| 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 | 62.6 | Low | 85.6 | Confident | 118 Ų | 118 | 60.1 Ų | 60.1 | 58% | 0.581 | 35% | 0.353 | S | S | * | . | 0 | 144 | 0 | -70.4 | -167.4 | 162.5 | 0 | 0 | 107.9 | S184 C185 P186 | M1-S184 WeakPolarHBondContact CA-O 3.19Å; M1-S184 WeakPolarHBondContact CB-O 3.07Å; M1-C185 HydrophobicContact CE-CB 4.43Å; M1-P186 HydrophobicContact CG-CG 4.49Å | |||
| 2 | L | 74.8 | Confident | 86.4 | Confident | 63 Ų | 63 | 58.5 Ų | 58.5 | 33% | 0.33 | 35% | 0.352 | S | S | . | . | trans | -61.4 | 158.2 | 178.1 | -91.1 | 80.9 | 0 | 0 | 0 | 111.7 | V6 L183 S184 | L2-V6 HydrophobicContact CB-CB 4.39Å; L2-V6 HydrophobicContact CD2-CB 4.03Å; L2-V6 HydrophobicContact CD2-CG1 3.47Å; L2-V6 VanDerWaalsContact CD2-CG1 3.47Å; L2-V6 HydrophobicContact CD2-CG2 4.42Å; L2-L183 WeakPolarHBondContact CD1-O 3.24Å; L2-S184 PolarHBondContact N-O 3.04Å | ||
| 3 | S | 84.7 | Confident | 87.1 | Confident | 80 Ų | 80 | 56.8 Ų | 56.8 | 56% | 0.559 | 34% | 0.339 | S | S | * | . | trans | -55.8 | 147.2 | 177.2 | 178.3 | 0 | 0 | 0 | 0 | 111.3 | A5 V6 Q7 | S3-A5 PolarHBondContact O-N 3.39Å; S3-V6 PolarHBondContact O-N 2.78Å; S3-Q7 PolarHBondContact O-N 2.91Å | ||
| 4 | A | 83.8 | Confident | 87.7 | Confident | 44 Ų | 44 | 52.7 Ų | 52.7 | 36% | 0.364 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -54.9 | -35.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | V6 Q7 I8 | A4-V6 VanDerWaalsContact C-N 3.34Å; A4-V6 PolarHBondContact O-N 3.42Å; A4-Q7 PolarHBondContact O-N 3.27Å; A4-I8 WeakPolarHBondContact O-CD1 3.16Å; A4-I8 VanDerWaalsContact O-CG1 3.27Å; A4-I8 WeakPolarHBondContact O-CG1 3.32Å; A4-I8 PolarHBondContact O-N 3.34Å |
| 5 | A | 87.6 | Confident | 88.3 | Confident | 65 Ų | 65 | 53.3 Ų | 53.3 | 54% | 0.537 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -59.4 | -42.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S3 I8 L9 | S3-A5 PolarHBondContact O-N 3.39Å; A5-I8 PolarHBondContact O-N 3.07Å; A5-L9 WeakPolarHBondContact O-CB 3.02Å; A5-L9 PolarHBondContact O-N 3.1Å |
| 6 | V | 89.3 | Confident | 88.8 | Confident | 48 Ų | 48 | 56.1 Ų | 56.1 | 29% | 0.291 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -70.9 | -36.1 | 179.7 | -178.1 | 0 | 0 | 0 | 0 | 111.2 | L2 S3 A4 L9 A10 I180 | L2-V6 HydrophobicContact CB-CB 4.39Å; L2-V6 HydrophobicContact CD2-CB 4.03Å; L2-V6 HydrophobicContact CD2-CG1 3.47Å; L2-V6 VanDerWaalsContact CD2-CG1 3.47Å; L2-V6 HydrophobicContact CD2-CG2 4.42Å; S3-V6 PolarHBondContact O-N 2.78Å; A4-V6 VanDerWaalsContact C-N 3.34Å; A4-V6 PolarHBondContact O-N 3.42Å; V6-L9 PolarHBondContact O-N 3.28Å; V6-A10 WeakPolarHBondContact O-CB 3.42Å; V6-A10 PolarHBondContact O-N 3.24Å; V6-I180 HydrophobicContact CG1-CG2 3.45Å; V6-I180 VanDerWaalsContact CG1-CG2 3.45Å |
| 7 | Q | 88.8 | Confident | 89.2 | Confident | 13 Ų | 13 | 52.8 Ų | 52.8 | 6% | 0.061 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.9 | -38.5 | 175.8 | -165.1 | 173.3 | 2.6 | 0 | 0 | 111.8 | S3 A4 F11 G101 L102 | S3-Q7 PolarHBondContact O-N 2.91Å; A4-Q7 PolarHBondContact O-N 3.27Å; Q7-F11 PolarHBondContact O-N 3.39Å; Q7-F11 VanDerWaalsContact O-N 3.08Å; Q7-G101 PolarHBondContact NE2-O 3.44Å; Q7-L102 HydrophobicContact CG-CD2 4.41Å; Q7-L102 HydrophobicContact CG-CG 4.44Å |
| 8 | I | 91 | Very high | 89.6 | Confident | 85 Ų | 85 | 50.8 Ų | 50.8 | 44% | 0.436 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -67.5 | -43.8 | 174.5 | -66.1 | 162.7 | 0 | 0 | 0 | 110.6 | A4 A5 A10 F11 A12 L102 | A4-I8 WeakPolarHBondContact O-CD1 3.16Å; A4-I8 VanDerWaalsContact O-CG1 3.27Å; A4-I8 WeakPolarHBondContact O-CG1 3.32Å; A4-I8 PolarHBondContact O-N 3.34Å; A5-I8 PolarHBondContact O-N 3.07Å; I8-A10 VanDerWaalsContact C-N 3.34Å; I8-A10 PolarHBondContact O-N 3.22Å; I8-F11 PolarHBondContact O-N 3.09Å; I8-A12 PolarHBondContact O-N 2.72Å; I8-L102 HydrophobicContact CG1-CD2 4.38Å |
| 9 | L | 93.3 | Very high | 89.9 | Confident | 100 Ų | 100 | 53.8 Ų | 53.8 | 52% | 0.524 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.7 | -44.3 | 175.8 | -179 | 64.8 | 0 | 0 | 0 | 111.6 | A5 V6 F11 A12 L13 | A5-L9 WeakPolarHBondContact O-CB 3.02Å; A5-L9 PolarHBondContact O-N 3.1Å; V6-L9 PolarHBondContact O-N 3.28Å; L9-F11 VanDerWaalsContact C-N 3.32Å; L9-F11 PolarHBondContact O-N 3.24Å; L9-A12 PolarHBondContact O-N 3.12Å; L9-L13 HydrophobicContact CG-CD1 4.21Å; L9-L13 WeakPolarHBondContact O-CG 3.44Å; L9-L13 PolarHBondContact O-N 3.31Å |
| 10 | A | 92.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.6 | -41.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | V6 I8 L13 A14 I180 F181 | V6-A10 WeakPolarHBondContact O-CB 3.42Å; V6-A10 PolarHBondContact O-N 3.24Å; I8-A10 VanDerWaalsContact C-N 3.34Å; I8-A10 PolarHBondContact O-N 3.22Å; A10-L13 PolarHBondContact O-N 3.07Å; A10-A14 WeakPolarHBondContact O-CB 3.42Å; A10-A14 PolarHBondContact O-N 3.35Å; A10-I180 HydrophobicContact CB-CB 3.88Å; A10-I180 HydrophobicContact CB-CG2 3.62Å; A10-F181 HydrophobicContact CB-CD2 4Å; A10-F181 HydrophobicContact CB-CE2 4.45Å |
| 11 | F | 93.3 | Very high | 90.3 | Very high | 45 Ų | 45 | 49.4 Ų | 49.4 | 20% | 0.197 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.4 | -40.5 | 175.8 | -175 | -105.4 | 0 | 0 | 0 | 112.2 | Q7 I8 L9 A14 L15 L95 L102 F181 | Q7-F11 PolarHBondContact O-N 3.39Å; Q7-F11 VanDerWaalsContact O-N 3.08Å; I8-F11 PolarHBondContact O-N 3.09Å; L9-F11 VanDerWaalsContact C-N 3.32Å; L9-F11 PolarHBondContact O-N 3.24Å; F11-A14 PolarHBondContact O-N 2.93Å; F11-L15 HydrophobicContact CD1-CD1 3.72Å; F11-L15 HydrophobicContact CD1-CG 4.3Å; F11-L15 HydrophobicContact CE1-CD1 3.41Å; F11-L15 VanDerWaalsContact CE1-CD1 3.41Å; F11-L15 HydrophobicContact CE1-CG 4.01Å; F11-L15 HydrophobicContact CZ-CD1 4.08Å; F11-L15 HydrophobicContact CZ-CD2 4.41Å; F11-L15 HydrophobicContact CZ-CG 4.23Å; F11-L15 WeakPolarHBondContact O-CB 3.43Å; F11-L15 WeakPolarHBondContact O-CG 3.46Å; F11-L15 PolarHBondContact O-N 3.36Å; F11-L95 HydrophobicContact CD2-CD1 4.16Å; F11-L95 HydrophobicContact CE2-CD1 3.48Å; F11-L95 VanDerWaalsContact CE2-CD1 3.48Å; F11-L95 HydrophobicContact CE2-CG 4.37Å; F11-L95 HydrophobicContact CZ-CD1 3.9Å; F11-L102 HydrophobicContact CB-CD1 4.39Å; F11-L102 HydrophobicContact CB-CD2 4.14Å; F11-L102 HydrophobicContact CD1-CD1 4.48Å; F11-L102 HydrophobicContact CD2-CD1 3.66Å; F11-L102 HydrophobicContact CE2-CD1 3.99Å; F11-L102 HydrophobicContact CG-CD1 3.93Å; F11-L102 HydrophobicContact CG-CD2 4.32Å; F11-F181 HydrophobicContact CB-CE2 4.47Å |
| 12 | A | 95.3 | Very high | 91.7 | Very high | 41 Ų | 41 | 46.5 Ų | 46.5 | 34% | 0.339 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64 | -42.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | I8 L9 L15 L16 | I8-A12 PolarHBondContact O-N 2.72Å; L9-A12 PolarHBondContact O-N 3.12Å; A12-L15 WeakPolarHBondContact O-CB 3.49Å; A12-L15 PolarHBondContact O-N 3.43Å; A12-L16 WeakPolarHBondContact O-CG 3.43Å; A12-L16 PolarHBondContact O-N 3.24Å |
| 13 | L | 95.5 | Very high | 92.6 | Very high | 36 Ų | 36 | 46.9 Ų | 46.9 | 19% | 0.188 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.5 | -44.4 | 173.9 | -72.9 | 166 | 0 | 0 | 0 | 111.5 | L9 A10 L15 L16 G17 F173 I180 | L9-L13 HydrophobicContact CG-CD1 4.21Å; L9-L13 WeakPolarHBondContact O-CG 3.44Å; L9-L13 PolarHBondContact O-N 3.31Å; A10-L13 PolarHBondContact O-N 3.07Å; L13-L15 PolarHBondContact O-N 2.94Å; L13-L16 PolarHBondContact O-N 3.07Å; L13-G17 PolarHBondContact O-N 2.94Å; L13-F173 HydrophobicContact CD2-CD1 4Å; L13-F173 HydrophobicContact CD2-CE1 4.46Å; L13-I180 HydrophobicContact CD1-CD1 4.15Å |
| 14 | A | 95.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | A10 F11 G17 V18 F125 | A10-A14 WeakPolarHBondContact O-CB 3.42Å; A10-A14 PolarHBondContact O-N 3.35Å; F11-A14 PolarHBondContact O-N 2.93Å; A14-G17 PolarHBondContact O-N 3.34Å; A14-V18 VanDerWaalsContact O-CG2 3.26Å; A14-V18 WeakPolarHBondContact O-CG2 3.02Å; A14-V18 PolarHBondContact O-N 3.41Å; A14-F125 HydrophobicContact CB-CD1 4.38Å; A14-F125 HydrophobicContact CB-CD2 4.29Å; A14-F125 HydrophobicContact CB-CE1 3.89Å; A14-F125 HydrophobicContact CB-CE2 3.78Å; A14-F125 HydrophobicContact CB-CZ 3.53Å |
| 15 | L | 96.1 | Very high | 93.1 | Very high | 61 Ų | 61 | 41.5 Ų | 41.5 | 32% | 0.319 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -58.3 | -49.3 | 174.3 | -80.2 | 171 | 0 | 0 | 0 | 112.1 | F11 A12 L13 G17 V18 L19 L95 | F11-L15 HydrophobicContact CD1-CD1 3.72Å; F11-L15 HydrophobicContact CD1-CG 4.3Å; F11-L15 HydrophobicContact CE1-CD1 3.41Å; F11-L15 VanDerWaalsContact CE1-CD1 3.41Å; F11-L15 HydrophobicContact CE1-CG 4.01Å; F11-L15 HydrophobicContact CZ-CD1 4.08Å; F11-L15 HydrophobicContact CZ-CD2 4.41Å; F11-L15 HydrophobicContact CZ-CG 4.23Å; F11-L15 WeakPolarHBondContact O-CB 3.43Å; F11-L15 WeakPolarHBondContact O-CG 3.46Å; F11-L15 PolarHBondContact O-N 3.36Å; A12-L15 WeakPolarHBondContact O-CB 3.49Å; A12-L15 PolarHBondContact O-N 3.43Å; L13-L15 PolarHBondContact O-N 2.94Å; L15-G17 VanDerWaalsContact C-N 3.29Å; L15-G17 PolarHBondContact O-N 3.39Å; L15-V18 PolarHBondContact O-N 3.37Å; L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 VanDerWaalsContact O-CG 3.31Å; L15-L19 WeakPolarHBondContact O-CG 3.45Å; L15-L19 PolarHBondContact O-N 3.36Å; L15-L95 HydrophobicContact CD2-CD1 3.52Å; L15-L95 HydrophobicContact CD2-CD2 3.63Å; L15-L95 HydrophobicContact CD2-CG 4.16Å; L15-L95 HydrophobicContact CG-CD1 3.85Å |
| 16 | L | 96.6 | Very high | 93.1 | Very high | 98 Ų | 98 | 44.5 Ų | 44.5 | 51% | 0.513 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.6 | -38.9 | 177.1 | -70.7 | 172.5 | 0 | 0 | 0 | 111.7 | A12 L13 G20 F173 | A12-L16 WeakPolarHBondContact O-CG 3.43Å; A12-L16 PolarHBondContact O-N 3.24Å; L13-L16 PolarHBondContact O-N 3.07Å; L16-G20 PolarHBondContact O-N 2.86Å; L16-F173 HydrophobicContact CB-CD2 4.22Å |
| 17 | G | 96.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.4 | -46.2 | 175 | 0 | 0 | 0 | 0 | 0 | 113.2 | L13 A14 L15 G20 A21 | L13-G17 PolarHBondContact O-N 2.94Å; A14-G17 PolarHBondContact O-N 3.34Å; L15-G17 VanDerWaalsContact C-N 3.29Å; L15-G17 PolarHBondContact O-N 3.39Å; G17-G20 PolarHBondContact O-N 3.07Å; G17-A21 WeakPolarHBondContact O-CB 3.42Å; G17-A21 PolarHBondContact O-N 3.48Å |
| 18 | V | 96 | Very high | 92.4 | Very high | 17 Ų | 17 | 46.5 Ų | 46.5 | 10% | 0.103 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.3 | -45.9 | 176.7 | 174.4 | 0 | 0 | 0 | 0 | 110.9 | A14 L15 A21 T22 A91 F125 L174 | A14-V18 VanDerWaalsContact O-CG2 3.26Å; A14-V18 WeakPolarHBondContact O-CG2 3.02Å; A14-V18 PolarHBondContact O-N 3.41Å; L15-V18 PolarHBondContact O-N 3.37Å; V18-A21 PolarHBondContact O-N 3Å; V18-T22 WeakPolarHBondContact O-CB 3.43Å; V18-T22 PolarHBondContact O-N 3.35Å; V18-T22 PolarHBondContact O-OG1 2.98Å; V18-A91 HydrophobicContact CG2-CB 3.86Å; V18-F125 HydrophobicContact CG2-CE1 4.34Å; V18-L174 HydrophobicContact CG2-CD2 3.99Å |
| 19 | L | 95.6 | Very high | 91.9 | Very high | 108 Ų | 108 | 44.7 Ų | 44.7 | 57% | 0.565 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -62.1 | -45.7 | 177.4 | -70.2 | 173.4 | 0 | 0 | 0 | 110.9 | L15 A21 T22 V23 | L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 VanDerWaalsContact O-CG 3.31Å; L15-L19 WeakPolarHBondContact O-CG 3.45Å; L15-L19 PolarHBondContact O-N 3.36Å; L19-A21 PolarHBondContact O-N 2.92Å; L19-T22 PolarHBondContact O-N 3.49Å; L19-V23 WeakPolarHBondContact O-CB 3.5Å; L19-V23 VanDerWaalsContact O-CG2 3.24Å; L19-V23 WeakPolarHBondContact O-CG2 2.8Å; L19-V23 PolarHBondContact O-N 3.03Å |
| 20 | G | 94 | Very high | 91.3 | Very high | 15 Ų | 15 | 40 Ų | 40 | 16% | 0.155 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -59.8 | -44.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | L16 G17 V23 A24 | L16-G20 PolarHBondContact O-N 2.86Å; G17-G20 PolarHBondContact O-N 3.07Å; G20-V23 PolarHBondContact O-N 3.21Å; G20-A24 VanDerWaalsContact O-CB 3.3Å; G20-A24 WeakPolarHBondContact O-CB 3.3Å; G20-A24 PolarHBondContact O-N 2.78Å |
| 21 | A | 93.4 | Very high | 90.4 | Very high | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.008 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -64.8 | -39.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | G17 V18 L19 T25 A170 | G17-A21 WeakPolarHBondContact O-CB 3.42Å; G17-A21 PolarHBondContact O-N 3.48Å; V18-A21 PolarHBondContact O-N 3Å; L19-A21 PolarHBondContact O-N 2.92Å; A21-T25 WeakPolarHBondContact O-CB 3.49Å; A21-T25 PolarHBondContact O-N 3.43Å; A21-T25 PolarHBondContact O-OG1 3.48Å; A21-A170 HydrophobicContact CB-CB 4.43Å |
| 22 | T | 93.5 | Very high | 89.4 | Confident | 56 Ų | 56 | 40.9 Ų | 40.9 | 34% | 0.344 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -65.6 | -47.4 | 176.8 | -53 | 0 | 0 | 0 | 0 | 110.9 | V18 L19 A24 T25 L26 | V18-T22 WeakPolarHBondContact O-CB 3.43Å; V18-T22 PolarHBondContact O-N 3.35Å; V18-T22 PolarHBondContact O-OG1 2.98Å; L19-T22 PolarHBondContact O-N 3.49Å; T22-A24 PolarHBondContact O-N 3.3Å; T22-T25 PolarHBondContact O-N 3.28Å; T22-L26 HydrophobicContact CG2-CD1 4.38Å; T22-L26 WeakPolarHBondContact O-CG 3.42Å; T22-L26 PolarHBondContact O-N 2.95Å; T22-L26 VanDerWaalsContact O-N 3.12Å |
| 23 | V | 92.6 | Very high | 87.9 | Confident | 71 Ų | 71 | 39.2 Ų | 39.2 | 43% | 0.43 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -61.1 | -46 | 177 | 170.3 | 0 | 0 | 0 | 0 | 110.5 | L19 G20 T25 L26 L27 | L19-V23 WeakPolarHBondContact O-CB 3.5Å; L19-V23 VanDerWaalsContact O-CG2 3.24Å; L19-V23 WeakPolarHBondContact O-CG2 2.8Å; L19-V23 PolarHBondContact O-N 3.03Å; G20-V23 PolarHBondContact O-N 3.21Å; V23-T25 VanDerWaalsContact C-N 3.28Å; V23-T25 PolarHBondContact O-N 3.31Å; V23-L26 PolarHBondContact O-N 3.44Å; V23-L27 HydrophobicContact CG1-CD1 3.66Å; V23-L27 WeakPolarHBondContact O-CB 3.33Å; V23-L27 WeakPolarHBondContact O-CD1 3.35Å; V23-L27 PolarHBondContact O-N 2.97Å |
| 24 | A | 90.4 | Very high | 86.1 | Confident | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.9 | -38.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | G20 T22 L26 W30 V166 T167 | G20-A24 VanDerWaalsContact O-CB 3.3Å; G20-A24 WeakPolarHBondContact O-CB 3.3Å; G20-A24 PolarHBondContact O-N 2.78Å; T22-A24 PolarHBondContact O-N 3.3Å; A24-L26 VanDerWaalsContact C-N 3.34Å; A24-L26 PolarHBondContact O-N 3.01Å; A24-W30 HydrophobicContact CB-CZ2 4.45Å; A24-W30 WeakPolarHBondContact O-CZ2 3.27Å; A24-W30 PolarHBondContact O-NE1 3.37Å; A24-V166 HydrophobicContact CB-CG1 4.21Å; A24-T167 HydrophobicContact CB-CG2 3.45Å; A24-T167 VanDerWaalsContact CB-CG2 3.45Å |
| 25 | T | 88.9 | Confident | 84.2 | Confident | 11 Ų | 11 | 44.2 Ų | 44.2 | 7% | 0.067 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.5 | -37.3 | 177.8 | -58.1 | 0 | 0 | 0 | 0 | 111.8 | A21 T22 V23 W51 M84 | A21-T25 WeakPolarHBondContact O-CB 3.49Å; A21-T25 PolarHBondContact O-N 3.43Å; A21-T25 PolarHBondContact O-OG1 3.48Å; T22-T25 PolarHBondContact O-N 3.28Å; V23-T25 VanDerWaalsContact C-N 3.28Å; V23-T25 PolarHBondContact O-N 3.31Å; T25-W51 HydrophobicContact CG2-CZ2 4.46Å; T25-W51 PolarHBondContact O-NE1 2.97Å; T25-W51 VanDerWaalsContact O-NE1 3.12Å; T25-M84 HydrophobicContact CG2-CB 4.29Å |
