| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 48.5 | Very low | 67.4 | Low | 170 Ų | 170 | 83.5 Ų | 83.5 | 84% | 0.837 | 44% | 0.436 | S | S | * | . | 0 | -77.2 | 0 | -54.5 | -152.6 | -85 | 0 | 0 | 113.2 | V3 E4 E5 | M1-V3 PolarHBondContact O-N 3.37Å; M1-E4 PolarHBondContact N-OE2 2.92Å; M1-E5 PolarHBondContact O-N 2.84Å | |||
| 2 | P | 62.2 | Low | 67.3 | Low | 102 Ų | 102 | 77.2 Ų | 77.2 | 66% | 0.662 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -70.7 | -28.4 | -174.7 | 26.6 | -33.7 | 0 | 0 | 0 | 114.4 | F6 | P2-F6 VanDerWaalsContact O-CB 3.26Å; P2-F6 WeakPolarHBondContact O-CB 3.42Å; P2-F6 PolarHBondContact O-N 3.26Å; P2-F6 VanDerWaalsContact O-N 3.15Å |
| 3 | V | 69.4 | Low | 67.3 | Low | 102 Ų | 102 | 72.5 Ų | 72.5 | 62% | 0.618 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -77.1 | -39.4 | -179.8 | -177.2 | 0 | 0 | 0 | 0 | 111.7 | M1 F6 V7 | M1-V3 PolarHBondContact O-N 3.37Å; V3-F6 WeakPolarHBondContact O-CB 3.28Å; V3-F6 PolarHBondContact O-N 3.16Å; V3-V7 HydrophobicContact CG1-CG2 4.26Å; V3-V7 WeakPolarHBondContact O-CB 3.49Å; V3-V7 WeakPolarHBondContact O-CG2 3.3Å; V3-V7 PolarHBondContact O-N 3.43Å |
| 4 | E | 70.3 | Confident | 67.5 | Low | 91 Ų | 91 | 68.4 Ų | 68.4 | 43% | 0.425 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -67 | -42.4 | 177.9 | -69.9 | 148.3 | 160.6 | 0 | 0 | 111.3 | M1 F6 V7 A8 W287 | M1-E4 PolarHBondContact N-OE2 2.92Å; E4-F6 VanDerWaalsContact C-N 3.31Å; E4-F6 PolarHBondContact O-N 3.03Å; E4-V7 PolarHBondContact O-N 3.28Å; E4-A8 VanDerWaalsContact O-CB 3.22Å; E4-A8 WeakPolarHBondContact O-CB 3.42Å; E4-A8 PolarHBondContact O-N 3.33Å; E4-W287 HydrophobicContact CB-CE3 4.4Å |
| 5 | E | 66.9 | Low | 67.7 | Low | 107 Ų | 107 | 68.5 Ų | 68.5 | 50% | 0.5 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.5 | -39.2 | 173.3 | -71.2 | 177 | -168.1 | 0 | 0 | 111.8 | M1 G9 | M1-E5 PolarHBondContact O-N 2.84Å; E5-G9 PolarHBondContact O-N 2.93Å |
| 6 | F | 67.6 | Low | 67.5 | Low | 113 Ų | 113 | 64.4 Ų | 64.4 | 50% | 0.496 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.4 | -44.7 | 175.5 | -178.3 | -95.1 | 0 | 0 | 0 | 112.2 | P2 V3 E4 G9 W10 | P2-F6 VanDerWaalsContact O-CB 3.26Å; P2-F6 WeakPolarHBondContact O-CB 3.42Å; P2-F6 PolarHBondContact O-N 3.26Å; P2-F6 VanDerWaalsContact O-N 3.15Å; V3-F6 WeakPolarHBondContact O-CB 3.28Å; V3-F6 PolarHBondContact O-N 3.16Å; E4-F6 VanDerWaalsContact C-N 3.31Å; E4-F6 PolarHBondContact O-N 3.03Å; F6-G9 PolarHBondContact O-N 3.4Å; F6-W10 WeakPolarHBondContact O-CB 3.4Å; F6-W10 PolarHBondContact O-N 3.4Å |
| 7 | V | 74 | Confident | 67.5 | Low | 50 Ų | 50 | 62.6 Ų | 62.6 | 30% | 0.303 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -68.2 | -41.5 | 178.1 | 175.9 | 0 | 0 | 0 | 0 | 110.6 | V3 E4 G9 W10 I11 W287 | V3-V7 HydrophobicContact CG1-CG2 4.26Å; V3-V7 WeakPolarHBondContact O-CB 3.49Å; V3-V7 WeakPolarHBondContact O-CG2 3.3Å; V3-V7 PolarHBondContact O-N 3.43Å; E4-V7 PolarHBondContact O-N 3.28Å; V7-G9 VanDerWaalsContact C-N 3.34Å; V7-G9 PolarHBondContact O-N 3.4Å; V7-W10 PolarHBondContact O-N 3.29Å; V7-I11 HydrophobicContact CG1-CD1 3.74Å; V7-I11 HydrophobicContact CG1-CG1 4.34Å; V7-I11 VanDerWaalsContact O-CG1 3.32Å; V7-I11 WeakPolarHBondContact O-CG1 3.36Å; V7-I11 PolarHBondContact O-N 3.47Å; V7-W287 HydrophobicContact CB-CH2 4.27Å; V7-W287 HydrophobicContact CB-CZ3 4.38Å; V7-W287 HydrophobicContact CG1-CH2 3.6Å; V7-W287 HydrophobicContact CG1-CZ3 4.13Å |
| 8 | A | 70 | Confident | 67.7 | Low | 0 Ų | 0 | 61.6 Ų | 61.6 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -62 | -41.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | E4 S12 Y280 L283 W287 | E4-A8 VanDerWaalsContact O-CB 3.22Å; E4-A8 WeakPolarHBondContact O-CB 3.42Å; E4-A8 PolarHBondContact O-N 3.33Å; A8-S12 VanDerWaalsContact O-CB 3.27Å; A8-S12 WeakPolarHBondContact O-CB 3.36Å; A8-S12 PolarHBondContact O-N 3.48Å; A8-S12 PolarHBondContact O-OG 3.44Å; A8-Y280 HydrophobicContact CB-CD2 4.24Å; A8-Y280 HydrophobicContact CB-CE2 4.29Å; A8-L283 HydrophobicContact CB-CB 4.05Å; A8-L283 HydrophobicContact CB-CD1 4.4Å; A8-W287 HydrophobicContact CB-CE3 4.41Å; A8-W287 HydrophobicContact CB-CZ3 4.01Å |
| 9 | G | 66.1 | Low | 67.7 | Low | 28 Ų | 28 | 62.5 Ų | 62.5 | 29% | 0.289 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.9 | -38.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | E5 F6 V7 S12 G13 | E5-G9 PolarHBondContact O-N 2.93Å; F6-G9 PolarHBondContact O-N 3.4Å; V7-G9 VanDerWaalsContact C-N 3.34Å; V7-G9 PolarHBondContact O-N 3.4Å; G9-S12 WeakPolarHBondContact CA-OG 3.46Å; G9-S12 PolarHBondContact O-OG 3.36Å; G9-S12 VanDerWaalsContact O-OG 3.05Å; G9-G13 PolarHBondContact O-N 2.97Å |
| 10 | W | 72.4 | Confident | 67.6 | Low | 104 Ų | 104 | 59.4 Ų | 59.4 | 39% | 0.394 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -68.9 | -46.7 | 177.3 | -175.4 | 66.1 | 0 | 0 | 0 | 112.6 | F6 V7 G13 A14 I66 | F6-W10 WeakPolarHBondContact O-CB 3.4Å; F6-W10 PolarHBondContact O-N 3.4Å; V7-W10 PolarHBondContact O-N 3.29Å; W10-G13 PolarHBondContact O-N 2.94Å; W10-A14 WeakPolarHBondContact O-CB 3.42Å; W10-A14 PolarHBondContact O-N 3.2Å; W10-I66 VanDerWaalsContact CD1-CG2 3.47Å |
| 11 | I | 73.4 | Confident | 67.7 | Low | 52 Ų | 52 | 56.6 Ų | 56.6 | 27% | 0.267 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -65.9 | -44.6 | 179.8 | -65 | 169 | 0 | 0 | 0 | 110.8 | V7 G13 A14 L15 L283 W287 | V7-I11 HydrophobicContact CG1-CD1 3.74Å; V7-I11 HydrophobicContact CG1-CG1 4.34Å; V7-I11 VanDerWaalsContact O-CG1 3.32Å; V7-I11 WeakPolarHBondContact O-CG1 3.36Å; V7-I11 PolarHBondContact O-N 3.47Å; I11-G13 VanDerWaalsContact C-N 3.35Å; I11-G13 PolarHBondContact O-N 2.91Å; I11-A14 PolarHBondContact O-N 3.42Å; I11-L15 HydrophobicContact CG2-CD1 3.98Å; I11-L15 WeakPolarHBondContact O-CG 3.37Å; I11-L15 PolarHBondContact O-N 3Å; I11-L283 HydrophobicContact CB-CD1 3.81Å; I11-L283 HydrophobicContact CD1-CD1 4.44Å; I11-L283 HydrophobicContact CG2-CD1 3.68Å; I11-W287 HydrophobicContact CD1-CH2 4.13Å |
| 12 | S | 67.3 | Low | 68.6 | Low | 7 Ų | 7 | 50 Ų | 50 | 5% | 0.049 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.4 | -41.7 | 176.1 | 57 | 0 | 0 | 0 | 0 | 111.9 | A8 G9 L15 G16 | A8-S12 VanDerWaalsContact O-CB 3.27Å; A8-S12 WeakPolarHBondContact O-CB 3.36Å; A8-S12 PolarHBondContact O-N 3.48Å; A8-S12 PolarHBondContact O-OG 3.44Å; G9-S12 WeakPolarHBondContact CA-OG 3.46Å; G9-S12 PolarHBondContact O-OG 3.36Å; G9-S12 VanDerWaalsContact O-OG 3.05Å; S12-L15 PolarHBondContact O-N 3.42Å; S12-G16 PolarHBondContact O-N 3.43Å |
| 13 | G | 66.8 | Low | 68.9 | Low | 16 Ų | 16 | 49.1 Ų | 49.1 | 17% | 0.165 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.2 | -42.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | G9 W10 I11 L17 | G9-G13 PolarHBondContact O-N 2.97Å; W10-G13 PolarHBondContact O-N 2.94Å; I11-G13 VanDerWaalsContact C-N 3.35Å; I11-G13 PolarHBondContact O-N 2.91Å; G13-L17 WeakPolarHBondContact O-CB 3.42Å; G13-L17 PolarHBondContact O-N 2.92Å |
| 14 | A | 69.8 | Low | 68.9 | Low | 15 Ų | 15 | 45.5 Ų | 45.5 | 12% | 0.124 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.2 | -44.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | W10 I11 L17 V18 I63 | W10-A14 WeakPolarHBondContact O-CB 3.42Å; W10-A14 PolarHBondContact O-N 3.2Å; I11-A14 PolarHBondContact O-N 3.42Å; A14-L17 WeakPolarHBondContact O-CB 3.16Å; A14-L17 PolarHBondContact O-N 2.95Å; A14-V18 WeakPolarHBondContact O-CG2 3.34Å; A14-V18 PolarHBondContact O-N 2.87Å; A14-I63 HydrophobicContact CB-CG2 4.25Å |
| 15 | L | 70.2 | Confident | 68.7 | Low | 71 Ų | 71 | 41.6 Ų | 41.6 | 37% | 0.372 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -64.1 | -43.7 | 177.1 | -74.5 | 168.5 | 0 | 0 | 0 | 112.4 | I11 S12 L17 V18 L19 S279 | I11-L15 HydrophobicContact CG2-CD1 3.98Å; I11-L15 WeakPolarHBondContact O-CG 3.37Å; I11-L15 PolarHBondContact O-N 3Å; S12-L15 PolarHBondContact O-N 3.42Å; L15-L17 VanDerWaalsContact C-N 3.26Å; L15-L17 PolarHBondContact O-N 3.01Å; L15-V18 PolarHBondContact O-N 3.14Å; L15-L19 PolarHBondContact O-N 2.71Å; L15-L19 VanDerWaalsContact O-N 3.11Å; L15-S279 WeakPolarHBondContact CD1-OG 3.44Å |
| 16 | G | 65.6 | Low | 68.7 | Low | 2 Ų | 2 | 37 Ų | 37 | 2% | 0.021 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.8 | -39.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S12 G20 | S12-G16 PolarHBondContact O-N 3.43Å; G16-G20 PolarHBondContact O-N 3.34Å |
| 17 | L | 67.6 | Low | 68.6 | Low | 34 Ų | 34 | 32.6 Ų | 32.6 | 18% | 0.178 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -67.8 | -42.9 | 176.1 | -158.1 | 101.9 | 0 | 0 | 0 | 112.2 | G13 A14 L15 L19 G20 H21 M59 P62 I63 I66 | G13-L17 WeakPolarHBondContact O-CB 3.42Å; G13-L17 PolarHBondContact O-N 2.92Å; A14-L17 WeakPolarHBondContact O-CB 3.16Å; A14-L17 PolarHBondContact O-N 2.95Å; L15-L17 VanDerWaalsContact C-N 3.26Å; L15-L17 PolarHBondContact O-N 3.01Å; L17-L19 VanDerWaalsContact C-N 3.26Å; L17-L19 PolarHBondContact O-N 3.28Å; L17-G20 PolarHBondContact O-N 3.16Å; L17-H21 VanDerWaalsContact O-CB 3.29Å; L17-H21 WeakPolarHBondContact O-CB 3.37Å; L17-H21 PolarHBondContact O-N 3.48Å; L17-M59 HydrophobicContact CD2-CG 4.48Å; L17-P62 HydrophobicContact CD2-CB 3.27Å; L17-P62 HydrophobicContact CD2-CG 4.35Å; L17-P62 HydrophobicContact CG-CB 4.48Å; L17-I63 HydrophobicContact CD2-CG1 3.86Å; L17-I66 HydrophobicContact CD1-CD1 4.47Å |
| 18 | V | 70.8 | Confident | 68.2 | Low | 45 Ų | 45 | 32.4 Ų | 32.4 | 27% | 0.273 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -55.9 | -42.7 | 177 | 168.6 | 0 | 0 | 0 | 0 | 111 | A14 L15 P22 F56 M59 I63 | A14-V18 WeakPolarHBondContact O-CG2 3.34Å; A14-V18 PolarHBondContact O-N 2.87Å; L15-V18 PolarHBondContact O-N 3.14Å; V18-P22 WeakPolarHBondContact O-CD 3.37Å; V18-F56 HydrophobicContact CG1-CE1 3.85Å; V18-M59 HydrophobicContact CB-CE 4.43Å; V18-M59 HydrophobicContact CB-SD 4.22Å; V18-M59 HydrophobicContact CG2-CE 4.48Å; V18-M59 HydrophobicContact CG2-SD 3.68Å; V18-I63 HydrophobicContact CG2-CD1 3.79Å |
| 19 | L | 68.1 | Low | 68 | Low | 79 Ų | 79 | 33.1 Ų | 33.1 | 41% | 0.414 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -79.7 | -30.8 | 179.2 | -70.2 | 172.8 | 0 | 0 | 0 | 114 | L15 L17 P22 V275 | L15-L19 PolarHBondContact O-N 2.71Å; L15-L19 VanDerWaalsContact O-N 3.11Å; L17-L19 VanDerWaalsContact C-N 3.26Å; L17-L19 PolarHBondContact O-N 3.28Å; L19-P22 WeakPolarHBondContact O-CD 3.24Å; L19-V275 HydrophobicContact CD1-CB 3.45Å; L19-V275 VanDerWaalsContact CD1-CB 3.45Å; L19-V275 HydrophobicContact CD1-CG1 3.4Å; L19-V275 VanDerWaalsContact CD1-CG1 3.4Å; L19-V275 HydrophobicContact CD1-CG2 3.42Å; L19-V275 VanDerWaalsContact CD1-CG2 3.42Å |
| 20 | G | 65.5 | Low | 67.8 | Low | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -77.9 | -23 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | G16 L17 F23 D24 V272 | G16-G20 PolarHBondContact O-N 3.34Å; L17-G20 PolarHBondContact O-N 3.16Å; G20-F23 WeakPolarHBondContact O-CB 3.3Å; G20-F23 PolarHBondContact O-N 2.82Å; G20-D24 PolarHBondContact O-N 3.36Å; G20-V272 VanDerWaalsContact CA-CG2 3.47Å |
| 21 | H | 70.1 | Confident | 66.8 | Low | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -67.6 | -37.4 | -172.5 | -160.6 | -74.4 | 0 | 0 | 0 | 115.1 | L17 F23 D24 T25 F55 M59 Q128 | L17-H21 VanDerWaalsContact O-CB 3.29Å; L17-H21 WeakPolarHBondContact O-CB 3.37Å; L17-H21 PolarHBondContact O-N 3.48Å; H21-F23 PolarHBondContact O-N 3.06Å; H21-D24 WeakPolarHBondContact O-CB 3.35Å; H21-D24 PolarHBondContact O-N 2.88Å; H21-D24 VanDerWaalsContact O-N 3.07Å; H21-T25 PolarHBondContact ND1-OG1 2.86Å; H21-T25 PolarHBondContact O-N 3.04Å; H21-T25 PolarHBondContact O-OG1 3.18Å; H21-T25 VanDerWaalsContact O-OG1 3.07Å; H21-F55 PolarHBondContact ND1-O 3.47Å; H21-M59 HydrophobicContact CB-CE 3.04Å; H21-Q128 PolarHBondContact CE1-NE2 3.2Å; H21-Q128 PolarHBondContact NE2-NE2 3.4Å |
| 22 | P | 66 | Low | 65.7 | Low | 32 Ų | 32 | 31.1 Ų | 31.1 | 21% | 0.208 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -56 | -39.6 | 172.4 | -25.7 | 34.5 | 0 | 0 | 0 | 112 | V18 L19 T25 V26 F55 F56 | V18-P22 WeakPolarHBondContact O-CD 3.37Å; L19-P22 WeakPolarHBondContact O-CD 3.24Å; P22-T25 PolarHBondContact O-N 3.27Å; P22-V26 VanDerWaalsContact O-CG2 3.24Å; P22-V26 WeakPolarHBondContact O-CG2 3.16Å; P22-V26 PolarHBondContact O-N 3.18Å; P22-F55 HydrophobicContact CB-CB 4.29Å; P22-F55 HydrophobicContact CB-CD1 4Å; P22-F55 HydrophobicContact CB-CG 4.44Å; P22-F55 HydrophobicContact CG-CB 4.38Å; P22-F56 HydrophobicContact CG-CZ 4.36Å |
| 23 | F | 69.9 | Low | 65 | Low | 83 Ų | 83 | 32.8 Ų | 32.8 | 36% | 0.364 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -69.1 | -38.7 | 175.2 | -65.6 | -81.8 | 0 | 0 | 0 | 112.2 | G20 H21 V26 K27 R268 | G20-F23 WeakPolarHBondContact O-CB 3.3Å; G20-F23 PolarHBondContact O-N 2.82Å; H21-F23 PolarHBondContact O-N 3.06Å; F23-V26 PolarHBondContact O-N 3.35Å; F23-K27 VanDerWaalsContact O-CB 3.23Å; F23-K27 WeakPolarHBondContact O-CB 3.05Å; F23-K27 PolarHBondContact O-N 3.23Å; F23-R268 HydrophobicContact CB-CB 4.25Å; F23-R268 HydrophobicContact CB-CG 3.96Å; F23-R268 HydrophobicContact CD2-CG 4.42Å; F23-R268 HydrophobicContact CG-CB 4.34Å; F23-R268 HydrophobicContact CG-CG 4.27Å |
