| 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 | 43.3 | Very low | 80.2 | Confident | 226 Ų | 226 | 70 Ų | 70 | 100% | 1.113 | 40% | 0.396 | S | S | * | . | 0 | 105.7 | 0 | -71 | -176.3 | -111.7 | 0 | 0 | 109.2 | N3 | M1-N3 PolarHBondContact O-N 2.86Š| |||
| 2 | A | 51.7 | Low | 81.5 | Confident | 29 Ų | 29 | 74.3 Ų | 74.3 | 24% | 0.24 | 41% | 0.408 | C | S | . | . | trans | -59.8 | 109.8 | 164.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | S4 K103 T185 | A2-S4 PolarHBondContact O-N 2.96Å; A2-K103 PolarHBondContact O-NZ 3.26Å; A2-T185 HydrophobicContact CB-CG2 3.73Å | ||
| 3 | N | 70.3 | Confident | 82.7 | Confident | 126 Ų | 126 | 72.2 Ų | 72.2 | 67% | 0.674 | 40% | 0.395 | S | S | * | . | trans | -58.5 | 128.3 | -179.8 | -152.6 | 5.3 | 0 | 0 | 0 | 106.4 | M1 G5 L6 Q7 | M1-N3 PolarHBondContact O-N 2.86Å; N3-G5 PolarHBondContact O-N 2.74Å; N3-L6 PolarHBondContact O-N 2.94Å; N3-Q7 PolarHBondContact O-N 3.46Å | ||
| 4 | S | 79.8 | Confident | 83.7 | Confident | 73 Ų | 73 | 67 Ų | 67 | 51% | 0.51 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -51.8 | -28 | -178.6 | -59.3 | 0 | 0 | 0 | 0 | 111.8 | A2 Q7 L8 | A2-S4 PolarHBondContact O-N 2.96Å; S4-Q7 PolarHBondContact O-N 3.04Å; S4-L8 WeakPolarHBondContact O-CB 3.42Å; S4-L8 PolarHBondContact O-N 3.11Å |
| 5 | G | 86.2 | Confident | 84.5 | Confident | 44 Ų | 44 | 65.9 Ų | 65.9 | 45% | 0.454 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -61 | -39.2 | 171 | 0 | 0 | 0 | 0 | 0 | 115.2 | N3 L8 L9 | N3-G5 PolarHBondContact O-N 2.74Å; G5-L8 PolarHBondContact O-N 3.43Å; G5-L9 VanDerWaalsContact O-CB 3.26Å; G5-L9 WeakPolarHBondContact O-CB 3.34Å; G5-L9 PolarHBondContact O-N 2.88Å |
| 6 | L | 88.2 | Confident | 85.3 | Confident | 62 Ų | 62 | 64 Ų | 64 | 33% | 0.325 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -69.8 | -39.5 | 178.1 | -176.2 | 64.4 | 0 | 0 | 0 | 111.5 | N3 L8 L9 G10 F181 | N3-L6 PolarHBondContact O-N 2.94Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L9 PolarHBondContact O-N 3.34Å; L6-G10 PolarHBondContact O-N 3.07Å; L6-F181 HydrophobicContact CD1-CB 4.23Å; L6-F181 HydrophobicContact CD1-CD1 4.07Å; L6-F181 HydrophobicContact CD1-CD2 4.07Å; L6-F181 HydrophobicContact CD1-CE1 4.43Å; L6-F181 HydrophobicContact CD1-CE2 4.44Å; L6-F181 HydrophobicContact CD1-CG 3.87Å; L6-F181 HydrophobicContact CG-CB 4.38Å |
| 7 | Q | 89.5 | Confident | 86 | Confident | 8 Ų | 8 | 60.2 Ų | 60.2 | 4% | 0.037 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65.1 | -41.9 | 176.6 | -167.7 | 176.8 | 26.1 | 0 | 0 | 110.9 | N3 S4 G10 Y11 G101 M102 L182 T185 | N3-Q7 PolarHBondContact O-N 3.46Å; S4-Q7 PolarHBondContact O-N 3.04Å; Q7-G10 PolarHBondContact O-N 2.79Å; Q7-Y11 WeakPolarHBondContact O-CB 3.4Å; Q7-Y11 PolarHBondContact O-N 2.78Å; Q7-G101 PolarHBondContact NE2-O 3.5Å; Q7-M102 HydrophobicContact CG-CE 4.47Å; Q7-M102 HydrophobicContact CG-CG 3.99Å; Q7-L182 HydrophobicContact CG-CD2 3.88Å; Q7-T185 HydrophobicContact CB-CG2 4.3Å; Q7-T185 HydrophobicContact CG-CG2 4.25Å |
| 8 | L | 91.3 | Very high | 86.7 | Confident | 75 Ų | 75 | 59.2 Ų | 59.2 | 39% | 0.393 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66.8 | -42.3 | 176.9 | -172.6 | 61.6 | 0 | 0 | 0 | 111.9 | S4 G5 L6 Y11 F12 M102 | S4-L8 WeakPolarHBondContact O-CB 3.42Å; S4-L8 PolarHBondContact O-N 3.11Å; G5-L8 PolarHBondContact O-N 3.43Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L8-Y11 PolarHBondContact O-N 2.84Å; L8-F12 HydrophobicContact CD1-CD2 3.93Å; L8-F12 HydrophobicContact CD1-CE2 3.35Å; L8-F12 HydrophobicContact CD1-CZ 4Å; L8-F12 HydrophobicContact CD2-CE2 4.03Å; L8-F12 HydrophobicContact CG-CD2 3.81Å; L8-F12 HydrophobicContact CG-CE2 3.45Å; L8-F12 VanDerWaalsContact CG-CE2 3.45Å; L8-F12 WeakPolarHBondContact O-CD2 3.02Å; L8-F12 PolarHBondContact O-N 2.05Å; L8-M102 HydrophobicContact CB-CE 4.36Å; L8-M102 HydrophobicContact CD1-CE 3.74Å |
| 9 | L | 93.3 | Very high | 87.3 | Confident | 89 Ų | 89 | 60.2 Ų | 60.2 | 47% | 0.466 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.3 | -48.4 | 173.4 | 178.4 | 62.9 | 0 | 0 | 0 | 111.2 | G5 L6 Y11 F12 L13 F181 | G5-L9 VanDerWaalsContact O-CB 3.26Å; G5-L9 WeakPolarHBondContact O-CB 3.34Å; G5-L9 PolarHBondContact O-N 2.88Å; L6-L9 PolarHBondContact O-N 3.34Å; L9-Y11 VanDerWaalsContact C-N 3.3Å; L9-Y11 PolarHBondContact O-N 2.9Å; L9-F12 PolarHBondContact O-N 2.83Å; L9-L13 HydrophobicContact CD1-CD1 4.14Å; L9-L13 HydrophobicContact CD1-CG 4.22Å; L9-L13 HydrophobicContact CG-CD1 3.97Å; L9-L13 HydrophobicContact CG-CG 4.46Å; L9-L13 WeakPolarHBondContact O-CB 3.37Å; L9-L13 VanDerWaalsContact O-CG 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 2.68Å; L9-F181 HydrophobicContact CD2-CE2 4.23Å |
| 10 | G | 94.1 | Very high | 87.8 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.3 | -42.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | L6 Q7 L13 A14 G178 | L6-G10 PolarHBondContact O-N 3.07Å; Q7-G10 PolarHBondContact O-N 2.79Å; G10-L13 PolarHBondContact O-N 3.38Å; G10-A14 VanDerWaalsContact O-CB 3.28Å; G10-A14 WeakPolarHBondContact O-CB 3.09Å; G10-A14 PolarHBondContact O-N 3.43Å; G10-G178 VanDerWaalsContact O-CA 3.24Å; G10-G178 WeakPolarHBondContact O-CA 3.08Å |
| 11 | Y | 94.5 | Very high | 88.2 | Confident | 38 Ų | 38 | 55.2 Ų | 55.2 | 15% | 0.149 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.2 | -47.7 | 175.6 | 177.9 | -101.9 | 0 | 0 | 0 | 112.8 | Q7 L8 L9 L13 A14 L15 M95 V99 M102 | Q7-Y11 WeakPolarHBondContact O-CB 3.4Å; Q7-Y11 PolarHBondContact O-N 2.78Å; L8-Y11 PolarHBondContact O-N 2.84Å; L9-Y11 VanDerWaalsContact C-N 3.3Å; L9-Y11 PolarHBondContact O-N 2.9Å; Y11-L13 PolarHBondContact O-N 2.85Å; Y11-A14 PolarHBondContact O-N 2.92Å; Y11-L15 WeakPolarHBondContact O-CB 3.3Å; Y11-L15 PolarHBondContact O-N 3.46Å; Y11-M95 HydrophobicContact CE2-CE 3.78Å; Y11-M95 HydrophobicContact CE2-SD 4.11Å; Y11-M95 WeakPolarHBondContact OH-CE 3.39Å; Y11-V99 HydrophobicContact CE2-CG2 3.62Å; Y11-V99 WeakPolarHBondContact OH-CG2 3.3Å; Y11-M102 HydrophobicContact CD1-CE 4.26Å; Y11-M102 HydrophobicContact CD1-SD 4.23Å; Y11-M102 HydrophobicContact CD2-SD 3.73Å; Y11-M102 HydrophobicContact CE2-SD 4.32Å; Y11-M102 HydrophobicContact CG-CE 3.92Å; Y11-M102 HydrophobicContact CG-SD 3.66Å |
| 12 | F | 95.9 | Very high | 90.8 | Very high | 122 Ų | 122 | 47.5 Ų | 47.5 | 54% | 0.535 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -67 | -36.9 | 179.1 | -75.4 | -59.6 | 0 | 0 | 0 | 112.8 | L8 L9 L15 G16 | L8-F12 HydrophobicContact CD1-CD2 3.93Å; L8-F12 HydrophobicContact CD1-CE2 3.35Å; L8-F12 HydrophobicContact CD1-CZ 4Å; L8-F12 HydrophobicContact CD2-CE2 4.03Å; L8-F12 HydrophobicContact CG-CD2 3.81Å; L8-F12 HydrophobicContact CG-CE2 3.45Å; L8-F12 VanDerWaalsContact CG-CE2 3.45Å; L8-F12 WeakPolarHBondContact O-CD2 3.02Å; L8-F12 PolarHBondContact O-N 2.05Å; L9-F12 PolarHBondContact O-N 2.83Å; F12-L15 HydrophobicContact CD1-CD2 4.39Å; F12-G16 PolarHBondContact O-N 2.83Å |
| 13 | L | 96.7 | Very high | 92.9 | Very high | 46 Ų | 46 | 48 Ų | 48 | 24% | 0.241 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63.6 | -45 | 173 | -71 | 172 | 0 | 0 | 0 | 111.4 | L9 G10 Y11 G16 G17 L174 F181 | L9-L13 HydrophobicContact CD1-CD1 4.14Å; L9-L13 HydrophobicContact CD1-CG 4.22Å; L9-L13 HydrophobicContact CG-CD1 3.97Å; L9-L13 HydrophobicContact CG-CG 4.46Å; L9-L13 WeakPolarHBondContact O-CB 3.37Å; L9-L13 VanDerWaalsContact O-CG 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 2.68Å; G10-L13 PolarHBondContact O-N 3.38Å; Y11-L13 PolarHBondContact O-N 2.85Å; L13-G16 PolarHBondContact O-N 3.06Å; L13-G17 PolarHBondContact O-N 2.98Å; L13-L174 HydrophobicContact CD2-CD2 3.86Å; L13-F181 HydrophobicContact CD1-CD2 3.79Å; L13-F181 HydrophobicContact CD1-CE2 3.62Å |
| 14 | A | 96.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.6 | -40.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G10 Y11 G17 W18 F126 L182 | G10-A14 VanDerWaalsContact O-CB 3.28Å; G10-A14 WeakPolarHBondContact O-CB 3.09Å; G10-A14 PolarHBondContact O-N 3.43Å; Y11-A14 PolarHBondContact O-N 2.92Å; A14-G17 PolarHBondContact O-N 2.92Å; A14-W18 WeakPolarHBondContact O-CB 3.43Å; A14-W18 PolarHBondContact O-N 2.77Å; A14-F126 HydrophobicContact CB-CB 4.49Å; A14-F126 HydrophobicContact CB-CD1 3.87Å; A14-F126 HydrophobicContact CB-CD2 3.65Å; A14-F126 HydrophobicContact CB-CE1 3.9Å; A14-F126 HydrophobicContact CB-CE2 3.64Å; A14-F126 HydrophobicContact CB-CG 3.76Å; A14-F126 HydrophobicContact CB-CZ 3.78Å; A14-L182 HydrophobicContact CB-CD1 4.35Å |
| 15 | L | 96.6 | Very high | 94.8 | Very high | 51 Ų | 51 | 39.2 Ų | 39.2 | 27% | 0.267 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -61.2 | -48.3 | 173.7 | 173.6 | 70.2 | 0 | 0 | 0 | 111.1 | Y11 F12 G17 W18 V19 M95 | Y11-L15 WeakPolarHBondContact O-CB 3.3Å; Y11-L15 PolarHBondContact O-N 3.46Å; F12-L15 HydrophobicContact CD1-CD2 4.39Å; L15-G17 VanDerWaalsContact C-N 3.32Å; L15-G17 PolarHBondContact O-N 2.61Å; L15-W18 PolarHBondContact O-N 2.84Å; L15-V19 HydrophobicContact CD1-CG2 4.39Å; L15-V19 WeakPolarHBondContact O-CG2 3.39Å; L15-V19 PolarHBondContact O-N 2.73Å; L15-M95 HydrophobicContact CB-CE 4.36Å; L15-M95 HydrophobicContact CB-SD 3.94Å; L15-M95 HydrophobicContact CD1-CE 3.34Å; L15-M95 HydrophobicContact CD1-SD 3.63Å; L15-M95 HydrophobicContact CG-CE 4.32Å; L15-M95 HydrophobicContact CG-SD 4.38Å |
| 16 | G | 97.4 | Very high | 95.2 | Very high | 35 Ų | 35 | 40 Ų | 40 | 36% | 0.361 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -60.9 | -41.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F12 L13 G20 | F12-G16 PolarHBondContact O-N 2.83Å; L13-G16 PolarHBondContact O-N 3.06Å; G16-G20 PolarHBondContact O-N 2.87Å |
| 17 | G | 97.5 | Very high | 95.4 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -58.5 | -49.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | L13 A14 L15 V19 G20 I21 S171 | L13-G17 PolarHBondContact O-N 2.98Å; A14-G17 PolarHBondContact O-N 2.92Å; L15-G17 VanDerWaalsContact C-N 3.32Å; L15-G17 PolarHBondContact O-N 2.61Å; G17-V19 PolarHBondContact O-N 2.79Å; G17-G20 CarbonylContact O-C 3.54Å; G17-G20 WeakPolarHBondContact O-CA 3.09Å; G17-G20 PolarHBondContact O-N 2.91Å; G17-G20 VanDerWaalsContact O-N 3.1Å; G17-I21 WeakPolarHBondContact O-CG1 3.27Å; G17-I21 PolarHBondContact O-N 3.43Å; G17-S171 WeakPolarHBondContact CA-O 3.5Å; G17-S171 WeakPolarHBondContact O-CB 3.5Å |
| 18 | W | 97.6 | Very high | 95.5 | Very high | 42 Ų | 42 | 41 Ų | 41 | 16% | 0.159 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.6 | -41.7 | -180 | -176.3 | 65.1 | 0 | 0 | 0 | 113.4 | A14 L15 G20 I21 I22 V88 G91 F92 M95 F126 | A14-W18 WeakPolarHBondContact O-CB 3.43Å; A14-W18 PolarHBondContact O-N 2.77Å; L15-W18 PolarHBondContact O-N 2.84Å; W18-G20 VanDerWaalsContact C-N 3.28Å; W18-G20 PolarHBondContact O-N 2.89Å; W18-I21 WeakPolarHBondContact O-CB 3.27Å; W18-I21 PolarHBondContact O-N 3.18Å; W18-I21 VanDerWaalsContact O-N 3.17Å; W18-I22 HydrophobicContact CD2-CD1 3.89Å; W18-I22 HydrophobicContact CE3-CD1 3.89Å; W18-I22 HydrophobicContact CH2-CD1 3.65Å; W18-I22 HydrophobicContact CZ2-CD1 3.64Å; W18-I22 HydrophobicContact CZ3-CD1 3.77Å; W18-I22 WeakPolarHBondContact O-CG1 3.45Å; W18-I22 PolarHBondContact O-N 3.21Å; W18-V88 PolarHBondContact NE1-O 2.9Å; W18-G91 VanDerWaalsContact CD1-CA 3.42Å; W18-F92 HydrophobicContact CH2-CD2 4.05Å; W18-F92 HydrophobicContact CZ2-CB 3.79Å; W18-F92 HydrophobicContact CZ2-CD2 4.04Å; W18-F92 HydrophobicContact CZ2-CG 4.43Å; W18-M95 HydrophobicContact CD2-CG 4.22Å; W18-M95 HydrophobicContact CE3-CG 4.13Å; W18-F126 HydrophobicContact CB-CE1 4.2Å |
| 19 | V | 97.7 | Very high | 95.6 | Very high | 78 Ų | 78 | 40.3 Ų | 40.3 | 47% | 0.473 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -61 | -40.3 | 172.2 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | L15 G17 I22 A23 | L15-V19 HydrophobicContact CD1-CG2 4.39Å; L15-V19 WeakPolarHBondContact O-CG2 3.39Å; L15-V19 PolarHBondContact O-N 2.73Å; G17-V19 PolarHBondContact O-N 2.79Å; V19-I22 PolarHBondContact O-N 3.27Å; V19-A23 WeakPolarHBondContact O-CB 3.18Å; V19-A23 PolarHBondContact O-N 3.19Å |
| 20 | G | 97.1 | Very high | 95.6 | Very high | 14 Ų | 14 | 36 Ų | 36 | 14% | 0.144 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.1 | -38.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | G16 G17 W18 A23 S24 S171 | G16-G20 PolarHBondContact O-N 2.87Å; G17-G20 CarbonylContact O-C 3.54Å; G17-G20 WeakPolarHBondContact O-CA 3.09Å; G17-G20 PolarHBondContact O-N 2.91Å; G17-G20 VanDerWaalsContact O-N 3.1Å; W18-G20 VanDerWaalsContact C-N 3.28Å; W18-G20 PolarHBondContact O-N 2.89Å; G20-A23 PolarHBondContact O-N 3.13Å; G20-S24 WeakPolarHBondContact O-CB 3.31Å; G20-S24 PolarHBondContact O-N 3.47Å; G20-S171 VanDerWaalsContact C-CB 3.44Å |
| 21 | I | 97.5 | Very high | 95.4 | Very high | 1 Ų | 1 | 37.7 Ų | 37.7 | 1% | 0.005 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.2 | -45.1 | 175.2 | -65.9 | 168.8 | 0 | 0 | 0 | 109.9 | G17 W18 S24 T25 M84 A87 V88 T133 S171 A175 | G17-I21 WeakPolarHBondContact O-CG1 3.27Å; G17-I21 PolarHBondContact O-N 3.43Å; W18-I21 WeakPolarHBondContact O-CB 3.27Å; W18-I21 PolarHBondContact O-N 3.18Å; W18-I21 VanDerWaalsContact O-N 3.17Å; I21-S24 PolarHBondContact O-N 3.08Å; I21-T25 WeakPolarHBondContact O-CB 3.44Å; I21-T25 PolarHBondContact O-N 3.1Å; I21-T25 PolarHBondContact O-OG1 2.97Å; I21-M84 HydrophobicContact CG2-CE 4.03Å; I21-A87 HydrophobicContact CG2-CB 4.17Å; I21-V88 HydrophobicContact CG2-CG2 3.84Å; I21-T133 WeakPolarHBondContact CD1-OG1 3.4Å; I21-T133 HydrophobicContact CG1-CG2 4Å; I21-T133 WeakPolarHBondContact CG1-OG1 3.36Å; I21-S171 WeakPolarHBondContact CG1-OG 3.41Å; I21-A175 HydrophobicContact CD1-CB 4.27Å |
| 22 | I | 97.2 | Very high | 95.2 | Very high | 65 Ų | 65 | 38.9 Ų | 38.9 | 33% | 0.333 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.8 | -47.7 | 176 | -66.1 | 167.4 | 0 | 0 | 0 | 110.4 | W18 V19 T25 A26 V88 | W18-I22 HydrophobicContact CD2-CD1 3.89Å; W18-I22 HydrophobicContact CE3-CD1 3.89Å; W18-I22 HydrophobicContact CH2-CD1 3.65Å; W18-I22 HydrophobicContact CZ2-CD1 3.64Å; W18-I22 HydrophobicContact CZ3-CD1 3.77Å; W18-I22 WeakPolarHBondContact O-CG1 3.45Å; W18-I22 PolarHBondContact O-N 3.21Å; V19-I22 PolarHBondContact O-N 3.27Å; I22-T25 WeakPolarHBondContact O-CB 3.31Å; I22-T25 PolarHBondContact O-N 2.97Å; I22-A26 WeakPolarHBondContact O-CB 3.46Å; I22-A26 PolarHBondContact O-N 3.36Å; I22-V88 HydrophobicContact CG1-CG1 4.1Å; I22-V88 HydrophobicContact CG1-CG2 4.11Å |
| 23 | A | 96.6 | Very high | 94.7 | Very high | 40 Ų | 40 | 33.7 Ų | 33.7 | 33% | 0.331 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -60 | -49.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | V19 G20 T25 A26 L27 | V19-A23 WeakPolarHBondContact O-CB 3.18Å; V19-A23 PolarHBondContact O-N 3.19Å; G20-A23 PolarHBondContact O-N 3.13Å; A23-T25 VanDerWaalsContact C-N 3.29Å; A23-T25 PolarHBondContact O-N 3.01Å; A23-A26 PolarHBondContact O-N 3.33Å; A23-A26 VanDerWaalsContact O-N 3.15Å; A23-L27 WeakPolarHBondContact O-CB 3.19Å; A23-L27 WeakPolarHBondContact O-CG 3.45Å; A23-L27 PolarHBondContact O-N 2.96Å |
| 24 | S | 95.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.7 | -40.2 | 176.1 | 177.5 | 0 | 0 | 0 | 0 | 111.8 | G20 I21 A26 W30 A164 G168 | G20-S24 WeakPolarHBondContact O-CB 3.31Å; G20-S24 PolarHBondContact O-N 3.47Å; I21-S24 PolarHBondContact O-N 3.08Å; S24-A26 PolarHBondContact O-N 3.16Å; S24-W30 PolarHBondContact O-NE1 3Å; S24-A164 PolarHBondContact OG-O 3.47Å; S24-G168 WeakPolarHBondContact OG-CA 3.23Å |
