| 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 | 48.8 | Very low | 71.5 | Confident | 195 Ų | 195 | 84.1 Ų | 84.1 | 96% | 0.961 | 50% | 0.501 | S | S | * | . | 0 | -23.8 | 0 | -148.9 | 171.5 | -86.1 | 0 | 0 | 114.1 | |||||
| 2 | A | 55.8 | Low | 72.6 | Confident | 83 Ų | 83 | 88.6 Ų | 88.6 | 69% | 0.686 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -66.7 | -39 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | I4 K5 A6 | A2-I4 PolarHBondContact O-N 3.43Å; A2-K5 PolarHBondContact O-N 2.86Å; A2-A6 PolarHBondContact O-N 3.45Å |
| 3 | G | 64 | Low | 73.4 | Confident | 26 Ų | 26 | 84.2 Ų | 84.2 | 27% | 0.268 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.3 | -40 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | K5 A6 L7 | G3-K5 PolarHBondContact O-N 2.79Å; G3-A6 PolarHBondContact O-N 3.16Å; G3-L7 WeakPolarHBondContact O-CB 3.23Å; G3-L7 PolarHBondContact O-N 2.95Å |
| 4 | I | 74.1 | Confident | 73.9 | Confident | 116 Ų | 116 | 79.1 Ų | 79.1 | 60% | 0.595 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -63.5 | -42.3 | -179.8 | -62.8 | 164.2 | 0 | 0 | 0 | 111.1 | A2 A6 L7 V8 | A2-I4 PolarHBondContact O-N 3.43Å; I4-A6 VanDerWaalsContact C-N 3.34Å; I4-A6 PolarHBondContact O-N 3.25Å; I4-L7 PolarHBondContact O-N 2.77Å; I4-V8 HydrophobicContact CG2-CG2 4.41Å; I4-V8 VanDerWaalsContact O-CG2 3.28Å; I4-V8 WeakPolarHBondContact O-CG2 3.28Å; I4-V8 PolarHBondContact O-N 3.48Å |
| 5 | K | 69.4 | Low | 74.6 | Confident | 159 Ų | 159 | 77 Ų | 77 | 69% | 0.691 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -64.4 | -40.1 | 178.8 | -65.1 | -176 | 178 | -174.4 | 0 | 111.6 | A2 G3 G9 | A2-K5 PolarHBondContact O-N 2.86Å; G3-K5 PolarHBondContact O-N 2.79Å; K5-G9 PolarHBondContact O-N 2.63Å; K5-G9 VanDerWaalsContact O-N 3.08Å |
| 6 | A | 73.7 | Confident | 75.2 | Confident | 32 Ų | 32 | 77.6 Ų | 77.6 | 26% | 0.264 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -65.5 | -43.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | A2 G3 I4 V8 G9 L10 V119 | A2-A6 PolarHBondContact O-N 3.45Å; G3-A6 PolarHBondContact O-N 3.16Å; I4-A6 VanDerWaalsContact C-N 3.34Å; I4-A6 PolarHBondContact O-N 3.25Å; A6-V8 PolarHBondContact O-N 3.36Å; A6-G9 PolarHBondContact O-N 2.93Å; A6-L10 WeakPolarHBondContact O-CB 3.18Å; A6-L10 VanDerWaalsContact O-CG 3.22Å; A6-L10 WeakPolarHBondContact O-CG 3.43Å; A6-L10 PolarHBondContact O-N 3.08Å; A6-V119 HydrophobicContact CB-CG1 3.96Å; A6-V119 HydrophobicContact CB-CG2 4.26Å |
| 7 | L | 76.4 | Confident | 75.6 | Confident | 95 Ų | 95 | 73 Ų | 73 | 50% | 0.497 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.7 | -42.1 | 178.8 | -136.5 | 148.7 | 0 | 0 | 0 | 112 | G3 I4 L10 S11 F120 | G3-L7 WeakPolarHBondContact O-CB 3.23Å; G3-L7 PolarHBondContact O-N 2.95Å; I4-L7 PolarHBondContact O-N 2.77Å; L7-L10 PolarHBondContact O-N 3.3Å; L7-S11 WeakPolarHBondContact O-CB 3.29Å; L7-S11 PolarHBondContact O-N 3.17Å; L7-F120 HydrophobicContact CD1-CZ 3.92Å; L7-F120 HydrophobicContact CG-CZ 4.43Å |
| 8 | V | 82.4 | Confident | 75.6 | Confident | 72 Ų | 72 | 73 Ų | 73 | 44% | 0.436 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -63 | -46.8 | 174.2 | 173 | 0 | 0 | 0 | 0 | 110.5 | I4 A6 L10 S11 F12 | I4-V8 HydrophobicContact CG2-CG2 4.41Å; I4-V8 VanDerWaalsContact O-CG2 3.28Å; I4-V8 WeakPolarHBondContact O-CG2 3.28Å; I4-V8 PolarHBondContact O-N 3.48Å; A6-V8 PolarHBondContact O-N 3.36Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.97Å; V8-S11 PolarHBondContact O-N 3.49Å; V8-F12 HydrophobicContact CG1-CD2 3.71Å; V8-F12 HydrophobicContact CG1-CE2 3.64Å; V8-F12 VanDerWaalsContact O-CD2 3.28Å; V8-F12 WeakPolarHBondContact O-CD2 3.45Å; V8-F12 PolarHBondContact O-N 3.38Å |
| 9 | G | 81.4 | Confident | 75.9 | Confident | 39 Ų | 39 | 73.2 Ų | 73.2 | 40% | 0.402 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -58.6 | -43.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | K5 A6 F12 S13 | K5-G9 PolarHBondContact O-N 2.63Å; K5-G9 VanDerWaalsContact O-N 3.08Å; A6-G9 PolarHBondContact O-N 2.93Å; G9-F12 PolarHBondContact O-N 3.43Å; G9-S13 PolarHBondContact O-N 3Å; G9-S13 PolarHBondContact O-OG 3.28Å |
| 10 | L | 77.7 | Confident | 75.8 | Confident | 26 Ų | 26 | 74 Ų | 74 | 14% | 0.136 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -65.2 | -38.3 | 176.8 | -69.3 | 165.6 | 0 | 0 | 0 | 112.2 | A6 L7 V8 S13 G14 T112 F116 F120 | A6-L10 WeakPolarHBondContact O-CB 3.18Å; A6-L10 VanDerWaalsContact O-CG 3.22Å; A6-L10 WeakPolarHBondContact O-CG 3.43Å; A6-L10 PolarHBondContact O-N 3.08Å; L7-L10 PolarHBondContact O-N 3.3Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.97Å; L10-S13 WeakPolarHBondContact CA-OG 3.37Å; L10-S13 PolarHBondContact O-OG 2.89Å; L10-G14 PolarHBondContact O-N 3.49Å; L10-T112 HydrophobicContact CB-CG2 4.16Å; L10-T112 HydrophobicContact CD2-CG2 3.92Å; L10-T112 VanDerWaalsContact CD2-O 3.32Å; L10-T112 WeakPolarHBondContact CD2-O 3.41Å; L10-T112 WeakPolarHBondContact O-CG2 3.26Å; L10-F116 HydrophobicContact CD1-CB 4.22Å; L10-F116 HydrophobicContact CD1-CD2 4.17Å; L10-F120 HydrophobicContact CD1-CE2 4.28Å |
| 11 | S | 82.3 | Confident | 75.6 | Confident | 82 Ų | 82 | 71 Ų | 71 | 57% | 0.573 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -66.2 | -43.2 | 176.2 | -178.3 | 0 | 0 | 0 | 0 | 111.8 | L7 V8 G14 A15 | L7-S11 WeakPolarHBondContact O-CB 3.29Å; L7-S11 PolarHBondContact O-N 3.17Å; V8-S11 PolarHBondContact O-N 3.49Å; S11-G14 PolarHBondContact O-N 2.87Å; S11-A15 WeakPolarHBondContact O-CB 3.43Å; S11-A15 PolarHBondContact O-N 3.04Å |
| 12 | F | 85.1 | Confident | 76.7 | Confident | 138 Ų | 138 | 67 Ų | 67 | 61% | 0.605 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -64.6 | -43.3 | 176 | -86.1 | -74.3 | 0 | 0 | 0 | 112.2 | V8 G9 G14 A15 I16 | V8-F12 HydrophobicContact CG1-CD2 3.71Å; V8-F12 HydrophobicContact CG1-CE2 3.64Å; V8-F12 VanDerWaalsContact O-CD2 3.28Å; V8-F12 WeakPolarHBondContact O-CD2 3.45Å; V8-F12 PolarHBondContact O-N 3.38Å; G9-F12 PolarHBondContact O-N 3.43Å; F12-G14 VanDerWaalsContact C-N 3.35Å; F12-A15 PolarHBondContact O-N 3.36Å; F12-I16 VanDerWaalsContact O-CG1 3.26Å; F12-I16 WeakPolarHBondContact O-CG1 3.19Å; F12-I16 PolarHBondContact O-N 3.45Å |
| 13 | S | 83.1 | Confident | 77.3 | Confident | 31 Ų | 31 | 67.8 Ų | 67.8 | 22% | 0.217 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -64.8 | -40.1 | 176.9 | 64.5 | 0 | 0 | 0 | 0 | 111.8 | G9 L10 I16 G17 V108 T112 | G9-S13 PolarHBondContact O-N 3Å; G9-S13 PolarHBondContact O-OG 3.28Å; L10-S13 WeakPolarHBondContact CA-OG 3.37Å; L10-S13 PolarHBondContact O-OG 2.89Å; S13-I16 PolarHBondContact O-N 3.07Å; S13-G17 PolarHBondContact O-N 2.94Å; S13-V108 VanDerWaalsContact O-CG1 3.22Å; S13-V108 WeakPolarHBondContact O-CG1 3.31Å; S13-T112 WeakPolarHBondContact CB-OG1 3.43Å; S13-T112 VanDerWaalsContact OG-CG2 3.31Å; S13-T112 WeakPolarHBondContact OG-CG2 3.46Å; S13-T112 PolarHBondContact OG-OG1 3.31Å |
| 14 | G | 80.8 | Confident | 77.4 | Confident | 14 Ų | 14 | 66.9 Ų | 66.9 | 14% | 0.144 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -60.9 | -45.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L10 S11 F12 I16 G17 L18 | L10-G14 PolarHBondContact O-N 3.49Å; S11-G14 PolarHBondContact O-N 2.87Å; F12-G14 VanDerWaalsContact C-N 3.35Å; G14-I16 PolarHBondContact O-N 3.09Å; G14-G17 PolarHBondContact O-N 3.44Å; G14-L18 WeakPolarHBondContact O-CG 3.22Å; G14-L18 PolarHBondContact O-N 2.77Å |
| 15 | A | 84 | Confident | 76.7 | Confident | 47 Ų | 47 | 63.1 Ų | 63.1 | 39% | 0.388 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -61.3 | -43.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | S11 F12 G17 L18 T19 | S11-A15 WeakPolarHBondContact O-CB 3.43Å; S11-A15 PolarHBondContact O-N 3.04Å; F12-A15 PolarHBondContact O-N 3.36Å; A15-G17 PolarHBondContact O-N 3.29Å; A15-L18 PolarHBondContact O-N 3.27Å; A15-T19 WeakPolarHBondContact O-CB 3.4Å; A15-T19 PolarHBondContact O-N 3.26Å; A15-T19 PolarHBondContact O-OG1 3.42Å |
| 16 | I | 84.3 | Confident | 76.1 | Confident | 86 Ų | 86 | 59.4 Ų | 59.4 | 44% | 0.441 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.7 | -47.5 | 175.5 | -69.7 | 165.1 | 0 | 0 | 0 | 110.4 | F12 S13 G14 L18 T19 F20 | F12-I16 VanDerWaalsContact O-CG1 3.26Å; F12-I16 WeakPolarHBondContact O-CG1 3.19Å; F12-I16 PolarHBondContact O-N 3.45Å; S13-I16 PolarHBondContact O-N 3.07Å; G14-I16 PolarHBondContact O-N 3.09Å; I16-L18 PolarHBondContact O-N 3.07Å; I16-T19 PolarHBondContact O-N 3.19Å; I16-T19 VanDerWaalsContact O-N 3.16Å; I16-F20 HydrophobicContact CG2-CD2 3.65Å; I16-F20 HydrophobicContact CG2-CE2 3.58Å; I16-F20 VanDerWaalsContact O-CD2 3.29Å; I16-F20 WeakPolarHBondContact O-CD2 2.9Å; I16-F20 PolarHBondContact O-N 3.15Å |
| 17 | G | 81.2 | Confident | 75.2 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -58.5 | -45.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | S13 G14 A15 T19 F20 L21 | S13-G17 PolarHBondContact O-N 2.94Å; G14-G17 PolarHBondContact O-N 3.44Å; A15-G17 PolarHBondContact O-N 3.29Å; G17-T19 VanDerWaalsContact C-N 3.32Å; G17-T19 PolarHBondContact O-N 3.08Å; G17-F20 PolarHBondContact O-N 3.02Å; G17-L21 PolarHBondContact O-N 3.28Å |
| 18 | L | 76.3 | Confident | 73.7 | Confident | 73 Ų | 73 | 67.9 Ų | 67.9 | 38% | 0.382 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.9 | -37.2 | 175.5 | -71.3 | 172.7 | 0 | 0 | 0 | 112.3 | G14 A15 I16 L21 L22 | G14-L18 WeakPolarHBondContact O-CG 3.22Å; G14-L18 PolarHBondContact O-N 2.77Å; A15-L18 PolarHBondContact O-N 3.27Å; I16-L18 PolarHBondContact O-N 3.07Å; L18-L21 WeakPolarHBondContact O-CB 3.08Å; L18-L21 PolarHBondContact O-N 3.47Å; L18-L22 WeakPolarHBondContact O-CB 3.48Å; L18-L22 WeakPolarHBondContact O-CG 3.28Å; L18-L22 PolarHBondContact O-N 3.19Å |