| 24 | D | 68 | Low | 64.4 | Low | 27 Ų | 27 | 37.7 Ų | 37.7 | 14% | 0.144 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.7 | -45.5 | 172.9 | -79.2 | -28.2 | 0 | 0 | 0 | 111.9 | G20 H21 V26 K27 V28 R268 | G20-D24 PolarHBondContact O-N 3.36Å; H21-D24 WeakPolarHBondContact O-CB 3.35Å; H21-D24 PolarHBondContact O-N 2.88Å; H21-D24 VanDerWaalsContact O-N 3.07Å; D24-V26 PolarHBondContact O-N 3.48Å; D24-K27 PolarHBondContact O-N 3.28Å; D24-V28 WeakPolarHBondContact O-CB 3.42Å; D24-V28 VanDerWaalsContact O-CG2 3.29Å; D24-V28 WeakPolarHBondContact O-CG2 3.4Å; D24-V28 PolarHBondContact O-N 3.01Å; D24-R268 VanDerWaalsContact CG-CZ 3.48Å; D24-R268 VanDerWaalsContact CG-NH2 3.28Å; D24-R268 IonicContact OD1-CZ 2.71Å; D24-R268 IonicContact OD1-NE 3.36Å; D24-R268 IonicContact OD1-NH1 2.91Å; D24-R268 PolarHBondContact OD1-NH1 3.45Å; D24-R268 IonicContact OD1-NH2 2.72Å; D24-R268 PolarHBondContact OD1-NH2 2.89Å; D24-R268 IonicContact OD2-CZ 3.14Å; D24-R268 IonicContact OD2-NH1 3.51Å; D24-R268 IonicContact OD2-NH2 3.56Å; D24-R268 PolarHBondContact OD2-NH2 2.83Å |
| 25 | T | 66.9 | Low | 63.9 | Low | 9 Ų | 9 | 41.5 Ų | 41.5 | 6% | 0.055 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.2 | -44.4 | 178.7 | -58.7 | 0 | 0 | 0 | 0 | 111 | H21 P22 R29 F55 | H21-T25 PolarHBondContact ND1-OG1 2.86Å; H21-T25 PolarHBondContact O-N 3.04Å; H21-T25 PolarHBondContact O-OG1 3.18Å; H21-T25 VanDerWaalsContact O-OG1 3.07Å; P22-T25 PolarHBondContact O-N 3.27Å; T25-R29 WeakPolarHBondContact O-CB 3.41Å; T25-R29 VanDerWaalsContact O-CG 3.3Å; T25-R29 WeakPolarHBondContact O-CG 3.37Å; T25-R29 PolarHBondContact O-N 3.44Å; T25-F55 PolarHBondContact OG1-O 3.01Å |
| 26 | V | 67.4 | Low | 63.5 | Low | 9 Ų | 9 | 39.7 Ų | 39.7 | 6% | 0.055 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -66.4 | -42.7 | 176.5 | 174.9 | 0 | 0 | 0 | 0 | 111 | P22 F23 D24 R29 L30 I39 C42 M43 I46 F55 | P22-V26 VanDerWaalsContact O-CG2 3.24Å; P22-V26 WeakPolarHBondContact O-CG2 3.16Å; P22-V26 PolarHBondContact O-N 3.18Å; F23-V26 PolarHBondContact O-N 3.35Å; D24-V26 PolarHBondContact O-N 3.48Å; V26-R29 PolarHBondContact O-N 3.48Å; V26-L30 WeakPolarHBondContact O-CB 3.24Å; V26-L30 PolarHBondContact O-N 2.86Å; V26-I39 HydrophobicContact CG1-CG2 3.81Å; V26-C42 HydrophobicContact CG1-CB 4.26Å; V26-M43 HydrophobicContact CG1-CG 4.38Å; V26-M43 HydrophobicContact CG2-CG 3.69Å; V26-I46 HydrophobicContact CG2-CD1 3.96Å; V26-F55 HydrophobicContact CG2-CE1 4.08Å |
| 27 | K | 65.8 | Low | 63.2 | Low | 22 Ų | 22 | 51.3 Ų | 51.3 | 10% | 0.096 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.2 | -50.2 | 177.3 | 179.2 | -178.8 | 172.2 | -173.3 | 0 | 110.9 | F23 D24 L30 Q31 D223 N265 | F23-K27 VanDerWaalsContact O-CB 3.23Å; F23-K27 WeakPolarHBondContact O-CB 3.05Å; F23-K27 PolarHBondContact O-N 3.23Å; D24-K27 PolarHBondContact O-N 3.28Å; K27-L30 PolarHBondContact O-N 3.47Å; K27-Q31 VanDerWaalsContact O-CB 3.27Å; K27-Q31 WeakPolarHBondContact O-CB 3.38Å; K27-Q31 WeakPolarHBondContact O-CG 3.45Å; K27-Q31 PolarHBondContact O-N 3.46Å; K27-D223 IonicContact NZ-OD2 2.84Å; K27-D223 PolarHBondContact NZ-OD2 3.44Å; K27-N265 PolarHBondContact NZ-OD1 2.98Å |
| 28 | V | 63.7 | Low | 63.3 | Low | 46 Ų | 46 | 50.9 Ų | 50.9 | 28% | 0.279 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.8 | -51.8 | 178.6 | 173.2 | 0 | 0 | 0 | 0 | 109.5 | D24 L30 Q31 T32 | D24-V28 WeakPolarHBondContact O-CB 3.42Å; D24-V28 VanDerWaalsContact O-CG2 3.29Å; D24-V28 WeakPolarHBondContact O-CG2 3.4Å; D24-V28 PolarHBondContact O-N 3.01Å; V28-L30 PolarHBondContact O-N 2.96Å; V28-Q31 CarbonylContact O-C 3.53Å; V28-Q31 PolarHBondContact O-N 3.16Å; V28-T32 HydrophobicContact CG1-CG2 3.91Å; V28-T32 WeakPolarHBondContact O-CB 2.97Å; V28-T32 WeakPolarHBondContact O-CG2 3.33Å; V28-T32 PolarHBondContact O-N 2.95Å; V28-T32 PolarHBondContact O-OG1 3.3Å |
| 29 | R | 65.8 | Low | 63.1 | Low | 15 Ų | 15 | 52.1 Ų | 52.1 | 6% | 0.057 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.4 | -38 | -178.7 | -72.9 | -179.7 | -176.1 | -146.3 | 6.4 | 114 | T25 V26 Q31 T32 Q33 Y36 E50 | T25-R29 WeakPolarHBondContact O-CB 3.41Å; T25-R29 VanDerWaalsContact O-CG 3.3Å; T25-R29 WeakPolarHBondContact O-CG 3.37Å; T25-R29 PolarHBondContact O-N 3.44Å; V26-R29 PolarHBondContact O-N 3.48Å; R29-Q31 VanDerWaalsContact C-N 3.32Å; R29-T32 WeakPolarHBondContact CA-OG1 3.42Å; R29-T32 PolarHBondContact O-N 2.84Å; R29-Q33 WeakPolarHBondContact O-CB 3.41Å; R29-Q33 PolarHBondContact O-N 3.48Å; R29-Y36 HydrophobicContact CB-CE2 4.03Å; R29-E50 IonicContact CZ-OE1 3.06Å; R29-E50 IonicContact CZ-OE2 3.55Å; R29-E50 IonicContact NH1-OE1 3.29Å; R29-E50 PolarHBondContact NH1-OE1 3.38Å; R29-E50 IonicContact NH1-OE2 3.81Å; R29-E50 VanDerWaalsContact NH2-CD 3.31Å; R29-E50 IonicContact NH2-OE1 2.69Å; R29-E50 PolarHBondContact NH2-OE1 2.83Å; R29-E50 VanDerWaalsContact NH2-OE1 3.14Å; R29-E50 IonicContact NH2-OE2 2.58Å; R29-E50 PolarHBondContact NH2-OE2 3.37Å |
| 30 | L | 63.5 | Low | 63.3 | Low | 52 Ų | 52 | 53.1 Ų | 53.1 | 27% | 0.272 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -69.4 | -32.6 | 175.7 | -167.9 | 72.2 | 0 | 0 | 0 | 111.7 | V26 K27 V28 I39 | V26-L30 WeakPolarHBondContact O-CB 3.24Å; V26-L30 PolarHBondContact O-N 2.86Å; K27-L30 PolarHBondContact O-N 3.47Å; V28-L30 PolarHBondContact O-N 2.96Å; L30-I39 HydrophobicContact CD2-CG1 3.86Å |
| 31 | Q | 51.1 | Low | 63.6 | Low | 66 Ų | 66 | 55.4 Ų | 55.4 | 31% | 0.308 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -80.8 | -25.1 | 176.6 | -71.7 | 179 | -6.5 | 0 | 0 | 113.1 | K27 V28 R29 S227 | K27-Q31 VanDerWaalsContact O-CB 3.27Å; K27-Q31 WeakPolarHBondContact O-CB 3.38Å; K27-Q31 WeakPolarHBondContact O-CG 3.45Å; K27-Q31 PolarHBondContact O-N 3.46Å; V28-Q31 CarbonylContact O-C 3.53Å; V28-Q31 PolarHBondContact O-N 3.16Å; R29-Q31 VanDerWaalsContact C-N 3.32Å; Q31-S227 PolarHBondContact OE1-OG 3.33Å |
| 32 | T | 49.2 | Very low | 63.5 | Low | 23 Ų | 23 | 55.4 Ų | 55.4 | 14% | 0.141 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -99.6 | -31.2 | -176.1 | 59.9 | 0 | 0 | 0 | 0 | 113.6 | V28 R29 M231 | V28-T32 HydrophobicContact CG1-CG2 3.91Å; V28-T32 WeakPolarHBondContact O-CB 2.97Å; V28-T32 WeakPolarHBondContact O-CG2 3.33Å; V28-T32 PolarHBondContact O-N 2.95Å; V28-T32 PolarHBondContact O-OG1 3.3Å; R29-T32 WeakPolarHBondContact CA-OG1 3.42Å; R29-T32 PolarHBondContact O-N 2.84Å; T32-M231 VanDerWaalsContact CA-SD 3.57Å; T32-M231 WeakPolarHBondContact CB-SD 3.38Å; T32-M231 HydrophobicContact CG2-CG 3.78Å; T32-M231 HydrophobicContact CG2-SD 3.33Å; T32-M231 WeakPolarHBondContact CG2-SD 3.16Å; T32-M231 WeakPolarHBondContact O-CE 3.33Å |
| 33 | Q | 54 | Low | 63.7 | Low | 42 Ų | 42 | 57.2 Ų | 57.2 | 20% | 0.196 | 29% | 0.294 | C | S | . | . | trans | -115.3 | 124 | -174.6 | -58.5 | -176.3 | -0.2 | 0 | 0 | 111.4 | R29 T35 Y36 T131 | R29-Q33 WeakPolarHBondContact O-CB 3.41Å; R29-Q33 PolarHBondContact O-N 3.48Å; Q33-T35 PolarHBondContact O-N 3.26Å; Q33-Y36 HydrophobicContact CB-CD2 3.89Å; Q33-Y36 HydrophobicContact CB-CE2 3.68Å; Q33-Y36 HydrophobicContact CG-CE2 4.27Å; Q33-Y36 PolarHBondContact OE1-OH 3.16Å; Q33-T131 PolarHBondContact NE2-OG1 3.46Å; Q33-T131 VanDerWaalsContact NE2-OG1 3.16Å | ||
| 34 | T | 54.3 | Low | 63.9 | Low | 119 Ų | 119 | 56.8 Ų | 56.8 | 73% | 0.73 | 30% | 0.298 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -1.5 | 176.2 | 55.2 | 0 | 0 | 0 | 0 | 113.5 | Y36 | T34-Y36 VanDerWaalsContact C-N 3.31Å; T34-Y36 PolarHBondContact O-N 2.72Å |
| 35 | T | 58.3 | Low | 64.2 | Low | 96 Ų | 96 | 58.7 Ų | 58.7 | 59% | 0.589 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | -11.4 | -173.6 | -46.4 | 0 | 0 | 0 | 0 | 113.2 | Q33 K45 | Q33-T35 PolarHBondContact O-N 3.26Å; T35-K45 PolarHBondContact O-NZ 2.78Å; T35-K45 VanDerWaalsContact O-NZ 3.16Å |
| 36 | Y | 61.2 | Low | 64.3 | Low | 33 Ų | 33 | 58.3 Ų | 58.3 | 13% | 0.129 | 30% | 0.303 | C | S | . | . | trans | -102.2 | 127.3 | -178.2 | -57.4 | -67.3 | 0 | 0 | 0 | 110.8 | R29 Q33 T34 G38 C42 K45 | R29-Y36 HydrophobicContact CB-CE2 4.03Å; Q33-Y36 HydrophobicContact CB-CD2 3.89Å; Q33-Y36 HydrophobicContact CB-CE2 3.68Å; Q33-Y36 HydrophobicContact CG-CE2 4.27Å; Q33-Y36 PolarHBondContact OE1-OH 3.16Å; T34-Y36 VanDerWaalsContact C-N 3.31Å; T34-Y36 PolarHBondContact O-N 2.72Å; Y36-G38 VanDerWaalsContact C-N 3.31Å; Y36-C42 VanDerWaalsContact CD1-CA 3.47Å; Y36-C42 HydrophobicContact CD1-CB 3.79Å; Y36-C42 HydrophobicContact CD2-CB 4.42Å; Y36-C42 HydrophobicContact CE1-CB 4.39Å; Y36-C42 HydrophobicContact CG-CB 3.82Å; Y36-K45 HydrophobicContact CD1-CB 4.48Å; Y36-K45 HydrophobicContact CD1-CD 3.77Å; Y36-K45 HydrophobicContact CE1-CB 3.88Å; Y36-K45 HydrophobicContact CE1-CD 3.69Å; Y36-K45 HydrophobicContact CE1-CG 4.45Å | ||
| 37 | R | 60.3 | Low | 64.6 | Low | 246 Ų | 246 | 64.6 Ų | 64.6 | 93% | 0.928 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -80.6 | -12.1 | 178.4 | -75.1 | -178.3 | 170.4 | 176.7 | -3 | 113.4 | D41 | R37-D41 PolarHBondContact N-OD2 2.85Š|
| 38 | G | 68.5 | Low | 64.8 | Low | 25 Ų | 25 | 73.7 Ų | 73.7 | 26% | 0.258 | 36% | 0.36 | S | S | . | . | S | Bend | trans | 175.3 | 178.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113 | Y36 V40 D41 C42 | Y36-G38 VanDerWaalsContact C-N 3.31Å; G38-V40 VanDerWaalsContact C-N 3.35Å; G38-V40 PolarHBondContact O-N 3.18Å; G38-D41 PolarHBondContact O-N 3.15Å; G38-C42 WeakPolarHBondContact O-CB 3.23Å; G38-C42 PolarHBondContact O-N 3.43Å |
| 39 | I | 67.1 | Low | 65.1 | Low | 71 Ų | 71 | 78.7 Ų | 78.7 | 36% | 0.364 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.8 | -45.5 | -177.1 | -54.9 | 173.5 | 0 | 0 | 0 | 110.8 | V26 L30 C42 M43 I264 | V26-I39 HydrophobicContact CG1-CG2 3.81Å; L30-I39 HydrophobicContact CD2-CG1 3.86Å; I39-C42 WeakPolarHBondContact O-CB 2.92Å; I39-C42 PolarHBondContact O-N 3.21Å; I39-M43 HydrophobicContact CG2-CE 3.97Å; I39-M43 HydrophobicContact CG2-SD 4.45Å; I39-M43 WeakPolarHBondContact O-CG 3.27Å; I39-M43 PolarHBondContact O-N 3.23Å; I39-I264 HydrophobicContact CD1-CD1 3.79Å; I39-I264 HydrophobicContact CD1-CG1 3.93Å; I39-I264 HydrophobicContact CG1-CD1 4.41Å |
| 40 | V | 72.6 | Confident | 65 | Low | 100 Ų | 100 | 79.7 Ų | 79.7 | 61% | 0.606 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -68.8 | -42 | -178.5 | -176.8 | 0 | 0 | 0 | 0 | 111.9 | G38 C42 M43 V44 | G38-V40 VanDerWaalsContact C-N 3.35Å; G38-V40 PolarHBondContact O-N 3.18Å; V40-C42 VanDerWaalsContact C-N 3.29Å; V40-C42 PolarHBondContact O-N 3.36Å; V40-M43 HydrophobicContact CB-CE 4.46Å; V40-M43 HydrophobicContact CG2-CE 4.14Å; V40-M43 PolarHBondContact O-N 2.92Å; V40-V44 HydrophobicContact CG1-CG2 4.34Å; V40-V44 WeakPolarHBondContact O-CB 3.23Å; V40-V44 VanDerWaalsContact O-CG2 3.28Å; V40-V44 WeakPolarHBondContact O-CG2 3.21Å; V40-V44 PolarHBondContact O-N 2.76Å |
| 41 | D | 72 | Confident | 65.2 | Low | 48 Ų | 48 | 80.7 Ų | 80.7 | 26% | 0.257 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63 | -38 | 175.4 | -179.2 | 45.7 | 0 | 0 | 0 | 111.4 | R37 G38 K45 | R37-D41 PolarHBondContact N-OD2 2.85Å; G38-D41 PolarHBondContact O-N 3.15Å; D41-K45 WeakPolarHBondContact O-CB 3.33Å; D41-K45 WeakPolarHBondContact O-CG 3.35Å; D41-K45 PolarHBondContact O-N 2.95Å; D41-K45 VanDerWaalsContact OD1-CE 3.3Å; D41-K45 WeakPolarHBondContact OD1-CE 3.48Å; D41-K45 IonicContact OD1-NZ 3.26Å; D41-K45 PolarHBondContact OD1-NZ 2.84Å; D41-K45 IonicContact OD2-NZ 2.84Å; D41-K45 PolarHBondContact OD2-NZ 3.05Å |
| 42 | C | 68.2 | Low | 65.7 | Low | 0 Ų | 0 | 82.5 Ų | 82.5 | 0% | 0 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -63.6 | -50.1 | 173 | -165.8 | 0 | 0 | 0 | 0 | 111.6 | V26 Y36 G38 I39 V40 V44 K45 I46 | V26-C42 HydrophobicContact CG1-CB 4.26Å; Y36-C42 VanDerWaalsContact CD1-CA 3.47Å; Y36-C42 HydrophobicContact CD1-CB 3.79Å; Y36-C42 HydrophobicContact CD2-CB 4.42Å; Y36-C42 HydrophobicContact CE1-CB 4.39Å; Y36-C42 HydrophobicContact CG-CB 3.82Å; G38-C42 WeakPolarHBondContact O-CB 3.23Å; G38-C42 PolarHBondContact O-N 3.43Å; I39-C42 WeakPolarHBondContact O-CB 2.92Å; I39-C42 PolarHBondContact O-N 3.21Å; V40-C42 VanDerWaalsContact C-N 3.29Å; V40-C42 PolarHBondContact O-N 3.36Å; C42-V44 PolarHBondContact O-N 3.08Å; C42-K45 PolarHBondContact O-N 2.91Å; C42-I46 WeakPolarHBondContact O-CD1 3.28Å; C42-I46 WeakPolarHBondContact O-CG1 3.31Å; C42-I46 PolarHBondContact O-N 2.81Å |
| 43 | M | 69.7 | Low | 66.4 | Low | 70 Ų | 70 | 88.1 Ų | 88.1 | 35% | 0.345 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -59 | -44.7 | 178.4 | -72.9 | -173.6 | -62.6 | 0 | 0 | 112.4 | V26 I39 V40 I46 Y47 | V26-M43 HydrophobicContact CG1-CG 4.38Å; V26-M43 HydrophobicContact CG2-CG 3.69Å; I39-M43 HydrophobicContact CG2-CE 3.97Å; I39-M43 HydrophobicContact CG2-SD 4.45Å; I39-M43 WeakPolarHBondContact O-CG 3.27Å; I39-M43 PolarHBondContact O-N 3.23Å; V40-M43 HydrophobicContact CB-CE 4.46Å; V40-M43 HydrophobicContact CG2-CE 4.14Å; V40-M43 PolarHBondContact O-N 2.92Å; M43-I46 PolarHBondContact O-N 3.29Å; M43-Y47 WeakPolarHBondContact O-CB 3.28Å; M43-Y47 PolarHBondContact O-N 3.25Å |