| 25 | T | 94.7 | Very high | 92.3 | Very high | 13 Ų | 13 | 39.6 Ų | 39.6 | 8% | 0.08 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.9 | -38.3 | 176.6 | -54.9 | 0 | 0 | 0 | 0 | 112.4 | I21 I22 A23 L50 W51 M84 | I21-T25 WeakPolarHBondContact O-CB 3.44Å; I21-T25 PolarHBondContact O-N 3.1Å; I21-T25 PolarHBondContact O-OG1 2.97Å; I22-T25 WeakPolarHBondContact O-CB 3.31Å; I22-T25 PolarHBondContact O-N 2.97Å; A23-T25 VanDerWaalsContact C-N 3.29Å; A23-T25 PolarHBondContact O-N 3.01Å; T25-L50 HydrophobicContact CG2-CD2 4.07Å; T25-W51 HydrophobicContact CG2-CZ2 4.27Å; T25-W51 PolarHBondContact O-NE1 3.15Å; T25-M84 HydrophobicContact CG2-CB 4.14Å; T25-M84 WeakPolarHBondContact OG1-CE 3.44Å |
| 26 | A | 94.1 | Very high | 90.5 | Very high | 61 Ų | 61 | 40.4 Ų | 40.4 | 50% | 0.504 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -83.5 | -28.4 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | I22 A23 S24 | I22-A26 WeakPolarHBondContact O-CB 3.46Å; I22-A26 PolarHBondContact O-N 3.36Å; A23-A26 PolarHBondContact O-N 3.33Å; A23-A26 VanDerWaalsContact O-N 3.15Å; S24-A26 PolarHBondContact O-N 3.16Å |
| 27 | L | 93.4 | Very high | 88.4 | Confident | 57 Ų | 57 | 39.7 Ų | 39.7 | 30% | 0.298 | 23% | 0.234 | S | C | . | . | trans | -64.5 | 134 | -175.8 | -79.4 | 167.1 | 0 | 0 | 0 | 111.9 | A23 Q29 W30 A164 V167 | A23-L27 WeakPolarHBondContact O-CB 3.19Å; A23-L27 WeakPolarHBondContact O-CG 3.45Å; A23-L27 PolarHBondContact O-N 2.96Å; L27-Q29 PolarHBondContact O-N 3.24Å; L27-W30 VanDerWaalsContact O-CD1 3.3Å; L27-A164 HydrophobicContact CB-CB 3.73Å; L27-A164 HydrophobicContact CD1-CB 4.18Å; L27-V167 HydrophobicContact CD1-CG2 4.49Å | ||
| 28 | P | 91 | Very high | 86.2 | Confident | 33 Ų | 33 | 47.2 Ų | 47.2 | 21% | 0.214 | 27% | 0.274 | C | S | . | . | S | Bend | trans | -83.2 | 11.4 | -179.3 | 34.9 | -36.5 | 0 | 0 | 0 | 113.7 | E48 G49 M52 | P28-E48 CarbonylContact O-C 3.55Å; P28-G49 VanDerWaalsContact C-CA 3.41Å; P28-G49 VanDerWaalsContact O-CA 3.27Å; P28-G49 WeakPolarHBondContact O-CA 3.11Å; P28-G49 PolarHBondContact O-N 2.92Å; P28-M52 HydrophobicContact CB-CG 3.55Å; P28-M52 HydrophobicContact CB-SD 3.92Å; P28-M52 HydrophobicContact CG-SD 4.45Å |
| 29 | Q | 92.1 | Very high | 83.9 | Confident | 61 Ų | 61 | 49.2 Ų | 49.2 | 29% | 0.285 | 30% | 0.3 | S | S | . | . | trans | -117.6 | 56.6 | -168.9 | -60.1 | 179.3 | -58.3 | 0 | 0 | 111.1 | L27 Y47 G162 P163 A164 | L27-Q29 PolarHBondContact O-N 3.24Å; Q29-Y47 HydrophobicContact CG-CD1 4.09Å; Q29-Y47 HydrophobicContact CG-CG 4.41Å; Q29-G162 CarbonylContact O-C 3.58Å; Q29-G162 WeakPolarHBondContact O-CA 3.43Å; Q29-P163 HydrophobicContact CB-CG 3.68Å; Q29-P163 HydrophobicContact CG-CG 4.34Å; Q29-A164 WeakPolarHBondContact O-CB 3.38Å; Q29-A164 PolarHBondContact O-N 3.32Å | ||
| 30 | W | 93.8 | Very high | 81.8 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 31% | 0.311 | C | S | . | . | S | Bend | trans | -79.9 | -37.4 | 174.8 | -82.2 | 58.8 | 0 | 0 | 0 | 111.4 | S24 L27 E48 L50 M84 V137 Y140 G162 A164 L165 | S24-W30 PolarHBondContact O-NE1 3Å; L27-W30 VanDerWaalsContact O-CD1 3.3Å; W30-E48 WeakPolarHBondContact CA-O 3.15Å; W30-E48 WeakPolarHBondContact CB-O 3.41Å; W30-E48 PolarHBondContact N-O 2.9Å; W30-L50 HydrophobicContact CZ2-CD2 4.37Å; W30-M84 HydrophobicContact CH2-CE 4.26Å; W30-M84 HydrophobicContact CH2-CG 3.76Å; W30-M84 HydrophobicContact CH2-SD 3.86Å; W30-M84 HydrophobicContact CZ2-CE 4.05Å; W30-M84 HydrophobicContact CZ2-CG 4.03Å; W30-M84 HydrophobicContact CZ2-SD 4.23Å; W30-V137 HydrophobicContact CH2-CG2 3.88Å; W30-V137 HydrophobicContact CZ3-CG2 4.23Å; W30-Y140 HydrophobicContact CB-CD1 4.45Å; W30-Y140 HydrophobicContact CB-CE1 3.81Å; W30-Y140 AromaticContact CE3-CD1 3.85Å; W30-Y140 HydrophobicContact CE3-CD1 3.85Å; W30-Y140 AromaticContact CE3-CD2 3.81Å; W30-Y140 HydrophobicContact CE3-CD2 3.81Å; W30-Y140 HydrophobicContact CE3-CE1 4.25Å; W30-Y140 HydrophobicContact CE3-CE2 4.21Å; W30-Y140 AromaticContact CE3-CG 3.62Å; W30-Y140 HydrophobicContact CE3-CG 3.62Å; W30-Y140 HydrophobicContact CZ3-CD2 4.25Å; W30-Y140 HydrophobicContact CZ3-CG 4.04Å; W30-G162 PolarHBondContact O-N 2.84Å; W30-A164 HydrophobicContact CG-CB 4.23Å; W30-L165 HydrophobicContact CD2-CD2 4.12Å; W30-L165 HydrophobicContact CE3-CD2 3.47Å; W30-L165 VanDerWaalsContact CE3-CD2 3.47Å; W30-L165 HydrophobicContact CZ3-CD2 3.86Å; W30-L165 WeakPolarHBondContact O-CD1 2.89Å; W30-L165 VanDerWaalsContact O-CG 3.28Å; W30-L165 WeakPolarHBondContact O-CG 3.3Å |
| 31 | K | 91 | Very high | 80.1 | Confident | 34 Ų | 34 | 59.8 Ų | 59.8 | 15% | 0.148 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.1 | 152.7 | 167.7 | 64.9 | 179.7 | -175 | 175.4 | 0 | 110.7 | E48 Y140 V144 Y159 E160 | K31-E48 HydrophobicContact CD-CB 4.29Å; K31-E48 VanDerWaalsContact CE-CB 3.4Å; K31-E48 WeakPolarHBondContact CE-OE2 2.78Å; K31-E48 HydrophobicContact CG-CB 3.77Å; K31-E48 PolarHBondContact N-O 3.29Å; K31-E48 IonicContact NZ-OE1 2.76Å; K31-E48 IonicContact NZ-OE2 3.91Å; K31-E48 PolarHBondContact NZ-OE2 2.94Å; K31-E48 PolarHBondContact O-N 3.38Å; K31-Y140 HydrophobicContact CB-CE1 4.1Å; K31-Y140 HydrophobicContact CD-CE1 4.34Å; K31-Y140 WeakPolarHBondContact CD-OH 3.48Å; K31-Y140 HydrophobicContact CG-CE1 4.28Å; K31-Y140 WeakPolarHBondContact CG-OH 3.43Å; K31-V144 HydrophobicContact CB-CG2 4.02Å; K31-V144 HydrophobicContact CD-CG2 4.2Å; K31-Y159 HydrophobicContact CB-CD1 4.01Å; K31-Y159 HydrophobicContact CB-CG 4.34Å; K31-Y159 HydrophobicContact CD-CD1 3.69Å; K31-Y159 HydrophobicContact CD-CD2 4.16Å; K31-Y159 HydrophobicContact CD-CE1 4.22Å; K31-Y159 HydrophobicContact CD-CG 3.66Å; K31-Y159 HydrophobicContact CG-CD1 3.57Å; K31-Y159 HydrophobicContact CG-CE1 4.12Å; K31-Y159 HydrophobicContact CG-CG 4.03Å; K31-E160 VanDerWaalsContact CA-O 3.31Å; K31-E160 WeakPolarHBondContact CA-O 3.41Å |
| 32 | Q | 89.6 | Confident | 78.2 | Confident | 63 Ų | 63 | 62.8 Ų | 62.8 | 29% | 0.294 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.6 | 137.6 | -178 | 177.5 | -179.9 | -42.1 | 0 | 0 | 109.4 | S34 L46 Y47 Y159 E160 | Q32-S34 PolarHBondContact O-N 3.37Å; Q32-L46 CarbonylContact C-O 3.56Å; Q32-L46 WeakPolarHBondContact CA-O 3.42Å; Q32-Y47 HydrophobicContact CB-CD1 4.08Å; Q32-Y47 HydrophobicContact CB-CE1 4.35Å; Q32-Y47 VanDerWaalsContact CD-CE1 3.49Å; Q32-Y47 HydrophobicContact CG-CD1 3.79Å; Q32-Y47 HydrophobicContact CG-CE1 3.62Å; Q32-Y47 VanDerWaalsContact OE1-CE1 3.28Å; Q32-Y159 VanDerWaalsContact C-CD1 3.44Å; Q32-Y159 CarbonylContact O-C 3.49Å; Q32-Y159 VanDerWaalsContact O-CA 3.3Å; Q32-Y159 WeakPolarHBondContact O-CA 3.46Å; Q32-E160 PolarHBondContact N-O 2.91Å; Q32-E160 PolarHBondContact O-N 2.58Å |
| 33 | S | 85.8 | Confident | 76.7 | Confident | 13 Ų | 13 | 61 Ų | 61 | 9% | 0.091 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.1 | 129 | 176.6 | 58.1 | 0 | 0 | 0 | 0 | 110.7 | Y35 L46 | S33-Y35 VanDerWaalsContact C-N 3.28Å; S33-Y35 PolarHBondContact O-N 2.64Å; S33-L46 PolarHBondContact N-O 2.76Å; S33-L46 PolarHBondContact OG-N 2.68Å; S33-L46 PolarHBondContact OG-O 3.23Å |
| 34 | S | 75.7 | Confident | 75.6 | Confident | 36 Ų | 36 | 61.1 Ų | 61.1 | 25% | 0.252 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -72.2 | -25.5 | -178.7 | -33.2 | 0 | 0 | 0 | 0 | 112.1 | Q32 R158 E160 | Q32-S34 PolarHBondContact O-N 3.37Å; S34-R158 WeakPolarHBondContact CB-O 3.36Å; S34-R158 PolarHBondContact N-O 3.29Å; S34-R158 VanDerWaalsContact OG-C 3.31Å; S34-R158 PolarHBondContact OG-O 3.1Å; S34-E160 WeakPolarHBondContact CB-OE1 3.26Å; S34-E160 WeakPolarHBondContact OG-CG 3.23Å |
| 35 | Y | 66.4 | Low | 75 | Confident | 134 Ų | 134 | 62 Ų | 62 | 53% | 0.525 | 37% | 0.365 | S | S | . | . | trans | -112.3 | 111.4 | -172.8 | -134.5 | -90.3 | 0 | 0 | 0 | 110.2 | S33 G37 | S33-Y35 VanDerWaalsContact C-N 3.28Å; S33-Y35 PolarHBondContact O-N 2.64Å; Y35-G37 PolarHBondContact O-N 3.47Å; Y35-G37 VanDerWaalsContact O-N 3.07Å | ||
| 36 | A | 58.2 | Low | 74.6 | Confident | 68 Ų | 68 | 64.4 Ų | 64.4 | 56% | 0.562 | 38% | 0.378 | S | S | * | . | trans | -79.2 | 73.6 | 161 | 0 | 0 | 0 | 0 | 0 | 107.7 | D38 A43 | A36-D38 PolarHBondContact O-N 3.06Å; A36-A43 HydrophobicContact CB-CB 4.45Å | ||
| 37 | G | 53.9 | Low | 74.4 | Confident | 20 Ų | 20 | 64 Ų | 64 | 21% | 0.206 | 36% | 0.363 | C | S | . | . | trans | -72.8 | 124.2 | -169 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y35 A39 | Y35-G37 PolarHBondContact O-N 3.47Å; Y35-G37 VanDerWaalsContact O-N 3.07Å; G37-A39 PolarHBondContact O-N 2.93Å | ||
| 38 | D | 52.1 | Low | 74.2 | Confident | 159 Ų | 159 | 62.8 Ų | 62.8 | 85% | 0.85 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.2 | 5.6 | 168.1 | -85.3 | -33.2 | 0 | 0 | 0 | 115.4 | A36 | A36-D38 PolarHBondContact O-N 3.06Š|
| 39 | A | 48.6 | Very low | 74.2 | Confident | 84 Ų | 84 | 61.2 Ų | 61.2 | 69% | 0.694 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.9 | 9.5 | -163.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | G37 | G37-A39 PolarHBondContact O-N 2.93Š|
| 40 | I | 53.5 | Low | 74.1 | Confident | 140 Ų | 140 | 58.3 Ų | 58.3 | 72% | 0.718 | 33% | 0.333 | S | S | * | . | S | Bend | trans | -147.3 | 54.6 | 172.9 | -38 | 174.5 | 0 | 0 | 0 | 111.3 | T42 | I40-T42 PolarHBondContact O-N 3.44Š|
| 41 | I | 60.7 | Low | 74 | Confident | 173 Ų | 173 | 62.7 Ų | 62.7 | 89% | 0.887 | 35% | 0.349 | S | S | * | . | S | Bend | trans | 67.3 | -21.1 | 169.3 | -55.4 | 170.5 | 0 | 0 | 0 | 116 | ||
| 42 | T | 59 | Low | 73.9 | Confident | 65 Ų | 65 | 63.8 Ų | 63.8 | 40% | 0.399 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -145.2 | 134.7 | 177.3 | 53.6 | 0 | 0 | 0 | 0 | 110.3 | I40 V44 | I40-T42 PolarHBondContact O-N 3.44Å; T42-V44 PolarHBondContact O-N 2.98Å |
| 43 | A | 65.2 | Low | 73.9 | Confident | 28 Ų | 28 | 62.3 Ų | 62.3 | 23% | 0.231 | 35% | 0.352 | C | S | . | . | trans | -73 | 120.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | A36 S58 | A36-A43 HydrophobicContact CB-CB 4.45Å; A43-S58 WeakPolarHBondContact CB-OG 3.36Å; A43-S58 PolarHBondContact O-N 3.43Å; A43-S58 VanDerWaalsContact O-N 3.11Å; A43-S58 PolarHBondContact O-OG 3.47Å | ||
| 44 | V | 73.5 | Confident | 74.2 | Confident | 41 Ų | 41 | 61.9 Ų | 61.9 | 25% | 0.248 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.2 | 123 | -178.8 | -176.1 | 0 | 0 | 0 | 0 | 109 | T42 L46 A55 S56 Q57 | T42-V44 PolarHBondContact O-N 2.98Å; V44-L46 HydrophobicContact CG1-CD2 4.15Å; V44-A55 HydrophobicContact CG1-CB 3.85Å; V44-S56 CarbonylContact C-O 3.56Å; V44-S56 WeakPolarHBondContact CA-O 3.37Å; V44-Q57 HydrophobicContact CG1-CG 4.45Å; V44-Q57 HydrophobicContact CG2-CG 4.1Å |
| 45 | G | 82.5 | Confident | 74.7 | Confident | 18 Ų | 18 | 61.2 Ų | 61.2 | 19% | 0.186 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.8 | 122.6 | 168.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | S56 | G45-S56 PolarHBondContact N-O 3.49Å; G45-S56 PolarHBondContact O-N 2.95Å |
| 46 | L | 87.5 | Confident | 75.7 | Confident | 64 Ų | 64 | 56.5 Ų | 56.5 | 34% | 0.335 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 129.4 | 177.1 | -63.9 | 172.4 | 0 | 0 | 0 | 110.1 | Q32 S33 V44 A55 Y159 | Q32-L46 CarbonylContact C-O 3.56Å; Q32-L46 WeakPolarHBondContact CA-O 3.42Å; S33-L46 PolarHBondContact N-O 2.76Å; S33-L46 PolarHBondContact OG-N 2.68Å; S33-L46 PolarHBondContact OG-O 3.23Å; V44-L46 HydrophobicContact CG1-CD2 4.15Å; L46-A55 HydrophobicContact CD2-CB 3.73Å; L46-Y159 HydrophobicContact CB-CE1 4.44Å |
| 47 | Y | 89.2 | Confident | 76.9 | Confident | 53 Ų | 53 | 55.6 Ų | 55.6 | 21% | 0.208 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 124 | 171.8 | -52.7 | -87 | 0 | 0 | 0 | 108 | Q29 Q32 S53 C54 | Q29-Y47 HydrophobicContact CG-CD1 4.09Å; Q29-Y47 HydrophobicContact CG-CG 4.41Å; Q32-Y47 HydrophobicContact CB-CD1 4.08Å; Q32-Y47 HydrophobicContact CB-CE1 4.35Å; Q32-Y47 VanDerWaalsContact CD-CE1 3.49Å; Q32-Y47 HydrophobicContact CG-CD1 3.79Å; Q32-Y47 HydrophobicContact CG-CE1 3.62Å; Q32-Y47 VanDerWaalsContact OE1-CE1 3.28Å; Y47-S53 CarbonylContact O-C 3.18Å; Y47-S53 WeakPolarHBondContact O-CA 3.44Å; Y47-C54 PolarHBondContact N-O 3.32Å; Y47-C54 PolarHBondContact O-N 3.33Å |
| 48 | E | 89.7 | Confident | 78 | Confident | 32 Ų | 32 | 59 Ų | 59 | 15% | 0.15 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 129.1 | 173.5 | -73.9 | -175.8 | -146.6 | 0 | 0 | 109.8 | P28 W30 K31 Y159 | P28-E48 CarbonylContact O-C 3.55Å; W30-E48 WeakPolarHBondContact CA-O 3.15Å; W30-E48 WeakPolarHBondContact CB-O 3.41Å; W30-E48 PolarHBondContact N-O 2.9Å; K31-E48 HydrophobicContact CD-CB 4.29Å; K31-E48 VanDerWaalsContact CE-CB 3.4Å; K31-E48 WeakPolarHBondContact CE-OE2 2.78Å; K31-E48 HydrophobicContact CG-CB 3.77Å; K31-E48 PolarHBondContact N-O 3.29Å; K31-E48 IonicContact NZ-OE1 2.76Å; K31-E48 IonicContact NZ-OE2 3.91Å; K31-E48 PolarHBondContact NZ-OE2 2.94Å; K31-E48 PolarHBondContact O-N 3.38Å; E48-Y159 HydrophobicContact CG-CE1 4.32Å; E48-Y159 VanDerWaalsContact OE1-CZ 3.26Å; E48-Y159 PolarHBondContact OE1-OH 3.42Å |
| 49 | G | 91.1 | Very high | 79.4 | Confident | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 33% | 0.326 | C | S | . | . | trans | -108.1 | -176.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P28 M52 | P28-G49 VanDerWaalsContact C-CA 3.41Å; P28-G49 VanDerWaalsContact O-CA 3.27Å; P28-G49 WeakPolarHBondContact O-CA 3.11Å; P28-G49 PolarHBondContact O-N 2.92Å; G49-M52 WeakPolarHBondContact CA-O 3.21Å; G49-M52 PolarHBondContact N-O 3.19Å | ||
| 50 | L | 89.8 | Confident | 80.8 | Confident | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 32% | 0.324 | C | S | . | . | S | Bend | trans | -68.2 | -38 | 173.8 | -166.1 | 63.9 | 0 | 0 | 0 | 111.3 | T25 W30 I77 A80 R81 M84 | T25-L50 HydrophobicContact CG2-CD2 4.07Å; W30-L50 HydrophobicContact CZ2-CD2 4.37Å; L50-I77 HydrophobicContact CD1-CG2 4.09Å; L50-A80 HydrophobicContact CD1-CB 4.04Å; L50-R81 HydrophobicContact CD1-CB 4.26Å; L50-R81 HydrophobicContact CD1-CG 3.42Å; L50-R81 VanDerWaalsContact CD1-CG 3.42Å; L50-R81 HydrophobicContact CD2-CG 4.03Å; L50-R81 HydrophobicContact CG-CB 4.43Å; L50-R81 HydrophobicContact CG-CG 3.46Å; L50-R81 VanDerWaalsContact CG-CG 3.46Å; L50-R81 PolarHBondContact O-NE 2.9Å; L50-R81 PolarHBondContact O-NH2 3.46Å; L50-M84 HydrophobicContact CD2-CB 4.07Å; L50-M84 HydrophobicContact CD2-CG 4.14Å |
| 51 | W | 90.5 | Very high | 82.3 | Confident | 91 Ų | 91 | 53.8 Ų | 53.8 | 35% | 0.345 | 31% | 0.314 | S | S | . | . | S | Bend | trans | -112.3 | -22.7 | -172.4 | -54.9 | 99.1 | 0 | 0 | 0 | 115.3 | T25 L66 Y67 R81 V85 | T25-W51 HydrophobicContact CG2-CZ2 4.27Å; T25-W51 PolarHBondContact O-NE1 3.15Å; W51-L66 HydrophobicContact CB-CD1 4.29Å; W51-L66 WeakPolarHBondContact O-CD1 3.42Å; W51-Y67 VanDerWaalsContact C-CD2 3.44Å; W51-Y67 WeakPolarHBondContact O-CD2 3.3Å; W51-Y67 PolarHBondContact O-N 2.84Å; W51-R81 HydrophobicContact CH2-CG 4.33Å; W51-R81 HydrophobicContact CZ3-CG 4.44Å; W51-V85 HydrophobicContact CH2-CG2 3.87Å; W51-V85 HydrophobicContact CZ2-CG2 3.83Å |
| 52 | M | 90.2 | Very high | 83.5 | Confident | 58 Ų | 58 | 49.9 Ų | 49.9 | 29% | 0.286 | 30% | 0.298 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.4 | 157.7 | -176 | 66.1 | -175.8 | 77.3 | 0 | 0 | 110.8 | P28 G49 C64 K65 L66 | P28-M52 HydrophobicContact CB-CG 3.55Å; P28-M52 HydrophobicContact CB-SD 3.92Å; P28-M52 HydrophobicContact CG-SD 4.45Å; G49-M52 WeakPolarHBondContact CA-O 3.21Å; G49-M52 PolarHBondContact N-O 3.19Å; M52-C64 HydrophobicContact SD-CB 4.09Å; M52-K65 WeakPolarHBondContact CA-O 3.49Å; M52-K65 WeakPolarHBondContact CB-O 3.22Å; M52-L66 HydrophobicContact CB-CD1 4.31Å |
