.95Å; F116-F120 WeakPolarHBondContact O-CB 3.25Å; F116-F120 WeakPolarHBondContact O-CD2 3.25Å; F116-F120 PolarHBondContact O-N 3.27Å; F120-N123 WeakPolarHBondContact O-CA 3.4Å; F120-N123 WeakPolarHBondContact O-CB 3.32Å; F120-N123 PolarHBondContact O-N 2.98Å; F120-D124 PolarHBondContact O-N 3.37Å |
| 121 | G | 54.4 | Low | 56.6 | Low | 28 Ų | 28 | 104.4 Ų | 104.4 | 29% | 0.289 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -70.3 | -30.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | F117 N123 D124 | F117-G121 WeakPolarHBondContact O-CA 3.28Å; F117-G121 PolarHBondContact O-N 3.46Å; G121-N123 PolarHBondContact O-N 3.38Å; G121-D124 PolarHBondContact O-N 3.47Å; G121-D124 VanDerWaalsContact O-N 3.15Å |
| 122 | S | 49.3 | Very low | 55.2 | Low | 77 Ų | 77 | 107.6 Ų | 107.6 | 54% | 0.538 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -68.2 | -14.6 | 168.1 | -173.8 | 0 | 0 | 0 | 0 | 112.9 | L118 | L118-S122 WeakPolarHBondContact O-CB 3.49Å; L118-S122 PolarHBondContact O-N 3.47Å |
| 123 | N | 44.3 | Very low | 54 | Low | 90 Ų | 90 | 112 Ų | 112 | 48% | 0.481 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -91.4 | -12.9 | 172.4 | -78.4 | -94.3 | 0 | 0 | 0 | 112.7 | V119 F120 G121 D125 F126 | V119-N123 PolarHBondContact O-ND2 3.43Å; F120-N123 WeakPolarHBondContact O-CA 3.4Å; F120-N123 WeakPolarHBondContact O-CB 3.32Å; F120-N123 PolarHBondContact O-N 2.98Å; G121-N123 PolarHBondContact O-N 3.38Å; N123-D125 PolarHBondContact O-N 3.49Å; N123-F126 WeakPolarHBondContact O-CA 3.26Å; N123-F126 WeakPolarHBondContact O-CB 3.35Å; N123-F126 PolarHBondContact O-N 2.93Å |
| 124 | D | 45.3 | Very low | 52.8 | Low | 103 Ų | 103 | 115.8 Ų | 115.8 | 55% | 0.551 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -71.7 | -18 | 170.9 | -67.3 | -37 | 0 | 0 | 0 | 111.8 | F120 G121 F126 | F120-D124 PolarHBondContact O-N 3.37Å; G121-D124 PolarHBondContact O-N 3.47Å; G121-D124 VanDerWaalsContact O-N 3.15Å; D124-F126 VanDerWaalsContact C-N 3.29Å |
| 125 | D | 44.5 | Very low | 51.5 | Low | 148 Ų | 148 | 115.5 Ų | 115.5 | 79% | 0.791 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.2 | -13.5 | 163.9 | -71 | -36.4 | 0 | 0 | 0 | 112.7 | N123 | N123-D125 PolarHBondContact O-N 3.49Š|
| 126 | F | 39.8 | Very low | 49.8 | Very low | 160 Ų | 160 | 121.1 Ų | 121.1 | 70% | 0.702 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -94.5 | -3.4 | -179.1 | -153.1 | -95.3 | 0 | 0 | 0 | 113.1 | N123 D124 | N123-F126 WeakPolarHBondContact O-CA 3.26Å; N123-F126 WeakPolarHBondContact O-CB 3.35Å; N123-F126 PolarHBondContact O-N 2.93Å; D124-F126 VanDerWaalsContact C-N 3.29Å |
| 127 | S | 38.2 | Very low | 48.2 | Very low | 68 Ų | 68 | 125.3 Ų | 125.3 | 48% | 0.476 | 61% | 0.607 | S | S | . | * | S | Bend | trans | -127.4 | 30.3 | -173.2 | 66.2 | 0 | 0 | 0 | 0 | 115.5 | ||
| 128 | W | 35.1 | Very low | 46.7 | Very low | 202 Ų | 202 | 126.9 Ų | 126.9 | 77% | 0.765 | 62% | 0.618 | S | S | * | * | S | Bend | trans | -121.3 | 12.5 | 165.1 | -69.1 | 111 | 0 | 0 | 0 | 114.4 | ||
| 129 | Q | 34.8 | Very low | 44.9 | Very low | 188 Ų | 188 | 126.8 Ų | 126.8 | 88% | 0.879 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -121.8 | 5.4 | 170.3 | -75.7 | -165.6 | -10 | 0 | 0 | 114.9 | ||
| 130 | Q | 32.9 | Very low | 42.9 | Very low | 156 Ų | 156 | 133.3 Ų | 133.3 | 73% | 0.729 | 64% | 0.64 | S | S | * | * | trans | -135.1 | 69.4 | 169.8 | -63.7 | -155.4 | -79.7 | 0 | 0 | 109.9 | ||||
| 131 | W | 34.4 | Very low | 41.2 | Very low | 311 Ų | 311 | 139.2 Ų | 139.2 | 100% | 1.178 | 67% | 0.671 | S | S | * | * | -174.4 | 0 | 110.9 | -84.3 | 20.7 | 0 | 0 | 0 | 106.3 |
Retrieved 131 of 131 residues in 461.3 ms
(Link to these results)