| 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 | 47 | Very low | 70.6 | Confident | 205 Ų | 205 | 87.7 Ų | 87.7 | 100% | 1.01 | 51% | 0.508 | S | S | * | . | 0 | -24.1 | 0 | -123.8 | 173.8 | -110.7 | 0 | 0 | 114.2 | |||||
| 2 | A | 54.8 | Low | 71.8 | Confident | 83 Ų | 83 | 92 Ų | 92 | 69% | 0.686 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.6 | -38.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | I4 K5 A6 | A2-I4 VanDerWaalsContact C-N 3.34Å; A2-I4 PolarHBondContact O-N 2.72Å; A2-K5 PolarHBondContact O-N 3.02Å; A2-A6 PolarHBondContact O-N 3.01Å |
| 3 | G | 62.8 | Low | 72.7 | Confident | 34 Ų | 34 | 85.9 Ų | 85.9 | 35% | 0.351 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.9 | -34.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | A6 L7 | G3-A6 PolarHBondContact O-N 3.16Å; G3-L7 WeakPolarHBondContact O-CB 3.45Å; G3-L7 VanDerWaalsContact O-CG 3.26Å; G3-L7 WeakPolarHBondContact O-CG 3.36Å; G3-L7 PolarHBondContact O-N 3.44Å |
| 4 | I | 71.8 | Confident | 73.2 | Confident | 106 Ų | 106 | 81.1 Ų | 81.1 | 54% | 0.544 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -66.8 | -42.5 | -179.9 | -66.1 | 161.2 | 0 | 0 | 0 | 111 | A2 A6 L7 I8 | A2-I4 VanDerWaalsContact C-N 3.34Å; A2-I4 PolarHBondContact O-N 2.72Å; I4-A6 VanDerWaalsContact C-N 3.34Å; I4-A6 PolarHBondContact O-N 3.33Å; I4-L7 PolarHBondContact O-N 3.24Å; I4-I8 HydrophobicContact CG2-CD1 3.81Å; I4-I8 WeakPolarHBondContact O-CD1 3.38Å; I4-I8 WeakPolarHBondContact O-CG1 3.26Å; I4-I8 PolarHBondContact O-N 3.05Å |
| 5 | K | 68.8 | Low | 73.9 | Confident | 162 Ų | 162 | 79.5 Ų | 79.5 | 70% | 0.704 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -64.8 | -40.2 | 177.6 | -71.4 | 174.9 | 178.6 | -85.7 | 0 | 111.3 | A2 I8 S9 | A2-K5 PolarHBondContact O-N 3.02Å; K5-I8 PolarHBondContact O-N 3.41Å; K5-S9 PolarHBondContact O-N 3.31Å; K5-S9 VanDerWaalsContact O-N 3.08Å |
| 6 | A | 71.9 | Confident | 74.5 | Confident | 19 Ų | 19 | 79.5 Ų | 79.5 | 16% | 0.157 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -64.3 | -46.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A2 G3 I4 I8 S9 L10 V119 | A2-A6 PolarHBondContact O-N 3.01Å; G3-A6 PolarHBondContact O-N 3.16Å; I4-A6 VanDerWaalsContact C-N 3.34Å; I4-A6 PolarHBondContact O-N 3.33Å; A6-I8 VanDerWaalsContact C-N 3.33Å; A6-I8 PolarHBondContact O-N 3.49Å; A6-S9 PolarHBondContact O-N 2.86Å; A6-S9 VanDerWaalsContact O-N 3.16Å; A6-S9 PolarHBondContact O-OG 3.04Å; A6-L10 WeakPolarHBondContact O-CD1 3.39Å; A6-L10 PolarHBondContact O-N 2.85Å; A6-V119 HydrophobicContact CB-CG1 3.89Å; A6-V119 HydrophobicContact CB-CG2 4.05Å |
| 7 | L | 76.4 | Confident | 74.9 | Confident | 77 Ų | 77 | 74.8 Ų | 74.8 | 40% | 0.403 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -58 | -42.9 | 176.1 | -76.1 | 170.1 | 0 | 0 | 0 | 112.6 | G3 I4 L10 S11 F120 | G3-L7 WeakPolarHBondContact O-CB 3.45Å; G3-L7 VanDerWaalsContact O-CG 3.26Å; G3-L7 WeakPolarHBondContact O-CG 3.36Å; G3-L7 PolarHBondContact O-N 3.44Å; I4-L7 PolarHBondContact O-N 3.24Å; L7-L10 PolarHBondContact O-N 3.38Å; L7-S11 PolarHBondContact O-N 3.4Å; L7-F120 HydrophobicContact CD1-CZ 4.29Å; L7-F120 HydrophobicContact CD2-CE2 3.74Å; L7-F120 HydrophobicContact CD2-CZ 3.67Å; L7-F120 HydrophobicContact CG-CE2 4.33Å; L7-F120 HydrophobicContact CG-CZ 4Å |
| 8 | I | 82.4 | Confident | 74.9 | Confident | 90 Ų | 90 | 75.2 Ų | 75.2 | 46% | 0.462 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.8 | -47.8 | 176.1 | -66.8 | 161.8 | 0 | 0 | 0 | 110 | I4 K5 A6 L10 S11 F12 | I4-I8 HydrophobicContact CG2-CD1 3.81Å; I4-I8 WeakPolarHBondContact O-CD1 3.38Å; I4-I8 WeakPolarHBondContact O-CG1 3.26Å; I4-I8 PolarHBondContact O-N 3.05Å; K5-I8 PolarHBondContact O-N 3.41Å; A6-I8 VanDerWaalsContact C-N 3.33Å; A6-I8 PolarHBondContact O-N 3.49Å; I8-L10 VanDerWaalsContact C-N 3.29Å; I8-L10 PolarHBondContact O-N 2.94Å; I8-S11 PolarHBondContact O-N 3.42Å; I8-F12 HydrophobicContact CG2-CD2 3.92Å; I8-F12 HydrophobicContact CG2-CE2 3.97Å; I8-F12 WeakPolarHBondContact O-CD2 3.32Å; I8-F12 PolarHBondContact O-N 3.49Å; I8-F12 VanDerWaalsContact O-N 3.07Å |
| 9 | S | 78.7 | Confident | 75.2 | Confident | 74 Ų | 74 | 77.7 Ų | 77.7 | 52% | 0.517 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.6 | -37 | 179 | 71.1 | 0 | 0 | 0 | 0 | 112.9 | K5 A6 F12 G13 | K5-S9 PolarHBondContact O-N 3.31Å; K5-S9 VanDerWaalsContact O-N 3.08Å; A6-S9 PolarHBondContact O-N 2.86Å; A6-S9 VanDerWaalsContact O-N 3.16Å; A6-S9 PolarHBondContact O-OG 3.04Å; S9-F12 PolarHBondContact O-N 3.31Å; S9-G13 PolarHBondContact O-N 3.45Å |
| 10 | L | 78.8 | Confident | 75.1 | Confident | 26 Ų | 26 | 77.5 Ų | 77.5 | 14% | 0.136 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -66 | -45.8 | 175.7 | -103.6 | 99 | 0 | 0 | 0 | 112.4 | A6 L7 I8 F12 G13 G14 T112 F116 | A6-L10 WeakPolarHBondContact O-CD1 3.39Å; A6-L10 PolarHBondContact O-N 2.85Å; L7-L10 PolarHBondContact O-N 3.38Å; I8-L10 VanDerWaalsContact C-N 3.29Å; I8-L10 PolarHBondContact O-N 2.94Å; L10-F12 VanDerWaalsContact C-N 3.28Å; L10-F12 PolarHBondContact O-N 3.41Å; L10-G13 PolarHBondContact O-N 3.14Å; L10-G13 VanDerWaalsContact O-N 3.15Å; L10-G14 PolarHBondContact O-N 3.05Å; L10-T112 HydrophobicContact CB-CG2 4.02Å; L10-T112 HydrophobicContact CD2-CG2 3.82Å; L10-T112 VanDerWaalsContact CD2-O 3.26Å; L10-T112 WeakPolarHBondContact CD2-O 3.47Å; L10-T112 HydrophobicContact CG-CG2 3.71Å; L10-T112 VanDerWaalsContact O-CG2 3.22Å; L10-T112 WeakPolarHBondContact O-CG2 3.49Å; L10-F116 HydrophobicContact CD2-CB 3.52Å; L10-F116 HydrophobicContact CD2-CD2 3.86Å; L10-F116 HydrophobicContact CD2-CG 4.18Å |
| 11 | S | 83.3 | Confident | 75 | Confident | 89 Ų | 89 | 74.2 Ų | 74.2 | 62% | 0.622 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -60.7 | -38.9 | 176.7 | -79.9 | 0 | 0 | 0 | 0 | 112 | L7 I8 G14 A15 | L7-S11 PolarHBondContact O-N 3.4Å; I8-S11 PolarHBondContact O-N 3.42Å; S11-G14 PolarHBondContact O-N 3.44Å; S11-A15 WeakPolarHBondContact O-CB 3.29Å; S11-A15 PolarHBondContact O-N 2.93Å |
| 12 | F | 84.8 | Confident | 76.2 | Confident | 139 Ų | 139 | 69.7 Ų | 69.7 | 61% | 0.61 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -63.4 | -43.1 | 173.5 | -91.8 | -82.7 | 0 | 0 | 0 | 112 | I8 S9 L10 A15 I16 | I8-F12 HydrophobicContact CG2-CD2 3.92Å; I8-F12 HydrophobicContact CG2-CE2 3.97Å; I8-F12 WeakPolarHBondContact O-CD2 3.32Å; I8-F12 PolarHBondContact O-N 3.49Å; I8-F12 VanDerWaalsContact O-N 3.07Å; S9-F12 PolarHBondContact O-N 3.31Å; L10-F12 VanDerWaalsContact C-N 3.28Å; L10-F12 PolarHBondContact O-N 3.41Å; F12-A15 PolarHBondContact O-N 3.44Å; F12-I16 WeakPolarHBondContact O-CD1 3.16Å; F12-I16 VanDerWaalsContact O-CG1 3.24Å; F12-I16 WeakPolarHBondContact O-CG1 3.45Å; F12-I16 PolarHBondContact O-N 3.35Å |
| 13 | G | 83.6 | Confident | 76.8 | Confident | 13 Ų | 13 | 69.8 Ų | 69.8 | 13% | 0.134 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -59.2 | -45.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S9 L10 I16 G17 V108 | S9-G13 PolarHBondContact O-N 3.45Å; L10-G13 PolarHBondContact O-N 3.14Å; L10-G13 VanDerWaalsContact O-N 3.15Å; G13-I16 PolarHBondContact O-N 3.01Å; G13-G17 PolarHBondContact O-N 3.15Å; G13-V108 WeakPolarHBondContact O-CG1 3.38Å |
| 14 | G | 80.3 | Confident | 77 | Confident | 19 Ų | 19 | 68.2 Ų | 68.2 | 20% | 0.196 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.4 | -44 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L10 S11 I16 G17 L18 | L10-G14 PolarHBondContact O-N 3.05Å; S11-G14 PolarHBondContact O-N 3.44Å; G14-I16 PolarHBondContact O-N 3.25Å; G14-G17 PolarHBondContact O-N 3.04Å; G14-L18 WeakPolarHBondContact O-CG 3.47Å; G14-L18 PolarHBondContact O-N 3.32Å |
| 15 | A | 83.1 | Confident | 76.6 | Confident | 57 Ų | 57 | 64.7 Ų | 64.7 | 47% | 0.471 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63 | -41.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | S11 F12 L18 M19 | S11-A15 WeakPolarHBondContact O-CB 3.29Å; S11-A15 PolarHBondContact O-N 2.93Å; F12-A15 PolarHBondContact O-N 3.44Å; A15-L18 PolarHBondContact O-N 3.03Å; A15-M19 WeakPolarHBondContact O-CB 3.39Å; A15-M19 PolarHBondContact O-N 3.29Å |
| 16 | I | 84.2 | Confident | 76.1 | Confident | 79 Ų | 79 | 60.6 Ų | 60.6 | 41% | 0.405 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 176.1 | -70.8 | 164.8 | 0 | 0 | 0 | 110.7 | F12 G13 G14 L18 M19 F20 V108 | F12-I16 WeakPolarHBondContact O-CD1 3.16Å; F12-I16 VanDerWaalsContact O-CG1 3.24Å; F12-I16 WeakPolarHBondContact O-CG1 3.45Å; F12-I16 PolarHBondContact O-N 3.35Å; G13-I16 PolarHBondContact O-N 3.01Å; G14-I16 PolarHBondContact O-N 3.25Å; I16-L18 PolarHBondContact O-N 2.93Å; I16-M19 WeakPolarHBondContact O-CB 3.28Å; I16-M19 PolarHBondContact O-N 3.47Å; I16-F20 HydrophobicContact CG2-CD2 3.68Å; I16-F20 HydrophobicContact CG2-CE2 3.32Å; I16-F20 HydrophobicContact CG2-CZ 4.36Å; I16-F20 WeakPolarHBondContact O-CD2 3.18Å; I16-F20 PolarHBondContact O-N 3Å; I16-V108 HydrophobicContact CG2-CG1 4.48Å |
| 17 | G | 80.3 | Confident | 75.4 | Confident | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | G13 G14 M19 F20 L21 | G13-G17 PolarHBondContact O-N 3.15Å; G14-G17 PolarHBondContact O-N 3.04Å; G17-M19 VanDerWaalsContact C-N 3.34Å; G17-F20 PolarHBondContact O-N 3Å; G17-L21 PolarHBondContact O-N 3.1Å; G17-L21 VanDerWaalsContact O-N 3.1Å |
| 18 | L | 74.6 | Confident | 74.1 | Confident | 82 Ų | 82 | 66 Ų | 66 | 43% | 0.429 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -66.7 | -35 | 175.7 | -69.9 | 174.6 | 0 | 0 | 0 | 112.4 | G14 A15 I16 L21 M22 | G14-L18 WeakPolarHBondContact O-CG 3.47Å; G14-L18 PolarHBondContact O-N 3.32Å; A15-L18 PolarHBondContact O-N 3.03Å; I16-L18 PolarHBondContact O-N 2.93Å; L18-L21 WeakPolarHBondContact O-CB 3.38Å; L18-L21 PolarHBondContact O-N 3.08Å; L18-M22 PolarHBondContact O-N 3.4Å |