| 44 | V | 75.3 | Confident | 66.8 | Low | 74 Ų | 74 | 86.3 Ų | 86.3 | 45% | 0.448 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.1 | -42.3 | -179.9 | 172 | 0 | 0 | 0 | 0 | 111.4 | V40 C42 Y47 R48 | V40-V44 HydrophobicContact CG1-CG2 4.34Å; V40-V44 WeakPolarHBondContact O-CB 3.23Å; V40-V44 VanDerWaalsContact O-CG2 3.28Å; V40-V44 WeakPolarHBondContact O-CG2 3.21Å; V40-V44 PolarHBondContact O-N 2.76Å; C42-V44 PolarHBondContact O-N 3.08Å; V44-Y47 PolarHBondContact O-N 3.41Å; V44-R48 WeakPolarHBondContact O-CB 3.27Å; V44-R48 PolarHBondContact O-N 2.99Å |
| 45 | K | 72.7 | Confident | 67.1 | Low | 67 Ų | 67 | 81.7 Ų | 81.7 | 29% | 0.291 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -66.7 | -40.5 | 176.7 | -80.3 | 171.9 | 179.2 | 156.4 | 0 | 112.3 | T35 Y36 D41 C42 R48 H49 | T35-K45 PolarHBondContact O-NZ 2.78Å; T35-K45 VanDerWaalsContact O-NZ 3.16Å; Y36-K45 HydrophobicContact CD1-CB 4.48Å; Y36-K45 HydrophobicContact CD1-CD 3.77Å; Y36-K45 HydrophobicContact CE1-CB 3.88Å; Y36-K45 HydrophobicContact CE1-CD 3.69Å; Y36-K45 HydrophobicContact CE1-CG 4.45Å; D41-K45 WeakPolarHBondContact O-CB 3.33Å; D41-K45 WeakPolarHBondContact O-CG 3.35Å; D41-K45 PolarHBondContact O-N 2.95Å; D41-K45 VanDerWaalsContact OD1-CE 3.3Å; D41-K45 WeakPolarHBondContact OD1-CE 3.48Å; D41-K45 IonicContact OD1-NZ 3.26Å; D41-K45 PolarHBondContact OD1-NZ 2.84Å; D41-K45 IonicContact OD2-NZ 2.84Å; D41-K45 PolarHBondContact OD2-NZ 3.05Å; C42-K45 PolarHBondContact O-N 2.91Å; K45-R48 PolarHBondContact O-N 3.2Å; K45-H49 WeakPolarHBondContact O-CB 3.44Å; K45-H49 PolarHBondContact O-CD2 3.2Å; K45-H49 PolarHBondContact O-N 3.36Å |
| 46 | I | 69.9 | Low | 67.3 | Low | 1 Ų | 1 | 81.1 Ų | 81.1 | 1% | 0.005 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -61 | -48.7 | 175 | -65.8 | 163 | 0 | 0 | 0 | 109.8 | V26 C42 M43 R48 H49 E50 S51 F55 | V26-I46 HydrophobicContact CG2-CD1 3.96Å; C42-I46 WeakPolarHBondContact O-CD1 3.28Å; C42-I46 WeakPolarHBondContact O-CG1 3.31Å; C42-I46 PolarHBondContact O-N 2.81Å; M43-I46 PolarHBondContact O-N 3.29Å; I46-R48 VanDerWaalsContact C-N 3.34Å; I46-R48 PolarHBondContact O-N 2.94Å; I46-H49 PolarHBondContact O-N 3.26Å; I46-E50 PolarHBondContact O-N 3.31Å; I46-S51 PolarHBondContact O-N 2.92Å; I46-F55 HydrophobicContact CB-CE1 4.05Å; I46-F55 HydrophobicContact CB-CE2 4.24Å; I46-F55 HydrophobicContact CB-CZ 3.73Å; I46-F55 HydrophobicContact CD1-CE1 4Å; I46-F55 HydrophobicContact CD1-CZ 4.5Å; I46-F55 HydrophobicContact CG2-CD1 4Å; I46-F55 HydrophobicContact CG2-CD2 3.91Å; I46-F55 HydrophobicContact CG2-CE1 3.68Å; I46-F55 HydrophobicContact CG2-CE2 3.57Å; I46-F55 HydrophobicContact CG2-CG 4.12Å; I46-F55 HydrophobicContact CG2-CZ 3.45Å; I46-F55 VanDerWaalsContact CG2-CZ 3.45Å |
| 47 | Y | 73.8 | Confident | 67.2 | Low | 141 Ų | 141 | 84.1 Ų | 84.1 | 55% | 0.553 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -61 | -42.1 | 179.5 | -175.7 | -99.2 | 0 | 0 | 0 | 112.3 | M43 V44 S51 L52 | M43-Y47 WeakPolarHBondContact O-CB 3.28Å; M43-Y47 PolarHBondContact O-N 3.25Å; V44-Y47 PolarHBondContact O-N 3.41Å; Y47-S51 WeakPolarHBondContact O-CA 3.44Å; Y47-S51 PolarHBondContact O-N 3.49Å; Y47-L52 HydrophobicContact CD2-CD2 4.01Å; Y47-L52 HydrophobicContact CD2-CG 4.34Å; Y47-L52 HydrophobicContact CE2-CD2 3.82Å; Y47-L52 HydrophobicContact CE2-CG 3.89Å |
| 48 | R | 70.3 | Confident | 67.2 | Low | 212 Ų | 212 | 73.3 Ų | 73.3 | 80% | 0.8 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -71.9 | -36.6 | 178.8 | -90.6 | -170.3 | 169.2 | -176.3 | -1.7 | 114.6 | V44 K45 I46 | V44-R48 WeakPolarHBondContact O-CB 3.27Å; V44-R48 PolarHBondContact O-N 2.99Å; K45-R48 PolarHBondContact O-N 3.2Å; I46-R48 VanDerWaalsContact C-N 3.34Å; I46-R48 PolarHBondContact O-N 2.94Å |
| 49 | H | 70 | Confident | 67 | Low | 151 Ų | 151 | 72.7 Ų | 72.7 | 70% | 0.699 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -96 | -28.5 | -173.9 | -80.8 | -83.3 | 0 | 0 | 0 | 114.4 | K45 I46 | K45-H49 WeakPolarHBondContact O-CB 3.44Å; K45-H49 PolarHBondContact O-CD2 3.2Å; K45-H49 PolarHBondContact O-N 3.36Å; I46-H49 PolarHBondContact O-N 3.26Å |
| 50 | E | 62 | Low | 66.9 | Low | 37 Ų | 37 | 73.4 Ų | 73.4 | 17% | 0.173 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -126.2 | 1.8 | -172.2 | -65.7 | -178.2 | -145.3 | 0 | 0 | 113.8 | R29 I46 G54 | R29-E50 IonicContact CZ-OE1 3.06Å; R29-E50 IonicContact CZ-OE2 3.55Å; R29-E50 IonicContact NH1-OE1 3.29Å; R29-E50 PolarHBondContact NH1-OE1 3.38Å; R29-E50 IonicContact NH1-OE2 3.81Å; R29-E50 VanDerWaalsContact NH2-CD 3.31Å; R29-E50 IonicContact NH2-OE1 2.69Å; R29-E50 PolarHBondContact NH2-OE1 2.83Å; R29-E50 VanDerWaalsContact NH2-OE1 3.14Å; R29-E50 IonicContact NH2-OE2 2.58Å; R29-E50 PolarHBondContact NH2-OE2 3.37Å; I46-E50 PolarHBondContact O-N 3.31Å; E50-G54 PolarHBondContact O-N 2.96Å |
| 51 | S | 68.3 | Low | 66.5 | Low | 72 Ų | 72 | 70.5 Ų | 70.5 | 50% | 0.503 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58.3 | -173.8 | -176.4 | -166.4 | 0 | 0 | 0 | 0 | 112.9 | I46 Y47 L53 G54 | I46-S51 PolarHBondContact O-N 2.92Å; Y47-S51 WeakPolarHBondContact O-CA 3.44Å; Y47-S51 PolarHBondContact O-N 3.49Å; S51-L53 PolarHBondContact O-N 2.72Å; S51-G54 PolarHBondContact O-N 2.8Å; S51-G54 VanDerWaalsContact O-N 3.16Å |
| 52 | L | 63 | Low | 66.1 | Low | 104 Ų | 104 | 68.6 Ų | 68.6 | 55% | 0.545 | 34% | 0.338 | S | S | . | . | G | 310 helix | trans | -60.3 | -30.7 | 178.8 | -73.6 | 171.1 | 0 | 0 | 0 | 112.5 | Y47 G54 F55 F56 | Y47-L52 HydrophobicContact CD2-CD2 4.01Å; Y47-L52 HydrophobicContact CD2-CG 4.34Å; Y47-L52 HydrophobicContact CE2-CD2 3.82Å; Y47-L52 HydrophobicContact CE2-CG 3.89Å; L52-G54 VanDerWaalsContact C-N 3.25Å; L52-G54 PolarHBondContact O-N 2.96Å; L52-F55 PolarHBondContact O-N 3.42Å; L52-F56 WeakPolarHBondContact O-CD2 3.29Å |
| 53 | L | 63.2 | Low | 66.1 | Low | 142 Ų | 142 | 70.7 Ų | 70.7 | 74% | 0.743 | 35% | 0.349 | S | S | * | . | G | 310 helix | trans | -68.3 | -22 | 179 | -69.3 | 168.1 | 0 | 0 | 0 | 113.2 | S51 F55 F56 K57 | S51-L53 PolarHBondContact O-N 2.72Å; L53-F55 VanDerWaalsContact C-N 3.26Å; L53-F55 PolarHBondContact O-N 2.87Å; L53-F56 PolarHBondContact O-N 3.47Å; L53-K57 PolarHBondContact O-N 3.25Å |
| 54 | G | 61.2 | Low | 66.1 | Low | 3 Ų | 3 | 70.7 Ų | 70.7 | 3% | 0.031 | 36% | 0.36 | C | S | . | . | G | 310 helix | trans | -60.4 | -33 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | E50 S51 L52 F56 | E50-G54 PolarHBondContact O-N 2.96Å; S51-G54 PolarHBondContact O-N 2.8Å; S51-G54 VanDerWaalsContact O-N 3.16Å; L52-G54 VanDerWaalsContact C-N 3.25Å; L52-G54 PolarHBondContact O-N 2.96Å; G54-F56 VanDerWaalsContact C-N 3.31Å; G54-F56 PolarHBondContact O-N 3.07Å |
| 55 | F | 61.6 | Low | 65.5 | Low | 23 Ų | 23 | 68.1 Ų | 68.1 | 10% | 0.101 | 35% | 0.345 | C | S | . | . | G | 310 helix | trans | -72.9 | -22.6 | 177.7 | -66.8 | -82.1 | 0 | 0 | 0 | 113.5 | H21 P22 T25 V26 I46 L52 L53 | H21-F55 PolarHBondContact ND1-O 3.47Å; P22-F55 HydrophobicContact CB-CB 4.29Å; P22-F55 HydrophobicContact CB-CD1 4Å; P22-F55 HydrophobicContact CB-CG 4.44Å; P22-F55 HydrophobicContact CG-CB 4.38Å; T25-F55 PolarHBondContact OG1-O 3.01Å; V26-F55 HydrophobicContact CG2-CE1 4.08Å; I46-F55 HydrophobicContact CB-CE1 4.05Å; I46-F55 HydrophobicContact CB-CE2 4.24Å; I46-F55 HydrophobicContact CB-CZ 3.73Å; I46-F55 HydrophobicContact CD1-CE1 4Å; I46-F55 HydrophobicContact CD1-CZ 4.5Å; I46-F55 HydrophobicContact CG2-CD1 4Å; I46-F55 HydrophobicContact CG2-CD2 3.91Å; I46-F55 HydrophobicContact CG2-CE1 3.68Å; I46-F55 HydrophobicContact CG2-CE2 3.57Å; I46-F55 HydrophobicContact CG2-CG 4.12Å; I46-F55 HydrophobicContact CG2-CZ 3.45Å; I46-F55 VanDerWaalsContact CG2-CZ 3.45Å; L52-F55 PolarHBondContact O-N 3.42Å; L53-F55 VanDerWaalsContact C-N 3.26Å; L53-F55 PolarHBondContact O-N 2.87Å |
| 56 | F | 62.4 | Low | 65.4 | Low | 83 Ų | 83 | 66 Ų | 66 | 36% | 0.364 | 34% | 0.337 | S | S | . | . | G | 310 helix | trans | -103.1 | 0.3 | -177.4 | -65.3 | -85.1 | 0 | 0 | 0 | 113 | V18 P22 L52 L53 G54 G58 M59 | V18-F56 HydrophobicContact CG1-CE1 3.85Å; P22-F56 HydrophobicContact CG-CZ 4.36Å; L52-F56 WeakPolarHBondContact O-CD2 3.29Å; L53-F56 PolarHBondContact O-N 3.47Å; G54-F56 VanDerWaalsContact C-N 3.31Å; G54-F56 PolarHBondContact O-N 3.07Å; F56-G58 PolarHBondContact O-N 3.1Å; F56-M59 HydrophobicContact CD1-CE 3.2Å; F56-M59 HydrophobicContact CD1-SD 3.56Å; F56-M59 VanDerWaalsContact CD1-SD 3.56Å; F56-M59 HydrophobicContact CE1-CE 3.59Å; F56-M59 HydrophobicContact CE1-SD 4.16Å; F56-M59 HydrophobicContact CG-CE 4.27Å; F56-M59 VanDerWaalsContact O-CB 3.23Å; F56-M59 WeakPolarHBondContact O-CB 3.45Å; F56-M59 PolarHBondContact O-N 3.05Å; F56-M59 VanDerWaalsContact O-N 3.12Å |
| 57 | K | 60 | Low | 65.4 | Low | 96 Ų | 96 | 67.1 Ų | 67.1 | 42% | 0.417 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | 119.9 | -179.5 | -159.3 | 175 | -178.8 | -176 | 0 | 110.2 | L53 | L53-K57 PolarHBondContact O-N 3.25Š|
| 58 | G | 59.7 | Low | 65.2 | Low | 19 Ų | 19 | 64.8 Ų | 64.8 | 20% | 0.196 | 35% | 0.346 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 88.8 | 7.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | F56 P62 | F56-G58 PolarHBondContact O-N 3.1Å; G58-P62 WeakPolarHBondContact O-CD 3.29Å |
| 59 | M | 64.1 | Low | 65.1 | Low | 12 Ų | 12 | 55.7 Ų | 55.7 | 6% | 0.059 | 32% | 0.315 | C | S | . | . | trans | -76.4 | -26.2 | -179.1 | -178 | -176.4 | -77.7 | 0 | 0 | 114.5 | L17 V18 H21 F56 F61 P62 I63 | L17-M59 HydrophobicContact CD2-CG 4.48Å; V18-M59 HydrophobicContact CB-CE 4.43Å; V18-M59 HydrophobicContact CB-SD 4.22Å; V18-M59 HydrophobicContact CG2-CE 4.48Å; V18-M59 HydrophobicContact CG2-SD 3.68Å; H21-M59 HydrophobicContact CB-CE 3.04Å; F56-M59 HydrophobicContact CD1-CE 3.2Å; F56-M59 HydrophobicContact CD1-SD 3.56Å; F56-M59 VanDerWaalsContact CD1-SD 3.56Å; F56-M59 HydrophobicContact CE1-CE 3.59Å; F56-M59 HydrophobicContact CE1-SD 4.16Å; F56-M59 HydrophobicContact CG-CE 4.27Å; F56-M59 VanDerWaalsContact O-CB 3.23Å; F56-M59 WeakPolarHBondContact O-CB 3.45Å; F56-M59 PolarHBondContact O-N 3.05Å; F56-M59 VanDerWaalsContact O-N 3.12Å; M59-F61 PolarHBondContact O-N 3.07Å; M59-F61 VanDerWaalsContact O-N 3.11Å; M59-P62 VanDerWaalsContact O-CD 3.26Å; M59-P62 WeakPolarHBondContact O-CD 3.39Å; M59-I63 HydrophobicContact CG-CD1 3.54Å; M59-I63 HydrophobicContact CG-CG1 3.95Å; M59-I63 WeakPolarHBondContact O-CG1 3.29Å; M59-I63 PolarHBondContact O-N 3.23Å; M59-I63 HydrophobicContact SD-CD1 3.7Å | ||
| 60 | S | 64.7 | Low | 65 | Low | 87 Ų | 87 | 51.3 Ų | 51.3 | 61% | 0.608 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -55.8 | -34.1 | -177.4 | 52.3 | 0 | 0 | 0 | 0 | 112.8 | A64 | S60-A64 WeakPolarHBondContact O-CB 3.25Å; S60-A64 PolarHBondContact O-N 2.85Å |
| 61 | F | 64.6 | Low | 65.3 | Low | 38 Ų | 38 | 52.3 Ų | 52.3 | 17% | 0.167 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -78.2 | -47.7 | -175.2 | -170.8 | -95.9 | 0 | 0 | 0 | 113.5 | M59 I63 A64 S65 F120 I123 K124 P147 | M59-F61 PolarHBondContact O-N 3.07Å; M59-F61 VanDerWaalsContact O-N 3.11Å; F61-I63 VanDerWaalsContact C-N 3.32Å; F61-I63 PolarHBondContact O-N 2.92Å; F61-A64 PolarHBondContact O-N 2.81Å; F61-S65 WeakPolarHBondContact O-CB 3.4Å; F61-S65 PolarHBondContact O-N 3.34Å; F61-S65 PolarHBondContact O-OG 2.93Å; F61-S65 VanDerWaalsContact O-OG 3.12Å; F61-F120 HydrophobicContact CE1-CB 3.53Å; F61-F120 AromaticContact CE1-CD1 3.59Å; F61-F120 HydrophobicContact CE1-CD1 3.59Å; F61-F120 HydrophobicContact CE1-CG 4.02Å; F61-F120 VanDerWaalsContact CE1-O 3.25Å; F61-F120 WeakPolarHBondContact CE1-O 3.24Å; F61-F120 HydrophobicContact CE2-CD1 4.03Å; F61-F120 HydrophobicContact CZ-CB 3.9Å; F61-F120 AromaticContact CZ-CD1 3.18Å; F61-F120 HydrophobicContact CZ-CD1 3.18Å; F61-F120 HydrophobicContact CZ-CE1 4.01Å; F61-F120 AromaticContact CZ-CG 3.91Å; F61-F120 HydrophobicContact CZ-CG 3.91Å; F61-I123 HydrophobicContact CZ-CD1 4.4Å; F61-K124 HydrophobicContact CD1-CB 4.48Å; F61-P147 HydrophobicContact CD2-CB 4.14Å; F61-P147 HydrophobicContact CE2-CB 4.42Å |
| 62 | P | 64.2 | Low | 65.4 | Low | 9 Ų | 9 | 50.8 Ų | 50.8 | 6% | 0.058 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -52.8 | -42 | 166.5 | -32.1 | 35.7 | 0 | 0 | 0 | 115.4 | L17 G58 M59 A64 S65 I66 K124 | L17-P62 HydrophobicContact CD2-CB 3.27Å; L17-P62 HydrophobicContact CD2-CG 4.35Å; L17-P62 HydrophobicContact CG-CB 4.48Å; G58-P62 WeakPolarHBondContact O-CD 3.29Å; M59-P62 VanDerWaalsContact O-CD 3.26Å; M59-P62 WeakPolarHBondContact O-CD 3.39Å; P62-A64 VanDerWaalsContact C-N 3.35Å; P62-S65 WeakPolarHBondContact CA-OG 3.35Å; P62-S65 PolarHBondContact O-N 3.11Å; P62-S65 PolarHBondContact O-OG 2.98Å; P62-I66 WeakPolarHBondContact O-CB 3.33Å; P62-I66 PolarHBondContact O-N 3.07Å; P62-K124 HydrophobicContact CG-CD 3.64Å; P62-K124 HydrophobicContact CG-CG 4.24Å |
| 63 | I | 68.6 | Low | 65.6 | Low | 44 Ų | 44 | 47.1 Ų | 47.1 | 23% | 0.226 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -67.3 | -40.7 | 178.8 | -67.4 | 178.3 | 0 | 0 | 0 | 110 | A14 L17 V18 M59 F61 I66 | A14-I63 HydrophobicContact CB-CG2 4.25Å; L17-I63 HydrophobicContact CD2-CG1 3.86Å; V18-I63 HydrophobicContact CG2-CD1 3.79Å; M59-I63 HydrophobicContact CG-CD1 3.54Å; M59-I63 HydrophobicContact CG-CG1 3.95Å; M59-I63 WeakPolarHBondContact O-CG1 3.29Å; M59-I63 PolarHBondContact O-N 3.23Å; M59-I63 HydrophobicContact SD-CD1 3.7Å; F61-I63 VanDerWaalsContact C-N 3.32Å; F61-I63 PolarHBondContact O-N 2.92Å; I63-I66 WeakPolarHBondContact O-CG2 3.4Å |