| 26 | L | 86.8 | Confident | 82 | Confident | 128 Ų | 128 | 44.2 Ų | 44.2 | 67% | 0.67 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -82.9 | -27.2 | -179.5 | -65.3 | 174 | 0 | 0 | 0 | 113.3 | T22 V23 A24 | T22-L26 HydrophobicContact CG2-CD1 4.38Å; T22-L26 WeakPolarHBondContact O-CG 3.42Å; T22-L26 PolarHBondContact O-N 2.95Å; T22-L26 VanDerWaalsContact O-N 3.12Å; V23-L26 PolarHBondContact O-N 3.44Å; A24-L26 VanDerWaalsContact C-N 3.34Å; A24-L26 PolarHBondContact O-N 3.01Å |
| 27 | L | 85.6 | Confident | 79.7 | Confident | 62 Ų | 62 | 47.4 Ų | 47.4 | 33% | 0.325 | 26% | 0.261 | S | S | . | . | trans | -66.2 | 131.8 | -176.5 | -113.1 | 68.3 | 0 | 0 | 0 | 111.5 | V23 N29 W30 A163 | V23-L27 HydrophobicContact CG1-CD1 3.66Å; V23-L27 WeakPolarHBondContact O-CB 3.33Å; V23-L27 WeakPolarHBondContact O-CD1 3.35Å; V23-L27 PolarHBondContact O-N 2.97Å; L27-N29 PolarHBondContact O-N 3.3Å; L27-W30 PolarHBondContact O-NE1 2.86Å; L27-A163 HydrophobicContact CB-CB 4.25Å | ||
| 28 | P | 79 | Confident | 77.5 | Confident | 41 Ų | 41 | 52.4 Ų | 52.4 | 27% | 0.266 | 30% | 0.296 | S | S | . | . | S | Bend | trans | -81.8 | 13 | 174.6 | 33.2 | -34.9 | 0 | 0 | 0 | 113.5 | Q48 G49 | P28-Q48 CarbonylContact O-C 3.34Å; P28-G49 VanDerWaalsContact C-CA 3.44Å; P28-G49 WeakPolarHBondContact O-CA 3.37Å; P28-G49 PolarHBondContact O-N 3.4Å; P28-G49 VanDerWaalsContact O-N 3.12Å |
| 29 | N | 80.6 | Confident | 75.1 | Confident | 47 Ų | 47 | 56.1 Ų | 56.1 | 25% | 0.251 | 32% | 0.323 | S | S | . | . | trans | -105.5 | 52 | -170.7 | -167.8 | 6.1 | 0 | 0 | 0 | 112.8 | L27 V32 G161 G162 A163 | L27-N29 PolarHBondContact O-N 3.3Å; N29-V32 WeakPolarHBondContact OD1-CG2 3.39Å; N29-G161 CarbonylContact O-C 3.17Å; N29-G161 VanDerWaalsContact O-CA 3.31Å; N29-G161 WeakPolarHBondContact O-CA 3.14Å; N29-G162 PolarHBondContact O-N 3.33Å; N29-A163 WeakPolarHBondContact O-CB 3.44Å; N29-A163 PolarHBondContact O-N 3.2Å | ||
| 30 | W | 80.6 | Confident | 73 | Confident | 2 Ų | 2 | 59.5 Ų | 59.5 | 1% | 0.008 | 34% | 0.339 | C | S | . | . | S | Bend | trans | -88.4 | -43 | 179.5 | -77.7 | 72.7 | 0 | 0 | 0 | 112.1 | A24 L27 Q48 M84 F139 G161 A163 L164 T167 | A24-W30 HydrophobicContact CB-CZ2 4.45Å; A24-W30 WeakPolarHBondContact O-CZ2 3.27Å; A24-W30 PolarHBondContact O-NE1 3.37Å; L27-W30 PolarHBondContact O-NE1 2.86Å; W30-Q48 PolarHBondContact N-O 3.36Å; W30-M84 HydrophobicContact CH2-CE 3.52Å; W30-M84 HydrophobicContact CH2-CG 4.26Å; W30-M84 HydrophobicContact CH2-SD 3.92Å; W30-M84 HydrophobicContact CZ2-CE 4.34Å; W30-M84 HydrophobicContact CZ2-CG 4.49Å; W30-M84 HydrophobicContact CZ2-SD 4.17Å; W30-M84 HydrophobicContact CZ3-CE 4.41Å; W30-F139 HydrophobicContact CD2-CE2 4.2Å; W30-F139 HydrophobicContact CD2-CZ 4.44Å; W30-F139 HydrophobicContact CE3-CD1 4.39Å; W30-F139 AromaticContact CE3-CD2 3.4Å; W30-F139 HydrophobicContact CE3-CD2 3.4Å; W30-F139 HydrophobicContact CE3-CE1 4.41Å; W30-F139 AromaticContact CE3-CE2 3.41Å; W30-F139 HydrophobicContact CE3-CE2 3.41Å; W30-F139 VanDerWaalsContact CE3-CE2 3.41Å; W30-F139 AromaticContact CE3-CG 3.93Å; W30-F139 HydrophobicContact CE3-CG 3.93Å; W30-F139 AromaticContact CE3-CZ 3.96Å; W30-F139 HydrophobicContact CE3-CZ 3.96Å; W30-F139 HydrophobicContact CH2-CD2 4.47Å; W30-F139 HydrophobicContact CH2-CE2 4.37Å; W30-F139 AromaticContact CZ3-CD2 3.36Å; W30-F139 HydrophobicContact CZ3-CD2 3.36Å; W30-F139 AromaticContact CZ3-CE2 3.53Å; W30-F139 HydrophobicContact CZ3-CE2 3.53Å; W30-F139 HydrophobicContact CZ3-CG 4.22Å; W30-F139 HydrophobicContact CZ3-CZ 4.49Å; W30-G161 WeakPolarHBondContact O-CA 3.49Å; W30-G161 PolarHBondContact O-N 3.46Å; W30-A163 HydrophobicContact CD2-CB 4.22Å; W30-A163 HydrophobicContact CG-CB 4.04Å; W30-L164 HydrophobicContact CE3-CD2 3.77Å; W30-L164 HydrophobicContact CE3-CG 4.3Å; W30-L164 HydrophobicContact CZ3-CD2 3.83Å; W30-T167 HydrophobicContact CH2-CG2 3.42Å; W30-T167 VanDerWaalsContact CH2-CG2 3.42Å; W30-T167 HydrophobicContact CZ2-CG2 3.83Å; W30-T167 HydrophobicContact CZ3-CG2 4.1Å |
| 31 | K | 72.9 | Confident | 71 | Confident | 43 Ų | 43 | 67 Ų | 67 | 19% | 0.187 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.3 | 124.9 | 175.6 | -174.4 | -179.4 | 171.3 | 82.2 | 0 | 108.5 | Q48 Y158 | K31-Q48 HydrophobicContact CB-CB 4.1Å; K31-Q48 PolarHBondContact N-O 3.32Å; K31-Q48 PolarHBondContact O-N 3.23Å; K31-Y158 VanDerWaalsContact NZ-CD1 3.33Å |
| 32 | V | 73.3 | Confident | 69.2 | Low | 20 Ų | 20 | 71.4 Ų | 71.4 | 12% | 0.121 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 118.4 | 170.4 | -174.3 | 0 | 0 | 0 | 0 | 107.4 | N29 M47 Q159 | N29-V32 WeakPolarHBondContact OD1-CG2 3.39Å; V32-M47 HydrophobicContact CG1-CE 4.01Å; V32-M47 HydrophobicContact CG1-SD 4.45Å; V32-M47 HydrophobicContact CG2-CE 4.08Å; V32-M47 HydrophobicContact CG2-SD 3.7Å; V32-Q159 PolarHBondContact N-O 3.4Å; V32-Q159 PolarHBondContact O-N 3.12Å |
| 33 | S | 64.1 | Low | 67.3 | Low | 7 Ų | 7 | 70.6 Ų | 70.6 | 5% | 0.049 | 40% | 0.395 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 124.2 | 169.8 | 63.2 | 0 | 0 | 0 | 0 | 109 | N35 Q46 | S33-N35 WeakPolarHBondContact CB-OD1 3.25Å; S33-N35 PolarHBondContact O-N 2.95Å; S33-N35 PolarHBondContact O-OD1 3.16Å; S33-N35 PolarHBondContact OG-OD1 2.92Å; S33-Q46 PolarHBondContact N-O 3.09Å; S33-Q46 PolarHBondContact O-N 3.04Å |
| 34 | V | 55.9 | Low | 66.1 | Low | 62 Ų | 62 | 71.3 Ų | 71.3 | 38% | 0.376 | 40% | 0.395 | S | S | . | . | trans | -94.3 | 87 | 170.9 | -176 | 0 | 0 | 0 | 0 | 105.7 | A36 | V34-A36 PolarHBondContact O-N 3.37Š| ||
| 35 | N | 56 | Low | 65.1 | Low | 78 Ų | 78 | 72.5 Ų | 72.5 | 42% | 0.417 | 40% | 0.404 | S | S | . | . | trans | -73.7 | 92 | -178.3 | -59.5 | 29.8 | 0 | 0 | 0 | 108.4 | S33 W37 | S33-N35 WeakPolarHBondContact CB-OD1 3.25Å; S33-N35 PolarHBondContact O-N 2.95Å; S33-N35 PolarHBondContact O-OD1 3.16Å; S33-N35 PolarHBondContact OG-OD1 2.92Å; N35-W37 PolarHBondContact O-N 2.9Å | ||
| 36 | A | 51.3 | Low | 64.4 | Low | 62 Ų | 62 | 74.6 Ų | 74.6 | 51% | 0.512 | 41% | 0.413 | S | S | . | . | trans | -96.5 | 60.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | V34 | V34-A36 PolarHBondContact O-N 3.37Š| ||
| 37 | W | 47.3 | Very low | 64.1 | Low | 165 Ų | 165 | 71.2 Ų | 71.2 | 63% | 0.625 | 39% | 0.394 | S | S | * | . | trans | -144.8 | 113.9 | 169.7 | -76.8 | 97.4 | 0 | 0 | 0 | 115.4 | N35 S39 P153 S155 | N35-W37 PolarHBondContact O-N 2.9Å; W37-S39 PolarHBondContact O-N 2.78Å; W37-P153 HydrophobicContact CZ2-CB 4.37Å; W37-P153 HydrophobicContact CZ2-CG 3.97Å; W37-S155 VanDerWaalsContact CE2-CB 3.48Å; W37-S155 WeakPolarHBondContact CZ2-OG 3.3Å; W37-S155 PolarHBondContact NE1-OG 2.83Å | ||
| 38 | S | 48.9 | Very low | 63.8 | Low | 105 Ų | 105 | 72.2 Ų | 72.2 | 73% | 0.734 | 40% | 0.397 | S | S | * | . | trans | 51 | 45.6 | 132 | 69 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 39 | S | 46.6 | Very low | 63.8 | Low | 95 Ų | 95 | 70.9 Ų | 70.9 | 66% | 0.664 | 39% | 0.391 | S | S | * | . | trans | -138.7 | 137.8 | 155.5 | -73.7 | 0 | 0 | 0 | 0 | 110.3 | W37 M41 | W37-S39 PolarHBondContact O-N 2.78Å; S39-M41 PolarHBondContact O-N 3.23Å | ||
| 40 | I | 52.3 | Low | 63.7 | Low | 178 Ų | 178 | 68.7 Ų | 68.7 | 91% | 0.913 | 38% | 0.379 | S | S | * | . | S | Bend | trans | -63.4 | 2.9 | -159.7 | -89.8 | 152.2 | 0 | 0 | 0 | 116.2 | ||
| 41 | M | 50.7 | Low | 63.8 | Low | 174 Ų | 174 | 73.5 Ų | 73.5 | 86% | 0.857 | 40% | 0.397 | S | S | * | . | S | Bend | trans | -135 | 103 | 173.1 | -105.9 | 133.9 | 78.2 | 0 | 0 | 110.1 | S39 P43 | S39-M41 PolarHBondContact O-N 3.23Å; M41-P43 WeakPolarHBondContact O-CD 3.5Å |
| 42 | T | 55 | Low | 64.2 | Low | 93 Ų | 93 | 72.2 Ų | 72.2 | 57% | 0.571 | 40% | 0.395 | S | S | * | . | trans | -96.8 | 116.2 | -154.7 | 41.4 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 43 | P | 55.4 | Low | 64.7 | Low | 38 Ų | 38 | 73.1 Ų | 73.1 | 25% | 0.247 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.9 | 132.8 | 158.4 | 30.5 | -31.1 | 0 | 0 | 0 | 110.1 | M41 Q46 V55 | M41-P43 WeakPolarHBondContact O-CD 3.5Å; P43-Q46 HydrophobicContact CB-CG 4.26Å; P43-V55 HydrophobicContact CB-CG1 3.59Å |
| 44 | I | 65.6 | Low | 65.6 | Low | 86 Ų | 86 | 72.9 Ų | 72.9 | 44% | 0.441 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.1 | -36.9 | -179.3 | -64.3 | 178 | 0 | 0 | 0 | 111 | W56 S58 | I44-W56 PolarHBondContact N-O 3.42Å; I44-S58 VanDerWaalsContact CD1-CB 3.43Å |
| 45 | S | 70.8 | Confident | 66.9 | Low | 26 Ų | 26 | 70.8 Ų | 70.8 | 18% | 0.182 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.5 | 133.5 | 179.5 | 55.3 | 0 | 0 | 0 | 0 | 110.4 | W56 | S45-W56 PolarHBondContact O-N 3.36Å; S45-W56 WeakPolarHBondContact OG-CB 3.21Å |
| 46 | Q | 74.4 | Confident | 68.1 | Low | 55 Ų | 55 | 72.6 Ų | 72.6 | 26% | 0.257 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.9 | 125.6 | 173.2 | -61.3 | -137.9 | -37 | 0 | 0 | 109.2 | S33 P43 V55 | S33-Q46 PolarHBondContact N-O 3.09Å; S33-Q46 PolarHBondContact O-N 3.04Å; P43-Q46 HydrophobicContact CB-CG 4.26Å; Q46-V55 HydrophobicContact CG-CG1 4.24Å; Q46-V55 HydrophobicContact CG-CG2 4.3Å |
| 47 | M | 79.8 | Confident | 69.5 | Low | 56 Ų | 56 | 74 Ų | 74 | 28% | 0.276 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 104.6 | -180 | -61.7 | -95.1 | 166.1 | 0 | 0 | 107 | V32 C54 | V32-M47 HydrophobicContact CG1-CE 4.01Å; V32-M47 HydrophobicContact CG1-SD 4.45Å; V32-M47 HydrophobicContact CG2-CE 4.08Å; V32-M47 HydrophobicContact CG2-SD 3.7Å; M47-C54 HydrophobicContact CB-CB 4.32Å; M47-C54 PolarHBondContact N-O 3.2Å; M47-C54 PolarHBondContact O-N 3.04Å |
| 48 | Q | 78.7 | Confident | 70.9 | Confident | 84 Ų | 84 | 70.2 Ų | 70.2 | 39% | 0.393 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 113.4 | 177.4 | -119.7 | 160 | 13.3 | 0 | 0 | 109.5 | P28 W30 K31 D53 | P28-Q48 CarbonylContact O-C 3.34Å; W30-Q48 PolarHBondContact N-O 3.36Å; K31-Q48 HydrophobicContact CB-CB 4.1Å; K31-Q48 PolarHBondContact N-O 3.32Å; K31-Q48 PolarHBondContact O-N 3.23Å; Q48-D53 WeakPolarHBondContact CA-OD1 3.44Å; Q48-D53 WeakPolarHBondContact CG-OD1 3.49Å |
| 49 | G | 79.6 | Confident | 72.3 | Confident | 12 Ų | 12 | 69.6 Ų | 69.6 | 12% | 0.124 | 37% | 0.373 | C | S | . | . | trans | -98.4 | 175.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | P28 A52 D53 K67 | P28-G49 VanDerWaalsContact C-CA 3.44Å; P28-G49 WeakPolarHBondContact O-CA 3.37Å; P28-G49 PolarHBondContact O-N 3.4Å; P28-G49 VanDerWaalsContact O-N 3.12Å; G49-A52 WeakPolarHBondContact CA-O 3.38Å; G49-A52 PolarHBondContact N-O 3.08Å; G49-A52 VanDerWaalsContact N-O 3.14Å; G49-D53 PolarHBondContact N-OD1 3.21Å; G49-K67 PolarHBondContact O-NZ 3.28Å | ||
| 50 | L | 78.3 | Confident | 73.8 | Confident | 2 Ų | 2 | 67.4 Ų | 67.4 | 1% | 0.01 | 37% | 0.365 | C | S | . | . | S | Bend | trans | -73.2 | -40 | 173.2 | -159 | 66.9 | 0 | 0 | 0 | 111.3 | M80 R81 M84 F139 | L50-M80 HydrophobicContact CD1-CB 4.44Å; L50-R81 HydrophobicContact CD1-CG 3.93Å; L50-R81 HydrophobicContact CD2-CG 4.22Å; L50-R81 HydrophobicContact CG-CG 3.7Å; L50-R81 PolarHBondContact O-NE 3.26Å; L50-R81 PolarHBondContact O-NH2 2.76Å; L50-M84 HydrophobicContact CD2-CB 4Å; L50-M84 HydrophobicContact CD2-CG 4.02Å; L50-F139 HydrophobicContact CD1-CE2 3.87Å; L50-F139 HydrophobicContact CD1-CZ 3.65Å |
| 51 | W | 82.4 | Confident | 75.2 | Confident | 103 Ų | 103 | 62.8 Ų | 62.8 | 39% | 0.39 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -112.1 | -33.7 | -174 | -58.5 | 88.8 | 0 | 0 | 0 | 115.1 | T25 K67 V85 | T25-W51 HydrophobicContact CG2-CZ2 4.46Å; T25-W51 PolarHBondContact O-NE1 2.97Å; T25-W51 VanDerWaalsContact O-NE1 3.12Å; W51-K67 WeakPolarHBondContact O-CD 3.41Å; W51-K67 PolarHBondContact O-N 3.41Å; W51-V85 HydrophobicContact CH2-CG2 3.83Å; W51-V85 HydrophobicContact CZ2-CG2 3.55Å |
| 52 | A | 82 | Confident | 76.8 | Confident | 16 Ų | 16 | 59.8 Ų | 59.8 | 13% | 0.132 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.6 | 144.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | G49 M66 K67 | G49-A52 WeakPolarHBondContact CA-O 3.38Å; G49-A52 PolarHBondContact N-O 3.08Å; G49-A52 VanDerWaalsContact N-O 3.14Å; A52-M66 HydrophobicContact CB-SD 3.74Å; A52-K67 PolarHBondContact O-NZ 3.47Å |
| 53 | D | 82.8 | Confident | 78.2 | Confident | 38 Ų | 38 | 57.9 Ų | 57.9 | 20% | 0.203 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101 | 132.1 | 165.1 | -72.2 | -37.7 | 0 | 0 | 0 | 108.1 | Q48 G49 C64 T65 K67 | Q48-D53 WeakPolarHBondContact CA-OD1 3.44Å; Q48-D53 WeakPolarHBondContact CG-OD1 3.49Å; G49-D53 PolarHBondContact N-OD1 3.21Å; D53-C64 CarbonylContact O-C 3.53Å; D53-C64 VanDerWaalsContact O-CA 3.3Å; D53-C64 WeakPolarHBondContact O-CA 3.31Å; D53-T65 PolarHBondContact N-O 3.37Å; D53-T65 PolarHBondContact O-N 3.17Å; D53-T65 PolarHBondContact O-OG1 2.84Å; D53-K67 VanDerWaalsContact OD1-CE 3.23Å; D53-K67 WeakPolarHBondContact OD1-CE 3.45Å; D53-K67 IonicContact OD1-NZ 2.6Å; D53-K67 PolarHBondContact OD1-NZ 2.93Å; D53-K67 WeakPolarHBondContact OD2-CE 3.16Å; D53-K67 IonicContact OD2-NZ 3.36Å; D53-K67 PolarHBondContact OD2-NZ 3.4Å |
| 54 | C | 84.3 | Confident | 79.7 | Confident | 3 Ų | 3 | 59 Ų | 59 | 2% | 0.02 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.5 | 137.4 | -179.2 | -61.8 | 0 | 0 | 0 | 0 | 110.2 | M47 F62 S63 C64 | M47-C54 HydrophobicContact CB-CB 4.32Å; M47-C54 PolarHBondContact N-O 3.2Å; M47-C54 PolarHBondContact O-N 3.04Å; C54-F62 HydrophobicContact CB-CE2 3.65Å; C54-F62 HydrophobicContact CB-CZ 3.59Å; C54-S63 WeakPolarHBondContact CA-O 3.48Å; C54-C64 HydrophobicContact CB-CB 4.2Å; C54-C64 WeakPolarHBondContact CB-SG 3.44Å; C54-C64 WeakPolarHBondContact SG-CB 3.39Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.46Å |
| 55 | V | 82.7 | Confident | 80.6 | Confident | 18 Ų | 18 | 58.8 Ų | 58.8 | 11% | 0.109 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.6 | 129.9 | -178.4 | -175.9 | 0 | 0 | 0 | 0 | 108.5 | P43 Q46 Y57 S63 | P43-V55 HydrophobicContact CB-CG1 3.59Å; Q46-V55 HydrophobicContact CG-CG1 4.24Å; Q46-V55 HydrophobicContact CG-CG2 4.3Å; V55-Y57 HydrophobicContact CB-CE2 4.16Å; V55-Y57 HydrophobicContact CG1-CD2 4.32Å; V55-Y57 HydrophobicContact CG1-CE1 4.23Å; V55-Y57 HydrophobicContact CG1-CE2 3.88Å; V55-S63 PolarHBondContact N-O 3.44Å; V55-S63 PolarHBondContact O-N 2.92Å; V55-S63 VanDerWaalsContact O-N 3.17Å |
| 56 | W | 80.8 | Confident | 81.2 | Confident | 116 Ų | 116 | 63.6 Ų | 63.6 | 44% | 0.439 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.5 | 117.5 | 173.5 | -167.4 | -84.7 | 0 | 0 | 0 | 110.1 | I44 S45 F62 | I44-W56 PolarHBondContact N-O 3.42Å; S45-W56 PolarHBondContact O-N 3.36Å; S45-W56 WeakPolarHBondContact OG-CB 3.21Å; W56-F62 HydrophobicContact CD2-CD2 4.38Å; W56-F62 HydrophobicContact CE3-CB 3.85Å; W56-F62 AromaticContact CE3-CD2 3.34Å; W56-F62 HydrophobicContact CE3-CD2 3.34Å; W56-F62 HydrophobicContact CE3-CE2 4.1Å; W56-F62 AromaticContact CE3-CG 3.88Å; W56-F62 HydrophobicContact CE3-CG 3.88Å; W56-F62 HydrophobicContact CH2-CB 4.48Å; W56-F62 HydrophobicContact CZ3-CB 3.66Å; W56-F62 AromaticContact CZ3-CD2 3.82Å; W56-F62 HydrophobicContact CZ3-CD2 3.82Å; W56-F62 AromaticContact CZ3-CG 3.9Å; W56-F62 HydrophobicContact CZ3-CG 3.9Å |
| 57 | Y | 81.3 | Confident | 81.2 | Confident | 91 Ų | 91 | 62.7 Ų | 62.7 | 36% | 0.357 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.9 | 150.8 | 177.6 | -66.7 | -83.2 | 0 | 0 | 0 | 111.6 | V55 S59 G60 V61 | V55-Y57 HydrophobicContact CB-CE2 4.16Å; V55-Y57 HydrophobicContact CG1-CD2 4.32Å; V55-Y57 HydrophobicContact CG1-CE1 4.23Å; V55-Y57 HydrophobicContact CG1-CE2 3.88Å; Y57-S59 WeakPolarHBondContact CB-OG 3.19Å; Y57-S59 PolarHBondContact O-N 3.06Å; Y57-S59 VanDerWaalsContact O-N 3.13Å; Y57-G60 PolarHBondContact O-N 3.25Å; Y57-G60 VanDerWaalsContact O-N 3.08Å; Y57-V61 PolarHBondContact N-O 3.44Å |