| 53 | S | 89.4 | Confident | 85 | Confident | 32 Ų | 32 | 52.1 Ų | 52.1 | 22% | 0.224 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.8 | 135.6 | 169.4 | 176.1 | 0 | 0 | 0 | 0 | 108.7 | Y47 C64 K65 | Y47-S53 CarbonylContact O-C 3.18Å; Y47-S53 WeakPolarHBondContact O-CA 3.44Å; S53-C64 CarbonylContact O-C 3.04Å; S53-C64 WeakPolarHBondContact O-CA 3.25Å; S53-K65 PolarHBondContact N-O 3.45Å; S53-K65 PolarHBondContact O-N 3.12Å |
| 54 | C | 90.5 | Very high | 86.2 | Confident | 4 Ų | 4 | 54.2 Ų | 54.2 | 3% | 0.027 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 135.9 | -178.9 | -60.6 | 0 | 0 | 0 | 0 | 110.5 | Y47 V62 Q63 C64 | Y47-C54 PolarHBondContact N-O 3.32Å; Y47-C54 PolarHBondContact O-N 3.33Å; C54-V62 HydrophobicContact CB-CG1 4.37Å; C54-Q63 CarbonylContact C-O 3.53Å; C54-Q63 VanDerWaalsContact CA-O 3.3Å; C54-Q63 WeakPolarHBondContact CA-O 3.28Å; C54-C64 HydrophobicContact CB-CB 4.14Å; C54-C64 WeakPolarHBondContact CB-SG 3.32Å; C54-C64 WeakPolarHBondContact SG-CB 3.33Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.43Å |
| 55 | A | 88 | Confident | 87 | Confident | 22 Ų | 22 | 58.5 Ų | 58.5 | 18% | 0.182 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 121.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | V44 L46 V62 Q63 | V44-A55 HydrophobicContact CG1-CB 3.85Å; L46-A55 HydrophobicContact CD2-CB 3.73Å; A55-V62 WeakPolarHBondContact O-CA 3.18Å; A55-Q63 PolarHBondContact N-O 3.02Å; A55-Q63 PolarHBondContact O-N 3.32Å |
| 56 | S | 86.4 | Confident | 87.3 | Confident | 34 Ų | 34 | 63 Ų | 63 | 24% | 0.238 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | 113.4 | 173.4 | -179.7 | 0 | 0 | 0 | 0 | 109.2 | V44 G45 | V44-S56 CarbonylContact C-O 3.56Å; V44-S56 WeakPolarHBondContact CA-O 3.37Å; G45-S56 PolarHBondContact N-O 3.49Å; G45-S56 PolarHBondContact O-N 2.95Å |
| 57 | Q | 82.8 | Confident | 87.2 | Confident | 50 Ų | 50 | 62.4 Ų | 62.4 | 23% | 0.234 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92 | 155.8 | 178.9 | -57.5 | -177.9 | 36.1 | 0 | 0 | 110.8 | V44 T59 G60 Q61 | V44-Q57 HydrophobicContact CG1-CG 4.45Å; V44-Q57 HydrophobicContact CG2-CG 4.1Å; Q57-T59 PolarHBondContact O-N 3.44Å; Q57-G60 PolarHBondContact O-N 3.22Å; Q57-Q61 PolarHBondContact N-O 3.36Å |
| 58 | S | 77.8 | Confident | 86.4 | Confident | 92 Ų | 92 | 65.9 Ų | 65.9 | 64% | 0.643 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.9 | -17.5 | 177.3 | -61.2 | 0 | 0 | 0 | 0 | 114.4 | A43 G60 | A43-S58 WeakPolarHBondContact CB-OG 3.36Å; A43-S58 PolarHBondContact O-N 3.43Å; A43-S58 VanDerWaalsContact O-N 3.11Å; A43-S58 PolarHBondContact O-OG 3.47Å; S58-G60 PolarHBondContact O-N 3.02Å |
| 59 | T | 80.4 | Confident | 85.5 | Confident | 99 Ų | 99 | 67.6 Ų | 67.6 | 61% | 0.607 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.3 | -1.6 | 173 | 55 | 0 | 0 | 0 | 0 | 113.6 | Q57 Q61 | Q57-T59 PolarHBondContact O-N 3.44Å; T59-Q61 PolarHBondContact O-N 2.91Å |
| 60 | G | 79.7 | Confident | 84.4 | Confident | 63 Ų | 63 | 72.7 Ų | 72.7 | 65% | 0.649 | 41% | 0.409 | S | S | * | . | S | Bend | trans | 80.2 | 2 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q57 S58 | Q57-G60 PolarHBondContact O-N 3.22Å; S58-G60 PolarHBondContact O-N 3.02Å |
| 61 | Q | 83.9 | Confident | 83 | Confident | 110 Ų | 110 | 81 Ų | 81 | 51% | 0.514 | 45% | 0.453 | S | S | . | . | trans | -80.7 | 126.3 | 175.8 | -65.9 | -171.9 | -7.7 | 0 | 0 | 110.8 | Q57 T59 | Q57-Q61 PolarHBondContact N-O 3.36Å; T59-Q61 PolarHBondContact O-N 2.91Å | ||
| 62 | V | 86.9 | Confident | 81.7 | Confident | 92 Ų | 92 | 81 Ų | 81 | 56% | 0.558 | 47% | 0.472 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -105.9 | 116.6 | 169.6 | -179.3 | 0 | 0 | 0 | 0 | 108.4 | C54 A55 | C54-V62 HydrophobicContact CB-CG1 4.37Å; A55-V62 WeakPolarHBondContact O-CA 3.18Å |
| 63 | Q | 89.4 | Confident | 80.7 | Confident | 112 Ų | 112 | 79.4 Ų | 79.4 | 52% | 0.523 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110 | 117.6 | 176.6 | -64.6 | -174 | -3.4 | 0 | 0 | 109.2 | C54 A55 | C54-Q63 CarbonylContact C-O 3.53Å; C54-Q63 VanDerWaalsContact CA-O 3.3Å; C54-Q63 WeakPolarHBondContact CA-O 3.28Å; A55-Q63 PolarHBondContact N-O 3.02Å; A55-Q63 PolarHBondContact O-N 3.32Å |
| 64 | C | 91.1 | Very high | 80.2 | Confident | 72 Ų | 72 | 82.3 Ų | 82.3 | 49% | 0.486 | 48% | 0.477 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.1 | 132.7 | 176.5 | -64.9 | 0 | 0 | 0 | 0 | 110.5 | M52 S53 C54 | M52-C64 HydrophobicContact SD-CB 4.09Å; S53-C64 CarbonylContact O-C 3.04Å; S53-C64 WeakPolarHBondContact O-CA 3.25Å; C54-C64 HydrophobicContact CB-CB 4.14Å; C54-C64 WeakPolarHBondContact CB-SG 3.32Å; C54-C64 WeakPolarHBondContact SG-CB 3.33Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.43Å |
| 65 | K | 90.2 | Very high | 79.6 | Confident | 130 Ų | 130 | 84.3 Ų | 84.3 | 57% | 0.565 | 50% | 0.499 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -121 | 127.4 | 176.5 | -168.9 | -179.1 | 175.8 | -171.2 | 0 | 109.6 | M52 S53 D68 | M52-K65 WeakPolarHBondContact CA-O 3.49Å; M52-K65 WeakPolarHBondContact CB-O 3.22Å; S53-K65 PolarHBondContact N-O 3.45Å; S53-K65 PolarHBondContact O-N 3.12Å; K65-D68 WeakPolarHBondContact CE-OD2 3.4Å; K65-D68 IonicContact NZ-OD2 2.68Å; K65-D68 PolarHBondContact NZ-OD2 3.1Å |
| 66 | L | 89.5 | Confident | 79.2 | Confident | 113 Ų | 113 | 86.9 Ų | 86.9 | 59% | 0.592 | 51% | 0.507 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70 | 145.6 | 171.4 | -161.3 | 77.5 | 0 | 0 | 0 | 109.2 | W51 M52 D68 | W51-L66 HydrophobicContact CB-CD1 4.29Å; W51-L66 WeakPolarHBondContact O-CD1 3.42Å; M52-L66 HydrophobicContact CB-CD1 4.31Å; L66-D68 PolarHBondContact O-N 3.46Å |
| 67 | Y | 84.9 | Confident | 79 | Confident | 52 Ų | 52 | 85.9 Ų | 85.9 | 20% | 0.204 | 50% | 0.499 | C | S | . | . | trans | -66.5 | 117.5 | 177.2 | -65.7 | -75.9 | 0 | 0 | 0 | 110.9 | W51 S69 L73 | W51-Y67 VanDerWaalsContact C-CD2 3.44Å; W51-Y67 WeakPolarHBondContact O-CD2 3.3Å; W51-Y67 PolarHBondContact O-N 2.84Å; Y67-S69 PolarHBondContact O-N 2.7Å; Y67-L73 HydrophobicContact CD1-CD1 3.6Å; Y67-L73 HydrophobicContact CD2-CD1 4.31Å; Y67-L73 HydrophobicContact CE1-CD1 3.65Å; Y67-L73 HydrophobicContact CE2-CD1 4.35Å; Y67-L73 HydrophobicContact CG-CD1 3.94Å | ||
| 68 | D | 73.1 | Confident | 79.2 | Confident | 125 Ų | 125 | 88.7 Ų | 88.7 | 67% | 0.668 | 51% | 0.511 | S | S | * | . | S | Bend | trans | -66 | -21.7 | -172.4 | -65.5 | -41.6 | 0 | 0 | 0 | 113.9 | K65 L66 | K65-D68 WeakPolarHBondContact CE-OD2 3.4Å; K65-D68 IonicContact NZ-OD2 2.68Å; K65-D68 PolarHBondContact NZ-OD2 3.1Å; L66-D68 PolarHBondContact O-N 3.46Å |
| 69 | S | 71 | Confident | 79.7 | Confident | 68 Ų | 68 | 86.6 Ų | 86.6 | 48% | 0.476 | 50% | 0.497 | S | S | . | . | trans | -149 | 126.2 | -179.2 | -70.7 | 0 | 0 | 0 | 0 | 111.3 | Y67 L71 A72 | Y67-S69 PolarHBondContact O-N 2.7Å; S69-L71 PolarHBondContact O-N 2.91Å; S69-A72 PolarHBondContact O-N 2.92Å | ||
| 70 | L | 66.2 | Low | 80.3 | Confident | 108 Ų | 108 | 81.9 Ų | 81.9 | 57% | 0.565 | 47% | 0.468 | S | S | * | . | G | 310 helix | trans | -60.5 | -29.4 | 172.4 | -63 | -177.7 | 0 | 0 | 0 | 112 | L73 | L70-L73 PolarHBondContact O-N 2.79Š|
| 71 | L | 60.5 | Low | 80.9 | Confident | 175 Ų | 175 | 79.8 Ų | 79.8 | 92% | 0.916 | 44% | 0.44 | S | S | * | . | G | 310 helix | trans | -78.9 | -20.3 | -175.6 | -159.6 | 67.4 | 0 | 0 | 0 | 113.8 | S69 L73 | S69-L71 PolarHBondContact O-N 2.91Å; L71-L73 VanDerWaalsContact C-N 3.32Å |
| 72 | A | 64.2 | Low | 81.3 | Confident | 91 Ų | 91 | 77.2 Ų | 77.2 | 75% | 0.752 | 44% | 0.438 | S | S | * | . | G | 310 helix | trans | -90 | -1.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S69 | S69-A72 PolarHBondContact O-N 2.92Š|
| 73 | L | 69.7 | Low | 81.7 | Confident | 23 Ų | 23 | 75.6 Ų | 75.6 | 12% | 0.12 | 43% | 0.426 | C | S | . | . | S | Bend | trans | -93.2 | 140.4 | -175.6 | -160.2 | 69.5 | 0 | 0 | 0 | 110.5 | Y67 L70 L71 G75 I77 | Y67-L73 HydrophobicContact CD1-CD1 3.6Å; Y67-L73 HydrophobicContact CD2-CD1 4.31Å; Y67-L73 HydrophobicContact CE1-CD1 3.65Å; Y67-L73 HydrophobicContact CE2-CD1 4.35Å; Y67-L73 HydrophobicContact CG-CD1 3.94Å; L70-L73 PolarHBondContact O-N 2.79Å; L71-L73 VanDerWaalsContact C-N 3.32Å; L73-G75 PolarHBondContact O-N 3.16Å; L73-I77 HydrophobicContact CD1-CD1 3.96Å; L73-I77 HydrophobicContact CD2-CB 3.85Å; L73-I77 HydrophobicContact CD2-CG2 3.53Å; L73-I77 HydrophobicContact CG-CB 3.98Å; L73-I77 HydrophobicContact CG-CD1 4.08Å; L73-I77 HydrophobicContact CG-CG2 4.13Å |
| 74 | D | 77.5 | Confident | 82 | Confident | 94 Ų | 94 | 70.2 Ų | 70.2 | 50% | 0.503 | 40% | 0.401 | S | S | . | . | trans | -51.5 | 132 | 178.1 | -165 | -20.8 | 0 | 0 | 0 | 111 | H76 I77 Q78 | D74-H76 PolarHBondContact O-N 3.45Å; D74-H76 IonicContact OD1-CD2 3.83Å; D74-H76 PolarHBondContact OD1-CD2 2.92Å; D74-H76 VanDerWaalsContact OD1-CD2 3.26Å; D74-H76 IonicContact OD1-CG 3.73Å; D74-H76 PolarHBondContact OD1-N 3.25Å; D74-H76 IonicContact OD2-CD2 3.26Å; D74-I77 HydrophobicContact CB-CD1 4.28Å; D74-I77 HydrophobicContact CB-CG1 4.27Å; D74-I77 PolarHBondContact O-N 2.98Å; D74-Q78 PolarHBondContact O-N 3.08Å | ||
| 75 | G | 79.2 | Confident | 82.2 | Confident | 46 Ų | 46 | 69.6 Ų | 69.6 | 47% | 0.474 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -57.5 | -26.2 | -174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L73 Q78 S79 | L73-G75 PolarHBondContact O-N 3.16Å; G75-Q78 PolarHBondContact O-N 3.24Å; G75-S79 PolarHBondContact O-N 2.94Å |
| 76 | H | 78.7 | Confident | 82.5 | Confident | 76 Ų | 76 | 66.6 Ų | 66.6 | 35% | 0.352 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -68.2 | -33.9 | 174.1 | -59 | -50.3 | 0 | 0 | 0 | 114.2 | D74 Q78 S79 A80 W139 L143 | D74-H76 PolarHBondContact O-N 3.45Å; D74-H76 IonicContact OD1-CD2 3.83Å; D74-H76 PolarHBondContact OD1-CD2 2.92Å; D74-H76 VanDerWaalsContact OD1-CD2 3.26Å; D74-H76 IonicContact OD1-CG 3.73Å; D74-H76 PolarHBondContact OD1-N 3.25Å; D74-H76 IonicContact OD2-CD2 3.26Å; H76-Q78 VanDerWaalsContact C-N 3.32Å; H76-S79 PolarHBondContact O-OG 3.46Å; H76-A80 PolarHBondContact O-N 3.36Å; H76-W139 AromaticContact ND1-NE1 3.72Å; H76-L143 HydrophobicContact CB-CD1 3.33Å; H76-L143 VanDerWaalsContact CG-CD1 3.49Å |
| 77 | I | 82.3 | Confident | 82.9 | Confident | 13 Ų | 13 | 61.2 Ų | 61.2 | 7% | 0.067 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -73.3 | -34 | 175.6 | -55.4 | 178.2 | 0 | 0 | 0 | 109.3 | L50 L73 D74 A80 R81 Y140 | L50-I77 HydrophobicContact CD1-CG2 4.09Å; L73-I77 HydrophobicContact CD1-CD1 3.96Å; L73-I77 HydrophobicContact CD2-CB 3.85Å; L73-I77 HydrophobicContact CD2-CG2 3.53Å; L73-I77 HydrophobicContact CG-CB 3.98Å; L73-I77 HydrophobicContact CG-CD1 4.08Å; L73-I77 HydrophobicContact CG-CG2 4.13Å; D74-I77 HydrophobicContact CB-CD1 4.28Å; D74-I77 HydrophobicContact CB-CG1 4.27Å; D74-I77 PolarHBondContact O-N 2.98Å; I77-A80 PolarHBondContact O-N 3.03Å; I77-R81 WeakPolarHBondContact O-CB 3.39Å; I77-R81 WeakPolarHBondContact O-CG 3.42Å; I77-R81 PolarHBondContact O-N 2.91Å; I77-Y140 HydrophobicContact CG1-CE2 4.19Å |
| 78 | Q | 87.4 | Confident | 83.5 | Confident | 108 Ų | 108 | 60.3 Ų | 60.3 | 51% | 0.505 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.2 | -39.2 | 176 | -167.2 | 175.2 | 10.9 | 0 | 0 | 112.6 | D74 G75 H76 R81 A82 | D74-Q78 PolarHBondContact O-N 3.08Å; G75-Q78 PolarHBondContact O-N 3.24Å; H76-Q78 VanDerWaalsContact C-N 3.32Å; Q78-R81 WeakPolarHBondContact O-CB 3.46Å; Q78-R81 PolarHBondContact O-N 3.4Å; Q78-A82 PolarHBondContact O-N 2.95Å |
| 79 | S | 88.3 | Confident | 84.6 | Confident | 48 Ų | 48 | 59.5 Ų | 59.5 | 34% | 0.336 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -67.1 | -42.2 | 175.3 | 66.5 | 0 | 0 | 0 | 0 | 111.9 | G75 H76 R81 A82 L83 | G75-S79 PolarHBondContact O-N 2.94Å; H76-S79 PolarHBondContact O-OG 3.46Å; S79-R81 VanDerWaalsContact C-N 3.31Å; S79-R81 PolarHBondContact O-N 2.86Å; S79-A82 PolarHBondContact O-N 2.87Å; S79-L83 WeakPolarHBondContact O-CG 3.37Å; S79-L83 PolarHBondContact O-N 3.26Å |
| 80 | A | 91.6 | Very high | 85.9 | Confident | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.8 | -41.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L50 H76 I77 A82 L83 M84 Y140 | L50-A80 HydrophobicContact CD1-CB 4.04Å; H76-A80 PolarHBondContact O-N 3.36Å; I77-A80 PolarHBondContact O-N 3.03Å; A80-A82 PolarHBondContact O-N 3.3Å; A80-L83 PolarHBondContact O-N 3.49Å; A80-M84 WeakPolarHBondContact O-CB 3.37Å; A80-M84 VanDerWaalsContact O-CG 3.26Å; A80-M84 WeakPolarHBondContact O-CG 3.38Å; A80-M84 PolarHBondContact O-N 2.91Å; A80-Y140 HydrophobicContact CB-CD2 4.35Å |
| 81 | R | 92.3 | Very high | 87.4 | Confident | 19 Ų | 19 | 52.9 Ų | 52.9 | 7% | 0.072 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -56.5 | -52.2 | 174.5 | -82 | 175.7 | -176.5 | -174.1 | 3.4 | 111.8 | L50 W51 I77 Q78 S79 L83 M84 V85 | L50-R81 HydrophobicContact CD1-CB 4.26Å; L50-R81 HydrophobicContact CD1-CG 3.42Å; L50-R81 VanDerWaalsContact CD1-CG 3.42Å; L50-R81 HydrophobicContact CD2-CG 4.03Å; L50-R81 HydrophobicContact CG-CB 4.43Å; L50-R81 HydrophobicContact CG-CG 3.46Å; L50-R81 VanDerWaalsContact CG-CG 3.46Å; L50-R81 PolarHBondContact O-NE 2.9Å; L50-R81 PolarHBondContact O-NH2 3.46Å; W51-R81 HydrophobicContact CH2-CG 4.33Å; W51-R81 HydrophobicContact CZ3-CG 4.44Å; I77-R81 WeakPolarHBondContact O-CB 3.39Å; I77-R81 WeakPolarHBondContact O-CG 3.42Å; I77-R81 PolarHBondContact O-N 2.91Å; Q78-R81 WeakPolarHBondContact O-CB 3.46Å; Q78-R81 PolarHBondContact O-N 3.4Å; S79-R81 VanDerWaalsContact C-N 3.31Å; S79-R81 PolarHBondContact O-N 2.86Å; R81-L83 PolarHBondContact O-N 3.36Å; R81-M84 PolarHBondContact O-N 3.46Å; R81-V85 WeakPolarHBondContact O-CB 3.46Å; R81-V85 VanDerWaalsContact O-CG2 3.29Å; R81-V85 WeakPolarHBondContact O-CG2 3.36Å; R81-V85 PolarHBondContact O-N 3.32Å |
| 82 | A | 92.6 | Very high | 89.1 | Confident | 57 Ų | 57 | 50.4 Ų | 50.4 | 47% | 0.471 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.1 | -47.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q78 S79 A80 M84 V85 V86 | Q78-A82 PolarHBondContact O-N 2.95Å; S79-A82 PolarHBondContact O-N 2.87Å; A80-A82 PolarHBondContact O-N 3.3Å; A82-M84 PolarHBondContact O-N 3.3Å; A82-V85 PolarHBondContact O-N 2.94Å; A82-V86 WeakPolarHBondContact O-CB 3.49Å; A82-V86 VanDerWaalsContact O-CG2 3.23Å; A82-V86 WeakPolarHBondContact O-CG2 3.37Å; A82-V86 PolarHBondContact O-N 3.4Å |
| 83 | L | 95.3 | Very high | 90.7 | Very high | 57 Ų | 57 | 49.4 Ų | 49.4 | 30% | 0.298 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 179.8 | -73.7 | 173.3 | 0 | 0 | 0 | 112.7 | S79 A80 R81 V86 A87 A136 | S79-L83 WeakPolarHBondContact O-CG 3.37Å; S79-L83 PolarHBondContact O-N 3.26Å; A80-L83 PolarHBondContact O-N 3.49Å; R81-L83 PolarHBondContact O-N 3.36Å; L83-V86 PolarHBondContact O-N 3.39Å; L83-A87 WeakPolarHBondContact O-CB 3.46Å; L83-A87 PolarHBondContact O-N 2.99Å; L83-A136 HydrophobicContact CB-CB 3.71Å; L83-A136 HydrophobicContact CD1-CB 3.97Å |