| 19 | T | 81 | Confident | 72 | Confident | 76 Ų | 76 | 72.3 Ų | 72.3 | 47% | 0.466 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -67.9 | -43.1 | 179.1 | -49.1 | 0 | 0 | 0 | 0 | 110.9 | A15 I16 G17 L21 L22 L23 | A15-T19 WeakPolarHBondContact O-CB 3.4Å; A15-T19 PolarHBondContact O-N 3.26Å; A15-T19 PolarHBondContact O-OG1 3.42Å; I16-T19 PolarHBondContact O-N 3.19Å; I16-T19 VanDerWaalsContact O-N 3.16Å; G17-T19 VanDerWaalsContact C-N 3.32Å; G17-T19 PolarHBondContact O-N 3.08Å; T19-L21 VanDerWaalsContact C-N 3.31Å; T19-L21 PolarHBondContact O-N 2.99Å; T19-L22 PolarHBondContact O-N 2.97Å; T19-L23 HydrophobicContact CG2-CD1 3.88Å; T19-L23 VanDerWaalsContact O-CD1 3.23Å; T19-L23 WeakPolarHBondContact O-CD1 3.37Å; T19-L23 PolarHBondContact O-N 2.96Å |
| 20 | F | 74.9 | Confident | 70.6 | Confident | 89 Ų | 89 | 71.3 Ų | 71.3 | 39% | 0.39 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61 | -39.6 | 172.2 | -86.4 | -74.9 | 0 | 0 | 0 | 112.2 | I16 G17 L23 G24 L101 | I16-F20 HydrophobicContact CG2-CD2 3.65Å; I16-F20 HydrophobicContact CG2-CE2 3.58Å; I16-F20 VanDerWaalsContact O-CD2 3.29Å; I16-F20 WeakPolarHBondContact O-CD2 2.9Å; I16-F20 PolarHBondContact O-N 3.15Å; G17-F20 PolarHBondContact O-N 3.02Å; F20-L23 PolarHBondContact O-N 3.27Å; F20-G24 PolarHBondContact O-N 3.22Å; F20-L101 HydrophobicContact CD1-CD2 3.71Å; F20-L101 HydrophobicContact CD1-CG 4.05Å; F20-L101 HydrophobicContact CE1-CD2 4.44Å; F20-L101 WeakPolarHBondContact O-CD2 3.22Å |
| 21 | L | 71.9 | Confident | 68.9 | Low | 13 Ų | 13 | 73.2 Ų | 73.2 | 7% | 0.068 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -63 | -45.4 | 175.8 | -145.2 | 83.8 | 0 | 0 | 0 | 111.5 | G17 L18 T19 G24 C25 V102 N106 | G17-L21 PolarHBondContact O-N 3.28Å; L18-L21 WeakPolarHBondContact O-CB 3.08Å; L18-L21 PolarHBondContact O-N 3.47Å; T19-L21 VanDerWaalsContact C-N 3.31Å; T19-L21 PolarHBondContact O-N 2.99Å; L21-G24 PolarHBondContact O-N 3.34Å; L21-C25 PolarHBondContact O-N 3.4Å; L21-V102 HydrophobicContact CD1-CG1 4.19Å; L21-N106 WeakPolarHBondContact CD1-OD1 3.22Å |
| 22 | L | 71.1 | Confident | 67.2 | Low | 111 Ų | 111 | 71 Ų | 71 | 58% | 0.581 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -65.9 | -41.9 | 178 | -76.3 | 169.4 | 0 | 0 | 0 | 112.1 | L18 T19 G24 C25 A26 | L18-L22 WeakPolarHBondContact O-CB 3.48Å; L18-L22 WeakPolarHBondContact O-CG 3.28Å; L18-L22 PolarHBondContact O-N 3.19Å; T19-L22 PolarHBondContact O-N 2.97Å; L22-G24 PolarHBondContact O-N 3.34Å; L22-C25 CarbonylContact O-C 3.56Å; L22-C25 PolarHBondContact O-N 2.92Å; L22-A26 WeakPolarHBondContact O-CB 3.48Å; L22-A26 PolarHBondContact O-N 3.41Å |
| 23 | L | 68.4 | Low | 65.6 | Low | 99 Ų | 99 | 73.3 Ų | 73.3 | 52% | 0.518 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62 | -34 | 174.3 | -96.5 | 75.6 | 0 | 0 | 0 | 112 | T19 F20 C25 L101 | T19-L23 HydrophobicContact CG2-CD1 3.88Å; T19-L23 VanDerWaalsContact O-CD1 3.23Å; T19-L23 WeakPolarHBondContact O-CD1 3.37Å; T19-L23 PolarHBondContact O-N 2.96Å; F20-L23 PolarHBondContact O-N 3.27Å; L23-C25 VanDerWaalsContact C-N 3.26Å; L23-C25 PolarHBondContact O-N 2.96Å; L23-L101 HydrophobicContact CB-CD2 3.56Å; L23-L101 HydrophobicContact CD2-CD2 4.43Å |
| 24 | G | 66.4 | Low | 63.9 | Low | 6 Ų | 6 | 79.4 Ų | 79.4 | 6% | 0.062 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -65.2 | -26.4 | 173 | 0 | 0 | 0 | 0 | 0 | 114 | F20 L21 L22 | F20-G24 PolarHBondContact O-N 3.22Å; L21-G24 PolarHBondContact O-N 3.34Å; L22-G24 PolarHBondContact O-N 3.34Å |
| 25 | C | 59.7 | Low | 62.5 | Low | 37 Ų | 37 | 79.3 Ų | 79.3 | 25% | 0.25 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -98.6 | -28.1 | 178.8 | -94.9 | 0 | 0 | 0 | 0 | 114.7 | L21 L22 L23 P35 | L21-C25 PolarHBondContact O-N 3.4Å; L22-C25 CarbonylContact O-C 3.56Å; L22-C25 PolarHBondContact O-N 2.92Å; L23-C25 VanDerWaalsContact C-N 3.26Å; L23-C25 PolarHBondContact O-N 2.96Å; C25-P35 WeakPolarHBondContact SG-CG 3.36Å |
| 26 | A | 56 | Low | 61.1 | Low | 81 Ų | 81 | 81.2 Ų | 81.2 | 67% | 0.669 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -90.3 | -7.8 | -170.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | L22 E28 | L22-A26 WeakPolarHBondContact O-CB 3.48Å; L22-A26 PolarHBondContact O-N 3.41Å; A26-E28 PolarHBondContact O-N 2.97Å |
| 27 | L | 54 | Low | 59.6 | Low | 107 Ų | 107 | 82.6 Ų | 82.6 | 56% | 0.56 | 43% | 0.428 | S | S | * | . | S | Bend | trans | -69.9 | 118.5 | 174.7 | -151.4 | 77.3 | 0 | 0 | 0 | 108.9 | Q29 Y30 | L27-Q29 PolarHBondContact O-N 3.42Å; L27-Y30 HydrophobicContact CB-CD2 4.21Å; L27-Y30 HydrophobicContact CD2-CE2 4.29Å; L27-Y30 PolarHBondContact O-N 2.86Å |
| 28 | E | 45.8 | Very low | 58.4 | Low | 199 Ų | 199 | 83 Ų | 83 | 93% | 0.93 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | -11.6 | -168 | -166.8 | 154.2 | 76.2 | 0 | 0 | 116 | A26 Y30 | A26-E28 PolarHBondContact O-N 2.97Å; E28-Y30 VanDerWaalsContact C-N 3.34Å |
| 29 | Q | 46.6 | Very low | 57.4 | Low | 164 Ų | 164 | 82.4 Ų | 82.4 | 77% | 0.766 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.9 | -6.3 | 174.1 | -143.8 | 161.1 | -4.2 | 0 | 0 | 113.9 | L27 | L27-Q29 PolarHBondContact O-N 3.42Š|
| 30 | Y | 51.5 | Low | 56.2 | Low | 19 Ų | 19 | 82.5 Ų | 82.5 | 8% | 0.075 | 42% | 0.424 | C | S | . | . | trans | -122.8 | 67.4 | -175.5 | -65.9 | -101.9 | 0 | 0 | 0 | 110.9 | L27 E28 V32 I94 Q95 A98 | L27-Y30 HydrophobicContact CB-CD2 4.21Å; L27-Y30 HydrophobicContact CD2-CE2 4.29Å; L27-Y30 PolarHBondContact O-N 2.86Å; E28-Y30 VanDerWaalsContact C-N 3.34Å; Y30-V32 PolarHBondContact O-N 3.04Å; Y30-I94 HydrophobicContact CD1-CB 4.1Å; Y30-I94 HydrophobicContact CD1-CG1 4.08Å; Y30-I94 HydrophobicContact CD1-CG2 4.05Å; Y30-I94 HydrophobicContact CE1-CB 3.79Å; Y30-I94 HydrophobicContact CE1-CG1 4.28Å; Y30-I94 HydrophobicContact CE1-CG2 3.48Å; Y30-I94 VanDerWaalsContact CE1-CG2 3.48Å; Y30-Q95 HydrophobicContact CE1-CB 4.42Å; Y30-Q95 HydrophobicContact CE2-CG 4.49Å; Y30-Q95 VanDerWaalsContact CZ-N 3.32Å; Y30-Q95 WeakPolarHBondContact OH-CA 3.19Å; Y30-Q95 WeakPolarHBondContact OH-CB 3.43Å; Y30-Q95 WeakPolarHBondContact OH-CG 3.4Å; Y30-Q95 PolarHBondContact OH-N 3.47Å; Y30-Q95 PolarHBondContact OH-O 3.42Å; Y30-Q95 VanDerWaalsContact OH-O 3.09Å; Y30-A98 HydrophobicContact CD1-CB 3.97Å; Y30-A98 HydrophobicContact CD2-CB 4.46Å; Y30-A98 HydrophobicContact CE1-CB 3.29Å; Y30-A98 HydrophobicContact CE2-CB 3.94Å; Y30-A98 HydrophobicContact CG-CB 4.45Å; Y30-A98 VanDerWaalsContact OH-CB 3.22Å; Y30-A98 WeakPolarHBondContact OH-CB 3.3Å; Y30-A98 PolarHBondContact OH-N 3.27Å | ||
| 31 | G | 42.1 | Very low | 55.1 | Low | 66 Ų | 66 | 80.6 Ų | 80.6 | 68% | 0.68 | 42% | 0.416 | S | S | * | . | trans | -68.9 | 45 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 32 | V | 48.2 | Very low | 54.2 | Low | 35 Ų | 35 | 82.9 Ų | 82.9 | 21% | 0.212 | 42% | 0.424 | C | S | . | . | trans | -126.7 | 100.3 | -176.3 | -159.6 | 0 | 0 | 0 | 0 | 109.7 | Y30 W34 P35 | Y30-V32 PolarHBondContact O-N 3.04Å; V32-W34 HydrophobicContact CG1-CB 3.94Å; V32-W34 HydrophobicContact CG1-CG 4.23Å; V32-W34 PolarHBondContact O-N 2.93Å; V32-W34 VanDerWaalsContact O-N 3.15Å; V32-P35 WeakPolarHBondContact O-CD 3.41Å | ||
| 33 | Y | 49.7 | Very low | 53.4 | Low | 187 Ų | 187 | 83.4 Ų | 83.4 | 73% | 0.733 | 43% | 0.426 | S | S | * | . | trans | -71.4 | 2.8 | 178 | -56.2 | -88.4 | 0 | 0 | 0 | 113.9 | L36 | Y33-L36 HydrophobicContact CD1-CD1 4.24Å; Y33-L36 VanDerWaalsContact O-CB 3.29Å; Y33-L36 WeakPolarHBondContact O-CB 3.46Å; Y33-L36 PolarHBondContact O-N 2.94Å; Y33-L36 VanDerWaalsContact O-N 3.16Å | ||
| 34 | W | 47.7 | Very low | 52.6 | Low | 158 Ų | 158 | 81.1 Ų | 81.1 | 60% | 0.598 | 41% | 0.414 | S | S | * | . | G | 310 helix | trans | -59.9 | -32 | -177.6 | -95.4 | 71.1 | 0 | 0 | 0 | 116 | V32 L36 F37 L84 L88 | V32-W34 HydrophobicContact CG1-CB 3.94Å; V32-W34 HydrophobicContact CG1-CG 4.23Å; V32-W34 PolarHBondContact O-N 2.93Å; V32-W34 VanDerWaalsContact O-N 3.15Å; W34-L36 PolarHBondContact O-N 3.45Å; W34-L36 VanDerWaalsContact O-N 3.17Å; W34-F37 WeakPolarHBondContact O-CB 3.31Å; W34-F37 PolarHBondContact O-N 3.25Å; W34-F37 VanDerWaalsContact O-N 3.08Å; W34-L84 HydrophobicContact CE3-CD2 4.16Å; W34-L88 HydrophobicContact CB-CD2 3.69Å; W34-L88 HydrophobicContact CE3-CD1 4.39Å; W34-L88 HydrophobicContact CG-CD2 4.35Å |
| 35 | P | 52.1 | Low | 51.9 | Low | 13 Ų | 13 | 82.7 Ų | 82.7 | 8% | 0.084 | 42% | 0.424 | C | S | . | . | G | 310 helix | trans | -64.7 | -17.4 | 176.4 | -20.8 | 33.7 | 0 | 0 | 0 | 113.5 | C25 V32 F37 V38 I94 | C25-P35 WeakPolarHBondContact SG-CG 3.36Å; V32-P35 WeakPolarHBondContact O-CD 3.41Å; P35-F37 PolarHBondContact O-N 3.42Å; P35-F37 VanDerWaalsContact O-N 3.14Å; P35-V38 VanDerWaalsContact O-CB 3.3Å; P35-V38 WeakPolarHBondContact O-CB 3.4Å; P35-V38 WeakPolarHBondContact O-CG2 3.17Å; P35-V38 PolarHBondContact O-N 2.96Å; P35-I94 HydrophobicContact CG-CD1 4.45Å |