| 19 | M | 80.6 | Confident | 72.7 | Confident | 122 Ų | 122 | 67.2 Ų | 67.2 | 60% | 0.601 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -63.7 | -46.6 | 175.2 | -165 | -159.3 | 177.6 | 0 | 0 | 110.7 | A15 I16 G17 L21 M22 L23 | A15-M19 WeakPolarHBondContact O-CB 3.39Å; A15-M19 PolarHBondContact O-N 3.29Å; I16-M19 WeakPolarHBondContact O-CB 3.28Å; I16-M19 PolarHBondContact O-N 3.47Å; G17-M19 VanDerWaalsContact C-N 3.34Å; M19-L21 VanDerWaalsContact C-N 3.29Å; M19-L21 PolarHBondContact O-N 3.43Å; M19-M22 PolarHBondContact O-N 3.49Å; M19-M22 VanDerWaalsContact O-N 3.16Å; M19-L23 HydrophobicContact CE-CD1 3.89Å; M19-L23 HydrophobicContact CG-CD1 3.7Å; M19-L23 WeakPolarHBondContact O-CD1 3.07Å; M19-L23 PolarHBondContact O-N 3.25Å; M19-L23 HydrophobicContact SD-CD1 4.38Å |
| 20 | F | 74.4 | Confident | 71.5 | Confident | 73 Ų | 73 | 65.4 Ų | 65.4 | 32% | 0.32 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.9 | -37.7 | 175.7 | -75.9 | -58.4 | 0 | 0 | 0 | 112.5 | I16 G17 L23 G24 L101 | I16-F20 HydrophobicContact CG2-CD2 3.68Å; I16-F20 HydrophobicContact CG2-CE2 3.32Å; I16-F20 HydrophobicContact CG2-CZ 4.36Å; I16-F20 WeakPolarHBondContact O-CD2 3.18Å; I16-F20 PolarHBondContact O-N 3Å; G17-F20 PolarHBondContact O-N 3Å; F20-L23 PolarHBondContact O-N 3.38Å; F20-G24 PolarHBondContact O-N 3.35Å; F20-G24 VanDerWaalsContact O-N 3.08Å; F20-L101 HydrophobicContact CB-CD2 4.11Å; F20-L101 HydrophobicContact CD1-CD2 3.63Å; F20-L101 HydrophobicContact CD1-CG 4.49Å; F20-L101 HydrophobicContact CG-CD2 4.35Å; F20-L101 VanDerWaalsContact O-CD2 3.26Å; F20-L101 WeakPolarHBondContact O-CD2 3.15Å |
| 21 | L | 71.9 | Confident | 70 | Confident | 10 Ų | 10 | 69.8 Ų | 69.8 | 5% | 0.052 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -61.9 | -45.8 | 173.8 | -165.2 | 79.4 | 0 | 0 | 0 | 111.4 | G17 L18 M19 G24 C25 L38 L39 V102 | G17-L21 PolarHBondContact O-N 3.1Å; G17-L21 VanDerWaalsContact O-N 3.1Å; L18-L21 WeakPolarHBondContact O-CB 3.38Å; L18-L21 PolarHBondContact O-N 3.08Å; M19-L21 VanDerWaalsContact C-N 3.29Å; M19-L21 PolarHBondContact O-N 3.43Å; L21-G24 PolarHBondContact O-N 3.12Å; L21-C25 PolarHBondContact O-N 3.37Å; L21-L38 HydrophobicContact CD1-CB 4.4Å; L21-L38 HydrophobicContact CD1-CD1 4.18Å; L21-L39 HydrophobicContact CD2-CD1 4.48Å; L21-V102 HydrophobicContact CD1-CG1 4.06Å; L21-V102 HydrophobicContact CD1-CG2 4.18Å |
| 22 | M | 71.9 | Confident | 68.6 | Low | 110 Ų | 110 | 70.8 Ų | 70.8 | 54% | 0.542 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65 | -40.1 | 177.2 | -86.3 | -68.9 | 165.4 | 0 | 0 | 112.6 | L18 M19 G24 C25 A26 | L18-M22 PolarHBondContact O-N 3.4Å; M19-M22 PolarHBondContact O-N 3.49Å; M19-M22 VanDerWaalsContact O-N 3.16Å; M22-G24 VanDerWaalsContact C-N 3.25Å; M22-G24 PolarHBondContact O-N 3.33Å; M22-C25 PolarHBondContact O-N 3.23Å; M22-C25 VanDerWaalsContact O-N 3.12Å; M22-A26 WeakPolarHBondContact O-CB 3.24Å; M22-A26 PolarHBondContact O-N 2.87Å |
| 23 | L | 67.9 | Low | 67.2 | Low | 84 Ų | 84 | 72.2 Ų | 72.2 | 44% | 0.44 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.2 | -32.2 | 174.4 | -90.7 | 85.2 | 0 | 0 | 0 | 112.4 | M19 F20 C25 L101 | M19-L23 HydrophobicContact CE-CD1 3.89Å; M19-L23 HydrophobicContact CG-CD1 3.7Å; M19-L23 WeakPolarHBondContact O-CD1 3.07Å; M19-L23 PolarHBondContact O-N 3.25Å; M19-L23 HydrophobicContact SD-CD1 4.38Å; F20-L23 PolarHBondContact O-N 3.38Å; L23-C25 VanDerWaalsContact C-N 3.3Å; L23-C25 PolarHBondContact O-N 3.16Å; L23-L101 HydrophobicContact CB-CD2 3.72Å |
| 24 | G | 66.8 | Low | 65.8 | Low | 2 Ų | 2 | 78.4 Ų | 78.4 | 2% | 0.021 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -65.2 | -30.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | F20 L21 M22 | F20-G24 PolarHBondContact O-N 3.35Å; F20-G24 VanDerWaalsContact O-N 3.08Å; L21-G24 PolarHBondContact O-N 3.12Å; M22-G24 VanDerWaalsContact C-N 3.25Å; M22-G24 PolarHBondContact O-N 3.33Å |
| 25 | C | 62.9 | Low | 64.6 | Low | 31 Ų | 31 | 77.8 Ų | 77.8 | 21% | 0.209 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -93 | -30.1 | 178 | -73.8 | 0 | 0 | 0 | 0 | 114.4 | L21 M22 L23 P35 | L21-C25 PolarHBondContact O-N 3.37Å; M22-C25 PolarHBondContact O-N 3.23Å; M22-C25 VanDerWaalsContact O-N 3.12Å; L23-C25 VanDerWaalsContact C-N 3.3Å; L23-C25 PolarHBondContact O-N 3.16Å; C25-P35 VanDerWaalsContact SG-CB 3.53Å; C25-P35 WeakPolarHBondContact SG-CG 3.38Å |
| 26 | A | 59.3 | Low | 63.5 | Low | 76 Ų | 76 | 79.1 Ų | 79.1 | 63% | 0.628 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -93.1 | -7.8 | -167.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | M22 | M22-A26 WeakPolarHBondContact O-CB 3.24Å; M22-A26 PolarHBondContact O-N 2.87Å |
| 27 | L | 57 | Low | 62.3 | Low | 94 Ų | 94 | 80.5 Ų | 80.5 | 49% | 0.492 | 41% | 0.409 | S | S | . | . | S | Bend | trans | -70.1 | 127.4 | 175.5 | -150.4 | 70.9 | 0 | 0 | 0 | 108.8 | V29 Y30 | L27-V29 PolarHBondContact O-N 2.83Å; L27-Y30 HydrophobicContact CB-CD2 3.82Å; L27-Y30 HydrophobicContact CB-CE2 4.45Å; L27-Y30 HydrophobicContact CD2-CD2 4.1Å; L27-Y30 HydrophobicContact CD2-CE2 3.9Å; L27-Y30 PolarHBondContact O-N 2.96Å |
| 28 | P | 49 | Very low | 61.4 | Low | 116 Ų | 116 | 80.7 Ų | 80.7 | 75% | 0.753 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.1 | -1.6 | -173.8 | 24.3 | -35 | 0 | 0 | 0 | 115 | ||
| 29 | V | 53.3 | Low | 60.9 | Low | 116 Ų | 116 | 79.7 Ų | 79.7 | 70% | 0.703 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.8 | -19.2 | 172.6 | -175 | 0 | 0 | 0 | 0 | 111.5 | L27 | L27-V29 PolarHBondContact O-N 2.83Š|
| 30 | Y | 53.3 | Low | 60 | Low | 36 Ų | 36 | 79.2 Ų | 79.2 | 14% | 0.141 | 40% | 0.4 | C | S | . | . | trans | -113 | 47.5 | -172.5 | -66.3 | -60.3 | 0 | 0 | 0 | 112.6 | L27 K32 A95 A98 | L27-Y30 HydrophobicContact CB-CD2 3.82Å; L27-Y30 HydrophobicContact CB-CE2 4.45Å; L27-Y30 HydrophobicContact CD2-CD2 4.1Å; L27-Y30 HydrophobicContact CD2-CE2 3.9Å; L27-Y30 PolarHBondContact O-N 2.96Å; Y30-K32 PolarHBondContact O-N 2.61Å; Y30-A95 HydrophobicContact CD1-CB 4.45Å; Y30-A95 HydrophobicContact CE1-CB 3.34Å; Y30-A95 VanDerWaalsContact CE1-N 3.27Å; Y30-A98 HydrophobicContact CD1-CB 3.99Å; Y30-A98 HydrophobicContact CD2-CB 3.78Å; Y30-A98 HydrophobicContact CE1-CB 3.81Å; Y30-A98 HydrophobicContact CE2-CB 3.63Å; Y30-A98 HydrophobicContact CG-CB 3.99Å; Y30-A98 PolarHBondContact OH-N 3.27Å | ||
| 31 | D | 47 | Very low | 59.3 | Low | 118 Ų | 118 | 77.5 Ų | 77.5 | 63% | 0.631 | 39% | 0.392 | S | S | * | . | trans | -62.4 | 59.2 | -179.4 | -143.5 | -65.4 | 0 | 0 | 0 | 113.2 | ||||
| 32 | K | 54.6 | Low | 58.6 | Low | 109 Ų | 109 | 79.4 Ų | 79.4 | 47% | 0.474 | 40% | 0.399 | S | S | . | . | trans | -150.2 | 93.5 | -163.9 | -65.4 | -69.5 | -177.5 | 173.9 | 0 | 106.9 | Y30 W34 P35 V93 | Y30-K32 PolarHBondContact O-N 2.61Å; K32-W34 PolarHBondContact O-N 3.44Å; K32-P35 WeakPolarHBondContact O-CD 3.23Å; K32-V93 HydrophobicContact CD-CG1 4.46Å; K32-V93 VanDerWaalsContact CG-O 3.29Å; K32-V93 WeakPolarHBondContact CG-O 3.23Å | ||
| 33 | Y | 54.8 | Low | 58 | Low | 169 Ų | 169 | 79.3 Ų | 79.3 | 66% | 0.663 | 40% | 0.4 | S | S | * | . | trans | -71.6 | 9.5 | 178.2 | -51.7 | -84.7 | 0 | 0 | 0 | 114.1 | L36 | Y33-L36 VanDerWaalsContact O-CB 3.25Å; Y33-L36 WeakPolarHBondContact O-CB 3.23Å; Y33-L36 PolarHBondContact O-N 2.98Å | ||
| 34 | W | 54.1 | Low | 57.4 | Low | 144 Ų | 144 | 77.6 Ų | 77.6 | 55% | 0.545 | 39% | 0.391 | S | S | . | . | G | 310 helix | trans | -61.6 | -32.7 | 178.6 | -104.7 | 85.7 | 0 | 0 | 0 | 116 | K32 L36 F37 F88 V93 | K32-W34 PolarHBondContact O-N 3.44Å; W34-L36 PolarHBondContact O-N 3.34Å; W34-L36 VanDerWaalsContact O-N 3.12Å; W34-F37 PolarHBondContact O-N 2.9Å; W34-F88 HydrophobicContact CD2-CD1 4.39Å; W34-F88 AromaticContact CD2-CE1 3.85Å; W34-F88 HydrophobicContact CD2-CE1 3.85Å; W34-F88 HydrophobicContact CD2-CE2 4.44Å; W34-F88 AromaticContact CD2-CZ 3.93Å; W34-F88 HydrophobicContact CD2-CZ 3.93Å; W34-F88 HydrophobicContact CE3-CD1 4Å; W34-F88 HydrophobicContact CE3-CD2 4.35Å; W34-F88 AromaticContact CE3-CE1 3.11Å; W34-F88 HydrophobicContact CE3-CE1 3.11Å; W34-F88 AromaticContact CE3-CE2 3.5Å; W34-F88 HydrophobicContact CE3-CE2 3.5Å; W34-F88 AromaticContact CE3-CZ 2.85Å; W34-F88 HydrophobicContact CE3-CZ 2.85Å; W34-F88 AromaticContact CH2-CE1 3.64Å; W34-F88 HydrophobicContact CH2-CE1 3.64Å; W34-F88 AromaticContact CH2-CZ 3.98Å; W34-F88 HydrophobicContact CH2-CZ 3.98Å; W34-F88 HydrophobicContact CZ2-CE1 4.35Å; W34-F88 HydrophobicContact CZ3-CD1 4.22Å; W34-F88 AromaticContact CZ3-CE1 3.03Å; W34-F88 HydrophobicContact CZ3-CE1 3.03Å; W34-F88 AromaticContact CZ3-CE2 4Å; W34-F88 HydrophobicContact CZ3-CE2 4Å; W34-F88 AromaticContact CZ3-CZ 2.92Å; W34-F88 HydrophobicContact CZ3-CZ 2.92Å; W34-V93 HydrophobicContact CB-CG1 4.13Å; W34-V93 HydrophobicContact CG-CG1 4.08Å |
| 35 | P | 56.7 | Low | 57 | Low | 5 Ų | 5 | 79 Ų | 79 | 3% | 0.032 | 40% | 0.402 | C | S | . | . | G | 310 helix | trans | -65.6 | -15 | 177.7 | -8.8 | 19.7 | 0 | 0 | 0 | 113 | C25 K32 F37 L38 I94 | C25-P35 VanDerWaalsContact SG-CB 3.53Å; C25-P35 WeakPolarHBondContact SG-CG 3.38Å; K32-P35 WeakPolarHBondContact O-CD 3.23Å; P35-F37 PolarHBondContact O-N 3.03Å; P35-F37 VanDerWaalsContact O-N 3.14Å; P35-L38 VanDerWaalsContact O-CB 3.31Å; P35-L38 WeakPolarHBondContact O-CB 3.39Å; P35-L38 PolarHBondContact O-N 3.35Å; P35-I94 HydrophobicContact CB-CD1 4.43Å; P35-I94 HydrophobicContact CG-CD1 3.73Å; P35-I94 HydrophobicContact CG-CG1 4.45Å |
| 36 | L | 58.4 | Low | 56.6 | Low | 86 Ų | 86 | 80.6 Ų | 80.6 | 45% | 0.45 | 41% | 0.412 | S | S | . | . | G | 310 helix | trans | -63 | -17.2 | 176.1 | -122.1 | 160.2 | 0 | 0 | 0 | 112.6 | Y33 W34 L38 L39 | Y33-L36 VanDerWaalsContact O-CB 3.25Å; Y33-L36 WeakPolarHBondContact O-CB 3.23Å; Y33-L36 PolarHBondContact O-N 2.98Å; W34-L36 PolarHBondContact O-N 3.34Å; W34-L36 VanDerWaalsContact O-N 3.12Å; L36-L38 PolarHBondContact O-N 3.39Å; L36-L39 HydrophobicContact CD2-CB 4Å; L36-L39 HydrophobicContact CD2-CD2 3.92Å; L36-L39 HydrophobicContact CD2-CG 4.47Å; L36-L39 WeakPolarHBondContact O-CB 3.37Å; L36-L39 PolarHBondContact O-N 3.27Å |