| 84 | M | 95.9 | Very high | 92 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.4 | -42.4 | 178.5 | -67.7 | -59.9 | -66.3 | 0 | 0 | 111.8 | I21 T25 W30 L50 A80 R81 A82 A87 V88 T133 A136 V137 | I21-M84 HydrophobicContact CG2-CE 4.03Å; T25-M84 HydrophobicContact CG2-CB 4.14Å; T25-M84 WeakPolarHBondContact OG1-CE 3.44Å; W30-M84 HydrophobicContact CH2-CE 4.26Å; W30-M84 HydrophobicContact CH2-CG 3.76Å; W30-M84 HydrophobicContact CH2-SD 3.86Å; W30-M84 HydrophobicContact CZ2-CE 4.05Å; W30-M84 HydrophobicContact CZ2-CG 4.03Å; W30-M84 HydrophobicContact CZ2-SD 4.23Å; L50-M84 HydrophobicContact CD2-CB 4.07Å; L50-M84 HydrophobicContact CD2-CG 4.14Å; A80-M84 WeakPolarHBondContact O-CB 3.37Å; A80-M84 VanDerWaalsContact O-CG 3.26Å; A80-M84 WeakPolarHBondContact O-CG 3.38Å; A80-M84 PolarHBondContact O-N 2.91Å; R81-M84 PolarHBondContact O-N 3.46Å; A82-M84 PolarHBondContact O-N 3.3Å; M84-A87 PolarHBondContact O-N 2.84Å; M84-V88 WeakPolarHBondContact O-CG2 3.18Å; M84-V88 PolarHBondContact O-N 3.19Å; M84-T133 HydrophobicContact CE-CG2 4.01Å; M84-T133 HydrophobicContact SD-CG2 3.94Å; M84-A136 HydrophobicContact CG-CB 4.05Å; M84-A136 HydrophobicContact SD-CB 3.83Å; M84-V137 HydrophobicContact SD-CG2 4.34Å |
| 85 | V | 95.9 | Very high | 92.8 | Very high | 58 Ų | 58 | 44.9 Ų | 44.9 | 35% | 0.352 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 175.8 | 172 | 0 | 0 | 0 | 0 | 111 | W51 R81 A82 A87 V88 L89 | W51-V85 HydrophobicContact CH2-CG2 3.87Å; W51-V85 HydrophobicContact CZ2-CG2 3.83Å; R81-V85 WeakPolarHBondContact O-CB 3.46Å; R81-V85 VanDerWaalsContact O-CG2 3.29Å; R81-V85 WeakPolarHBondContact O-CG2 3.36Å; R81-V85 PolarHBondContact O-N 3.32Å; A82-V85 PolarHBondContact O-N 2.94Å; V85-A87 VanDerWaalsContact C-N 3.32Å; V85-A87 PolarHBondContact O-N 2.7Å; V85-V88 PolarHBondContact O-N 2.73Å; V85-L89 HydrophobicContact CG1-CD1 4.22Å; V85-L89 WeakPolarHBondContact O-CG 3.48Å; V85-L89 PolarHBondContact O-N 3.5Å |
| 86 | V | 96.7 | Very high | 93.6 | Very high | 67 Ų | 67 | 46.2 Ų | 46.2 | 41% | 0.406 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -60.3 | -43.4 | 175.4 | 169.9 | 0 | 0 | 0 | 0 | 110.6 | A82 L83 V88 L89 L90 | A82-V86 WeakPolarHBondContact O-CB 3.49Å; A82-V86 VanDerWaalsContact O-CG2 3.23Å; A82-V86 WeakPolarHBondContact O-CG2 3.37Å; A82-V86 PolarHBondContact O-N 3.4Å; L83-V86 PolarHBondContact O-N 3.39Å; V86-V88 PolarHBondContact O-N 2.81Å; V86-L89 PolarHBondContact O-N 3.41Å; V86-L90 HydrophobicContact CG1-CD1 3.73Å; V86-L90 HydrophobicContact CG1-CG 4.09Å; V86-L90 WeakPolarHBondContact O-CB 3.38Å; V86-L90 VanDerWaalsContact O-CG 3.26Å; V86-L90 WeakPolarHBondContact O-CG 3.47Å; V86-L90 PolarHBondContact O-N 3.38Å |
| 87 | A | 97.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.9 | -41.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | I21 L83 M84 V85 G91 A129 C132 T133 | I21-A87 HydrophobicContact CG2-CB 4.17Å; L83-A87 WeakPolarHBondContact O-CB 3.46Å; L83-A87 PolarHBondContact O-N 2.99Å; M84-A87 PolarHBondContact O-N 2.84Å; V85-A87 VanDerWaalsContact C-N 3.32Å; V85-A87 PolarHBondContact O-N 2.7Å; A87-G91 PolarHBondContact O-N 3.22Å; A87-A129 HydrophobicContact CB-CB 4.49Å; A87-A129 WeakPolarHBondContact CB-O 3.15Å; A87-A129 WeakPolarHBondContact O-CB 3.26Å; A87-C132 HydrophobicContact CB-CB 4.04Å; A87-T133 WeakPolarHBondContact CB-OG1 3.32Å |
| 88 | V | 97.5 | Very high | 94.8 | Very high | 34 Ų | 34 | 44.5 Ų | 44.5 | 21% | 0.206 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.1 | -45.9 | 175.5 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | W18 I21 I22 M84 V85 V86 G91 F92 | W18-V88 PolarHBondContact NE1-O 2.9Å; I21-V88 HydrophobicContact CG2-CG2 3.84Å; I22-V88 HydrophobicContact CG1-CG1 4.1Å; I22-V88 HydrophobicContact CG1-CG2 4.11Å; M84-V88 WeakPolarHBondContact O-CG2 3.18Å; M84-V88 PolarHBondContact O-N 3.19Å; V85-V88 PolarHBondContact O-N 2.73Å; V86-V88 PolarHBondContact O-N 2.81Å; V88-G91 PolarHBondContact O-N 3.21Å; V88-F92 PolarHBondContact O-N 3.41Å |
| 89 | L | 97.6 | Very high | 95 | Very high | 107 Ų | 107 | 42 Ų | 42 | 56% | 0.56 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -65.2 | -45.8 | 178.8 | -67.8 | 176.2 | 0 | 0 | 0 | 112.1 | V85 V86 G91 F92 V93 | V85-L89 HydrophobicContact CG1-CD1 4.22Å; V85-L89 WeakPolarHBondContact O-CG 3.48Å; V85-L89 PolarHBondContact O-N 3.5Å; V86-L89 PolarHBondContact O-N 3.41Å; L89-G91 VanDerWaalsContact C-N 3.31Å; L89-G91 PolarHBondContact O-N 3.17Å; L89-F92 WeakPolarHBondContact O-CB 3.44Å; L89-F92 PolarHBondContact O-N 3.46Å; L89-V93 WeakPolarHBondContact O-CG2 3.46Å; L89-V93 PolarHBondContact O-N 3.47Å; L89-V93 VanDerWaalsContact O-N 3.09Å |
| 90 | L | 97.2 | Very high | 95.1 | Very high | 37 Ų | 37 | 42.3 Ų | 42.3 | 19% | 0.194 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.8 | -43.2 | 175.9 | -72.7 | 175.7 | 0 | 0 | 0 | 111.1 | V86 F92 V93 A94 L125 L128 A129 | V86-L90 HydrophobicContact CG1-CD1 3.73Å; V86-L90 HydrophobicContact CG1-CG 4.09Å; V86-L90 WeakPolarHBondContact O-CB 3.38Å; V86-L90 VanDerWaalsContact O-CG 3.26Å; V86-L90 WeakPolarHBondContact O-CG 3.47Å; V86-L90 PolarHBondContact O-N 3.38Å; L90-F92 VanDerWaalsContact C-N 3.35Å; L90-F92 PolarHBondContact O-N 2.84Å; L90-V93 PolarHBondContact O-N 3.41Å; L90-A94 VanDerWaalsContact O-CB 3.26Å; L90-A94 WeakPolarHBondContact O-CB 3.44Å; L90-A94 PolarHBondContact O-N 2.92Å; L90-L125 HydrophobicContact CD2-CD2 4.19Å; L90-L128 HydrophobicContact CD1-CD2 3.81Å; L90-L128 HydrophobicContact CD1-CG 3.83Å; L90-L128 HydrophobicContact CD2-CD2 4.45Å; L90-A129 HydrophobicContact CB-CB 4Å |
| 91 | G | 97.2 | Very high | 94.9 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.8 | -34.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | W18 A87 V88 L89 A94 M95 | W18-G91 VanDerWaalsContact CD1-CA 3.42Å; A87-G91 PolarHBondContact O-N 3.22Å; V88-G91 PolarHBondContact O-N 3.21Å; L89-G91 VanDerWaalsContact C-N 3.31Å; L89-G91 PolarHBondContact O-N 3.17Å; G91-A94 PolarHBondContact O-N 2.87Å; G91-M95 WeakPolarHBondContact O-CB 3.45Å; G91-M95 VanDerWaalsContact O-CG 3.24Å; G91-M95 WeakPolarHBondContact O-CG 3.41Å; G91-M95 PolarHBondContact O-N 3.31Å |
| 92 | F | 97.2 | Very high | 94.6 | Very high | 124 Ų | 124 | 41.9 Ų | 41.9 | 54% | 0.544 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64.1 | -45.9 | 173 | -179.3 | -103.5 | 0 | 0 | 0 | 111.6 | W18 V88 L89 L90 A94 M95 V96 | W18-F92 HydrophobicContact CH2-CD2 4.05Å; W18-F92 HydrophobicContact CZ2-CB 3.79Å; W18-F92 HydrophobicContact CZ2-CD2 4.04Å; W18-F92 HydrophobicContact CZ2-CG 4.43Å; V88-F92 PolarHBondContact O-N 3.41Å; L89-F92 WeakPolarHBondContact O-CB 3.44Å; L89-F92 PolarHBondContact O-N 3.46Å; L90-F92 VanDerWaalsContact C-N 3.35Å; L90-F92 PolarHBondContact O-N 2.84Å; F92-A94 VanDerWaalsContact C-N 3.35Å; F92-M95 WeakPolarHBondContact O-CB 3.32Å; F92-M95 PolarHBondContact O-N 2.96Å; F92-V96 HydrophobicContact CE1-CG2 4.41Å; F92-V96 HydrophobicContact CZ-CG2 4.38Å; F92-V96 WeakPolarHBondContact O-CG2 3.24Å; F92-V96 PolarHBondContact O-N 2.81Å |
| 93 | V | 97.2 | Very high | 94 | Very high | 69 Ų | 69 | 44.7 Ų | 44.7 | 42% | 0.418 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -63.6 | -43.6 | 175.7 | 179 | 0 | 0 | 0 | 0 | 110.4 | L89 L90 M95 V96 L97 L125 | L89-V93 WeakPolarHBondContact O-CG2 3.46Å; L89-V93 PolarHBondContact O-N 3.47Å; L89-V93 VanDerWaalsContact O-N 3.09Å; L90-V93 PolarHBondContact O-N 3.41Å; V93-M95 VanDerWaalsContact C-N 3.33Å; V93-M95 PolarHBondContact O-N 3.49Å; V93-V96 PolarHBondContact O-N 2.93Å; V93-L97 HydrophobicContact CG1-CD1 4.19Å; V93-L97 HydrophobicContact CG1-CG 4.32Å; V93-L97 WeakPolarHBondContact O-CG 3.33Å; V93-L97 PolarHBondContact O-N 3.35Å; V93-L125 HydrophobicContact CB-CD1 4.26Å; V93-L125 HydrophobicContact CG1-CD1 3.7Å |
| 94 | A | 96.6 | Very high | 93.4 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58.6 | -42.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L90 G91 F92 L97 S98 G122 L125 F126 | L90-A94 VanDerWaalsContact O-CB 3.26Å; L90-A94 WeakPolarHBondContact O-CB 3.44Å; L90-A94 PolarHBondContact O-N 2.92Å; G91-A94 PolarHBondContact O-N 2.87Å; F92-A94 VanDerWaalsContact C-N 3.35Å; A94-L97 PolarHBondContact O-N 3.14Å; A94-S98 VanDerWaalsContact O-CB 3.23Å; A94-S98 WeakPolarHBondContact O-CB 3.47Å; A94-S98 PolarHBondContact O-N 2.9Å; A94-S98 PolarHBondContact O-OG 3.45Å; A94-G122 WeakPolarHBondContact CB-O 3.26Å; A94-L125 HydrophobicContact CB-CB 3.59Å; A94-F126 HydrophobicContact CB-CB 4.45Å; A94-F126 HydrophobicContact CB-CD1 3.81Å; A94-F126 HydrophobicContact CB-CD2 3.63Å; A94-F126 HydrophobicContact CB-CE1 3.86Å; A94-F126 HydrophobicContact CB-CE2 3.71Å; A94-F126 HydrophobicContact CB-CG 3.68Å; A94-F126 HydrophobicContact CB-CZ 3.8Å |
| 95 | M | 95.5 | Very high | 92.8 | Very high | 22 Ų | 22 | 48.2 Ų | 48.2 | 11% | 0.108 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -57.1 | -51.7 | 174.9 | -83.5 | -65 | -56.2 | 0 | 0 | 111.2 | Y11 L15 W18 G91 F92 V93 S98 V99 F126 | Y11-M95 HydrophobicContact CE2-CE 3.78Å; Y11-M95 HydrophobicContact CE2-SD 4.11Å; Y11-M95 WeakPolarHBondContact OH-CE 3.39Å; L15-M95 HydrophobicContact CB-CE 4.36Å; L15-M95 HydrophobicContact CB-SD 3.94Å; L15-M95 HydrophobicContact CD1-CE 3.34Å; L15-M95 HydrophobicContact CD1-SD 3.63Å; L15-M95 HydrophobicContact CG-CE 4.32Å; L15-M95 HydrophobicContact CG-SD 4.38Å; W18-M95 HydrophobicContact CD2-CG 4.22Å; W18-M95 HydrophobicContact CE3-CG 4.13Å; G91-M95 WeakPolarHBondContact O-CB 3.45Å; G91-M95 VanDerWaalsContact O-CG 3.24Å; G91-M95 WeakPolarHBondContact O-CG 3.41Å; G91-M95 PolarHBondContact O-N 3.31Å; F92-M95 WeakPolarHBondContact O-CB 3.32Å; F92-M95 PolarHBondContact O-N 2.96Å; V93-M95 VanDerWaalsContact C-N 3.33Å; V93-M95 PolarHBondContact O-N 3.49Å; M95-S98 PolarHBondContact O-N 3.03Å; M95-V99 WeakPolarHBondContact O-CG2 3.44Å; M95-V99 PolarHBondContact O-N 2.9Å; M95-F126 HydrophobicContact CB-CZ 4.25Å; M95-F126 HydrophobicContact CG-CE1 4.09Å; M95-F126 HydrophobicContact CG-CZ 3.62Å; M95-F126 HydrophobicContact SD-CE1 4.27Å; M95-F126 HydrophobicContact SD-CZ 3.55Å; M95-F126 VanDerWaalsContact SD-CZ 3.55Å |
| 96 | V | 95 | Very high | 92.1 | Very high | 74 Ų | 74 | 56.3 Ų | 56.3 | 45% | 0.448 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.5 | -48 | -179.5 | 175.3 | 0 | 0 | 0 | 0 | 111 | F92 V93 S98 V99 V100 | F92-V96 HydrophobicContact CE1-CG2 4.41Å; F92-V96 HydrophobicContact CZ-CG2 4.38Å; F92-V96 WeakPolarHBondContact O-CG2 3.24Å; F92-V96 PolarHBondContact O-N 2.81Å; V93-V96 PolarHBondContact O-N 2.93Å; V96-S98 VanDerWaalsContact C-N 3.32Å; V96-S98 PolarHBondContact O-N 2.97Å; V96-V99 PolarHBondContact O-N 3.26Å; V96-V100 WeakPolarHBondContact O-CG2 3.33Å; V96-V100 PolarHBondContact O-N 3.27Å; V96-V100 VanDerWaalsContact O-N 3.1Å |
| 97 | L | 93.6 | Very high | 91.2 | Very high | 53 Ų | 53 | 57.4 Ų | 57.4 | 28% | 0.277 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -61.8 | -41 | 178.3 | -66.9 | -174.8 | 0 | 0 | 0 | 111.8 | V93 A94 V100 G101 V118 A121 L125 | V93-L97 HydrophobicContact CG1-CD1 4.19Å; V93-L97 HydrophobicContact CG1-CG 4.32Å; V93-L97 WeakPolarHBondContact O-CG 3.33Å; V93-L97 PolarHBondContact O-N 3.35Å; A94-L97 PolarHBondContact O-N 3.14Å; L97-V100 PolarHBondContact O-N 2.97Å; L97-G101 PolarHBondContact O-N 3.45Å; L97-V118 HydrophobicContact CB-CG1 4.26Å; L97-V118 HydrophobicContact CD2-CG1 4.25Å; L97-V118 VanDerWaalsContact O-CG1 3.31Å; L97-V118 WeakPolarHBondContact O-CG1 3.46Å; L97-A121 HydrophobicContact CD1-CB 4.27Å; L97-L125 HydrophobicContact CD1-CD1 3.68Å |
| 98 | S | 92.5 | Very high | 89.9 | Confident | 1 Ų | 1 | 59.4 Ų | 59.4 | 1% | 0.007 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 179 | -60.2 | 0 | 0 | 0 | 0 | 111.3 | A94 M95 V96 V100 G101 M102 F126 | A94-S98 VanDerWaalsContact O-CB 3.23Å; A94-S98 WeakPolarHBondContact O-CB 3.47Å; A94-S98 PolarHBondContact O-N 2.9Å; A94-S98 PolarHBondContact O-OG 3.45Å; M95-S98 PolarHBondContact O-N 3.03Å; V96-S98 VanDerWaalsContact C-N 3.32Å; V96-S98 PolarHBondContact O-N 2.97Å; S98-V100 VanDerWaalsContact C-N 3.33Å; S98-V100 PolarHBondContact O-N 3.39Å; S98-G101 PolarHBondContact O-N 2.95Å; S98-M102 WeakPolarHBondContact O-CG 3.34Å; S98-M102 PolarHBondContact O-N 3.42Å; S98-F126 WeakPolarHBondContact OG-CE2 3.5Å |
| 99 | V | 92.1 | Very high | 88.9 | Confident | 55 Ų | 55 | 63 Ų | 63 | 33% | 0.333 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.4 | -45.4 | 175.5 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | Y11 M95 V96 T105 | Y11-V99 HydrophobicContact CE2-CG2 3.62Å; Y11-V99 WeakPolarHBondContact OH-CG2 3.3Å; M95-V99 WeakPolarHBondContact O-CG2 3.44Å; M95-V99 PolarHBondContact O-N 2.9Å; V96-V99 PolarHBondContact O-N 3.26Å; V99-T105 WeakPolarHBondContact O-CB 3.47Å; V99-T105 WeakPolarHBondContact O-CG2 3.22Å; V99-T105 PolarHBondContact O-OG1 3.21Å |
| 100 | V | 90.9 | Very high | 87.9 | Confident | 54 Ų | 54 | 62.7 Ų | 62.7 | 33% | 0.327 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -67.4 | -37.1 | 179 | 176.4 | 0 | 0 | 0 | 0 | 111.9 | V96 L97 S98 V107 V118 | V96-V100 WeakPolarHBondContact O-CG2 3.33Å; V96-V100 PolarHBondContact O-N 3.27Å; V96-V100 VanDerWaalsContact O-N 3.1Å; L97-V100 PolarHBondContact O-N 2.97Å; S98-V100 VanDerWaalsContact C-N 3.33Å; S98-V100 PolarHBondContact O-N 3.39Å; V100-V107 HydrophobicContact CG1-CG1 4.33Å; V100-V118 HydrophobicContact CB-CG1 4.31Å; V100-V118 HydrophobicContact CG1-CG1 4.26Å |
| 101 | G | 87.4 | Confident | 87.2 | Confident | 3 Ų | 3 | 65.6 Ų | 65.6 | 3% | 0.031 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -77.9 | -13.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | Q7 L97 S98 K115 | Q7-G101 PolarHBondContact NE2-O 3.5Å; L97-G101 PolarHBondContact O-N 3.45Å; S98-G101 PolarHBondContact O-N 2.95Å; G101-K115 WeakPolarHBondContact O-CG 3.35Å |
| 102 | M | 86.3 | Confident | 86.5 | Confident | 8 Ų | 8 | 70 Ų | 70 | 4% | 0.039 | 39% | 0.389 | C | S | . | . | S | Bend | trans | -71.6 | 140.5 | -178.3 | -79.3 | 170.8 | 93.8 | 0 | 0 | 113.3 | Q7 L8 Y11 S98 C104 T105 K115 | Q7-M102 HydrophobicContact CG-CE 4.47Å; Q7-M102 HydrophobicContact CG-CG 3.99Å; L8-M102 HydrophobicContact CB-CE 4.36Å; L8-M102 HydrophobicContact CD1-CE 3.74Å; Y11-M102 HydrophobicContact CD1-CE 4.26Å; Y11-M102 HydrophobicContact CD1-SD 4.23Å; Y11-M102 HydrophobicContact CD2-SD 3.73Å; Y11-M102 HydrophobicContact CE2-SD 4.32Å; Y11-M102 HydrophobicContact CG-CE 3.92Å; Y11-M102 HydrophobicContact CG-SD 3.66Å; S98-M102 WeakPolarHBondContact O-CG 3.34Å; S98-M102 PolarHBondContact O-N 3.42Å; M102-C104 PolarHBondContact O-N 3.43Å; M102-C104 VanDerWaalsContact O-N 3.14Å; M102-T105 PolarHBondContact O-N 3.35Å; M102-K115 WeakPolarHBondContact O-CE 3.47Å; M102-K115 PolarHBondContact O-NZ 3.4Å |
| 103 | K | 80.2 | Confident | 85.8 | Confident | 115 Ų | 115 | 68.1 Ų | 68.1 | 50% | 0.5 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.8 | -29.8 | -180 | -69.1 | 179.5 | -178.4 | 173 | 0 | 113.4 | A2 T105 K115 | A2-K103 PolarHBondContact O-NZ 3.26Å; K103-T105 VanDerWaalsContact C-N 3.27Å; K103-T105 PolarHBondContact O-N 2.9Å; K103-K115 PolarHBondContact O-NZ 3.49Å |
| 104 | C | 82.3 | Confident | 85.3 | Confident | 101 Ų | 101 | 67.1 Ų | 67.1 | 68% | 0.682 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | -16.1 | 178.6 | 55.3 | 0 | 0 | 0 | 0 | 114.4 | M102 | M102-C104 PolarHBondContact O-N 3.43Å; M102-C104 VanDerWaalsContact O-N 3.14Å |