| 36 | L | 54.4 | Low | 51.4 | Low | 87 Ų | 87 | 83.6 Ų | 83.6 | 46% | 0.455 | 43% | 0.429 | S | S | . | . | G | 310 helix | trans | -62 | -15 | 171.1 | -87.7 | 145.3 | 0 | 0 | 0 | 113.4 | Y33 W34 V38 L39 | Y33-L36 HydrophobicContact CD1-CD1 4.24Å; Y33-L36 VanDerWaalsContact O-CB 3.29Å; Y33-L36 WeakPolarHBondContact O-CB 3.46Å; Y33-L36 PolarHBondContact O-N 2.94Å; Y33-L36 VanDerWaalsContact O-N 3.16Å; W34-L36 PolarHBondContact O-N 3.45Å; W34-L36 VanDerWaalsContact O-N 3.17Å; L36-V38 PolarHBondContact O-N 3.02Å; L36-L39 HydrophobicContact CD2-CB 4.36Å; L36-L39 HydrophobicContact CD2-CD1 3.43Å; L36-L39 VanDerWaalsContact CD2-CD1 3.43Å; L36-L39 HydrophobicContact CG-CD1 4.39Å; L36-L39 WeakPolarHBondContact O-CB 3.29Å; L36-L39 PolarHBondContact O-N 3.5Å |
| 37 | F | 53.3 | Low | 51.3 | Low | 114 Ų | 114 | 83.2 Ų | 83.2 | 50% | 0.5 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -65.6 | -25.1 | 171.3 | -134.2 | -87.3 | 0 | 0 | 0 | 112.2 | W34 P35 L39 I40 F41 | W34-F37 WeakPolarHBondContact O-CB 3.31Å; W34-F37 PolarHBondContact O-N 3.25Å; W34-F37 VanDerWaalsContact O-N 3.08Å; P35-F37 PolarHBondContact O-N 3.42Å; P35-F37 VanDerWaalsContact O-N 3.14Å; F37-L39 PolarHBondContact O-N 3.2Å; F37-I40 HydrophobicContact CD1-CD1 4.31Å; F37-I40 HydrophobicContact CD2-CD1 4.05Å; F37-I40 HydrophobicContact CE1-CD1 4.27Å; F37-I40 HydrophobicContact CE2-CD1 4Å; F37-I40 HydrophobicContact CG-CD1 4.21Å; F37-I40 HydrophobicContact CZ-CD1 4.12Å; F37-I40 WeakPolarHBondContact O-CB 3.46Å; F37-I40 PolarHBondContact O-N 3.01Å; F37-F41 PolarHBondContact O-N 3.17Å |
| 38 | V | 55.2 | Low | 51 | Low | 8 Ų | 8 | 79.2 Ų | 79.2 | 5% | 0.048 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -67 | -28.4 | 172 | -177.9 | 0 | 0 | 0 | 0 | 111.1 | P35 L36 I40 F41 Y42 A81 | P35-V38 VanDerWaalsContact O-CB 3.3Å; P35-V38 WeakPolarHBondContact O-CB 3.4Å; P35-V38 WeakPolarHBondContact O-CG2 3.17Å; P35-V38 PolarHBondContact O-N 2.96Å; L36-V38 PolarHBondContact O-N 3.02Å; V38-I40 VanDerWaalsContact C-N 3.33Å; V38-F41 WeakPolarHBondContact O-CB 3.3Å; V38-F41 PolarHBondContact O-N 3.4Å; V38-Y42 PolarHBondContact O-N 3.3Å; V38-A81 HydrophobicContact CG1-CB 4.26Å |
| 39 | L | 56.1 | Low | 51.3 | Low | 62 Ų | 62 | 73 Ų | 73 | 33% | 0.325 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -67.6 | -32 | 173.4 | -108.3 | 156.3 | 0 | 0 | 0 | 112 | L36 F37 Y42 I43 | L36-L39 HydrophobicContact CD2-CB 4.36Å; L36-L39 HydrophobicContact CD2-CD1 3.43Å; L36-L39 VanDerWaalsContact CD2-CD1 3.43Å; L36-L39 HydrophobicContact CG-CD1 4.39Å; L36-L39 WeakPolarHBondContact O-CB 3.29Å; L36-L39 PolarHBondContact O-N 3.5Å; F37-L39 PolarHBondContact O-N 3.2Å; L39-Y42 VanDerWaalsContact O-CB 3.29Å; L39-Y42 WeakPolarHBondContact O-CB 3.22Å; L39-Y42 PolarHBondContact O-N 3.11Å; L39-I43 WeakPolarHBondContact O-CG1 3.47Å; L39-I43 PolarHBondContact O-N 3.08Å |
| 40 | I | 55.2 | Low | 51.5 | Low | 77 Ų | 77 | 72.7 Ų | 72.7 | 40% | 0.395 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -64.6 | -42.3 | 171.3 | -61.3 | 178 | 0 | 0 | 0 | 110.2 | F37 V38 Y42 I43 L44 | F37-I40 HydrophobicContact CD1-CD1 4.31Å; F37-I40 HydrophobicContact CD2-CD1 4.05Å; F37-I40 HydrophobicContact CE1-CD1 4.27Å; F37-I40 HydrophobicContact CE2-CD1 4Å; F37-I40 HydrophobicContact CG-CD1 4.21Å; F37-I40 HydrophobicContact CZ-CD1 4.12Å; F37-I40 WeakPolarHBondContact O-CB 3.46Å; F37-I40 PolarHBondContact O-N 3.01Å; V38-I40 VanDerWaalsContact C-N 3.33Å; I40-Y42 VanDerWaalsContact C-N 3.26Å; I40-Y42 PolarHBondContact O-N 3.29Å; I40-I43 CarbonylContact O-C 3.5Å; I40-I43 PolarHBondContact O-N 3.39Å; I40-I43 VanDerWaalsContact O-N 3.15Å; I40-L44 HydrophobicContact CG2-CD1 3.79Å; I40-L44 WeakPolarHBondContact O-CD1 3.39Å; I40-L44 PolarHBondContact O-N 3.14Å |
| 41 | F | 52.2 | Low | 51.5 | Low | 49 Ų | 49 | 74.6 Ų | 74.6 | 22% | 0.215 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.3 | -31.2 | 174.5 | -83.7 | -65.4 | 0 | 0 | 0 | 113.4 | F37 V38 L44 S45 I77 | F37-F41 PolarHBondContact O-N 3.17Å; V38-F41 WeakPolarHBondContact O-CB 3.3Å; V38-F41 PolarHBondContact O-N 3.4Å; F41-L44 CarbonylContact O-C 3.54Å; F41-L44 PolarHBondContact O-N 3.16Å; F41-S45 PolarHBondContact O-N 2.9Å; F41-I77 HydrophobicContact CB-CG2 3.82Å; F41-I77 HydrophobicContact CD1-CB 4.16Å; F41-I77 HydrophobicContact CD1-CD1 4.13Å; F41-I77 HydrophobicContact CD1-CG1 3.54Å; F41-I77 HydrophobicContact CD1-CG2 3.87Å; F41-I77 HydrophobicContact CE1-CG1 3.87Å; F41-I77 HydrophobicContact CG-CG2 4.06Å |
| 42 | Y | 53.5 | Low | 51.5 | Low | 62 Ų | 62 | 74.5 Ų | 74.5 | 24% | 0.243 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -69.1 | -38.5 | 170.7 | -115.2 | -73.9 | 0 | 0 | 0 | 113.5 | V38 L39 I40 L44 S45 P46 I109 | V38-Y42 PolarHBondContact O-N 3.3Å; L39-Y42 VanDerWaalsContact O-CB 3.29Å; L39-Y42 WeakPolarHBondContact O-CB 3.22Å; L39-Y42 PolarHBondContact O-N 3.11Å; I40-Y42 VanDerWaalsContact C-N 3.26Å; I40-Y42 PolarHBondContact O-N 3.29Å; Y42-L44 PolarHBondContact O-N 3.47Å; Y42-S45 WeakPolarHBondContact O-CB 3.48Å; Y42-S45 PolarHBondContact O-N 3.43Å; Y42-S45 VanDerWaalsContact O-N 3.14Å; Y42-P46 VanDerWaalsContact O-CD 3.24Å; Y42-P46 WeakPolarHBondContact O-CD 3.31Å; Y42-I109 HydrophobicContact CE1-CG2 4.47Å; Y42-I109 HydrophobicContact CE2-CB 4.17Å; Y42-I109 HydrophobicContact CE2-CD1 3.51Å; Y42-I109 HydrophobicContact CE2-CG1 4.07Å; Y42-I109 HydrophobicContact CE2-CG2 3.33Å; Y42-I109 WeakPolarHBondContact OH-CB 3.5Å; Y42-I109 VanDerWaalsContact OH-CD1 3.31Å; Y42-I109 WeakPolarHBondContact OH-CD1 3.47Å; Y42-I109 WeakPolarHBondContact OH-CG1 3.42Å; Y42-I109 WeakPolarHBondContact OH-CG2 3.44Å |
| 43 | I | 53 | Low | 51.5 | Low | 122 Ų | 122 | 83.4 Ų | 83.4 | 63% | 0.626 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -71.2 | -20.2 | 172.1 | -68.4 | 169.2 | 0 | 0 | 0 | 111.4 | L39 I40 P46 | L39-I43 WeakPolarHBondContact O-CG1 3.47Å; L39-I43 PolarHBondContact O-N 3.08Å; I40-I43 CarbonylContact O-C 3.5Å; I40-I43 PolarHBondContact O-N 3.39Å; I40-I43 VanDerWaalsContact O-N 3.15Å; I43-P46 VanDerWaalsContact C-CD 3.46Å; I43-P46 WeakPolarHBondContact O-CD 3.28Å; I43-P46 WeakPolarHBondContact O-CG 3.39Å |
| 44 | L | 51.4 | Low | 51.3 | Low | 50 Ų | 50 | 84.7 Ų | 84.7 | 26% | 0.262 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -84.4 | -19.2 | 166.5 | -91.1 | 90.4 | 0 | 0 | 0 | 113.6 | I40 F41 Y42 P46 I47 F73 | I40-L44 HydrophobicContact CG2-CD1 3.79Å; I40-L44 WeakPolarHBondContact O-CD1 3.39Å; I40-L44 PolarHBondContact O-N 3.14Å; F41-L44 CarbonylContact O-C 3.54Å; F41-L44 PolarHBondContact O-N 3.16Å; Y42-L44 PolarHBondContact O-N 3.47Å; L44-P46 VanDerWaalsContact C-N 3.27Å; L44-I47 HydrophobicContact CB-CD1 3.85Å; L44-I47 HydrophobicContact CD2-CD1 3.61Å; L44-I47 HydrophobicContact CG-CD1 3.48Å; L44-I47 VanDerWaalsContact CG-CD1 3.48Å; L44-I47 WeakPolarHBondContact O-CB 3.32Å; L44-I47 WeakPolarHBondContact O-CG1 3.46Å; L44-I47 PolarHBondContact O-N 3.33Å; L44-F73 HydrophobicContact CB-CE1 4.37Å; L44-F73 HydrophobicContact CD2-CE1 3.75Å; L44-F73 HydrophobicContact CD2-CZ 3.53Å |
| 45 | S | 52.7 | Low | 51.2 | Low | 39 Ų | 39 | 80.1 Ų | 80.1 | 27% | 0.273 | 39% | 0.388 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55 | -26.4 | 171.3 | -169.7 | 0 | 0 | 0 | 0 | 115.7 | F41 Y42 I47 P48 T49 | F41-S45 PolarHBondContact O-N 2.9Å; Y42-S45 WeakPolarHBondContact O-CB 3.48Å; Y42-S45 PolarHBondContact O-N 3.43Å; Y42-S45 VanDerWaalsContact O-N 3.14Å; S45-I47 PolarHBondContact O-N 3.29Å; S45-P48 WeakPolarHBondContact O-CD 3.46Å; S45-P48 WeakPolarHBondContact O-CG 3.36Å; S45-T49 PolarHBondContact O-OG1 2.76Å |
| 46 | P | 49.4 | Very low | 50.9 | Low | 56 Ų | 56 | 85.1 Ų | 85.1 | 36% | 0.364 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -70.4 | -9.3 | 169.4 | 24.3 | -37.1 | 0 | 0 | 0 | 115 | Y42 I43 L44 T49 F50 | Y42-P46 VanDerWaalsContact O-CD 3.24Å; Y42-P46 WeakPolarHBondContact O-CD 3.31Å; I43-P46 VanDerWaalsContact C-CD 3.46Å; I43-P46 WeakPolarHBondContact O-CD 3.28Å; I43-P46 WeakPolarHBondContact O-CG 3.39Å; L44-P46 VanDerWaalsContact C-N 3.27Å; P46-T49 VanDerWaalsContact CA-OG1 3.26Å; P46-T49 WeakPolarHBondContact CA-OG1 3.17Å; P46-T49 PolarHBondContact O-N 3.27Å; P46-T49 PolarHBondContact O-OG1 2.99Å; P46-F50 WeakPolarHBondContact O-CB 3.11Å; P46-F50 PolarHBondContact O-N 3.44Å |
| 47 | I | 52.9 | Low | 50.5 | Low | 73 Ų | 73 | 88 Ų | 88 | 37% | 0.374 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62.2 | -49.2 | 177.4 | -66.6 | 173.5 | 0 | 0 | 0 | 112.1 | L44 S45 T49 F50 I51 | L44-I47 HydrophobicContact CB-CD1 3.85Å; L44-I47 HydrophobicContact CD2-CD1 3.61Å; L44-I47 HydrophobicContact CG-CD1 3.48Å; L44-I47 VanDerWaalsContact CG-CD1 3.48Å; L44-I47 WeakPolarHBondContact O-CB 3.32Å; L44-I47 WeakPolarHBondContact O-CG1 3.46Å; L44-I47 PolarHBondContact O-N 3.33Å; S45-I47 PolarHBondContact O-N 3.29Å; I47-T49 PolarHBondContact O-N 3.43Å; I47-F50 PolarHBondContact O-N 2.76Å; I47-I51 HydrophobicContact CG2-CD1 3.76Å; I47-I51 WeakPolarHBondContact O-CB 3.01Å; I47-I51 PolarHBondContact O-N 2.95Å |
| 48 | P | 47.9 | Very low | 50.1 | Low | 23 Ų | 23 | 88.4 Ų | 88.4 | 15% | 0.149 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -64.1 | -27.4 | 173.8 | 20.5 | -32 | 0 | 0 | 0 | 113.5 | S45 S52 A70 | S45-P48 WeakPolarHBondContact O-CD 3.46Å; S45-P48 WeakPolarHBondContact O-CG 3.36Å; P48-S52 PolarHBondContact O-N 2.89Å; P48-S52 PolarHBondContact O-OG 2.95Å; P48-A70 HydrophobicContact CB-CB 4.43Å |
| 49 | T | 52.1 | Low | 49.7 | Very low | 68 Ų | 68 | 91.5 Ų | 91.5 | 42% | 0.417 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -76.3 | -31.7 | 175 | -0.1 | 0 | 0 | 0 | 0 | 112.5 | S45 P46 I47 S52 R53 | S45-T49 PolarHBondContact O-OG1 2.76Å; P46-T49 VanDerWaalsContact CA-OG1 3.26Å; P46-T49 WeakPolarHBondContact CA-OG1 3.17Å; P46-T49 PolarHBondContact O-N 3.27Å; P46-T49 PolarHBondContact O-OG1 2.99Å; I47-T49 PolarHBondContact O-N 3.43Å; T49-S52 VanDerWaalsContact CA-OG 3.31Å; T49-S52 WeakPolarHBondContact CA-OG 3.31Å; T49-S52 PolarHBondContact O-OG 3.44Å; T49-S52 VanDerWaalsContact O-OG 3.11Å; T49-R53 PolarHBondContact O-N 3.01Å |