| 37 | F | 60.4 | Low | 56.4 | Low | 107 Ų | 107 | 80.4 Ų | 80.4 | 47% | 0.469 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.3 | -26 | 170.8 | -156 | -94.7 | 0 | 0 | 0 | 112.7 | W34 P35 L39 F40 F41 L84 | W34-F37 PolarHBondContact O-N 2.9Å; P35-F37 PolarHBondContact O-N 3.03Å; P35-F37 VanDerWaalsContact O-N 3.14Å; F37-L39 PolarHBondContact O-N 3.24Å; F37-F40 VanDerWaalsContact O-CB 3.29Å; F37-F40 WeakPolarHBondContact O-CB 3.3Å; F37-F40 PolarHBondContact O-N 3.24Å; F37-F40 VanDerWaalsContact O-N 3.14Å; F37-F41 HydrophobicContact CD1-CD2 4.08Å; F37-F41 AromaticContact CD1-CE2 3.71Å; F37-F41 HydrophobicContact CD1-CE2 3.71Å; F37-F41 HydrophobicContact CE1-CD2 4.27Å; F37-F41 AromaticContact CE1-CE2 3.57Å; F37-F41 HydrophobicContact CE1-CE2 3.57Å; F37-F41 HydrophobicContact CE1-CZ 4.35Å; F37-F41 PolarHBondContact O-N 2.94Å; F37-L84 HydrophobicContact CD1-CD1 4.12Å |
| 38 | L | 61 | Low | 56 | Low | 5 Ų | 5 | 77 Ų | 77 | 3% | 0.026 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -65.9 | -29.1 | 171.7 | -78.1 | 151.3 | 0 | 0 | 0 | 112.1 | L21 P35 L36 F40 F41 Y42 A81 V102 | L21-L38 HydrophobicContact CD1-CB 4.4Å; L21-L38 HydrophobicContact CD1-CD1 4.18Å; P35-L38 VanDerWaalsContact O-CB 3.31Å; P35-L38 WeakPolarHBondContact O-CB 3.39Å; P35-L38 PolarHBondContact O-N 3.35Å; L36-L38 PolarHBondContact O-N 3.39Å; L38-F40 PolarHBondContact O-N 2.97Å; L38-F41 PolarHBondContact O-N 3.49Å; L38-Y42 WeakPolarHBondContact O-CD2 3.04Å; L38-Y42 PolarHBondContact O-N 3.04Å; L38-A81 HydrophobicContact CD2-CB 4.02Å; L38-A81 WeakPolarHBondContact CD2-O 3.5Å; L38-V102 HydrophobicContact CD1-CG1 3.51Å |
| 39 | L | 63 | Low | 56.3 | Low | 60 Ų | 60 | 77 Ų | 77 | 31% | 0.314 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.9 | -33.8 | 173.7 | -155.7 | 95.9 | 0 | 0 | 0 | 111 | L21 L36 F37 Y42 I43 | L21-L39 HydrophobicContact CD2-CD1 4.48Å; L36-L39 HydrophobicContact CD2-CB 4Å; L36-L39 HydrophobicContact CD2-CD2 3.92Å; L36-L39 HydrophobicContact CD2-CG 4.47Å; L36-L39 WeakPolarHBondContact O-CB 3.37Å; L36-L39 PolarHBondContact O-N 3.27Å; F37-L39 PolarHBondContact O-N 3.24Å; L39-Y42 WeakPolarHBondContact O-CB 3.41Å; L39-Y42 PolarHBondContact O-N 3.44Å; L39-I43 HydrophobicContact CD2-CD1 4.23Å; L39-I43 VanDerWaalsContact O-CG1 3.31Å; L39-I43 WeakPolarHBondContact O-CG1 3.33Å; L39-I43 PolarHBondContact O-N 2.92Å |
| 40 | F | 62.8 | Low | 56.4 | Low | 112 Ų | 112 | 75.3 Ų | 75.3 | 49% | 0.491 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -65.6 | -42.4 | 174 | -171.7 | -96.9 | 0 | 0 | 0 | 111.5 | F37 L38 Y42 I43 L44 | F37-F40 VanDerWaalsContact O-CB 3.29Å; F37-F40 WeakPolarHBondContact O-CB 3.3Å; F37-F40 PolarHBondContact O-N 3.24Å; F37-F40 VanDerWaalsContact O-N 3.14Å; L38-F40 PolarHBondContact O-N 2.97Å; F40-Y42 VanDerWaalsContact C-N 3.27Å; F40-Y42 PolarHBondContact O-N 3.26Å; F40-I43 CarbonylContact O-C 3.56Å; F40-I43 PolarHBondContact O-N 3.38Å; F40-L44 HydrophobicContact CD1-CD1 3.91Å; F40-L44 HydrophobicContact CD1-CD2 4.47Å; F40-L44 HydrophobicContact CE1-CD1 3.47Å; F40-L44 VanDerWaalsContact CE1-CD1 3.47Å; F40-L44 HydrophobicContact CE1-CD2 3.99Å; F40-L44 HydrophobicContact CE1-CG 4.36Å; F40-L44 HydrophobicContact CE2-CD1 4.22Å; F40-L44 HydrophobicContact CG-CD1 4.45Å; F40-L44 HydrophobicContact CZ-CD1 3.65Å; F40-L44 PolarHBondContact O-N 3.08Å |
| 41 | F | 58.4 | Low | 56.3 | Low | 37 Ų | 37 | 76.2 Ų | 76.2 | 16% | 0.162 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.2 | -33.2 | 171.9 | -79.8 | -78.3 | 0 | 0 | 0 | 112.6 | F37 L38 L44 A45 I77 L84 | F37-F41 HydrophobicContact CD1-CD2 4.08Å; F37-F41 AromaticContact CD1-CE2 3.71Å; F37-F41 HydrophobicContact CD1-CE2 3.71Å; F37-F41 HydrophobicContact CE1-CD2 4.27Å; F37-F41 AromaticContact CE1-CE2 3.57Å; F37-F41 HydrophobicContact CE1-CE2 3.57Å; F37-F41 HydrophobicContact CE1-CZ 4.35Å; F37-F41 PolarHBondContact O-N 2.94Å; L38-F41 PolarHBondContact O-N 3.49Å; F41-L44 CarbonylContact O-C 3.51Å; F41-L44 PolarHBondContact O-N 3.08Å; F41-A45 PolarHBondContact O-N 3.46Å; F41-I77 HydrophobicContact CD1-CG1 4.44Å; F41-I77 HydrophobicContact CD1-CG2 4.18Å; F41-L84 HydrophobicContact CD2-CD1 4.1Å; F41-L84 HydrophobicContact CE2-CD1 3.36Å; F41-L84 HydrophobicContact CZ-CD1 4.09Å |
| 42 | Y | 58.9 | Low | 56.3 | Low | 51 Ų | 51 | 73.2 Ų | 73.2 | 20% | 0.2 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -67.4 | -37.2 | 171.5 | -96.8 | -68.2 | 0 | 0 | 0 | 113.7 | L38 L39 F40 L44 A45 P46 I109 | L38-Y42 WeakPolarHBondContact O-CD2 3.04Å; L38-Y42 PolarHBondContact O-N 3.04Å; L39-Y42 WeakPolarHBondContact O-CB 3.41Å; L39-Y42 PolarHBondContact O-N 3.44Å; F40-Y42 VanDerWaalsContact C-N 3.27Å; F40-Y42 PolarHBondContact O-N 3.26Å; Y42-L44 VanDerWaalsContact C-N 3.28Å; Y42-A45 VanDerWaalsContact O-CB 3.29Å; Y42-A45 WeakPolarHBondContact O-CB 3.49Å; Y42-A45 PolarHBondContact O-N 3.27Å; Y42-P46 WeakPolarHBondContact O-CD 2.98Å; Y42-I109 HydrophobicContact CE1-CB 4.26Å; Y42-I109 HydrophobicContact CE1-CD1 3.92Å; Y42-I109 HydrophobicContact CE1-CG2 3.36Å; Y42-I109 HydrophobicContact CE2-CD1 3.84Å; Y42-I109 WeakPolarHBondContact OH-CB 3.13Å; Y42-I109 WeakPolarHBondContact OH-CD1 3.31Å; Y42-I109 WeakPolarHBondContact OH-CG1 3.08Å; Y42-I109 WeakPolarHBondContact OH-CG2 3.29Å |
| 43 | I | 58.8 | Low | 56.1 | Low | 107 Ų | 107 | 76.8 Ų | 76.8 | 55% | 0.549 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -73 | -24 | 173.5 | -67.9 | 165.8 | 0 | 0 | 0 | 111.2 | L39 F40 P46 | L39-I43 HydrophobicContact CD2-CD1 4.23Å; L39-I43 VanDerWaalsContact O-CG1 3.31Å; L39-I43 WeakPolarHBondContact O-CG1 3.33Å; L39-I43 PolarHBondContact O-N 2.92Å; F40-I43 CarbonylContact O-C 3.56Å; F40-I43 PolarHBondContact O-N 3.38Å; I43-P46 VanDerWaalsContact C-CD 3.49Å; I43-P46 WeakPolarHBondContact O-CD 3.32Å; I43-P46 WeakPolarHBondContact O-CG 3.49Å |
| 44 | L | 55.8 | Low | 55.9 | Low | 48 Ų | 48 | 79.1 Ų | 79.1 | 25% | 0.251 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -81.8 | -22 | 169.1 | -99.6 | 64.3 | 0 | 0 | 0 | 113.2 | F40 F41 Y42 P46 I47 P48 | F40-L44 HydrophobicContact CD1-CD1 3.91Å; F40-L44 HydrophobicContact CD1-CD2 4.47Å; F40-L44 HydrophobicContact CE1-CD1 3.47Å; F40-L44 VanDerWaalsContact CE1-CD1 3.47Å; F40-L44 HydrophobicContact CE1-CD2 3.99Å; F40-L44 HydrophobicContact CE1-CG 4.36Å; F40-L44 HydrophobicContact CE2-CD1 4.22Å; F40-L44 HydrophobicContact CG-CD1 4.45Å; F40-L44 HydrophobicContact CZ-CD1 3.65Å; F40-L44 PolarHBondContact O-N 3.08Å; F41-L44 CarbonylContact O-C 3.51Å; F41-L44 PolarHBondContact O-N 3.08Å; Y42-L44 VanDerWaalsContact C-N 3.28Å; L44-P46 VanDerWaalsContact C-CD 3.45Å; L44-P46 VanDerWaalsContact C-N 3.32Å; L44-I47 HydrophobicContact CB-CD1 4.22Å; L44-I47 HydrophobicContact CD1-CD1 4.34Å; L44-I47 HydrophobicContact CD2-CD1 4.46Å; L44-I47 HydrophobicContact CG-CD1 3.63Å; L44-I47 WeakPolarHBondContact O-CB 2.98Å; L44-I47 VanDerWaalsContact O-CG1 3.24Å; L44-I47 WeakPolarHBondContact O-CG1 3.46Å; L44-I47 PolarHBondContact O-N 2.84Å; L44-P48 WeakPolarHBondContact O-CD 3.34Å |
| 45 | A | 58.6 | Low | 55.6 | Low | 32 Ų | 32 | 74.5 Ų | 74.5 | 26% | 0.264 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -28.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | F41 Y42 I47 P48 | F41-A45 PolarHBondContact O-N 3.46Å; Y42-A45 VanDerWaalsContact O-CB 3.29Å; Y42-A45 WeakPolarHBondContact O-CB 3.49Å; Y42-A45 PolarHBondContact O-N 3.27Å; A45-I47 PolarHBondContact O-N 3.47Å; A45-P48 WeakPolarHBondContact O-CD 3.35Å; A45-P48 WeakPolarHBondContact O-CG 3.32Å |
| 46 | P | 53.7 | Low | 55.3 | Low | 64 Ų | 64 | 80.1 Ų | 80.1 | 42% | 0.416 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -72.7 | -8.1 | 168.8 | 25.6 | -36.5 | 0 | 0 | 0 | 114.5 | Y42 I43 L44 Y49 C50 | Y42-P46 WeakPolarHBondContact O-CD 2.98Å; I43-P46 VanDerWaalsContact C-CD 3.49Å; I43-P46 WeakPolarHBondContact O-CD 3.32Å; I43-P46 WeakPolarHBondContact O-CG 3.49Å; L44-P46 VanDerWaalsContact C-CD 3.45Å; L44-P46 VanDerWaalsContact C-N 3.32Å; P46-Y49 WeakPolarHBondContact O-CB 3.22Å; P46-Y49 PolarHBondContact O-N 3.45Å; P46-C50 WeakPolarHBondContact O-CB 3.33Å; P46-C50 PolarHBondContact O-N 3.29Å |
| 47 | I | 55.2 | Low | 54.8 | Low | 73 Ų | 73 | 82.9 Ų | 82.9 | 37% | 0.374 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62.7 | -50.1 | 175 | -62.6 | -175.8 | 0 | 0 | 0 | 112 | L44 A45 Y49 C50 I51 L73 | L44-I47 HydrophobicContact CB-CD1 4.22Å; L44-I47 HydrophobicContact CD1-CD1 4.34Å; L44-I47 HydrophobicContact CD2-CD1 4.46Å; L44-I47 HydrophobicContact CG-CD1 3.63Å; L44-I47 WeakPolarHBondContact O-CB 2.98Å; L44-I47 VanDerWaalsContact O-CG1 3.24Å; L44-I47 WeakPolarHBondContact O-CG1 3.46Å; L44-I47 PolarHBondContact O-N 2.84Å; A45-I47 PolarHBondContact O-N 3.47Å; I47-Y49 PolarHBondContact O-N 3.46Å; I47-C50 PolarHBondContact O-N 3.45Å; I47-I51 HydrophobicContact CG2-CD1 3.75Å; I47-I51 HydrophobicContact CG2-CG1 4.5Å; I47-I51 WeakPolarHBondContact O-CD1 3.42Å; I47-I51 VanDerWaalsContact O-CG1 3.25Å; I47-I51 WeakPolarHBondContact O-CG1 3.45Å; I47-I51 PolarHBondContact O-N 2.9Å; I47-L73 HydrophobicContact CG2-CD2 4.39Å |
| 48 | P | 49.3 | Very low | 54 | Low | 21 Ų | 21 | 83.1 Ų | 83.1 | 14% | 0.136 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -61.3 | -32.8 | 173.3 | 20.9 | -32.3 | 0 | 0 | 0 | 112.4 | L44 A45 I51 S52 | L44-P48 WeakPolarHBondContact O-CD 3.34Å; A45-P48 WeakPolarHBondContact O-CD 3.35Å; A45-P48 WeakPolarHBondContact O-CG 3.32Å; P48-I51 PolarHBondContact O-N 3.1Å; P48-S52 PolarHBondContact O-N 2.94Å; P48-S52 PolarHBondContact O-OG 3.4Å |
| 49 | Y | 54.5 | Low | 53.3 | Low | 116 Ų | 116 | 87.9 Ų | 87.9 | 46% | 0.455 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -68.2 | -40.7 | 176.6 | -167.1 | -96.4 | 0 | 0 | 0 | 113 | P46 I47 I51 S52 R53 F116 | P46-Y49 WeakPolarHBondContact O-CB 3.22Å; P46-Y49 PolarHBondContact O-N 3.45Å; I47-Y49 PolarHBondContact O-N 3.46Å; Y49-I51 VanDerWaalsContact C-N 3.33Å; Y49-S52 VanDerWaalsContact CA-OG 3.29Å; Y49-S52 WeakPolarHBondContact CA-OG 3.4Å; Y49-S52 PolarHBondContact O-OG 3.25Å; Y49-R53 WeakPolarHBondContact O-CB 3.43Å; Y49-R53 PolarHBondContact O-N 2.92Å; Y49-R53 VanDerWaalsContact O-N 3.11Å; Y49-F116 AromaticContact CE2-CE1 3.83Å; Y49-F116 HydrophobicContact CE2-CE1 3.83Å; Y49-F116 HydrophobicContact CE2-CZ 4.04Å |