| 105 | T | 83.5 | Confident | 84.8 | Confident | 30 Ų | 30 | 68.2 Ų | 68.2 | 18% | 0.184 | 39% | 0.387 | C | S | . | . | trans | -88.9 | 127.9 | -177.4 | -57.8 | 0 | 0 | 0 | 0 | 110.3 | V99 M102 K103 V107 K115 | V99-T105 WeakPolarHBondContact O-CB 3.47Å; V99-T105 WeakPolarHBondContact O-CG2 3.22Å; V99-T105 PolarHBondContact O-OG1 3.21Å; M102-T105 PolarHBondContact O-N 3.35Å; K103-T105 VanDerWaalsContact C-N 3.27Å; K103-T105 PolarHBondContact O-N 2.9Å; T105-V107 VanDerWaalsContact C-N 3.26Å; T105-V107 HydrophobicContact CG2-CB 3.97Å; T105-V107 HydrophobicContact CG2-CG2 3.92Å; T105-V107 PolarHBondContact O-N 3.29Å; T105-K115 PolarHBondContact O-NZ 3.45Å | ||
| 106 | R | 80.8 | Confident | 84.4 | Confident | 229 Ų | 229 | 67.8 Ų | 67.8 | 86% | 0.864 | 39% | 0.388 | S | S | * | . | trans | -74.2 | -12.8 | -178.6 | -71.6 | -79.3 | 179.3 | 117.5 | -1.6 | 114.1 | G108 | R106-G108 PolarHBondContact O-N 2.99Š| ||
| 107 | V | 76.8 | Confident | 84.1 | Confident | 90 Ų | 90 | 72.8 Ų | 72.8 | 55% | 0.545 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | 127.1 | -179.9 | -176.6 | 0 | 0 | 0 | 0 | 109.8 | V100 T105 | V100-V107 HydrophobicContact CG1-CG1 4.33Å; T105-V107 VanDerWaalsContact C-N 3.26Å; T105-V107 HydrophobicContact CG2-CB 3.97Å; T105-V107 HydrophobicContact CG2-CG2 3.92Å; T105-V107 PolarHBondContact O-N 3.29Å |
| 108 | G | 70.5 | Confident | 84 | Confident | 42 Ų | 42 | 72.4 Ų | 72.4 | 43% | 0.433 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 77.6 | 21.2 | 173 | 0 | 0 | 0 | 0 | 0 | 115.9 | R106 S110 N111 | R106-G108 PolarHBondContact O-N 2.99Å; G108-S110 PolarHBondContact O-N 2.93Å; G108-N111 PolarHBondContact O-N 3Å |
| 109 | D | 75.8 | Confident | 83.9 | Confident | 110 Ų | 110 | 72.4 Ų | 72.4 | 59% | 0.588 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -9.3 | -179.3 | -145.7 | 39.1 | 0 | 0 | 0 | 114.1 | N111 K115 | D109-N111 VanDerWaalsContact C-N 3.26Å; D109-N111 PolarHBondContact O-N 3Å; D109-K115 IonicContact OD1-NZ 3.66Å |
| 110 | S | 77 | Confident | 83.9 | Confident | 100 Ų | 100 | 72.3 Ų | 72.3 | 70% | 0.699 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | -26.6 | 174.2 | 54.4 | 0 | 0 | 0 | 0 | 113.6 | G108 | G108-S110 PolarHBondContact O-N 2.93Š|
| 111 | N | 82.7 | Confident | 84 | Confident | 97 Ų | 97 | 71.7 Ų | 71.7 | 52% | 0.519 | 40% | 0.396 | S | S | . | . | trans | -137.7 | 90 | -174.9 | -72.8 | -48.1 | 0 | 0 | 0 | 111.6 | G108 D109 I113 A114 K115 | G108-N111 PolarHBondContact O-N 3Å; D109-N111 VanDerWaalsContact C-N 3.26Å; D109-N111 PolarHBondContact O-N 3Å; N111-I113 PolarHBondContact O-N 3.41Å; N111-A114 HydrophobicContact CB-CB 3.78Å; N111-A114 PolarHBondContact O-N 3.06Å; N111-A114 VanDerWaalsContact O-N 3.12Å; N111-K115 PolarHBondContact O-N 3.35Å; N111-K115 VanDerWaalsContact O-N 3.09Å | ||
| 112 | P | 82.4 | Confident | 84.4 | Confident | 94 Ų | 94 | 71.6 Ų | 71.6 | 61% | 0.61 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -61.2 | -31.2 | -178 | 23.8 | -33.9 | 0 | 0 | 0 | 113 | K115 G116 | P112-K115 PolarHBondContact O-N 3.01Å; P112-G116 PolarHBondContact O-N 3.48Å |
| 113 | I | 83.4 | Confident | 84.8 | Confident | 83 Ų | 83 | 71.2 Ų | 71.2 | 43% | 0.426 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -66.2 | -45.7 | 176.4 | -59 | 170.8 | 0 | 0 | 0 | 110.8 | N111 K115 G116 R117 | N111-I113 PolarHBondContact O-N 3.41Å; I113-K115 VanDerWaalsContact C-N 3.32Å; I113-K115 PolarHBondContact O-N 2.98Å; I113-G116 PolarHBondContact O-N 3.44Å; I113-R117 WeakPolarHBondContact O-CG 3.14Å; I113-R117 PolarHBondContact O-N 3.49Å |
| 114 | A | 86.6 | Confident | 85.6 | Confident | 49 Ų | 49 | 68 Ų | 68 | 41% | 0.405 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.7 | -42.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | N111 G116 R117 V118 | N111-A114 HydrophobicContact CB-CB 3.78Å; N111-A114 PolarHBondContact O-N 3.06Å; N111-A114 VanDerWaalsContact O-N 3.12Å; A114-G116 PolarHBondContact O-N 3.33Å; A114-R117 PolarHBondContact O-N 2.93Å; A114-V118 WeakPolarHBondContact O-CG2 3.4Å; A114-V118 PolarHBondContact O-N 3.5Å |
| 115 | K | 86.5 | Confident | 86.3 | Confident | 22 Ų | 22 | 65.1 Ų | 65.1 | 10% | 0.096 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -59.6 | -43.1 | 175.2 | -170.2 | 171.9 | -177.5 | 175.8 | 0 | 112.6 | G101 M102 K103 T105 D109 N111 P112 I113 V118 A119 | G101-K115 WeakPolarHBondContact O-CG 3.35Å; M102-K115 WeakPolarHBondContact O-CE 3.47Å; M102-K115 PolarHBondContact O-NZ 3.4Å; K103-K115 PolarHBondContact O-NZ 3.49Å; T105-K115 PolarHBondContact O-NZ 3.45Å; D109-K115 IonicContact OD1-NZ 3.66Å; N111-K115 PolarHBondContact O-N 3.35Å; N111-K115 VanDerWaalsContact O-N 3.09Å; P112-K115 PolarHBondContact O-N 3.01Å; I113-K115 VanDerWaalsContact C-N 3.32Å; I113-K115 PolarHBondContact O-N 2.98Å; K115-V118 PolarHBondContact O-N 3.26Å; K115-A119 PolarHBondContact O-N 3.39Å |
| 116 | G | 85.6 | Confident | 87 | Confident | 13 Ų | 13 | 63.8 Ų | 63.8 | 13% | 0.134 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | P112 I113 A114 V118 A119 I120 | P112-G116 PolarHBondContact O-N 3.48Å; I113-G116 PolarHBondContact O-N 3.44Å; A114-G116 PolarHBondContact O-N 3.33Å; G116-V118 VanDerWaalsContact C-N 3.34Å; G116-V118 PolarHBondContact O-N 2.92Å; G116-A119 PolarHBondContact O-N 3.32Å; G116-I120 WeakPolarHBondContact O-CG1 3.42Å; G116-I120 PolarHBondContact O-N 2.95Å |
| 117 | R | 88.8 | Confident | 87.8 | Confident | 180 Ų | 180 | 55 Ų | 55 | 68% | 0.679 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -62.7 | -40.4 | 175.2 | -70.8 | 179.2 | 176.8 | -179.3 | -0.6 | 112.3 | I113 A114 I120 A121 | I113-R117 WeakPolarHBondContact O-CG 3.14Å; I113-R117 PolarHBondContact O-N 3.49Å; A114-R117 PolarHBondContact O-N 2.93Å; R117-I120 PolarHBondContact O-N 3.36Å; R117-A121 WeakPolarHBondContact O-CB 3.37Å; R117-A121 PolarHBondContact O-N 3.4Å |
| 118 | V | 91.6 | Very high | 88.7 | Confident | 44 Ų | 44 | 54.5 Ų | 54.5 | 27% | 0.267 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64 | -40.7 | 175.9 | 171.5 | 0 | 0 | 0 | 0 | 111.2 | L97 V100 A114 K115 G116 A121 G122 | L97-V118 HydrophobicContact CB-CG1 4.26Å; L97-V118 HydrophobicContact CD2-CG1 4.25Å; L97-V118 VanDerWaalsContact O-CG1 3.31Å; L97-V118 WeakPolarHBondContact O-CG1 3.46Å; V100-V118 HydrophobicContact CB-CG1 4.31Å; V100-V118 HydrophobicContact CG1-CG1 4.26Å; A114-V118 WeakPolarHBondContact O-CG2 3.4Å; A114-V118 PolarHBondContact O-N 3.5Å; K115-V118 PolarHBondContact O-N 3.26Å; G116-V118 VanDerWaalsContact C-N 3.34Å; G116-V118 PolarHBondContact O-N 2.92Å; V118-A121 PolarHBondContact O-N 2.93Å; V118-G122 PolarHBondContact O-N 2.75Å |
| 119 | A | 90.2 | Very high | 90 | Very high | 1 Ų | 1 | 52.6 Ų | 52.6 | 1% | 0.008 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.3 | -44.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | K115 G116 G122 G123 | K115-A119 PolarHBondContact O-N 3.39Å; G116-A119 PolarHBondContact O-N 3.32Å; A119-G122 PolarHBondContact O-N 3.44Å; A119-G123 PolarHBondContact O-N 3.31Å |
| 120 | I | 91.8 | Very high | 91.1 | Very high | 54 Ų | 54 | 47.3 Ų | 47.3 | 28% | 0.277 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 176.3 | -67 | 167.1 | 0 | 0 | 0 | 110.7 | G116 R117 G122 G123 A124 P187 | G116-I120 WeakPolarHBondContact O-CG1 3.42Å; G116-I120 PolarHBondContact O-N 2.95Å; R117-I120 PolarHBondContact O-N 3.36Å; I120-G122 VanDerWaalsContact C-N 3.34Å; I120-G122 PolarHBondContact O-N 2.9Å; I120-G123 PolarHBondContact O-N 3.25Å; I120-A124 WeakPolarHBondContact O-CB 3.47Å; I120-A124 PolarHBondContact O-N 2.85Å; I120-P187 HydrophobicContact CD1-CG 4.41Å |
| 121 | A | 94.2 | Very high | 92.1 | Very high | 41 Ų | 41 | 46.5 Ų | 46.5 | 34% | 0.339 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61 | -43.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L97 R117 V118 A124 L125 | L97-A121 HydrophobicContact CD1-CB 4.27Å; R117-A121 WeakPolarHBondContact O-CB 3.37Å; R117-A121 PolarHBondContact O-N 3.4Å; V118-A121 PolarHBondContact O-N 2.93Å; A121-A124 PolarHBondContact O-N 2.88Å; A121-L125 WeakPolarHBondContact O-CG 3.46Å; A121-L125 PolarHBondContact O-N 2.99Å |
| 122 | G | 94.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -58.8 | -47.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A94 V118 A119 I120 A124 L125 F126 | A94-G122 WeakPolarHBondContact CB-O 3.26Å; V118-G122 PolarHBondContact O-N 2.75Å; A119-G122 PolarHBondContact O-N 3.44Å; I120-G122 VanDerWaalsContact C-N 3.34Å; I120-G122 PolarHBondContact O-N 2.9Å; G122-A124 PolarHBondContact O-N 2.84Å; G122-L125 PolarHBondContact O-N 2.86Å; G122-F126 WeakPolarHBondContact O-CD2 3.38Å; G122-F126 PolarHBondContact O-N 2.85Å; G122-F126 VanDerWaalsContact O-N 3.08Å |
| 123 | G | 95.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.1 | -43.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | A119 I120 L125 F126 I127 G179 | A119-G123 PolarHBondContact O-N 3.31Å; I120-G123 PolarHBondContact O-N 3.25Å; G123-L125 VanDerWaalsContact C-N 3.35Å; G123-L125 PolarHBondContact O-N 3.45Å; G123-F126 WeakPolarHBondContact O-CB 3.42Å; G123-F126 PolarHBondContact O-N 2.97Å; G123-I127 WeakPolarHBondContact O-CG1 3.42Å; G123-I127 PolarHBondContact O-N 2.92Å; G123-G179 WeakPolarHBondContact O-CA 3.33Å |
| 124 | A | 96.3 | Very high | 94.1 | Very high | 48 Ų | 48 | 37.1 Ų | 37.1 | 40% | 0.397 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -63.6 | -39.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | I120 A121 G122 I127 L128 C183 | I120-A124 WeakPolarHBondContact O-CB 3.47Å; I120-A124 PolarHBondContact O-N 2.85Å; A121-A124 PolarHBondContact O-N 2.88Å; G122-A124 PolarHBondContact O-N 2.84Å; A124-I127 PolarHBondContact O-N 3.3Å; A124-L128 PolarHBondContact O-N 3.07Å; A124-C183 PolarHBondContact N-SG 3.47Å |
| 125 | L | 97.4 | Very high | 94.6 | Very high | 41 Ų | 41 | 38.3 Ų | 38.3 | 22% | 0.215 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67.1 | -35.5 | 174.9 | -68.8 | -179.9 | 0 | 0 | 0 | 112.4 | L90 V93 A94 L97 A121 G122 G123 L128 A129 | L90-L125 HydrophobicContact CD2-CD2 4.19Å; V93-L125 HydrophobicContact CB-CD1 4.26Å; V93-L125 HydrophobicContact CG1-CD1 3.7Å; A94-L125 HydrophobicContact CB-CB 3.59Å; L97-L125 HydrophobicContact CD1-CD1 3.68Å; A121-L125 WeakPolarHBondContact O-CG 3.46Å; A121-L125 PolarHBondContact O-N 2.99Å; G122-L125 PolarHBondContact O-N 2.86Å; G123-L125 VanDerWaalsContact C-N 3.35Å; G123-L125 PolarHBondContact O-N 3.45Å; L125-L128 PolarHBondContact O-N 2.89Å; L125-A129 WeakPolarHBondContact O-CB 3.3Å; L125-A129 PolarHBondContact O-N 3.47Å |
| 126 | F | 97.6 | Very high | 95 | Very high | 1 Ų | 1 | 37.3 Ų | 37.3 | 0% | 0.004 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.4 | -40.9 | 172.1 | -84.6 | -58.4 | 0 | 0 | 0 | 112.8 | A14 W18 A94 M95 S98 G122 G123 L128 A129 G130 L182 | A14-F126 HydrophobicContact CB-CB 4.49Å; A14-F126 HydrophobicContact CB-CD1 3.87Å; A14-F126 HydrophobicContact CB-CD2 3.65Å; A14-F126 HydrophobicContact CB-CE1 3.9Å; A14-F126 HydrophobicContact CB-CE2 3.64Å; A14-F126 HydrophobicContact CB-CG 3.76Å; A14-F126 HydrophobicContact CB-CZ 3.78Å; W18-F126 HydrophobicContact CB-CE1 4.2Å; A94-F126 HydrophobicContact CB-CB 4.45Å; A94-F126 HydrophobicContact CB-CD1 3.81Å; A94-F126 HydrophobicContact CB-CD2 3.63Å; A94-F126 HydrophobicContact CB-CE1 3.86Å; A94-F126 HydrophobicContact CB-CE2 3.71Å; A94-F126 HydrophobicContact CB-CG 3.68Å; A94-F126 HydrophobicContact CB-CZ 3.8Å; M95-F126 HydrophobicContact CB-CZ 4.25Å; M95-F126 HydrophobicContact CG-CE1 4.09Å; M95-F126 HydrophobicContact CG-CZ 3.62Å; M95-F126 HydrophobicContact SD-CE1 4.27Å; M95-F126 HydrophobicContact SD-CZ 3.55Å; M95-F126 VanDerWaalsContact SD-CZ 3.55Å; S98-F126 WeakPolarHBondContact OG-CE2 3.5Å; G122-F126 WeakPolarHBondContact O-CD2 3.38Å; G122-F126 PolarHBondContact O-N 2.85Å; G122-F126 VanDerWaalsContact O-N 3.08Å; G123-F126 WeakPolarHBondContact O-CB 3.42Å; G123-F126 PolarHBondContact O-N 2.97Å; F126-L128 VanDerWaalsContact C-N 3.33Å; F126-A129 PolarHBondContact O-N 3.15Å; F126-G130 PolarHBondContact O-N 3.18Å; F126-L182 HydrophobicContact CD2-CD1 3.86Å; F126-L182 HydrophobicContact CE2-CD1 4.1Å |
| 127 | I | 97.5 | Very high | 95.5 | Very high | 44 Ų | 44 | 36.7 Ų | 36.7 | 23% | 0.226 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.8 | -47 | 174.1 | -65.4 | 168.4 | 0 | 0 | 0 | 109.5 | G123 A124 A129 G130 L131 | G123-I127 WeakPolarHBondContact O-CG1 3.42Å; G123-I127 PolarHBondContact O-N 2.92Å; A124-I127 PolarHBondContact O-N 3.3Å; I127-A129 PolarHBondContact O-N 3.49Å; I127-G130 PolarHBondContact O-N 3.25Å; I127-L131 HydrophobicContact CG2-CD1 4Å; I127-L131 HydrophobicContact CG2-CG 4.3Å; I127-L131 VanDerWaalsContact O-CG 3.3Å; I127-L131 WeakPolarHBondContact O-CG 3.29Å; I127-L131 PolarHBondContact O-N 3.39Å |
| 128 | L | 97.5 | Very high | 95.8 | Very high | 81 Ų | 81 | 29.6 Ų | 29.6 | 42% | 0.424 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -61.5 | -44.8 | 178.3 | -174.8 | 61.4 | 0 | 0 | 0 | 112.1 | L90 A124 L125 F126 G130 L131 C132 | L90-L128 HydrophobicContact CD1-CD2 3.81Å; L90-L128 HydrophobicContact CD1-CG 3.83Å; L90-L128 HydrophobicContact CD2-CD2 4.45Å; A124-L128 PolarHBondContact O-N 3.07Å; L125-L128 PolarHBondContact O-N 2.89Å; F126-L128 VanDerWaalsContact C-N 3.33Å; L128-G130 VanDerWaalsContact C-N 3.34Å; L128-G130 PolarHBondContact O-N 3.36Å; L128-L131 PolarHBondContact O-N 3.49Å; L128-C132 PolarHBondContact O-N 3.21Å; L128-C132 PolarHBondContact O-SG 3.41Å; L128-C132 VanDerWaalsContact O-SG 3.32Å |
| 129 | A | 97.7 | Very high | 95.9 | Very high | 1 Ų | 1 | 33.7 Ų | 33.7 | 1% | 0.008 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.4 | -42.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | A87 L90 L125 F126 I127 C132 T133 | A87-A129 HydrophobicContact CB-CB 4.49Å; A87-A129 WeakPolarHBondContact CB-O 3.15Å; A87-A129 WeakPolarHBondContact O-CB 3.26Å; L90-A129 HydrophobicContact CB-CB 4Å; L125-A129 WeakPolarHBondContact O-CB 3.3Å; L125-A129 PolarHBondContact O-N 3.47Å; F126-A129 PolarHBondContact O-N 3.15Å; I127-A129 PolarHBondContact O-N 3.49Å; A129-C132 PolarHBondContact O-N 3.01Å; A129-T133 PolarHBondContact O-N 3.34Å; A129-T133 PolarHBondContact O-OG1 2.87Å |
| 130 | G | 97.7 | Very high | 96.1 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.1 | -43.7 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | F126 I127 L128 T133 L134 A172 | F126-G130 PolarHBondContact O-N 3.18Å; I127-G130 PolarHBondContact O-N 3.25Å; L128-G130 VanDerWaalsContact C-N 3.34Å; L128-G130 PolarHBondContact O-N 3.36Å; G130-T133 PolarHBondContact O-N 2.85Å; G130-L134 WeakPolarHBondContact O-CB 3.47Å; G130-L134 PolarHBondContact O-N 3.41Å; G130-A172 WeakPolarHBondContact O-CB 3.39Å |
| 131 | L | 97.7 | Very high | 96.2 | Very high | 82 Ų | 82 | 32 Ų | 32 | 43% | 0.429 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -65.6 | -41 | 176.3 | -68.9 | 176.4 | 0 | 0 | 0 | 112.4 | I127 L128 T133 L134 T135 | I127-L131 HydrophobicContact CG2-CD1 4Å; I127-L131 HydrophobicContact CG2-CG 4.3Å; I127-L131 VanDerWaalsContact O-CG 3.3Å; I127-L131 WeakPolarHBondContact O-CG 3.29Å; I127-L131 PolarHBondContact O-N 3.39Å; L128-L131 PolarHBondContact O-N 3.49Å; L131-T133 VanDerWaalsContact C-N 3.33Å; L131-T133 PolarHBondContact O-N 2.89Å; L131-L134 WeakPolarHBondContact O-CB 3.4Å; L131-L134 PolarHBondContact O-N 3.44Å; L131-T135 WeakPolarHBondContact O-CG2 3.24Å; L131-T135 PolarHBondContact O-N 3.09Å; L131-T135 PolarHBondContact O-OG1 2.84Å |