| 64 | A | 68.5 | Low | 65.8 | Low | 69 Ų | 69 | 46.2 Ų | 46.2 | 57% | 0.57 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -67.4 | -33.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | S60 F61 P62 | S60-A64 WeakPolarHBondContact O-CB 3.25Å; S60-A64 PolarHBondContact O-N 2.85Å; F61-A64 PolarHBondContact O-N 2.81Å; P62-A64 VanDerWaalsContact C-N 3.35Å |
| 65 | S | 64 | Low | 66.1 | Low | 20 Ų | 20 | 48 Ų | 48 | 14% | 0.14 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -87.9 | -18.2 | -175.2 | 65.7 | 0 | 0 | 0 | 0 | 114.6 | F61 P62 A67 V68 V69 | F61-S65 WeakPolarHBondContact O-CB 3.4Å; F61-S65 PolarHBondContact O-N 3.34Å; F61-S65 PolarHBondContact O-OG 2.93Å; F61-S65 VanDerWaalsContact O-OG 3.12Å; P62-S65 WeakPolarHBondContact CA-OG 3.35Å; P62-S65 PolarHBondContact O-N 3.11Å; P62-S65 PolarHBondContact O-OG 2.98Å; S65-A67 VanDerWaalsContact C-N 3.31Å; S65-A67 PolarHBondContact O-N 3.42Å; S65-V68 PolarHBondContact O-N 2.94Å; S65-V69 VanDerWaalsContact O-CG2 3.23Å; S65-V69 WeakPolarHBondContact O-CG2 3.23Å; S65-V69 PolarHBondContact O-N 3.49Å |
| 66 | I | 70.6 | Confident | 66.5 | Low | 23 Ų | 23 | 48.1 Ų | 48.1 | 12% | 0.118 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -58.6 | -37.8 | -172.3 | -159 | 162.6 | 0 | 0 | 0 | 113.9 | W10 L17 P62 I63 V69 N70 | W10-I66 VanDerWaalsContact CD1-CG2 3.47Å; L17-I66 HydrophobicContact CD1-CD1 4.47Å; P62-I66 WeakPolarHBondContact O-CB 3.33Å; P62-I66 PolarHBondContact O-N 3.07Å; I63-I66 WeakPolarHBondContact O-CG2 3.4Å; I66-V69 PolarHBondContact O-N 3.21Å; I66-N70 WeakPolarHBondContact O-CB 3.19Å; I66-N70 PolarHBondContact O-N 3.45Å; I66-N70 PolarHBondContact O-ND2 2.96Å |
| 67 | A | 68.2 | Low | 66.6 | Low | 24 Ų | 24 | 45.9 Ų | 45.9 | 20% | 0.198 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65 | -43.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S65 S71 | S65-A67 VanDerWaalsContact C-N 3.31Å; S65-A67 PolarHBondContact O-N 3.42Å; A67-S71 VanDerWaalsContact O-CB 3.24Å; A67-S71 WeakPolarHBondContact O-CB 3.2Å; A67-S71 PolarHBondContact O-N 3.25Å; A67-S71 PolarHBondContact O-OG 3.37Å |
| 68 | V | 70.5 | Confident | 66.8 | Low | 92 Ų | 92 | 43.7 Ų | 43.7 | 56% | 0.558 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -66.8 | -44 | 179.6 | -179.5 | 0 | 0 | 0 | 0 | 109.6 | S65 S71 V72 | S65-V68 PolarHBondContact O-N 2.94Å; V68-S71 PolarHBondContact O-N 3.25Å; V68-V72 VanDerWaalsContact O-CG2 3.31Å; V68-V72 WeakPolarHBondContact O-CG2 3.33Å; V68-V72 PolarHBondContact O-N 2.88Å |
| 69 | V | 68.5 | Low | 67.2 | Low | 22 Ų | 22 | 47.8 Ų | 47.8 | 13% | 0.133 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.6 | -50.4 | -180 | 172 | 0 | 0 | 0 | 0 | 111.9 | S65 I66 S71 V72 L73 Q113 L117 | S65-V69 VanDerWaalsContact O-CG2 3.23Å; S65-V69 WeakPolarHBondContact O-CG2 3.23Å; S65-V69 PolarHBondContact O-N 3.49Å; I66-V69 PolarHBondContact O-N 3.21Å; V69-S71 VanDerWaalsContact C-N 3.33Å; V69-V72 PolarHBondContact O-N 3.28Å; V69-L73 WeakPolarHBondContact O-CB 3.31Å; V69-L73 PolarHBondContact O-N 3.12Å; V69-Q113 HydrophobicContact CG1-CG 4.34Å; V69-Q113 VanDerWaalsContact CG1-NE2 3.27Å; V69-L117 HydrophobicContact CB-CD2 4.44Å; V69-L117 HydrophobicContact CG1-CD1 3.75Å; V69-L117 HydrophobicContact CG1-CD2 4.43Å; V69-L117 HydrophobicContact CG1-CG 4.33Å; V69-L117 HydrophobicContact CG2-CD1 4.07Å; V69-L117 HydrophobicContact CG2-CD2 3.2Å; V69-L117 HydrophobicContact CG2-CG 3.77Å |
| 70 | N | 67.8 | Low | 67.2 | Low | 59 Ų | 59 | 48 Ų | 48 | 32% | 0.316 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -66.5 | -39.1 | -179.8 | -71.4 | -15.9 | 0 | 0 | 0 | 110.8 | I66 V72 L73 F74 | I66-N70 WeakPolarHBondContact O-CB 3.19Å; I66-N70 PolarHBondContact O-N 3.45Å; I66-N70 PolarHBondContact O-ND2 2.96Å; N70-V72 PolarHBondContact O-N 3.36Å; N70-L73 PolarHBondContact O-N 3.2Å; N70-F74 HydrophobicContact CB-CD2 4.33Å; N70-F74 HydrophobicContact CB-CE2 4.27Å; N70-F74 WeakPolarHBondContact O-CD2 3.13Å; N70-F74 PolarHBondContact O-N 3.05Å |
| 71 | S | 68.3 | Low | 67.1 | Low | 58 Ų | 58 | 44.8 Ų | 44.8 | 41% | 0.406 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.1 | -44.6 | 175 | -61.6 | 0 | 0 | 0 | 0 | 112.3 | A67 V68 V69 G75 | A67-S71 VanDerWaalsContact O-CB 3.24Å; A67-S71 WeakPolarHBondContact O-CB 3.2Å; A67-S71 PolarHBondContact O-N 3.25Å; A67-S71 PolarHBondContact O-OG 3.37Å; V68-S71 PolarHBondContact O-N 3.25Å; V69-S71 VanDerWaalsContact C-N 3.33Å; S71-G75 WeakPolarHBondContact O-CA 3.22Å; S71-G75 PolarHBondContact O-N 3.41Å |
| 72 | V | 70.5 | Confident | 67.2 | Low | 40 Ų | 40 | 46.7 Ų | 46.7 | 24% | 0.242 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.8 | -45.1 | 176.4 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | V68 V69 N70 G75 V76 | V68-V72 VanDerWaalsContact O-CG2 3.31Å; V68-V72 WeakPolarHBondContact O-CG2 3.33Å; V68-V72 PolarHBondContact O-N 2.88Å; V69-V72 PolarHBondContact O-N 3.28Å; N70-V72 PolarHBondContact O-N 3.36Å; V72-G75 PolarHBondContact O-N 2.98Å; V72-V76 HydrophobicContact CG1-CG2 4.11Å; V72-V76 VanDerWaalsContact O-CB 3.31Å; V72-V76 WeakPolarHBondContact O-CB 3.19Å; V72-V76 WeakPolarHBondContact O-CG2 3.17Å; V72-V76 PolarHBondContact O-N 3.32Å |
| 73 | L | 67.4 | Low | 67.2 | Low | 26 Ų | 26 | 53 Ų | 53 | 14% | 0.136 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -58.9 | -53.1 | 178.9 | 177.2 | 58.1 | 0 | 0 | 0 | 111.9 | V69 N70 Y77 Q113 V178 | V69-L73 WeakPolarHBondContact O-CB 3.31Å; V69-L73 PolarHBondContact O-N 3.12Å; N70-L73 PolarHBondContact O-N 3.2Å; L73-Y77 WeakPolarHBondContact O-CB 3.39Å; L73-Y77 PolarHBondContact O-N 3.48Å; L73-Q113 HydrophobicContact CB-CG 4.3Å; L73-V178 HydrophobicContact CD1-CG1 4.45Å |
| 74 | F | 66.3 | Low | 66.8 | Low | 124 Ų | 124 | 53.4 Ų | 53.4 | 54% | 0.544 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -70.1 | -35.6 | -178.9 | -71.3 | -62.5 | 0 | 0 | 0 | 112.7 | N70 S78 | N70-F74 HydrophobicContact CB-CD2 4.33Å; N70-F74 HydrophobicContact CB-CE2 4.27Å; N70-F74 WeakPolarHBondContact O-CD2 3.13Å; N70-F74 PolarHBondContact O-N 3.05Å; F74-S78 VanDerWaalsContact O-CB 3.25Å; F74-S78 WeakPolarHBondContact O-CB 3.38Å; F74-S78 PolarHBondContact O-N 3.26Å; F74-S78 PolarHBondContact O-OG 2.96Å |
| 75 | G | 68.1 | Low | 66.3 | Low | 41 Ų | 41 | 52.8 Ų | 52.8 | 42% | 0.423 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -65.5 | -47.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | S71 V72 S78 N79 | S71-G75 WeakPolarHBondContact O-CA 3.22Å; S71-G75 PolarHBondContact O-N 3.41Å; V72-G75 PolarHBondContact O-N 2.98Å; G75-S78 PolarHBondContact O-N 2.95Å; G75-N79 WeakPolarHBondContact O-CB 3.49Å; G75-N79 PolarHBondContact O-N 3.38Å |
| 76 | V | 69.2 | Low | 65.9 | Low | 25 Ų | 25 | 56.1 Ų | 56.1 | 15% | 0.152 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -66.8 | -45.5 | 176.7 | 177.3 | 0 | 0 | 0 | 0 | 110.4 | V72 S78 N79 T80 L112 | V72-V76 HydrophobicContact CG1-CG2 4.11Å; V72-V76 VanDerWaalsContact O-CB 3.31Å; V72-V76 WeakPolarHBondContact O-CB 3.19Å; V72-V76 WeakPolarHBondContact O-CG2 3.17Å; V72-V76 PolarHBondContact O-N 3.32Å; V76-S78 VanDerWaalsContact C-N 3.3Å; V76-S78 PolarHBondContact O-N 3.47Å; V76-N79 PolarHBondContact O-N 3.49Å; V76-T80 VanDerWaalsContact O-CB 3.24Å; V76-T80 WeakPolarHBondContact O-CB 3.41Å; V76-T80 PolarHBondContact O-N 2.92Å; V76-T80 PolarHBondContact O-OG1 3.36Å; V76-L112 HydrophobicContact CG1-CB 4.15Å; V76-L112 HydrophobicContact CG1-CD1 3.59Å; V76-L112 HydrophobicContact CG1-CG 4.46Å; V76-L112 HydrophobicContact CG2-CB 4.27Å; V76-L112 HydrophobicContact CG2-CD1 4.31Å |
| 77 | Y | 65.6 | Low | 64.9 | Low | 36 Ų | 36 | 58.2 Ų | 58.2 | 14% | 0.141 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -55 | -47.4 | 176 | 179.8 | -100.1 | 0 | 0 | 0 | 111.6 | L73 L81 A105 F182 | L73-Y77 WeakPolarHBondContact O-CB 3.39Å; L73-Y77 PolarHBondContact O-N 3.48Å; Y77-L81 HydrophobicContact CE1-CD2 4.4Å; Y77-L81 WeakPolarHBondContact O-CB 3.45Å; Y77-L81 PolarHBondContact O-N 3.01Å; Y77-A105 HydrophobicContact CD2-CB 4.46Å; Y77-A105 HydrophobicContact CE2-CB 4.37Å; Y77-F182 HydrophobicContact CD1-CZ 4.49Å; Y77-F182 HydrophobicContact CD2-CD2 4.4Å; Y77-F182 HydrophobicContact CD2-CE1 4.1Å; Y77-F182 AromaticContact CD2-CE2 3.89Å; Y77-F182 HydrophobicContact CD2-CE2 3.89Å; Y77-F182 AromaticContact CD2-CZ 3.73Å; Y77-F182 HydrophobicContact CD2-CZ 3.73Å; Y77-F182 HydrophobicContact CE1-CE1 4.09Å; Y77-F182 HydrophobicContact CE1-CZ 4.44Å; Y77-F182 AromaticContact CE2-CD1 3.74Å; Y77-F182 HydrophobicContact CE2-CD1 3.74Å; Y77-F182 HydrophobicContact CE2-CD2 4.11Å; Y77-F182 AromaticContact CE2-CE1 3.56Å; Y77-F182 HydrophobicContact CE2-CE1 3.56Å; Y77-F182 AromaticContact CE2-CE2 3.95Å; Y77-F182 HydrophobicContact CE2-CE2 3.95Å; Y77-F182 HydrophobicContact CE2-CG 4.02Å; Y77-F182 AromaticContact CE2-CZ 3.67Å; Y77-F182 HydrophobicContact CE2-CZ 3.67Å; Y77-F182 HydrophobicContact CG-CZ 4.14Å; Y77-F182 AromaticContact CZ-CD1 3.84Å; Y77-F182 AromaticContact CZ-CE1 3.55Å |
| 78 | S | 64.1 | Low | 63.9 | Low | 49 Ų | 49 | 61.4 Ų | 61.4 | 34% | 0.343 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.8 | -46.1 | 179 | -61.1 | 0 | 0 | 0 | 0 | 112 | F74 G75 V76 L81 L82 | F74-S78 VanDerWaalsContact O-CB 3.25Å; F74-S78 WeakPolarHBondContact O-CB 3.38Å; F74-S78 PolarHBondContact O-N 3.26Å; F74-S78 PolarHBondContact O-OG 2.96Å; G75-S78 PolarHBondContact O-N 2.95Å; V76-S78 VanDerWaalsContact C-N 3.3Å; V76-S78 PolarHBondContact O-N 3.47Å; S78-L81 PolarHBondContact O-N 3Å; S78-L82 WeakPolarHBondContact O-CG 3.46Å; S78-L82 PolarHBondContact O-N 2.72Å |
| 79 | N | 67.6 | Low | 62.7 | Low | 105 Ų | 105 | 63.6 Ų | 63.6 | 56% | 0.561 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -71.3 | -38.8 | -177.4 | -163.9 | 52 | 0 | 0 | 0 | 112.6 | G75 V76 L82 L83 | G75-N79 WeakPolarHBondContact O-CB 3.49Å; G75-N79 PolarHBondContact O-N 3.38Å; V76-N79 PolarHBondContact O-N 3.49Å; N79-L82 PolarHBondContact O-N 3.25Å; N79-L83 WeakPolarHBondContact O-CB 3.41Å; N79-L83 PolarHBondContact O-N 2.61Å |
| 80 | T | 64.6 | Low | 61.5 | Low | 17 Ų | 17 | 70.7 Ų | 70.7 | 10% | 0.104 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -68.5 | -38.6 | 176.2 | -61 | 0 | 0 | 0 | 0 | 111.3 | V76 L82 L83 L84 A105 T108 | V76-T80 VanDerWaalsContact O-CB 3.24Å; V76-T80 WeakPolarHBondContact O-CB 3.41Å; V76-T80 PolarHBondContact O-N 2.92Å; V76-T80 PolarHBondContact O-OG1 3.36Å; T80-L82 VanDerWaalsContact C-N 3.34Å; T80-L83 PolarHBondContact O-N 3.31Å; T80-L84 HydrophobicContact CG2-CD1 3.56Å; T80-L84 WeakPolarHBondContact O-CB 3.47Å; T80-L84 WeakPolarHBondContact O-CD1 3.39Å; T80-L84 PolarHBondContact O-N 3.21Å; T80-A105 HydrophobicContact CG2-CB 4.1Å; T80-T108 HydrophobicContact CG2-CG2 3.98Å |
| 81 | L | 62.3 | Low | 60.4 | Low | 19 Ų | 19 | 73.1 Ų | 73.1 | 10% | 0.099 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -64 | -40.2 | 173.3 | -167.4 | 72.8 | 0 | 0 | 0 | 111.4 | Y77 S78 T85 A105 | Y77-L81 HydrophobicContact CE1-CD2 4.4Å; Y77-L81 WeakPolarHBondContact O-CB 3.45Å; Y77-L81 PolarHBondContact O-N 3.01Å; S78-L81 PolarHBondContact O-N 3Å; L81-T85 VanDerWaalsContact O-CB 3.25Å; L81-T85 WeakPolarHBondContact O-CB 3.47Å; L81-T85 PolarHBondContact O-N 3.05Å; L81-T85 PolarHBondContact O-OG1 3.16Å; L81-A105 HydrophobicContact CD1-CB 4.27Å |
| 82 | L | 65.4 | Low | 59.4 | Low | 79 Ų | 79 | 77 Ų | 77 | 41% | 0.414 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 174 | -73.1 | 169.1 | 0 | 0 | 0 | 112 | S78 N79 T80 A86 | S78-L82 WeakPolarHBondContact O-CG 3.46Å; S78-L82 PolarHBondContact O-N 2.72Å; N79-L82 PolarHBondContact O-N 3.25Å; T80-L82 VanDerWaalsContact C-N 3.34Å; L82-A86 PolarHBondContact O-N 2.94Å |
| 83 | L | 65 | Low | 58.2 | Low | 141 Ų | 141 | 86.5 Ų | 86.5 | 74% | 0.738 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -68 | -41.1 | 179.8 | -156.1 | 90.4 | 0 | 0 | 0 | 112.6 | N79 T80 | N79-L83 WeakPolarHBondContact O-CB 3.41Å; N79-L83 PolarHBondContact O-N 2.61Å; T80-L83 PolarHBondContact O-N 3.31Å |
| 84 | L | 60.8 | Low | 57.1 | Low | 52 Ų | 52 | 89 Ų | 89 | 27% | 0.272 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -75.3 | -29.1 | -178.6 | -84.9 | 154.3 | 0 | 0 | 0 | 113.5 | T80 L104 A105 | T80-L84 HydrophobicContact CG2-CD1 3.56Å; T80-L84 WeakPolarHBondContact O-CB 3.47Å; T80-L84 WeakPolarHBondContact O-CD1 3.39Å; T80-L84 PolarHBondContact O-N 3.21Å; L84-L104 HydrophobicContact CD1-CB 4.31Å; L84-L104 HydrophobicContact CD2-CD2 3.86Å; L84-A105 HydrophobicContact CD1-CB 4.12Å |
| 85 | T | 58 | Low | 56 | Low | 57 Ų | 57 | 90.4 Ų | 90.4 | 35% | 0.35 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -86.9 | -22.1 | -175.9 | -47.3 | 0 | 0 | 0 | 0 | 111.2 | L81 T87 | L81-T85 VanDerWaalsContact O-CB 3.25Å; L81-T85 WeakPolarHBondContact O-CB 3.47Å; L81-T85 PolarHBondContact O-N 3.05Å; L81-T85 PolarHBondContact O-OG1 3.16Å; T85-T87 WeakPolarHBondContact CG2-OG1 3.43Å; T85-T87 PolarHBondContact O-N 3.33Å; T85-T87 PolarHBondContact O-OG1 3.36Å |
| 86 | A | 55.4 | Low | 55.4 | Low | 89 Ų | 89 | 93 Ų | 93 | 74% | 0.736 | 49% | 0.491 | S | S | * | . | trans | 45.7 | 21 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | L82 | L82-A86 PolarHBondContact O-N 2.94Š| ||