| 58 | S | 76.3 | Confident | 80.4 | Confident | 86 Ų | 86 | 66.7 Ų | 66.7 | 60% | 0.601 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -22.6 | 175 | -166.1 | 0 | 0 | 0 | 0 | 114 | I44 G60 | I44-S58 VanDerWaalsContact CD1-CB 3.43Å; S58-G60 PolarHBondContact O-N 3Å |
| 59 | S | 78.6 | Confident | 79.4 | Confident | 92 Ų | 92 | 66.6 Ų | 66.6 | 64% | 0.643 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | 0.8 | 176.6 | 50.9 | 0 | 0 | 0 | 0 | 113.7 | Y57 V61 | Y57-S59 WeakPolarHBondContact CB-OG 3.19Å; Y57-S59 PolarHBondContact O-N 3.06Å; Y57-S59 VanDerWaalsContact O-N 3.13Å; S59-V61 PolarHBondContact O-N 3.43Å |
| 60 | G | 78.9 | Confident | 78.4 | Confident | 49 Ų | 49 | 69.7 Ų | 69.7 | 51% | 0.505 | 39% | 0.392 | S | S | . | . | S | Bend | trans | 78.7 | 5.6 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y57 S58 | Y57-G60 PolarHBondContact O-N 3.25Å; Y57-G60 VanDerWaalsContact O-N 3.08Å; S58-G60 PolarHBondContact O-N 3Å |
| 61 | V | 80.3 | Confident | 77.3 | Confident | 80 Ų | 80 | 78.2 Ų | 78.2 | 49% | 0.485 | 44% | 0.437 | S | S | . | . | trans | -84.2 | 128 | 176.7 | -177.5 | 0 | 0 | 0 | 0 | 109.5 | Y57 S59 | Y57-V61 PolarHBondContact N-O 3.44Å; S59-V61 PolarHBondContact O-N 3.43Å | ||
| 62 | F | 85.3 | Confident | 75.9 | Confident | 112 Ų | 112 | 78.3 Ų | 78.3 | 49% | 0.491 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.6 | 119.8 | 171.8 | -175.2 | -119.8 | 0 | 0 | 0 | 109.4 | C54 W56 C64 | C54-F62 HydrophobicContact CB-CE2 3.65Å; C54-F62 HydrophobicContact CB-CZ 3.59Å; W56-F62 HydrophobicContact CD2-CD2 4.38Å; W56-F62 HydrophobicContact CE3-CB 3.85Å; W56-F62 AromaticContact CE3-CD2 3.34Å; W56-F62 HydrophobicContact CE3-CD2 3.34Å; W56-F62 HydrophobicContact CE3-CE2 4.1Å; W56-F62 AromaticContact CE3-CG 3.88Å; W56-F62 HydrophobicContact CE3-CG 3.88Å; W56-F62 HydrophobicContact CH2-CB 4.48Å; W56-F62 HydrophobicContact CZ3-CB 3.66Å; W56-F62 AromaticContact CZ3-CD2 3.82Å; W56-F62 HydrophobicContact CZ3-CD2 3.82Å; W56-F62 AromaticContact CZ3-CG 3.9Å; W56-F62 HydrophobicContact CZ3-CG 3.9Å; F62-C64 WeakPolarHBondContact CE1-SG 3.44Å; F62-C64 WeakPolarHBondContact CZ-SG 3.26Å |
| 63 | S | 83.8 | Confident | 75.2 | Confident | 52 Ų | 52 | 79.5 Ų | 79.5 | 36% | 0.364 | 46% | 0.457 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 126 | 178.3 | -170.8 | 0 | 0 | 0 | 0 | 109.6 | C54 V55 | C54-S63 WeakPolarHBondContact CA-O 3.48Å; V55-S63 PolarHBondContact N-O 3.44Å; V55-S63 PolarHBondContact O-N 2.92Å; V55-S63 VanDerWaalsContact O-N 3.17Å |
| 64 | C | 87.4 | Confident | 74.8 | Confident | 62 Ų | 62 | 80.7 Ų | 80.7 | 42% | 0.419 | 47% | 0.467 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 125.2 | 173 | -69.5 | 0 | 0 | 0 | 0 | 109.6 | D53 C54 F62 | D53-C64 CarbonylContact O-C 3.53Å; D53-C64 VanDerWaalsContact O-CA 3.3Å; D53-C64 WeakPolarHBondContact O-CA 3.31Å; C54-C64 HydrophobicContact CB-CB 4.2Å; C54-C64 WeakPolarHBondContact CB-SG 3.44Å; C54-C64 WeakPolarHBondContact SG-CB 3.39Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.46Å; F62-C64 WeakPolarHBondContact CE1-SG 3.44Å; F62-C64 WeakPolarHBondContact CZ-SG 3.26Å |
| 65 | T | 84.1 | Confident | 74.4 | Confident | 82 Ų | 82 | 85 Ų | 85 | 50% | 0.503 | 50% | 0.496 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.2 | 125.3 | 176.2 | 52.5 | 0 | 0 | 0 | 0 | 109.4 | D53 | D53-T65 PolarHBondContact N-O 3.37Å; D53-T65 PolarHBondContact O-N 3.17Å; D53-T65 PolarHBondContact O-OG1 2.84Å |
| 66 | M | 82.7 | Confident | 74.1 | Confident | 126 Ų | 126 | 85.8 Ų | 85.8 | 62% | 0.621 | 50% | 0.502 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -72.5 | 145.2 | 173.7 | -72.7 | -67 | -163 | 0 | 0 | 110.3 | A52 D68 | A52-M66 HydrophobicContact CB-SD 3.74Å; M66-D68 PolarHBondContact O-N 3.48Å; M66-D68 VanDerWaalsContact O-N 3.15Å |
| 67 | K | 74.7 | Confident | 74 | Confident | 36 Ų | 36 | 82.5 Ų | 82.5 | 16% | 0.157 | 49% | 0.492 | C | S | . | . | trans | -82.9 | 87.1 | 173.1 | -66 | 93 | 153.5 | 167.6 | 0 | 110.1 | G49 W51 A52 D53 | G49-K67 PolarHBondContact O-NZ 3.28Å; W51-K67 WeakPolarHBondContact O-CD 3.41Å; W51-K67 PolarHBondContact O-N 3.41Å; A52-K67 PolarHBondContact O-NZ 3.47Å; D53-K67 VanDerWaalsContact OD1-CE 3.23Å; D53-K67 WeakPolarHBondContact OD1-CE 3.45Å; D53-K67 IonicContact OD1-NZ 2.6Å; D53-K67 PolarHBondContact OD1-NZ 2.93Å; D53-K67 WeakPolarHBondContact OD2-CE 3.16Å; D53-K67 IonicContact OD2-NZ 3.36Å; D53-K67 PolarHBondContact OD2-NZ 3.4Å | ||
| 68 | D | 62.9 | Low | 74.1 | Confident | 140 Ų | 140 | 83 Ų | 83 | 75% | 0.749 | 50% | 0.498 | S | S | * | . | trans | -76.2 | -21.8 | -175.7 | -61.6 | -39.8 | 0 | 0 | 0 | 113.8 | M66 V70 | M66-D68 PolarHBondContact O-N 3.48Å; M66-D68 VanDerWaalsContact O-N 3.15Å; D68-V70 PolarHBondContact O-N 3.49Å | ||
| 69 | S | 59.3 | Low | 74.5 | Confident | 82 Ų | 82 | 84.7 Ų | 84.7 | 57% | 0.573 | 50% | 0.498 | S | S | * | . | trans | -99.6 | 89.9 | -177.4 | -69 | 0 | 0 | 0 | 0 | 112.4 | L71 S72 | S69-L71 PolarHBondContact O-N 3.48Å; S69-S72 PolarHBondContact O-N 2.85Å | ||
| 70 | V | 57.6 | Low | 74.8 | Confident | 77 Ų | 77 | 80.4 Ų | 80.4 | 47% | 0.467 | 47% | 0.468 | S | S | . | . | G | 310 helix | trans | -63.9 | -25.2 | 174.4 | -161.8 | 0 | 0 | 0 | 0 | 111.8 | D68 | D68-V70 PolarHBondContact O-N 3.49Š|
| 71 | L | 56.3 | Low | 75.2 | Confident | 181 Ų | 181 | 79.2 Ų | 79.2 | 95% | 0.948 | 45% | 0.448 | S | S | * | . | G | 310 helix | trans | -80.6 | -15 | -176.2 | -128.5 | 73 | 0 | 0 | 0 | 114.9 | S69 | S69-L71 PolarHBondContact O-N 3.48Š|
| 72 | S | 52.6 | Low | 75.7 | Confident | 106 Ų | 106 | 78.3 Ų | 78.3 | 74% | 0.741 | 45% | 0.449 | S | S | * | . | G | 310 helix | trans | -109.6 | 5.7 | -178.5 | -168.7 | 0 | 0 | 0 | 0 | 113 | S69 | S69-S72 PolarHBondContact O-N 2.85Š|
| 73 | L | 66.3 | Low | 75.9 | Confident | 40 Ų | 40 | 73.7 Ų | 73.7 | 21% | 0.209 | 43% | 0.433 | C | S | . | . | S | Bend | trans | -96.6 | 142 | -174.7 | -154.9 | 70.5 | 0 | 0 | 0 | 110.3 | L77 R81 | L73-L77 HydrophobicContact CD1-CD1 4.19Å; L73-L77 HydrophobicContact CD2-CB 4.02Å; L73-L77 HydrophobicContact CD2-CD1 4.14Å; L73-L77 HydrophobicContact CG-CB 4.29Å; L73-L77 HydrophobicContact CG-CD1 3.98Å; L73-R81 VanDerWaalsContact CD2-NH1 3.35Å; L73-R81 VanDerWaalsContact CD2-NH2 3.32Å |
| 74 | P | 73.9 | Confident | 76.3 | Confident | 63 Ų | 63 | 71.2 Ų | 71.2 | 41% | 0.409 | 42% | 0.416 | S | S | . | . | trans | -56.9 | 140.3 | -179.4 | 20.2 | -33.9 | 0 | 0 | 0 | 112 | S76 L77 | P74-S76 PolarHBondContact O-N 3.19Å; P74-S76 VanDerWaalsContact O-N 3.13Å; P74-L77 HydrophobicContact CG-CB 4.5Å; P74-L77 HydrophobicContact CG-CD1 3.75Å; P74-L77 HydrophobicContact CG-CG 4.07Å; P74-L77 PolarHBondContact O-N 3.31Å | ||
| 75 | P | 75.9 | Confident | 76.5 | Confident | 95 Ų | 95 | 71 Ų | 71 | 62% | 0.617 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -61.3 | -27.6 | -172.4 | 23 | -33.7 | 0 | 0 | 0 | 113.3 | L77 Q78 M79 | P75-L77 PolarHBondContact O-N 3.01Å; P75-Q78 PolarHBondContact O-N 3.24Å; P75-M79 PolarHBondContact O-N 3.45Å; P75-M79 VanDerWaalsContact O-N 3.15Å |
| 76 | S | 76.4 | Confident | 77 | Confident | 34 Ų | 34 | 71.4 Ų | 71.4 | 24% | 0.238 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -60.2 | -41.6 | 174.9 | 53.9 | 0 | 0 | 0 | 0 | 112.4 | P74 M79 M80 | P74-S76 PolarHBondContact O-N 3.19Å; P74-S76 VanDerWaalsContact O-N 3.13Å; S76-M79 PolarHBondContact O-N 2.88Å; S76-M80 VanDerWaalsContact C-CE 3.49Å; S76-M80 VanDerWaalsContact O-CE 3.23Å; S76-M80 WeakPolarHBondContact O-CE 3.49Å; S76-M80 WeakPolarHBondContact O-CG 3.31Å; S76-M80 PolarHBondContact O-N 3.35Å; S76-M80 VanDerWaalsContact O-N 3.16Å |
| 77 | L | 79.3 | Confident | 77.6 | Confident | 46 Ų | 46 | 65.4 Ų | 65.4 | 24% | 0.241 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -69.1 | -34.5 | 177.8 | -72.5 | 179.5 | 0 | 0 | 0 | 112.4 | L73 P74 P75 M80 R81 F139 | L73-L77 HydrophobicContact CD1-CD1 4.19Å; L73-L77 HydrophobicContact CD2-CB 4.02Å; L73-L77 HydrophobicContact CD2-CD1 4.14Å; L73-L77 HydrophobicContact CG-CB 4.29Å; L73-L77 HydrophobicContact CG-CD1 3.98Å; P74-L77 HydrophobicContact CG-CB 4.5Å; P74-L77 HydrophobicContact CG-CD1 3.75Å; P74-L77 HydrophobicContact CG-CG 4.07Å; P74-L77 PolarHBondContact O-N 3.31Å; P75-L77 PolarHBondContact O-N 3.01Å; L77-M80 HydrophobicContact CD2-CE 4.04Å; L77-M80 PolarHBondContact O-N 2.89Å; L77-R81 WeakPolarHBondContact O-CG 3.49Å; L77-R81 PolarHBondContact O-N 3.01Å; L77-F139 HydrophobicContact CD2-CE1 4.03Å; L77-F139 HydrophobicContact CD2-CZ 4.02Å |
| 78 | Q | 83.8 | Confident | 78.6 | Confident | 102 Ų | 102 | 64.7 Ų | 64.7 | 48% | 0.477 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -66 | -42.2 | 177.6 | -169.4 | 175.6 | 0.5 | 0 | 0 | 111.4 | P75 M80 R81 A82 | P75-Q78 PolarHBondContact O-N 3.24Å; Q78-M80 VanDerWaalsContact C-N 3.33Å; Q78-M80 PolarHBondContact O-N 3.36Å; Q78-R81 PolarHBondContact O-N 3.5Å; Q78-A82 WeakPolarHBondContact O-CB 3.49Å; Q78-A82 PolarHBondContact O-N 2.97Å |
| 79 | M | 84.3 | Confident | 80.1 | Confident | 121 Ų | 121 | 63.6 Ų | 63.6 | 60% | 0.596 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -62 | -40.9 | 174.1 | -69.9 | -172.8 | -74.7 | 0 | 0 | 111.8 | P75 S76 A82 G83 | P75-M79 PolarHBondContact O-N 3.45Å; P75-M79 VanDerWaalsContact O-N 3.15Å; S76-M79 PolarHBondContact O-N 2.88Å; M79-A82 PolarHBondContact O-N 2.95Å; M79-G83 PolarHBondContact O-N 3.26Å |
| 80 | M | 85 | Confident | 81.9 | Confident | 3 Ų | 3 | 61 Ų | 61 | 2% | 0.015 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -66.2 | -41.7 | 178.1 | -68.6 | -176.5 | -104.8 | 0 | 0 | 112.6 | L50 S76 L77 Q78 G83 M84 P135 L138 F139 | L50-M80 HydrophobicContact CD1-CB 4.44Å; S76-M80 VanDerWaalsContact C-CE 3.49Å; S76-M80 VanDerWaalsContact O-CE 3.23Å; S76-M80 WeakPolarHBondContact O-CE 3.49Å; S76-M80 WeakPolarHBondContact O-CG 3.31Å; S76-M80 PolarHBondContact O-N 3.35Å; S76-M80 VanDerWaalsContact O-N 3.16Å; L77-M80 HydrophobicContact CD2-CE 4.04Å; L77-M80 PolarHBondContact O-N 2.89Å; Q78-M80 VanDerWaalsContact C-N 3.33Å; Q78-M80 PolarHBondContact O-N 3.36Å; M80-G83 PolarHBondContact O-N 3.5Å; M80-M84 PolarHBondContact O-N 2.74Å; M80-P135 HydrophobicContact CB-CB 3.99Å; M80-P135 HydrophobicContact CG-CB 3.94Å; M80-L138 HydrophobicContact CE-CB 4.38Å; M80-L138 HydrophobicContact CG-CB 4.26Å; M80-L138 HydrophobicContact CG-CD1 4.04Å; M80-L138 HydrophobicContact SD-CB 3.88Å; M80-F139 HydrophobicContact CB-CE2 3.88Å; M80-F139 HydrophobicContact CB-CZ 4.39Å; M80-F139 HydrophobicContact CE-CZ 4.47Å; M80-F139 HydrophobicContact CG-CD2 4.37Å; M80-F139 HydrophobicContact CG-CE2 4.08Å; M80-F139 HydrophobicContact SD-CD1 3.99Å; M80-F139 HydrophobicContact SD-CD2 3.27Å; M80-F139 WeakPolarHBondContact SD-CD2 3.23Å; M80-F139 HydrophobicContact SD-CE1 3.96Å; M80-F139 HydrophobicContact SD-CE2 3.23Å; M80-F139 WeakPolarHBondContact SD-CE2 3.36Å; M80-F139 HydrophobicContact SD-CG 3.66Å; M80-F139 HydrophobicContact SD-CZ 3.58Å; M80-F139 VanDerWaalsContact SD-CZ 3.58Å |
| 81 | R | 88 | Confident | 83.7 | Confident | 23 Ų | 23 | 57.3 Ų | 57.3 | 9% | 0.087 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -59 | -52.3 | 172.7 | -78.8 | 173.3 | -179.1 | -174.4 | 3.9 | 111.8 | L50 L73 L77 Q78 G83 M84 V85 | L50-R81 HydrophobicContact CD1-CG 3.93Å; L50-R81 HydrophobicContact CD2-CG 4.22Å; L50-R81 HydrophobicContact CG-CG 3.7Å; L50-R81 PolarHBondContact O-NE 3.26Å; L50-R81 PolarHBondContact O-NH2 2.76Å; L73-R81 VanDerWaalsContact CD2-NH1 3.35Å; L73-R81 VanDerWaalsContact CD2-NH2 3.32Å; L77-R81 WeakPolarHBondContact O-CG 3.49Å; L77-R81 PolarHBondContact O-N 3.01Å; Q78-R81 PolarHBondContact O-N 3.5Å; R81-G83 VanDerWaalsContact C-N 3.3Å; R81-G83 PolarHBondContact O-N 2.97Å; R81-M84 PolarHBondContact O-N 3.23Å; R81-V85 WeakPolarHBondContact O-CG2 3.4Å; R81-V85 PolarHBondContact O-N 2.98Å |
| 82 | A | 89.8 | Confident | 85.6 | Confident | 61 Ų | 61 | 50.6 Ų | 50.6 | 50% | 0.504 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.6 | -42 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q78 M79 V85 L86 | Q78-A82 WeakPolarHBondContact O-CB 3.49Å; Q78-A82 PolarHBondContact O-N 2.97Å; M79-A82 PolarHBondContact O-N 2.95Å; A82-V85 PolarHBondContact O-N 3.39Å; A82-L86 VanDerWaalsContact O-CB 3.25Å; A82-L86 WeakPolarHBondContact O-CB 3.38Å; A82-L86 PolarHBondContact O-N 2.88Å |
| 83 | G | 90.5 | Very high | 87.7 | Confident | 15 Ų | 15 | 51.2 Ų | 51.2 | 16% | 0.155 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.2 | -45.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | M79 M80 R81 L86 C87 | M79-G83 PolarHBondContact O-N 3.26Å; M80-G83 PolarHBondContact O-N 3.5Å; R81-G83 VanDerWaalsContact C-N 3.3Å; R81-G83 PolarHBondContact O-N 2.97Å; G83-L86 PolarHBondContact O-N 2.89Å; G83-C87 VanDerWaalsContact O-CB 3.28Å; G83-C87 WeakPolarHBondContact O-CB 3.42Å; G83-C87 PolarHBondContact O-N 2.94Å |
| 84 | M | 91.3 | Very high | 89 | Confident | 1 Ų | 1 | 49.3 Ų | 49.3 | 1% | 0.005 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -64.9 | -42.4 | 177.3 | -80 | -76.6 | 153.7 | 0 | 0 | 112.6 | T25 W30 L50 M80 R81 C87 C88 P135 T167 | T25-M84 HydrophobicContact CG2-CB 4.29Å; W30-M84 HydrophobicContact CH2-CE 3.52Å; W30-M84 HydrophobicContact CH2-CG 4.26Å; W30-M84 HydrophobicContact CH2-SD 3.92Å; W30-M84 HydrophobicContact CZ2-CE 4.34Å; W30-M84 HydrophobicContact CZ2-CG 4.49Å; W30-M84 HydrophobicContact CZ2-SD 4.17Å; W30-M84 HydrophobicContact CZ3-CE 4.41Å; L50-M84 HydrophobicContact CD2-CB 4Å; L50-M84 HydrophobicContact CD2-CG 4.02Å; M80-M84 PolarHBondContact O-N 2.74Å; R81-M84 PolarHBondContact O-N 3.23Å; M84-C87 WeakPolarHBondContact O-CB 3.34Å; M84-C87 PolarHBondContact O-N 3.44Å; M84-C88 PolarHBondContact O-N 3.09Å; M84-C88 PolarHBondContact O-SG 3.36Å; M84-P135 HydrophobicContact CE-CB 4.05Å; M84-P135 HydrophobicContact CE-CG 3.32Å; M84-P135 HydrophobicContact CG-CB 4.38Å; M84-P135 HydrophobicContact CG-CG 4.08Å; M84-P135 HydrophobicContact SD-CG 4.45Å; M84-T167 HydrophobicContact CE-CG2 4.05Å |
| 85 | V | 92.8 | Very high | 90 | Very high | 58 Ų | 58 | 48 Ų | 48 | 35% | 0.352 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.5 | -46 | 175.8 | 175 | 0 | 0 | 0 | 0 | 110.9 | W51 R81 A82 C87 C88 M89 | W51-V85 HydrophobicContact CH2-CG2 3.83Å; W51-V85 HydrophobicContact CZ2-CG2 3.55Å; R81-V85 WeakPolarHBondContact O-CG2 3.4Å; R81-V85 PolarHBondContact O-N 2.98Å; A82-V85 PolarHBondContact O-N 3.39Å; V85-C87 VanDerWaalsContact C-N 3.33Å; V85-C87 PolarHBondContact O-N 3.42Å; V85-C88 WeakPolarHBondContact O-CB 3.39Å; V85-C88 PolarHBondContact O-N 3.34Å; V85-M89 WeakPolarHBondContact O-CG 3.45Å; V85-M89 PolarHBondContact O-N 3.24Å |
| 86 | L | 94.6 | Very high | 90.9 | Very high | 90 Ų | 90 | 47.1 Ų | 47.1 | 47% | 0.471 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.2 | -42 | 177.9 | -175.2 | 64.1 | 0 | 0 | 0 | 111.2 | A82 G83 C88 M89 V90 L131 | A82-L86 VanDerWaalsContact O-CB 3.25Å; A82-L86 WeakPolarHBondContact O-CB 3.38Å; A82-L86 PolarHBondContact O-N 2.88Å; G83-L86 PolarHBondContact O-N 2.89Å; L86-C88 VanDerWaalsContact C-N 3.34Å; L86-C88 PolarHBondContact O-N 3.5Å; L86-M89 PolarHBondContact O-N 2.89Å; L86-V90 HydrophobicContact CD1-CG2 4.32Å; L86-V90 HydrophobicContact CG-CG2 4.38Å; L86-V90 VanDerWaalsContact O-CG2 3.3Å; L86-V90 WeakPolarHBondContact O-CG2 3.45Å; L86-V90 PolarHBondContact O-N 3.35Å; L86-L131 HydrophobicContact CD2-CD1 4.07Å; L86-L131 HydrophobicContact CD2-CD2 4.39Å; L86-L131 HydrophobicContact CG-CD1 4.08Å |