| 132 | C | 96.7 | Very high | 96.2 | Very high | 20 Ų | 20 | 33.2 Ų | 33.2 | 14% | 0.135 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.9 | -40.2 | 173.6 | -71.9 | 0 | 0 | 0 | 0 | 112.2 | A87 L128 A129 T135 A136 | A87-C132 HydrophobicContact CB-CB 4.04Å; L128-C132 PolarHBondContact O-N 3.21Å; L128-C132 PolarHBondContact O-SG 3.41Å; L128-C132 VanDerWaalsContact O-SG 3.32Å; A129-C132 PolarHBondContact O-N 3.01Å; C132-T135 PolarHBondContact O-OG1 3.28Å; C132-A136 WeakPolarHBondContact O-CB 3.28Å; C132-A136 PolarHBondContact O-N 3.44Å; C132-A136 VanDerWaalsContact O-N 3.07Å |
| 133 | T | 97.3 | Very high | 96 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -65.6 | -45.5 | 175.1 | -56.4 | 0 | 0 | 0 | 0 | 110.5 | I21 M84 A87 A129 G130 L131 T135 A136 V137 A172 | I21-T133 WeakPolarHBondContact CD1-OG1 3.4Å; I21-T133 HydrophobicContact CG1-CG2 4Å; I21-T133 WeakPolarHBondContact CG1-OG1 3.36Å; M84-T133 HydrophobicContact CE-CG2 4.01Å; M84-T133 HydrophobicContact SD-CG2 3.94Å; A87-T133 WeakPolarHBondContact CB-OG1 3.32Å; A129-T133 PolarHBondContact O-N 3.34Å; A129-T133 PolarHBondContact O-OG1 2.87Å; G130-T133 PolarHBondContact O-N 2.85Å; L131-T133 VanDerWaalsContact C-N 3.33Å; L131-T133 PolarHBondContact O-N 2.89Å; T133-T135 PolarHBondContact O-N 2.83Å; T133-A136 PolarHBondContact O-N 3.33Å; T133-V137 HydrophobicContact CG2-CG2 4.14Å; T133-V137 WeakPolarHBondContact O-CB 3.38Å; T133-V137 VanDerWaalsContact O-CG2 3.22Å; T133-V137 WeakPolarHBondContact O-CG2 2.73Å; T133-V137 PolarHBondContact O-N 3.45Å; T133-A172 HydrophobicContact CG2-CB 4.13Å |
| 134 | L | 97.3 | Very high | 95.8 | Very high | 57 Ų | 57 | 35.6 Ų | 35.6 | 30% | 0.298 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -56.4 | -52.9 | 178.4 | -161.8 | 74.2 | 0 | 0 | 0 | 110.3 | G130 L131 A136 V137 S138 W169 A172 | G130-L134 WeakPolarHBondContact O-CB 3.47Å; G130-L134 PolarHBondContact O-N 3.41Å; L131-L134 WeakPolarHBondContact O-CB 3.4Å; L131-L134 PolarHBondContact O-N 3.44Å; L134-A136 PolarHBondContact O-N 2.93Å; L134-V137 PolarHBondContact O-N 2.93Å; L134-S138 VanDerWaalsContact O-CB 3.27Å; L134-S138 WeakPolarHBondContact O-CB 3.27Å; L134-S138 PolarHBondContact O-N 3.47Å; L134-S138 PolarHBondContact O-OG 3.05Å; L134-W169 HydrophobicContact CD1-CD2 4.32Å; L134-W169 HydrophobicContact CD1-CE3 3.19Å; L134-W169 HydrophobicContact CD1-CH2 4.44Å; L134-W169 HydrophobicContact CD1-CZ3 3.27Å; L134-W169 HydrophobicContact CG-CE3 4.22Å; L134-W169 HydrophobicContact CG-CZ3 3.85Å; L134-A172 HydrophobicContact CB-CB 4.1Å; L134-A172 HydrophobicContact CD1-CB 3.85Å |
| 135 | T | 96.2 | Very high | 95.6 | Very high | 74 Ų | 74 | 35.8 Ų | 35.8 | 45% | 0.454 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -61.1 | -42.5 | -179.8 | 54.3 | 0 | 0 | 0 | 0 | 112.2 | L131 C132 T133 W139 | L131-T135 WeakPolarHBondContact O-CG2 3.24Å; L131-T135 PolarHBondContact O-N 3.09Å; L131-T135 PolarHBondContact O-OG1 2.84Å; C132-T135 PolarHBondContact O-OG1 3.28Å; T133-T135 PolarHBondContact O-N 2.83Å; T135-W139 WeakPolarHBondContact O-CB 3.34Å; T135-W139 PolarHBondContact O-N 3.48Å |
| 136 | A | 95.4 | Very high | 95.3 | Very high | 1 Ų | 1 | 39.7 Ų | 39.7 | 1% | 0.008 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.8 | -49.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L83 M84 C132 T133 L134 Y140 | L83-A136 HydrophobicContact CB-CB 3.71Å; L83-A136 HydrophobicContact CD1-CB 3.97Å; M84-A136 HydrophobicContact CG-CB 4.05Å; M84-A136 HydrophobicContact SD-CB 3.83Å; C132-A136 WeakPolarHBondContact O-CB 3.28Å; C132-A136 PolarHBondContact O-N 3.44Å; C132-A136 VanDerWaalsContact O-N 3.07Å; T133-A136 PolarHBondContact O-N 3.33Å; L134-A136 PolarHBondContact O-N 2.93Å; A136-Y140 WeakPolarHBondContact O-CB 3.14Å; A136-Y140 PolarHBondContact O-N 2.94Å |
| 137 | V | 95.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -70.2 | -41.9 | -177.5 | 177 | 0 | 0 | 0 | 0 | 110.8 | W30 M84 T133 L134 Y140 A141 L165 W169 | W30-V137 HydrophobicContact CH2-CG2 3.88Å; W30-V137 HydrophobicContact CZ3-CG2 4.23Å; M84-V137 HydrophobicContact SD-CG2 4.34Å; T133-V137 HydrophobicContact CG2-CG2 4.14Å; T133-V137 WeakPolarHBondContact O-CB 3.38Å; T133-V137 VanDerWaalsContact O-CG2 3.22Å; T133-V137 WeakPolarHBondContact O-CG2 2.73Å; T133-V137 PolarHBondContact O-N 3.45Å; L134-V137 PolarHBondContact O-N 2.93Å; V137-Y140 PolarHBondContact O-N 3.45Å; V137-A141 WeakPolarHBondContact O-CB 3.13Å; V137-A141 PolarHBondContact O-N 2.78Å; V137-L165 HydrophobicContact CG1-CB 4.05Å; V137-L165 HydrophobicContact CG1-CD2 3.75Å; V137-L165 WeakPolarHBondContact CG1-O 3.43Å; V137-W169 HydrophobicContact CG1-CD2 4.23Å; V137-W169 HydrophobicContact CG1-CG 4.02Å |
| 138 | S | 95.8 | Very high | 94.5 | Very high | 31 Ų | 31 | 44.5 Ų | 44.5 | 22% | 0.217 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.8 | -43.8 | 175.4 | -54.8 | 0 | 0 | 0 | 0 | 112.2 | L134 A141 T142 W169 | L134-S138 VanDerWaalsContact O-CB 3.27Å; L134-S138 WeakPolarHBondContact O-CB 3.27Å; L134-S138 PolarHBondContact O-N 3.47Å; L134-S138 PolarHBondContact O-OG 3.05Å; S138-A141 PolarHBondContact O-N 2.86Å; S138-T142 WeakPolarHBondContact O-CB 3.39Å; S138-T142 PolarHBondContact O-N 3.27Å; S138-T142 PolarHBondContact O-OG1 3.05Å; S138-W169 WeakPolarHBondContact OG-CH2 3.42Å; S138-W169 VanDerWaalsContact OG-CZ2 3.24Å; S138-W169 WeakPolarHBondContact OG-CZ2 3.48Å; S138-W169 WeakPolarHBondContact OG-CZ3 3.3Å |
| 139 | W | 94.5 | Very high | 94.1 | Very high | 130 Ų | 130 | 48 Ų | 48 | 49% | 0.492 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.5 | -47.4 | 179.7 | -174.7 | -97 | 0 | 0 | 0 | 110.5 | H76 T135 A141 T142 L143 | H76-W139 AromaticContact ND1-NE1 3.72Å; T135-W139 WeakPolarHBondContact O-CB 3.34Å; T135-W139 PolarHBondContact O-N 3.48Å; W139-A141 PolarHBondContact O-N 3.07Å; W139-T142 PolarHBondContact O-N 2.87Å; W139-L143 WeakPolarHBondContact O-CG 3.38Å; W139-L143 PolarHBondContact O-N 2.69Å; W139-L143 VanDerWaalsContact O-N 3.14Å |
| 140 | Y | 93.6 | Very high | 93.7 | Very high | 10 Ų | 10 | 50.7 Ų | 50.7 | 4% | 0.039 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.9 | -45.6 | 176.2 | -164.1 | -81.1 | 0 | 0 | 0 | 111.9 | W30 K31 I77 A80 A136 V137 T142 L143 V144 L165 | W30-Y140 HydrophobicContact CB-CD1 4.45Å; W30-Y140 HydrophobicContact CB-CE1 3.81Å; W30-Y140 AromaticContact CE3-CD1 3.85Å; W30-Y140 HydrophobicContact CE3-CD1 3.85Å; W30-Y140 AromaticContact CE3-CD2 3.81Å; W30-Y140 HydrophobicContact CE3-CD2 3.81Å; W30-Y140 HydrophobicContact CE3-CE1 4.25Å; W30-Y140 HydrophobicContact CE3-CE2 4.21Å; W30-Y140 AromaticContact CE3-CG 3.62Å; W30-Y140 HydrophobicContact CE3-CG 3.62Å; W30-Y140 HydrophobicContact CZ3-CD2 4.25Å; W30-Y140 HydrophobicContact CZ3-CG 4.04Å; K31-Y140 HydrophobicContact CB-CE1 4.1Å; K31-Y140 HydrophobicContact CD-CE1 4.34Å; K31-Y140 WeakPolarHBondContact CD-OH 3.48Å; K31-Y140 HydrophobicContact CG-CE1 4.28Å; K31-Y140 WeakPolarHBondContact CG-OH 3.43Å; I77-Y140 HydrophobicContact CG1-CE2 4.19Å; A80-Y140 HydrophobicContact CB-CD2 4.35Å; A136-Y140 WeakPolarHBondContact O-CB 3.14Å; A136-Y140 PolarHBondContact O-N 2.94Å; V137-Y140 PolarHBondContact O-N 3.45Å; Y140-T142 VanDerWaalsContact C-N 3.32Å; Y140-T142 PolarHBondContact O-N 2.86Å; Y140-L143 PolarHBondContact O-N 2.85Å; Y140-V144 HydrophobicContact CD1-CG2 3.87Å; Y140-V144 HydrophobicContact CE1-CG2 3.68Å; Y140-V144 WeakPolarHBondContact O-CG2 3.45Å; Y140-V144 PolarHBondContact O-N 3.41Å; Y140-V144 VanDerWaalsContact O-N 3.08Å; Y140-L165 HydrophobicContact CD1-CD1 4.33Å; Y140-L165 HydrophobicContact CD1-CD2 3.89Å; Y140-L165 HydrophobicContact CG-CD2 4.39Å |
| 141 | A | 94.1 | Very high | 93.3 | Very high | 11 Ų | 11 | 56.5 Ų | 56.5 | 9% | 0.091 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.4 | -39.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | V137 S138 W139 L143 V144 T145 F161 L165 | V137-A141 WeakPolarHBondContact O-CB 3.13Å; V137-A141 PolarHBondContact O-N 2.78Å; S138-A141 PolarHBondContact O-N 2.86Å; W139-A141 PolarHBondContact O-N 3.07Å; A141-L143 VanDerWaalsContact C-N 3.3Å; A141-L143 PolarHBondContact O-N 3.32Å; A141-V144 PolarHBondContact O-N 3.45Å; A141-T145 WeakPolarHBondContact O-CB 3.35Å; A141-T145 PolarHBondContact O-N 3.14Å; A141-T145 PolarHBondContact O-OG1 3.48Å; A141-F161 HydrophobicContact CB-CD1 4.32Å; A141-F161 HydrophobicContact CB-CE1 3.78Å; A141-F161 HydrophobicContact CB-CZ 4.22Å; A141-F161 WeakPolarHBondContact O-CE1 3.35Å; A141-L165 HydrophobicContact CB-CD1 4.26Å |
| 142 | T | 93.8 | Very high | 92.9 | Very high | 66 Ų | 66 | 57.3 Ų | 57.3 | 41% | 0.405 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.7 | -41 | 177.6 | -58.8 | 0 | 0 | 0 | 0 | 111.1 | S138 W139 Y140 T145 Q146 | S138-T142 WeakPolarHBondContact O-CB 3.39Å; S138-T142 PolarHBondContact O-N 3.27Å; S138-T142 PolarHBondContact O-OG1 3.05Å; W139-T142 PolarHBondContact O-N 2.87Å; Y140-T142 VanDerWaalsContact C-N 3.32Å; Y140-T142 PolarHBondContact O-N 2.86Å; T142-T145 WeakPolarHBondContact O-CB 3.46Å; T142-T145 PolarHBondContact O-N 3.34Å; T142-Q146 VanDerWaalsContact O-CG 3.32Å; T142-Q146 WeakPolarHBondContact O-CG 3.39Å; T142-Q146 PolarHBondContact O-N 3.34Å |
| 143 | L | 91 | Very high | 92.3 | Very high | 38 Ų | 38 | 56.7 Ų | 56.7 | 20% | 0.199 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -67.2 | -44.8 | 177.9 | -67.4 | 168.2 | 0 | 0 | 0 | 112.5 | H76 W139 Y140 A141 T145 Q146 E147 | H76-L143 HydrophobicContact CB-CD1 3.33Å; H76-L143 VanDerWaalsContact CG-CD1 3.49Å; W139-L143 WeakPolarHBondContact O-CG 3.38Å; W139-L143 PolarHBondContact O-N 2.69Å; W139-L143 VanDerWaalsContact O-N 3.14Å; Y140-L143 PolarHBondContact O-N 2.85Å; A141-L143 VanDerWaalsContact C-N 3.3Å; A141-L143 PolarHBondContact O-N 3.32Å; L143-T145 PolarHBondContact O-N 3.02Å; L143-Q146 PolarHBondContact O-N 3.08Å; L143-E147 WeakPolarHBondContact O-CB 3.38Å; L143-E147 PolarHBondContact O-N 2.71Å |
| 144 | V | 90.8 | Very high | 91.6 | Very high | 11 Ų | 11 | 60.2 Ų | 60.2 | 7% | 0.067 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.3 | -40.3 | 174.9 | 174.8 | 0 | 0 | 0 | 0 | 110.4 | K31 Y140 A141 E147 F148 Y159 F161 | K31-V144 HydrophobicContact CB-CG2 4.02Å; K31-V144 HydrophobicContact CD-CG2 4.2Å; Y140-V144 HydrophobicContact CD1-CG2 3.87Å; Y140-V144 HydrophobicContact CE1-CG2 3.68Å; Y140-V144 WeakPolarHBondContact O-CG2 3.45Å; Y140-V144 PolarHBondContact O-N 3.41Å; Y140-V144 VanDerWaalsContact O-N 3.08Å; A141-V144 PolarHBondContact O-N 3.45Å; V144-E147 PolarHBondContact O-N 3.03Å; V144-F148 WeakPolarHBondContact O-CB 3.36Å; V144-F148 PolarHBondContact O-N 3.33Å; V144-Y159 VanDerWaalsContact CG1-O 3.31Å; V144-Y159 WeakPolarHBondContact CG1-O 3.5Å; V144-F161 HydrophobicContact CB-CD1 4.27Å; V144-F161 HydrophobicContact CB-CE1 4.09Å; V144-F161 HydrophobicContact CG1-CD1 4Å; V144-F161 HydrophobicContact CG1-CE1 4.1Å |
| 145 | T | 92.2 | Very high | 90.7 | Very high | 53 Ų | 53 | 61.4 Ų | 61.4 | 33% | 0.325 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -64.2 | -47.4 | 176.5 | -52.6 | 0 | 0 | 0 | 0 | 111.7 | A141 T142 L143 E147 F148 F149 F161 | A141-T145 WeakPolarHBondContact O-CB 3.35Å; A141-T145 PolarHBondContact O-N 3.14Å; A141-T145 PolarHBondContact O-OG1 3.48Å; T142-T145 WeakPolarHBondContact O-CB 3.46Å; T142-T145 PolarHBondContact O-N 3.34Å; L143-T145 PolarHBondContact O-N 3.02Å; T145-E147 VanDerWaalsContact C-N 3.33Å; T145-E147 PolarHBondContact O-N 3.22Å; T145-F148 PolarHBondContact O-N 3.4Å; T145-F149 HydrophobicContact CG2-CD2 3.74Å; T145-F149 HydrophobicContact CG2-CE2 3.73Å; T145-F149 WeakPolarHBondContact O-CD2 3.4Å; T145-F149 PolarHBondContact O-N 3.4Å; T145-F149 VanDerWaalsContact O-N 3.12Å; T145-F161 VanDerWaalsContact OG1-CZ 3.25Å; T145-F161 WeakPolarHBondContact OG1-CZ 3.38Å |
| 146 | Q | 91.5 | Very high | 89.7 | Confident | 122 Ų | 122 | 62.6 Ų | 62.6 | 57% | 0.57 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -60.4 | -43.5 | 178.8 | -75.2 | 175 | -1.3 | 0 | 0 | 111.6 | T142 L143 F149 N150 | T142-Q146 VanDerWaalsContact O-CG 3.32Å; T142-Q146 WeakPolarHBondContact O-CG 3.39Å; T142-Q146 PolarHBondContact O-N 3.34Å; L143-Q146 PolarHBondContact O-N 3.08Å; Q146-F149 PolarHBondContact O-N 3.2Å; Q146-N150 WeakPolarHBondContact O-CB 3.36Å; Q146-N150 PolarHBondContact O-N 2.86Å |
| 147 | E | 88.6 | Confident | 89 | Confident | 89 Ų | 89 | 64.7 Ų | 64.7 | 42% | 0.416 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68.1 | -36.9 | 178.6 | -169.2 | 57.9 | -153.6 | 0 | 0 | 112 | L143 V144 T145 F149 N150 T153 | L143-E147 WeakPolarHBondContact O-CB 3.38Å; L143-E147 PolarHBondContact O-N 2.71Å; V144-E147 PolarHBondContact O-N 3.03Å; T145-E147 VanDerWaalsContact C-N 3.33Å; T145-E147 PolarHBondContact O-N 3.22Å; E147-F149 PolarHBondContact O-N 3.45Å; E147-N150 PolarHBondContact O-N 3.27Å; E147-T153 VanDerWaalsContact CD-OG1 3.26Å; E147-T153 HydrophobicContact CG-CG2 4.12Å; E147-T153 WeakPolarHBondContact O-CB 3.08Å; E147-T153 PolarHBondContact O-OG1 3.02Å; E147-T153 WeakPolarHBondContact OE1-CB 3.26Å; E147-T153 WeakPolarHBondContact OE1-CG2 3.37Å; E147-T153 PolarHBondContact OE1-OG1 2.67Å |
| 148 | F | 88.6 | Confident | 88.4 | Confident | 57 Ų | 57 | 67.9 Ų | 67.9 | 25% | 0.25 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.8 | -39.7 | 176.8 | -172.8 | -87.3 | 0 | 0 | 0 | 112.7 | V144 T145 R158 Y159 E160 | V144-F148 WeakPolarHBondContact O-CB 3.36Å; V144-F148 PolarHBondContact O-N 3.33Å; T145-F148 PolarHBondContact O-N 3.4Å; F148-R158 HydrophobicContact CD2-CB 3.87Å; F148-R158 HydrophobicContact CD2-CG 4.41Å; F148-R158 HydrophobicContact CE2-CB 4.12Å; F148-R158 PolarHBondContact O-NE 3.34Å; F148-Y159 WeakPolarHBondContact CD2-O 3.48Å; F148-E160 HydrophobicContact CE2-CG 4.36Å |
| 149 | F | 89.8 | Confident | 88 | Confident | 154 Ų | 154 | 68.1 Ų | 68.1 | 68% | 0.675 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -90.7 | -3.7 | -179.3 | -70.2 | -66.7 | 0 | 0 | 0 | 114.2 | T145 Q146 E147 P151 | T145-F149 HydrophobicContact CG2-CD2 3.74Å; T145-F149 HydrophobicContact CG2-CE2 3.73Å; T145-F149 WeakPolarHBondContact O-CD2 3.4Å; T145-F149 PolarHBondContact O-N 3.4Å; T145-F149 VanDerWaalsContact O-N 3.12Å; Q146-F149 PolarHBondContact O-N 3.2Å; E147-F149 PolarHBondContact O-N 3.45Å; F149-P151 WeakPolarHBondContact O-CD 3.24Å |
| 150 | N | 90.1 | Very high | 87.9 | Confident | 58 Ų | 58 | 66.4 Ų | 66.4 | 31% | 0.31 | 36% | 0.362 | S | S | . | . | trans | -70.7 | 121.4 | 176.8 | -174.1 | -15.7 | 0 | 0 | 0 | 109.7 | Q146 E147 S152 T153 | Q146-N150 WeakPolarHBondContact O-CB 3.36Å; Q146-N150 PolarHBondContact O-N 2.86Å; E147-N150 PolarHBondContact O-N 3.27Å; N150-S152 PolarHBondContact O-N 2.96Å; N150-S152 VanDerWaalsContact O-N 3.16Å; N150-S152 VanDerWaalsContact OD1-CB 3.3Å; N150-S152 WeakPolarHBondContact OD1-CB 3.49Å; N150-S152 PolarHBondContact OD1-N 3.48Å; N150-S152 PolarHBondContact OD1-OG 3.39Å; N150-T153 PolarHBondContact O-N 3.35Å; N150-T153 VanDerWaalsContact O-N 3.08Å | ||
| 151 | P | 88.5 | Confident | 87.8 | Confident | 122 Ų | 122 | 70.2 Ų | 70.2 | 79% | 0.792 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.9 | -18.7 | 180 | 26.4 | -35.1 | 0 | 0 | 0 | 113.2 | F149 T153 | F149-P151 WeakPolarHBondContact O-CD 3.24Å; P151-T153 VanDerWaalsContact C-N 3.29Å |
| 152 | S | 89.6 | Confident | 87.7 | Confident | 99 Ų | 99 | 69.7 Ų | 69.7 | 69% | 0.692 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.9 | -17.5 | 176.9 | -47.6 | 0 | 0 | 0 | 0 | 112.7 | N150 | N150-S152 PolarHBondContact O-N 2.96Å; N150-S152 VanDerWaalsContact O-N 3.16Å; N150-S152 VanDerWaalsContact OD1-CB 3.3Å; N150-S152 WeakPolarHBondContact OD1-CB 3.49Å; N150-S152 PolarHBondContact OD1-N 3.48Å; N150-S152 PolarHBondContact OD1-OG 3.39Å |