| 87 | T | 49.2 | Very low | 54.8 | Low | 68 Ų | 68 | 93.9 Ų | 93.9 | 42% | 0.417 | 50% | 0.498 | S | S | . | . | S | Bend | trans | -137.3 | 146.3 | -178.4 | 48.6 | 0 | 0 | 0 | 0 | 111.3 | T85 E91 | T85-T87 WeakPolarHBondContact CG2-OG1 3.43Å; T85-T87 PolarHBondContact O-N 3.33Å; T85-T87 PolarHBondContact O-OG1 3.36Å; T87-E91 WeakPolarHBondContact CB-OE2 3.22Å; T87-E91 VanDerWaalsContact CG2-OE2 3.24Å; T87-E91 WeakPolarHBondContact CG2-OE2 3.16Å |
| 88 | S | 47 | Very low | 54.8 | Low | 91 Ų | 91 | 95.1 Ų | 95.1 | 64% | 0.636 | 51% | 0.512 | S | S | * | . | trans | -60.1 | 154.2 | -166.9 | -161.4 | 0 | 0 | 0 | 0 | 112.6 | Q90 E91 | S88-Q90 PolarHBondContact O-N 3.35Å; S88-E91 PolarHBondContact O-N 3.37Å | ||
| 89 | H | 46.5 | Very low | 54.8 | Low | 137 Ų | 137 | 97.7 Ų | 97.7 | 63% | 0.634 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -46.7 | -16.6 | 179.5 | -126.3 | -94.7 | 0 | 0 | 0 | 115.1 | R92 | H89-R92 WeakPolarHBondContact O-CB 3.32Š|
| 90 | Q | 41.7 | Very low | 54.5 | Low | 172 Ų | 172 | 97.2 Ų | 97.2 | 80% | 0.804 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86 | -27.9 | -176.4 | -158.5 | 140.2 | -29.1 | 0 | 0 | 114.5 | S88 | S88-Q90 PolarHBondContact O-N 3.35Š|
| 91 | E | 46.1 | Very low | 54.7 | Low | 110 Ų | 110 | 100.1 Ų | 100.1 | 51% | 0.514 | 53% | 0.528 | S | S | . | . | G | 310 helix | trans | -85 | -12.7 | 175.9 | -75 | -174.3 | 138.6 | 0 | 0 | 113.2 | T87 S88 R93 A94 Q95 | T87-E91 WeakPolarHBondContact CB-OE2 3.22Å; T87-E91 VanDerWaalsContact CG2-OE2 3.24Å; T87-E91 WeakPolarHBondContact CG2-OE2 3.16Å; S88-E91 PolarHBondContact O-N 3.37Å; E91-R93 PolarHBondContact O-N 3.1Å; E91-A94 PolarHBondContact O-N 3.31Å; E91-Q95 PolarHBondContact O-N 3.42Å |
| 92 | R | 46.8 | Very low | 54.9 | Low | 139 Ų | 139 | 99.2 Ų | 99.2 | 53% | 0.525 | 52% | 0.523 | S | S | . | . | G | 310 helix | trans | -54.3 | -20.1 | 173.7 | -141.8 | -176.6 | -165.3 | -171.4 | 4.2 | 113.8 | H89 | H89-R92 WeakPolarHBondContact O-CB 3.32Š|
| 93 | R | 45.9 | Very low | 55.1 | Low | 240 Ų | 240 | 98.8 Ų | 98.8 | 91% | 0.906 | 52% | 0.518 | S | S | * | . | G | 310 helix | trans | -100.3 | -13.3 | -179.4 | -128.5 | 176.7 | -173.3 | 172.9 | 0.9 | 113.5 | E91 | E91-R93 PolarHBondContact O-N 3.1Š|
| 94 | A | 42.6 | Very low | 55.4 | Low | 77 Ų | 77 | 96.1 Ų | 96.1 | 64% | 0.636 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.4 | -27.9 | -167.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | E91 | E91-A94 PolarHBondContact O-N 3.31Š|
| 95 | Q | 44.9 | Very low | 55.8 | Low | 155 Ų | 155 | 93.7 Ų | 93.7 | 72% | 0.724 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -137.3 | 125.3 | 178.5 | -69.3 | -177 | -4.4 | 0 | 0 | 111.5 | E91 | E91-Q95 PolarHBondContact O-N 3.42Š|
| 96 | P | 54.8 | Low | 56.2 | Low | 94 Ų | 94 | 91 Ų | 91 | 61% | 0.61 | 48% | 0.475 | S | S | * | . | P | Polyproline II helix | trans | -66.4 | 124 | 178.1 | 26.3 | -31.8 | 0 | 0 | 0 | 109.7 | ||
| 97 | P | 57.1 | Low | 57 | Low | 44 Ų | 44 | 87.6 Ų | 87.6 | 29% | 0.286 | 45% | 0.446 | S | S | . | . | P | Polyproline II helix | trans | -57.5 | 146.3 | -174.4 | 16.5 | -27 | 0 | 0 | 0 | 112.5 | Y99 I102 R190 | P97-Y99 PolarHBondContact O-N 3.47Å; P97-I102 HydrophobicContact CB-CD1 4.23Å; P97-I102 HydrophobicContact CB-CG1 4.28Å; P97-I102 HydrophobicContact CG-CD1 4.09Å; P97-I102 HydrophobicContact CG-CG1 4.21Å; P97-I102 WeakPolarHBondContact O-CD1 3.31Å; P97-R190 VanDerWaalsContact O-CZ 3.28Å; P97-R190 PolarHBondContact O-NH1 2.92Å; P97-R190 PolarHBondContact O-NH2 2.93Å |
| 98 | S | 65 | Low | 58.3 | Low | 63 Ų | 63 | 86.9 Ų | 86.9 | 44% | 0.441 | 44% | 0.441 | S | S | . | . | P | Polyproline II helix | trans | -62 | 138.4 | 179.2 | -174.6 | 0 | 0 | 0 | 0 | 111.1 | T100 H101 I102 | S98-T100 PolarHBondContact O-N 3.26Å; S98-H101 PolarHBondContact O-N 3.11Å; S98-I102 PolarHBondContact O-N 2.95Å |
| 99 | Y | 63.7 | Low | 59.3 | Low | 103 Ų | 103 | 82.6 Ų | 82.6 | 40% | 0.404 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -49.6 | -32 | 179.3 | -68.8 | -75.7 | 0 | 0 | 0 | 112.8 | P97 F103 R190 | P97-Y99 PolarHBondContact O-N 3.47Å; Y99-F103 WeakPolarHBondContact O-CB 3.18Å; Y99-F103 PolarHBondContact O-N 3.3Å; Y99-R190 WeakPolarHBondContact OH-CD 3.35Å |
| 100 | T | 62.6 | Low | 60.4 | Low | 95 Ų | 95 | 76.1 Ų | 76.1 | 58% | 0.583 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -68 | -37.9 | 177.6 | -39.1 | 0 | 0 | 0 | 0 | 112.8 | S98 L104 | S98-T100 PolarHBondContact O-N 3.26Å; T100-L104 WeakPolarHBondContact O-CB 3.2Å; T100-L104 PolarHBondContact O-N 2.88Å |
| 101 | H | 67.4 | Low | 62.2 | Low | 78 Ų | 78 | 71.6 Ų | 71.6 | 36% | 0.361 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -70.4 | -38.2 | 177.6 | -70.2 | -65.2 | 0 | 0 | 0 | 111.7 | S98 L104 A105 | S98-H101 PolarHBondContact O-N 3.11Å; H101-L104 PolarHBondContact O-N 2.86Å; H101-A105 VanDerWaalsContact O-CB 3.26Å; H101-A105 WeakPolarHBondContact O-CB 3.45Å; H101-A105 PolarHBondContact O-N 2.85Å |
| 102 | I | 67.3 | Low | 63.5 | Low | 0 Ų | 0 | 69.8 Ų | 69.8 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65 | -44 | 176.2 | -64 | 144.8 | 0 | 0 | 0 | 110.3 | P97 S98 A105 G106 F182 E186 | P97-I102 HydrophobicContact CB-CD1 4.23Å; P97-I102 HydrophobicContact CB-CG1 4.28Å; P97-I102 HydrophobicContact CG-CD1 4.09Å; P97-I102 HydrophobicContact CG-CG1 4.21Å; P97-I102 WeakPolarHBondContact O-CD1 3.31Å; S98-I102 PolarHBondContact O-N 2.95Å; I102-A105 PolarHBondContact O-N 2.88Å; I102-G106 PolarHBondContact O-N 2.9Å; I102-F182 HydrophobicContact CG2-CB 3.82Å; I102-E186 HydrophobicContact CD1-CG 3.99Å; I102-E186 VanDerWaalsContact CD1-OE1 3.29Å; I102-E186 WeakPolarHBondContact CD1-OE1 3.13Å; I102-E186 WeakPolarHBondContact CD1-OE2 3.22Å; I102-E186 WeakPolarHBondContact CG1-OE2 3.42Å; I102-E186 WeakPolarHBondContact CG2-OE2 3.11Å |
| 103 | F | 69.8 | Low | 64.9 | Low | 69 Ų | 69 | 64.1 Ų | 64.1 | 30% | 0.303 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.9 | -46.2 | 175 | -176.6 | -109.5 | 0 | 0 | 0 | 112.4 | Y99 A105 G106 C107 I183 | Y99-F103 WeakPolarHBondContact O-CB 3.18Å; Y99-F103 PolarHBondContact O-N 3.3Å; F103-A105 VanDerWaalsContact C-N 3.34Å; F103-A105 PolarHBondContact O-N 3.16Å; F103-G106 PolarHBondContact O-N 3.22Å; F103-C107 WeakPolarHBondContact CZ-SG 3.43Å; F103-C107 WeakPolarHBondContact O-CB 3.3Å; F103-C107 PolarHBondContact O-N 2.84Å; F103-C107 PolarHBondContact O-SG 3.36Å; F103-C107 VanDerWaalsContact O-SG 3.33Å; F103-I183 HydrophobicContact CB-CD1 3.68Å; F103-I183 HydrophobicContact CB-CG1 3.83Å; F103-I183 HydrophobicContact CD2-CD1 3.2Å; F103-I183 HydrophobicContact CD2-CG1 3.82Å; F103-I183 HydrophobicContact CE2-CD1 4Å; F103-I183 HydrophobicContact CG-CD1 3.65Å; F103-I183 HydrophobicContact CG-CG1 4.23Å |
| 104 | L | 71.4 | Confident | 66.2 | Low | 86 Ų | 86 | 52.7 Ų | 52.7 | 45% | 0.45 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -66.1 | -38.6 | -179.5 | -141.6 | 77 | 0 | 0 | 0 | 111.6 | L84 T100 H101 T108 | L84-L104 HydrophobicContact CD1-CB 4.31Å; L84-L104 HydrophobicContact CD2-CD2 3.86Å; T100-L104 WeakPolarHBondContact O-CB 3.2Å; T100-L104 PolarHBondContact O-N 2.88Å; H101-L104 PolarHBondContact O-N 2.86Å; L104-T108 WeakPolarHBondContact O-CB 3.23Å; L104-T108 PolarHBondContact O-N 3.25Å; L104-T108 PolarHBondContact O-OG1 2.93Å |
| 105 | A | 68 | Low | 68 | Low | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.8 | -42.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y77 T80 L81 L84 H101 I102 F103 G109 | Y77-A105 HydrophobicContact CD2-CB 4.46Å; Y77-A105 HydrophobicContact CE2-CB 4.37Å; T80-A105 HydrophobicContact CG2-CB 4.1Å; L81-A105 HydrophobicContact CD1-CB 4.27Å; L84-A105 HydrophobicContact CD1-CB 4.12Å; H101-A105 VanDerWaalsContact O-CB 3.26Å; H101-A105 WeakPolarHBondContact O-CB 3.45Å; H101-A105 PolarHBondContact O-N 2.85Å; I102-A105 PolarHBondContact O-N 2.88Å; F103-A105 VanDerWaalsContact C-N 3.34Å; F103-A105 PolarHBondContact O-N 3.16Å; A105-G109 PolarHBondContact O-N 3.43Å |
| 106 | G | 67.4 | Low | 69.6 | Low | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.6 | -45.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | I102 F103 G109 G110 V178 | I102-G106 PolarHBondContact O-N 2.9Å; F103-G106 PolarHBondContact O-N 3.22Å; G106-G109 PolarHBondContact O-N 3.18Å; G106-G110 PolarHBondContact O-N 3.24Å; G106-V178 VanDerWaalsContact O-CG1 3.29Å; G106-V178 WeakPolarHBondContact O-CG1 3.45Å |
| 107 | C | 72.8 | Confident | 70.5 | Confident | 19 Ų | 19 | 46.9 Ų | 46.9 | 13% | 0.128 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.3 | -44.9 | 176.7 | -75.3 | 0 | 0 | 0 | 0 | 112.1 | F103 G110 F111 T175 | F103-C107 WeakPolarHBondContact CZ-SG 3.43Å; F103-C107 WeakPolarHBondContact O-CB 3.3Å; F103-C107 PolarHBondContact O-N 2.84Å; F103-C107 PolarHBondContact O-SG 3.36Å; F103-C107 VanDerWaalsContact O-SG 3.33Å; C107-G110 PolarHBondContact O-N 3.38Å; C107-F111 WeakPolarHBondContact O-CB 3.49Å; C107-F111 PolarHBondContact O-N 2.94Å; C107-T175 HydrophobicContact CB-CG2 3.74Å |
| 108 | T | 74.8 | Confident | 71.3 | Confident | 53 Ų | 53 | 45 Ų | 45 | 33% | 0.325 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -66.1 | -40.5 | 177.9 | -52.8 | 0 | 0 | 0 | 0 | 111.3 | T80 L104 F111 L112 | T80-T108 HydrophobicContact CG2-CG2 3.98Å; L104-T108 WeakPolarHBondContact O-CB 3.23Å; L104-T108 PolarHBondContact O-N 3.25Å; L104-T108 PolarHBondContact O-OG1 2.93Å; T108-F111 PolarHBondContact O-N 3.29Å; T108-L112 HydrophobicContact CG2-CD1 4.33Å; T108-L112 PolarHBondContact O-N 3.21Å; T108-L112 VanDerWaalsContact O-N 3.1Å |
| 109 | G | 68.3 | Low | 71.8 | Confident | 1 Ų | 1 | 42.9 Ų | 42.9 | 1% | 0.01 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59 | -51.5 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A105 G106 F111 L112 Q113 | A105-G109 PolarHBondContact O-N 3.43Å; G106-G109 PolarHBondContact O-N 3.18Å; G109-F111 VanDerWaalsContact C-N 3.32Å; G109-F111 PolarHBondContact O-N 2.58Å; G109-L112 PolarHBondContact O-N 2.91Å; G109-Q113 WeakPolarHBondContact O-CB 3.38Å; G109-Q113 PolarHBondContact O-N 2.92Å |
| 110 | G | 70 | Confident | 72.2 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.9 | -38.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | G106 C107 A114 | G106-G110 PolarHBondContact O-N 3.24Å; C107-G110 PolarHBondContact O-N 3.38Å; G110-A114 WeakPolarHBondContact O-CB 3.46Å; G110-A114 PolarHBondContact O-N 2.69Å |
| 111 | F | 78.8 | Confident | 72.6 | Confident | 78 Ų | 78 | 39.6 Ų | 39.6 | 34% | 0.342 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -64.8 | -50.6 | 177.4 | -177.7 | -93.8 | 0 | 0 | 0 | 112.6 | C107 T108 G109 A114 Y115 W168 M171 | C107-F111 WeakPolarHBondContact O-CB 3.49Å; C107-F111 PolarHBondContact O-N 2.94Å; T108-F111 PolarHBondContact O-N 3.29Å; G109-F111 VanDerWaalsContact C-N 3.32Å; G109-F111 PolarHBondContact O-N 2.58Å; F111-A114 PolarHBondContact O-N 3.24Å; F111-Y115 PolarHBondContact O-N 3.47Å; F111-W168 AromaticContact CE2-CZ3 3.9Å; F111-W168 HydrophobicContact CE2-CZ3 3.9Å; F111-M171 HydrophobicContact CD1-CE 4.32Å; F111-M171 HydrophobicContact CD2-CB 4.14Å; F111-M171 HydrophobicContact CD2-CE 4.11Å; F111-M171 HydrophobicContact CD2-CG 4.16Å; F111-M171 HydrophobicContact CD2-SD 4.21Å; F111-M171 HydrophobicContact CE1-CE 3.81Å; F111-M171 HydrophobicContact CE2-CB 4.2Å; F111-M171 HydrophobicContact CE2-CE 3.58Å; F111-M171 HydrophobicContact CE2-CG 4.09Å; F111-M171 HydrophobicContact CE2-SD 3.55Å; F111-M171 VanDerWaalsContact CE2-SD 3.55Å; F111-M171 HydrophobicContact CG-CE 4.46Å; F111-M171 HydrophobicContact CZ-CE 3.41Å; F111-M171 VanDerWaalsContact CZ-CE 3.41Å; F111-M171 HydrophobicContact CZ-SD 3.89Å |
| 112 | L | 75.4 | Confident | 72.8 | Confident | 71 Ų | 71 | 36.8 Ų | 36.8 | 37% | 0.372 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -69 | -38.7 | -179.5 | -73.6 | 172.2 | 0 | 0 | 0 | 111.7 | V76 T108 G109 Y115 C116 | V76-L112 HydrophobicContact CG1-CB 4.15Å; V76-L112 HydrophobicContact CG1-CD1 3.59Å; V76-L112 HydrophobicContact CG1-CG 4.46Å; V76-L112 HydrophobicContact CG2-CB 4.27Å; V76-L112 HydrophobicContact CG2-CD1 4.31Å; T108-L112 HydrophobicContact CG2-CD1 4.33Å; T108-L112 PolarHBondContact O-N 3.21Å; T108-L112 VanDerWaalsContact O-N 3.1Å; G109-L112 PolarHBondContact O-N 2.91Å; L112-Y115 WeakPolarHBondContact O-CB 3.36Å; L112-Y115 PolarHBondContact O-N 2.99Å; L112-C116 PolarHBondContact O-N 2.86Å; L112-C116 PolarHBondContact O-SG 2.99Å |
| 113 | Q | 74.8 | Confident | 73 | Confident | 21 Ų | 21 | 37.4 Ų | 37.4 | 10% | 0.098 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -58.4 | -49.7 | 171.9 | -175.8 | -165.4 | 1.4 | 0 | 0 | 110.7 | V69 L73 G109 Y115 C116 L117 | V69-Q113 HydrophobicContact CG1-CG 4.34Å; V69-Q113 VanDerWaalsContact CG1-NE2 3.27Å; L73-Q113 HydrophobicContact CB-CG 4.3Å; G109-Q113 WeakPolarHBondContact O-CB 3.38Å; G109-Q113 PolarHBondContact O-N 2.92Å; Q113-Y115 VanDerWaalsContact C-N 3.3Å; Q113-Y115 PolarHBondContact O-N 2.64Å; Q113-C116 PolarHBondContact O-N 2.66Å; Q113-L117 HydrophobicContact CG-CD1 3.9Å; Q113-L117 VanDerWaalsContact O-CB 3.28Å; Q113-L117 WeakPolarHBondContact O-CB 3.13Å; Q113-L117 PolarHBondContact O-N 3.24Å |