| 50 | C | 54.4 | Low | 52.9 | Low | 81 Ų | 81 | 91.8 Ų | 91.8 | 55% | 0.547 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -67.4 | -34.5 | 173.5 | -83.9 | 0 | 0 | 0 | 0 | 112.2 | P46 I47 R53 R54 | P46-C50 WeakPolarHBondContact O-CB 3.33Å; P46-C50 PolarHBondContact O-N 3.29Å; I47-C50 PolarHBondContact O-N 3.45Å; C50-R53 PolarHBondContact O-N 3.02Å; C50-R54 PolarHBondContact O-N 2.72Å; C50-R54 VanDerWaalsContact O-N 3.16Å |
| 51 | I | 52.1 | Low | 52.5 | Low | 55 Ų | 55 | 91.5 Ų | 91.5 | 28% | 0.282 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -68.8 | -47.6 | 175.7 | -68.6 | 165.5 | 0 | 0 | 0 | 109.9 | I47 P48 Y49 R53 R54 I55 A70 | I47-I51 HydrophobicContact CG2-CD1 3.75Å; I47-I51 HydrophobicContact CG2-CG1 4.5Å; I47-I51 WeakPolarHBondContact O-CD1 3.42Å; I47-I51 VanDerWaalsContact O-CG1 3.25Å; I47-I51 WeakPolarHBondContact O-CG1 3.45Å; I47-I51 PolarHBondContact O-N 2.9Å; P48-I51 PolarHBondContact O-N 3.1Å; Y49-I51 VanDerWaalsContact C-N 3.33Å; I51-R53 PolarHBondContact O-N 3.44Å; I51-R54 PolarHBondContact O-N 2.89Å; I51-R54 VanDerWaalsContact O-N 3.14Å; I51-I55 HydrophobicContact CG2-CD1 3.51Å; I51-I55 HydrophobicContact CG2-CG1 4.31Å; I51-I55 WeakPolarHBondContact O-CD1 3.3Å; I51-I55 WeakPolarHBondContact O-CG1 3.21Å; I51-I55 PolarHBondContact O-N 2.89Å; I51-I55 VanDerWaalsContact O-N 3.11Å; I51-A70 HydrophobicContact CG2-CB 4.4Å |
| 52 | S | 47.5 | Very low | 52.2 | Low | 56 Ų | 56 | 92.8 Ų | 92.8 | 39% | 0.392 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.4 | -33.6 | 175.1 | 46 | 0 | 0 | 0 | 0 | 113.3 | P48 Y49 | P48-S52 PolarHBondContact O-N 2.94Å; P48-S52 PolarHBondContact O-OG 3.4Å; Y49-S52 VanDerWaalsContact CA-OG 3.29Å; Y49-S52 WeakPolarHBondContact CA-OG 3.4Å; Y49-S52 PolarHBondContact O-OG 3.25Å |
| 53 | R | 49.9 | Very low | 52.1 | Low | 184 Ų | 184 | 92.2 Ų | 92.2 | 69% | 0.694 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -79.1 | -23.5 | 179.8 | -156.2 | 173.8 | 177.6 | 172 | 0.3 | 113.7 | Y49 C50 I51 | Y49-R53 WeakPolarHBondContact O-CB 3.43Å; Y49-R53 PolarHBondContact O-N 2.92Å; Y49-R53 VanDerWaalsContact O-N 3.11Å; C50-R53 PolarHBondContact O-N 3.02Å; I51-R53 PolarHBondContact O-N 3.44Å |
| 54 | R | 49.9 | Very low | 52.2 | Low | 218 Ų | 218 | 92 Ų | 92 | 82% | 0.823 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -83.4 | -20.3 | 171.3 | -85.9 | -170 | 171.2 | -155 | -1.6 | 113.3 | C50 I51 | C50-R54 PolarHBondContact O-N 2.72Å; C50-R54 VanDerWaalsContact O-N 3.16Å; I51-R54 PolarHBondContact O-N 2.89Å; I51-R54 VanDerWaalsContact O-N 3.14Å |
| 55 | I | 49.1 | Very low | 52.5 | Low | 46 Ų | 46 | 92.7 Ų | 92.7 | 24% | 0.236 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -76.2 | -20.5 | -176.5 | -74.7 | 165.3 | 0 | 0 | 0 | 113.3 | I51 D57 C66 | I51-I55 HydrophobicContact CG2-CD1 3.51Å; I51-I55 HydrophobicContact CG2-CG1 4.31Å; I51-I55 WeakPolarHBondContact O-CD1 3.3Å; I51-I55 WeakPolarHBondContact O-CG1 3.21Å; I51-I55 PolarHBondContact O-N 2.89Å; I51-I55 VanDerWaalsContact O-N 3.11Å; I55-D57 PolarHBondContact O-N 2.92Å; I55-C66 HydrophobicContact CD1-CB 4.12Å |
| 56 | I | 49.5 | Very low | 52.7 | Low | 123 Ų | 123 | 93.3 Ų | 93.3 | 63% | 0.631 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -17.8 | 179.1 | -63.7 | 159.5 | 0 | 0 | 0 | 111.7 | ||
| 57 | D | 47.7 | Very low | 53 | Low | 145 Ų | 145 | 96.1 Ų | 96.1 | 78% | 0.775 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.9 | -14.5 | -174 | -105.2 | -72.3 | 0 | 0 | 0 | 115.5 | I55 | I55-D57 PolarHBondContact O-N 2.92Š|
| 58 | D | 43.5 | Very low | 53.6 | Low | 112 Ų | 112 | 98.9 Ų | 98.9 | 60% | 0.599 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -143.6 | 101.4 | -171.4 | -145 | -66.9 | 0 | 0 | 0 | 116.1 | ||
| 59 | T | 46.3 | Very low | 54.5 | Low | 105 Ų | 105 | 103.3 Ų | 103.3 | 64% | 0.644 | 55% | 0.547 | S | S | * | . | trans | 55.8 | 124.9 | 143.8 | -38.8 | 0 | 0 | 0 | 0 | 121.7 | S61 A62 | T59-S61 VanDerWaalsContact C-N 3.34Å; T59-S61 PolarHBondContact O-N 2.7Å; T59-A62 PolarHBondContact O-N 3.05Å | ||
| 60 | D | 56.1 | Low | 55.1 | Low | 141 Ų | 141 | 98.7 Ų | 98.7 | 75% | 0.754 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -37.2 | -28.2 | -174.8 | -119.3 | -101.9 | 0 | 0 | 0 | 120.4 | ||
| 61 | S | 53.3 | Low | 55.9 | Low | 106 Ų | 106 | 99.3 Ų | 99.3 | 74% | 0.741 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.9 | -30.4 | -174.4 | -61.6 | 0 | 0 | 0 | 0 | 114.3 | T59 | T59-S61 VanDerWaalsContact C-N 3.34Å; T59-S61 PolarHBondContact O-N 2.7Å |
| 62 | A | 51.6 | Low | 57 | Low | 65 Ų | 65 | 104 Ų | 104 | 54% | 0.537 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -77.8 | -27.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | T59 N64 A65 C66 | T59-A62 PolarHBondContact O-N 3.05Å; A62-N64 PolarHBondContact O-N 2.92Å; A62-A65 PolarHBondContact O-N 3.36Å; A62-C66 VanDerWaalsContact O-CB 3.27Å; A62-C66 WeakPolarHBondContact O-CB 3.33Å; A62-C66 PolarHBondContact O-N 3.39Å |
| 63 | S | 58 | Low | 58.3 | Low | 38 Ų | 38 | 105 Ų | 105 | 27% | 0.266 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -58.2 | -42.5 | 179.5 | -172.8 | 0 | 0 | 0 | 0 | 113 | K67 | S63-K67 WeakPolarHBondContact O-CB 3.25Å; S63-K67 PolarHBondContact O-N 3.02Å |
| 64 | N | 59.5 | Low | 59.2 | Low | 104 Ų | 104 | 98.7 Ų | 98.7 | 56% | 0.556 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -67.9 | -45.6 | -179.6 | -75.6 | -36.3 | 0 | 0 | 0 | 113 | A62 K67 E68 | A62-N64 PolarHBondContact O-N 2.92Å; N64-K67 PolarHBondContact O-N 3.43Å; N64-E68 WeakPolarHBondContact O-CB 3.5Å; N64-E68 VanDerWaalsContact O-CG 3.3Å; N64-E68 WeakPolarHBondContact O-CG 3.05Å; N64-E68 PolarHBondContact O-N 3.49Å |
| 65 | A | 63.6 | Low | 60.5 | Low | 62 Ų | 62 | 91.9 Ų | 91.9 | 51% | 0.512 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.8 | -37.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A62 L69 | A62-A65 PolarHBondContact O-N 3.36Å; A65-L69 WeakPolarHBondContact O-CB 3.48Å; A65-L69 VanDerWaalsContact O-CG 3.32Å; A65-L69 WeakPolarHBondContact O-CG 3.42Å; A65-L69 PolarHBondContact O-N 3.27Å |
| 66 | C | 61.7 | Low | 61.9 | Low | 45 Ų | 45 | 91.2 Ų | 91.2 | 30% | 0.304 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -71.6 | -35.8 | 178.1 | -155.5 | 0 | 0 | 0 | 0 | 112.1 | I55 A62 L69 A70 | I55-C66 HydrophobicContact CD1-CB 4.12Å; A62-C66 VanDerWaalsContact O-CB 3.27Å; A62-C66 WeakPolarHBondContact O-CB 3.33Å; A62-C66 PolarHBondContact O-N 3.39Å; C66-L69 PolarHBondContact O-N 3.34Å; C66-A70 VanDerWaalsContact O-CB 3.3Å; C66-A70 WeakPolarHBondContact O-CB 3.34Å; C66-A70 PolarHBondContact O-N 2.9Å |
| 67 | K | 60.2 | Low | 63.2 | Low | 122 Ų | 122 | 86.5 Ų | 86.5 | 53% | 0.53 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.4 | -45.7 | 173.8 | -177.7 | 178.4 | 176.3 | -179.6 | 0 | 112 | S63 N64 A70 L71 | S63-K67 WeakPolarHBondContact O-CB 3.25Å; S63-K67 PolarHBondContact O-N 3.02Å; N64-K67 PolarHBondContact O-N 3.43Å; K67-A70 PolarHBondContact O-N 3.4Å; K67-L71 PolarHBondContact O-N 2.91Å |
| 68 | E | 68.3 | Low | 64.8 | Low | 131 Ų | 131 | 81.5 Ų | 81.5 | 61% | 0.612 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -61.7 | -43.1 | 174.2 | -71.7 | -64.4 | 135.3 | 0 | 0 | 111.2 | N64 A70 L71 F72 | N64-E68 WeakPolarHBondContact O-CB 3.5Å; N64-E68 VanDerWaalsContact O-CG 3.3Å; N64-E68 WeakPolarHBondContact O-CG 3.05Å; N64-E68 PolarHBondContact O-N 3.49Å; E68-A70 PolarHBondContact O-N 3.34Å; E68-L71 PolarHBondContact O-N 3.16Å; E68-F72 VanDerWaalsContact O-CB 3.32Å; E68-F72 WeakPolarHBondContact O-CB 3.38Å; E68-F72 PolarHBondContact O-N 3.5Å |
| 69 | L | 69 | Low | 66.7 | Low | 114 Ų | 114 | 81.1 Ų | 81.1 | 60% | 0.597 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.8 | -39.4 | 174.3 | -79.1 | 172.2 | 0 | 0 | 0 | 112.7 | A65 C66 F72 L73 | A65-L69 WeakPolarHBondContact O-CB 3.48Å; A65-L69 VanDerWaalsContact O-CG 3.32Å; A65-L69 WeakPolarHBondContact O-CG 3.42Å; A65-L69 PolarHBondContact O-N 3.27Å; C66-L69 PolarHBondContact O-N 3.34Å; L69-F72 PolarHBondContact O-N 3.08Å; L69-L73 VanDerWaalsContact O-CB 3.31Å; L69-L73 WeakPolarHBondContact O-CB 3.4Å; L69-L73 PolarHBondContact O-N 3.48Å |
| 70 | A | 65.8 | Low | 68.4 | Low | 19 Ų | 19 | 78.3 Ų | 78.3 | 16% | 0.157 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -66.1 | -42.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | I51 C66 K67 E68 L73 T74 | I51-A70 HydrophobicContact CG2-CB 4.4Å; C66-A70 VanDerWaalsContact O-CB 3.3Å; C66-A70 WeakPolarHBondContact O-CB 3.34Å; C66-A70 PolarHBondContact O-N 2.9Å; K67-A70 PolarHBondContact O-N 3.4Å; E68-A70 PolarHBondContact O-N 3.34Å; A70-L73 PolarHBondContact O-N 3.28Å; A70-T74 WeakPolarHBondContact O-CB 3.08Å; A70-T74 PolarHBondContact O-N 3.4Å; A70-T74 PolarHBondContact O-OG1 2.99Å |
| 71 | L | 70.8 | Confident | 69.3 | Low | 94 Ų | 94 | 71.8 Ų | 71.8 | 49% | 0.492 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.2 | -43.6 | 173 | -84.6 | 165.4 | 0 | 0 | 0 | 111.7 | K67 E68 L73 T74 T75 | K67-L71 PolarHBondContact O-N 2.91Å; E68-L71 PolarHBondContact O-N 3.16Å; L71-L73 PolarHBondContact O-N 3.38Å; L71-T74 PolarHBondContact O-N 3.37Å; L71-T75 WeakPolarHBondContact O-CB 3.39Å; L71-T75 WeakPolarHBondContact O-CG2 3.43Å; L71-T75 PolarHBondContact O-N 3.36Å; L71-T75 PolarHBondContact O-OG1 3Å |
| 72 | F | 76.6 | Confident | 70.6 | Confident | 153 Ų | 153 | 69.4 Ų | 69.4 | 67% | 0.671 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -61.7 | -43.9 | 176.2 | -176.5 | -100.3 | 0 | 0 | 0 | 112.1 | E68 L69 T75 G76 | E68-F72 VanDerWaalsContact O-CB 3.32Å; E68-F72 WeakPolarHBondContact O-CB 3.38Å; E68-F72 PolarHBondContact O-N 3.5Å; L69-F72 PolarHBondContact O-N 3.08Å; F72-T75 WeakPolarHBondContact CA-OG1 3.29Å; F72-T75 PolarHBondContact O-OG1 2.96Å; F72-G76 PolarHBondContact O-N 2.92Å |