| 50 | F | 50.5 | Low | 49.6 | Very low | 158 Ų | 158 | 95.5 Ų | 95.5 | 69% | 0.693 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -71.3 | -36.8 | 170.7 | -108.5 | -86.8 | 0 | 0 | 0 | 112.3 | P46 I47 R54 | P46-F50 WeakPolarHBondContact O-CB 3.11Å; P46-F50 PolarHBondContact O-N 3.44Å; I47-F50 PolarHBondContact O-N 2.76Å; F50-R54 PolarHBondContact O-N 3.09Å |
| 51 | I | 51.7 | Low | 49.4 | Very low | 59 Ų | 59 | 95.9 Ų | 95.9 | 30% | 0.303 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -68.5 | -44.9 | 177 | -82.2 | 155.3 | 0 | 0 | 0 | 111.2 | I47 R53 R54 L55 C66 | I47-I51 HydrophobicContact CG2-CD1 3.76Å; I47-I51 WeakPolarHBondContact O-CB 3.01Å; I47-I51 PolarHBondContact O-N 2.95Å; I51-R53 PolarHBondContact O-N 3.43Å; I51-R54 PolarHBondContact O-N 3.43Å; I51-L55 HydrophobicContact CG2-CD1 4.42Å; I51-L55 WeakPolarHBondContact O-CB 2.81Å; I51-L55 PolarHBondContact O-N 3.37Å; I51-C66 WeakPolarHBondContact CG2-SG 3.4Å |
| 52 | S | 43.1 | Very low | 49.3 | Very low | 64 Ų | 64 | 96.4 Ų | 96.4 | 45% | 0.448 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.2 | -37.3 | 176.1 | 42.9 | 0 | 0 | 0 | 0 | 113.2 | P48 T49 R54 L55 | P48-S52 PolarHBondContact O-N 2.89Å; P48-S52 PolarHBondContact O-OG 2.95Å; T49-S52 VanDerWaalsContact CA-OG 3.31Å; T49-S52 WeakPolarHBondContact CA-OG 3.31Å; T49-S52 PolarHBondContact O-OG 3.44Å; T49-S52 VanDerWaalsContact O-OG 3.11Å; S52-R54 PolarHBondContact O-N 3.39Å; S52-L55 PolarHBondContact O-N 3.01Å |
| 53 | R | 46.9 | Very low | 49.5 | Very low | 222 Ų | 222 | 95.5 Ų | 95.5 | 84% | 0.838 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -72 | -22 | 175.3 | -94.7 | 172.7 | 67.5 | 170 | 0.8 | 115 | T49 I51 | T49-R53 PolarHBondContact O-N 3.01Å; I51-R53 PolarHBondContact O-N 3.43Å |
| 54 | R | 46.2 | Very low | 49.7 | Very low | 215 Ų | 215 | 93.9 Ų | 93.9 | 81% | 0.811 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -84.6 | -12 | 173 | -97.4 | -80.1 | -172.4 | 164.7 | 0 | 112.9 | F50 I51 S52 | F50-R54 PolarHBondContact O-N 3.09Å; I51-R54 PolarHBondContact O-N 3.43Å; S52-R54 PolarHBondContact O-N 3.39Å |
| 55 | L | 46.1 | Very low | 50 | Low | 61 Ų | 61 | 93.9 Ų | 93.9 | 32% | 0.319 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -95.1 | -8.4 | -170.3 | -123.8 | 76.7 | 0 | 0 | 0 | 115.2 | I51 S52 D57 S63 | I51-L55 HydrophobicContact CG2-CD1 4.42Å; I51-L55 WeakPolarHBondContact O-CB 2.81Å; I51-L55 PolarHBondContact O-N 3.37Å; S52-L55 PolarHBondContact O-N 3.01Å; L55-D57 PolarHBondContact O-N 3.48Å; L55-D57 VanDerWaalsContact O-N 3.17Å; L55-S63 WeakPolarHBondContact CD2-OG 3.05Å |
| 56 | S | 45.3 | Very low | 50.1 | Low | 119 Ų | 119 | 93.7 Ų | 93.7 | 83% | 0.832 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -70.2 | -1.7 | 174.2 | -71.7 | 0 | 0 | 0 | 0 | 113.7 | ||
| 57 | D | 45.8 | Very low | 50.5 | Low | 148 Ų | 148 | 99.2 Ų | 99.2 | 79% | 0.791 | 53% | 0.533 | S | S | * | . | S | Bend | trans | -113.2 | -23.5 | -170 | -155.4 | -123.9 | 0 | 0 | 0 | 115.2 | L55 | L55-D57 PolarHBondContact O-N 3.48Å; L55-D57 VanDerWaalsContact O-N 3.17Å |
| 58 | D | 44.6 | Very low | 51 | Low | 121 Ų | 121 | 102.3 Ų | 102.3 | 65% | 0.647 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -159.7 | 122 | -175.6 | -150.5 | -94.9 | 0 | 0 | 0 | 116.4 | ||
| 59 | S | 46 | Very low | 51.8 | Low | 74 Ų | 74 | 107 Ų | 107 | 52% | 0.517 | 57% | 0.569 | S | S | . | * | trans | 76.4 | 109 | 152.8 | -64.5 | 0 | 0 | 0 | 0 | 121.7 | A61 A62 S63 | S59-A61 VanDerWaalsContact C-N 3.33Å; S59-A61 PolarHBondContact O-N 3.28Å; S59-A61 VanDerWaalsContact O-N 3.16Å; S59-A62 PolarHBondContact O-N 3.07Å; S59-S63 PolarHBondContact O-N 3Å | ||
| 60 | D | 54.9 | Low | 52.2 | Low | 145 Ų | 145 | 104.9 Ų | 104.9 | 78% | 0.775 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -50.5 | -30.5 | 176.9 | -81.8 | -90.4 | 0 | 0 | 0 | 117.4 | N64 | D60-N64 PolarHBondContact O-ND2 3.46Å; D60-N64 VanDerWaalsContact O-ND2 3.13Å |
| 61 | A | 51.9 | Low | 52.9 | Low | 85 Ų | 85 | 101 Ų | 101 | 70% | 0.702 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -80.6 | -36.9 | -178 | 0 | 0 | 0 | 0 | 0 | 112.9 | S59 S63 | S59-A61 VanDerWaalsContact C-N 3.33Å; S59-A61 PolarHBondContact O-N 3.28Å; S59-A61 VanDerWaalsContact O-N 3.16Å; A61-S63 VanDerWaalsContact C-N 3.31Å |
| 62 | A | 49.7 | Very low | 53.8 | Low | 61 Ų | 61 | 106.1 Ų | 106.1 | 50% | 0.504 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -71.4 | -30.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | S59 N64 C66 | S59-A62 PolarHBondContact O-N 3.07Å; A62-N64 PolarHBondContact O-N 3.39Å; A62-C66 VanDerWaalsContact O-CB 3.24Å; A62-C66 WeakPolarHBondContact O-CB 2.94Å; A62-C66 PolarHBondContact O-N 3.28Å |
| 63 | S | 57 | Low | 54.9 | Low | 43 Ų | 43 | 107.3 Ų | 107.3 | 30% | 0.301 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.1 | -42.4 | 178.4 | -171.1 | 0 | 0 | 0 | 0 | 113.2 | L55 S59 A61 R67 | L55-S63 WeakPolarHBondContact CD2-OG 3.05Å; S59-S63 PolarHBondContact O-N 3Å; A61-S63 VanDerWaalsContact C-N 3.31Å; S63-R67 WeakPolarHBondContact O-CB 3.36Å; S63-R67 PolarHBondContact O-N 2.97Å |
| 64 | N | 56.8 | Low | 55.8 | Low | 88 Ų | 88 | 99.3 Ų | 99.3 | 47% | 0.471 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -68.3 | -46.2 | 179.3 | -76.9 | -58.2 | 0 | 0 | 0 | 112.9 | D60 A62 C66 R67 E68 | D60-N64 PolarHBondContact O-ND2 3.46Å; D60-N64 VanDerWaalsContact O-ND2 3.13Å; A62-N64 PolarHBondContact O-N 3.39Å; N64-C66 PolarHBondContact O-N 2.94Å; N64-R67 PolarHBondContact O-N 3.39Å; N64-E68 WeakPolarHBondContact O-CG 3.43Å; N64-E68 PolarHBondContact O-N 3.17Å |
| 65 | A | 57.9 | Low | 57.1 | Low | 49 Ų | 49 | 92.4 Ų | 92.4 | 41% | 0.405 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.6 | -38.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | E68 L69 | A65-E68 PolarHBondContact O-N 3.17Å; A65-L69 WeakPolarHBondContact O-CB 3.36Å; A65-L69 VanDerWaalsContact O-CG 3.27Å; A65-L69 WeakPolarHBondContact O-CG 3.36Å; A65-L69 PolarHBondContact O-N 2.91Å |
| 66 | C | 56 | Low | 58.3 | Low | 35 Ų | 35 | 91.1 Ų | 91.1 | 24% | 0.236 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -71.4 | -36 | 178.3 | -150.4 | 0 | 0 | 0 | 0 | 112 | I51 A62 N64 L69 A70 | I51-C66 WeakPolarHBondContact CG2-SG 3.4Å; A62-C66 VanDerWaalsContact O-CB 3.24Å; A62-C66 WeakPolarHBondContact O-CB 2.94Å; A62-C66 PolarHBondContact O-N 3.28Å; N64-C66 PolarHBondContact O-N 2.94Å; C66-L69 PolarHBondContact O-N 3.3Å; C66-A70 VanDerWaalsContact O-CB 3.31Å; C66-A70 WeakPolarHBondContact O-CB 3.24Å; C66-A70 PolarHBondContact O-N 3.44Å |
| 67 | R | 57.8 | Low | 59.5 | Low | 173 Ų | 173 | 86.4 Ų | 86.4 | 65% | 0.653 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.8 | -42.2 | 172.4 | 176.9 | 170.9 | 162.5 | -104.2 | -1 | 112 | S63 N64 A70 C71 | S63-R67 WeakPolarHBondContact O-CB 3.36Å; S63-R67 PolarHBondContact O-N 2.97Å; N64-R67 PolarHBondContact O-N 3.39Å; R67-A70 PolarHBondContact O-N 2.94Å; R67-C71 WeakPolarHBondContact O-CB 3.13Å; R67-C71 PolarHBondContact O-N 3.43Å |
| 68 | E | 63.6 | Low | 60.9 | Low | 138 Ų | 138 | 81.4 Ų | 81.4 | 65% | 0.645 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -63.5 | -45 | 174.1 | -74.8 | 179.9 | 154.9 | 0 | 0 | 111.5 | N64 A65 A70 C71 F72 | N64-E68 WeakPolarHBondContact O-CG 3.43Å; N64-E68 PolarHBondContact O-N 3.17Å; A65-E68 PolarHBondContact O-N 3.17Å; E68-A70 PolarHBondContact O-N 3.46Å; E68-C71 WeakPolarHBondContact O-CB 3.29Å; E68-C71 PolarHBondContact O-N 3.14Å; E68-F72 WeakPolarHBondContact O-CB 3.36Å; E68-F72 PolarHBondContact O-N 3.38Å |
| 69 | L | 62.9 | Low | 62.5 | Low | 121 Ų | 121 | 80.6 Ų | 80.6 | 63% | 0.634 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62.3 | -41.2 | 175.1 | -74.1 | 172.4 | 0 | 0 | 0 | 112.5 | A65 C66 C71 F72 F73 | A65-L69 WeakPolarHBondContact O-CB 3.36Å; A65-L69 VanDerWaalsContact O-CG 3.27Å; A65-L69 WeakPolarHBondContact O-CG 3.36Å; A65-L69 PolarHBondContact O-N 2.91Å; C66-L69 PolarHBondContact O-N 3.3Å; L69-C71 VanDerWaalsContact C-N 3.35Å; L69-F72 PolarHBondContact O-N 3.25Å; L69-F73 WeakPolarHBondContact O-CB 3.48Å; L69-F73 PolarHBondContact O-N 3Å |
| 70 | A | 61.5 | Low | 63.8 | Low | 23 Ų | 23 | 79.5 Ų | 79.5 | 19% | 0.19 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -64.2 | -39.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | P48 C66 R67 E68 F73 T74 | P48-A70 HydrophobicContact CB-CB 4.43Å; C66-A70 VanDerWaalsContact O-CB 3.31Å; C66-A70 WeakPolarHBondContact O-CB 3.24Å; C66-A70 PolarHBondContact O-N 3.44Å; R67-A70 PolarHBondContact O-N 2.94Å; E68-A70 PolarHBondContact O-N 3.46Å; A70-F73 PolarHBondContact O-N 3.42Å; A70-T74 WeakPolarHBondContact O-CB 3.36Å; A70-T74 PolarHBondContact O-N 3.04Å; A70-T74 PolarHBondContact O-OG1 3.33Å |
| 71 | C | 65.5 | Low | 64.5 | Low | 77 Ų | 77 | 72.6 Ų | 72.6 | 52% | 0.52 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -65.2 | -42.5 | 174.5 | -168.4 | 0 | 0 | 0 | 0 | 111.4 | R67 E68 L69 F73 T74 T75 | R67-C71 WeakPolarHBondContact O-CB 3.13Å; R67-C71 PolarHBondContact O-N 3.43Å; E68-C71 WeakPolarHBondContact O-CB 3.29Å; E68-C71 PolarHBondContact O-N 3.14Å; L69-C71 VanDerWaalsContact C-N 3.35Å; C71-F73 PolarHBondContact O-N 3.48Å; C71-T74 PolarHBondContact O-N 3.15Å; C71-T75 WeakPolarHBondContact O-CB 3.43Å; C71-T75 WeakPolarHBondContact O-CG2 3.39Å; C71-T75 PolarHBondContact O-N 3.14Å; C71-T75 PolarHBondContact O-OG1 2.91Å |