| 87 | C | 94.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -55.1 | -48.7 | 172.4 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | G83 M84 V85 M89 V90 A91 A128 L131 | G83-C87 VanDerWaalsContact O-CB 3.28Å; G83-C87 WeakPolarHBondContact O-CB 3.42Å; G83-C87 PolarHBondContact O-N 2.94Å; M84-C87 WeakPolarHBondContact O-CB 3.34Å; M84-C87 PolarHBondContact O-N 3.44Å; V85-C87 VanDerWaalsContact C-N 3.33Å; V85-C87 PolarHBondContact O-N 3.42Å; C87-M89 VanDerWaalsContact C-N 3.34Å; C87-M89 PolarHBondContact O-N 3.44Å; C87-V90 PolarHBondContact O-N 2.89Å; C87-A91 WeakPolarHBondContact O-CB 3.33Å; C87-A91 PolarHBondContact O-N 3.26Å; C87-A128 PolarHBondContact SG-O 3.15Å; C87-L131 HydrophobicContact CB-CB 4.08Å |
| 88 | C | 94.6 | Very high | 92.2 | Very high | 20 Ų | 20 | 44.7 Ų | 44.7 | 14% | 0.135 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -60.9 | -42.1 | 178.5 | -67.4 | 0 | 0 | 0 | 0 | 112.1 | M84 V85 L86 A91 A92 | M84-C88 PolarHBondContact O-N 3.09Å; M84-C88 PolarHBondContact O-SG 3.36Å; V85-C88 WeakPolarHBondContact O-CB 3.39Å; V85-C88 PolarHBondContact O-N 3.34Å; L86-C88 VanDerWaalsContact C-N 3.34Å; L86-C88 PolarHBondContact O-N 3.5Å; C88-A91 PolarHBondContact O-N 2.92Å; C88-A92 VanDerWaalsContact O-CB 3.3Å; C88-A92 WeakPolarHBondContact O-CB 3.49Å; C88-A92 PolarHBondContact O-N 3.37Å |
| 89 | M | 96.2 | Very high | 92.5 | Very high | 118 Ų | 118 | 41.9 Ų | 41.9 | 58% | 0.581 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -63.9 | -46.9 | 177.4 | -67.6 | -63.7 | 100 | 0 | 0 | 112.2 | V85 L86 C87 A92 F93 | V85-M89 WeakPolarHBondContact O-CG 3.45Å; V85-M89 PolarHBondContact O-N 3.24Å; L86-M89 PolarHBondContact O-N 2.89Å; C87-M89 VanDerWaalsContact C-N 3.34Å; C87-M89 PolarHBondContact O-N 3.44Å; M89-A92 PolarHBondContact O-N 3.23Å; M89-F93 WeakPolarHBondContact O-CB 3.49Å; M89-F93 PolarHBondContact O-N 3.46Å |
| 90 | V | 96.3 | Very high | 92.6 | Very high | 27 Ų | 27 | 38.6 Ų | 38.6 | 16% | 0.164 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.3 | -39.4 | 178.9 | 176.9 | 0 | 0 | 0 | 0 | 110.9 | L86 C87 F93 G94 C124 L127 A128 L131 | L86-V90 HydrophobicContact CD1-CG2 4.32Å; L86-V90 HydrophobicContact CG-CG2 4.38Å; L86-V90 VanDerWaalsContact O-CG2 3.3Å; L86-V90 WeakPolarHBondContact O-CG2 3.45Å; L86-V90 PolarHBondContact O-N 3.35Å; C87-V90 PolarHBondContact O-N 2.89Å; V90-F93 PolarHBondContact O-N 3.46Å; V90-G94 PolarHBondContact O-N 2.87Å; V90-C124 HydrophobicContact CG1-CB 4.2Å; V90-C124 WeakPolarHBondContact CG1-O 3.28Å; V90-L127 HydrophobicContact CG1-CB 4.49Å; V90-L127 HydrophobicContact CG1-CD2 4.36Å; V90-A128 HydrophobicContact CB-CB 4.32Å; V90-A128 HydrophobicContact CG1-CB 4.07Å; V90-L131 HydrophobicContact CG2-CD1 4.26Å |
| 91 | A | 96.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -68.1 | -39.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | V18 C87 C88 G94 L95 F125 A128 L174 | V18-A91 HydrophobicContact CG2-CB 3.86Å; C87-A91 WeakPolarHBondContact O-CB 3.33Å; C87-A91 PolarHBondContact O-N 3.26Å; C88-A91 PolarHBondContact O-N 2.92Å; A91-G94 PolarHBondContact O-N 3.43Å; A91-L95 WeakPolarHBondContact O-CB 3.45Å; A91-L95 PolarHBondContact O-N 2.88Å; A91-F125 WeakPolarHBondContact O-CE1 3.46Å; A91-A128 HydrophobicContact CB-CB 3.88Å; A91-L174 HydrophobicContact CB-CD2 4.38Å |
| 92 | A | 95.6 | Very high | 92.2 | Very high | 39 Ų | 39 | 38.1 Ų | 38.1 | 32% | 0.322 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.4 | -43.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | C88 M89 L95 C96 | C88-A92 VanDerWaalsContact O-CB 3.3Å; C88-A92 WeakPolarHBondContact O-CB 3.49Å; C88-A92 PolarHBondContact O-N 3.37Å; M89-A92 PolarHBondContact O-N 3.23Å; A92-L95 WeakPolarHBondContact O-CB 3.47Å; A92-L95 PolarHBondContact O-N 2.94Å; A92-L95 VanDerWaalsContact O-N 3.16Å; A92-C96 PolarHBondContact O-N 3.49Å; A92-C96 PolarHBondContact O-SG 3.03Å; A92-C96 VanDerWaalsContact O-SG 3.36Å |
| 93 | F | 95.7 | Very high | 91.4 | Very high | 120 Ų | 120 | 39.9 Ų | 39.9 | 53% | 0.526 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -62.1 | -43.9 | 174.9 | -173.2 | -107.1 | 0 | 0 | 0 | 111.8 | M89 V90 L95 C96 L97 | M89-F93 WeakPolarHBondContact O-CB 3.49Å; M89-F93 PolarHBondContact O-N 3.46Å; V90-F93 PolarHBondContact O-N 3.46Å; F93-L95 VanDerWaalsContact C-N 3.27Å; F93-L95 PolarHBondContact O-N 3.44Å; F93-C96 PolarHBondContact O-N 2.97Å; F93-L97 HydrophobicContact CD1-CD1 3.84Å; F93-L97 HydrophobicContact CD1-CG 4.32Å; F93-L97 HydrophobicContact CE1-CD1 3.43Å; F93-L97 VanDerWaalsContact CE1-CD1 3.43Å; F93-L97 HydrophobicContact CE1-CG 4.04Å; F93-L97 HydrophobicContact CZ-CD1 4.01Å; F93-L97 HydrophobicContact CZ-CD2 4.29Å; F93-L97 HydrophobicContact CZ-CG 4.24Å; F93-L97 WeakPolarHBondContact O-CG 3.48Å; F93-L97 PolarHBondContact O-N 3.33Å |
| 94 | G | 95.1 | Very high | 90.3 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.3 | -38.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | V90 A91 L97 G98 F125 | V90-G94 PolarHBondContact O-N 2.87Å; A91-G94 PolarHBondContact O-N 3.43Å; G94-L97 PolarHBondContact O-N 3.42Å; G94-G98 WeakPolarHBondContact O-CA 3.34Å; G94-G98 PolarHBondContact O-N 3.41Å; G94-F125 WeakPolarHBondContact O-CZ 3.29Å |
| 95 | L | 94.8 | Very high | 89.5 | Confident | 36 Ų | 36 | 45.8 Ų | 45.8 | 19% | 0.188 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.9 | -41 | 176.3 | -171.6 | 69.3 | 0 | 0 | 0 | 112.7 | F11 L15 A91 A92 F93 G98 S99 F125 | F11-L95 HydrophobicContact CD2-CD1 4.16Å; F11-L95 HydrophobicContact CE2-CD1 3.48Å; F11-L95 VanDerWaalsContact CE2-CD1 3.48Å; F11-L95 HydrophobicContact CE2-CG 4.37Å; F11-L95 HydrophobicContact CZ-CD1 3.9Å; L15-L95 HydrophobicContact CD2-CD1 3.52Å; L15-L95 HydrophobicContact CD2-CD2 3.63Å; L15-L95 HydrophobicContact CD2-CG 4.16Å; L15-L95 HydrophobicContact CG-CD1 3.85Å; A91-L95 WeakPolarHBondContact O-CB 3.45Å; A91-L95 PolarHBondContact O-N 2.88Å; A92-L95 WeakPolarHBondContact O-CB 3.47Å; A92-L95 PolarHBondContact O-N 2.94Å; A92-L95 VanDerWaalsContact O-N 3.16Å; F93-L95 VanDerWaalsContact C-N 3.27Å; F93-L95 PolarHBondContact O-N 3.44Å; L95-G98 PolarHBondContact O-N 3.02Å; L95-S99 WeakPolarHBondContact O-CB 3.41Å; L95-S99 PolarHBondContact O-N 2.99Å; L95-F125 HydrophobicContact CB-CE1 4.38Å; L95-F125 HydrophobicContact CB-CZ 4.23Å; L95-F125 HydrophobicContact CD1-CZ 4.37Å |
| 96 | C | 94.1 | Very high | 88.2 | Confident | 76 Ų | 76 | 54.9 Ų | 54.9 | 51% | 0.514 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62 | -45.6 | 172.5 | -66.5 | 0 | 0 | 0 | 0 | 111.5 | A92 F93 G98 S99 L100 | A92-C96 PolarHBondContact O-N 3.49Å; A92-C96 PolarHBondContact O-SG 3.03Å; A92-C96 VanDerWaalsContact O-SG 3.36Å; F93-C96 PolarHBondContact O-N 2.97Å; C96-G98 VanDerWaalsContact C-N 3.33Å; C96-G98 PolarHBondContact O-N 3.15Å; C96-S99 PolarHBondContact O-N 3.29Å; C96-S99 PolarHBondContact O-OG 2.92Å; C96-L100 VanDerWaalsContact O-CG 3.32Å; C96-L100 WeakPolarHBondContact O-CG 3.3Å; C96-L100 PolarHBondContact O-N 3.23Å |
| 97 | L | 91.8 | Very high | 86.9 | Confident | 29 Ų | 29 | 59 Ų | 59 | 15% | 0.152 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.6 | -38.9 | 175.9 | -66.8 | -178.8 | 0 | 0 | 0 | 112 | F93 G94 L100 G101 A120 A121 | F93-L97 HydrophobicContact CD1-CD1 3.84Å; F93-L97 HydrophobicContact CD1-CG 4.32Å; F93-L97 HydrophobicContact CE1-CD1 3.43Å; F93-L97 VanDerWaalsContact CE1-CD1 3.43Å; F93-L97 HydrophobicContact CE1-CG 4.04Å; F93-L97 HydrophobicContact CZ-CD1 4.01Å; F93-L97 HydrophobicContact CZ-CD2 4.29Å; F93-L97 HydrophobicContact CZ-CG 4.24Å; F93-L97 WeakPolarHBondContact O-CG 3.48Å; F93-L97 PolarHBondContact O-N 3.33Å; G94-L97 PolarHBondContact O-N 3.42Å; L97-L100 PolarHBondContact O-N 2.85Å; L97-G101 PolarHBondContact O-N 3.26Å; L97-A120 HydrophobicContact CD1-CB 3.99Å; L97-A121 HydrophobicContact CB-CB 3.72Å |
| 98 | G | 90.5 | Very high | 85.5 | Confident | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -59.6 | -48.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | G94 L95 C96 L100 G101 L102 | G94-G98 WeakPolarHBondContact O-CA 3.34Å; G94-G98 PolarHBondContact O-N 3.41Å; L95-G98 PolarHBondContact O-N 3.02Å; C96-G98 VanDerWaalsContact C-N 3.33Å; C96-G98 PolarHBondContact O-N 3.15Å; G98-L100 VanDerWaalsContact C-N 3.3Å; G98-L100 PolarHBondContact O-N 3.45Å; G98-G101 WeakPolarHBondContact O-CA 3.38Å; G98-G101 PolarHBondContact O-N 3.47Å; G98-L102 WeakPolarHBondContact O-CD1 3.45Å; G98-L102 PolarHBondContact O-N 3.3Å |
| 99 | S | 89.8 | Confident | 84.3 | Confident | 43 Ų | 43 | 65.3 Ų | 65.3 | 30% | 0.301 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.2 | -35.6 | -179.9 | 71.2 | 0 | 0 | 0 | 0 | 112.8 | L95 C96 T105 | L95-S99 WeakPolarHBondContact O-CB 3.41Å; L95-S99 PolarHBondContact O-N 2.99Å; C96-S99 PolarHBondContact O-N 3.29Å; C96-S99 PolarHBondContact O-OG 2.92Å; S99-T105 WeakPolarHBondContact O-CB 3.41Å; S99-T105 PolarHBondContact O-OG1 2.95Å |
| 100 | L | 87.8 | Confident | 83.3 | Confident | 51 Ų | 51 | 63.3 Ų | 63.3 | 27% | 0.267 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -72 | -28.8 | 173.4 | -61.1 | 176.6 | 0 | 0 | 0 | 112.7 | C96 L97 G98 W107 | C96-L100 VanDerWaalsContact O-CG 3.32Å; C96-L100 WeakPolarHBondContact O-CG 3.3Å; C96-L100 PolarHBondContact O-N 3.23Å; L97-L100 PolarHBondContact O-N 2.85Å; G98-L100 VanDerWaalsContact C-N 3.3Å; G98-L100 PolarHBondContact O-N 3.45Å; L100-W107 HydrophobicContact CD1-CH2 4.27Å; L100-W107 HydrophobicContact CD1-CZ3 4.29Å; L100-W107 HydrophobicContact CD2-CD2 3.73Å; L100-W107 VanDerWaalsContact CD2-CE2 3.41Å; L100-W107 HydrophobicContact CD2-CE3 3.92Å; L100-W107 HydrophobicContact CD2-CH2 3.56Å; L100-W107 HydrophobicContact CD2-CZ2 3.34Å; L100-W107 HydrophobicContact CD2-CZ3 3.84Å |
| 101 | G | 81.2 | Confident | 82.2 | Confident | 2 Ų | 2 | 68.4 Ų | 68.4 | 2% | 0.021 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -78.6 | -17 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | Q7 L97 G98 K114 | Q7-G101 PolarHBondContact NE2-O 3.44Å; L97-G101 PolarHBondContact O-N 3.26Å; G98-G101 WeakPolarHBondContact O-CA 3.38Å; G98-G101 PolarHBondContact O-N 3.47Å; G101-K114 WeakPolarHBondContact O-CE 3.16Å |
| 102 | L | 83.3 | Confident | 81.3 | Confident | 15 Ų | 15 | 78 Ų | 78 | 8% | 0.079 | 42% | 0.42 | C | S | . | . | S | Bend | trans | -71.8 | 140.9 | -177.9 | -73.6 | 109.3 | 0 | 0 | 0 | 113.1 | Q7 I8 F11 G98 C104 T105 K114 | Q7-L102 HydrophobicContact CG-CD2 4.41Å; Q7-L102 HydrophobicContact CG-CG 4.44Å; I8-L102 HydrophobicContact CG1-CD2 4.38Å; F11-L102 HydrophobicContact CB-CD1 4.39Å; F11-L102 HydrophobicContact CB-CD2 4.14Å; F11-L102 HydrophobicContact CD1-CD1 4.48Å; F11-L102 HydrophobicContact CD2-CD1 3.66Å; F11-L102 HydrophobicContact CE2-CD1 3.99Å; F11-L102 HydrophobicContact CG-CD1 3.93Å; F11-L102 HydrophobicContact CG-CD2 4.32Å; G98-L102 WeakPolarHBondContact O-CD1 3.45Å; G98-L102 PolarHBondContact O-N 3.3Å; L102-C104 PolarHBondContact O-N 3.47Å; L102-T105 PolarHBondContact O-N 3.08Å; L102-T105 VanDerWaalsContact O-N 3.07Å; L102-K114 WeakPolarHBondContact O-CE 3.48Å; L102-K114 PolarHBondContact O-NZ 2.99Å |
| 103 | K | 72.1 | Confident | 80.5 | Confident | 97 Ų | 97 | 78.4 Ų | 78.4 | 42% | 0.422 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.4 | -33.7 | 176.6 | -69.4 | -170.7 | -176.5 | 76.2 | 0 | 113.2 | T105 | K103-T105 PolarHBondContact O-N 3.24Š|
| 104 | C | 67.9 | Low | 79.6 | Confident | 99 Ų | 99 | 74.8 Ų | 74.8 | 67% | 0.669 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.8 | -21.6 | 179.6 | -55.9 | 0 | 0 | 0 | 0 | 113.5 | L102 R106 | L102-C104 PolarHBondContact O-N 3.47Å; C104-R106 PolarHBondContact O-N 3.12Å |
| 105 | T | 74.3 | Confident | 79 | Confident | 42 Ų | 42 | 75.3 Ų | 75.3 | 26% | 0.258 | 41% | 0.413 | S | S | . | . | S | Bend | trans | -84.3 | 103.7 | 176.2 | -53.8 | 0 | 0 | 0 | 0 | 108.9 | S99 L102 K103 W107 K114 | S99-T105 WeakPolarHBondContact O-CB 3.41Å; S99-T105 PolarHBondContact O-OG1 2.95Å; L102-T105 PolarHBondContact O-N 3.08Å; L102-T105 VanDerWaalsContact O-N 3.07Å; K103-T105 PolarHBondContact O-N 3.24Å; T105-W107 HydrophobicContact CG2-CG 4.16Å; T105-W107 PolarHBondContact O-N 2.79Å; T105-K114 PolarHBondContact O-NZ 2.9Å; T105-K114 VanDerWaalsContact O-NZ 3.12Å |
| 106 | R | 65.6 | Low | 78.5 | Confident | 249 Ų | 249 | 79.8 Ų | 79.8 | 94% | 0.94 | 43% | 0.433 | S | S | * | . | trans | -76.9 | 70.2 | 176.9 | -169.2 | 168.8 | 178.1 | 159.5 | -2.9 | 110.1 | C104 | C104-R106 PolarHBondContact O-N 3.12Š| ||
| 107 | W | 67.5 | Low | 78.2 | Confident | 175 Ų | 175 | 78.2 Ų | 78.2 | 66% | 0.663 | 42% | 0.421 | S | S | * | . | trans | -88.3 | 124.2 | 163 | -88.5 | 37.2 | 0 | 0 | 0 | 108 | L100 T105 G109 | L100-W107 HydrophobicContact CD1-CH2 4.27Å; L100-W107 HydrophobicContact CD1-CZ3 4.29Å; L100-W107 HydrophobicContact CD2-CD2 3.73Å; L100-W107 VanDerWaalsContact CD2-CE2 3.41Å; L100-W107 HydrophobicContact CD2-CE3 3.92Å; L100-W107 HydrophobicContact CD2-CH2 3.56Å; L100-W107 HydrophobicContact CD2-CZ2 3.34Å; L100-W107 HydrophobicContact CD2-CZ3 3.84Å; T105-W107 HydrophobicContact CG2-CG 4.16Å; T105-W107 PolarHBondContact O-N 2.79Å; W107-G109 PolarHBondContact O-N 2.89Å | ||
| 108 | G | 64.7 | Low | 78 | Confident | 98 Ų | 98 | 77 Ų | 77 | 100% | 1.01 | 42% | 0.415 | S | S | * | . | trans | -70.6 | 52.4 | -177 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 109 | G | 69.3 | Low | 77.9 | Confident | 55 Ų | 55 | 80.1 Ų | 80.1 | 57% | 0.567 | 43% | 0.431 | S | S | * | . | trans | -108.2 | 162.7 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | W107 | W107-G109 PolarHBondContact O-N 2.89Š| ||
| 110 | S | 76.9 | Confident | 78 | Confident | 76 Ų | 76 | 80.3 Ų | 80.3 | 53% | 0.531 | 44% | 0.435 | S | S | . | . | trans | -65.2 | 147.6 | 175.3 | 73.5 | 0 | 0 | 0 | 0 | 111.4 | R112 A113 K114 | S110-R112 PolarHBondContact O-N 3.37Å; S110-R112 VanDerWaalsContact O-N 3.09Å; S110-A113 PolarHBondContact O-N 3.49Å; S110-A113 VanDerWaalsContact O-N 3.1Å; S110-A113 PolarHBondContact OG-N 2.94Å; S110-K114 PolarHBondContact O-N 3.35Å | ||
| 111 | Q | 73.3 | Confident | 78.3 | Confident | 135 Ų | 135 | 77.9 Ų | 77.9 | 63% | 0.631 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -56.4 | -28.2 | 177.6 | -72 | -66 | -37.6 | 0 | 0 | 112.7 | G115 | Q111-G115 PolarHBondContact O-N 2.87Å |
| 112 | R | 75.8 | Confident | 78.9 | Confident | 200 Ų | 200 | 77.8 Ų | 77.8 | 76% | 0.755 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -69.6 | -43.8 | 177.6 | -163.6 | 175.8 | -164.1 | 174.1 | 5.1 | 112.2 | S110 K114 G115 H116 | S110-R112 PolarHBondContact O-N 3.37Å; S110-R112 VanDerWaalsContact O-N 3.09Å; R112-K114 VanDerWaalsContact C-N 3.28Å; R112-K114 PolarHBondContact O-N 3.21Å; R112-G115 PolarHBondContact O-N 3.49Å; R112-H116 PolarHBondContact O-CD2 3.29Å; R112-H116 PolarHBondContact O-N 3.28Å |