| 73 | L | 73.1 | Confident | 72 | Confident | 79 Ų | 79 | 67.5 Ų | 67.5 | 41% | 0.414 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -69.2 | -39.8 | 179.2 | -156.5 | 116.1 | 0 | 0 | 0 | 111.4 | I47 L69 A70 L71 G76 I77 | I47-L73 HydrophobicContact CG2-CD2 4.39Å; L69-L73 VanDerWaalsContact O-CB 3.31Å; L69-L73 WeakPolarHBondContact O-CB 3.4Å; L69-L73 PolarHBondContact O-N 3.48Å; A70-L73 PolarHBondContact O-N 3.28Å; L71-L73 PolarHBondContact O-N 3.38Å; L73-G76 PolarHBondContact O-N 2.83Å; L73-I77 HydrophobicContact CD2-CD1 3.72Å; L73-I77 HydrophobicContact CG-CD1 4.39Å; L73-I77 VanDerWaalsContact O-CG1 3.23Å; L73-I77 WeakPolarHBondContact O-CG1 3.33Å; L73-I77 PolarHBondContact O-N 3.33Å |
| 74 | T | 70.2 | Confident | 72.9 | Confident | 50 Ų | 50 | 67.4 Ų | 67.4 | 31% | 0.307 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -65.2 | -45.9 | 178.1 | -51.8 | 0 | 0 | 0 | 0 | 111 | A70 L71 I77 V78 | A70-T74 WeakPolarHBondContact O-CB 3.08Å; A70-T74 PolarHBondContact O-N 3.4Å; A70-T74 PolarHBondContact O-OG1 2.99Å; L71-T74 PolarHBondContact O-N 3.37Å; T74-I77 PolarHBondContact O-N 2.95Å; T74-V78 WeakPolarHBondContact O-CG2 3.3Å; T74-V78 PolarHBondContact O-N 3.3Å |
| 75 | T | 76.7 | Confident | 73.5 | Confident | 76 Ų | 76 | 62.5 Ų | 62.5 | 47% | 0.466 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -64.3 | -40.2 | 175.4 | 51.1 | 0 | 0 | 0 | 0 | 111.6 | L71 F72 I77 V78 V79 | L71-T75 WeakPolarHBondContact O-CB 3.39Å; L71-T75 WeakPolarHBondContact O-CG2 3.43Å; L71-T75 PolarHBondContact O-N 3.36Å; L71-T75 PolarHBondContact O-OG1 3Å; F72-T75 WeakPolarHBondContact CA-OG1 3.29Å; F72-T75 PolarHBondContact O-OG1 2.96Å; T75-I77 PolarHBondContact O-N 3.35Å; T75-V78 PolarHBondContact O-N 3.07Å; T75-V79 VanDerWaalsContact O-CG2 3.3Å; T75-V79 WeakPolarHBondContact O-CG2 3.26Å; T75-V79 PolarHBondContact O-N 3.05Å |
| 76 | G | 79.3 | Confident | 74.2 | Confident | 32 Ų | 32 | 64.2 Ų | 64.2 | 33% | 0.33 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -59.5 | -42.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | F72 L73 S80 | F72-G76 PolarHBondContact O-N 2.92Å; L73-G76 PolarHBondContact O-N 2.83Å; G76-S80 VanDerWaalsContact O-CB 3.29Å; G76-S80 WeakPolarHBondContact O-CB 3.27Å; G76-S80 PolarHBondContact O-N 3.2Å; G76-S80 PolarHBondContact O-OG 3.25Å |
| 77 | I | 77.1 | Confident | 75.1 | Confident | 23 Ų | 23 | 67.3 Ų | 67.3 | 12% | 0.118 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -64.9 | -43.8 | 174.9 | -69.6 | 165.1 | 0 | 0 | 0 | 110.7 | F41 L73 T74 T75 S80 A81 | F41-I77 HydrophobicContact CD1-CG1 4.44Å; F41-I77 HydrophobicContact CD1-CG2 4.18Å; L73-I77 HydrophobicContact CD2-CD1 3.72Å; L73-I77 HydrophobicContact CG-CD1 4.39Å; L73-I77 VanDerWaalsContact O-CG1 3.23Å; L73-I77 WeakPolarHBondContact O-CG1 3.33Å; L73-I77 PolarHBondContact O-N 3.33Å; T74-I77 PolarHBondContact O-N 2.95Å; T75-I77 PolarHBondContact O-N 3.35Å; I77-S80 PolarHBondContact O-N 3.36Å; I77-A81 WeakPolarHBondContact O-CB 3.01Å; I77-A81 PolarHBondContact O-N 3.32Å |
| 78 | V | 79.6 | Confident | 75.6 | Confident | 40 Ų | 40 | 62.2 Ų | 62.2 | 24% | 0.242 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -59.5 | -52.3 | 178.2 | 177 | 0 | 0 | 0 | 0 | 110.7 | T74 T75 S80 A81 F82 F110 | T74-V78 WeakPolarHBondContact O-CG2 3.3Å; T74-V78 PolarHBondContact O-N 3.3Å; T75-V78 PolarHBondContact O-N 3.07Å; V78-S80 VanDerWaalsContact C-N 3.28Å; V78-S80 PolarHBondContact O-N 2.87Å; V78-A81 PolarHBondContact O-N 3.37Å; V78-F82 HydrophobicContact CG1-CD2 4.02Å; V78-F82 HydrophobicContact CG1-CE2 3.9Å; V78-F82 VanDerWaalsContact O-CD2 3.23Å; V78-F82 WeakPolarHBondContact O-CD2 3.13Å; V78-F82 PolarHBondContact O-N 3.34Å; V78-F110 HydrophobicContact CB-CE1 3.87Å; V78-F110 HydrophobicContact CB-CZ 3.87Å; V78-F110 HydrophobicContact CG1-CD1 4.28Å; V78-F110 HydrophobicContact CG1-CD2 4.38Å; V78-F110 HydrophobicContact CG1-CE1 3.91Å; V78-F110 HydrophobicContact CG1-CE2 4Å; V78-F110 HydrophobicContact CG1-CZ 3.78Å; V78-F110 HydrophobicContact CG2-CD1 3.84Å; V78-F110 HydrophobicContact CG2-CE1 3.23Å; V78-F110 HydrophobicContact CG2-CZ 3.77Å |
| 79 | V | 84.5 | Confident | 75.9 | Confident | 104 Ų | 104 | 56.2 Ų | 56.2 | 63% | 0.63 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -60.6 | -40.5 | 179 | 173.5 | 0 | 0 | 0 | 0 | 110.7 | T75 F82 G83 | T75-V79 VanDerWaalsContact O-CG2 3.3Å; T75-V79 WeakPolarHBondContact O-CG2 3.26Å; T75-V79 PolarHBondContact O-N 3.05Å; V79-F82 PolarHBondContact O-N 3.2Å; V79-G83 PolarHBondContact O-N 2.93Å |
| 80 | S | 80.7 | Confident | 76.2 | Confident | 46 Ų | 46 | 60.9 Ų | 60.9 | 32% | 0.322 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65.7 | -39.7 | 177.6 | -58.8 | 0 | 0 | 0 | 0 | 112.3 | G76 I77 V78 F82 G83 L84 | G76-S80 VanDerWaalsContact O-CB 3.29Å; G76-S80 WeakPolarHBondContact O-CB 3.27Å; G76-S80 PolarHBondContact O-N 3.2Å; G76-S80 PolarHBondContact O-OG 3.25Å; I77-S80 PolarHBondContact O-N 3.36Å; V78-S80 VanDerWaalsContact C-N 3.28Å; V78-S80 PolarHBondContact O-N 2.87Å; S80-F82 VanDerWaalsContact C-N 3.27Å; S80-F82 PolarHBondContact O-N 3.34Å; S80-G83 PolarHBondContact O-N 3.4Å; S80-L84 WeakPolarHBondContact O-CB 2.95Å; S80-L84 PolarHBondContact O-N 2.84Å |
| 81 | A | 76.2 | Confident | 76.6 | Confident | 5 Ų | 5 | 62.8 Ų | 62.8 | 4% | 0.041 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.6 | -32.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L38 I77 V78 P85 N106 F110 | L38-A81 HydrophobicContact CD2-CB 4.02Å; L38-A81 WeakPolarHBondContact CD2-O 3.5Å; I77-A81 WeakPolarHBondContact O-CB 3.01Å; I77-A81 PolarHBondContact O-N 3.32Å; V78-A81 PolarHBondContact O-N 3.37Å; A81-P85 WeakPolarHBondContact O-CD 3.41Å; A81-P85 VanDerWaalsContact O-CG 3.31Å; A81-P85 WeakPolarHBondContact O-CG 3.26Å; A81-N106 PolarHBondContact O-ND2 3.17Å; A81-F110 HydrophobicContact CB-CE2 4.22Å; A81-F110 HydrophobicContact CB-CZ 4.06Å |
| 82 | F | 81.3 | Confident | 76.4 | Confident | 56 Ų | 56 | 65.4 Ų | 65.4 | 25% | 0.246 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -84.9 | -35.8 | 173.7 | -73.2 | -71.6 | 0 | 0 | 0 | 113.4 | V78 V79 S80 P85 I86 L103 N106 V107 F110 | V78-F82 HydrophobicContact CG1-CD2 4.02Å; V78-F82 HydrophobicContact CG1-CE2 3.9Å; V78-F82 VanDerWaalsContact O-CD2 3.23Å; V78-F82 WeakPolarHBondContact O-CD2 3.13Å; V78-F82 PolarHBondContact O-N 3.34Å; V79-F82 PolarHBondContact O-N 3.2Å; S80-F82 VanDerWaalsContact C-N 3.27Å; S80-F82 PolarHBondContact O-N 3.34Å; F82-P85 WeakPolarHBondContact O-CD 3.31Å; F82-P85 WeakPolarHBondContact O-CG 3.46Å; F82-I86 VanDerWaalsContact O-CD1 3.23Å; F82-I86 WeakPolarHBondContact O-CD1 3.46Å; F82-I86 VanDerWaalsContact O-CG1 3.3Å; F82-I86 WeakPolarHBondContact O-CG1 3.37Å; F82-L103 HydrophobicContact CD1-CD1 3.73Å; F82-L103 HydrophobicContact CD1-CG 4.17Å; F82-L103 HydrophobicContact CE1-CD1 4.31Å; F82-L103 HydrophobicContact CE1-CG 4.26Å; F82-N106 HydrophobicContact CD1-CB 4.38Å; F82-N106 HydrophobicContact CE1-CB 3.77Å; F82-N106 HydrophobicContact CZ-CB 3.96Å; F82-V107 HydrophobicContact CE1-CG2 4.05Å; F82-V107 HydrophobicContact CZ-CG2 4.14Å; F82-F110 HydrophobicContact CD2-CD2 4.48Å; F82-F110 HydrophobicContact CD2-CE2 4.01Å; F82-F110 AromaticContact CE2-CD2 3.39Å; F82-F110 HydrophobicContact CE2-CD2 3.39Å; F82-F110 AromaticContact CE2-CE2 3.31Å; F82-F110 HydrophobicContact CE2-CE2 3.31Å; F82-F110 HydrophobicContact CE2-CG 4.48Å; F82-F110 HydrophobicContact CE2-CZ 4.37Å; F82-F110 AromaticContact CZ-CD2 3.57Å; F82-F110 HydrophobicContact CZ-CD2 3.57Å; F82-F110 AromaticContact CZ-CE2 3.8Å; F82-F110 HydrophobicContact CZ-CE2 3.8Å |
| 83 | G | 80.5 | Confident | 75.9 | Confident | 25 Ų | 25 | 59.8 Ų | 59.8 | 26% | 0.258 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -70.3 | -44 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | V79 S80 I86 I87 | V79-G83 PolarHBondContact O-N 2.93Å; S80-G83 PolarHBondContact O-N 3.4Å; G83-I86 PolarHBondContact O-N 2.72Å; G83-I87 WeakPolarHBondContact O-CD1 3.29Å; G83-I87 VanDerWaalsContact O-CG1 3.25Å; G83-I87 WeakPolarHBondContact O-CG1 3.44Å; G83-I87 PolarHBondContact O-N 3.23Å |
| 84 | L | 76.3 | Confident | 75.7 | Confident | 35 Ų | 35 | 56.5 Ų | 56.5 | 18% | 0.183 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -54.2 | -52.2 | -179.8 | -99 | 155.3 | 0 | 0 | 0 | 114.8 | F37 F41 S80 I86 I87 F88 | F37-L84 HydrophobicContact CD1-CD1 4.12Å; F41-L84 HydrophobicContact CD2-CD1 4.1Å; F41-L84 HydrophobicContact CE2-CD1 3.36Å; F41-L84 HydrophobicContact CZ-CD1 4.09Å; S80-L84 WeakPolarHBondContact O-CB 2.95Å; S80-L84 PolarHBondContact O-N 2.84Å; L84-I86 VanDerWaalsContact C-N 3.28Å; L84-I86 PolarHBondContact O-N 2.81Å; L84-I87 PolarHBondContact O-N 3Å; L84-F88 HydrophobicContact CB-CE2 4.34Å; L84-F88 HydrophobicContact CD2-CE1 4.22Å; L84-F88 HydrophobicContact CD2-CE2 3.5Å; L84-F88 VanDerWaalsContact CD2-CE2 3.5Å; L84-F88 HydrophobicContact CD2-CZ 3.18Å; L84-F88 WeakPolarHBondContact O-CD2 3.25Å; L84-F88 PolarHBondContact O-N 3.14Å; L84-F88 VanDerWaalsContact O-N 3.08Å |
| 85 | P | 72.6 | Confident | 75.8 | Confident | 2 Ų | 2 | 56.2 Ų | 56.2 | 1% | 0.013 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.4 | -34 | 179.5 | 22.1 | -31.7 | 0 | 0 | 0 | 112.7 | A81 F82 F88 A89 V102 | A81-P85 WeakPolarHBondContact O-CD 3.41Å; A81-P85 VanDerWaalsContact O-CG 3.31Å; A81-P85 WeakPolarHBondContact O-CG 3.26Å; F82-P85 WeakPolarHBondContact O-CD 3.31Å; F82-P85 WeakPolarHBondContact O-CG 3.46Å; P85-F88 PolarHBondContact O-N 2.9Å; P85-A89 PolarHBondContact O-N 2.99Å; P85-V102 HydrophobicContact CB-CG1 3.96Å; P85-V102 HydrophobicContact CG-CG1 4.14Å |