| 153 | T | 83.7 | Confident | 87.8 | Confident | 8 Ų | 8 | 69.1 Ų | 69.1 | 5% | 0.049 | 37% | 0.371 | C | S | . | . | S | Bend | trans | -84.9 | 116.1 | -176.4 | -52.7 | 0 | 0 | 0 | 0 | 109.7 | E147 N150 P151 A157 R158 | E147-T153 VanDerWaalsContact CD-OG1 3.26Å; E147-T153 HydrophobicContact CG-CG2 4.12Å; E147-T153 WeakPolarHBondContact O-CB 3.08Å; E147-T153 PolarHBondContact O-OG1 3.02Å; E147-T153 WeakPolarHBondContact OE1-CB 3.26Å; E147-T153 WeakPolarHBondContact OE1-CG2 3.37Å; E147-T153 PolarHBondContact OE1-OG1 2.67Å; N150-T153 PolarHBondContact O-N 3.35Å; N150-T153 VanDerWaalsContact O-N 3.08Å; P151-T153 VanDerWaalsContact C-N 3.29Å; T153-A157 HydrophobicContact CG2-CB 4.44Å; T153-R158 HydrophobicContact CG2-CG 4.14Å |
| 154 | P | 82.6 | Confident | 88 | Confident | 74 Ų | 74 | 67.3 Ų | 67.3 | 48% | 0.481 | 36% | 0.362 | S | S | . | . | trans | -67.1 | 146.2 | -175.6 | 32.3 | -37.1 | 0 | 0 | 0 | 109.7 | N156 A157 | P154-N156 VanDerWaalsContact CB-OD1 3.27Å; P154-N156 WeakPolarHBondContact CB-OD1 3.48Å; P154-N156 PolarHBondContact O-N 3.3Å; P154-A157 HydrophobicContact CG-CB 3.79Å; P154-A157 PolarHBondContact O-N 2.62Å | ||
| 155 | V | 77.9 | Confident | 88.2 | Confident | 82 Ų | 82 | 66.9 Ų | 66.9 | 50% | 0.497 | 36% | 0.359 | S | S | . | . | G | 310 helix | trans | -56.6 | -30.1 | -170.4 | -66.3 | 0 | 0 | 0 | 0 | 113.7 | A157 | V155-A157 VanDerWaalsContact C-N 3.33Š|
| 156 | N | 76.8 | Confident | 88.4 | Confident | 99 Ų | 99 | 70.2 Ų | 70.2 | 53% | 0.529 | 37% | 0.37 | S | S | . | . | G | 310 helix | trans | -77.6 | -12.3 | 177.9 | 60.6 | -33 | 0 | 0 | 0 | 114.2 | P154 | P154-N156 VanDerWaalsContact CB-OD1 3.27Å; P154-N156 WeakPolarHBondContact CB-OD1 3.48Å; P154-N156 PolarHBondContact O-N 3.3Å |
| 157 | A | 79.3 | Confident | 88.6 | Confident | 45 Ų | 45 | 67 Ų | 67 | 37% | 0.372 | 36% | 0.358 | S | S | . | . | G | 310 helix | trans | -106.3 | 8.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | T153 P154 V155 Y159 | T153-A157 HydrophobicContact CG2-CB 4.44Å; P154-A157 HydrophobicContact CG-CB 3.79Å; P154-A157 PolarHBondContact O-N 2.62Å; V155-A157 VanDerWaalsContact C-N 3.33Å; A157-Y159 WeakPolarHBondContact O-CD2 3.37Å |
| 158 | R | 84.6 | Confident | 89 | Confident | 66 Ų | 66 | 62.7 Ų | 62.7 | 25% | 0.249 | 34% | 0.338 | C | S | . | . | trans | -78.5 | 135 | -179.1 | -68.3 | -175 | -177.3 | 176.1 | -2.2 | 111.7 | S34 F148 T153 | S34-R158 WeakPolarHBondContact CB-O 3.36Å; S34-R158 PolarHBondContact N-O 3.29Å; S34-R158 VanDerWaalsContact OG-C 3.31Å; S34-R158 PolarHBondContact OG-O 3.1Å; F148-R158 HydrophobicContact CD2-CB 3.87Å; F148-R158 HydrophobicContact CD2-CG 4.41Å; F148-R158 HydrophobicContact CE2-CB 4.12Å; F148-R158 PolarHBondContact O-NE 3.34Å; T153-R158 HydrophobicContact CG2-CG 4.14Å | ||
| 159 | Y | 87.3 | Confident | 89.5 | Confident | 36 Ų | 36 | 65 Ų | 65 | 14% | 0.141 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.9 | 142.3 | 176 | -75.6 | -89.3 | 0 | 0 | 0 | 111.7 | K31 Q32 L46 E48 V144 F148 A157 | K31-Y159 HydrophobicContact CB-CD1 4.01Å; K31-Y159 HydrophobicContact CB-CG 4.34Å; K31-Y159 HydrophobicContact CD-CD1 3.69Å; K31-Y159 HydrophobicContact CD-CD2 4.16Å; K31-Y159 HydrophobicContact CD-CE1 4.22Å; K31-Y159 HydrophobicContact CD-CG 3.66Å; K31-Y159 HydrophobicContact CG-CD1 3.57Å; K31-Y159 HydrophobicContact CG-CE1 4.12Å; K31-Y159 HydrophobicContact CG-CG 4.03Å; Q32-Y159 VanDerWaalsContact C-CD1 3.44Å; Q32-Y159 CarbonylContact O-C 3.49Å; Q32-Y159 VanDerWaalsContact O-CA 3.3Å; Q32-Y159 WeakPolarHBondContact O-CA 3.46Å; L46-Y159 HydrophobicContact CB-CE1 4.44Å; E48-Y159 HydrophobicContact CG-CE1 4.32Å; E48-Y159 VanDerWaalsContact OE1-CZ 3.26Å; E48-Y159 PolarHBondContact OE1-OH 3.42Å; V144-Y159 VanDerWaalsContact CG1-O 3.31Å; V144-Y159 WeakPolarHBondContact CG1-O 3.5Å; F148-Y159 WeakPolarHBondContact CD2-O 3.48Å; A157-Y159 WeakPolarHBondContact O-CD2 3.37Å |
| 160 | E | 90.9 | Very high | 89.9 | Confident | 95 Ų | 95 | 60.6 Ų | 60.6 | 44% | 0.444 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | 167.1 | 170.1 | -83.4 | 168.8 | -162.6 | 0 | 0 | 110.9 | K31 Q32 S34 F148 G162 | K31-E160 VanDerWaalsContact CA-O 3.31Å; K31-E160 WeakPolarHBondContact CA-O 3.41Å; Q32-E160 PolarHBondContact N-O 2.91Å; Q32-E160 PolarHBondContact O-N 2.58Å; S34-E160 WeakPolarHBondContact CB-OE1 3.26Å; S34-E160 WeakPolarHBondContact OG-CG 3.23Å; F148-E160 HydrophobicContact CE2-CG 4.36Å; E160-G162 PolarHBondContact O-N 2.85Å |
| 161 | F | 92.8 | Very high | 90.2 | Very high | 90 Ų | 90 | 58 Ų | 58 | 40% | 0.395 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.3 | 123.7 | 176 | -61 | -36.5 | 0 | 0 | 0 | 111.4 | A141 V144 T145 L165 F166 | A141-F161 HydrophobicContact CB-CD1 4.32Å; A141-F161 HydrophobicContact CB-CE1 3.78Å; A141-F161 HydrophobicContact CB-CZ 4.22Å; A141-F161 WeakPolarHBondContact O-CE1 3.35Å; V144-F161 HydrophobicContact CB-CD1 4.27Å; V144-F161 HydrophobicContact CB-CE1 4.09Å; V144-F161 HydrophobicContact CG1-CD1 4Å; V144-F161 HydrophobicContact CG1-CE1 4.1Å; T145-F161 VanDerWaalsContact OG1-CZ 3.25Å; T145-F161 WeakPolarHBondContact OG1-CZ 3.38Å; F161-L165 HydrophobicContact CB-CD1 4.03Å; F161-L165 HydrophobicContact CD1-CD1 3.7Å; F161-L165 HydrophobicContact CG-CD1 4.16Å; F161-F166 HydrophobicContact CB-CE2 4.05Å; F161-F166 HydrophobicContact CB-CZ 4.08Å; F161-F166 HydrophobicContact CD2-CZ 4.49Å |
| 162 | G | 92.5 | Very high | 90.7 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 29% | 0.285 | C | S | . | . | P | Polyproline II helix | trans | -79.8 | 157.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q29 W30 E160 A164 L165 | Q29-G162 CarbonylContact O-C 3.58Å; Q29-G162 WeakPolarHBondContact O-CA 3.43Å; W30-G162 PolarHBondContact O-N 2.84Å; E160-G162 PolarHBondContact O-N 2.85Å; G162-A164 PolarHBondContact O-N 3.33Å; G162-A164 VanDerWaalsContact O-N 3.1Å; G162-L165 PolarHBondContact O-N 3.49Å; G162-L165 VanDerWaalsContact O-N 3.13Å |
| 163 | P | 94.2 | Very high | 91 | Very high | 53 Ų | 53 | 49 Ų | 49 | 34% | 0.344 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -53.6 | -30 | 178.6 | 19.3 | -33.2 | 0 | 0 | 0 | 114.2 | Q29 L165 F166 V167 | Q29-P163 HydrophobicContact CB-CG 3.68Å; Q29-P163 HydrophobicContact CG-CG 4.34Å; P163-L165 PolarHBondContact O-N 2.97Å; P163-F166 PolarHBondContact O-N 2.86Å; P163-V167 PolarHBondContact O-N 3.03Å |
| 164 | A | 95 | Very high | 91.7 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.1 | -28.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | S24 L27 Q29 W30 G162 G168 | S24-A164 PolarHBondContact OG-O 3.47Å; L27-A164 HydrophobicContact CB-CB 3.73Å; L27-A164 HydrophobicContact CD1-CB 4.18Å; Q29-A164 WeakPolarHBondContact O-CB 3.38Å; Q29-A164 PolarHBondContact O-N 3.32Å; W30-A164 HydrophobicContact CG-CB 4.23Å; G162-A164 PolarHBondContact O-N 3.33Å; G162-A164 VanDerWaalsContact O-N 3.1Å; A164-G168 PolarHBondContact O-N 2.86Å |
| 165 | L | 95.2 | Very high | 92.4 | Very high | 2 Ų | 2 | 48.2 Ų | 48.2 | 1% | 0.01 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.7 | -45.5 | 176 | -65.6 | 176.6 | 0 | 0 | 0 | 110.6 | W30 V137 Y140 A141 F161 G162 P163 V167 G168 W169 | W30-L165 HydrophobicContact CD2-CD2 4.12Å; W30-L165 HydrophobicContact CE3-CD2 3.47Å; W30-L165 VanDerWaalsContact CE3-CD2 3.47Å; W30-L165 HydrophobicContact CZ3-CD2 3.86Å; W30-L165 WeakPolarHBondContact O-CD1 2.89Å; W30-L165 VanDerWaalsContact O-CG 3.28Å; W30-L165 WeakPolarHBondContact O-CG 3.3Å; V137-L165 HydrophobicContact CG1-CB 4.05Å; V137-L165 HydrophobicContact CG1-CD2 3.75Å; V137-L165 WeakPolarHBondContact CG1-O 3.43Å; Y140-L165 HydrophobicContact CD1-CD1 4.33Å; Y140-L165 HydrophobicContact CD1-CD2 3.89Å; Y140-L165 HydrophobicContact CG-CD2 4.39Å; A141-L165 HydrophobicContact CB-CD1 4.26Å; F161-L165 HydrophobicContact CB-CD1 4.03Å; F161-L165 HydrophobicContact CD1-CD1 3.7Å; F161-L165 HydrophobicContact CG-CD1 4.16Å; G162-L165 PolarHBondContact O-N 3.49Å; G162-L165 VanDerWaalsContact O-N 3.13Å; P163-L165 PolarHBondContact O-N 2.97Å; L165-V167 VanDerWaalsContact C-N 3.34Å; L165-V167 PolarHBondContact O-N 2.91Å; L165-G168 CarbonylContact O-C 3.56Å; L165-G168 WeakPolarHBondContact O-CA 3.49Å; L165-G168 PolarHBondContact O-N 3.39Å; L165-W169 PolarHBondContact O-N 2.97Å |
| 166 | F | 96.4 | Very high | 93.3 | Very high | 124 Ų | 124 | 46.3 Ų | 46.3 | 54% | 0.544 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -63.4 | -40.3 | 178.6 | -58.6 | -78 | 0 | 0 | 0 | 112 | F161 P163 G168 W169 A170 | F161-F166 HydrophobicContact CB-CE2 4.05Å; F161-F166 HydrophobicContact CB-CZ 4.08Å; F161-F166 HydrophobicContact CD2-CZ 4.49Å; P163-F166 PolarHBondContact O-N 2.86Å; F166-G168 VanDerWaalsContact C-N 3.3Å; F166-G168 PolarHBondContact O-N 3.27Å; F166-W169 PolarHBondContact O-N 3.06Å; F166-A170 WeakPolarHBondContact O-CB 3.16Å; F166-A170 PolarHBondContact O-N 3.16Å |
| 167 | V | 96.8 | Very high | 94.3 | Very high | 53 Ų | 53 | 46.1 Ų | 46.1 | 32% | 0.321 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60.3 | -43 | 171.5 | 178.4 | 0 | 0 | 0 | 0 | 110.4 | L27 P163 L165 A170 S171 | L27-V167 HydrophobicContact CD1-CG2 4.49Å; P163-V167 PolarHBondContact O-N 3.03Å; L165-V167 VanDerWaalsContact C-N 3.34Å; L165-V167 PolarHBondContact O-N 2.91Å; V167-A170 PolarHBondContact O-N 3.49Å; V167-S171 WeakPolarHBondContact O-CB 3.19Å; V167-S171 PolarHBondContact O-N 3.48Å; V167-S171 PolarHBondContact O-OG 3.16Å |
| 168 | G | 97.3 | Very high | 95 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -56.4 | -51.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | S24 A164 L165 F166 A170 S171 A172 | S24-G168 WeakPolarHBondContact OG-CA 3.23Å; A164-G168 PolarHBondContact O-N 2.86Å; L165-G168 CarbonylContact O-C 3.56Å; L165-G168 WeakPolarHBondContact O-CA 3.49Å; L165-G168 PolarHBondContact O-N 3.39Å; F166-G168 VanDerWaalsContact C-N 3.3Å; F166-G168 PolarHBondContact O-N 3.27Å; G168-A170 PolarHBondContact O-N 2.86Å; G168-S171 WeakPolarHBondContact CA-OG 3.34Å; G168-S171 PolarHBondContact O-N 2.88Å; G168-S171 PolarHBondContact O-OG 3.29Å; G168-A172 WeakPolarHBondContact O-CB 3.47Å; G168-A172 PolarHBondContact O-N 3.02Å |
| 169 | W | 98.1 | Very high | 95.5 | Very high | 106 Ų | 106 | 40.9 Ų | 40.9 | 40% | 0.402 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -59.7 | -47 | 176.4 | -72.8 | 109.2 | 0 | 0 | 0 | 113.1 | L134 V137 S138 L165 F166 S171 A172 G173 | L134-W169 HydrophobicContact CD1-CD2 4.32Å; L134-W169 HydrophobicContact CD1-CE3 3.19Å; L134-W169 HydrophobicContact CD1-CH2 4.44Å; L134-W169 HydrophobicContact CD1-CZ3 3.27Å; L134-W169 HydrophobicContact CG-CE3 4.22Å; L134-W169 HydrophobicContact CG-CZ3 3.85Å; V137-W169 HydrophobicContact CG1-CD2 4.23Å; V137-W169 HydrophobicContact CG1-CG 4.02Å; S138-W169 WeakPolarHBondContact OG-CH2 3.42Å; S138-W169 VanDerWaalsContact OG-CZ2 3.24Å; S138-W169 WeakPolarHBondContact OG-CZ2 3.48Å; S138-W169 WeakPolarHBondContact OG-CZ3 3.3Å; L165-W169 PolarHBondContact O-N 2.97Å; F166-W169 PolarHBondContact O-N 3.06Å; W169-S171 VanDerWaalsContact C-N 3.32Å; W169-S171 PolarHBondContact O-N 3.38Å; W169-A172 PolarHBondContact O-N 3.29Å; W169-G173 PolarHBondContact O-N 3.49Å |
| 170 | A | 97.8 | Very high | 95.9 | Very high | 60 Ų | 60 | 41.1 Ų | 41.1 | 50% | 0.496 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.7 | -43.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | F166 V167 G168 G173 L174 | F166-A170 WeakPolarHBondContact O-CB 3.16Å; F166-A170 PolarHBondContact O-N 3.16Å; V167-A170 PolarHBondContact O-N 3.49Å; G168-A170 PolarHBondContact O-N 2.86Å; A170-G173 PolarHBondContact O-N 3.28Å; A170-L174 WeakPolarHBondContact O-CG 3.26Å; A170-L174 PolarHBondContact O-N 2.95Å |
| 171 | S | 97.5 | Very high | 96 | Very high | 3 Ų | 3 | 39.8 Ų | 39.8 | 2% | 0.021 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -64.9 | -40.9 | 178.9 | 75.1 | 0 | 0 | 0 | 0 | 112.7 | G17 G20 I21 V167 G168 W169 L174 A175 | G17-S171 WeakPolarHBondContact CA-O 3.5Å; G17-S171 WeakPolarHBondContact O-CB 3.5Å; G20-S171 VanDerWaalsContact C-CB 3.44Å; I21-S171 WeakPolarHBondContact CG1-OG 3.41Å; V167-S171 WeakPolarHBondContact O-CB 3.19Å; V167-S171 PolarHBondContact O-N 3.48Å; V167-S171 PolarHBondContact O-OG 3.16Å; G168-S171 WeakPolarHBondContact CA-OG 3.34Å; G168-S171 PolarHBondContact O-N 2.88Å; G168-S171 PolarHBondContact O-OG 3.29Å; W169-S171 VanDerWaalsContact C-N 3.32Å; W169-S171 PolarHBondContact O-N 3.38Å; S171-L174 PolarHBondContact O-N 3.37Å; S171-A175 WeakPolarHBondContact O-CB 3.31Å; S171-A175 PolarHBondContact O-N 3Å |
| 172 | A | 97.6 | Very high | 95.9 | Very high | 1 Ų | 1 | 35.5 Ų | 35.5 | 1% | 0.008 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.4 | -45.3 | 174 | 0 | 0 | 0 | 0 | 0 | 111.3 | G130 T133 L134 G168 W169 A175 V176 | G130-A172 WeakPolarHBondContact O-CB 3.39Å; T133-A172 HydrophobicContact CG2-CB 4.13Å; L134-A172 HydrophobicContact CB-CB 4.1Å; L134-A172 HydrophobicContact CD1-CB 3.85Å; G168-A172 WeakPolarHBondContact O-CB 3.47Å; G168-A172 PolarHBondContact O-N 3.02Å; W169-A172 PolarHBondContact O-N 3.29Å; A172-A175 PolarHBondContact O-N 3.32Å; A172-V176 VanDerWaalsContact O-CG2 3.32Å; A172-V176 WeakPolarHBondContact O-CG2 3.35Å; A172-V176 PolarHBondContact O-N 2.92Å |
| 173 | G | 97.7 | Very high | 95.8 | Very high | 32 Ų | 32 | 37 Ų | 37 | 33% | 0.33 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.4 | -47.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | W169 A170 V176 L177 | W169-G173 PolarHBondContact O-N 3.49Å; A170-G173 PolarHBondContact O-N 3.28Å; G173-V176 PolarHBondContact O-N 3.34Å; G173-L177 WeakPolarHBondContact O-CB 3.49Å; G173-L177 VanDerWaalsContact O-CG 3.26Å; G173-L177 WeakPolarHBondContact O-CG 3.35Å; G173-L177 PolarHBondContact O-N 3.33Å |
| 174 | L | 97.6 | Very high | 95.3 | Very high | 65 Ų | 65 | 38.6 Ų | 38.6 | 34% | 0.34 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.7 | -42.4 | 177 | -72.2 | 174.9 | 0 | 0 | 0 | 112.5 | L13 A170 S171 G178 | L13-L174 HydrophobicContact CD2-CD2 3.86Å; A170-L174 WeakPolarHBondContact O-CG 3.26Å; A170-L174 PolarHBondContact O-N 2.95Å; S171-L174 PolarHBondContact O-N 3.37Å; L174-G178 PolarHBondContact O-N 3.44Å |
| 175 | A | 97.5 | Very high | 94.1 | Very high | 1 Ų | 1 | 39.2 Ų | 39.2 | 1% | 0.008 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.4 | -44 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | I21 S171 A172 G179 | I21-A175 HydrophobicContact CD1-CB 4.27Å; S171-A175 WeakPolarHBondContact O-CB 3.31Å; S171-A175 PolarHBondContact O-N 3Å; A172-A175 PolarHBondContact O-N 3.32Å; A175-G179 PolarHBondContact O-N 3.48Å |
| 176 | V | 97.4 | Very high | 92.3 | Very high | 41 Ų | 41 | 43.9 Ų | 43.9 | 25% | 0.248 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -66.7 | -44.1 | 177.4 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | A172 G173 S180 | A172-V176 VanDerWaalsContact O-CG2 3.32Å; A172-V176 WeakPolarHBondContact O-CG2 3.35Å; A172-V176 PolarHBondContact O-N 2.92Å; G173-V176 PolarHBondContact O-N 3.34Å; V176-S180 VanDerWaalsContact O-CB 3.3Å; V176-S180 WeakPolarHBondContact O-CB 3.49Å; V176-S180 PolarHBondContact O-N 3.47Å; V176-S180 PolarHBondContact O-OG 2.9Å |
| 177 | L | 96.4 | Very high | 90.4 | Very high | 96 Ų | 96 | 40.4 Ų | 40.4 | 50% | 0.503 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -64.4 | -47.3 | 177.5 | -73.1 | 174.1 | 0 | 0 | 0 | 111.6 | G173 S180 F181 | G173-L177 WeakPolarHBondContact O-CB 3.49Å; G173-L177 VanDerWaalsContact O-CG 3.26Å; G173-L177 WeakPolarHBondContact O-CG 3.35Å; G173-L177 PolarHBondContact O-N 3.33Å; L177-S180 WeakPolarHBondContact O-CB 3.41Å; L177-S180 PolarHBondContact O-N 3.28Å; L177-F181 PolarHBondContact O-N 3.19Å |