| 113 | A | 78.8 | Confident | 79.4 | Confident | 49 Ų | 49 | 79 Ų | 79 | 41% | 0.405 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.1 | -39.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S110 G115 H116 T117 | S110-A113 PolarHBondContact O-N 3.49Å; S110-A113 VanDerWaalsContact O-N 3.1Å; S110-A113 PolarHBondContact OG-N 2.94Å; A113-G115 VanDerWaalsContact C-N 3.3Å; A113-G115 PolarHBondContact O-N 3.42Å; A113-H116 PolarHBondContact O-N 3.19Å; A113-T117 PolarHBondContact O-N 3.12Å; A113-T117 VanDerWaalsContact O-N 3.07Å; A113-T117 PolarHBondContact O-OG1 3.49Å |
| 114 | K | 77.8 | Confident | 80.6 | Confident | 43 Ų | 43 | 75.4 Ų | 75.4 | 19% | 0.187 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -64.5 | -31.4 | 177.1 | -164.3 | 165.8 | -171.7 | 152.4 | 0 | 113.6 | G101 L102 T105 S110 R112 T117 A118 | G101-K114 WeakPolarHBondContact O-CE 3.16Å; L102-K114 WeakPolarHBondContact O-CE 3.48Å; L102-K114 PolarHBondContact O-NZ 2.99Å; T105-K114 PolarHBondContact O-NZ 2.9Å; T105-K114 VanDerWaalsContact O-NZ 3.12Å; S110-K114 PolarHBondContact O-N 3.35Å; R112-K114 VanDerWaalsContact C-N 3.28Å; R112-K114 PolarHBondContact O-N 3.21Å; K114-T117 PolarHBondContact O-OG1 2.9Å; K114-T117 VanDerWaalsContact O-OG1 3.07Å; K114-A118 WeakPolarHBondContact O-CB 3.34Å; K114-A118 PolarHBondContact O-N 2.87Å |
| 115 | G | 81.1 | Confident | 81.9 | Confident | 12 Ų | 12 | 70.7 Ų | 70.7 | 12% | 0.124 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -70.4 | -42.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q111 R112 A113 A118 M119 | Q111-G115 PolarHBondContact O-N 2.87Å; R112-G115 PolarHBondContact O-N 3.49Å; A113-G115 VanDerWaalsContact C-N 3.3Å; A113-G115 PolarHBondContact O-N 3.42Å; G115-A118 PolarHBondContact O-N 3.27Å; G115-M119 PolarHBondContact O-N 2.89Å |
| 116 | H | 85.1 | Confident | 83 | Confident | 129 Ų | 129 | 70.6 Ų | 70.6 | 60% | 0.597 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -64.6 | -41.8 | 177.3 | -83.9 | -82 | 0 | 0 | 0 | 112.4 | R112 A113 A118 M119 A120 | R112-H116 PolarHBondContact O-CD2 3.29Å; R112-H116 PolarHBondContact O-N 3.28Å; A113-H116 PolarHBondContact O-N 3.19Å; H116-A118 VanDerWaalsContact C-N 3.35Å; H116-M119 PolarHBondContact O-N 3.44Å; H116-A120 WeakPolarHBondContact O-CB 3.35Å; H116-A120 PolarHBondContact O-N 3.5Å |
| 117 | T | 87.4 | Confident | 84.4 | Confident | 44 Ų | 44 | 63 Ų | 63 | 27% | 0.27 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -66 | -38 | 177.1 | 54.6 | 0 | 0 | 0 | 0 | 112.1 | A113 K114 A120 A121 | A113-T117 PolarHBondContact O-N 3.12Å; A113-T117 VanDerWaalsContact O-N 3.07Å; A113-T117 PolarHBondContact O-OG1 3.49Å; K114-T117 PolarHBondContact O-OG1 2.9Å; K114-T117 VanDerWaalsContact O-OG1 3.07Å; T117-A120 PolarHBondContact O-N 2.86Å; T117-A121 WeakPolarHBondContact O-CB 3.24Å; T117-A121 PolarHBondContact O-N 3.48Å |
| 118 | A | 87.7 | Confident | 85.8 | Confident | 3 Ų | 3 | 54.7 Ų | 54.7 | 3% | 0.025 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.5 | -42.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | K114 G115 H116 A121 G122 F181 | K114-A118 WeakPolarHBondContact O-CB 3.34Å; K114-A118 PolarHBondContact O-N 2.87Å; G115-A118 PolarHBondContact O-N 3.27Å; H116-A118 VanDerWaalsContact C-N 3.35Å; A118-A121 PolarHBondContact O-N 2.89Å; A118-G122 PolarHBondContact O-N 3.45Å; A118-F181 HydrophobicContact CB-CD1 3.98Å; A118-F181 HydrophobicContact CB-CE1 3.91Å; A118-F181 WeakPolarHBondContact O-CD1 3.42Å |
| 119 | M | 88.8 | Confident | 87.3 | Confident | 66 Ų | 66 | 50.1 Ų | 50.1 | 33% | 0.325 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.6 | -43.9 | 174.9 | -81.6 | -68.6 | 176.5 | 0 | 0 | 112.5 | G115 H116 A121 G122 G123 C182 C185 | G115-M119 PolarHBondContact O-N 2.89Å; H116-M119 PolarHBondContact O-N 3.44Å; M119-A121 VanDerWaalsContact C-N 3.33Å; M119-A121 PolarHBondContact O-N 2.91Å; M119-G122 PolarHBondContact O-N 3.32Å; M119-G123 PolarHBondContact O-N 3.37Å; M119-C182 WeakPolarHBondContact CE-O 3.42Å; M119-C182 HydrophobicContact SD-CB 4.47Å; M119-C185 HydrophobicContact CE-CB 3.58Å; M119-C185 WeakPolarHBondContact CE-O 3.48Å; M119-C185 HydrophobicContact CG-CB 4.39Å |
| 120 | A | 92.6 | Very high | 88.5 | Confident | 47 Ų | 47 | 52 Ų | 52 | 39% | 0.388 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.7 | -42.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L97 H116 T117 G122 G123 C124 | L97-A120 HydrophobicContact CD1-CB 3.99Å; H116-A120 WeakPolarHBondContact O-CB 3.35Å; H116-A120 PolarHBondContact O-N 3.5Å; T117-A120 PolarHBondContact O-N 2.86Å; A120-G122 PolarHBondContact O-N 2.9Å; A120-G123 PolarHBondContact O-N 3.46Å; A120-C124 PolarHBondContact O-N 3.03Å; A120-C124 PolarHBondContact O-SG 3.48Å |
| 121 | A | 93.4 | Very high | 89.3 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59.3 | -46.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L97 T117 A118 M119 G123 C124 F125 F181 | L97-A121 HydrophobicContact CB-CB 3.72Å; T117-A121 WeakPolarHBondContact O-CB 3.24Å; T117-A121 PolarHBondContact O-N 3.48Å; A118-A121 PolarHBondContact O-N 2.89Å; M119-A121 VanDerWaalsContact C-N 3.33Å; M119-A121 PolarHBondContact O-N 2.91Å; A121-G123 PolarHBondContact O-N 2.89Å; A121-C124 PolarHBondContact O-N 3.46Å; A121-F125 WeakPolarHBondContact O-CD2 3.23Å; A121-F125 PolarHBondContact O-N 3.16Å; A121-F181 HydrophobicContact CB-CD1 4.22Å; A121-F181 HydrophobicContact CB-CE1 4.25Å |
| 122 | G | 93.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59.6 | -45.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A118 M119 A120 C124 F125 V126 C182 | A118-G122 PolarHBondContact O-N 3.45Å; M119-G122 PolarHBondContact O-N 3.32Å; A120-G122 PolarHBondContact O-N 2.9Å; G122-C124 PolarHBondContact O-N 3.29Å; G122-F125 PolarHBondContact O-N 3.45Å; G122-V126 WeakPolarHBondContact O-CG2 3.45Å; G122-V126 PolarHBondContact O-N 2.88Å; G122-C182 VanDerWaalsContact C-SG 3.58Å |
| 123 | G | 94.6 | Very high | 91 | Very high | 39 Ų | 39 | 37.5 Ų | 37.5 | 40% | 0.402 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -59.4 | -43.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113 | M119 A120 A121 F125 V126 L127 | M119-G123 PolarHBondContact O-N 3.37Å; A120-G123 PolarHBondContact O-N 3.46Å; A121-G123 PolarHBondContact O-N 2.89Å; G123-F125 PolarHBondContact O-N 3.47Å; G123-V126 PolarHBondContact O-N 3.31Å; G123-L127 WeakPolarHBondContact O-CB 2.94Å; G123-L127 PolarHBondContact O-N 3.15Å |
| 124 | C | 96.2 | Very high | 91.7 | Very high | 22 Ų | 22 | 39.3 Ų | 39.3 | 15% | 0.149 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.6 | -42 | 175.2 | -67.7 | 0 | 0 | 0 | 0 | 112.2 | V90 A120 A121 G122 L127 A128 | V90-C124 HydrophobicContact CG1-CB 4.2Å; V90-C124 WeakPolarHBondContact CG1-O 3.28Å; A120-C124 PolarHBondContact O-N 3.03Å; A120-C124 PolarHBondContact O-SG 3.48Å; A121-C124 PolarHBondContact O-N 3.46Å; G122-C124 PolarHBondContact O-N 3.29Å; C124-L127 PolarHBondContact O-N 2.95Å; C124-A128 VanDerWaalsContact O-CB 3.31Å; C124-A128 WeakPolarHBondContact O-CB 3.01Å; C124-A128 PolarHBondContact O-N 3.34Å |
| 125 | F | 95.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67.4 | -39.1 | 178 | -71.3 | -48.6 | 0 | 0 | 0 | 113.3 | A14 V18 A91 G94 L95 A121 G122 G123 A128 S129 L174 | A14-F125 HydrophobicContact CB-CD1 4.38Å; A14-F125 HydrophobicContact CB-CD2 4.29Å; A14-F125 HydrophobicContact CB-CE1 3.89Å; A14-F125 HydrophobicContact CB-CE2 3.78Å; A14-F125 HydrophobicContact CB-CZ 3.53Å; V18-F125 HydrophobicContact CG2-CE1 4.34Å; A91-F125 WeakPolarHBondContact O-CE1 3.46Å; G94-F125 WeakPolarHBondContact O-CZ 3.29Å; L95-F125 HydrophobicContact CB-CE1 4.38Å; L95-F125 HydrophobicContact CB-CZ 4.23Å; L95-F125 HydrophobicContact CD1-CZ 4.37Å; A121-F125 WeakPolarHBondContact O-CD2 3.23Å; A121-F125 PolarHBondContact O-N 3.16Å; G122-F125 PolarHBondContact O-N 3.45Å; G123-F125 PolarHBondContact O-N 3.47Å; F125-A128 PolarHBondContact O-N 2.79Å; F125-S129 WeakPolarHBondContact O-CB 3.45Å; F125-S129 PolarHBondContact O-N 3.3Å; F125-L174 HydrophobicContact CD1-CD2 3.9Å; F125-L174 HydrophobicContact CE1-CD2 4.39Å |
| 126 | V | 96.2 | Very high | 92.5 | Very high | 41 Ų | 41 | 36.8 Ų | 36.8 | 25% | 0.248 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.7 | -46.2 | 174 | 174.5 | 0 | 0 | 0 | 0 | 110.2 | G122 G123 A128 S129 L130 L175 | G122-V126 WeakPolarHBondContact O-CG2 3.45Å; G122-V126 PolarHBondContact O-N 2.88Å; G123-V126 PolarHBondContact O-N 3.31Å; V126-A128 PolarHBondContact O-N 3.12Å; V126-S129 WeakPolarHBondContact O-CB 3.11Å; V126-S129 PolarHBondContact O-N 3.4Å; V126-L130 WeakPolarHBondContact O-CG 3.35Å; V126-L130 PolarHBondContact O-N 3Å; V126-L130 VanDerWaalsContact O-N 3.08Å; V126-L175 HydrophobicContact CG1-CD1 4.29Å; V126-L175 HydrophobicContact CG2-CD1 4.44Å |
| 127 | L | 96.2 | Very high | 92.7 | Very high | 90 Ų | 90 | 33.3 Ų | 33.3 | 47% | 0.471 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -61.4 | -43.8 | 177 | -177.1 | 62.3 | 0 | 0 | 0 | 111.8 | V90 G123 C124 S129 L130 L131 | V90-L127 HydrophobicContact CG1-CB 4.49Å; V90-L127 HydrophobicContact CG1-CD2 4.36Å; G123-L127 WeakPolarHBondContact O-CB 2.94Å; G123-L127 PolarHBondContact O-N 3.15Å; C124-L127 PolarHBondContact O-N 2.95Å; L127-S129 VanDerWaalsContact C-N 3.34Å; L127-S129 PolarHBondContact O-N 3.21Å; L127-L130 PolarHBondContact O-N 2.74Å; L127-L131 HydrophobicContact CG-CD1 4.15Å; L127-L131 WeakPolarHBondContact O-CG 3.17Å; L127-L131 PolarHBondContact O-N 3.2Å |
| 128 | A | 96.5 | Very high | 92.7 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.8 | -42.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | C87 V90 A91 C124 F125 V126 L130 L131 C132 | C87-A128 PolarHBondContact SG-O 3.15Å; V90-A128 HydrophobicContact CB-CB 4.32Å; V90-A128 HydrophobicContact CG1-CB 4.07Å; A91-A128 HydrophobicContact CB-CB 3.88Å; C124-A128 VanDerWaalsContact O-CB 3.31Å; C124-A128 WeakPolarHBondContact O-CB 3.01Å; C124-A128 PolarHBondContact O-N 3.34Å; F125-A128 PolarHBondContact O-N 2.79Å; V126-A128 PolarHBondContact O-N 3.12Å; A128-L130 PolarHBondContact O-N 2.97Å; A128-L131 PolarHBondContact O-N 2.93Å; A128-C132 WeakPolarHBondContact O-CB 3.3Å; A128-C132 PolarHBondContact O-N 3.43Å |
| 129 | S | 96.1 | Very high | 92.6 | Very high | 1 Ų | 1 | 35.1 Ų | 35.1 | 1% | 0.007 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.7 | -44.4 | 176.1 | -177.9 | 0 | 0 | 0 | 0 | 112 | F125 V126 L127 C132 L133 A171 | F125-S129 WeakPolarHBondContact O-CB 3.45Å; F125-S129 PolarHBondContact O-N 3.3Å; V126-S129 WeakPolarHBondContact O-CB 3.11Å; V126-S129 PolarHBondContact O-N 3.4Å; L127-S129 VanDerWaalsContact C-N 3.34Å; L127-S129 PolarHBondContact O-N 3.21Å; S129-C132 WeakPolarHBondContact O-CB 3.41Å; S129-C132 PolarHBondContact O-N 3.47Å; S129-L133 PolarHBondContact O-N 2.86Å; S129-A171 PolarHBondContact OG-O 3.13Å |
| 130 | L | 95.2 | Very high | 92.4 | Very high | 96 Ų | 96 | 34.3 Ų | 34.3 | 50% | 0.503 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63.6 | -44.2 | 175.9 | -65.8 | 174.8 | 0 | 0 | 0 | 112 | V126 L127 A128 C132 L133 V134 | V126-L130 WeakPolarHBondContact O-CG 3.35Å; V126-L130 PolarHBondContact O-N 3Å; V126-L130 VanDerWaalsContact O-N 3.08Å; L127-L130 PolarHBondContact O-N 2.74Å; A128-L130 PolarHBondContact O-N 2.97Å; L130-C132 PolarHBondContact O-N 2.9Å; L130-L133 PolarHBondContact O-N 3.36Å; L130-L133 VanDerWaalsContact O-N 3.15Å; L130-V134 WeakPolarHBondContact O-CG2 3.45Å; L130-V134 PolarHBondContact O-N 2.6Å; L130-V134 VanDerWaalsContact O-N 3.12Å |
| 131 | L | 93.4 | Very high | 92.1 | Very high | 43 Ų | 43 | 36.2 Ų | 36.2 | 23% | 0.225 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.9 | -25.4 | 176.1 | -70.9 | 173.1 | 0 | 0 | 0 | 113 | L86 C87 V90 L127 A128 P135 | L86-L131 HydrophobicContact CD2-CD1 4.07Å; L86-L131 HydrophobicContact CD2-CD2 4.39Å; L86-L131 HydrophobicContact CG-CD1 4.08Å; C87-L131 HydrophobicContact CB-CB 4.08Å; V90-L131 HydrophobicContact CG2-CD1 4.26Å; L127-L131 HydrophobicContact CG-CD1 4.15Å; L127-L131 WeakPolarHBondContact O-CG 3.17Å; L127-L131 PolarHBondContact O-N 3.2Å; A128-L131 PolarHBondContact O-N 2.93Å; L131-P135 WeakPolarHBondContact O-CD 3.32Å; L131-P135 WeakPolarHBondContact O-CG 3.33Å |
| 132 | C | 92.7 | Very high | 91.6 | Very high | 1 Ų | 1 | 40.8 Ų | 40.8 | 1% | 0.007 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -78.6 | -37 | 172.8 | -164 | 0 | 0 | 0 | 0 | 112.3 | A128 S129 L130 P135 A136 A171 | A128-C132 WeakPolarHBondContact O-CB 3.3Å; A128-C132 PolarHBondContact O-N 3.43Å; S129-C132 WeakPolarHBondContact O-CB 3.41Å; S129-C132 PolarHBondContact O-N 3.47Å; L130-C132 PolarHBondContact O-N 2.9Å; C132-P135 WeakPolarHBondContact O-CD 3.23Å; C132-P135 VanDerWaalsContact O-CG 3.3Å; C132-P135 WeakPolarHBondContact O-CG 3.27Å; C132-A136 PolarHBondContact O-N 2.82Å; C132-A171 HydrophobicContact CB-CB 4.29Å |
| 133 | L | 92.8 | Very high | 91 | Very high | 62 Ų | 62 | 41.7 Ų | 41.7 | 33% | 0.325 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -68 | -36.2 | 179.3 | -90 | 154 | 0 | 0 | 0 | 113 | S129 L130 A136 A137 F168 A171 | S129-L133 PolarHBondContact O-N 2.86Å; L130-L133 PolarHBondContact O-N 3.36Å; L130-L133 VanDerWaalsContact O-N 3.15Å; L133-A136 PolarHBondContact O-N 2.65Å; L133-A137 WeakPolarHBondContact O-CB 3.31Å; L133-A137 PolarHBondContact O-N 2.78Å; L133-F168 HydrophobicContact CD2-CD1 4.21Å; L133-F168 HydrophobicContact CD2-CE1 3.99Å; L133-A171 HydrophobicContact CG-CB 4.21Å |
| 134 | V | 91.8 | Very high | 90.4 | Very high | 86 Ų | 86 | 43.7 Ų | 43.7 | 52% | 0.521 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -55.6 | -58.9 | 178.3 | 172 | 0 | 0 | 0 | 0 | 112.6 | L130 A136 A137 L138 | L130-V134 WeakPolarHBondContact O-CG2 3.45Å; L130-V134 PolarHBondContact O-N 2.6Å; L130-V134 VanDerWaalsContact O-N 3.12Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 3.14Å; V134-A137 PolarHBondContact O-N 3.46Å; V134-L138 HydrophobicContact CG1-CD1 4.22Å; V134-L138 WeakPolarHBondContact O-CG 3.13Å; V134-L138 PolarHBondContact O-N 2.05Å |
| 135 | P | 88 | Confident | 89.7 | Confident | 2 Ų | 2 | 45.3 Ų | 45.3 | 1% | 0.013 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62.7 | -36 | 177.4 | 24.7 | -34.5 | 0 | 0 | 0 | 112.3 | M80 M84 L131 C132 A137 L138 F139 | M80-P135 HydrophobicContact CB-CB 3.99Å; M80-P135 HydrophobicContact CG-CB 3.94Å; M84-P135 HydrophobicContact CE-CB 4.05Å; M84-P135 HydrophobicContact CE-CG 3.32Å; M84-P135 HydrophobicContact CG-CB 4.38Å; M84-P135 HydrophobicContact CG-CG 4.08Å; M84-P135 HydrophobicContact SD-CG 4.45Å; L131-P135 WeakPolarHBondContact O-CD 3.32Å; L131-P135 WeakPolarHBondContact O-CG 3.33Å; C132-P135 WeakPolarHBondContact O-CD 3.23Å; C132-P135 VanDerWaalsContact O-CG 3.3Å; C132-P135 WeakPolarHBondContact O-CG 3.27Å; P135-A137 VanDerWaalsContact C-N 3.35Å; P135-A137 PolarHBondContact O-N 2.96Å; P135-L138 PolarHBondContact O-N 3.23Å; P135-F139 WeakPolarHBondContact O-CB 3.19Å; P135-F139 WeakPolarHBondContact O-CD2 3.33Å; P135-F139 PolarHBondContact O-N 3.09Å |
| 136 | A | 88.6 | Confident | 88.7 | Confident | 1 Ų | 1 | 46.4 Ų | 46.4 | 1% | 0.008 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62 | -41.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | C132 L133 V134 T140 F168 | C132-A136 PolarHBondContact O-N 2.82Å; L133-A136 PolarHBondContact O-N 2.65Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 3.14Å; A136-T140 WeakPolarHBondContact O-CB 3.09Å; A136-T140 PolarHBondContact O-N 2.83Å; A136-T140 PolarHBondContact O-OG1 3.3Å; A136-F168 HydrophobicContact CB-CE1 4.37Å; A136-F168 HydrophobicContact CB-CE2 4.18Å; A136-F168 HydrophobicContact CB-CZ 3.98Å |