| 72 | F | 69.3 | Low | 65.5 | Low | 167 Ų | 167 | 71.4 Ų | 71.4 | 73% | 0.732 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -63.4 | -42.1 | 177.2 | -148.6 | -86 | 0 | 0 | 0 | 111.9 | E68 L69 T75 G76 | E68-F72 WeakPolarHBondContact O-CB 3.36Å; E68-F72 PolarHBondContact O-N 3.38Å; L69-F72 PolarHBondContact O-N 3.25Å; F72-T75 WeakPolarHBondContact CA-OG1 3.39Å; F72-T75 PolarHBondContact O-OG1 3.07Å; F72-G76 PolarHBondContact O-N 3.38Å |
| 73 | F | 68 | Low | 66.5 | Low | 89 Ų | 89 | 69.8 Ų | 69.8 | 39% | 0.39 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -68.1 | -45.5 | 177.3 | -158.6 | -108.4 | 0 | 0 | 0 | 111.1 | L44 L69 A70 C71 T75 G76 I77 | L44-F73 HydrophobicContact CB-CE1 4.37Å; L44-F73 HydrophobicContact CD2-CE1 3.75Å; L44-F73 HydrophobicContact CD2-CZ 3.53Å; L69-F73 WeakPolarHBondContact O-CB 3.48Å; L69-F73 PolarHBondContact O-N 3Å; A70-F73 PolarHBondContact O-N 3.42Å; C71-F73 PolarHBondContact O-N 3.48Å; F73-T75 VanDerWaalsContact C-N 3.34Å; F73-T75 PolarHBondContact O-N 3.35Å; F73-G76 PolarHBondContact O-N 2.87Å; F73-I77 HydrophobicContact CD1-CD1 3.42Å; F73-I77 VanDerWaalsContact CD1-CD1 3.42Å; F73-I77 HydrophobicContact CD1-CG1 4.1Å; F73-I77 HydrophobicContact CE1-CD1 3.42Å; F73-I77 VanDerWaalsContact CE1-CD1 3.42Å; F73-I77 HydrophobicContact CE1-CG1 4.09Å; F73-I77 HydrophobicContact CG-CD1 4.38Å; F73-I77 HydrophobicContact CZ-CD1 4.36Å; F73-I77 WeakPolarHBondContact O-CG1 3.21Å; F73-I77 PolarHBondContact O-N 3.42Å |
| 74 | T | 65.9 | Low | 67.1 | Low | 53 Ų | 53 | 69.5 Ų | 69.5 | 33% | 0.325 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -60.6 | -44.2 | 179 | -54.1 | 0 | 0 | 0 | 0 | 111.2 | A70 C71 I77 V78 | A70-T74 WeakPolarHBondContact O-CB 3.36Å; A70-T74 PolarHBondContact O-N 3.04Å; A70-T74 PolarHBondContact O-OG1 3.33Å; C71-T74 PolarHBondContact O-N 3.15Å; T74-I77 PolarHBondContact O-N 3.23Å; T74-V78 WeakPolarHBondContact O-CG2 3.31Å; T74-V78 PolarHBondContact O-N 3.49Å |
| 75 | T | 71.6 | Confident | 67.5 | Low | 71 Ų | 71 | 65.7 Ų | 65.7 | 44% | 0.436 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -66.6 | -40.6 | 175.7 | 49.8 | 0 | 0 | 0 | 0 | 112.2 | C71 F72 F73 I77 V78 V79 | C71-T75 WeakPolarHBondContact O-CB 3.43Å; C71-T75 WeakPolarHBondContact O-CG2 3.39Å; C71-T75 PolarHBondContact O-N 3.14Å; C71-T75 PolarHBondContact O-OG1 2.91Å; F72-T75 WeakPolarHBondContact CA-OG1 3.39Å; F72-T75 PolarHBondContact O-OG1 3.07Å; F73-T75 VanDerWaalsContact C-N 3.34Å; F73-T75 PolarHBondContact O-N 3.35Å; T75-I77 VanDerWaalsContact C-N 3.32Å; T75-I77 PolarHBondContact O-N 3.49Å; T75-V78 PolarHBondContact O-N 3.39Å; T75-V79 VanDerWaalsContact O-CG2 3.28Å; T75-V79 WeakPolarHBondContact O-CG2 3.16Å; T75-V79 PolarHBondContact O-N 3.22Å |
| 76 | G | 72.3 | Confident | 68 | Low | 33 Ų | 33 | 67.5 Ų | 67.5 | 34% | 0.34 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -59.7 | -39.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | F72 F73 S80 | F72-G76 PolarHBondContact O-N 3.38Å; F73-G76 PolarHBondContact O-N 2.87Å; G76-S80 VanDerWaalsContact O-CB 3.27Å; G76-S80 WeakPolarHBondContact O-CB 3.43Å; G76-S80 PolarHBondContact O-N 3.19Å; G76-S80 PolarHBondContact O-OG 2.94Å |
| 77 | I | 71.4 | Confident | 68.7 | Low | 21 Ų | 21 | 71.1 Ų | 71.1 | 11% | 0.108 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -65.3 | -47.2 | 174.9 | -66.4 | 173.3 | 0 | 0 | 0 | 110.7 | F41 F73 T74 T75 V79 S80 A81 | F41-I77 HydrophobicContact CB-CG2 3.82Å; F41-I77 HydrophobicContact CD1-CB 4.16Å; F41-I77 HydrophobicContact CD1-CD1 4.13Å; F41-I77 HydrophobicContact CD1-CG1 3.54Å; F41-I77 HydrophobicContact CD1-CG2 3.87Å; F41-I77 HydrophobicContact CE1-CG1 3.87Å; F41-I77 HydrophobicContact CG-CG2 4.06Å; F73-I77 HydrophobicContact CD1-CD1 3.42Å; F73-I77 VanDerWaalsContact CD1-CD1 3.42Å; F73-I77 HydrophobicContact CD1-CG1 4.1Å; F73-I77 HydrophobicContact CE1-CD1 3.42Å; F73-I77 VanDerWaalsContact CE1-CD1 3.42Å; F73-I77 HydrophobicContact CE1-CG1 4.09Å; F73-I77 HydrophobicContact CG-CD1 4.38Å; F73-I77 HydrophobicContact CZ-CD1 4.36Å; F73-I77 WeakPolarHBondContact O-CG1 3.21Å; F73-I77 PolarHBondContact O-N 3.42Å; T74-I77 PolarHBondContact O-N 3.23Å; T75-I77 VanDerWaalsContact C-N 3.32Å; T75-I77 PolarHBondContact O-N 3.49Å; I77-V79 PolarHBondContact O-N 2.89Å; I77-S80 PolarHBondContact O-N 2.81Å; I77-A81 WeakPolarHBondContact O-CB 3.33Å; I77-A81 PolarHBondContact O-N 3.37Å |
| 78 | V | 73.7 | Confident | 69 | Low | 42 Ų | 42 | 63.6 Ų | 63.6 | 26% | 0.255 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -58.1 | -52 | 179.3 | 175.6 | 0 | 0 | 0 | 0 | 110.2 | T74 T75 S80 A81 F82 F110 | T74-V78 WeakPolarHBondContact O-CG2 3.31Å; T74-V78 PolarHBondContact O-N 3.49Å; T75-V78 PolarHBondContact O-N 3.39Å; V78-S80 VanDerWaalsContact C-N 3.29Å; V78-S80 PolarHBondContact O-N 2.85Å; V78-A81 PolarHBondContact O-N 3.29Å; V78-F82 HydrophobicContact CG1-CD2 3.97Å; V78-F82 HydrophobicContact CG1-CE2 3.88Å; V78-F82 WeakPolarHBondContact O-CD2 3.35Å; V78-F82 PolarHBondContact O-N 2.96Å; V78-F110 VanDerWaalsContact CA-CZ 3.5Å; V78-F110 HydrophobicContact CB-CE1 4.02Å; V78-F110 HydrophobicContact CB-CE2 4.4Å; V78-F110 HydrophobicContact CB-CZ 3.96Å; V78-F110 HydrophobicContact CG1-CD2 4.29Å; V78-F110 HydrophobicContact CG1-CE1 4.37Å; V78-F110 HydrophobicContact CG1-CE2 4.06Å; V78-F110 HydrophobicContact CG1-CZ 4.13Å; V78-F110 HydrophobicContact CG2-CD1 3.6Å; V78-F110 HydrophobicContact CG2-CE1 3.26Å; V78-F110 HydrophobicContact CG2-CE2 4.39Å; V78-F110 HydrophobicContact CG2-CG 4.33Å; V78-F110 HydrophobicContact CG2-CZ 3.73Å |
| 79 | V | 78 | Confident | 69 | Low | 104 Ų | 104 | 57.5 Ų | 57.5 | 63% | 0.63 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -60.7 | -40.8 | 179.8 | 174.8 | 0 | 0 | 0 | 0 | 110.9 | T75 I77 F82 G83 | T75-V79 VanDerWaalsContact O-CG2 3.28Å; T75-V79 WeakPolarHBondContact O-CG2 3.16Å; T75-V79 PolarHBondContact O-N 3.22Å; I77-V79 PolarHBondContact O-N 2.89Å; V79-F82 PolarHBondContact O-N 3.3Å; V79-G83 PolarHBondContact O-N 3.3Å |
| 80 | S | 73.1 | Confident | 69.1 | Low | 51 Ų | 51 | 61.6 Ų | 61.6 | 36% | 0.357 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -67 | -40.1 | 178 | -61 | 0 | 0 | 0 | 0 | 112.6 | G76 I77 V78 F82 G83 L84 | G76-S80 VanDerWaalsContact O-CB 3.27Å; G76-S80 WeakPolarHBondContact O-CB 3.43Å; G76-S80 PolarHBondContact O-N 3.19Å; G76-S80 PolarHBondContact O-OG 2.94Å; I77-S80 PolarHBondContact O-N 2.81Å; V78-S80 VanDerWaalsContact C-N 3.29Å; V78-S80 PolarHBondContact O-N 2.85Å; S80-F82 VanDerWaalsContact C-N 3.28Å; S80-F82 PolarHBondContact O-N 2.86Å; S80-G83 PolarHBondContact O-N 3.43Å; S80-L84 WeakPolarHBondContact O-CB 3.4Å; S80-L84 PolarHBondContact O-N 2.89Å |
| 81 | A | 70 | Confident | 69.4 | Low | 1 Ų | 1 | 65 Ų | 65 | 1% | 0.008 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -64.3 | -32 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | V38 I77 V78 P85 N106 F110 | V38-A81 HydrophobicContact CG1-CB 4.26Å; I77-A81 WeakPolarHBondContact O-CB 3.33Å; I77-A81 PolarHBondContact O-N 3.37Å; V78-A81 PolarHBondContact O-N 3.29Å; A81-P85 WeakPolarHBondContact O-CD 3.2Å; A81-P85 WeakPolarHBondContact O-CG 3.21Å; A81-N106 PolarHBondContact O-ND2 2.9Å; A81-F110 HydrophobicContact CB-CE2 4.05Å; A81-F110 HydrophobicContact CB-CZ 3.87Å |
| 82 | F | 73.1 | Confident | 69.1 | Low | 60 Ų | 60 | 65.3 Ų | 65.3 | 26% | 0.263 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -84.7 | -34.8 | 172.9 | -73.3 | -72.6 | 0 | 0 | 0 | 113.1 | V78 V79 S80 P85 I86 M103 N106 F110 | V78-F82 HydrophobicContact CG1-CD2 3.97Å; V78-F82 HydrophobicContact CG1-CE2 3.88Å; V78-F82 WeakPolarHBondContact O-CD2 3.35Å; V78-F82 PolarHBondContact O-N 2.96Å; V79-F82 PolarHBondContact O-N 3.3Å; S80-F82 VanDerWaalsContact C-N 3.28Å; S80-F82 PolarHBondContact O-N 2.86Å; F82-P85 WeakPolarHBondContact O-CD 3.25Å; F82-P85 WeakPolarHBondContact O-CG 3.36Å; F82-I86 WeakPolarHBondContact O-CD1 3.09Å; F82-I86 VanDerWaalsContact O-CG1 3.25Å; F82-I86 WeakPolarHBondContact O-CG1 3.49Å; F82-M103 HydrophobicContact CD1-CG 4.47Å; F82-N106 HydrophobicContact CE1-CB 3.93Å; F82-N106 HydrophobicContact CZ-CB 3.98Å; F82-F110 HydrophobicContact CD2-CE2 4.15Å; F82-F110 AromaticContact CE2-CD2 3.56Å; F82-F110 HydrophobicContact CE2-CD2 3.56Å; F82-F110 AromaticContact CE2-CE2 3.51Å; F82-F110 HydrophobicContact CE2-CE2 3.51Å; F82-F110 AromaticContact CZ-CD2 3.9Å; F82-F110 HydrophobicContact CZ-CD2 3.9Å; F82-F110 HydrophobicContact CZ-CE2 4.1Å |
| 83 | G | 70.9 | Confident | 68.5 | Low | 26 Ų | 26 | 61.6 Ų | 61.6 | 27% | 0.268 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -68.9 | -40 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | V79 S80 I86 I87 | V79-G83 PolarHBondContact O-N 3.3Å; S80-G83 PolarHBondContact O-N 3.43Å; G83-I86 PolarHBondContact O-N 3.28Å; G83-I87 WeakPolarHBondContact O-CD1 3.22Å; G83-I87 VanDerWaalsContact O-CG1 3.3Å; G83-I87 WeakPolarHBondContact O-CG1 3.45Å; G83-I87 PolarHBondContact O-N 3.26Å |
| 84 | L | 69.1 | Low | 68.3 | Low | 38 Ų | 38 | 57.9 Ų | 57.9 | 20% | 0.199 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -61.8 | -49.2 | -176.5 | -149.6 | 153.3 | 0 | 0 | 0 | 113.7 | W34 S80 I86 I87 L88 | W34-L84 HydrophobicContact CE3-CD2 4.16Å; S80-L84 WeakPolarHBondContact O-CB 3.4Å; S80-L84 PolarHBondContact O-N 2.89Å; L84-I86 VanDerWaalsContact C-N 3.31Å; L84-I86 PolarHBondContact O-N 3.42Å; L84-I87 PolarHBondContact O-N 3.17Å; L84-L88 HydrophobicContact CD2-CD1 3.81Å; L84-L88 WeakPolarHBondContact O-CD1 3.27Å; L84-L88 PolarHBondContact O-N 3.38Å; L84-L88 VanDerWaalsContact O-N 3.14Å |