| 114 | A | 73.6 | Confident | 73 | Confident | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.1 | -36 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G110 F111 L117 A118 L170 M171 D174 | G110-A114 WeakPolarHBondContact O-CB 3.46Å; G110-A114 PolarHBondContact O-N 2.69Å; F111-A114 PolarHBondContact O-N 3.24Å; A114-L117 PolarHBondContact O-N 3.36Å; A114-A118 WeakPolarHBondContact O-CB 3.42Å; A114-A118 PolarHBondContact O-N 3.47Å; A114-L170 HydrophobicContact CB-CD2 4.35Å; A114-L170 HydrophobicContact CB-CG 4.11Å; A114-M171 HydrophobicContact CB-CB 4.41Å; A114-M171 HydrophobicContact CB-CG 3.82Å; A114-D174 HydrophobicContact CB-CB 3.99Å |
| 115 | Y | 80.3 | Confident | 72.7 | Confident | 117 Ų | 117 | 33.3 Ų | 33.3 | 46% | 0.459 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -62.3 | -48.1 | 174.7 | -172.8 | -111.8 | 0 | 0 | 0 | 112.2 | F111 L112 Q113 L117 F164 M171 | F111-Y115 PolarHBondContact O-N 3.47Å; L112-Y115 WeakPolarHBondContact O-CB 3.36Å; L112-Y115 PolarHBondContact O-N 2.99Å; Q113-Y115 VanDerWaalsContact C-N 3.3Å; Q113-Y115 PolarHBondContact O-N 2.64Å; Y115-L117 VanDerWaalsContact C-N 3.3Å; Y115-L117 PolarHBondContact O-N 2.98Å; Y115-F164 HydrophobicContact CD2-CD1 4.3Å; Y115-F164 AromaticContact CD2-CE1 3.8Å; Y115-F164 HydrophobicContact CD2-CE1 3.8Å; Y115-F164 HydrophobicContact CE1-CE1 4.45Å; Y115-F164 AromaticContact CE2-CD1 3.98Å; Y115-F164 HydrophobicContact CE2-CD1 3.98Å; Y115-F164 AromaticContact CE2-CE1 3.43Å; Y115-F164 HydrophobicContact CE2-CE1 3.43Å; Y115-F164 VanDerWaalsContact CE2-CE1 3.43Å; Y115-F164 HydrophobicContact CE2-CZ 4.09Å; Y115-F164 HydrophobicContact CG-CE1 4.48Å; Y115-F164 AromaticContact CZ-CE1 3.8Å; Y115-M171 HydrophobicContact CD2-CE 3.41Å; Y115-M171 VanDerWaalsContact CD2-CE 3.41Å; Y115-M171 HydrophobicContact CG-CE 3.82Å |
| 116 | C | 77.7 | Confident | 72.8 | Confident | 64 Ų | 64 | 36.2 Ų | 36.2 | 43% | 0.432 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -65.5 | -35.7 | 177.3 | -69.4 | 0 | 0 | 0 | 0 | 112 | L112 Q113 F120 | L112-C116 PolarHBondContact O-N 2.86Å; L112-C116 PolarHBondContact O-SG 2.99Å; Q113-C116 PolarHBondContact O-N 2.66Å; C116-F120 WeakPolarHBondContact O-CD2 3.49Å; C116-F120 WeakPolarHBondContact O-CE2 3.26Å |
| 117 | L | 73.8 | Confident | 72.7 | Confident | 22 Ų | 22 | 37.4 Ų | 37.4 | 12% | 0.115 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -78.9 | -26.3 | -179.1 | -90.8 | 172.8 | 0 | 0 | 0 | 114.8 | V69 Q113 A114 Y115 F120 D121 L170 | V69-L117 HydrophobicContact CB-CD2 4.44Å; V69-L117 HydrophobicContact CG1-CD1 3.75Å; V69-L117 HydrophobicContact CG1-CD2 4.43Å; V69-L117 HydrophobicContact CG1-CG 4.33Å; V69-L117 HydrophobicContact CG2-CD1 4.07Å; V69-L117 HydrophobicContact CG2-CD2 3.2Å; V69-L117 HydrophobicContact CG2-CG 3.77Å; Q113-L117 HydrophobicContact CG-CD1 3.9Å; Q113-L117 VanDerWaalsContact O-CB 3.28Å; Q113-L117 WeakPolarHBondContact O-CB 3.13Å; Q113-L117 PolarHBondContact O-N 3.24Å; A114-L117 PolarHBondContact O-N 3.36Å; Y115-L117 VanDerWaalsContact C-N 3.3Å; Y115-L117 PolarHBondContact O-N 2.98Å; L117-F120 HydrophobicContact CD2-CB 4.46Å; L117-F120 WeakPolarHBondContact O-CA 3.34Å; L117-F120 WeakPolarHBondContact O-CB 3.4Å; L117-F120 PolarHBondContact O-N 3.39Å; L117-D121 PolarHBondContact O-N 3.36Å; L117-L170 HydrophobicContact CB-CD2 4.25Å |
| 118 | A | 75.4 | Confident | 72 | Confident | 6 Ų | 6 | 37.8 Ų | 37.8 | 5% | 0.05 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -47.7 | -49.7 | -173.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | A114 F120 L122 F164 A167 L170 | A114-A118 WeakPolarHBondContact O-CB 3.42Å; A114-A118 PolarHBondContact O-N 3.47Å; A118-F120 VanDerWaalsContact C-N 3.32Å; A118-F120 PolarHBondContact O-N 2.96Å; A118-L122 WeakPolarHBondContact O-CB 3.31Å; A118-L122 PolarHBondContact O-N 3.38Å; A118-L122 VanDerWaalsContact O-N 3.09Å; A118-F164 HydrophobicContact CB-CD1 4.17Å; A118-F164 HydrophobicContact CB-CE1 4.48Å; A118-A167 HydrophobicContact CB-CB 3.48Å; A118-A167 VanDerWaalsContact CB-CB 3.48Å; A118-L170 HydrophobicContact CB-CD2 4.21Å |
| 119 | P | 73.6 | Confident | 71.3 | Confident | 18 Ų | 18 | 37.6 Ų | 37.6 | 12% | 0.117 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -67.9 | -33.8 | 179.1 | 26.3 | -34.6 | 0 | 0 | 0 | 112.5 | I123 L163 | P119-I123 WeakPolarHBondContact O-CD1 3.32Å; P119-I123 VanDerWaalsContact O-CG1 3.28Å; P119-I123 WeakPolarHBondContact O-CG1 3.4Å; P119-I123 PolarHBondContact O-N 3.03Å; P119-L163 HydrophobicContact CB-CD2 3.57Å; P119-L163 HydrophobicContact CB-CG 3.75Å |
| 120 | F | 73.3 | Confident | 71 | Confident | 90 Ų | 90 | 38.8 Ų | 38.8 | 40% | 0.395 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -66.8 | -48.2 | 178 | -67.3 | -94 | 0 | 0 | 0 | 110.7 | F61 C116 L117 A118 L122 I123 K124 | F61-F120 HydrophobicContact CE1-CB 3.53Å; F61-F120 AromaticContact CE1-CD1 3.59Å; F61-F120 HydrophobicContact CE1-CD1 3.59Å; F61-F120 HydrophobicContact CE1-CG 4.02Å; F61-F120 VanDerWaalsContact CE1-O 3.25Å; F61-F120 WeakPolarHBondContact CE1-O 3.24Å; F61-F120 HydrophobicContact CE2-CD1 4.03Å; F61-F120 HydrophobicContact CZ-CB 3.9Å; F61-F120 AromaticContact CZ-CD1 3.18Å; F61-F120 HydrophobicContact CZ-CD1 3.18Å; F61-F120 HydrophobicContact CZ-CE1 4.01Å; F61-F120 AromaticContact CZ-CG 3.91Å; F61-F120 HydrophobicContact CZ-CG 3.91Å; C116-F120 WeakPolarHBondContact O-CD2 3.49Å; C116-F120 WeakPolarHBondContact O-CE2 3.26Å; L117-F120 HydrophobicContact CD2-CB 4.46Å; L117-F120 WeakPolarHBondContact O-CA 3.34Å; L117-F120 WeakPolarHBondContact O-CB 3.4Å; L117-F120 PolarHBondContact O-N 3.39Å; A118-F120 VanDerWaalsContact C-N 3.32Å; A118-F120 PolarHBondContact O-N 2.96Å; F120-L122 VanDerWaalsContact C-N 3.31Å; F120-L122 PolarHBondContact O-N 3.45Å; F120-I123 PolarHBondContact O-N 3.03Å; F120-K124 PolarHBondContact O-N 3.39Å |
| 121 | D | 71.3 | Confident | 70.1 | Confident | 38 Ų | 38 | 41.6 Ų | 41.6 | 20% | 0.203 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.4 | -38.7 | 178.7 | -112.4 | 21.2 | 0 | 0 | 0 | 111.9 | L117 K124 V125 L170 K226 | L117-D121 PolarHBondContact O-N 3.36Å; D121-K124 PolarHBondContact O-N 2.99Å; D121-V125 VanDerWaalsContact O-CG2 3.32Å; D121-V125 WeakPolarHBondContact O-CG2 3.26Å; D121-V125 PolarHBondContact O-N 3Å; D121-L170 HydrophobicContact CB-CD2 4.28Å; D121-L170 WeakPolarHBondContact OD2-CD1 3.34Å; D121-K226 IonicContact OD2-NZ 3.97Å; D121-K226 PolarHBondContact OD2-NZ 3.15Å |
| 122 | L | 70.7 | Confident | 68.8 | Low | 19 Ų | 19 | 41.3 Ų | 41.3 | 10% | 0.099 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.8 | -47.6 | 176.7 | -179.1 | 66.3 | 0 | 0 | 0 | 112 | A118 F120 K124 V125 R126 G162 L163 | A118-L122 WeakPolarHBondContact O-CB 3.31Å; A118-L122 PolarHBondContact O-N 3.38Å; A118-L122 VanDerWaalsContact O-N 3.09Å; F120-L122 VanDerWaalsContact C-N 3.31Å; F120-L122 PolarHBondContact O-N 3.45Å; L122-K124 VanDerWaalsContact C-N 3.32Å; L122-K124 PolarHBondContact O-N 3.45Å; L122-V125 PolarHBondContact O-N 2.93Å; L122-R126 PolarHBondContact O-N 3.4Å; L122-G162 WeakPolarHBondContact CD2-O 3.19Å; L122-L163 WeakPolarHBondContact CD2-O 3.35Å |
| 123 | I | 70.9 | Confident | 67.4 | Low | 13 Ų | 13 | 42.7 Ų | 42.7 | 7% | 0.067 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.8 | -44.7 | 178.5 | -66.6 | 160.4 | 0 | 0 | 0 | 110 | F61 P119 F120 R126 L127 P147 C150 A151 I154 | F61-I123 HydrophobicContact CZ-CD1 4.4Å; P119-I123 WeakPolarHBondContact O-CD1 3.32Å; P119-I123 VanDerWaalsContact O-CG1 3.28Å; P119-I123 WeakPolarHBondContact O-CG1 3.4Å; P119-I123 PolarHBondContact O-N 3.03Å; F120-I123 PolarHBondContact O-N 3.03Å; I123-R126 PolarHBondContact O-N 2.96Å; I123-L127 HydrophobicContact CG2-CD1 3.82Å; I123-L127 HydrophobicContact CG2-CG 4.44Å; I123-L127 WeakPolarHBondContact O-CG 3.35Å; I123-L127 PolarHBondContact O-N 3.49Å; I123-P147 HydrophobicContact CG2-CB 4.13Å; I123-C150 HydrophobicContact CG2-CB 4.3Å; I123-A151 HydrophobicContact CD1-CB 3.73Å; I123-A151 HydrophobicContact CG1-CB 4.36Å; I123-I154 HydrophobicContact CG1-CD1 4.43Å |
| 124 | K | 70.3 | Confident | 66 | Low | 33 Ų | 33 | 46.7 Ų | 46.7 | 14% | 0.143 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.1 | -50.6 | 177.3 | -176.6 | -168.4 | 179.6 | 174.2 | 0 | 111.5 | F61 P62 F120 D121 L122 R126 L127 Q128 | F61-K124 HydrophobicContact CD1-CB 4.48Å; P62-K124 HydrophobicContact CG-CD 3.64Å; P62-K124 HydrophobicContact CG-CG 4.24Å; F120-K124 PolarHBondContact O-N 3.39Å; D121-K124 PolarHBondContact O-N 2.99Å; L122-K124 VanDerWaalsContact C-N 3.32Å; L122-K124 PolarHBondContact O-N 3.45Å; K124-R126 PolarHBondContact O-N 3.5Å; K124-L127 PolarHBondContact O-N 3Å; K124-Q128 HydrophobicContact CG-CG 4.44Å; K124-Q128 WeakPolarHBondContact O-CB 3.31Å; K124-Q128 VanDerWaalsContact O-CG 3.29Å; K124-Q128 WeakPolarHBondContact O-CG 3.48Å; K124-Q128 PolarHBondContact O-N 2.92Å |
| 125 | V | 66.1 | Low | 64.6 | Low | 37 Ų | 37 | 50.8 Ų | 50.8 | 22% | 0.224 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.7 | -41.6 | -178.4 | 171.1 | 0 | 0 | 0 | 0 | 111.3 | D121 L122 Q128 N129 | D121-V125 VanDerWaalsContact O-CG2 3.32Å; D121-V125 WeakPolarHBondContact O-CG2 3.26Å; D121-V125 PolarHBondContact O-N 3Å; L122-V125 PolarHBondContact O-N 2.93Å; V125-Q128 PolarHBondContact O-N 3.27Å; V125-N129 WeakPolarHBondContact O-CB 3.36Å; V125-N129 PolarHBondContact O-N 3.11Å |
| 126 | R | 69.1 | Low | 62.8 | Low | 61 Ų | 61 | 51.7 Ų | 51.7 | 23% | 0.23 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 177.7 | -72.1 | -151 | -175.9 | -167.7 | 5 | 112.8 | L122 I123 K124 Q128 N129 Q130 Y144 E158 | L122-R126 PolarHBondContact O-N 3.4Å; I123-R126 PolarHBondContact O-N 2.96Å; K124-R126 PolarHBondContact O-N 3.5Å; R126-Q128 VanDerWaalsContact C-N 3.34Å; R126-Q128 PolarHBondContact O-N 2.88Å; R126-N129 PolarHBondContact O-N 3.07Å; R126-Q130 PolarHBondContact O-N 3.41Å; R126-Y144 HydrophobicContact CB-CE2 4.49Å; R126-E158 IonicContact CZ-OE1 3.48Å; R126-E158 VanDerWaalsContact CZ-OE1 3.29Å; R126-E158 IonicContact NH1-OE1 3.57Å; R126-E158 PolarHBondContact NH1-OE1 3.31Å; R126-E158 IonicContact NH2-OE1 2.68Å; R126-E158 PolarHBondContact NH2-OE1 2.89Å; R126-E158 IonicContact NH2-OE2 2.99Å |
| 127 | L | 65.6 | Low | 60.9 | Low | 25 Ų | 25 | 55.4 Ų | 55.4 | 13% | 0.131 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 175.8 | -72 | 168.5 | 0 | 0 | 0 | 112.3 | I123 K124 Q130 P147 C150 | I123-L127 HydrophobicContact CG2-CD1 3.82Å; I123-L127 HydrophobicContact CG2-CG 4.44Å; I123-L127 WeakPolarHBondContact O-CG 3.35Å; I123-L127 PolarHBondContact O-N 3.49Å; K124-L127 PolarHBondContact O-N 3Å; L127-Q130 PolarHBondContact O-N 3.34Å; L127-P147 HydrophobicContact CD1-CB 3.9Å; L127-C150 HydrophobicContact CD2-CB 4.18Å; L127-C150 HydrophobicContact CG-CB 4.41Å |
| 128 | Q | 58.2 | Low | 59.9 | Low | 27 Ų | 27 | 58.4 Ų | 58.4 | 13% | 0.126 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -71.1 | -30.3 | 178.9 | -74.6 | -175.8 | -8.8 | 0 | 0 | 112.9 | H21 K124 V125 R126 Q130 | H21-Q128 PolarHBondContact CE1-NE2 3.2Å; H21-Q128 PolarHBondContact NE2-NE2 3.4Å; K124-Q128 HydrophobicContact CG-CG 4.44Å; K124-Q128 WeakPolarHBondContact O-CB 3.31Å; K124-Q128 VanDerWaalsContact O-CG 3.29Å; K124-Q128 WeakPolarHBondContact O-CG 3.48Å; K124-Q128 PolarHBondContact O-N 2.92Å; V125-Q128 PolarHBondContact O-N 3.27Å; R126-Q128 VanDerWaalsContact C-N 3.34Å; R126-Q128 PolarHBondContact O-N 2.88Å; Q128-Q130 VanDerWaalsContact C-N 3.31Å |
| 129 | N | 60.7 | Low | 58.7 | Low | 49 Ų | 49 | 60.7 Ų | 60.7 | 26% | 0.262 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -81.8 | -10.8 | 179.1 | -156.5 | 31.4 | 0 | 0 | 0 | 113.2 | V125 R126 T131 L234 | V125-N129 WeakPolarHBondContact O-CB 3.36Å; V125-N129 PolarHBondContact O-N 3.11Å; R126-N129 PolarHBondContact O-N 3.07Å; N129-T131 VanDerWaalsContact C-N 3.31Å; N129-T131 PolarHBondContact O-N 3.07Å; N129-T131 PolarHBondContact O-OG1 2.86Å; N129-L234 WeakPolarHBondContact ND2-CD1 3.48Å |
| 130 | Q | 60.6 | Low | 57.8 | Low | 25 Ų | 25 | 64.8 Ų | 64.8 | 12% | 0.117 | 39% | 0.389 | C | S | . | . | trans | -70.4 | 89.3 | 174.5 | -165.6 | -179.7 | -21.7 | 0 | 0 | 110 | R126 L127 Q128 E132 Q143 Y144 | R126-Q130 PolarHBondContact O-N 3.41Å; L127-Q130 PolarHBondContact O-N 3.34Å; Q128-Q130 VanDerWaalsContact C-N 3.31Å; Q130-E132 HydrophobicContact CG-CB 4.39Å; Q130-E132 HydrophobicContact CG-CG 4.22Å; Q130-E132 PolarHBondContact NE2-OE2 3.3Å; Q130-E132 PolarHBondContact O-N 3.4Å; Q130-Q143 VanDerWaalsContact NE2-N 3.16Å; Q130-Y144 PolarHBondContact OE1-O 3.4Å | ||
| 131 | T | 52.3 | Low | 57 | Low | 60 Ų | 60 | 65 Ų | 65 | 37% | 0.368 | 40% | 0.4 | S | S | . | . | trans | -90 | 41.9 | 176.8 | -36.9 | 0 | 0 | 0 | 0 | 109.8 | Q33 N129 | Q33-T131 PolarHBondContact NE2-OG1 3.46Å; Q33-T131 VanDerWaalsContact NE2-OG1 3.16Å; N129-T131 VanDerWaalsContact C-N 3.31Å; N129-T131 PolarHBondContact O-N 3.07Å; N129-T131 PolarHBondContact O-OG1 2.86Å | ||
| 132 | E | 51.7 | Low | 56.4 | Low | 71 Ų | 71 | 66.1 Ų | 66.1 | 33% | 0.332 | 41% | 0.409 | S | S | . | . | trans | -75.4 | 126.7 | 170.7 | -76.6 | 177.3 | 151.1 | 0 | 0 | 108.1 | Q130 P142 Q143 | Q130-E132 HydrophobicContact CG-CB 4.39Å; Q130-E132 HydrophobicContact CG-CG 4.22Å; Q130-E132 PolarHBondContact NE2-OE2 3.3Å; Q130-E132 PolarHBondContact O-N 3.4Å; E132-P142 WeakPolarHBondContact OE2-CA 3.32Å; E132-Q143 PolarHBondContact OE2-N 3.49Å | ||