| 137 | A | 89.9 | Confident | 87.7 | Confident | 56 Ų | 56 | 48.9 Ų | 48.9 | 46% | 0.463 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -67.7 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | L133 V134 P135 T140 N141 | L133-A137 WeakPolarHBondContact O-CB 3.31Å; L133-A137 PolarHBondContact O-N 2.78Å; V134-A137 PolarHBondContact O-N 3.46Å; P135-A137 VanDerWaalsContact C-N 3.35Å; P135-A137 PolarHBondContact O-N 2.96Å; A137-T140 PolarHBondContact O-N 3.43Å; A137-N141 WeakPolarHBondContact O-CB 3.23Å; A137-N141 PolarHBondContact O-N 3.43Å |
| 138 | L | 87.8 | Confident | 86.7 | Confident | 63 Ų | 63 | 50.6 Ų | 50.6 | 33% | 0.33 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.1 | -49.3 | 174.7 | -69.4 | 176.3 | 0 | 0 | 0 | 111.2 | M80 V134 P135 T140 N141 E142 | M80-L138 HydrophobicContact CE-CB 4.38Å; M80-L138 HydrophobicContact CG-CB 4.26Å; M80-L138 HydrophobicContact CG-CD1 4.04Å; M80-L138 HydrophobicContact SD-CB 3.88Å; V134-L138 HydrophobicContact CG1-CD1 4.22Å; V134-L138 WeakPolarHBondContact O-CG 3.13Å; V134-L138 PolarHBondContact O-N 2.05Å; P135-L138 PolarHBondContact O-N 3.23Å; L138-T140 VanDerWaalsContact C-N 3.28Å; L138-T140 PolarHBondContact O-N 2.85Å; L138-N141 PolarHBondContact O-N 2.83Å; L138-N141 VanDerWaalsContact O-N 3.15Å; L138-E142 WeakPolarHBondContact O-CG 3.27Å; L138-E142 PolarHBondContact O-N 3.39Å |
| 139 | F | 84.1 | Confident | 85.5 | Confident | 22 Ų | 22 | 55.7 Ų | 55.7 | 10% | 0.096 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.2 | -42.2 | 175.5 | -89 | -68 | 0 | 0 | 0 | 112.3 | W30 L50 L77 M80 P135 N141 E142 V143 L164 | W30-F139 HydrophobicContact CD2-CE2 4.2Å; W30-F139 HydrophobicContact CD2-CZ 4.44Å; W30-F139 HydrophobicContact CE3-CD1 4.39Å; W30-F139 AromaticContact CE3-CD2 3.4Å; W30-F139 HydrophobicContact CE3-CD2 3.4Å; W30-F139 HydrophobicContact CE3-CE1 4.41Å; W30-F139 AromaticContact CE3-CE2 3.41Å; W30-F139 HydrophobicContact CE3-CE2 3.41Å; W30-F139 VanDerWaalsContact CE3-CE2 3.41Å; W30-F139 AromaticContact CE3-CG 3.93Å; W30-F139 HydrophobicContact CE3-CG 3.93Å; W30-F139 AromaticContact CE3-CZ 3.96Å; W30-F139 HydrophobicContact CE3-CZ 3.96Å; W30-F139 HydrophobicContact CH2-CD2 4.47Å; W30-F139 HydrophobicContact CH2-CE2 4.37Å; W30-F139 AromaticContact CZ3-CD2 3.36Å; W30-F139 HydrophobicContact CZ3-CD2 3.36Å; W30-F139 AromaticContact CZ3-CE2 3.53Å; W30-F139 HydrophobicContact CZ3-CE2 3.53Å; W30-F139 HydrophobicContact CZ3-CG 4.22Å; W30-F139 HydrophobicContact CZ3-CZ 4.49Å; L50-F139 HydrophobicContact CD1-CE2 3.87Å; L50-F139 HydrophobicContact CD1-CZ 3.65Å; L77-F139 HydrophobicContact CD2-CE1 4.03Å; L77-F139 HydrophobicContact CD2-CZ 4.02Å; M80-F139 HydrophobicContact CB-CE2 3.88Å; M80-F139 HydrophobicContact CB-CZ 4.39Å; M80-F139 HydrophobicContact CE-CZ 4.47Å; M80-F139 HydrophobicContact CG-CD2 4.37Å; M80-F139 HydrophobicContact CG-CE2 4.08Å; M80-F139 HydrophobicContact SD-CD1 3.99Å; M80-F139 HydrophobicContact SD-CD2 3.27Å; M80-F139 WeakPolarHBondContact SD-CD2 3.23Å; M80-F139 HydrophobicContact SD-CE1 3.96Å; M80-F139 HydrophobicContact SD-CE2 3.23Å; M80-F139 WeakPolarHBondContact SD-CE2 3.36Å; M80-F139 HydrophobicContact SD-CG 3.66Å; M80-F139 HydrophobicContact SD-CZ 3.58Å; M80-F139 VanDerWaalsContact SD-CZ 3.58Å; P135-F139 WeakPolarHBondContact O-CB 3.19Å; P135-F139 WeakPolarHBondContact O-CD2 3.33Å; P135-F139 PolarHBondContact O-N 3.09Å; F139-N141 VanDerWaalsContact C-N 3.33Å; F139-N141 PolarHBondContact O-N 2.93Å; F139-E142 PolarHBondContact O-N 2.99Å; F139-V143 WeakPolarHBondContact O-CB 3.45Å; F139-V143 VanDerWaalsContact O-CG2 3.24Å; F139-V143 WeakPolarHBondContact O-CG2 3.46Å; F139-V143 PolarHBondContact O-N 3.44Å; F139-L164 HydrophobicContact CB-CD2 3.8Å; F139-L164 HydrophobicContact CG-CD2 4.39Å |
| 140 | T | 85.2 | Confident | 83.7 | Confident | 48 Ų | 48 | 58.8 Ų | 58.8 | 29% | 0.294 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 178 | -56.4 | 0 | 0 | 0 | 0 | 110.9 | A136 A137 L138 V143 I144 | A136-T140 WeakPolarHBondContact O-CB 3.09Å; A136-T140 PolarHBondContact O-N 2.83Å; A136-T140 PolarHBondContact O-OG1 3.3Å; A137-T140 PolarHBondContact O-N 3.43Å; L138-T140 VanDerWaalsContact C-N 3.28Å; L138-T140 PolarHBondContact O-N 2.85Å; T140-V143 PolarHBondContact O-N 3.26Å; T140-I144 HydrophobicContact CG2-CD1 3.73Å; T140-I144 HydrophobicContact CG2-CG1 4.36Å; T140-I144 WeakPolarHBondContact O-CB 3.47Å; T140-I144 WeakPolarHBondContact O-CG1 3.33Å; T140-I144 PolarHBondContact O-N 3.04Å |
| 141 | N | 87.2 | Confident | 81.7 | Confident | 87 Ų | 87 | 61 Ų | 61 | 47% | 0.465 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -64.9 | -43.7 | 176.9 | -168.7 | 28.5 | 0 | 0 | 0 | 112.3 | A137 L138 F139 V143 I144 T145 | A137-N141 WeakPolarHBondContact O-CB 3.23Å; A137-N141 PolarHBondContact O-N 3.43Å; L138-N141 PolarHBondContact O-N 2.83Å; L138-N141 VanDerWaalsContact O-N 3.15Å; F139-N141 VanDerWaalsContact C-N 3.33Å; F139-N141 PolarHBondContact O-N 2.93Å; N141-V143 VanDerWaalsContact C-N 3.28Å; N141-V143 PolarHBondContact O-N 2.96Å; N141-I144 PolarHBondContact O-N 2.88Å; N141-T145 WeakPolarHBondContact O-CB 3.3Å; N141-T145 WeakPolarHBondContact O-CG2 2.95Å; N141-T145 PolarHBondContact O-N 3.33Å; N141-T145 PolarHBondContact O-OG1 3.24Å |
| 142 | E | 82.9 | Confident | 79.8 | Confident | 96 Ų | 96 | 66.6 Ų | 66.6 | 45% | 0.449 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -60.8 | -38.5 | 174.6 | -68.4 | -67.9 | 146.3 | 0 | 0 | 111.7 | L138 F139 T145 A146 | L138-E142 WeakPolarHBondContact O-CG 3.27Å; L138-E142 PolarHBondContact O-N 3.39Å; F139-E142 PolarHBondContact O-N 2.99Å; E142-T145 WeakPolarHBondContact CA-OG1 3.41Å; E142-T145 PolarHBondContact O-OG1 2.84Å; E142-T145 VanDerWaalsContact O-OG1 3.1Å; E142-A146 WeakPolarHBondContact O-CB 3.16Å; E142-A146 PolarHBondContact O-N 2.97Å |
| 143 | V | 79.8 | Confident | 77.8 | Confident | 19 Ų | 19 | 70.2 Ų | 70.2 | 12% | 0.115 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -68.3 | -47.2 | 176.3 | 168.8 | 0 | 0 | 0 | 0 | 110.9 | F139 T140 N141 A146 F147 | F139-V143 WeakPolarHBondContact O-CB 3.45Å; F139-V143 VanDerWaalsContact O-CG2 3.24Å; F139-V143 WeakPolarHBondContact O-CG2 3.46Å; F139-V143 PolarHBondContact O-N 3.44Å; T140-V143 PolarHBondContact O-N 3.26Å; N141-V143 VanDerWaalsContact C-N 3.28Å; N141-V143 PolarHBondContact O-N 2.96Å; V143-A146 PolarHBondContact O-N 2.73Å; V143-F147 HydrophobicContact CG1-CD2 3.81Å; V143-F147 HydrophobicContact CG1-CE2 3.35Å; V143-F147 HydrophobicContact CG1-CZ 4.42Å; V143-F147 WeakPolarHBondContact O-CD2 3.19Å; V143-F147 PolarHBondContact O-N 3.13Å |
| 144 | I | 82.3 | Confident | 75.9 | Confident | 82 Ų | 82 | 74.7 Ų | 74.7 | 42% | 0.421 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -62.5 | -48.6 | 179.1 | -70 | 167.6 | 0 | 0 | 0 | 110.9 | T140 N141 A146 F147 L148 | T140-I144 HydrophobicContact CG2-CD1 3.73Å; T140-I144 HydrophobicContact CG2-CG1 4.36Å; T140-I144 WeakPolarHBondContact O-CB 3.47Å; T140-I144 WeakPolarHBondContact O-CG1 3.33Å; T140-I144 PolarHBondContact O-N 3.04Å; N141-I144 PolarHBondContact O-N 2.88Å; I144-A146 VanDerWaalsContact C-N 3.31Å; I144-A146 PolarHBondContact O-N 3.4Å; I144-F147 WeakPolarHBondContact O-CA 3.26Å; I144-F147 WeakPolarHBondContact O-CB 3.41Å; I144-F147 PolarHBondContact O-N 3.49Å; I144-L148 HydrophobicContact CG2-CD1 3.68Å; I144-L148 WeakPolarHBondContact O-CD1 3.39Å; I144-L148 PolarHBondContact O-N 2.82Å |
| 145 | T | 81.3 | Confident | 74 | Confident | 56 Ų | 56 | 71.9 Ų | 71.9 | 34% | 0.344 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -60.8 | -42.2 | 178.3 | 48.9 | 0 | 0 | 0 | 0 | 111.2 | N141 E142 F147 L148 T149 | N141-T145 WeakPolarHBondContact O-CB 3.3Å; N141-T145 WeakPolarHBondContact O-CG2 2.95Å; N141-T145 PolarHBondContact O-N 3.33Å; N141-T145 PolarHBondContact O-OG1 3.24Å; E142-T145 WeakPolarHBondContact CA-OG1 3.41Å; E142-T145 PolarHBondContact O-OG1 2.84Å; E142-T145 VanDerWaalsContact O-OG1 3.1Å; T145-F147 VanDerWaalsContact C-N 3.26Å; T145-F147 PolarHBondContact O-N 2.96Å; T145-L148 PolarHBondContact O-N 3.46Å; T145-L148 VanDerWaalsContact O-N 3.12Å; T145-T149 WeakPolarHBondContact O-CG2 3.07Å; T145-T149 PolarHBondContact O-N 3.12Å; T145-T149 PolarHBondContact O-OG1 3.25Å |
| 146 | A | 75.3 | Confident | 72.4 | Confident | 22 Ų | 22 | 73.3 Ų | 73.3 | 18% | 0.182 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -59.5 | -35.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | E142 V143 I144 T150 | E142-A146 WeakPolarHBondContact O-CB 3.16Å; E142-A146 PolarHBondContact O-N 2.97Å; V143-A146 PolarHBondContact O-N 2.73Å; I144-A146 VanDerWaalsContact C-N 3.31Å; I144-A146 PolarHBondContact O-N 3.4Å; A146-T150 WeakPolarHBondContact O-CB 3.31Å; A146-T150 PolarHBondContact O-N 3.32Å; A146-T150 PolarHBondContact O-OG1 2.97Å |
| 147 | F | 74.1 | Confident | 71 | Confident | 94 Ų | 94 | 80.3 Ų | 80.3 | 41% | 0.412 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -69.5 | -40.8 | 173.3 | -75.6 | -68.7 | 0 | 0 | 0 | 113 | V143 I144 T145 Y158 | V143-F147 HydrophobicContact CG1-CD2 3.81Å; V143-F147 HydrophobicContact CG1-CE2 3.35Å; V143-F147 HydrophobicContact CG1-CZ 4.42Å; V143-F147 WeakPolarHBondContact O-CD2 3.19Å; V143-F147 PolarHBondContact O-N 3.13Å; I144-F147 WeakPolarHBondContact O-CA 3.26Å; I144-F147 WeakPolarHBondContact O-CB 3.41Å; I144-F147 PolarHBondContact O-N 3.49Å; T145-F147 VanDerWaalsContact C-N 3.26Å; T145-F147 PolarHBondContact O-N 2.96Å; F147-Y158 HydrophobicContact CE1-CD2 4.39Å; F147-Y158 WeakPolarHBondContact CZ-O 3.04Å |
| 148 | L | 76.6 | Confident | 69.6 | Low | 125 Ų | 125 | 80.5 Ų | 80.5 | 65% | 0.654 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -75.1 | -30.3 | -177.4 | -87.6 | 77.7 | 0 | 0 | 0 | 113.1 | I144 T145 | I144-L148 HydrophobicContact CG2-CD1 3.68Å; I144-L148 WeakPolarHBondContact O-CD1 3.39Å; I144-L148 PolarHBondContact O-N 2.82Å; T145-L148 PolarHBondContact O-N 3.46Å; T145-L148 VanDerWaalsContact O-N 3.12Å |
| 149 | T | 70.2 | Confident | 68.8 | Low | 108 Ų | 108 | 83.4 Ų | 83.4 | 66% | 0.663 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -85.3 | -13.8 | 179.3 | 56.2 | 0 | 0 | 0 | 0 | 113.5 | T145 D151 | T145-T149 WeakPolarHBondContact O-CG2 3.07Å; T145-T149 PolarHBondContact O-N 3.12Å; T145-T149 PolarHBondContact O-OG1 3.25Å; T149-D151 PolarHBondContact O-N 3.06Å; T149-D151 VanDerWaalsContact O-N 3.1Å |
| 150 | T | 59.8 | Low | 68.2 | Low | 66 Ų | 66 | 86.4 Ų | 86.4 | 41% | 0.405 | 47% | 0.465 | S | S | . | . | trans | -86.7 | 67.6 | 176.6 | -47.9 | 0 | 0 | 0 | 0 | 109.3 | A146 L152 | A146-T150 WeakPolarHBondContact O-CB 3.31Å; A146-T150 PolarHBondContact O-N 3.32Å; A146-T150 PolarHBondContact O-OG1 2.97Å; T150-L152 PolarHBondContact O-N 2.63Å | ||
| 151 | D | 53.2 | Low | 67.9 | Low | 141 Ų | 141 | 84.1 Ų | 84.1 | 75% | 0.754 | 45% | 0.451 | S | S | * | . | trans | -67.8 | 93.8 | 166.4 | -77.3 | -58.9 | 0 | 0 | 0 | 108.7 | T149 | T149-D151 PolarHBondContact O-N 3.06Å; T149-D151 VanDerWaalsContact O-N 3.1Å | ||
| 152 | L | 52.8 | Low | 67.8 | Low | 161 Ų | 161 | 81.7 Ų | 81.7 | 84% | 0.843 | 45% | 0.446 | S | S | * | . | S | Bend | trans | 76.6 | 120.7 | 170.5 | -51.6 | 153.1 | 0 | 0 | 0 | 115 | T150 | T150-L152 PolarHBondContact O-N 2.63Š|
| 153 | P | 51.2 | Low | 68 | Low | 77 Ų | 77 | 77.1 Ų | 77.1 | 50% | 0.5 | 43% | 0.425 | S | S | . | . | cis | -127.8 | 171.3 | 32.6 | 25.5 | -1.3 | 0 | 0 | 0 | 115.7 | W37 S155 | W37-P153 HydrophobicContact CZ2-CB 4.37Å; W37-P153 HydrophobicContact CZ2-CG 3.97Å; P153-S155 WeakPolarHBondContact CG-OG 3.49Å; P153-S155 PolarHBondContact O-N 2.88Å; P153-S155 PolarHBondContact O-OG 2.92Å | ||
| 154 | D | 53.2 | Low | 68.3 | Low | 156 Ų | 156 | 76.7 Ų | 76.7 | 83% | 0.834 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | 14.2 | -176.3 | -88.4 | -58 | 0 | 0 | 0 | 118.8 | ||
| 155 | S | 51.6 | Low | 68.7 | Low | 27 Ų | 27 | 76.3 Ų | 76.3 | 19% | 0.189 | 43% | 0.426 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -126.7 | 4.4 | -153 | 40.5 | 0 | 0 | 0 | 0 | 113.9 | W37 P153 | W37-S155 VanDerWaalsContact CE2-CB 3.48Å; W37-S155 WeakPolarHBondContact CZ2-OG 3.3Å; W37-S155 PolarHBondContact NE1-OG 2.83Å; P153-S155 WeakPolarHBondContact CG-OG 3.49Å; P153-S155 PolarHBondContact O-N 2.88Å; P153-S155 PolarHBondContact O-OG 2.92Å |
| 156 | S | 53.2 | Low | 69.2 | Low | 32 Ų | 32 | 76 Ų | 76 | 22% | 0.224 | 42% | 0.423 | C | S | . | . | trans | -125.4 | 67.8 | 164.7 | -173.7 | 0 | 0 | 0 | 0 | 110.2 | Y158 | S156-Y158 VanDerWaalsContact C-N 3.34Å; S156-Y158 WeakPolarHBondContact O-CD2 3.34Å; S156-Y158 PolarHBondContact O-N 2.98Å; S156-Y158 VanDerWaalsContact OG-CE2 3.24Å; S156-Y158 WeakPolarHBondContact OG-CE2 3.26Å; S156-Y158 VanDerWaalsContact OG-CZ 3.31Å | ||
| 157 | K | 58.8 | Low | 70.1 | Confident | 149 Ų | 149 | 75 Ų | 75 | 65% | 0.648 | 42% | 0.415 | S | S | * | . | trans | -66.9 | 93.7 | 168.8 | -71.5 | -176.9 | 177.6 | 179 | 0 | 108.6 | ||||
| 158 | Y | 62.1 | Low | 71 | Confident | 60 Ų | 60 | 75 Ų | 75 | 24% | 0.235 | 42% | 0.415 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.2 | 137.7 | 166.1 | -65.3 | -79.3 | 0 | 0 | 0 | 108.3 | K31 F147 S156 | K31-Y158 VanDerWaalsContact NZ-CD1 3.33Å; F147-Y158 HydrophobicContact CE1-CD2 4.39Å; F147-Y158 WeakPolarHBondContact CZ-O 3.04Å; S156-Y158 VanDerWaalsContact C-N 3.34Å; S156-Y158 WeakPolarHBondContact O-CD2 3.34Å; S156-Y158 PolarHBondContact O-N 2.98Å; S156-Y158 VanDerWaalsContact OG-CE2 3.24Å; S156-Y158 WeakPolarHBondContact OG-CE2 3.26Å; S156-Y158 VanDerWaalsContact OG-CZ 3.31Å |
| 159 | Q | 70.1 | Confident | 71.9 | Confident | 123 Ų | 123 | 73.6 Ų | 73.6 | 58% | 0.575 | 41% | 0.407 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 137.2 | 168.7 | -83.7 | 175.7 | 29.4 | 0 | 0 | 108.7 | V32 G161 | V32-Q159 PolarHBondContact N-O 3.4Å; V32-Q159 PolarHBondContact O-N 3.12Å; Q159-G161 PolarHBondContact O-N 3.39Å |
| 160 | P | 71.6 | Confident | 73.1 | Confident | 86 Ų | 86 | 68.6 Ų | 68.6 | 56% | 0.558 | 38% | 0.377 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -58.8 | 126.9 | 172.4 | 24.8 | -31.5 | 0 | 0 | 0 | 108.5 | L164 | P160-L164 HydrophobicContact CB-CD1 4.36Å |
| 161 | G | 78.9 | Confident | 74.8 | Confident | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 36% | 0.358 | C | S | . | . | trans | -67.2 | 150.7 | 180 | 0 | 0 | 0 | 0 | 0 | 111.4 | N29 W30 Q159 A163 L164 | N29-G161 CarbonylContact O-C 3.17Å; N29-G161 VanDerWaalsContact O-CA 3.31Å; N29-G161 WeakPolarHBondContact O-CA 3.14Å; W30-G161 WeakPolarHBondContact O-CA 3.49Å; W30-G161 PolarHBondContact O-N 3.46Å; Q159-G161 PolarHBondContact O-N 3.39Å; G161-A163 PolarHBondContact O-N 3.25Å; G161-A163 VanDerWaalsContact O-N 3.12Å; G161-L164 PolarHBondContact O-N 3.47Å; G161-L164 VanDerWaalsContact O-N 3.11Å | ||
| 162 | G | 84.2 | Confident | 76.8 | Confident | 35 Ų | 35 | 60.6 Ų | 60.6 | 36% | 0.361 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -59.9 | -24.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | N29 L164 C165 V166 | N29-G162 PolarHBondContact O-N 3.33Å; G162-L164 VanDerWaalsContact C-N 3.3Å; G162-L164 PolarHBondContact O-N 3.34Å; G162-C165 PolarHBondContact O-N 3.41Å; G162-V166 WeakPolarHBondContact O-CG2 3.45Å; G162-V166 PolarHBondContact O-N 3.06Å |