| 85 | P | 65.8 | Low | 68.3 | Low | 8 Ų | 8 | 61.2 Ų | 61.2 | 5% | 0.052 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.9 | -32.2 | 176.2 | 24.3 | -33.4 | 0 | 0 | 0 | 113.1 | A81 F82 L88 A89 V102 | A81-P85 WeakPolarHBondContact O-CD 3.2Å; A81-P85 WeakPolarHBondContact O-CG 3.21Å; F82-P85 WeakPolarHBondContact O-CD 3.25Å; F82-P85 WeakPolarHBondContact O-CG 3.36Å; P85-L88 PolarHBondContact O-N 3.36Å; P85-A89 WeakPolarHBondContact O-CB 3.5Å; P85-A89 PolarHBondContact O-N 3.23Å; P85-V102 HydrophobicContact CB-CG1 3.99Å; P85-V102 HydrophobicContact CG-CG1 4.15Å |
| 86 | I | 69.4 | Low | 68.2 | Low | 87 Ų | 87 | 67.1 Ų | 67.1 | 45% | 0.446 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -65.7 | -42.6 | 177.5 | -66.4 | 168.6 | 0 | 0 | 0 | 111 | F82 G83 L84 A89 R90 | F82-I86 WeakPolarHBondContact O-CD1 3.09Å; F82-I86 VanDerWaalsContact O-CG1 3.25Å; F82-I86 WeakPolarHBondContact O-CG1 3.49Å; G83-I86 PolarHBondContact O-N 3.28Å; L84-I86 VanDerWaalsContact C-N 3.31Å; L84-I86 PolarHBondContact O-N 3.42Å; I86-A89 PolarHBondContact O-N 2.84Å; I86-R90 WeakPolarHBondContact O-CG 3.26Å; I86-R90 PolarHBondContact O-N 3.06Å |
| 87 | I | 69.1 | Low | 68 | Low | 111 Ų | 111 | 67.9 Ų | 67.9 | 57% | 0.569 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -66.5 | -42.3 | 178 | -64 | 162.2 | 0 | 0 | 0 | 110.3 | G83 L84 A89 R90 V91 | G83-I87 WeakPolarHBondContact O-CD1 3.22Å; G83-I87 VanDerWaalsContact O-CG1 3.3Å; G83-I87 WeakPolarHBondContact O-CG1 3.45Å; G83-I87 PolarHBondContact O-N 3.26Å; L84-I87 PolarHBondContact O-N 3.17Å; I87-A89 PolarHBondContact O-N 3.26Å; I87-R90 WeakPolarHBondContact O-CB 3.19Å; I87-R90 PolarHBondContact O-N 2.92Å; I87-V91 PolarHBondContact O-N 3.39Å |
| 88 | L | 64.3 | Low | 67.9 | Low | 14 Ų | 14 | 67.3 Ų | 67.3 | 7% | 0.073 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -66.9 | -35.8 | 177.8 | -93.3 | 70.9 | 0 | 0 | 0 | 113 | W34 L84 P85 R90 V91 A92 L93 I94 | W34-L88 HydrophobicContact CB-CD2 3.69Å; W34-L88 HydrophobicContact CE3-CD1 4.39Å; W34-L88 HydrophobicContact CG-CD2 4.35Å; L84-L88 HydrophobicContact CD2-CD1 3.81Å; L84-L88 WeakPolarHBondContact O-CD1 3.27Å; L84-L88 PolarHBondContact O-N 3.38Å; L84-L88 VanDerWaalsContact O-N 3.14Å; P85-L88 PolarHBondContact O-N 3.36Å; L88-R90 VanDerWaalsContact C-N 3.27Å; L88-R90 PolarHBondContact O-N 3.33Å; L88-V91 PolarHBondContact O-N 2.96Å; L88-A92 PolarHBondContact O-N 3.31Å; L88-L93 HydrophobicContact CG-CD1 4.46Å; L88-L93 PolarHBondContact O-N 2.8Å; L88-I94 HydrophobicContact CB-CD1 3.76Å; L88-I94 HydrophobicContact CB-CG1 4.2Å; L88-I94 HydrophobicContact CD2-CD1 3.74Å; L88-I94 HydrophobicContact CD2-CG1 4.43Å; L88-I94 HydrophobicContact CG-CD1 4.4Å |
| 89 | A | 64.9 | Low | 67.7 | Low | 10 Ų | 10 | 65.6 Ų | 65.6 | 8% | 0.083 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.2 | -34.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | P85 I86 I87 A92 C99 | P85-A89 WeakPolarHBondContact O-CB 3.5Å; P85-A89 PolarHBondContact O-N 3.23Å; I86-A89 PolarHBondContact O-N 2.84Å; I87-A89 PolarHBondContact O-N 3.26Å; A89-A92 PolarHBondContact O-N 2.85Å; A89-C99 HydrophobicContact CB-CB 4.3Å |
| 90 | R | 65.3 | Low | 67.7 | Low | 207 Ų | 207 | 62.2 Ų | 62.2 | 78% | 0.781 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -71.5 | -27 | 176.6 | -73.4 | -73.8 | -79.2 | -147.1 | -4.6 | 113.8 | I86 I87 L88 A92 | I86-R90 WeakPolarHBondContact O-CG 3.26Å; I86-R90 PolarHBondContact O-N 3.06Å; I87-R90 WeakPolarHBondContact O-CB 3.19Å; I87-R90 PolarHBondContact O-N 2.92Å; L88-R90 VanDerWaalsContact C-N 3.27Å; L88-R90 PolarHBondContact O-N 3.33Å; R90-A92 PolarHBondContact O-N 3.36Å |
| 91 | V | 66.3 | Low | 67.8 | Low | 95 Ų | 95 | 62.4 Ų | 62.4 | 58% | 0.576 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.9 | 5.4 | 174.1 | -176.2 | 0 | 0 | 0 | 0 | 111.5 | I87 L88 L93 | I87-V91 PolarHBondContact O-N 3.39Å; L88-V91 PolarHBondContact O-N 2.96Å; V91-L93 HydrophobicContact CB-CD1 4.34Å; V91-L93 HydrophobicContact CB-CG 4.2Å; V91-L93 HydrophobicContact CG1-CD1 3.96Å; V91-L93 HydrophobicContact CG1-CG 3.86Å; V91-L93 PolarHBondContact O-N 3.42Å; V91-L93 VanDerWaalsContact O-N 3.11Å |
| 92 | A | 60.8 | Low | 68.1 | Low | 84 Ų | 84 | 62.7 Ų | 62.7 | 69% | 0.694 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.3 | 20 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | L88 A89 R90 I94 | L88-A92 PolarHBondContact O-N 3.31Å; A89-A92 PolarHBondContact O-N 2.85Å; R90-A92 PolarHBondContact O-N 3.36Å; A92-I94 VanDerWaalsContact C-N 3.27Å |
| 93 | L | 56.4 | Low | 68.4 | Low | 88 Ų | 88 | 63.5 Ų | 63.5 | 46% | 0.461 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -75.8 | -20.3 | 173.8 | -66.5 | 177.5 | 0 | 0 | 0 | 112 | L88 V91 | L88-L93 HydrophobicContact CG-CD1 4.46Å; L88-L93 PolarHBondContact O-N 2.8Å; V91-L93 HydrophobicContact CB-CD1 4.34Å; V91-L93 HydrophobicContact CB-CG 4.2Å; V91-L93 HydrophobicContact CG1-CD1 3.96Å; V91-L93 HydrophobicContact CG1-CG 3.86Å; V91-L93 PolarHBondContact O-N 3.42Å; V91-L93 VanDerWaalsContact O-N 3.11Å |
| 94 | I | 62.5 | Low | 68.9 | Low | 12 Ų | 12 | 64.4 Ų | 64.4 | 6% | 0.062 | 35% | 0.35 | C | S | . | . | S | Bend | trans | -133.1 | 126.1 | -176.9 | -64 | -176 | 0 | 0 | 0 | 108.1 | Y30 P35 L88 A92 A98 C99 | Y30-I94 HydrophobicContact CD1-CB 4.1Å; Y30-I94 HydrophobicContact CD1-CG1 4.08Å; Y30-I94 HydrophobicContact CD1-CG2 4.05Å; Y30-I94 HydrophobicContact CE1-CB 3.79Å; Y30-I94 HydrophobicContact CE1-CG1 4.28Å; Y30-I94 HydrophobicContact CE1-CG2 3.48Å; Y30-I94 VanDerWaalsContact CE1-CG2 3.48Å; P35-I94 HydrophobicContact CG-CD1 4.45Å; L88-I94 HydrophobicContact CB-CD1 3.76Å; L88-I94 HydrophobicContact CB-CG1 4.2Å; L88-I94 HydrophobicContact CD2-CD1 3.74Å; L88-I94 HydrophobicContact CD2-CG1 4.43Å; L88-I94 HydrophobicContact CG-CD1 4.4Å; A92-I94 VanDerWaalsContact C-N 3.27Å; I94-A98 HydrophobicContact CG2-CB 3.86Å; I94-C99 HydrophobicContact CG2-CB 4.28Å |
| 95 | Q | 66.5 | Low | 69.4 | Low | 123 Ų | 123 | 62.6 Ų | 62.6 | 58% | 0.575 | 34% | 0.341 | S | S | * | . | trans | -67.5 | 155 | 168.3 | -43.9 | -100.9 | -61.1 | 0 | 0 | 111.7 | Y30 G97 A98 C99 | Y30-Q95 HydrophobicContact CE1-CB 4.42Å; Y30-Q95 HydrophobicContact CE2-CG 4.49Å; Y30-Q95 VanDerWaalsContact CZ-N 3.32Å; Y30-Q95 WeakPolarHBondContact OH-CA 3.19Å; Y30-Q95 WeakPolarHBondContact OH-CB 3.43Å; Y30-Q95 WeakPolarHBondContact OH-CG 3.4Å; Y30-Q95 PolarHBondContact OH-N 3.47Å; Y30-Q95 PolarHBondContact OH-O 3.42Å; Y30-Q95 VanDerWaalsContact OH-O 3.09Å; Q95-G97 PolarHBondContact O-N 2.96Å; Q95-A98 PolarHBondContact O-N 2.97Å; Q95-A98 VanDerWaalsContact O-N 3.08Å; Q95-C99 PolarHBondContact O-N 3.17Å | ||
| 96 | W | 69.6 | Low | 70.2 | Confident | 195 Ų | 195 | 62.3 Ų | 62.3 | 74% | 0.739 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -50.4 | -31 | 177.6 | -63.4 | 99.9 | 0 | 0 | 0 | 113.9 | C99 G100 | W96-C99 PolarHBondContact O-N 2.96Å; W96-G100 PolarHBondContact O-N 3.42Å |
| 97 | G | 68.5 | Low | 70.8 | Confident | 49 Ų | 49 | 60.3 Ų | 60.3 | 51% | 0.505 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.8 | -48.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q95 C99 G100 L101 | Q95-G97 PolarHBondContact O-N 2.96Å; G97-C99 VanDerWaalsContact C-N 3.35Å; G97-G100 PolarHBondContact O-N 2.73Å; G97-L101 PolarHBondContact O-N 2.68Å; G97-L101 VanDerWaalsContact O-N 3.17Å |
| 98 | A | 68.2 | Low | 71.4 | Confident | 8 Ų | 8 | 57.1 Ų | 57.1 | 7% | 0.066 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -72.4 | -31.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y30 I94 Q95 G100 L101 V102 | Y30-A98 HydrophobicContact CD1-CB 3.97Å; Y30-A98 HydrophobicContact CD2-CB 4.46Å; Y30-A98 HydrophobicContact CE1-CB 3.29Å; Y30-A98 HydrophobicContact CE2-CB 3.94Å; Y30-A98 HydrophobicContact CG-CB 4.45Å; Y30-A98 VanDerWaalsContact OH-CB 3.22Å; Y30-A98 WeakPolarHBondContact OH-CB 3.3Å; Y30-A98 PolarHBondContact OH-N 3.27Å; I94-A98 HydrophobicContact CG2-CB 3.86Å; Q95-A98 PolarHBondContact O-N 2.97Å; Q95-A98 VanDerWaalsContact O-N 3.08Å; A98-G100 VanDerWaalsContact C-N 3.27Å; A98-G100 PolarHBondContact O-N 2.95Å; A98-L101 PolarHBondContact O-N 3.4Å; A98-V102 VanDerWaalsContact O-CG2 3.31Å; A98-V102 WeakPolarHBondContact O-CG2 3.38Å; A98-V102 PolarHBondContact O-N 2.93Å |
| 99 | C | 71 | Confident | 72.2 | Confident | 6 Ų | 6 | 56.5 Ų | 56.5 | 4% | 0.041 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -58.3 | -42.3 | 171.7 | -165.3 | 0 | 0 | 0 | 0 | 111.1 | A89 I94 Q95 W96 G97 V102 M103 | A89-C99 HydrophobicContact CB-CB 4.3Å; I94-C99 HydrophobicContact CG2-CB 4.28Å; Q95-C99 PolarHBondContact O-N 3.17Å; W96-C99 PolarHBondContact O-N 2.96Å; G97-C99 VanDerWaalsContact C-N 3.35Å; C99-V102 PolarHBondContact O-N 3.34Å; C99-M103 WeakPolarHBondContact O-CG 2.95Å; C99-M103 PolarHBondContact O-N 3.49Å |
| 100 | G | 76.1 | Confident | 72.7 | Confident | 34 Ų | 34 | 58 Ų | 58 | 35% | 0.351 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.2 | -45.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | W96 G97 A98 M103 A104 | W96-G100 PolarHBondContact O-N 3.42Å; G97-G100 PolarHBondContact O-N 2.73Å; A98-G100 VanDerWaalsContact C-N 3.27Å; A98-G100 PolarHBondContact O-N 2.95Å; G100-M103 PolarHBondContact O-N 3.44Å; G100-A104 WeakPolarHBondContact O-CB 3.06Å; G100-A104 PolarHBondContact O-N 3.26Å |