| 86 | I | 78.3 | Confident | 75.7 | Confident | 98 Ų | 98 | 62 Ų | 62 | 50% | 0.503 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -66.2 | -41.3 | 177 | -63.2 | 168.4 | 0 | 0 | 0 | 110.8 | F82 G83 L84 A89 R90 | F82-I86 VanDerWaalsContact O-CD1 3.23Å; F82-I86 WeakPolarHBondContact O-CD1 3.46Å; F82-I86 VanDerWaalsContact O-CG1 3.3Å; F82-I86 WeakPolarHBondContact O-CG1 3.37Å; G83-I86 PolarHBondContact O-N 2.72Å; L84-I86 VanDerWaalsContact C-N 3.28Å; L84-I86 PolarHBondContact O-N 2.81Å; I86-A89 PolarHBondContact O-N 3.34Å; I86-R90 PolarHBondContact O-N 3.14Å |
| 87 | I | 80.2 | Confident | 75.4 | Confident | 109 Ų | 109 | 62.4 Ų | 62.4 | 56% | 0.559 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -65.8 | -39.8 | 177.8 | -63.8 | 156.4 | 0 | 0 | 0 | 110.5 | G83 L84 R90 A91 | G83-I87 WeakPolarHBondContact O-CD1 3.29Å; G83-I87 VanDerWaalsContact O-CG1 3.25Å; G83-I87 WeakPolarHBondContact O-CG1 3.44Å; G83-I87 PolarHBondContact O-N 3.23Å; L84-I87 PolarHBondContact O-N 3Å; I87-R90 PolarHBondContact O-N 3.23Å; I87-A91 WeakPolarHBondContact O-CB 3.33Å; I87-A91 PolarHBondContact O-N 3.43Å |
| 88 | F | 71.5 | Confident | 75.2 | Confident | 15 Ų | 15 | 61.4 Ų | 61.4 | 7% | 0.066 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -68.5 | -36.4 | 175.2 | -65.6 | -35.4 | 0 | 0 | 0 | 114.3 | W34 L84 P85 R90 A91 D92 V93 I94 | W34-F88 HydrophobicContact CD2-CD1 4.39Å; W34-F88 AromaticContact CD2-CE1 3.85Å; W34-F88 HydrophobicContact CD2-CE1 3.85Å; W34-F88 HydrophobicContact CD2-CE2 4.44Å; W34-F88 AromaticContact CD2-CZ 3.93Å; W34-F88 HydrophobicContact CD2-CZ 3.93Å; W34-F88 HydrophobicContact CE3-CD1 4Å; W34-F88 HydrophobicContact CE3-CD2 4.35Å; W34-F88 AromaticContact CE3-CE1 3.11Å; W34-F88 HydrophobicContact CE3-CE1 3.11Å; W34-F88 AromaticContact CE3-CE2 3.5Å; W34-F88 HydrophobicContact CE3-CE2 3.5Å; W34-F88 AromaticContact CE3-CZ 2.85Å; W34-F88 HydrophobicContact CE3-CZ 2.85Å; W34-F88 AromaticContact CH2-CE1 3.64Å; W34-F88 HydrophobicContact CH2-CE1 3.64Å; W34-F88 AromaticContact CH2-CZ 3.98Å; W34-F88 HydrophobicContact CH2-CZ 3.98Å; W34-F88 HydrophobicContact CZ2-CE1 4.35Å; W34-F88 HydrophobicContact CZ3-CD1 4.22Å; W34-F88 AromaticContact CZ3-CE1 3.03Å; W34-F88 HydrophobicContact CZ3-CE1 3.03Å; W34-F88 AromaticContact CZ3-CE2 4Å; W34-F88 HydrophobicContact CZ3-CE2 4Å; W34-F88 AromaticContact CZ3-CZ 2.92Å; W34-F88 HydrophobicContact CZ3-CZ 2.92Å; L84-F88 HydrophobicContact CB-CE2 4.34Å; L84-F88 HydrophobicContact CD2-CE1 4.22Å; L84-F88 HydrophobicContact CD2-CE2 3.5Å; L84-F88 VanDerWaalsContact CD2-CE2 3.5Å; L84-F88 HydrophobicContact CD2-CZ 3.18Å; L84-F88 WeakPolarHBondContact O-CD2 3.25Å; L84-F88 PolarHBondContact O-N 3.14Å; L84-F88 VanDerWaalsContact O-N 3.08Å; P85-F88 PolarHBondContact O-N 2.9Å; F88-R90 PolarHBondContact O-N 3.12Å; F88-A91 PolarHBondContact O-N 2.95Å; F88-D92 PolarHBondContact O-N 3.04Å; F88-V93 HydrophobicContact CB-CB 4.26Å; F88-V93 HydrophobicContact CD1-CB 4.46Å; F88-V93 PolarHBondContact O-N 3.18Å; F88-I94 HydrophobicContact CB-CB 4.32Å; F88-I94 HydrophobicContact CB-CD1 3.62Å; F88-I94 HydrophobicContact CB-CG1 3.97Å; F88-I94 HydrophobicContact CD2-CD1 3.75Å; F88-I94 HydrophobicContact CG-CD1 4.03Å; F88-I94 PolarHBondContact O-N 3.38Å |
| 89 | A | 72.9 | Confident | 75 | Confident | 5 Ų | 5 | 60 Ų | 60 | 4% | 0.041 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -62.2 | -36.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | P85 I86 I94 C99 | P85-A89 PolarHBondContact O-N 2.99Å; I86-A89 PolarHBondContact O-N 3.34Å; A89-I94 WeakPolarHBondContact CA-O 3.33Å; A89-C99 HydrophobicContact CB-CB 4.02Å |
| 90 | R | 75.3 | Confident | 74.9 | Confident | 212 Ų | 212 | 57.7 Ų | 57.7 | 80% | 0.8 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -74.5 | -29.2 | 176.5 | -166.7 | 66.3 | -133.3 | -138.3 | -1 | 113.6 | I86 I87 F88 D92 | I86-R90 PolarHBondContact O-N 3.14Å; I87-R90 PolarHBondContact O-N 3.23Å; F88-R90 PolarHBondContact O-N 3.12Å; R90-D92 VanDerWaalsContact C-N 3.25Å; R90-D92 PolarHBondContact O-N 3.29Å |
| 91 | A | 75.7 | Confident | 74.8 | Confident | 60 Ų | 60 | 58 Ų | 58 | 50% | 0.496 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.4 | 7.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | I87 F88 V93 | I87-A91 WeakPolarHBondContact O-CB 3.33Å; I87-A91 PolarHBondContact O-N 3.43Å; F88-A91 PolarHBondContact O-N 2.95Å; A91-V93 HydrophobicContact CB-CG2 3.87Å; A91-V93 PolarHBondContact O-N 2.66Å; A91-V93 VanDerWaalsContact O-N 3.08Å |
| 92 | D | 66.2 | Low | 74.9 | Confident | 149 Ų | 149 | 58 Ų | 58 | 80% | 0.797 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.3 | 23.3 | -176 | -103.1 | -78.8 | 0 | 0 | 0 | 113.7 | F88 R90 | F88-D92 PolarHBondContact O-N 3.04Å; R90-D92 VanDerWaalsContact C-N 3.25Å; R90-D92 PolarHBondContact O-N 3.29Å |
| 93 | V | 65.3 | Low | 75 | Confident | 35 Ų | 35 | 58.4 Ų | 58.4 | 21% | 0.212 | 32% | 0.319 | C | S | . | . | S | Bend | trans | -83.1 | -29.4 | 178 | -179.5 | 0 | 0 | 0 | 0 | 110.8 | K32 W34 F88 A91 | K32-V93 HydrophobicContact CD-CG1 4.46Å; K32-V93 VanDerWaalsContact CG-O 3.29Å; K32-V93 WeakPolarHBondContact CG-O 3.23Å; W34-V93 HydrophobicContact CB-CG1 4.13Å; W34-V93 HydrophobicContact CG-CG1 4.08Å; F88-V93 HydrophobicContact CB-CB 4.26Å; F88-V93 HydrophobicContact CD1-CB 4.46Å; F88-V93 PolarHBondContact O-N 3.18Å; A91-V93 HydrophobicContact CB-CG2 3.87Å; A91-V93 PolarHBondContact O-N 2.66Å; A91-V93 VanDerWaalsContact O-N 3.08Å |
| 94 | I | 68.7 | Low | 75.3 | Confident | 9 Ų | 9 | 60.6 Ų | 60.6 | 5% | 0.046 | 33% | 0.327 | C | S | . | . | S | Bend | trans | -135.2 | 133.3 | 179.9 | -61.4 | 172.1 | 0 | 0 | 0 | 106.9 | P35 F88 A89 A98 | P35-I94 HydrophobicContact CB-CD1 4.43Å; P35-I94 HydrophobicContact CG-CD1 3.73Å; P35-I94 HydrophobicContact CG-CG1 4.45Å; F88-I94 HydrophobicContact CB-CB 4.32Å; F88-I94 HydrophobicContact CB-CD1 3.62Å; F88-I94 HydrophobicContact CB-CG1 3.97Å; F88-I94 HydrophobicContact CD2-CD1 3.75Å; F88-I94 HydrophobicContact CG-CD1 4.03Å; F88-I94 PolarHBondContact O-N 3.38Å; A89-I94 WeakPolarHBondContact CA-O 3.33Å; I94-A98 HydrophobicContact CG2-CB 3.4Å |
| 95 | A | 73 | Confident | 75.5 | Confident | 45 Ų | 45 | 59 Ų | 59 | 37% | 0.372 | 32% | 0.32 | S | S | . | . | trans | -78.2 | 159.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y30 G97 A98 C99 | Y30-A95 HydrophobicContact CD1-CB 4.45Å; Y30-A95 HydrophobicContact CE1-CB 3.34Å; Y30-A95 VanDerWaalsContact CE1-N 3.27Å; A95-G97 PolarHBondContact O-N 3.37Å; A95-A98 PolarHBondContact O-N 2.82Å; A95-C99 PolarHBondContact O-N 3.48Å; A95-C99 VanDerWaalsContact O-N 3.14Å | ||
| 96 | W | 73.9 | Confident | 76 | Confident | 197 Ų | 197 | 59 Ų | 59 | 75% | 0.746 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -53.9 | -30.4 | -171.9 | -74.6 | 86.7 | 0 | 0 | 0 | 114.3 | C99 A100 | W96-C99 PolarHBondContact O-N 2.95Å; W96-A100 PolarHBondContact O-N 2.91Å |
| 97 | G | 74.6 | Confident | 76.3 | Confident | 40 Ų | 40 | 58.2 Ų | 58.2 | 41% | 0.412 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66.3 | -45.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | A95 C99 A100 L101 | A95-G97 PolarHBondContact O-N 3.37Å; G97-C99 VanDerWaalsContact C-N 3.33Å; G97-A100 PolarHBondContact O-N 2.7Å; G97-L101 PolarHBondContact O-N 3.29Å; G97-L101 VanDerWaalsContact O-N 3.16Å |
| 98 | A | 72.5 | Confident | 76.5 | Confident | 2 Ų | 2 | 54.9 Ų | 54.9 | 2% | 0.017 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -67.8 | -35.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y30 I94 A95 A100 L101 V102 | Y30-A98 HydrophobicContact CD1-CB 3.99Å; Y30-A98 HydrophobicContact CD2-CB 3.78Å; Y30-A98 HydrophobicContact CE1-CB 3.81Å; Y30-A98 HydrophobicContact CE2-CB 3.63Å; Y30-A98 HydrophobicContact CG-CB 3.99Å; Y30-A98 PolarHBondContact OH-N 3.27Å; I94-A98 HydrophobicContact CG2-CB 3.4Å; A95-A98 PolarHBondContact O-N 2.82Å; A98-A100 VanDerWaalsContact C-N 3.34Å; A98-A100 PolarHBondContact O-N 2.92Å; A98-L101 PolarHBondContact O-N 2.88Å; A98-V102 VanDerWaalsContact O-CG2 3.28Å; A98-V102 WeakPolarHBondContact O-CG2 3.29Å; A98-V102 PolarHBondContact O-N 3.38Å |
| 99 | C | 76 | Confident | 77 | Confident | 11 Ų | 11 | 54.8 Ų | 54.8 | 7% | 0.074 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60 | -43.1 | 173.7 | -167.6 | 0 | 0 | 0 | 0 | 112 | A89 A95 W96 G97 V102 L103 | A89-C99 HydrophobicContact CB-CB 4.02Å; A95-C99 PolarHBondContact O-N 3.48Å; A95-C99 VanDerWaalsContact O-N 3.14Å; W96-C99 PolarHBondContact O-N 2.95Å; G97-C99 VanDerWaalsContact C-N 3.33Å; C99-V102 PolarHBondContact O-N 2.92Å; C99-L103 WeakPolarHBondContact O-CB 3.29Å; C99-L103 PolarHBondContact O-N 3.34Å |
| 100 | A | 81.3 | Confident | 77.3 | Confident | 55 Ų | 55 | 56.3 Ų | 56.3 | 46% | 0.455 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.7 | -39.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | W96 G97 A98 L103 T104 | W96-A100 PolarHBondContact O-N 2.91Å; G97-A100 PolarHBondContact O-N 2.7Å; A98-A100 VanDerWaalsContact C-N 3.34Å; A98-A100 PolarHBondContact O-N 2.92Å; A100-L103 PolarHBondContact O-N 3.17Å; A100-T104 WeakPolarHBondContact O-CB 3.16Å; A100-T104 PolarHBondContact O-N 3.4Å; A100-T104 PolarHBondContact O-OG1 3.23Å |
| 101 | L | 79.4 | Confident | 77.7 | Confident | 54 Ų | 54 | 49 Ų | 49 | 28% | 0.283 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -62.2 | -45.5 | 175.8 | -109.8 | 127.9 | 0 | 0 | 0 | 112 | F20 L23 G97 A98 T104 G105 | F20-L101 HydrophobicContact CB-CD2 4.11Å; F20-L101 HydrophobicContact CD1-CD2 3.63Å; F20-L101 HydrophobicContact CD1-CG 4.49Å; F20-L101 HydrophobicContact CG-CD2 4.35Å; F20-L101 VanDerWaalsContact O-CD2 3.26Å; F20-L101 WeakPolarHBondContact O-CD2 3.15Å; L23-L101 HydrophobicContact CB-CD2 3.72Å; G97-L101 PolarHBondContact O-N 3.29Å; G97-L101 VanDerWaalsContact O-N 3.16Å; A98-L101 PolarHBondContact O-N 2.88Å; L101-T104 PolarHBondContact O-N 3.29Å; L101-G105 PolarHBondContact O-N 3.3Å |