| 163 | A | 87 | Confident | 78.9 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.5 | -35 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L27 N29 W30 G161 C165 V166 T167 | L27-A163 HydrophobicContact CB-CB 4.25Å; N29-A163 WeakPolarHBondContact O-CB 3.44Å; N29-A163 PolarHBondContact O-N 3.2Å; W30-A163 HydrophobicContact CD2-CB 4.22Å; W30-A163 HydrophobicContact CG-CB 4.04Å; G161-A163 PolarHBondContact O-N 3.25Å; G161-A163 VanDerWaalsContact O-N 3.12Å; A163-C165 PolarHBondContact O-N 3.11Å; A163-V166 PolarHBondContact O-N 3.35Å; A163-T167 WeakPolarHBondContact O-CG2 3.49Å; A163-T167 PolarHBondContact O-N 3.41Å |
| 164 | L | 87.9 | Confident | 81 | Confident | 10 Ų | 10 | 53 Ų | 53 | 5% | 0.052 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.4 | -46.3 | 177.2 | -75.5 | 170 | 0 | 0 | 0 | 111.1 | W30 F139 P160 G161 G162 V166 T167 F168 | W30-L164 HydrophobicContact CE3-CD2 3.77Å; W30-L164 HydrophobicContact CE3-CG 4.3Å; W30-L164 HydrophobicContact CZ3-CD2 3.83Å; F139-L164 HydrophobicContact CB-CD2 3.8Å; F139-L164 HydrophobicContact CG-CD2 4.39Å; P160-L164 HydrophobicContact CB-CD1 4.36Å; G161-L164 PolarHBondContact O-N 3.47Å; G161-L164 VanDerWaalsContact O-N 3.11Å; G162-L164 VanDerWaalsContact C-N 3.3Å; G162-L164 PolarHBondContact O-N 3.34Å; L164-V166 VanDerWaalsContact C-N 3.28Å; L164-V166 PolarHBondContact O-N 3.07Å; L164-T167 PolarHBondContact O-N 2.92Å; L164-T167 VanDerWaalsContact O-N 3.09Å; L164-T167 PolarHBondContact O-OG1 3.49Å; L164-F168 VanDerWaalsContact O-CD2 3.26Å; L164-F168 WeakPolarHBondContact O-CD2 3.35Å; L164-F168 PolarHBondContact O-N 3.11Å; L164-F168 VanDerWaalsContact O-N 3.11Å |
| 165 | C | 90.1 | Very high | 83.1 | Confident | 75 Ų | 75 | 49 Ų | 49 | 51% | 0.507 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -58 | -43.1 | 176 | -63.7 | 0 | 0 | 0 | 0 | 111.7 | G162 A163 T167 F168 I169 | G162-C165 PolarHBondContact O-N 3.41Å; A163-C165 PolarHBondContact O-N 3.11Å; C165-T167 VanDerWaalsContact C-N 3.33Å; C165-T167 PolarHBondContact O-N 2.96Å; C165-F168 PolarHBondContact O-N 3.15Å; C165-I169 WeakPolarHBondContact O-CD1 3.24Å; C165-I169 VanDerWaalsContact O-CG1 3.26Å; C165-I169 WeakPolarHBondContact O-CG1 3.44Å; C165-I169 PolarHBondContact O-N 3.35Å |
| 166 | V | 92.3 | Very high | 85.2 | Confident | 48 Ų | 48 | 49.6 Ų | 49.6 | 29% | 0.291 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 177 | 179 | 0 | 0 | 0 | 0 | 111.3 | A24 G162 A163 L164 I169 A170 | A24-V166 HydrophobicContact CB-CG1 4.21Å; G162-V166 WeakPolarHBondContact O-CG2 3.45Å; G162-V166 PolarHBondContact O-N 3.06Å; A163-V166 PolarHBondContact O-N 3.35Å; L164-V166 VanDerWaalsContact C-N 3.28Å; L164-V166 PolarHBondContact O-N 3.07Å; V166-I169 PolarHBondContact O-N 3.17Å; V166-A170 WeakPolarHBondContact O-CB 3.46Å; V166-A170 PolarHBondContact O-N 3.44Å |
| 167 | T | 92.6 | Very high | 87.1 | Confident | 1 Ų | 1 | 48.1 Ų | 48.1 | 1% | 0.006 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.6 | -43.2 | 177.2 | 62.4 | 0 | 0 | 0 | 0 | 112.6 | A24 W30 M84 A163 L164 C165 A170 A171 | A24-T167 HydrophobicContact CB-CG2 3.45Å; A24-T167 VanDerWaalsContact CB-CG2 3.45Å; W30-T167 HydrophobicContact CH2-CG2 3.42Å; W30-T167 VanDerWaalsContact CH2-CG2 3.42Å; W30-T167 HydrophobicContact CZ2-CG2 3.83Å; W30-T167 HydrophobicContact CZ3-CG2 4.1Å; M84-T167 HydrophobicContact CE-CG2 4.05Å; A163-T167 WeakPolarHBondContact O-CG2 3.49Å; A163-T167 PolarHBondContact O-N 3.41Å; L164-T167 PolarHBondContact O-N 2.92Å; L164-T167 VanDerWaalsContact O-N 3.09Å; L164-T167 PolarHBondContact O-OG1 3.49Å; C165-T167 VanDerWaalsContact C-N 3.33Å; C165-T167 PolarHBondContact O-N 2.96Å; T167-A170 PolarHBondContact O-N 3.06Å; T167-A171 VanDerWaalsContact O-CB 3.27Å; T167-A171 WeakPolarHBondContact O-CB 3.32Å; T167-A171 PolarHBondContact O-N 3.24Å |
| 168 | F | 93.5 | Very high | 88.8 | Confident | 95 Ų | 95 | 41 Ų | 41 | 42% | 0.417 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -64.7 | -43.5 | 177.5 | -80 | -72.5 | 0 | 0 | 0 | 111.8 | L133 A136 L164 C165 A171 G172 | L133-F168 HydrophobicContact CD2-CD1 4.21Å; L133-F168 HydrophobicContact CD2-CE1 3.99Å; A136-F168 HydrophobicContact CB-CE1 4.37Å; A136-F168 HydrophobicContact CB-CE2 4.18Å; A136-F168 HydrophobicContact CB-CZ 3.98Å; L164-F168 VanDerWaalsContact O-CD2 3.26Å; L164-F168 WeakPolarHBondContact O-CD2 3.35Å; L164-F168 PolarHBondContact O-N 3.11Å; L164-F168 VanDerWaalsContact O-N 3.11Å; C165-F168 PolarHBondContact O-N 3.15Å; F168-A171 PolarHBondContact O-N 3.08Å; F168-G172 PolarHBondContact O-N 2.88Å |
| 169 | I | 95.1 | Very high | 90.3 | Very high | 96 Ų | 96 | 41.2 Ų | 41.2 | 49% | 0.492 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.8 | -46.4 | 176.6 | -65.8 | 166 | 0 | 0 | 0 | 110.2 | C165 V166 G172 F173 | C165-I169 WeakPolarHBondContact O-CD1 3.24Å; C165-I169 VanDerWaalsContact O-CG1 3.26Å; C165-I169 WeakPolarHBondContact O-CG1 3.44Å; C165-I169 PolarHBondContact O-N 3.35Å; V166-I169 PolarHBondContact O-N 3.17Å; I169-G172 PolarHBondContact O-N 3.3Å; I169-F173 HydrophobicContact CG2-CD2 3.93Å; I169-F173 HydrophobicContact CG2-CE1 4.48Å; I169-F173 HydrophobicContact CG2-CE2 3.37Å; I169-F173 HydrophobicContact CG2-CZ 3.69Å; I169-F173 WeakPolarHBondContact O-CG 3.38Å; I169-F173 PolarHBondContact O-N 3.23Å |
| 170 | A | 95.5 | Very high | 91.4 | Very high | 2 Ų | 2 | 37.2 Ų | 37.2 | 2% | 0.017 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.9 | -44.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | A21 V166 T167 G172 F173 L174 | A21-A170 HydrophobicContact CB-CB 4.43Å; V166-A170 WeakPolarHBondContact O-CB 3.46Å; V166-A170 PolarHBondContact O-N 3.44Å; T167-A170 PolarHBondContact O-N 3.06Å; A170-G172 VanDerWaalsContact C-N 3.31Å; A170-G172 PolarHBondContact O-N 3.02Å; A170-F173 PolarHBondContact O-N 3.04Å; A170-L174 WeakPolarHBondContact O-CG 3.21Å; A170-L174 PolarHBondContact O-N 3.49Å |
| 171 | A | 95.7 | Very high | 92.2 | Very high | 3 Ų | 3 | 33.1 Ų | 33.1 | 3% | 0.025 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.5 | -40.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | S129 C132 L133 T167 F168 L174 L175 | S129-A171 PolarHBondContact OG-O 3.13Å; C132-A171 HydrophobicContact CB-CB 4.29Å; L133-A171 HydrophobicContact CG-CB 4.21Å; T167-A171 VanDerWaalsContact O-CB 3.27Å; T167-A171 WeakPolarHBondContact O-CB 3.32Å; T167-A171 PolarHBondContact O-N 3.24Å; F168-A171 PolarHBondContact O-N 3.08Å; A171-L174 PolarHBondContact O-N 3.06Å; A171-L175 WeakPolarHBondContact O-CB 2.98Å; A171-L175 PolarHBondContact O-N 3.1Å |
| 172 | G | 96.1 | Very high | 92.7 | Very high | 36 Ų | 36 | 35 Ų | 35 | 37% | 0.371 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -62.6 | -43.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | F168 I169 A170 L175 A176 | F168-G172 PolarHBondContact O-N 2.88Å; I169-G172 PolarHBondContact O-N 3.3Å; A170-G172 VanDerWaalsContact C-N 3.31Å; A170-G172 PolarHBondContact O-N 3.02Å; G172-L175 PolarHBondContact O-N 2.75Å; G172-A176 WeakPolarHBondContact O-CB 3.22Å; G172-A176 PolarHBondContact O-N 3.42Å |
| 173 | F | 96.4 | Very high | 92.9 | Very high | 79 Ų | 79 | 38.9 Ų | 38.9 | 35% | 0.346 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -67 | -40.5 | 176.2 | -65.9 | -27.4 | 0 | 0 | 0 | 113 | L13 L16 I169 A170 G177 | L13-F173 HydrophobicContact CD2-CD1 4Å; L13-F173 HydrophobicContact CD2-CE1 4.46Å; L16-F173 HydrophobicContact CB-CD2 4.22Å; I169-F173 HydrophobicContact CG2-CD2 3.93Å; I169-F173 HydrophobicContact CG2-CE1 4.48Å; I169-F173 HydrophobicContact CG2-CE2 3.37Å; I169-F173 HydrophobicContact CG2-CZ 3.69Å; I169-F173 WeakPolarHBondContact O-CG 3.38Å; I169-F173 PolarHBondContact O-N 3.23Å; A170-F173 PolarHBondContact O-N 3.04Å; F173-G177 PolarHBondContact O-N 3.12Å |
| 174 | L | 95.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62 | -42.7 | 173 | -73.8 | 170.3 | 0 | 0 | 0 | 111.5 | V18 A91 F125 A170 A171 G178 | V18-L174 HydrophobicContact CG2-CD2 3.99Å; A91-L174 HydrophobicContact CB-CD2 4.38Å; F125-L174 HydrophobicContact CD1-CD2 3.9Å; F125-L174 HydrophobicContact CE1-CD2 4.39Å; A170-L174 WeakPolarHBondContact O-CG 3.21Å; A170-L174 PolarHBondContact O-N 3.49Å; A171-L174 PolarHBondContact O-N 3.06Å; L174-G178 PolarHBondContact O-N 3.21Å |
| 175 | L | 96.6 | Very high | 91.7 | Very high | 71 Ų | 71 | 39.7 Ų | 39.7 | 37% | 0.372 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -65.6 | -49.6 | 178.7 | -170.3 | 64.3 | 0 | 0 | 0 | 111.2 | V126 A171 G172 G177 G178 V179 | V126-L175 HydrophobicContact CG1-CD1 4.29Å; V126-L175 HydrophobicContact CG2-CD1 4.44Å; A171-L175 WeakPolarHBondContact O-CB 2.98Å; A171-L175 PolarHBondContact O-N 3.1Å; G172-L175 PolarHBondContact O-N 2.75Å; L175-G177 PolarHBondContact O-N 3.38Å; L175-G178 PolarHBondContact O-N 3.04Å; L175-V179 HydrophobicContact CD1-CG2 4.46Å; L175-V179 WeakPolarHBondContact O-CG2 3.4Å; L175-V179 PolarHBondContact O-N 2.89Å |
| 176 | A | 95.6 | Very high | 90.2 | Very high | 41 Ų | 41 | 41 Ų | 41 | 34% | 0.339 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60 | -47.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | G172 G178 V179 I180 | G172-A176 WeakPolarHBondContact O-CB 3.22Å; G172-A176 PolarHBondContact O-N 3.42Å; A176-G178 PolarHBondContact O-N 3.31Å; A176-V179 PolarHBondContact O-N 3.44Å; A176-I180 WeakPolarHBondContact O-CB 3.45Å; A176-I180 WeakPolarHBondContact O-CD1 3.42Å; A176-I180 WeakPolarHBondContact O-CG1 3.15Å; A176-I180 PolarHBondContact O-N 2.83Å |
| 177 | G | 93.8 | Very high | 88.2 | Confident | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.4 | -44.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | F173 L175 I180 F181 | F173-G177 PolarHBondContact O-N 3.12Å; L175-G177 PolarHBondContact O-N 3.38Å; G177-I180 PolarHBondContact O-N 3.06Å; G177-F181 WeakPolarHBondContact O-CB 3.5Å; G177-F181 PolarHBondContact O-N 3.4Å |
| 178 | G | 93.8 | Very high | 85.9 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.3 | -48.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | L174 L175 A176 I180 F181 C182 | L174-G178 PolarHBondContact O-N 3.21Å; L175-G178 PolarHBondContact O-N 3.04Å; A176-G178 PolarHBondContact O-N 3.31Å; G178-I180 PolarHBondContact O-N 3.31Å; G178-F181 WeakPolarHBondContact O-CB 3.44Å; G178-F181 PolarHBondContact O-N 2.88Å; G178-C182 PolarHBondContact O-N 2.75Å; G178-C182 PolarHBondContact O-SG 3.39Å |
| 179 | V | 93.7 | Very high | 83.7 | Confident | 65 Ų | 65 | 54.3 Ų | 54.3 | 39% | 0.394 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61.5 | -43.8 | 177.6 | 174.9 | 0 | 0 | 0 | 0 | 110.8 | L175 A176 F181 C182 L183 | L175-V179 HydrophobicContact CD1-CG2 4.46Å; L175-V179 WeakPolarHBondContact O-CG2 3.4Å; L175-V179 PolarHBondContact O-N 2.89Å; A176-V179 PolarHBondContact O-N 3.44Å; V179-F181 VanDerWaalsContact C-N 3.31Å; V179-F181 PolarHBondContact O-N 3.26Å; V179-C182 PolarHBondContact O-N 2.97Å; V179-L183 HydrophobicContact CG1-CD1 3.87Å; V179-L183 HydrophobicContact CG1-CG 4.28Å; V179-L183 VanDerWaalsContact O-CG 3.29Å; V179-L183 WeakPolarHBondContact O-CG 3.46Å; V179-L183 PolarHBondContact O-N 3.12Å |
| 180 | I | 92.1 | Very high | 81.4 | Confident | 39 Ų | 39 | 55 Ų | 55 | 20% | 0.2 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -64.6 | -37.4 | 177.7 | -62.3 | 163.5 | 0 | 0 | 0 | 111.1 | V6 A10 L13 A176 G177 G178 L183 S184 | V6-I180 HydrophobicContact CG1-CG2 3.45Å; V6-I180 VanDerWaalsContact CG1-CG2 3.45Å; A10-I180 HydrophobicContact CB-CB 3.88Å; A10-I180 HydrophobicContact CB-CG2 3.62Å; L13-I180 HydrophobicContact CD1-CD1 4.15Å; A176-I180 WeakPolarHBondContact O-CB 3.45Å; A176-I180 WeakPolarHBondContact O-CD1 3.42Å; A176-I180 WeakPolarHBondContact O-CG1 3.15Å; A176-I180 PolarHBondContact O-N 2.83Å; G177-I180 PolarHBondContact O-N 3.06Å; G178-I180 PolarHBondContact O-N 3.31Å; I180-L183 PolarHBondContact O-N 3.31Å; I180-S184 WeakPolarHBondContact O-CB 3.39Å; I180-S184 PolarHBondContact O-N 2.97Å; I180-S184 VanDerWaalsContact O-N 3.09Å; I180-S184 PolarHBondContact O-OG 3.42Å |
| 181 | F | 89.6 | Confident | 78.9 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.8 | -43.2 | 173.9 | -117.7 | -85.2 | 0 | 0 | 0 | 112 | A10 F11 A118 A121 G177 G178 V179 L183 S184 | A10-F181 HydrophobicContact CB-CD2 4Å; A10-F181 HydrophobicContact CB-CE2 4.45Å; F11-F181 HydrophobicContact CB-CE2 4.47Å; A118-F181 HydrophobicContact CB-CD1 3.98Å; A118-F181 HydrophobicContact CB-CE1 3.91Å; A118-F181 WeakPolarHBondContact O-CD1 3.42Å; A121-F181 HydrophobicContact CB-CD1 4.22Å; A121-F181 HydrophobicContact CB-CE1 4.25Å; G177-F181 WeakPolarHBondContact O-CB 3.5Å; G177-F181 PolarHBondContact O-N 3.4Å; G178-F181 WeakPolarHBondContact O-CB 3.44Å; G178-F181 PolarHBondContact O-N 2.88Å; V179-F181 VanDerWaalsContact C-N 3.31Å; V179-F181 PolarHBondContact O-N 3.26Å; F181-L183 PolarHBondContact O-N 2.62Å; F181-S184 WeakPolarHBondContact O-CB 3.13Å; F181-S184 PolarHBondContact O-N 3.3Å |
| 182 | C | 89.1 | Confident | 76 | Confident | 40 Ų | 40 | 63 Ų | 63 | 27% | 0.27 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.6 | -39.7 | 173.9 | -68.4 | 0 | 0 | 0 | 0 | 111.9 | M119 G122 G178 V179 S184 | M119-C182 WeakPolarHBondContact CE-O 3.42Å; M119-C182 HydrophobicContact SD-CB 4.47Å; G122-C182 VanDerWaalsContact C-SG 3.58Å; G178-C182 PolarHBondContact O-N 2.75Å; G178-C182 PolarHBondContact O-SG 3.39Å; V179-C182 PolarHBondContact O-N 2.97Å; C182-S184 VanDerWaalsContact C-N 3.26Å; C182-S184 PolarHBondContact O-N 2.91Å |
| 183 | L | 87.6 | Confident | 73.3 | Confident | 116 Ų | 116 | 67.2 Ų | 67.2 | 61% | 0.607 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -74.3 | -17.9 | 179.5 | -65.4 | 174.2 | 0 | 0 | 0 | 113 | L2 V179 I180 F181 C185 | L2-L183 WeakPolarHBondContact CD1-O 3.24Å; V179-L183 HydrophobicContact CG1-CD1 3.87Å; V179-L183 HydrophobicContact CG1-CG 4.28Å; V179-L183 VanDerWaalsContact O-CG 3.29Å; V179-L183 WeakPolarHBondContact O-CG 3.46Å; V179-L183 PolarHBondContact O-N 3.12Å; I180-L183 PolarHBondContact O-N 3.31Å; F181-L183 PolarHBondContact O-N 2.62Å; L183-C185 VanDerWaalsContact C-N 3.26Å; L183-C185 PolarHBondContact O-N 3.23Å |
| 184 | S | 81.1 | Confident | 70.9 | Confident | 6 Ų | 6 | 71.5 Ų | 71.5 | 4% | 0.042 | 45% | 0.447 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -18.5 | -174 | -70.9 | 0 | 0 | 0 | 0 | 114.8 | M1 L2 I180 F181 C182 | M1-S184 WeakPolarHBondContact CA-O 3.19Å; M1-S184 WeakPolarHBondContact CB-O 3.07Å; L2-S184 PolarHBondContact N-O 3.04Å; I180-S184 WeakPolarHBondContact O-CB 3.39Å; I180-S184 PolarHBondContact O-N 2.97Å; I180-S184 VanDerWaalsContact O-N 3.09Å; I180-S184 PolarHBondContact O-OG 3.42Å; F181-S184 WeakPolarHBondContact O-CB 3.13Å; F181-S184 PolarHBondContact O-N 3.3Å; C182-S184 VanDerWaalsContact C-N 3.26Å; C182-S184 PolarHBondContact O-N 2.91Å |
| 185 | C | 69.5 | Low | 68 | Low | 20 Ų | 20 | 76.5 Ų | 76.5 | 14% | 0.135 | 48% | 0.482 | C | S | . | . | trans | -109.1 | 111.5 | 174.4 | -56.8 | 0 | 0 | 0 | 0 | 112.1 | M1 M119 L183 G187 | M1-C185 HydrophobicContact CE-CB 4.43Å; M119-C185 HydrophobicContact CE-CB 3.58Å; M119-C185 WeakPolarHBondContact CE-O 3.48Å; M119-C185 HydrophobicContact CG-CB 4.39Å; L183-C185 VanDerWaalsContact C-N 3.26Å; L183-C185 PolarHBondContact O-N 3.23Å; C185-G187 PolarHBondContact O-N 2.93Å; C185-G187 VanDerWaalsContact O-N 3.09Å | ||
| 186 | P | 59.7 | Low | 65.4 | Low | 103 Ų | 103 | 79.8 Ų | 79.8 | 67% | 0.669 | 51% | 0.505 | S | S | * | . | trans | -77.8 | 89.9 | 164.3 | 30.1 | -28.4 | 0 | 0 | 0 | 108.2 | M1 | M1-P186 HydrophobicContact CG-CG 4.49Š| ||