| 101 | L | 76.7 | Confident | 73.4 | Confident | 55 Ų | 55 | 53.8 Ų | 53.8 | 29% | 0.288 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.1 | -41.4 | 176.9 | -102 | 106.9 | 0 | 0 | 0 | 112.6 | F20 L23 G97 A98 A104 G105 | F20-L101 HydrophobicContact CD1-CD2 3.71Å; F20-L101 HydrophobicContact CD1-CG 4.05Å; F20-L101 HydrophobicContact CE1-CD2 4.44Å; F20-L101 WeakPolarHBondContact O-CD2 3.22Å; L23-L101 HydrophobicContact CB-CD2 3.56Å; L23-L101 HydrophobicContact CD2-CD2 4.43Å; G97-L101 PolarHBondContact O-N 2.68Å; G97-L101 VanDerWaalsContact O-N 3.17Å; A98-L101 PolarHBondContact O-N 3.4Å; L101-A104 PolarHBondContact O-N 3.11Å; L101-G105 PolarHBondContact O-N 2.82Å |
| 102 | V | 75.3 | Confident | 74 | Confident | 6 Ų | 6 | 50.2 Ų | 50.2 | 4% | 0.036 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68 | -41.6 | 178.4 | 173 | 0 | 0 | 0 | 0 | 111 | L21 P85 A98 C99 G105 N106 | L21-V102 HydrophobicContact CD1-CG1 4.19Å; P85-V102 HydrophobicContact CB-CG1 3.99Å; P85-V102 HydrophobicContact CG-CG1 4.15Å; A98-V102 VanDerWaalsContact O-CG2 3.31Å; A98-V102 WeakPolarHBondContact O-CG2 3.38Å; A98-V102 PolarHBondContact O-N 2.93Å; C99-V102 PolarHBondContact O-N 3.34Å; V102-G105 PolarHBondContact O-N 3.23Å; V102-N106 WeakPolarHBondContact O-CB 3.14Å; V102-N106 VanDerWaalsContact O-CG 3.32Å; V102-N106 PolarHBondContact O-N 3.33Å |
| 103 | M | 78.9 | Confident | 74.6 | Confident | 78 Ų | 78 | 48.2 Ų | 48.2 | 38% | 0.384 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63.4 | -41.9 | 174.3 | -75.2 | -155 | -60.5 | 0 | 0 | 112.3 | F82 C99 G100 N106 A107 | F82-M103 HydrophobicContact CD1-CG 4.47Å; C99-M103 WeakPolarHBondContact O-CG 2.95Å; C99-M103 PolarHBondContact O-N 3.49Å; G100-M103 PolarHBondContact O-N 3.44Å; M103-N106 PolarHBondContact O-N 3.02Å; M103-A107 WeakPolarHBondContact O-CB 3.28Å; M103-A107 PolarHBondContact O-N 2.84Å |
| 104 | A | 83.4 | Confident | 75.4 | Confident | 45 Ų | 45 | 49 Ų | 49 | 37% | 0.372 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -64.3 | -44.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | G100 L101 A107 V108 | G100-A104 WeakPolarHBondContact O-CB 3.06Å; G100-A104 PolarHBondContact O-N 3.26Å; L101-A104 PolarHBondContact O-N 3.11Å; A104-A107 PolarHBondContact O-N 2.74Å; A104-V108 WeakPolarHBondContact O-CG2 3.2Å; A104-V108 PolarHBondContact O-N 2.93Å; A104-V108 VanDerWaalsContact O-N 3.07Å |
| 105 | G | 79 | Confident | 75.9 | Confident | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -57.2 | -50.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L101 V102 A107 V108 I109 | L101-G105 PolarHBondContact O-N 2.82Å; V102-G105 PolarHBondContact O-N 3.23Å; G105-A107 VanDerWaalsContact C-N 3.34Å; G105-A107 PolarHBondContact O-N 2.97Å; G105-V108 PolarHBondContact O-N 2.96Å; G105-I109 VanDerWaalsContact O-CB 3.28Å; G105-I109 WeakPolarHBondContact O-CB 3.39Å; G105-I109 WeakPolarHBondContact O-CG1 3.33Å; G105-I109 PolarHBondContact O-N 3.47Å |
| 106 | N | 81.8 | Confident | 76.2 | Confident | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.9 | -41.8 | 176.8 | -75.9 | -8.7 | 0 | 0 | 0 | 112.5 | L21 A81 F82 V102 M103 I109 F110 | L21-N106 WeakPolarHBondContact CD1-OD1 3.22Å; A81-N106 PolarHBondContact O-ND2 2.9Å; F82-N106 HydrophobicContact CE1-CB 3.93Å; F82-N106 HydrophobicContact CZ-CB 3.98Å; V102-N106 WeakPolarHBondContact O-CB 3.14Å; V102-N106 VanDerWaalsContact O-CG 3.32Å; V102-N106 PolarHBondContact O-N 3.33Å; M103-N106 PolarHBondContact O-N 3.02Å; N106-I109 WeakPolarHBondContact O-CB 3.46Å; N106-I109 PolarHBondContact O-N 2.83Å; N106-F110 HydrophobicContact CB-CD2 4.46Å; N106-F110 HydrophobicContact CB-CE2 4.24Å; N106-F110 WeakPolarHBondContact O-CD2 3.12Å; N106-F110 PolarHBondContact O-N 2.97Å |
| 107 | A | 81.3 | Confident | 76.1 | Confident | 45 Ų | 45 | 44.5 Ų | 44.5 | 37% | 0.372 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -62.3 | -45.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | M103 A104 G105 I109 F110 L111 | M103-A107 WeakPolarHBondContact O-CB 3.28Å; M103-A107 PolarHBondContact O-N 2.84Å; A104-A107 PolarHBondContact O-N 2.74Å; G105-A107 VanDerWaalsContact C-N 3.34Å; G105-A107 PolarHBondContact O-N 2.97Å; A107-I109 VanDerWaalsContact C-N 3.29Å; A107-I109 PolarHBondContact O-N 3.48Å; A107-F110 PolarHBondContact O-N 3.29Å; A107-L111 WeakPolarHBondContact O-CB 3.46Å; A107-L111 PolarHBondContact O-N 3.2Å |
| 108 | V | 82.1 | Confident | 76.1 | Confident | 44 Ų | 44 | 48.1 Ų | 48.1 | 27% | 0.267 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.9 | -39.9 | 178.1 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | S13 A104 G105 L111 T112 | S13-V108 VanDerWaalsContact O-CG1 3.22Å; S13-V108 WeakPolarHBondContact O-CG1 3.31Å; A104-V108 WeakPolarHBondContact O-CG2 3.2Å; A104-V108 PolarHBondContact O-N 2.93Å; A104-V108 VanDerWaalsContact O-N 3.07Å; G105-V108 PolarHBondContact O-N 2.96Å; V108-L111 PolarHBondContact O-N 3.21Å; V108-T112 PolarHBondContact O-N 3.48Å; V108-T112 PolarHBondContact O-OG1 3.48Å |
| 109 | I | 80.6 | Confident | 76 | Confident | 1 Ų | 1 | 51.1 Ų | 51.1 | 1% | 0.005 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.2 | -51.3 | 176.6 | -80.3 | 178 | 0 | 0 | 0 | 111.7 | Y42 G105 N106 A107 L111 T112 I113 | Y42-I109 HydrophobicContact CE1-CG2 4.47Å; Y42-I109 HydrophobicContact CE2-CB 4.17Å; Y42-I109 HydrophobicContact CE2-CD1 3.51Å; Y42-I109 HydrophobicContact CE2-CG1 4.07Å; Y42-I109 HydrophobicContact CE2-CG2 3.33Å; Y42-I109 WeakPolarHBondContact OH-CB 3.5Å; Y42-I109 VanDerWaalsContact OH-CD1 3.31Å; Y42-I109 WeakPolarHBondContact OH-CD1 3.47Å; Y42-I109 WeakPolarHBondContact OH-CG1 3.42Å; Y42-I109 WeakPolarHBondContact OH-CG2 3.44Å; G105-I109 VanDerWaalsContact O-CB 3.28Å; G105-I109 WeakPolarHBondContact O-CB 3.39Å; G105-I109 WeakPolarHBondContact O-CG1 3.33Å; G105-I109 PolarHBondContact O-N 3.47Å; N106-I109 WeakPolarHBondContact O-CB 3.46Å; N106-I109 PolarHBondContact O-N 2.83Å; A107-I109 VanDerWaalsContact C-N 3.29Å; A107-I109 PolarHBondContact O-N 3.48Å; I109-L111 VanDerWaalsContact C-N 3.31Å; I109-L111 PolarHBondContact O-N 3.39Å; I109-T112 WeakPolarHBondContact O-CB 3.31Å; I109-T112 PolarHBondContact O-N 3.24Å; I109-T112 VanDerWaalsContact O-N 3.09Å; I109-I113 HydrophobicContact CG2-CD1 4.3Å; I109-I113 WeakPolarHBondContact O-CG1 3.5Å; I109-I113 PolarHBondContact O-N 2.8Å |
| 110 | F | 77.4 | Confident | 75.6 | Confident | 41 Ų | 41 | 53.8 Ų | 53.8 | 18% | 0.18 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -66.6 | -36.6 | 180 | -74.2 | -57.5 | 0 | 0 | 0 | 111.6 | V78 A81 F82 N106 A107 T112 I113 L114 | V78-F110 VanDerWaalsContact CA-CZ 3.5Å; V78-F110 HydrophobicContact CB-CE1 4.02Å; V78-F110 HydrophobicContact CB-CE2 4.4Å; V78-F110 HydrophobicContact CB-CZ 3.96Å; V78-F110 HydrophobicContact CG1-CD2 4.29Å; V78-F110 HydrophobicContact CG1-CE1 4.37Å; V78-F110 HydrophobicContact CG1-CE2 4.06Å; V78-F110 HydrophobicContact CG1-CZ 4.13Å; V78-F110 HydrophobicContact CG2-CD1 3.6Å; V78-F110 HydrophobicContact CG2-CE1 3.26Å; V78-F110 HydrophobicContact CG2-CE2 4.39Å; V78-F110 HydrophobicContact CG2-CG 4.33Å; V78-F110 HydrophobicContact CG2-CZ 3.73Å; A81-F110 HydrophobicContact CB-CE2 4.05Å; A81-F110 HydrophobicContact CB-CZ 3.87Å; F82-F110 HydrophobicContact CD2-CE2 4.15Å; F82-F110 AromaticContact CE2-CD2 3.56Å; F82-F110 HydrophobicContact CE2-CD2 3.56Å; F82-F110 AromaticContact CE2-CE2 3.51Å; F82-F110 HydrophobicContact CE2-CE2 3.51Å; F82-F110 AromaticContact CZ-CD2 3.9Å; F82-F110 HydrophobicContact CZ-CD2 3.9Å; F82-F110 HydrophobicContact CZ-CE2 4.1Å; N106-F110 HydrophobicContact CB-CD2 4.46Å; N106-F110 HydrophobicContact CB-CE2 4.24Å; N106-F110 WeakPolarHBondContact O-CD2 3.12Å; N106-F110 PolarHBondContact O-N 2.97Å; A107-F110 PolarHBondContact O-N 3.29Å; F110-T112 VanDerWaalsContact C-N 3.28Å; F110-T112 PolarHBondContact O-N 2.85Å; F110-I113 HydrophobicContact CD1-CD1 4.3Å; F110-I113 PolarHBondContact O-N 3.48Å; F110-L114 WeakPolarHBondContact O-CB 3.39Å; F110-L114 PolarHBondContact O-N 3.3Å |
| 111 | L | 79.8 | Confident | 74.5 | Confident | 120 Ų | 120 | 54.7 Ų | 54.7 | 63% | 0.628 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -60.6 | -38.2 | 171.2 | -100.1 | 166.3 | 0 | 0 | 0 | 112.4 | A107 V108 I109 L114 G115 | A107-L111 WeakPolarHBondContact O-CB 3.46Å; A107-L111 PolarHBondContact O-N 3.2Å; V108-L111 PolarHBondContact O-N 3.21Å; I109-L111 VanDerWaalsContact C-N 3.31Å; I109-L111 PolarHBondContact O-N 3.39Å; L111-L114 PolarHBondContact O-N 3.27Å; L111-G115 PolarHBondContact O-N 3.42Å |
| 112 | T | 77.3 | Confident | 73 | Confident | 20 Ų | 20 | 55.6 Ų | 55.6 | 12% | 0.123 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -66.8 | -43.2 | 177 | -55.1 | 0 | 0 | 0 | 0 | 110.9 | L10 S13 V108 I109 F110 G115 F116 | L10-T112 HydrophobicContact CB-CG2 4.16Å; L10-T112 HydrophobicContact CD2-CG2 3.92Å; L10-T112 VanDerWaalsContact CD2-O 3.32Å; L10-T112 WeakPolarHBondContact CD2-O 3.41Å; L10-T112 WeakPolarHBondContact O-CG2 3.26Å; S13-T112 WeakPolarHBondContact CB-OG1 3.43Å; S13-T112 VanDerWaalsContact OG-CG2 3.31Å; S13-T112 WeakPolarHBondContact OG-CG2 3.46Å; S13-T112 PolarHBondContact OG-OG1 3.31Å; V108-T112 PolarHBondContact O-N 3.48Å; V108-T112 PolarHBondContact O-OG1 3.48Å; I109-T112 WeakPolarHBondContact O-CB 3.31Å; I109-T112 PolarHBondContact O-N 3.24Å; I109-T112 VanDerWaalsContact O-N 3.09Å; F110-T112 VanDerWaalsContact C-N 3.28Å; F110-T112 PolarHBondContact O-N 2.85Å; T112-G115 PolarHBondContact O-N 2.97Å; T112-F116 PolarHBondContact O-N 3.49Å |