| 102 | V | 78.6 | Confident | 77.8 | Confident | 3 Ų | 3 | 47.2 Ų | 47.2 | 2% | 0.018 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.3 | -43.5 | 176.8 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | L21 L38 P85 A98 C99 T104 G105 N106 | L21-V102 HydrophobicContact CD1-CG1 4.06Å; L21-V102 HydrophobicContact CD1-CG2 4.18Å; L38-V102 HydrophobicContact CD1-CG1 3.51Å; P85-V102 HydrophobicContact CB-CG1 3.96Å; P85-V102 HydrophobicContact CG-CG1 4.14Å; A98-V102 VanDerWaalsContact O-CG2 3.28Å; A98-V102 WeakPolarHBondContact O-CG2 3.29Å; A98-V102 PolarHBondContact O-N 3.38Å; C99-V102 PolarHBondContact O-N 2.92Å; V102-T104 VanDerWaalsContact C-N 3.3Å; V102-T104 PolarHBondContact O-N 2.86Å; V102-G105 PolarHBondContact O-N 3.41Å; V102-N106 PolarHBondContact O-N 2.85Å |
| 103 | L | 82.7 | Confident | 78.3 | Confident | 65 Ų | 65 | 43.1 Ų | 43.1 | 34% | 0.34 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.3 | -43.4 | 177.4 | -152.2 | 88.6 | 0 | 0 | 0 | 111.1 | F82 C99 A100 N106 V107 | F82-L103 HydrophobicContact CD1-CD1 3.73Å; F82-L103 HydrophobicContact CD1-CG 4.17Å; F82-L103 HydrophobicContact CE1-CD1 4.31Å; F82-L103 HydrophobicContact CE1-CG 4.26Å; C99-L103 WeakPolarHBondContact O-CB 3.29Å; C99-L103 PolarHBondContact O-N 3.34Å; A100-L103 PolarHBondContact O-N 3.17Å; L103-N106 PolarHBondContact O-N 3.37Å; L103-V107 WeakPolarHBondContact O-CG2 3.41Å; L103-V107 PolarHBondContact O-N 2.99Å |
| 104 | T | 85.6 | Confident | 78.7 | Confident | 72 Ų | 72 | 47.4 Ų | 47.4 | 44% | 0.442 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -65 | -44.3 | 178 | -53.7 | 0 | 0 | 0 | 0 | 111.1 | A100 L101 V102 N106 V107 V108 | A100-T104 WeakPolarHBondContact O-CB 3.16Å; A100-T104 PolarHBondContact O-N 3.4Å; A100-T104 PolarHBondContact O-OG1 3.23Å; L101-T104 PolarHBondContact O-N 3.29Å; V102-T104 VanDerWaalsContact C-N 3.3Å; V102-T104 PolarHBondContact O-N 2.86Å; T104-N106 PolarHBondContact O-N 3.41Å; T104-V107 PolarHBondContact O-N 3.14Å; T104-V108 WeakPolarHBondContact O-CG2 3.13Å; T104-V108 PolarHBondContact O-N 2.87Å |
| 105 | G | 81.6 | Confident | 79.1 | Confident | 2 Ų | 2 | 48.1 Ų | 48.1 | 2% | 0.021 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.6 | -45.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L101 V102 V107 V108 I109 | L101-G105 PolarHBondContact O-N 3.3Å; V102-G105 PolarHBondContact O-N 3.41Å; G105-V107 PolarHBondContact O-N 3.41Å; G105-V108 PolarHBondContact O-N 2.89Å; G105-I109 WeakPolarHBondContact O-CG1 3.4Å; G105-I109 PolarHBondContact O-N 3.4Å |
| 106 | N | 83.6 | Confident | 79.1 | Confident | 1 Ų | 1 | 48.5 Ų | 48.5 | 1% | 0.005 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.4 | -44.8 | 176.1 | -76 | -15.7 | 0 | 0 | 0 | 111.7 | A81 F82 V102 L103 T104 V108 I109 F110 | A81-N106 PolarHBondContact O-ND2 3.17Å; F82-N106 HydrophobicContact CD1-CB 4.38Å; F82-N106 HydrophobicContact CE1-CB 3.77Å; F82-N106 HydrophobicContact CZ-CB 3.96Å; V102-N106 PolarHBondContact O-N 2.85Å; L103-N106 PolarHBondContact O-N 3.37Å; T104-N106 PolarHBondContact O-N 3.41Å; N106-V108 PolarHBondContact O-N 3.38Å; N106-I109 PolarHBondContact O-N 3.5Å; N106-F110 HydrophobicContact CB-CD2 4.36Å; N106-F110 HydrophobicContact CB-CE2 4.19Å; N106-F110 WeakPolarHBondContact O-CD2 3.47Å; N106-F110 PolarHBondContact O-N 2.85Å |
| 107 | V | 84.7 | Confident | 78.8 | Confident | 81 Ų | 81 | 45.4 Ų | 45.4 | 49% | 0.491 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -58.4 | -46.3 | 176.4 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | F82 L103 T104 G105 I109 F110 A111 | F82-V107 HydrophobicContact CE1-CG2 4.05Å; F82-V107 HydrophobicContact CZ-CG2 4.14Å; L103-V107 WeakPolarHBondContact O-CG2 3.41Å; L103-V107 PolarHBondContact O-N 2.99Å; T104-V107 PolarHBondContact O-N 3.14Å; G105-V107 PolarHBondContact O-N 3.41Å; V107-I109 VanDerWaalsContact C-N 3.3Å; V107-I109 PolarHBondContact O-N 3.39Å; V107-F110 PolarHBondContact O-N 3.43Å; V107-A111 WeakPolarHBondContact O-CB 3.24Å; V107-A111 PolarHBondContact O-N 2.81Å |
| 108 | V | 84.4 | Confident | 78.6 | Confident | 39 Ų | 39 | 49.5 Ų | 49.5 | 24% | 0.236 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.1 | -41.6 | 179.2 | 173.4 | 0 | 0 | 0 | 0 | 111 | G13 I16 T104 G105 N106 A111 T112 | G13-V108 WeakPolarHBondContact O-CG1 3.38Å; I16-V108 HydrophobicContact CG2-CG1 4.48Å; T104-V108 WeakPolarHBondContact O-CG2 3.13Å; T104-V108 PolarHBondContact O-N 2.87Å; G105-V108 PolarHBondContact O-N 2.89Å; N106-V108 PolarHBondContact O-N 3.38Å; V108-A111 PolarHBondContact O-N 3.03Å; V108-T112 WeakPolarHBondContact O-CB 3.41Å; V108-T112 PolarHBondContact O-N 3.36Å; V108-T112 PolarHBondContact O-OG1 2.87Å |
| 109 | I | 81.6 | Confident | 78.4 | Confident | 13 Ų | 13 | 51.3 Ų | 51.3 | 7% | 0.067 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -75.4 | -38.7 | -177.6 | -60.1 | 169.1 | 0 | 0 | 0 | 111.7 | Y42 G105 N106 V107 A111 T112 I113 | Y42-I109 HydrophobicContact CE1-CB 4.26Å; Y42-I109 HydrophobicContact CE1-CD1 3.92Å; Y42-I109 HydrophobicContact CE1-CG2 3.36Å; Y42-I109 HydrophobicContact CE2-CD1 3.84Å; Y42-I109 WeakPolarHBondContact OH-CB 3.13Å; Y42-I109 WeakPolarHBondContact OH-CD1 3.31Å; Y42-I109 WeakPolarHBondContact OH-CG1 3.08Å; Y42-I109 WeakPolarHBondContact OH-CG2 3.29Å; G105-I109 WeakPolarHBondContact O-CG1 3.4Å; G105-I109 PolarHBondContact O-N 3.4Å; N106-I109 PolarHBondContact O-N 3.5Å; V107-I109 VanDerWaalsContact C-N 3.3Å; V107-I109 PolarHBondContact O-N 3.39Å; I109-A111 VanDerWaalsContact C-N 3.31Å; I109-A111 PolarHBondContact O-N 3.32Å; I109-T112 WeakPolarHBondContact O-CA 3.14Å; I109-T112 WeakPolarHBondContact O-CB 3.31Å; I109-T112 PolarHBondContact O-N 2.91Å; I109-T112 VanDerWaalsContact O-N 3.1Å; I109-I113 HydrophobicContact CG2-CD1 4.16Å; I109-I113 HydrophobicContact CG2-CG1 4.49Å; I109-I113 WeakPolarHBondContact O-CG1 3.32Å; I109-I113 PolarHBondContact O-N 2.93Å |
| 110 | F | 79.4 | Confident | 77.7 | Confident | 37 Ų | 37 | 54.2 Ų | 54.2 | 16% | 0.162 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63 | -38.5 | 171.9 | -74.6 | -59 | 0 | 0 | 0 | 112.1 | V78 A81 F82 N106 V107 T112 I113 L114 | V78-F110 HydrophobicContact CB-CE1 3.87Å; V78-F110 HydrophobicContact CB-CZ 3.87Å; V78-F110 HydrophobicContact CG1-CD1 4.28Å; V78-F110 HydrophobicContact CG1-CD2 4.38Å; V78-F110 HydrophobicContact CG1-CE1 3.91Å; V78-F110 HydrophobicContact CG1-CE2 4Å; V78-F110 HydrophobicContact CG1-CZ 3.78Å; V78-F110 HydrophobicContact CG2-CD1 3.84Å; V78-F110 HydrophobicContact CG2-CE1 3.23Å; V78-F110 HydrophobicContact CG2-CZ 3.77Å; A81-F110 HydrophobicContact CB-CE2 4.22Å; A81-F110 HydrophobicContact CB-CZ 4.06Å; F82-F110 HydrophobicContact CD2-CD2 4.48Å; F82-F110 HydrophobicContact CD2-CE2 4.01Å; F82-F110 AromaticContact CE2-CD2 3.39Å; F82-F110 HydrophobicContact CE2-CD2 3.39Å; F82-F110 AromaticContact CE2-CE2 3.31Å; F82-F110 HydrophobicContact CE2-CE2 3.31Å; F82-F110 HydrophobicContact CE2-CG 4.48Å; F82-F110 HydrophobicContact CE2-CZ 4.37Å; F82-F110 AromaticContact CZ-CD2 3.57Å; F82-F110 HydrophobicContact CZ-CD2 3.57Å; F82-F110 AromaticContact CZ-CE2 3.8Å; F82-F110 HydrophobicContact CZ-CE2 3.8Å; N106-F110 HydrophobicContact CB-CD2 4.36Å; N106-F110 HydrophobicContact CB-CE2 4.19Å; N106-F110 WeakPolarHBondContact O-CD2 3.47Å; N106-F110 PolarHBondContact O-N 2.85Å; V107-F110 PolarHBondContact O-N 3.43Å; F110-T112 VanDerWaalsContact C-N 3.28Å; F110-T112 PolarHBondContact O-N 2.9Å; F110-I113 HydrophobicContact CD1-CD1 4.21Å; F110-I113 PolarHBondContact O-N 2.64Å; F110-L114 WeakPolarHBondContact O-CB 3.3Å; F110-L114 PolarHBondContact O-N 2.89Å |
| 111 | A | 82.6 | Confident | 76.4 | Confident | 58 Ų | 58 | 53.1 Ų | 53.1 | 48% | 0.479 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.1 | -37.7 | 172 | 0 | 0 | 0 | 0 | 0 | 111.8 | V107 V108 I109 L114 G115 | V107-A111 WeakPolarHBondContact O-CB 3.24Å; V107-A111 PolarHBondContact O-N 2.81Å; V108-A111 PolarHBondContact O-N 3.03Å; I109-A111 VanDerWaalsContact C-N 3.31Å; I109-A111 PolarHBondContact O-N 3.32Å; A111-L114 PolarHBondContact O-N 3.27Å; A111-G115 PolarHBondContact O-N 2.84Å |
| 112 | T | 78.3 | Confident | 74.9 | Confident | 24 Ų | 24 | 55 Ų | 55 | 15% | 0.147 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.4 | -42.9 | 175.4 | -54.8 | 0 | 0 | 0 | 0 | 111.3 | L10 V108 I109 F110 G115 F116 | L10-T112 HydrophobicContact CB-CG2 4.02Å; L10-T112 HydrophobicContact CD2-CG2 3.82Å; L10-T112 VanDerWaalsContact CD2-O 3.26Å; L10-T112 WeakPolarHBondContact CD2-O 3.47Å; L10-T112 HydrophobicContact CG-CG2 3.71Å; L10-T112 VanDerWaalsContact O-CG2 3.22Å; L10-T112 WeakPolarHBondContact O-CG2 3.49Å; V108-T112 WeakPolarHBondContact O-CB 3.41Å; V108-T112 PolarHBondContact O-N 3.36Å; V108-T112 PolarHBondContact O-OG1 2.87Å; I109-T112 WeakPolarHBondContact O-CA 3.14Å; I109-T112 WeakPolarHBondContact O-CB 3.31Å; I109-T112 PolarHBondContact O-N 2.91Å; I109-T112 VanDerWaalsContact O-N 3.1Å; F110-T112 VanDerWaalsContact C-N 3.28Å; F110-T112 PolarHBondContact O-N 2.9Å; T112-G115 PolarHBondContact O-N 3.11Å; T112-F116 PolarHBondContact O-N 3.27Å |
| 113 | I | 75.8 | Confident | 73.2 | Confident | 63 Ų | 63 | 58.6 Ų | 58.6 | 32% | 0.323 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -63.7 | -45.1 | 175.7 | -66.1 | 164.6 | 0 | 0 | 0 | 110.9 | I109 F110 G115 F116 F117 | I109-I113 HydrophobicContact CG2-CD1 4.16Å; I109-I113 HydrophobicContact CG2-CG1 4.49Å; I109-I113 WeakPolarHBondContact O-CG1 3.32Å; I109-I113 PolarHBondContact O-N 2.93Å; F110-I113 HydrophobicContact CD1-CD1 4.21Å; F110-I113 PolarHBondContact O-N 2.64Å; I113-G115 VanDerWaalsContact C-N 3.32Å; I113-G115 PolarHBondContact O-N 3.03Å; I113-F116 VanDerWaalsContact O-CB 3.3Å; I113-F116 WeakPolarHBondContact O-CB 3.44Å; I113-F116 PolarHBondContact O-N 3.46Å; I113-F116 VanDerWaalsContact O-N 3.14Å; I113-F117 HydrophobicContact CG2-CD2 3.89Å; I113-F117 HydrophobicContact CG2-CE2 3.79Å; I113-F117 WeakPolarHBondContact O-CD2 3.03Å; I113-F117 PolarHBondContact O-N 3.49Å |