| 187 | G | 50 | Low | 62.2 | Low | 52 Ų | 52 | 82.9 Ų | 82.9 | 54% | 0.536 | 52% | 0.524 | S | S | . | . | trans | -162.6 | 97.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | C185 | C185-G187 PolarHBondContact O-N 2.93Å; C185-G187 VanDerWaalsContact O-N 3.09Å | ||
| 188 | S | 44.4 | Very low | 59.1 | Low | 115 Ų | 115 | 88.7 Ų | 88.7 | 80% | 0.804 | 56% | 0.555 | S | S | * | * | trans | 52.7 | 98.7 | 175.8 | 65.2 | 0 | 0 | 0 | 0 | 116.8 | S190 | S188-S190 PolarHBondContact O-N 3.47Š| ||
| 189 | R | 46.6 | Very low | 56.3 | Low | 256 Ų | 256 | 93.6 Ų | 93.6 | 97% | 0.966 | 59% | 0.589 | S | S | * | * | trans | -45.7 | 112.2 | 150 | -80 | 177.4 | 172.4 | -160.4 | -3.5 | 109.2 | ||||
| 190 | S | 45.7 | Very low | 53.4 | Low | 111 Ų | 111 | 96.7 Ų | 96.7 | 78% | 0.776 | 60% | 0.604 | S | S | * | * | trans | -152.4 | 129.9 | 152.6 | -83.5 | 0 | 0 | 0 | 0 | 107.2 | S188 | S188-S190 PolarHBondContact O-N 3.47Š| ||
| 191 | A | 43.7 | Very low | 50.5 | Low | 105 Ų | 105 | 99.9 Ų | 99.9 | 87% | 0.868 | 63% | 0.629 | S | S | * | * | trans | 75.5 | 91.8 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 192 | G | 35.5 | Very low | 47.9 | Very low | 68 Ų | 68 | 108 Ų | 108 | 70% | 0.701 | 67% | 0.671 | S | S | * | * | trans | -63.3 | 170.8 | 150.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 193 | P | 39.7 | Very low | 45.1 | Very low | 124 Ų | 124 | 117.1 Ų | 117.1 | 81% | 0.805 | 70% | 0.7 | S | S | * | * | -114.1 | 150.4 | 95 | 32.4 | -31.4 | 0 | 0 | 0 | 111.4 | S195 | P193-S195 PolarHBondContact O-N 2.96Š| |||
| 194 | D | 44.5 | Very low | 42.3 | Very low | 169 Ų | 169 | 119.1 Ų | 119.1 | 90% | 0.904 | 71% | 0.71 | S | S | * | * | trans | -59.1 | 103.1 | 178.1 | -59.5 | -59.3 | 0 | 0 | 0 | 111.1 | ||||
| 195 | S | 36.8 | Very low | 40 | Very low | 105 Ų | 105 | 127.4 Ų | 127.4 | 73% | 0.734 | 75% | 0.748 | S | S | * | * | trans | -130.6 | 102.7 | 152.1 | 51.7 | 0 | 0 | 0 | 0 | 106.8 | P193 S197 | P193-S195 PolarHBondContact O-N 2.96Å; S195-S197 PolarHBondContact O-N 3.1Å | ||
| 196 | V | 40.4 | Very low | 38.2 | Very low | 140 Ų | 140 | 137.7 Ų | 137.7 | 85% | 0.848 | 78% | 0.784 | S | S | * | * | trans | -42.6 | 102.1 | 170.1 | 174 | 0 | 0 | 0 | 0 | 109.3 | N198 | V196-N198 HydrophobicContact CG1-CB 4.08Š| ||
| 197 | S | 29.9 | Very low | 36.7 | Very low | 106 Ų | 106 | 142.7 Ų | 142.7 | 74% | 0.741 | 79% | 0.79 | S | S | * | * | trans | -109 | 77.5 | 154.5 | -174.8 | 0 | 0 | 0 | 0 | 105.7 | S195 S199 | S195-S197 PolarHBondContact O-N 3.1Å; S197-S199 VanDerWaalsContact C-N 3.34Å; S197-S199 PolarHBondContact O-N 2.99Å | ||
| 198 | N | 28.5 | Very low | 35.6 | Very low | 122 Ų | 122 | 147.8 Ų | 147.8 | 65% | 0.652 | 80% | 0.799 | S | S | * | * | trans | -58.6 | 101.9 | 165.3 | -170.8 | 33.5 | 0 | 0 | 0 | 106.9 | V196 D200 | V196-N198 HydrophobicContact CG1-CB 4.08Å; N198-D200 PolarHBondContact O-N 2.61Å | ||
| 199 | S | 35 | Very low | 34.9 | Very low | 103 Ų | 103 | 150.3 Ų | 150.3 | 72% | 0.72 | 80% | 0.799 | S | S | * | * | trans | -68.9 | 89.7 | 161.5 | -67.3 | 0 | 0 | 0 | 0 | 107 | S197 | S197-S199 VanDerWaalsContact C-N 3.34Å; S197-S199 PolarHBondContact O-N 2.99Å | ||
| 200 | D | 32.2 | Very low | 34.1 | Very low | 131 Ų | 131 | 142.9 Ų | 142.9 | 70% | 0.701 | 78% | 0.783 | S | S | * | * | trans | -158.5 | 138.5 | 149.8 | -93.9 | -36.3 | 0 | 0 | 0 | 109.6 | N198 | N198-D200 PolarHBondContact O-N 2.61Š| ||
| 201 | S | 31.9 | Very low | 33 | Very low | 105 Ų | 105 | 147 Ų | 147 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | trans | 82.2 | 83 | 165.7 | 67.2 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 202 | I | 34.2 | Very low | 32.1 | Very low | 170 Ų | 170 | 148.5 Ų | 148.5 | 87% | 0.872 | 79% | 0.786 | S | S | * | * | -116 | 74.5 | 117.3 | -61.1 | -165.3 | 0 | 0 | 0 | 107 | |||||
| 203 | R | 30.1 | Very low | 31.5 | Very low | 233 Ų | 233 | 153.3 Ų | 153.3 | 88% | 0.879 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -87.9 | 117.4 | 148.4 | -165.9 | 177.6 | -162.8 | -164.7 | 3.8 | 104 | E205 | R203-E205 PolarHBondContact O-N 3.48Å; R203-E205 VanDerWaalsContact O-N 3.12Å |
| 204 | L | 29.9 | Very low | 31.4 | Very low | 157 Ų | 157 | 151.9 Ų | 151.9 | 82% | 0.822 | 78% | 0.781 | S | S | * | * | trans | -32.8 | 115.8 | 175.8 | -91.2 | 81.1 | 0 | 0 | 0 | 111.8 | R206 | L204-R206 PolarHBondContact O-N 2.78Š| ||
| 205 | E | 31.8 | Very low | 30.4 | Very low | 181 Ų | 181 | 153.9 Ų | 153.9 | 85% | 0.846 | 78% | 0.781 | S | S | * | * | trans | -71.7 | 109.5 | 164.7 | -158.2 | -159.9 | 108.2 | 0 | 0 | 107.9 | R203 | R203-E205 PolarHBondContact O-N 3.48Å; R203-E205 VanDerWaalsContact O-N 3.12Å | ||
| 206 | R | 32.5 | Very low | 30.2 | Very low | 235 Ų | 235 | 157.9 Ų | 157.9 | 89% | 0.887 | 79% | 0.788 | S | S | * | * | trans | -122.6 | 94.4 | 156.9 | -154.6 | -126.9 | -83.4 | -124.9 | 4.1 | 108.3 | L204 | L204-R206 PolarHBondContact O-N 2.78Š| ||
| 207 | R | 28.1 | Very low | 29.5 | Very low | 209 Ų | 209 | 160.9 Ų | 160.9 | 79% | 0.789 | 79% | 0.79 | S | S | * | * | trans | 56.1 | 122.9 | 154.4 | -96.6 | -158.9 | -175 | -80.2 | 3 | 120.6 | ||||
| 208 | Q | 26.4 | Very low | 29.2 | Very low | 158 Ų | 158 | 164.5 Ų | 164.5 | 74% | 0.738 | 79% | 0.792 | S | S | * | * | trans | -26.8 | 152.1 | 139.3 | -89.1 | 157.7 | -45.5 | 0 | 0 | 115.5 | ||||
| 209 | E | 29 | Very low | 29 | Very low | 168 Ų | 168 | 166.3 Ų | 166.3 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | cis | -164.7 | -167.7 | 33.4 | -132.5 | -149.3 | 127.4 | 0 | 0 | 111.7 | ||||
| 210 | P | 30.3 | Very low | 28.5 | Very low | 100 Ų | 100 | 169.9 Ų | 169.9 | 65% | 0.649 | 80% | 0.797 | S | S | * | * | -120 | -178.5 | -121.8 | 43.9 | -27.7 | 0 | 0 | 0 | 118.4 | |||||
| 211 | K | 22.6 | Very low | 28.4 | Very low | 197 Ų | 197 | 168.7 Ų | 168.7 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | trans | 92.3 | 122.8 | 146.2 | -151.5 | 171.8 | -172.1 | 174.7 | 0 | 119.6 | ||||
| 212 | V | 23.8 | Very low | 28.3 | Very low | 138 Ų | 138 | 170.2 Ų | 170.2 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | 156.9 | 128.3 | 127.1 | 168 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 213 | E | 23.7 | Very low | 28 | Very low | 169 Ų | 169 | 173.2 Ų | 173.2 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | trans | -80.1 | -170.3 | 179.9 | -154.3 | -159.1 | 86 | 0 | 0 | 112.1 | ||||
| 214 | P | 37.8 | Very low | 27.9 | Very low | 94 Ų | 94 | 169.5 Ų | 169.5 | 61% | 0.61 | 80% | 0.801 | S | S | * | * | -104.3 | 175.7 | -91.8 | 37.2 | -24.5 | 0 | 0 | 0 | 113 | |||||
| 215 | K | 24 | Very low | 27.8 | Very low | 210 Ų | 210 | 170.6 Ų | 170.6 | 91% | 0.913 | 80% | 0.802 | S | S | * | * | trans | -158.5 | 127.6 | 137.2 | -80.9 | -144.1 | 176.7 | 177.4 | 0 | 114.3 | ||||
| 216 | Q | 30.9 | Very low | 27.5 | Very low | 189 Ų | 189 | 167.9 Ų | 167.9 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | -56.6 | 149.3 | 161.7 | -69.1 | -173.2 | -19.5 | 0 | 0 | 114.1 | ||||
| 217 | K | 27.4 | Very low | 27.1 | Very low | 204 Ų | 204 | 164.9 Ų | 164.9 | 89% | 0.887 | 80% | 0.799 | S | S | * | * | trans | -169.6 | 104 | 143.6 | -104.2 | 174.3 | -176.7 | -177.3 | 0 | 107.4 | ||||
| 218 | K | 23.8 | Very low | 27.1 | Very low | 181 Ų | 181 | 162.7 Ų | 162.7 | 79% | 0.787 | 80% | 0.798 | S | S | * | * | 74.1 | 124.2 | 75.1 | -158.9 | 176.9 | -165.6 | 174.1 | 0 | 114 | |||||
| 219 | K | 23 | Very low | 27.3 | Very low | 161 Ų | 161 | 162.3 Ų | 162.3 | 70% | 0.7 | 81% | 0.806 | S | S | * | * | trans | 74.9 | 146.7 | 154.7 | -91.2 | 175.7 | 174.3 | -178.3 | 0 | 116.5 | ||||
| 220 | K | 25.4 | Very low | 27.1 | Very low | 177 Ų | 177 | 164.1 Ų | 164.1 | 77% | 0.77 | 81% | 0.806 | S | S | * | * | cis | -168.3 | 153.7 | 2.5 | -141.6 | 171.6 | -177 | -163.6 | 0 | 107.8 | ||||
| 221 | S | 30.5 | Very low | 26.9 | Very low | 107 Ų | 107 | 168.4 Ų | 168.4 | 75% | 0.748 | 82% | 0.817 | S | S | * | * | trans | -43.1 | 142.5 | 163.4 | 171.1 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 222 | V | 28.2 | Very low | 27.1 | Very low | 137 Ų | 137 | 167.1 Ų | 167.1 | 83% | 0.83 | 81% | 0.814 | S | S | * | * | trans | -155.8 | 124 | 139 | 179 | 0 | 0 | 0 | 0 | 110 | ||||
| 223 | R | 29.3 | Very low | 27.1 | Very low | 232 Ų | 232 | 168.6 Ų | 168.6 | 88% | 0.875 | 81% | 0.809 | S | S | * | * | trans | -84.1 | 142.9 | 156.4 | -85.3 | -165.8 | -170.3 | -164.3 | 4.5 | 108.9 | ||||
| 224 | L | 27.6 | Very low | 27.3 | Very low | 156 Ų | 156 | 166.8 Ų | 166.8 | 82% | 0.817 | 81% | 0.81 | S | S | * | * | trans | -176.5 | 104.5 | 140.3 | -120.8 | 77.5 | 0 | 0 | 0 | 107 | ||||
| 225 | Q | 28.3 | Very low | 26.9 | Very low | 180 Ų | 180 | 168 Ų | 168 | 84% | 0.841 | 82% | 0.815 | S | S | * | * | 44.3 | 116.8 | 105.6 | -98 | -178 | -31.4 | 0 | 0 | 115.1 | |||||
| 226 | T | 24.8 | Very low | 27.2 | Very low | 124 Ų | 124 | 165.2 Ų | 165.2 | 76% | 0.761 | 81% | 0.81 | S | S | * | * | 170.1 | 116.2 | 116.7 | -66.5 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 227 | D | 24.9 | Very low | 27 | Very low | 172 Ų | 172 | 162.8 Ų | 162.8 | 92% | 0.92 | 80% | 0.803 | S | S | * | * | trans | -140.7 | 96.6 | 154.1 | -93.6 | -40.4 | 0 | 0 | 0 | 107.3 | ||||
| 228 | E | 28.2 | Very low | 27 | Very low | 163 Ų | 163 | 163.1 Ų | 163.1 | 76% | 0.762 | 80% | 0.798 | S | S | * | * | trans | -90.9 | 114.2 | 157.2 | -106.1 | -151.5 | 100.5 | 0 | 0 | 107.2 | ||||
| 229 | V | 29 | Very low | 27.2 | Very low | 149 Ų | 149 | 163.3 Ų | 163.3 | 90% | 0.903 | 80% | 0.802 | S | S | * | * | trans | -140.3 | 123.2 | 135.8 | -179.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 230 | R | 25 | Very low | 27.3 | Very low | 206 Ų | 206 | 164.2 Ų | 164.2 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | trans | -100.9 | 127.7 | -173.4 | 176.2 | 171.1 | -152.5 | -166.9 | 4.7 | 110.3 | ||||
| 231 | Q | 26.4 | Very low | 27.6 | Very low | 190 Ų | 190 | 162.9 Ų | 162.9 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | trans | -168.9 | 135.1 | 153.9 | -104.5 | -175.8 | -11.4 | 0 | 0 | 106.2 | ||||
| 232 | E | 28 | Very low | 28.1 | Very low | 171 Ų | 171 | 162.4 Ų | 162.4 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | cis | -159.4 | 143.2 | -17.2 | 174.5 | 168.9 | 92.1 | 0 | 0 | 104.7 | ||||
| 233 | K | 23.7 | Very low | 28.1 | Very low | 168 Ų | 168 | 162.9 Ų | 162.9 | 73% | 0.73 | 79% | 0.794 | S | S | * | * | trans | -5.5 | 132.3 | 168.4 | -68.3 | 164.8 | 178.2 | 174.9 | 0 | 118.5 | ||||
| 234 | T | 27.3 | Very low | 28.1 | Very low | 132 Ų | 132 | 159.8 Ų | 159.8 | 81% | 0.81 | 79% | 0.787 | S | S | * | * | -171.2 | 105.1 | 92.2 | -64.7 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 235 | V | 29.3 | Very low | 28.2 | Very low | 118 Ų | 118 | 159.7 Ų | 159.7 | 72% | 0.715 | 79% | 0.787 | S | S | * | * | 53.5 | 90.4 | 85.7 | -176.4 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 236 | L | 29.4 | Very low | 28.8 | Very low | 153 Ų | 153 | 158.6 Ų | 158.6 | 80% | 0.801 | 79% | 0.786 | S | S | * | * | 117.9 | 133.5 | 106.3 | -157.7 | 74.5 | 0 | 0 | 0 | 106.5 | |||||
| 237 | D | 26.7 | Very low | 29.2 | Very low | 137 Ų | 137 | 161.5 Ų | 161.5 | 73% | 0.733 | 79% | 0.788 | S | S | * | * | cis | -152 | 166.5 | 28.6 | -149.5 | -32.8 | 0 | 0 | 0 | 110.7 | ||||
| 238 | R | 27.3 | Very low | 29.5 | Very low | 211 Ų | 211 | 160 Ų | 160 | 80% | 0.796 | 78% | 0.78 | S | S | * | * | trans | -93.9 | 133 | -167.5 | 176.2 | -147.2 | -134.1 | -129.5 | 12.4 | 110.8 | ||||
| 239 | Q | 28.2 | Very low | 29.6 | Very low | 186 Ų | 186 | 158.7 Ų | 158.7 | 87% | 0.869 | 78% | 0.779 | S | S | * | * | -164.7 | 116.7 | 129.8 | -123.4 | 159.3 | -92.7 | 0 | 0 | 116 | |||||
| 240 | K | 26.5 | Very low | 30 | Very low | 180 Ų | 180 | 162.1 Ų | 162.1 | 78% | 0.783 | 78% | 0.777 | S | S | * | * | trans | -33.9 | 155.3 | 142 | -91.3 | -173.6 | -178.2 | -166.6 | 0 | 112.9 | ||||
| 241 | L | 31.3 | Very low | 30.4 | Very low | 148 Ų | 148 | 157.4 Ų | 157.4 | 78% | 0.775 | 78% | 0.775 | S | S | * | * | cis | -174.2 | -156.7 | 5.3 | -163.1 | 83 | 0 | 0 | 0 | 105.2 | ||||
| 242 | P | 39.7 | Very low | 31.1 | Very low | 97 Ų | 97 | 155 Ų | 155 | 63% | 0.63 | 77% | 0.768 | S | S | * | * | -120.1 | 177.6 | -107.7 | 43.7 | -26.3 | 0 | 0 | 0 | 117.7 | |||||
| 243 | Q | 28.8 | Very low | 31.7 | Very low | 148 Ų | 148 | 155 Ų | 155 | 69% | 0.692 | 77% | 0.768 | S | S | * | * | trans | 61.2 | 121.3 | 135 | -166.3 | -176.4 | -56.8 | 0 | 0 | 122.7 | ||||
| 244 | K | 28.7 | Very low | 32.6 | Very low | 167 Ų | 167 | 154.6 Ų | 154.6 | 73% | 0.726 | 77% | 0.769 | S | S | * | * | trans | 64.7 | 114.3 | 148.3 | -73.9 | 171.6 | -165.2 | 162 | 0 | 118.9 | ||||
| 245 | D | 30.6 | Very low | 33.2 | Very low | 154 Ų | 154 | 158.4 Ų | 158.4 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | trans | -154.4 | 119.1 | 132 | -88.3 | -48.7 | 0 | 0 | 0 | 106.5 | ||||
| 246 | L | 41.2 | Very low | 33.8 | Very low | 157 Ų | 157 | 163.1 Ų | 163.1 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | 98.7 | 97 | 80.7 | -157.5 | 76.3 | 0 | 0 | 0 | 109.4 | |||||
| 247 | K | 32.3 | Very low | 34 | Very low | 184 Ų | 184 | 163.7 Ų | 163.7 | 80% | 0.8 | 80% | 0.798 | S | S | * | * | trans | -38 | 120.8 | 159.5 | -172.8 | 166.1 | -178.7 | -179 | 0 | 112 | ||||
| 248 | D | 31.6 | Very low | 34.4 | Very low | 140 Ų | 140 | 165.1 Ų | 165.1 | 75% | 0.749 | 80% | 0.802 | S | S | * | * | 166.8 | 153.7 | 128.9 | -83.4 | -29.7 | 0 | 0 | 0 | 111.1 | |||||
| 249 | N | 29.8 | Very low | 34.8 | Very low | 137 Ų | 137 | 162.5 Ų | 162.5 | 73% | 0.733 | 80% | 0.802 | S | S | * | * | trans | 79 | 107.4 | 178.9 | -65.2 | -17.5 | 0 | 0 | 0 | 117.4 | ||||
| 250 | Y | 37.8 | Very low | 35.2 | Very low | 221 Ų | 221 | 161.1 Ų | 161.1 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | -168 | 122 | 80.6 | -106.8 | -86.9 | 0 | 0 | 0 | 110.3 | |||||
| 251 | S | 34.3 | Very low | 35.7 | Very low | 106 Ų | 106 | 159.9 Ų | 159.9 | 74% | 0.741 | 80% | 0.799 | S | S | * | * | trans | -68.8 | 157.4 | 163 | -62.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 252 | L | 41.4 | Very low | 36 | Very low | 141 Ų | 141 | 160.7 Ų | 160.7 | 74% | 0.738 | 80% | 0.801 | S | S | * | * | trans | 77.2 | 100.1 | 147.8 | -103 | 164.9 | 0 | 0 | 0 | 119.5 | E254 | L252-E254 HydrophobicContact CD2-CB 4.4Å; L252-E254 HydrophobicContact CD2-CG 4.28Å | ||
| 253 | Q | 40.1 | Very low | 35.8 | Very low | 170 Ų | 170 | 165.3 Ų | 165.3 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | -159.6 | 91.5 | 128.7 | -131.8 | -175.6 | -23.1 | 0 | 0 | 107 | |||||
| 254 | E | 41.5 | Very low | 36.3 | Very low | 160 Ų | 160 | 166.6 Ų | 166.6 | 75% | 0.748 | 82% | 0.822 | S | S | * | * | 34.5 | 103.2 | 95.5 | -102.9 | -169.8 | 98.9 | 0 | 0 | 113.5 | L252 | L252-E254 HydrophobicContact CD2-CB 4.4Å; L252-E254 HydrophobicContact CD2-CG 4.28Å | |||
| 255 | Y | 40.8 | Very low | 37 | Very low | 211 Ų | 211 | 166.6 Ų | 166.6 | 83% | 0.827 | 83% | 0.83 | S | S | * | * | trans | -161.4 | 114.1 | 137.2 | -97.4 | -75.5 | 0 | 0 | 0 | 108.9 | ||||
| 256 | V | 42.1 | Very low | 37.5 | Very low | 218 Ų | 218 | 167.7 Ų | 167.7 | 100% | 1.321 | 83% | 0.831 | S | S | * | * | trans | 79.6 | 0 | 168 | -161.1 | 0 | 0 | 0 | 0 | 118 |
Retrieved 256 of 256 residues in 216.7 ms
(Link to these results)