| 178 | G | 95.3 | Very high | 88.4 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.6 | -45.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | G10 L174 S180 F181 L182 | G10-G178 VanDerWaalsContact O-CA 3.24Å; G10-G178 WeakPolarHBondContact O-CA 3.08Å; L174-G178 PolarHBondContact O-N 3.44Å; G178-S180 VanDerWaalsContact C-N 3.33Å; G178-S180 PolarHBondContact O-N 2.99Å; G178-F181 PolarHBondContact O-N 3.05Å; G178-L182 WeakPolarHBondContact O-CG 3.42Å; G178-L182 PolarHBondContact O-N 3.38Å |
| 179 | G | 95.3 | Very high | 86.2 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62.1 | -38.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | G123 A175 L182 C183 | G123-G179 WeakPolarHBondContact O-CA 3.33Å; A175-G179 PolarHBondContact O-N 3.48Å; G179-L182 PolarHBondContact O-N 3.37Å; G179-C183 WeakPolarHBondContact O-CB 3.39Å; G179-C183 PolarHBondContact O-N 3.04Å; G179-C183 PolarHBondContact O-SG 2.98Å |
| 180 | S | 94.1 | Very high | 83.7 | Confident | 41 Ų | 41 | 52.2 Ų | 52.2 | 29% | 0.287 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.7 | -45.7 | 175.5 | -60.6 | 0 | 0 | 0 | 0 | 111.7 | V176 L177 G178 L182 C183 C184 | V176-S180 VanDerWaalsContact O-CB 3.3Å; V176-S180 WeakPolarHBondContact O-CB 3.49Å; V176-S180 PolarHBondContact O-N 3.47Å; V176-S180 PolarHBondContact O-OG 2.9Å; L177-S180 WeakPolarHBondContact O-CB 3.41Å; L177-S180 PolarHBondContact O-N 3.28Å; G178-S180 VanDerWaalsContact C-N 3.33Å; G178-S180 PolarHBondContact O-N 2.99Å; S180-L182 VanDerWaalsContact C-N 3.3Å; S180-L182 PolarHBondContact O-N 3.25Å; S180-C183 PolarHBondContact O-N 3.09Å; S180-C183 VanDerWaalsContact O-N 3.16Å; S180-C184 PolarHBondContact O-N 3.12Å; S180-C184 PolarHBondContact O-SG 3.21Å |
| 181 | F | 92.7 | Very high | 81.1 | Confident | 67 Ų | 67 | 58.8 Ų | 58.8 | 29% | 0.294 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63 | -35.2 | 175.6 | -68.2 | -19.6 | 0 | 0 | 0 | 113.1 | L6 L9 L13 L177 G178 | L6-F181 HydrophobicContact CD1-CB 4.23Å; L6-F181 HydrophobicContact CD1-CD1 4.07Å; L6-F181 HydrophobicContact CD1-CD2 4.07Å; L6-F181 HydrophobicContact CD1-CE1 4.43Å; L6-F181 HydrophobicContact CD1-CE2 4.44Å; L6-F181 HydrophobicContact CD1-CG 3.87Å; L6-F181 HydrophobicContact CG-CB 4.38Å; L9-F181 HydrophobicContact CD2-CE2 4.23Å; L13-F181 HydrophobicContact CD1-CD2 3.79Å; L13-F181 HydrophobicContact CD1-CE2 3.62Å; L177-F181 PolarHBondContact O-N 3.19Å; G178-F181 PolarHBondContact O-N 3.05Å |
| 182 | L | 91.2 | Very high | 78.4 | Confident | 1 Ų | 1 | 64.5 Ų | 64.5 | 1% | 0.005 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -68.9 | -38.2 | 172.7 | -68.4 | 170.5 | 0 | 0 | 0 | 112 | Q7 A14 F126 G178 G179 S180 T185 | Q7-L182 HydrophobicContact CG-CD2 3.88Å; A14-L182 HydrophobicContact CB-CD1 4.35Å; F126-L182 HydrophobicContact CD2-CD1 3.86Å; F126-L182 HydrophobicContact CE2-CD1 4.1Å; G178-L182 WeakPolarHBondContact O-CG 3.42Å; G178-L182 PolarHBondContact O-N 3.38Å; G179-L182 PolarHBondContact O-N 3.37Å; S180-L182 VanDerWaalsContact C-N 3.3Å; S180-L182 PolarHBondContact O-N 3.25Å; L182-T185 PolarHBondContact O-N 2.97Å; L182-T185 PolarHBondContact O-OG1 3.02Å |
| 183 | C | 90.2 | Very high | 75.8 | Confident | 32 Ų | 32 | 71.2 Ų | 71.2 | 22% | 0.216 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -69.5 | -33.5 | 175.8 | -72.8 | 0 | 0 | 0 | 0 | 113.1 | A124 G179 S180 T185 | A124-C183 PolarHBondContact N-SG 3.47Å; G179-C183 WeakPolarHBondContact O-CB 3.39Å; G179-C183 PolarHBondContact O-N 3.04Å; G179-C183 PolarHBondContact O-SG 2.98Å; S180-C183 PolarHBondContact O-N 3.09Å; S180-C183 VanDerWaalsContact O-N 3.16Å; C183-T185 PolarHBondContact O-N 3.21Å |
| 184 | C | 84.2 | Confident | 73.1 | Confident | 86 Ų | 86 | 74.3 Ų | 74.3 | 58% | 0.581 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -5.2 | 176.9 | -68.3 | 0 | 0 | 0 | 0 | 113.4 | S180 C186 | S180-C184 PolarHBondContact O-N 3.12Å; S180-C184 PolarHBondContact O-SG 3.21Å; C184-C186 PolarHBondContact O-N 3.45Å |
| 185 | T | 69.5 | Low | 70.4 | Confident | 13 Ų | 13 | 75.6 Ų | 75.6 | 8% | 0.08 | 43% | 0.426 | C | S | . | . | trans | -79.5 | 64.4 | 169.6 | 73.4 | 0 | 0 | 0 | 0 | 110.7 | A2 Q7 L182 C183 P187 | A2-T185 HydrophobicContact CB-CG2 3.73Å; Q7-T185 HydrophobicContact CB-CG2 4.3Å; Q7-T185 HydrophobicContact CG-CG2 4.25Å; L182-T185 PolarHBondContact O-N 2.97Å; L182-T185 PolarHBondContact O-OG1 3.02Å; C183-T185 PolarHBondContact O-N 3.21Å; T185-P187 WeakPolarHBondContact O-CD 3.48Å | ||
| 186 | C | 58.6 | Low | 68 | Low | 100 Ų | 100 | 81.6 Ų | 81.6 | 68% | 0.676 | 47% | 0.465 | S | S | * | . | P | Polyproline II helix | trans | -64.6 | 124.3 | 172.8 | -64.2 | 0 | 0 | 0 | 0 | 109.3 | C184 E188 | C184-C186 PolarHBondContact O-N 3.45Å; C186-E188 PolarHBondContact O-N 3.29Å |
| 187 | P | 56.6 | Low | 65.8 | Low | 51 Ų | 51 | 87.6 Ų | 87.6 | 33% | 0.331 | 49% | 0.49 | S | S | . | . | P | Polyproline II helix | trans | -62.1 | 118.8 | 162.8 | 22.6 | -25.6 | 0 | 0 | 0 | 106.9 | I120 T185 P189 | I120-P187 HydrophobicContact CD1-CG 4.41Å; T185-P187 WeakPolarHBondContact O-CD 3.48Å; P187-P189 WeakPolarHBondContact O-CD 3.46Å |
| 188 | E | 54.3 | Low | 63.8 | Low | 148 Ų | 148 | 88.1 Ų | 88.1 | 69% | 0.692 | 50% | 0.499 | S | S | * | . | P | Polyproline II helix | trans | -53 | 124.1 | 170 | -166.6 | 92 | 68.5 | 0 | 0 | 106.8 | C186 E190 | C186-E188 PolarHBondContact O-N 3.29Å; E188-E190 PolarHBondContact O-N 3.21Å |
| 189 | P | 50.2 | Low | 61.4 | Low | 104 Ų | 104 | 98 Ų | 98 | 68% | 0.675 | 54% | 0.538 | S | S | * | . | P | Polyproline II helix | trans | -53.6 | 129.3 | 169.2 | -18.4 | 29.1 | 0 | 0 | 0 | 107 | P187 R191 | P187-P189 WeakPolarHBondContact O-CD 3.46Å; P189-R191 VanDerWaalsContact C-N 3.34Å; P189-R191 PolarHBondContact O-N 2.79Å |
| 190 | E | 46.4 | Very low | 59.3 | Low | 154 Ų | 154 | 109.1 Ų | 109.1 | 72% | 0.72 | 58% | 0.58 | S | S | * | * | trans | -50 | 107.6 | 166.6 | -93.4 | 172.3 | 112.6 | 0 | 0 | 106.7 | E188 | E188-E190 PolarHBondContact O-N 3.21Š| ||
| 191 | R | 42.9 | Very low | 57.7 | Low | 198 Ų | 198 | 111.8 Ų | 111.8 | 75% | 0.747 | 60% | 0.597 | S | S | * | * | trans | -55.5 | 126 | 157.8 | -67.2 | -176.8 | -177 | 163.6 | 2.3 | 103.6 | P189 N193 | P189-R191 VanDerWaalsContact C-N 3.34Å; P189-R191 PolarHBondContact O-N 2.79Å; R191-N193 PolarHBondContact O-N 3.01Å | ||
| 192 | P | 40.6 | Very low | 56 | Low | 124 Ų | 124 | 111.4 Ų | 111.4 | 81% | 0.805 | 61% | 0.612 | S | S | * | * | trans | -53.6 | 110.1 | 174.6 | 21.9 | -31.2 | 0 | 0 | 0 | 106 | S194 | P192-S194 PolarHBondContact O-N 2.78Š| ||
| 193 | N | 42.2 | Very low | 54.3 | Low | 142 Ų | 142 | 117.7 Ų | 117.7 | 76% | 0.759 | 65% | 0.652 | S | S | * | * | trans | -53.7 | 119.5 | -179.7 | -94.5 | -26.4 | 0 | 0 | 0 | 106.7 | R191 S195 | R191-N193 PolarHBondContact O-N 3.01Å; N193-S195 PolarHBondContact O-N 2.89Å | ||
| 194 | S | 41.5 | Very low | 52.4 | Low | 96 Ų | 96 | 121.3 Ų | 121.3 | 67% | 0.671 | 68% | 0.678 | S | S | * | * | trans | 16.9 | 108.5 | 145.4 | 55.4 | 0 | 0 | 0 | 0 | 114.8 | P192 | P192-S194 PolarHBondContact O-N 2.78Š| ||
| 195 | S | 41.3 | Very low | 51 | Low | 92 Ų | 92 | 122.4 Ų | 122.4 | 64% | 0.643 | 69% | 0.693 | S | S | * | * | trans | 9.6 | 128.5 | 147.8 | 40.1 | 0 | 0 | 0 | 0 | 116.6 | N193 Q197 | N193-S195 PolarHBondContact O-N 2.89Å; S195-Q197 PolarHBondContact O-N 3.5Å | ||
| 196 | P | 46.8 | Very low | 50 | Low | 128 Ų | 128 | 125.4 Ų | 125.4 | 83% | 0.831 | 72% | 0.72 | S | S | * | * | trans | -56.5 | 112.3 | 164.2 | -8.9 | 21.7 | 0 | 0 | 0 | 107.2 | P198 | P196-P198 WeakPolarHBondContact O-CD 3.41Å; P196-P198 VanDerWaalsContact O-N 3.16Å | ||
| 197 | Q | 51.3 | Low | 49.5 | Very low | 167 Ų | 167 | 125.7 Ų | 125.7 | 78% | 0.78 | 73% | 0.729 | S | S | * | * | trans | -51.9 | 122.2 | 166.8 | -88.2 | -76.3 | -28.6 | 0 | 0 | 107.1 | S195 Y199 | S195-Q197 PolarHBondContact O-N 3.5Å; Q197-Y199 PolarHBondContact O-N 3.19Å; Q197-Y199 VanDerWaalsContact O-N 3.1Å | ||
| 198 | P | 54.1 | Low | 49.1 | Very low | 107 Ų | 107 | 134.5 Ų | 134.5 | 70% | 0.695 | 76% | 0.756 | S | S | * | * | trans | -60.8 | 121.4 | 173.9 | -15.1 | 27.7 | 0 | 0 | 0 | 107.1 | P196 R200 | P196-P198 WeakPolarHBondContact O-CD 3.41Å; P196-P198 VanDerWaalsContact O-N 3.16Å; P198-R200 PolarHBondContact O-N 2.88Å | ||
| 199 | Y | 45.4 | Very low | 49 | Very low | 207 Ų | 207 | 135.8 Ų | 135.8 | 81% | 0.812 | 76% | 0.762 | S | S | * | * | trans | -48.1 | 105.6 | 168 | -178.3 | -94.5 | 0 | 0 | 0 | 108.3 | Q197 P201 | Q197-Y199 PolarHBondContact O-N 3.19Å; Q197-Y199 VanDerWaalsContact O-N 3.1Å; Y199-P201 HydrophobicContact CD1-CG 4.27Å; Y199-P201 HydrophobicContact CE1-CB 4.38Å; Y199-P201 HydrophobicContact CE1-CG 4.39Å; Y199-P201 VanDerWaalsContact O-CD 3.26Å; Y199-P201 WeakPolarHBondContact O-CD 3.26Å | ||
| 200 | R | 51.1 | Low | 48.9 | Very low | 233 Ų | 233 | 136.2 Ų | 136.2 | 88% | 0.879 | 77% | 0.765 | S | S | * | * | trans | -83.8 | 108.5 | 174.2 | -159.8 | 176.9 | -168.4 | 164.4 | 2.8 | 105.8 | P198 G202 | P198-R200 PolarHBondContact O-N 2.88Å; R200-G202 PolarHBondContact O-N 3.1Å | ||
| 201 | P | 59.8 | Low | 49.2 | Very low | 98 Ų | 98 | 134.4 Ų | 134.4 | 64% | 0.636 | 76% | 0.764 | S | S | * | * | trans | -64.2 | 124 | 173.7 | -10.6 | 27 | 0 | 0 | 0 | 106.9 | Y199 | Y199-P201 HydrophobicContact CD1-CG 4.27Å; Y199-P201 HydrophobicContact CE1-CB 4.38Å; Y199-P201 HydrophobicContact CE1-CG 4.39Å; Y199-P201 VanDerWaalsContact O-CD 3.26Å; Y199-P201 WeakPolarHBondContact O-CD 3.26Å | ||
| 202 | G | 56.9 | Low | 49.5 | Very low | 59 Ų | 59 | 130.5 Ų | 130.5 | 61% | 0.608 | 76% | 0.762 | S | S | * | * | trans | -57 | 155 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | R200 S204 | R200-G202 PolarHBondContact O-N 3.1Å; G202-S204 PolarHBondContact O-N 2.95Å | ||
| 203 | P | 57.5 | Low | 49.8 | Very low | 132 Ų | 132 | 133.3 Ų | 133.3 | 86% | 0.857 | 76% | 0.761 | S | S | * | * | trans | -62.8 | 115.1 | 179.2 | 13.6 | -8.8 | 0 | 0 | 0 | 108.8 | A205 | P203-A205 PolarHBondContact O-N 3.04Š| ||
| 204 | S | 50.2 | Low | 50.3 | Low | 108 Ų | 108 | 133.6 Ų | 133.6 | 76% | 0.755 | 76% | 0.762 | S | S | * | * | trans | -62.6 | 107.6 | 173.4 | -175.3 | 0 | 0 | 0 | 0 | 108.7 | G202 A206 | G202-S204 PolarHBondContact O-N 2.95Å; S204-A206 PolarHBondContact O-N 3.03Å | ||
| 205 | A | 54 | Low | 50.8 | Low | 110 Ų | 110 | 134.7 Ų | 134.7 | 91% | 0.909 | 77% | 0.767 | S | S | * | * | trans | -75 | 40.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | P203 | P203-A205 PolarHBondContact O-N 3.04Š| ||
| 206 | A | 49.2 | Very low | 50.9 | Low | 76 Ų | 76 | 135.4 Ų | 135.4 | 63% | 0.628 | 78% | 0.778 | S | S | * | * | trans | -132.9 | 51.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | S204 R208 | S204-A206 PolarHBondContact O-N 3.03Å; A206-R208 PolarHBondContact O-N 3.2Å | ||
| 207 | A | 46.9 | Very low | 50.9 | Low | 106 Ų | 106 | 134.6 Ų | 134.6 | 88% | 0.876 | 78% | 0.776 | S | S | * | * | trans | -75.1 | 84.5 | 147.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 208 | R | 49.1 | Very low | 50.6 | Low | 235 Ų | 235 | 131 Ų | 131 | 89% | 0.887 | 78% | 0.775 | S | S | * | * | trans | -118.1 | 95.4 | 160.6 | -94.3 | -176 | 173.8 | 165.4 | -0.8 | 106.9 | A206 | A206-R208 PolarHBondContact O-N 3.2Š| ||
| 209 | E | 52.5 | Low | 50.4 | Low | 175 Ų | 175 | 136 Ų | 136 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -52.1 | 134.7 | 166.3 | -69.4 | 177.8 | 119.1 | 0 | 0 | 109.8 | V211 | E209-V211 PolarHBondContact O-N 3.01Š| ||
| 210 | P | 47.6 | Very low | 50.2 | Low | 114 Ų | 114 | 129.6 Ų | 129.6 | 74% | 0.74 | 78% | 0.783 | S | S | * | * | trans | -78.6 | 103.6 | 166.2 | 31.2 | -27.1 | 0 | 0 | 0 | 107.5 | V212 | P210-V212 VanDerWaalsContact C-N 3.29Å; P210-V212 PolarHBondContact O-N 3.26Å | ||
| 211 | V | 51.8 | Low | 49.9 | Very low | 115 Ų | 115 | 124.1 Ų | 124.1 | 70% | 0.697 | 78% | 0.777 | S | S | * | * | trans | -65.6 | 95.2 | 163.8 | 178.5 | 0 | 0 | 0 | 0 | 107.3 | E209 K213 | E209-V211 PolarHBondContact O-N 3.01Å; V211-K213 HydrophobicContact CG1-CG 4.03Å; V211-K213 PolarHBondContact O-N 3.22Å | ||
| 212 | V | 49.7 | Very low | 49.2 | Very low | 116 Ų | 116 | 127.8 Ų | 127.8 | 70% | 0.703 | 79% | 0.79 | S | S | * | * | trans | -68.9 | 94.9 | 167.4 | 176.3 | 0 | 0 | 0 | 0 | 107.3 | P210 L214 | P210-V212 VanDerWaalsContact C-N 3.29Å; P210-V212 PolarHBondContact O-N 3.26Å; V212-L214 HydrophobicContact CG1-CD1 4.38Å; V212-L214 PolarHBondContact O-N 2.9Å | ||
| 213 | K | 48 | Very low | 48.5 | Very low | 183 Ų | 183 | 128 Ų | 128 | 80% | 0.796 | 79% | 0.793 | S | S | * | * | trans | -74.4 | 103.4 | 166 | -71.5 | -174.9 | 175.8 | -177.8 | 0 | 107.9 | V211 | V211-K213 HydrophobicContact CG1-CG 4.03Å; V211-K213 PolarHBondContact O-N 3.22Å | ||
| 214 | L | 52 | Low | 47.8 | Very low | 148 Ų | 148 | 132.7 Ų | 132.7 | 78% | 0.775 | 82% | 0.819 | S | S | * | * | trans | -61.8 | 137.1 | 166.7 | -88.2 | 97.2 | 0 | 0 | 0 | 109.8 | V212 A216 | V212-L214 HydrophobicContact CG1-CD1 4.38Å; V212-L214 PolarHBondContact O-N 2.9Å; L214-A216 PolarHBondContact O-N 3.29Å | ||
| 215 | P | 50.8 | Low | 47.7 | Very low | 120 Ų | 120 | 133.9 Ų | 133.9 | 78% | 0.779 | 82% | 0.822 | S | S | * | * | trans | -74.3 | 115 | 173.7 | 29.3 | -30 | 0 | 0 | 0 | 109.6 | S217 | P215-S217 PolarHBondContact O-N 3.43Š| ||
| 216 | A | 43.8 | Very low | 47.3 | Very low | 107 Ų | 107 | 135.2 Ų | 135.2 | 88% | 0.884 | 82% | 0.817 | S | S | * | * | trans | -76.9 | 110.3 | 161.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | L214 | L214-A216 PolarHBondContact O-N 3.29Š| ||
| 217 | S | 46.3 | Very low | 47.2 | Very low | 111 Ų | 111 | 138.4 Ų | 138.4 | 78% | 0.776 | 83% | 0.828 | S | S | * | * | trans | -144.9 | 95.5 | 164.6 | -161 | 0 | 0 | 0 | 0 | 111.3 | P215 | P215-S217 PolarHBondContact O-N 3.43Š| ||
| 218 | A | 46.2 | Very low | 47.2 | Very low | 92 Ų | 92 | 140.4 Ų | 140.4 | 76% | 0.76 | 83% | 0.825 | S | S | * | * | trans | 37.7 | 106.8 | 131.7 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 219 | K | 49 | Very low | 47.1 | Very low | 211 Ų | 211 | 134.4 Ų | 134.4 | 92% | 0.917 | 82% | 0.821 | S | S | * | * | trans | -149.7 | 114.7 | 131.2 | -76.2 | -175.2 | 179.7 | 175 | 0 | 104.6 | ||||
| 220 | G | 42.7 | Very low | 46.8 | Very low | 73 Ų | 73 | 131.7 Ų | 131.7 | 75% | 0.753 | 82% | 0.821 | S | S | * | * | 95.8 | 133 | 53.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 221 | P | 43.3 | Very low | 46.7 | Very low | 118 Ų | 118 | 133 Ų | 133 | 77% | 0.766 | 83% | 0.827 | S | S | * | * | trans | -111.8 | -164.4 | -131.6 | 35.5 | -21.3 | 0 | 0 | 0 | 115.1 | ||||
| 222 | L | 44.9 | Very low | 46.3 | Very low | 174 Ų | 174 | 134.4 Ų | 134.4 | 91% | 0.911 | 84% | 0.837 | S | S | * | * | trans | 87.7 | 132 | 178.2 | -65.2 | 104.1 | 0 | 0 | 0 | 114.4 | ||||
| 223 | G | 42.7 | Very low | 46.1 | Very low | 65 Ų | 65 | 135.9 Ų | 135.9 | 67% | 0.67 | 85% | 0.848 | S | S | * | * | cis | 162.1 | 147.4 | 7.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 224 | V | 43 | Very low | 45.9 | Very low | 229 Ų | 229 | 131.6 Ų | 131.6 | 100% | 1.388 | 85% | 0.853 | S | S | * | * | trans | 76 | 0 | -178.6 | -164.9 | 0 | 0 | 0 | 0 | 115.7 |
Retrieved 224 of 224 residues in 182 ms
(Link to these results)