| 133 | P | 44.3 | Very low | 56 | Low | 100 Ų | 100 | 71.2 Ų | 71.2 | 65% | 0.649 | 43% | 0.433 | S | S | * | . | trans | -57.6 | 143.6 | 179.4 | 21.9 | -29.7 | 0 | 0 | 0 | 109.5 | A135 | P133-A135 PolarHBondContact O-N 3.02Š| ||
| 134 | V | 45.8 | Very low | 55.6 | Low | 106 Ų | 106 | 71.9 Ų | 71.9 | 64% | 0.642 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -36.3 | 123.9 | 171.4 | 174.8 | 0 | 0 | 0 | 0 | 109 | Q136 | V134-Q136 PolarHBondContact O-N 2.9Š|
| 135 | A | 43.9 | Very low | 55.3 | Low | 85 Ų | 85 | 76.9 Ų | 76.9 | 70% | 0.702 | 46% | 0.458 | S | S | * | . | trans | -34.4 | 100.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | P133 | P133-A135 PolarHBondContact O-N 3.02Š| ||
| 136 | Q | 42.8 | Very low | 55.4 | Low | 136 Ų | 136 | 76 Ų | 76 | 64% | 0.636 | 46% | 0.457 | S | S | * | . | trans | -75.3 | 141.1 | 165.6 | -70.8 | -173.4 | 8.3 | 0 | 0 | 106 | V134 G138 S139 | V134-Q136 PolarHBondContact O-N 2.9Å; Q136-G138 PolarHBondContact O-N 2.88Å; Q136-S139 PolarHBondContact N-OG 3.45Å; Q136-S139 PolarHBondContact O-N 3.46Å; Q136-S139 PolarHBondContact O-OG 3.36Å; Q136-S139 VanDerWaalsContact O-OG 3.06Å | ||
| 137 | P | 39.1 | Very low | 55.2 | Low | 143 Ų | 143 | 75.3 Ų | 75.3 | 93% | 0.929 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.9 | 108 | 174.3 | -17.7 | 29.1 | 0 | 0 | 0 | 108.9 | ||
| 138 | G | 52.8 | Low | 55.6 | Low | 84 Ų | 84 | 81.9 Ų | 81.9 | 87% | 0.866 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 108.8 | -1.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 117.1 | Q136 | Q136-G138 PolarHBondContact O-N 2.88Š|
| 139 | S | 49.3 | Very low | 56.5 | Low | 55 Ų | 55 | 84.7 Ų | 84.7 | 39% | 0.385 | 51% | 0.505 | S | S | . | . | S | Bend | trans | -78.3 | 147.4 | 170.9 | 58.1 | 0 | 0 | 0 | 0 | 111.8 | Q136 | Q136-S139 PolarHBondContact N-OG 3.45Å; Q136-S139 PolarHBondContact O-N 3.46Å; Q136-S139 PolarHBondContact O-OG 3.36Å; Q136-S139 VanDerWaalsContact O-OG 3.06Å |
| 140 | P | 54.5 | Low | 57 | Low | 103 Ų | 103 | 82.3 Ų | 82.3 | 67% | 0.669 | 49% | 0.492 | S | S | * | . | P | Polyproline II helix | trans | -55.1 | 149.2 | 175.7 | 22.6 | -32.3 | 0 | 0 | 0 | 111.3 | ||
| 141 | P | 56.3 | Low | 57.7 | Low | 94 Ų | 94 | 82.3 Ų | 82.3 | 61% | 0.61 | 50% | 0.497 | S | S | * | . | P | Polyproline II helix | trans | -59.6 | 148.3 | -178.1 | 25.4 | -33.8 | 0 | 0 | 0 | 110.5 | Q143 | P141-Q143 PolarHBondContact O-N 2.91Š|
| 142 | P | 60.2 | Low | 59 | Low | 62 Ų | 62 | 81.8 Ų | 81.8 | 40% | 0.403 | 50% | 0.498 | S | S | . | . | P | Polyproline II helix | trans | -57.2 | 136.4 | -176.6 | 18.9 | -29.8 | 0 | 0 | 0 | 111.6 | E132 Y144 Q145 | E132-P142 WeakPolarHBondContact OE2-CA 3.32Å; P142-Y144 PolarHBondContact O-N 3.49Å; P142-Q145 HydrophobicContact CG-CG 4.44Å |
| 143 | Q | 61.9 | Low | 60.3 | Low | 127 Ų | 127 | 79.3 Ų | 79.3 | 59% | 0.593 | 49% | 0.489 | S | S | * | . | S | Bend | trans | -52.1 | -34.2 | -176.5 | -171.1 | 166.8 | 20.2 | 0 | 0 | 113 | Q130 E132 P141 | Q130-Q143 VanDerWaalsContact NE2-N 3.16Å; E132-Q143 PolarHBondContact OE2-N 3.49Å; P141-Q143 PolarHBondContact O-N 2.91Å |
| 144 | Y | 62.3 | Low | 61.8 | Low | 26 Ų | 26 | 74.5 Ų | 74.5 | 10% | 0.102 | 46% | 0.458 | C | S | . | . | trans | -123.7 | 122 | 165.5 | -51.6 | -68.5 | 0 | 0 | 0 | 111.4 | R126 Q130 P142 G146 C150 | R126-Y144 HydrophobicContact CB-CE2 4.49Å; Q130-Y144 PolarHBondContact OE1-O 3.4Å; P142-Y144 PolarHBondContact O-N 3.49Å; Y144-G146 VanDerWaalsContact C-N 3.34Å; Y144-C150 HydrophobicContact CD1-CB 3.77Å; Y144-C150 HydrophobicContact CE1-CB 4.39Å; Y144-C150 HydrophobicContact CG-CB 3.93Å | ||
| 145 | Q | 64.3 | Low | 63.5 | Low | 139 Ų | 139 | 75.6 Ų | 75.6 | 65% | 0.65 | 45% | 0.454 | S | S | * | . | S | Bend | trans | -83 | -11.2 | 177.9 | -64 | -176.6 | -4.6 | 0 | 0 | 113.2 | P142 | P142-Q145 HydrophobicContact CG-CG 4.44Š|
| 146 | G | 67.8 | Low | 65.2 | Low | 18 Ų | 18 | 82.1 Ų | 82.1 | 19% | 0.186 | 46% | 0.46 | C | S | . | . | S | Bend | trans | 174.5 | 175.9 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | Y144 M148 H149 C150 | Y144-G146 VanDerWaalsContact C-N 3.34Å; G146-M148 PolarHBondContact O-N 3.02Å; G146-H149 PolarHBondContact O-N 2.99Å; G146-C150 WeakPolarHBondContact O-CB 3.32Å; G146-C150 PolarHBondContact O-N 2.91Å |
| 147 | P | 65.6 | Low | 66.9 | Low | 47 Ų | 47 | 82.1 Ų | 82.1 | 31% | 0.305 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.1 | -39.2 | -176.5 | 22.6 | -31.1 | 0 | 0 | 0 | 113.6 | F61 I123 L127 C150 A151 | F61-P147 HydrophobicContact CD2-CB 4.14Å; F61-P147 HydrophobicContact CE2-CB 4.42Å; I123-P147 HydrophobicContact CG2-CB 4.13Å; L127-P147 HydrophobicContact CD1-CB 3.9Å; P147-C150 PolarHBondContact O-N 3.41Å; P147-A151 WeakPolarHBondContact O-CB 3.38Å; P147-A151 PolarHBondContact O-N 2.89Å |
| 148 | M | 74 | Confident | 68.6 | Low | 163 Ų | 163 | 78 Ų | 78 | 80% | 0.803 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -68.7 | -37.7 | 176 | -67 | -58.7 | -162.9 | 0 | 0 | 111.9 | G146 A151 A152 | G146-M148 PolarHBondContact O-N 3.02Å; M148-A151 PolarHBondContact O-N 3.44Å; M148-A152 VanDerWaalsContact O-CB 3.28Å; M148-A152 WeakPolarHBondContact O-CB 3.48Å; M148-A152 PolarHBondContact O-N 2.99Å |
| 149 | H | 76.6 | Confident | 69.9 | Low | 85 Ų | 85 | 75.1 Ų | 75.1 | 39% | 0.394 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -65.8 | -43.5 | 174.4 | -171.2 | -93 | 0 | 0 | 0 | 110.8 | G146 A152 S153 | G146-H149 PolarHBondContact O-N 2.99Å; H149-A152 PolarHBondContact O-N 3.26Å; H149-S153 WeakPolarHBondContact O-CB 3.44Å; H149-S153 PolarHBondContact O-N 3.09Å; H149-S153 PolarHBondContact O-OG 2.89Å |
| 150 | C | 70.8 | Confident | 71.1 | Confident | 0 Ų | 0 | 79.5 Ų | 79.5 | 0% | 0 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60.1 | -47.8 | 175.2 | -169.7 | 0 | 0 | 0 | 0 | 111.9 | I123 L127 Y144 G146 P147 A152 S153 I154 | I123-C150 HydrophobicContact CG2-CB 4.3Å; L127-C150 HydrophobicContact CD2-CB 4.18Å; L127-C150 HydrophobicContact CG-CB 4.41Å; Y144-C150 HydrophobicContact CD1-CB 3.77Å; Y144-C150 HydrophobicContact CE1-CB 4.39Å; Y144-C150 HydrophobicContact CG-CB 3.93Å; G146-C150 WeakPolarHBondContact O-CB 3.32Å; G146-C150 PolarHBondContact O-N 2.91Å; P147-C150 PolarHBondContact O-N 3.41Å; C150-A152 PolarHBondContact O-N 3.22Å; C150-S153 PolarHBondContact O-N 2.98Å; C150-I154 WeakPolarHBondContact O-CD1 3.33Å; C150-I154 WeakPolarHBondContact O-CG1 3.07Å; C150-I154 PolarHBondContact O-N 3.25Å |
| 151 | A | 75.5 | Confident | 71.9 | Confident | 25 Ų | 25 | 83.4 Ų | 83.4 | 21% | 0.207 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.4 | -46.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I123 P147 M148 I154 F155 | I123-A151 HydrophobicContact CD1-CB 3.73Å; I123-A151 HydrophobicContact CG1-CB 4.36Å; P147-A151 WeakPolarHBondContact O-CB 3.38Å; P147-A151 PolarHBondContact O-N 2.89Å; M148-A151 PolarHBondContact O-N 3.44Å; A151-I154 PolarHBondContact O-N 2.84Å; A151-F155 WeakPolarHBondContact O-CB 3.26Å; A151-F155 PolarHBondContact O-N 2.91Å |
| 152 | A | 80.7 | Confident | 72.5 | Confident | 48 Ų | 48 | 79.1 Ų | 79.1 | 40% | 0.397 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.7 | -40.6 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | M148 H149 C150 F155 R156 | M148-A152 VanDerWaalsContact O-CB 3.28Å; M148-A152 WeakPolarHBondContact O-CB 3.48Å; M148-A152 PolarHBondContact O-N 2.99Å; H149-A152 PolarHBondContact O-N 3.26Å; C150-A152 PolarHBondContact O-N 3.22Å; A152-F155 PolarHBondContact O-N 2.91Å; A152-R156 WeakPolarHBondContact O-CB 3.29Å; A152-R156 WeakPolarHBondContact O-CG 3.48Å; A152-R156 PolarHBondContact O-N 2.85Å |
| 153 | S | 77.9 | Confident | 73 | Confident | 19 Ų | 19 | 78 Ų | 78 | 13% | 0.133 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -63.2 | -47.4 | 175 | -66.7 | 0 | 0 | 0 | 0 | 111.5 | H149 C150 F155 R156 E157 | H149-S153 WeakPolarHBondContact O-CB 3.44Å; H149-S153 PolarHBondContact O-N 3.09Å; H149-S153 PolarHBondContact O-OG 2.89Å; C150-S153 PolarHBondContact O-N 2.98Å; S153-F155 VanDerWaalsContact C-N 3.3Å; S153-F155 PolarHBondContact O-N 3.49Å; S153-R156 PolarHBondContact O-N 3.48Å; S153-E157 WeakPolarHBondContact O-CB 3.41Å; S153-E157 WeakPolarHBondContact O-CG 3.25Å; S153-E157 PolarHBondContact O-N 3.37Å |
| 154 | I | 75.4 | Confident | 73.4 | Confident | 0 Ų | 0 | 75.4 Ų | 75.4 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -60.8 | -43 | 177.2 | -65.2 | 163.4 | 0 | 0 | 0 | 110.4 | I123 C150 A151 R156 E157 E158 G159 L163 | I123-I154 HydrophobicContact CG1-CD1 4.43Å; C150-I154 WeakPolarHBondContact O-CD1 3.33Å; C150-I154 WeakPolarHBondContact O-CG1 3.07Å; C150-I154 PolarHBondContact O-N 3.25Å; A151-I154 PolarHBondContact O-N 2.84Å; I154-R156 VanDerWaalsContact C-N 3.32Å; I154-R156 PolarHBondContact O-N 2.84Å; I154-E157 PolarHBondContact O-N 3.44Å; I154-E158 WeakPolarHBondContact O-CA 3.35Å; I154-E158 PolarHBondContact O-N 3.09Å; I154-G159 PolarHBondContact O-N 3.22Å; I154-L163 HydrophobicContact CB-CD1 4.22Å; I154-L163 HydrophobicContact CG2-CD1 3.81Å |
| 155 | F | 81.6 | Confident | 73.5 | Confident | 128 Ų | 128 | 80.2 Ų | 80.2 | 56% | 0.561 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -64.6 | -36.9 | 179.3 | -168.5 | -96.5 | 0 | 0 | 0 | 112.3 | A151 A152 S153 G159 | A151-F155 WeakPolarHBondContact O-CB 3.26Å; A151-F155 PolarHBondContact O-N 2.91Å; A152-F155 PolarHBondContact O-N 2.91Å; S153-F155 VanDerWaalsContact C-N 3.3Å; S153-F155 PolarHBondContact O-N 3.49Å; F155-G159 WeakPolarHBondContact O-CA 3.14Å; F155-G159 PolarHBondContact O-N 3.43Å |
| 156 | R | 80.9 | Confident | 73.5 | Confident | 223 Ų | 223 | 75.5 Ų | 75.5 | 84% | 0.842 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -74.1 | -38.5 | 176.6 | -79 | -178.8 | 172.9 | 167.2 | -1.4 | 113.6 | A152 S153 I154 | A152-R156 WeakPolarHBondContact O-CB 3.29Å; A152-R156 WeakPolarHBondContact O-CG 3.48Å; A152-R156 PolarHBondContact O-N 2.85Å; S153-R156 PolarHBondContact O-N 3.48Å; I154-R156 VanDerWaalsContact C-N 3.32Å; I154-R156 PolarHBondContact O-N 2.84Å |
| 157 | E | 78.7 | Confident | 73.5 | Confident | 135 Ų | 135 | 75.1 Ų | 75.1 | 63% | 0.631 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -87.5 | -41.3 | -174 | -69.6 | 173.1 | -168.6 | 0 | 0 | 113.2 | S153 I154 | S153-E157 WeakPolarHBondContact O-CB 3.41Å; S153-E157 WeakPolarHBondContact O-CG 3.25Å; S153-E157 PolarHBondContact O-N 3.37Å; I154-E157 PolarHBondContact O-N 3.44Å |
| 158 | E | 73.1 | Confident | 73.7 | Confident | 56 Ų | 56 | 80.9 Ų | 80.9 | 26% | 0.262 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -115.5 | -5.8 | -172.4 | -61.3 | -174.4 | -140 | 0 | 0 | 113 | R126 I154 G162 R165 | R126-E158 IonicContact CZ-OE1 3.48Å; R126-E158 VanDerWaalsContact CZ-OE1 3.29Å; R126-E158 IonicContact NH1-OE1 3.57Å; R126-E158 PolarHBondContact NH1-OE1 3.31Å; R126-E158 IonicContact NH2-OE1 2.68Å; R126-E158 PolarHBondContact NH2-OE1 2.89Å; R126-E158 IonicContact NH2-OE2 2.99Å; I154-E158 WeakPolarHBondContact O-CA 3.35Å; I154-E158 PolarHBondContact O-N 3.09Å; E158-G162 PolarHBondContact O-N 3.49Å; E158-R165 IonicContact OE1-NH1 2.84Å; E158-R165 WeakPolarHBondContact OE2-CD 3.27Å; E158-R165 IonicContact OE2-CZ 2.78Å; E158-R165 IonicContact OE2-NH1 3.25Å; E158-R165 PolarHBondContact OE2-NH1 3.34Å |
| 159 | G | 79.9 | Confident | 73.2 | Confident | 25 Ų | 25 | 74 Ų | 74 | 26% | 0.258 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | 67.4 | -167.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | I154 F155 R161 G162 | I154-G159 PolarHBondContact O-N 3.22Å; F155-G159 WeakPolarHBondContact O-CA 3.14Å; F155-G159 PolarHBondContact O-N 3.43Å; G159-R161 PolarHBondContact O-N 3.1Å; G159-G162 PolarHBondContact O-N 2.85Å; G159-G162 VanDerWaalsContact O-N 3.1Å |
| 160 | Y | 75.4 | Confident | 72.9 | Confident | 147 Ų | 147 | 70.1 Ų | 70.1 | 58% | 0.576 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -60.7 | -32.4 | -179.3 | 78 | -89.3 | 0 | 0 | 0 | 113.2 | G162 L163 | Y160-G162 VanDerWaalsContact C-N 3.33Å; Y160-L163 PolarHBondContact O-N 2.92Å |
| 161 | R | 71.3 | Confident | 73 | Confident | 185 Ų | 185 | 70.7 Ų | 70.7 | 70% | 0.698 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -71.6 | -29.6 | 178 | -66.5 | -173.4 | 174.8 | 179.1 | -2.9 | 112.3 | G159 L163 F164 R165 | G159-R161 PolarHBondContact O-N 3.1Å; R161-L163 VanDerWaalsContact C-N 3.3Å; R161-L163 PolarHBondContact O-N 3.46Å; R161-F164 PolarHBondContact O-N 3.34Å; R161-R165 PolarHBondContact O-N 2.91Å |
| 162 | G | 68.4 | Low | 72.8 | Confident | 4 Ų | 4 | 72.9 Ų | 72.9 | 4% | 0.041 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.7 | -37.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L122 E158 G159 Y160 F164 R165 | L122-G162 WeakPolarHBondContact CD2-O 3.19Å; E158-G162 PolarHBondContact O-N 3.49Å; G159-G162 PolarHBondContact O-N 2.85Å; G159-G162 VanDerWaalsContact O-N 3.1Å; Y160-G162 VanDerWaalsContact C-N 3.33Å; G162-F164 VanDerWaalsContact C-N 3.28Å; G162-F164 PolarHBondContact O-N 3.22Å; G162-R165 WeakPolarHBondContact O-CB 3.49Å; G162-R165 PolarHBondContact O-N 3.47Å; G162-R165 VanDerWaalsContact O-N 3.15Å |