| 114 | L | 74.4 | Confident | 71.4 | Confident | 124 Ų | 124 | 60.4 Ų | 60.4 | 65% | 0.649 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -60.1 | -41.8 | 173.3 | -96.9 | 160.8 | 0 | 0 | 0 | 111.8 | F110 A111 F116 F117 L118 | F110-L114 WeakPolarHBondContact O-CB 3.3Å; F110-L114 PolarHBondContact O-N 2.89Å; A111-L114 PolarHBondContact O-N 3.27Å; L114-F116 VanDerWaalsContact C-N 3.29Å; L114-F116 PolarHBondContact O-N 2.98Å; L114-F117 PolarHBondContact O-N 2.86Å; L114-L118 WeakPolarHBondContact O-CB 3.3Å; L114-L118 PolarHBondContact O-N 3.11Å |
| 115 | G | 77.6 | Confident | 69.4 | Low | 24 Ų | 24 | 64.1 Ų | 64.1 | 25% | 0.247 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.6 | -37.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | A111 T112 I113 V119 | A111-G115 PolarHBondContact O-N 2.84Å; T112-G115 PolarHBondContact O-N 3.11Å; I113-G115 VanDerWaalsContact C-N 3.32Å; I113-G115 PolarHBondContact O-N 3.03Å; G115-V119 VanDerWaalsContact O-CB 3.29Å; G115-V119 WeakPolarHBondContact O-CB 3.5Å; G115-V119 VanDerWaalsContact O-CG2 3.27Å; G115-V119 WeakPolarHBondContact O-CG2 3.32Å; G115-V119 PolarHBondContact O-N 2.98Å |
| 116 | F | 73 | Confident | 67.5 | Low | 54 Ų | 54 | 71.9 Ų | 71.9 | 24% | 0.237 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -61.9 | -51.5 | 172.7 | -170.7 | -96.9 | 0 | 0 | 0 | 110.6 | L10 Y49 T112 I113 L114 L118 V119 F120 | L10-F116 HydrophobicContact CD2-CB 3.52Å; L10-F116 HydrophobicContact CD2-CD2 3.86Å; L10-F116 HydrophobicContact CD2-CG 4.18Å; Y49-F116 AromaticContact CE2-CE1 3.83Å; Y49-F116 HydrophobicContact CE2-CE1 3.83Å; Y49-F116 HydrophobicContact CE2-CZ 4.04Å; T112-F116 PolarHBondContact O-N 3.27Å; I113-F116 VanDerWaalsContact O-CB 3.3Å; I113-F116 WeakPolarHBondContact O-CB 3.44Å; I113-F116 PolarHBondContact O-N 3.46Å; I113-F116 VanDerWaalsContact O-N 3.14Å; L114-F116 VanDerWaalsContact C-N 3.29Å; L114-F116 PolarHBondContact O-N 2.98Å; F116-L118 VanDerWaalsContact C-N 3.32Å; F116-L118 PolarHBondContact O-N 3.14Å; F116-V119 PolarHBondContact O-N 3.29Å; F116-F120 HydrophobicContact CD1-CD2 4.22Å; F116-F120 AromaticContact CD2-CD2 3.45Å; F116-F120 HydrophobicContact CD2-CD2 3.45Å; F116-F120 VanDerWaalsContact CD2-CD2 3.45Å; F116-F120 AromaticContact CD2-CE2 3.6Å; F116-F120 HydrophobicContact CD2-CE2 3.6Å; F116-F120 HydrophobicContact CE1-CB 4.3Å; F116-F120 HydrophobicContact CE1-CD2 4.08Å; F116-F120 HydrophobicContact CE1-CG 4.3Å; F116-F120 AromaticContact CE2-CD2 3.3Å; F116-F120 HydrophobicContact CE2-CD2 3.3Å; F116-F120 AromaticContact CE2-CE2 3.32Å; F116-F120 HydrophobicContact CE2-CE2 3.32Å; F116-F120 HydrophobicContact CE2-CG 4.11Å; F116-F120 HydrophobicContact CE2-CZ 4.13Å; F116-F120 AromaticContact CG-CD2 3.93Å; F116-F120 HydrophobicContact CG-CD2 3.93Å; F116-F120 HydrophobicContact CG-CE2 4.5Å; F116-F120 HydrophobicContact CZ-CB 4.46Å; F116-F120 AromaticContact CZ-CD2 3.64Å; F116-F120 HydrophobicContact CZ-CD2 3.64Å; F116-F120 HydrophobicContact CZ-CE2 4.02Å; F116-F120 AromaticContact CZ-CG 3.99Å; F116-F120 HydrophobicContact CZ-CG 3.99Å; F116-F120 WeakPolarHBondContact O-CB 3.31Å; F116-F120 WeakPolarHBondContact O-CD2 3.38Å; F116-F120 PolarHBondContact O-N 3.44Å |
| 117 | F | 68.3 | Low | 65.4 | Low | 132 Ų | 132 | 75.3 Ų | 75.3 | 58% | 0.579 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -62.6 | -36.1 | 179.1 | -83.6 | -70.4 | 0 | 0 | 0 | 113 | I113 L114 G121 | I113-F117 HydrophobicContact CG2-CD2 3.89Å; I113-F117 HydrophobicContact CG2-CE2 3.79Å; I113-F117 WeakPolarHBondContact O-CD2 3.03Å; I113-F117 PolarHBondContact O-N 3.49Å; L114-F117 PolarHBondContact O-N 2.86Å; F117-G121 WeakPolarHBondContact O-CA 3.1Å; F117-G121 PolarHBondContact O-N 2.83Å |
| 118 | L | 69.9 | Low | 63 | Low | 126 Ų | 126 | 81.7 Ų | 81.7 | 66% | 0.66 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -72.3 | -43.2 | 178 | -167.7 | 154.7 | 0 | 0 | 0 | 110.9 | L114 F116 T122 | L114-L118 WeakPolarHBondContact O-CB 3.3Å; L114-L118 PolarHBondContact O-N 3.11Å; F116-L118 VanDerWaalsContact C-N 3.32Å; F116-L118 PolarHBondContact O-N 3.14Å; L118-T122 WeakPolarHBondContact O-CB 3.34Å; L118-T122 PolarHBondContact O-N 3.22Å; L118-T122 PolarHBondContact O-OG1 3.16Å |
| 119 | V | 67.6 | Low | 60.7 | Low | 40 Ų | 40 | 88.6 Ų | 88.6 | 24% | 0.242 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -68.1 | -44.4 | 178 | 167.5 | 0 | 0 | 0 | 0 | 111.5 | A6 G115 F116 N123 | A6-V119 HydrophobicContact CB-CG1 3.89Å; A6-V119 HydrophobicContact CB-CG2 4.05Å; G115-V119 VanDerWaalsContact O-CB 3.29Å; G115-V119 WeakPolarHBondContact O-CB 3.5Å; G115-V119 VanDerWaalsContact O-CG2 3.27Å; G115-V119 WeakPolarHBondContact O-CG2 3.32Å; G115-V119 PolarHBondContact O-N 2.98Å; F116-V119 PolarHBondContact O-N 3.29Å; V119-N123 PolarHBondContact O-ND2 3.47Å |
| 120 | F | 60.6 | Low | 58.4 | Low | 72 Ų | 72 | 96.1 Ų | 96.1 | 32% | 0.316 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -91.8 | -30.3 | -175.9 | -73.8 | -83.6 | 0 | 0 | 0 | 113.5 | L7 F116 N123 D124 | L7-F120 HydrophobicContact CD1-CZ 4.29Å; L7-F120 HydrophobicContact CD2-CE2 3.74Å; L7-F120 HydrophobicContact CD2-CZ 3.67Å; L7-F120 HydrophobicContact CG-CE2 4.33Å; L7-F120 HydrophobicContact CG-CZ 4Å; F116-F120 HydrophobicContact CD1-CD2 4.22Å; F116-F120 AromaticContact CD2-CD2 3.45Å; F116-F120 HydrophobicContact CD2-CD2 3.45Å; F116-F120 VanDerWaalsContact CD2-CD2 3.45Å; F116-F120 AromaticContact CD2-CE2 3.6Å; F116-F120 HydrophobicContact CD2-CE2 3.6Å; F116-F120 HydrophobicContact CE1-CB 4.3Å; F116-F120 HydrophobicContact CE1-CD2 4.08Å; F116-F120 HydrophobicContact CE1-CG 4.3Å; F116-F120 AromaticContact CE2-CD2 3.3Å; F116-F120 HydrophobicContact CE2-CD2 3.3Å; F116-F120 AromaticContact CE2-CE2 3.32Å; F116-F120 HydrophobicContact CE2-CE2 3.32Å; F116-F120 HydrophobicContact CE2-CG 4.11Å; F116-F120 HydrophobicContact CE2-CZ 4.13Å; F116-F120 AromaticContact CG-CD2 3.93Å; F116-F120 HydrophobicContact CG-CD2 3.93Å; F116-F120 HydrophobicContact CG-CE2 4.5Å; F116-F120 HydrophobicContact CZ-CB 4.46Å; F116-F120 AromaticContact CZ-CD2 3.64Å; F116-F120 HydrophobicContact CZ-CD2 3.64Å; F116-F120 HydrophobicContact CZ-CE2 4.02Å; F116-F120 AromaticContact CZ-CG 3.99Å; F116-F120 HydrophobicContact CZ-CG 3.99Å; F116-F120 WeakPolarHBondContact O-CB 3.31Å; F116-F120 WeakPolarHBondContact O-CD2 3.38Å; F116-F120 PolarHBondContact O-N 3.44Å; F120-N123 CarbonylContact O-C 3.5Å; F120-N123 WeakPolarHBondContact O-CA 3.17Å; F120-N123 WeakPolarHBondContact O-CB 3.5Å; F120-N123 PolarHBondContact O-N 3.49Å; F120-D124 PolarHBondContact O-N 3.42Å; F120-D124 VanDerWaalsContact O-N 3.17Å |
| 121 | G | 54 | Low | 56.3 | Low | 31 Ų | 31 | 109.4 Ų | 109.4 | 32% | 0.32 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -72.4 | -29.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | F117 N123 D124 | F117-G121 WeakPolarHBondContact O-CA 3.1Å; F117-G121 PolarHBondContact O-N 2.83Å; G121-N123 PolarHBondContact O-N 3Å; G121-D124 PolarHBondContact O-N 3.26Å |
| 122 | T | 47.8 | Very low | 55 | Low | 93 Ų | 93 | 112 Ų | 112 | 57% | 0.571 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68 | -19.1 | 165.4 | -71.9 | 0 | 0 | 0 | 0 | 112.3 | L118 | L118-T122 WeakPolarHBondContact O-CB 3.34Å; L118-T122 PolarHBondContact O-N 3.22Å; L118-T122 PolarHBondContact O-OG1 3.16Å |
| 123 | N | 42.8 | Very low | 53.7 | Low | 79 Ų | 79 | 116.6 Ų | 116.6 | 42% | 0.422 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.4 | -8.9 | 175.6 | -76.5 | -89.4 | 0 | 0 | 0 | 113.5 | V119 F120 G121 D125 F126 | V119-N123 PolarHBondContact O-ND2 3.47Å; F120-N123 CarbonylContact O-C 3.5Å; F120-N123 WeakPolarHBondContact O-CA 3.17Å; F120-N123 WeakPolarHBondContact O-CB 3.5Å; F120-N123 PolarHBondContact O-N 3.49Å; G121-N123 PolarHBondContact O-N 3Å; N123-D125 PolarHBondContact O-N 2.94Å; N123-F126 WeakPolarHBondContact O-CA 3.25Å; N123-F126 WeakPolarHBondContact O-CB 3.27Å; N123-F126 PolarHBondContact O-N 3.32Å |
| 124 | D | 45.6 | Very low | 52.5 | Low | 104 Ų | 104 | 119.6 Ų | 119.6 | 56% | 0.556 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -18.3 | 169.1 | -74.2 | -46.1 | 0 | 0 | 0 | 111.9 | F120 G121 F126 | F120-D124 PolarHBondContact O-N 3.42Å; F120-D124 VanDerWaalsContact O-N 3.17Å; G121-D124 PolarHBondContact O-N 3.26Å; D124-F126 VanDerWaalsContact C-N 3.31Å |
| 125 | D | 44.6 | Very low | 51.2 | Low | 150 Ų | 150 | 119.4 Ų | 119.4 | 80% | 0.802 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -12.4 | 164.9 | -70.1 | -41.2 | 0 | 0 | 0 | 112.8 | N123 | N123-D125 PolarHBondContact O-N 2.94Š|
| 126 | F | 40.5 | Very low | 49.6 | Very low | 164 Ų | 164 | 125.3 Ų | 125.3 | 72% | 0.719 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -99.4 | -1.3 | -176.3 | -135.9 | -90.5 | 0 | 0 | 0 | 113.7 | N123 D124 | N123-F126 WeakPolarHBondContact O-CA 3.25Å; N123-F126 WeakPolarHBondContact O-CB 3.27Å; N123-F126 PolarHBondContact O-N 3.32Å; D124-F126 VanDerWaalsContact C-N 3.31Å |
| 127 | S | 39.3 | Very low | 48 | Very low | 73 Ų | 73 | 130.1 Ų | 130.1 | 51% | 0.51 | 63% | 0.625 | S | S | . | * | S | Bend | trans | -138.4 | 40.7 | -174.6 | 67.6 | 0 | 0 | 0 | 0 | 115.9 | ||
| 128 | W | 35.3 | Very low | 46.6 | Very low | 216 Ų | 216 | 129.9 Ų | 129.9 | 82% | 0.818 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -115.4 | 14.6 | 154 | -71.8 | 111.3 | 0 | 0 | 0 | 113.6 | ||
| 129 | Q | 35.1 | Very low | 44.8 | Very low | 183 Ų | 183 | 130.2 Ų | 130.2 | 86% | 0.855 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -126.9 | 3.6 | 179.1 | -105 | -173.4 | -135.8 | 0 | 0 | 116.4 | ||
| 130 | Q | 34.2 | Very low | 42.9 | Very low | 171 Ų | 171 | 137.8 Ų | 137.8 | 80% | 0.799 | 66% | 0.657 | S | S | * | * | trans | -136.4 | 48.1 | -179.4 | -70.4 | -126.6 | -90.4 | 0 | 0 | 114.3 | ||||
| 131 | W | 34.6 | Very low | 41.3 | Very low | 317 Ų | 317 | 143.7 Ų | 143.7 | 100% | 1.201 | 69% | 0.689 | S | S | * | * | trans | 179.3 | 0 | 133.9 | 60.2 | -61.6 | 0 | 0 | 0 | 108.3 |
Retrieved 131 of 131 residues in 908.2 ms
(Link to these results)