| 113 | I | 74.5 | Confident | 71.3 | Confident | 41 Ų | 41 | 57.1 Ų | 57.1 | 21% | 0.21 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 176.5 | -64.4 | 165 | 0 | 0 | 0 | 110.7 | I109 F110 F116 F117 | I109-I113 HydrophobicContact CG2-CD1 4.3Å; I109-I113 WeakPolarHBondContact O-CG1 3.5Å; I109-I113 PolarHBondContact O-N 2.8Å; F110-I113 HydrophobicContact CD1-CD1 4.3Å; F110-I113 PolarHBondContact O-N 3.48Å; I113-F116 WeakPolarHBondContact O-CB 3.43Å; I113-F116 PolarHBondContact O-N 2.99Å; I113-F117 HydrophobicContact CG2-CD2 4.11Å; I113-F117 HydrophobicContact CG2-CE2 4.31Å; I113-F117 PolarHBondContact O-N 2.86Å |
| 114 | L | 72.6 | Confident | 69.7 | Low | 106 Ų | 106 | 61.4 Ų | 61.4 | 56% | 0.555 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -64.6 | -42.7 | 176.8 | -163.6 | 159.2 | 0 | 0 | 0 | 111 | F110 L111 F116 F117 L118 | F110-L114 WeakPolarHBondContact O-CB 3.39Å; F110-L114 PolarHBondContact O-N 3.3Å; L111-L114 PolarHBondContact O-N 3.27Å; L114-F116 VanDerWaalsContact C-N 3.3Å; L114-F116 PolarHBondContact O-N 2.88Å; L114-F117 CarbonylContact O-C 3.58Å; L114-F117 PolarHBondContact O-N 3.27Å; L114-F117 VanDerWaalsContact O-N 3.17Å; L114-L118 HydrophobicContact CD2-CD1 4.32Å; L114-L118 WeakPolarHBondContact O-CB 3.38Å; L114-L118 PolarHBondContact O-N 2.95Å |
| 115 | G | 74.1 | Confident | 67.7 | Low | 21 Ų | 21 | 66.4 Ų | 66.4 | 22% | 0.216 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -60.2 | -39.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L111 T112 L118 V119 | L111-G115 PolarHBondContact O-N 3.42Å; T112-G115 PolarHBondContact O-N 2.97Å; G115-L118 PolarHBondContact O-N 3.17Å; G115-V119 VanDerWaalsContact O-CB 3.31Å; G115-V119 WeakPolarHBondContact O-CB 3.24Å; G115-V119 WeakPolarHBondContact O-CG2 3.27Å; G115-V119 PolarHBondContact O-N 2.93Å |
| 116 | F | 72.3 | Confident | 66 | Low | 91 Ų | 91 | 72.5 Ų | 72.5 | 40% | 0.399 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -62.4 | -49.1 | 171.7 | -176.4 | -90.4 | 0 | 0 | 0 | 111.2 | L10 T112 I113 L114 L118 V119 F120 | L10-F116 HydrophobicContact CD1-CB 4.22Å; L10-F116 HydrophobicContact CD1-CD2 4.17Å; T112-F116 PolarHBondContact O-N 3.49Å; I113-F116 WeakPolarHBondContact O-CB 3.43Å; I113-F116 PolarHBondContact O-N 2.99Å; L114-F116 VanDerWaalsContact C-N 3.3Å; L114-F116 PolarHBondContact O-N 2.88Å; F116-L118 VanDerWaalsContact C-N 3.3Å; F116-L118 PolarHBondContact O-N 3.38Å; F116-V119 PolarHBondContact O-N 3.43Å; F116-F120 HydrophobicContact CD1-CD2 4.27Å; F116-F120 AromaticContact CD2-CD2 3.39Å; F116-F120 HydrophobicContact CD2-CD2 3.39Å; F116-F120 AromaticContact CD2-CE2 3.54Å; F116-F120 HydrophobicContact CD2-CE2 3.54Å; F116-F120 HydrophobicContact CD2-CG 4.45Å; F116-F120 HydrophobicContact CE1-CB 4.37Å; F116-F120 HydrophobicContact CE1-CD2 4.24Å; F116-F120 HydrophobicContact CE1-CG 4.5Å; F116-F120 AromaticContact CE2-CD2 3.36Å; F116-F120 HydrophobicContact CE2-CD2 3.36Å; F116-F120 AromaticContact CE2-CE2 3.46Å; F116-F120 HydrophobicContact CE2-CE2 3.46Å; F116-F120 VanDerWaalsContact CE2-CE2 3.46Å; F116-F120 HydrophobicContact CE2-CG 4.1Å; F116-F120 HydrophobicContact CE2-CZ 4.25Å; F116-F120 AromaticContact CG-CD2 3.86Å; F116-F120 HydrophobicContact CG-CD2 3.86Å; F116-F120 HydrophobicContact CG-CE2 4.42Å; F116-F120 HydrophobicContact CZ-CB 4.44Å; F116-F120 AromaticContact CZ-CD2 3.81Å; F116-F120 HydrophobicContact CZ-CD2 3.81Å; F116-F120 HydrophobicContact CZ-CE2 4.28Å; F116-F120 HydrophobicContact CZ-CG 4.12Å; F116-F120 WeakPolarHBondContact O-CB 3.15Å; F116-F120 WeakPolarHBondContact O-CD2 3.43Å; F116-F120 PolarHBondContact O-N 3.47Å |
| 117 | F | 66.5 | Low | 64 | Low | 123 Ų | 123 | 76.6 Ų | 76.6 | 54% | 0.539 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61.6 | -35.1 | 176.2 | -95.1 | -77.2 | 0 | 0 | 0 | 113.5 | I113 L114 G121 | I113-F117 HydrophobicContact CG2-CD2 4.11Å; I113-F117 HydrophobicContact CG2-CE2 4.31Å; I113-F117 PolarHBondContact O-N 2.86Å; L114-F117 CarbonylContact O-C 3.58Å; L114-F117 PolarHBondContact O-N 3.27Å; L114-F117 VanDerWaalsContact O-N 3.17Å; F117-G121 WeakPolarHBondContact O-CA 3.36Å; F117-G121 PolarHBondContact O-N 3.48Å |
| 118 | L | 68.6 | Low | 62 | Low | 125 Ų | 125 | 85.4 Ų | 85.4 | 65% | 0.654 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -73.3 | -41 | 179 | -164.6 | 156.1 | 0 | 0 | 0 | 111 | L114 G115 F116 | L114-L118 HydrophobicContact CD2-CD1 4.32Å; L114-L118 WeakPolarHBondContact O-CB 3.38Å; L114-L118 PolarHBondContact O-N 2.95Å; G115-L118 PolarHBondContact O-N 3.17Å; F116-L118 VanDerWaalsContact C-N 3.3Å; F116-L118 PolarHBondContact O-N 3.38Å |
| 119 | V | 67.5 | Low | 59.9 | Low | 70 Ų | 70 | 91.5 Ų | 91.5 | 42% | 0.424 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -72 | -36.7 | 178.5 | 169.3 | 0 | 0 | 0 | 0 | 112.3 | A6 G115 F116 | A6-V119 HydrophobicContact CB-CG1 3.96Å; A6-V119 HydrophobicContact CB-CG2 4.26Å; G115-V119 VanDerWaalsContact O-CB 3.31Å; G115-V119 WeakPolarHBondContact O-CB 3.24Å; G115-V119 WeakPolarHBondContact O-CG2 3.27Å; G115-V119 PolarHBondContact O-N 2.93Å; F116-V119 PolarHBondContact O-N 3.43Å |
| 120 | F | 61.6 | Low | 57.7 | Low | 63 Ų | 63 | 100.3 Ų | 100.3 | 28% | 0.276 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -108.9 | -15.3 | -173.5 | -68.3 | -80 | 0 | 0 | 0 | 114.9 | L7 L10 F116 | L7-F120 HydrophobicContact CD1-CZ 3.92Å; L7-F120 HydrophobicContact CG-CZ 4.43Å; L10-F120 HydrophobicContact CD1-CE2 4.28Å; F116-F120 HydrophobicContact CD1-CD2 4.27Å; F116-F120 AromaticContact CD2-CD2 3.39Å; F116-F120 HydrophobicContact CD2-CD2 3.39Å; F116-F120 AromaticContact CD2-CE2 3.54Å; F116-F120 HydrophobicContact CD2-CE2 3.54Å; F116-F120 HydrophobicContact CD2-CG 4.45Å; F116-F120 HydrophobicContact CE1-CB 4.37Å; F116-F120 HydrophobicContact CE1-CD2 4.24Å; F116-F120 HydrophobicContact CE1-CG 4.5Å; F116-F120 AromaticContact CE2-CD2 3.36Å; F116-F120 HydrophobicContact CE2-CD2 3.36Å; F116-F120 AromaticContact CE2-CE2 3.46Å; F116-F120 HydrophobicContact CE2-CE2 3.46Å; F116-F120 VanDerWaalsContact CE2-CE2 3.46Å; F116-F120 HydrophobicContact CE2-CG 4.1Å; F116-F120 HydrophobicContact CE2-CZ 4.25Å; F116-F120 AromaticContact CG-CD2 3.86Å; F116-F120 HydrophobicContact CG-CD2 3.86Å; F116-F120 HydrophobicContact CG-CE2 4.42Å; F116-F120 HydrophobicContact CZ-CB 4.44Å; F116-F120 AromaticContact CZ-CD2 3.81Å; F116-F120 HydrophobicContact CZ-CD2 3.81Å; F116-F120 HydrophobicContact CZ-CE2 4.28Å; F116-F120 HydrophobicContact CZ-CG 4.12Å; F116-F120 WeakPolarHBondContact O-CB 3.15Å; F116-F120 WeakPolarHBondContact O-CD2 3.43Å; F116-F120 PolarHBondContact O-N 3.47Å |
| 121 | G | 52.4 | Low | 55.7 | Low | 53 Ų | 53 | 113.7 Ų | 113.7 | 55% | 0.546 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -105.1 | -7.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | F117 G123 | F117-G121 WeakPolarHBondContact O-CA 3.36Å; F117-G121 PolarHBondContact O-N 3.48Å; G121-G123 VanDerWaalsContact C-N 3.3Å; G121-G123 PolarHBondContact O-N 2.95Å |
| 122 | G | 45.9 | Very low | 54.5 | Low | 74 Ų | 74 | 113.4 Ų | 113.4 | 76% | 0.763 | 59% | 0.587 | S | S | * | * | S | Bend | trans | -86.2 | 13.2 | 177 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 123 | G | 39.7 | Very low | 53.3 | Low | 38 Ų | 38 | 118.3 Ų | 118.3 | 39% | 0.392 | 61% | 0.611 | S | S | . | * | trans | -146 | 107.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | G121 D125 | G121-G123 VanDerWaalsContact C-N 3.3Å; G121-G123 PolarHBondContact O-N 2.95Å; G123-D125 PolarHBondContact O-N 3.13Å | ||
| 124 | D | 44.5 | Very low | 52.1 | Low | 167 Ų | 167 | 122.6 Ų | 122.6 | 89% | 0.893 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.7 | 33.4 | 149.7 | -74.6 | -112.5 | 0 | 0 | 0 | 112.3 | ||
| 125 | D | 42.8 | Very low | 50.9 | Low | 151 Ų | 151 | 123.6 Ų | 123.6 | 81% | 0.807 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -156.9 | 40.9 | -174.6 | -71.9 | -64.8 | 0 | 0 | 0 | 111.7 | G123 | G123-D125 PolarHBondContact O-N 3.13Š|
| 126 | F | 43.5 | Very low | 49.5 | Very low | 127 Ų | 127 | 130 Ų | 130 | 56% | 0.557 | 66% | 0.664 | S | S | * | * | trans | -102.2 | 73 | 156.6 | -141.8 | -92.4 | 0 | 0 | 0 | 107.8 | W128 | F126-W128 PolarHBondContact O-N 3.28Š| ||
| 127 | S | 38.1 | Very low | 47.9 | Very low | 88 Ų | 88 | 132.6 Ų | 132.6 | 62% | 0.615 | 68% | 0.682 | S | S | * | * | trans | -52.4 | 110.9 | 169.6 | 64.5 | 0 | 0 | 0 | 0 | 108 | E129 | S127-E129 PolarHBondContact O-N 3.34Š| ||
| 128 | W | 41 | Very low | 46.6 | Very low | 229 Ų | 229 | 133.3 Ų | 133.3 | 87% | 0.867 | 69% | 0.692 | S | S | * | * | trans | -70.2 | 21.4 | 169.3 | -76.1 | 94.8 | 0 | 0 | 0 | 112.3 | F126 Q130 | F126-W128 PolarHBondContact O-N 3.28Å; W128-Q130 PolarHBondContact O-N 3.16Å | ||
| 129 | E | 38.1 | Very low | 44.9 | Very low | 173 Ų | 173 | 133.9 Ų | 133.9 | 81% | 0.808 | 70% | 0.695 | S | S | * | * | trans | -97.4 | 50.2 | -177.5 | -60.1 | -137.4 | 129.3 | 0 | 0 | 112.5 | S127 | S127-E129 PolarHBondContact O-N 3.34Š| ||
| 130 | Q | 32.8 | Very low | 43.1 | Very low | 185 Ų | 185 | 139.3 Ų | 139.3 | 86% | 0.864 | 72% | 0.718 | S | S | * | * | trans | -132.6 | 50.1 | 161.4 | -71.7 | -150.6 | -53 | 0 | 0 | 111.8 | W128 | W128-Q130 PolarHBondContact O-N 3.16Š| ||
| 131 | W | 36.3 | Very low | 41.4 | Very low | 323 Ų | 323 | 146.2 Ų | 146.2 | 100% | 1.223 | 76% | 0.758 | S | S | * | * | trans | -139.1 | 0 | 142.9 | -115.7 | 70 | 0 | 0 | 0 | 109.2 |
Retrieved 131 of 131 residues in 228.3 ms
(Link to these results)