| 163 | L | 70.5 | Confident | 72.4 | Confident | 37 Ų | 37 | 72.8 Ų | 72.8 | 19% | 0.194 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -67 | -27.8 | -179.3 | -138.2 | 78.8 | 0 | 0 | 0 | 113.2 | P119 L122 I154 Y160 R161 | P119-L163 HydrophobicContact CB-CD2 3.57Å; P119-L163 HydrophobicContact CB-CG 3.75Å; L122-L163 WeakPolarHBondContact CD2-O 3.35Å; I154-L163 HydrophobicContact CB-CD1 4.22Å; I154-L163 HydrophobicContact CG2-CD1 3.81Å; Y160-L163 PolarHBondContact O-N 2.92Å; R161-L163 VanDerWaalsContact C-N 3.3Å; R161-L163 PolarHBondContact O-N 3.46Å |
| 164 | F | 71.4 | Confident | 72 | Confident | 73 Ų | 73 | 72.7 Ų | 72.7 | 32% | 0.32 | 33% | 0.327 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.2 | 12.6 | 176.7 | -73.6 | -88.5 | 0 | 0 | 0 | 113 | Y115 A118 R161 G162 G166 A167 | Y115-F164 HydrophobicContact CD2-CD1 4.3Å; Y115-F164 AromaticContact CD2-CE1 3.8Å; Y115-F164 HydrophobicContact CD2-CE1 3.8Å; Y115-F164 HydrophobicContact CE1-CE1 4.45Å; Y115-F164 AromaticContact CE2-CD1 3.98Å; Y115-F164 HydrophobicContact CE2-CD1 3.98Å; Y115-F164 AromaticContact CE2-CE1 3.43Å; Y115-F164 HydrophobicContact CE2-CE1 3.43Å; Y115-F164 VanDerWaalsContact CE2-CE1 3.43Å; Y115-F164 HydrophobicContact CE2-CZ 4.09Å; Y115-F164 HydrophobicContact CG-CE1 4.48Å; Y115-F164 AromaticContact CZ-CE1 3.8Å; A118-F164 HydrophobicContact CB-CD1 4.17Å; A118-F164 HydrophobicContact CB-CE1 4.48Å; R161-F164 PolarHBondContact O-N 3.34Å; G162-F164 VanDerWaalsContact C-N 3.28Å; G162-F164 PolarHBondContact O-N 3.22Å; F164-G166 PolarHBondContact O-N 2.84Å; F164-G166 VanDerWaalsContact O-N 3.12Å; F164-A167 HydrophobicContact CB-CB 4.08Å; F164-A167 HydrophobicContact CD1-CB 4.01Å; F164-A167 WeakPolarHBondContact O-CB 3.49Å; F164-A167 PolarHBondContact O-N 2.92Å |
| 165 | R | 64.2 | Low | 71.9 | Confident | 128 Ų | 128 | 74.2 Ų | 74.2 | 48% | 0.483 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.5 | 113.1 | -178.4 | -164.2 | 170.7 | -174 | -179.8 | -3 | 110.2 | E158 R161 G162 | E158-R165 IonicContact OE1-NH1 2.84Å; E158-R165 WeakPolarHBondContact OE2-CD 3.27Å; E158-R165 IonicContact OE2-CZ 2.78Å; E158-R165 IonicContact OE2-NH1 3.25Å; E158-R165 PolarHBondContact OE2-NH1 3.34Å; R161-R165 PolarHBondContact O-N 2.91Å; G162-R165 WeakPolarHBondContact O-CB 3.49Å; G162-R165 PolarHBondContact O-N 3.47Å; G162-R165 VanDerWaalsContact O-N 3.15Å |
| 166 | G | 63.3 | Low | 71.5 | Confident | 39 Ų | 39 | 70.1 Ų | 70.1 | 40% | 0.402 | 32% | 0.322 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.3 | -0.1 | -173 | 0 | 0 | 0 | 0 | 0 | 114.5 | F164 W168 A169 L170 | F164-G166 PolarHBondContact O-N 2.84Å; F164-G166 VanDerWaalsContact O-N 3.12Å; G166-W168 PolarHBondContact O-N 3.05Å; G166-A169 PolarHBondContact O-N 3.05Å; G166-A169 VanDerWaalsContact O-N 3.14Å; G166-L170 PolarHBondContact O-N 2.84Å; G166-L170 VanDerWaalsContact O-N 3.1Å |
| 167 | A | 69.4 | Low | 71 | Confident | 10 Ų | 10 | 60.4 Ų | 60.4 | 8% | 0.083 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -55.7 | -39.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | A118 F164 A169 L170 M171 | A118-A167 HydrophobicContact CB-CB 3.48Å; A118-A167 VanDerWaalsContact CB-CB 3.48Å; F164-A167 HydrophobicContact CB-CB 4.08Å; F164-A167 HydrophobicContact CD1-CB 4.01Å; F164-A167 WeakPolarHBondContact O-CB 3.49Å; F164-A167 PolarHBondContact O-N 2.92Å; A167-A169 VanDerWaalsContact C-N 3.34Å; A167-A169 PolarHBondContact O-N 3.49Å; A167-L170 WeakPolarHBondContact O-CB 3.4Å; A167-L170 PolarHBondContact O-N 3.39Å; A167-L170 VanDerWaalsContact O-N 3.17Å; A167-M171 WeakPolarHBondContact O-CB 3.48Å; A167-M171 VanDerWaalsContact O-CG 3.24Å; A167-M171 WeakPolarHBondContact O-CG 3.39Å; A167-M171 PolarHBondContact O-N 3.05Å |
| 168 | W | 69.1 | Low | 70.5 | Confident | 168 Ų | 168 | 55 Ų | 55 | 64% | 0.636 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -64.4 | -37.3 | 178.6 | -166.4 | -119.9 | 0 | 0 | 0 | 113.2 | F111 G166 L170 M171 L172 | F111-W168 AromaticContact CE2-CZ3 3.9Å; F111-W168 HydrophobicContact CE2-CZ3 3.9Å; G166-W168 PolarHBondContact O-N 3.05Å; W168-L170 VanDerWaalsContact C-N 3.34Å; W168-M171 HydrophobicContact CE3-CB 4.37Å; W168-M171 HydrophobicContact CE3-SD 3.8Å; W168-M171 HydrophobicContact CZ3-SD 4.13Å; W168-M171 PolarHBondContact O-N 3.47Å; W168-L172 WeakPolarHBondContact O-CB 3.5Å; W168-L172 PolarHBondContact O-N 3.32Å |
| 169 | A | 63.9 | Low | 70.3 | Confident | 20 Ų | 20 | 52.4 Ų | 52.4 | 17% | 0.165 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -68.8 | -36.1 | 175 | 0 | 0 | 0 | 0 | 0 | 111.5 | G166 A167 R173 | G166-A169 PolarHBondContact O-N 3.05Å; G166-A169 VanDerWaalsContact O-N 3.14Å; A167-A169 VanDerWaalsContact C-N 3.34Å; A167-A169 PolarHBondContact O-N 3.49Å; A169-R173 WeakPolarHBondContact O-CB 3.47Å; A169-R173 PolarHBondContact O-N 3.2Å; A169-R173 VanDerWaalsContact O-N 3.11Å |
| 170 | L | 69.4 | Low | 70 | Confident | 3 Ų | 3 | 53.7 Ų | 53.7 | 2% | 0.016 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.5 | -47.4 | 173.4 | -176.9 | 68.8 | 0 | 0 | 0 | 111.3 | A114 L117 A118 D121 G166 A167 W168 R173 D174 | A114-L170 HydrophobicContact CB-CD2 4.35Å; A114-L170 HydrophobicContact CB-CG 4.11Å; L117-L170 HydrophobicContact CB-CD2 4.25Å; A118-L170 HydrophobicContact CB-CD2 4.21Å; D121-L170 HydrophobicContact CB-CD2 4.28Å; D121-L170 WeakPolarHBondContact OD2-CD1 3.34Å; G166-L170 PolarHBondContact O-N 2.84Å; G166-L170 VanDerWaalsContact O-N 3.1Å; A167-L170 WeakPolarHBondContact O-CB 3.4Å; A167-L170 PolarHBondContact O-N 3.39Å; A167-L170 VanDerWaalsContact O-N 3.17Å; W168-L170 VanDerWaalsContact C-N 3.34Å; L170-R173 WeakPolarHBondContact O-CB 3.22Å; L170-R173 PolarHBondContact O-N 3.4Å; L170-D174 WeakPolarHBondContact CD1-OD2 3.38Å; L170-D174 WeakPolarHBondContact O-CB 3.35Å; L170-D174 PolarHBondContact O-N 2.87Å |
| 171 | M | 74.2 | Confident | 69.7 | Low | 11 Ų | 11 | 50.7 Ų | 50.7 | 5% | 0.054 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.8 | -45.9 | 177.7 | -71.8 | 168.6 | 145.7 | 0 | 0 | 112.2 | F111 A114 Y115 A167 W168 R173 D174 T175 | F111-M171 HydrophobicContact CD1-CE 4.32Å; F111-M171 HydrophobicContact CD2-CB 4.14Å; F111-M171 HydrophobicContact CD2-CE 4.11Å; F111-M171 HydrophobicContact CD2-CG 4.16Å; F111-M171 HydrophobicContact CD2-SD 4.21Å; F111-M171 HydrophobicContact CE1-CE 3.81Å; F111-M171 HydrophobicContact CE2-CB 4.2Å; F111-M171 HydrophobicContact CE2-CE 3.58Å; F111-M171 HydrophobicContact CE2-CG 4.09Å; F111-M171 HydrophobicContact CE2-SD 3.55Å; F111-M171 VanDerWaalsContact CE2-SD 3.55Å; F111-M171 HydrophobicContact CG-CE 4.46Å; F111-M171 HydrophobicContact CZ-CE 3.41Å; F111-M171 VanDerWaalsContact CZ-CE 3.41Å; F111-M171 HydrophobicContact CZ-SD 3.89Å; A114-M171 HydrophobicContact CB-CB 4.41Å; A114-M171 HydrophobicContact CB-CG 3.82Å; Y115-M171 HydrophobicContact CD2-CE 3.41Å; Y115-M171 VanDerWaalsContact CD2-CE 3.41Å; Y115-M171 HydrophobicContact CG-CE 3.82Å; A167-M171 WeakPolarHBondContact O-CB 3.48Å; A167-M171 VanDerWaalsContact O-CG 3.24Å; A167-M171 WeakPolarHBondContact O-CG 3.39Å; A167-M171 PolarHBondContact O-N 3.05Å; W168-M171 HydrophobicContact CE3-CB 4.37Å; W168-M171 HydrophobicContact CE3-SD 3.8Å; W168-M171 HydrophobicContact CZ3-SD 4.13Å; W168-M171 PolarHBondContact O-N 3.47Å; M171-R173 PolarHBondContact O-N 3.09Å; M171-D174 PolarHBondContact O-N 2.7Å; M171-T175 WeakPolarHBondContact O-CB 3.39Å; M171-T175 PolarHBondContact O-N 2.99Å; M171-T175 PolarHBondContact O-OG1 3.04Å |
| 172 | L | 70.5 | Confident | 69.6 | Low | 72 Ų | 72 | 43 Ų | 43 | 38% | 0.377 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -64 | -29.3 | 178.4 | -171.3 | 72 | 0 | 0 | 0 | 111.7 | W168 P176 V242 | W168-L172 WeakPolarHBondContact O-CB 3.5Å; W168-L172 PolarHBondContact O-N 3.32Å; L172-P176 WeakPolarHBondContact O-CD 3.44Å; L172-P176 WeakPolarHBondContact O-CG 3.22Å; L172-V242 HydrophobicContact CD2-CG1 3.86Å |
| 173 | R | 71.5 | Confident | 69.9 | Low | 46 Ų | 46 | 45.7 Ų | 45.7 | 17% | 0.174 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -75.4 | -54.8 | 172.1 | -176.5 | -168 | 68.1 | 166.3 | 7.7 | 112.1 | A169 L170 M171 P176 T177 L222 D223 | A169-R173 WeakPolarHBondContact O-CB 3.47Å; A169-R173 PolarHBondContact O-N 3.2Å; A169-R173 VanDerWaalsContact O-N 3.11Å; L170-R173 WeakPolarHBondContact O-CB 3.22Å; L170-R173 PolarHBondContact O-N 3.4Å; M171-R173 PolarHBondContact O-N 3.09Å; R173-P176 VanDerWaalsContact O-CD 3.31Å; R173-P176 WeakPolarHBondContact O-CD 3.46Å; R173-P176 WeakPolarHBondContact O-CG 3.32Å; R173-T177 VanDerWaalsContact O-CB 3.26Å; R173-T177 WeakPolarHBondContact O-CB 3.39Å; R173-T177 PolarHBondContact O-N 2.73Å; R173-T177 PolarHBondContact O-OG1 3.01Å; R173-L222 HydrophobicContact CB-CB 3.94Å; R173-L222 HydrophobicContact CB-CD1 4.48Å; R173-L222 HydrophobicContact CG-CB 3.77Å; R173-D223 WeakPolarHBondContact CD-OD1 3.09Å; R173-D223 IonicContact CZ-OD1 3.51Å; R173-D223 IonicContact NE-OD1 2.7Å; R173-D223 IonicContact NH1-OD1 3.29Å; R173-D223 PolarHBondContact NH1-OD1 3.45Å |
| 174 | D | 70 | Confident | 69.9 | Low | 16 Ų | 16 | 45.7 Ų | 45.7 | 9% | 0.086 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -72.6 | -36.4 | -167.1 | -70.2 | 2.8 | 0 | 0 | 0 | 111.5 | A114 L170 M171 T177 V178 | A114-D174 HydrophobicContact CB-CB 3.99Å; L170-D174 WeakPolarHBondContact CD1-OD2 3.38Å; L170-D174 WeakPolarHBondContact O-CB 3.35Å; L170-D174 PolarHBondContact O-N 2.87Å; M171-D174 PolarHBondContact O-N 2.7Å; D174-T177 PolarHBondContact O-N 3.38Å; D174-V178 WeakPolarHBondContact O-CB 3.28Å; D174-V178 VanDerWaalsContact O-CG2 3.25Å; D174-V178 WeakPolarHBondContact O-CG2 3.47Å; D174-V178 PolarHBondContact O-N 3.05Å |
| 175 | T | 73.6 | Confident | 69.7 | Low | 32 Ų | 32 | 45.3 Ų | 45.3 | 20% | 0.196 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -54.8 | -58.3 | 179.2 | -56.7 | 0 | 0 | 0 | 0 | 112.9 | C107 M171 G179 | C107-T175 HydrophobicContact CB-CG2 3.74Å; M171-T175 WeakPolarHBondContact O-CB 3.39Å; M171-T175 PolarHBondContact O-N 2.99Å; M171-T175 PolarHBondContact O-OG1 3.04Å; T175-G179 PolarHBondContact O-N 2.9Å; T175-G179 VanDerWaalsContact O-N 3.16Å |
| 176 | P | 72.3 | Confident | 69.9 | Low | 42 Ų | 42 | 40.9 Ų | 40.9 | 27% | 0.273 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -69.9 | -33 | 178.6 | 27.7 | -35.1 | 0 | 0 | 0 | 112.4 | L172 R173 G179 I180 L222 | L172-P176 WeakPolarHBondContact O-CD 3.44Å; L172-P176 WeakPolarHBondContact O-CG 3.22Å; R173-P176 VanDerWaalsContact O-CD 3.31Å; R173-P176 WeakPolarHBondContact O-CD 3.46Å; R173-P176 WeakPolarHBondContact O-CG 3.32Å; P176-G179 PolarHBondContact O-N 3.4Å; P176-I180 WeakPolarHBondContact O-CB 3.28Å; P176-I180 WeakPolarHBondContact O-CD1 3.42Å; P176-I180 WeakPolarHBondContact O-CG1 3.27Å; P176-I180 PolarHBondContact O-N 3.39Å; P176-L222 HydrophobicContact CG-CD1 3.79Å |
| 177 | T | 70.1 | Confident | 70.1 | Confident | 20 Ų | 20 | 40 Ų | 40 | 12% | 0.123 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63.7 | -44.5 | -178.4 | -60.8 | 0 | 0 | 0 | 0 | 111.6 | R173 D174 Y181 S215 A219 | R173-T177 VanDerWaalsContact O-CB 3.26Å; R173-T177 WeakPolarHBondContact O-CB 3.39Å; R173-T177 PolarHBondContact O-N 2.73Å; R173-T177 PolarHBondContact O-OG1 3.01Å; D174-T177 PolarHBondContact O-N 3.38Å; T177-Y181 WeakPolarHBondContact O-CB 3.17Å; T177-Y181 PolarHBondContact O-N 3.05Å; T177-S215 WeakPolarHBondContact CG2-OG 3.24Å; T177-S215 PolarHBondContact O-OG 3.46Å; T177-A219 HydrophobicContact CG2-CB 3.75Å; T177-A219 WeakPolarHBondContact OG1-CB 3.34Å |
| 178 | V | 69.4 | Low | 70.1 | Confident | 22 Ų | 22 | 41.1 Ų | 41.1 | 13% | 0.133 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -72.5 | -40.7 | 177.9 | 177 | 0 | 0 | 0 | 0 | 110.8 | L73 G106 D174 I180 Y181 F182 | L73-V178 HydrophobicContact CD1-CG1 4.45Å; G106-V178 VanDerWaalsContact O-CG1 3.29Å; G106-V178 WeakPolarHBondContact O-CG1 3.45Å; D174-V178 WeakPolarHBondContact O-CB 3.28Å; D174-V178 VanDerWaalsContact O-CG2 3.25Å; D174-V178 WeakPolarHBondContact O-CG2 3.47Å; D174-V178 PolarHBondContact O-N 3.05Å; V178-I180 PolarHBondContact O-N 3.48Å; V178-Y181 WeakPolarHBondContact O-CB 3.29Å; V178-Y181 PolarHBondContact O-N 3.37Å; V178-F182 HydrophobicContact CG1-CD2 3.71Å; V178-F182 HydrophobicContact CG1-CE2 3.68Å; V178-F182 WeakPolarHBondContact O-CD2 3.36Å; V178-F182 PolarHBondContact O-N 2.89Å |
| 179 | G | 68.8 | Low | 69.9 | Low | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.2 | -46 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113 | T175 P176 F182 I183 | T175-G179 PolarHBondContact O-N 2.9Å; T175-G179 VanDerWaalsContact O-N 3.16Å; P176-G179 PolarHBondContact O-N 3.4Å; G179-F182 PolarHBondContact O-N 3.2Å; G179-I183 WeakPolarHBondContact O-CG1 3.4Å; G179-I183 PolarHBondContact O-N 3.33Å |
| 180 | I | 72.4 | Confident | 70.1 | Confident | 53 Ų | 53 | 36.2 Ų | 36.2 | 27% | 0.272 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -66.3 | -38.9 | 177.7 | -69.4 | 165.9 | 0 | 0 | 0 | 111.2 | P176 V178 T184 A214 A218 | P176-I180 WeakPolarHBondContact O-CB 3.28Å; P176-I180 WeakPolarHBondContact O-CD1 3.42Å; P176-I180 WeakPolarHBondContact O-CG1 3.27Å; P176-I180 PolarHBondContact O-N 3.39Å; V178-I180 PolarHBondContact O-N 3.48Å; I180-T184 VanDerWaalsContact O-CB 3.29Å; I180-T184 WeakPolarHBondContact O-CB 3.1Å; I180-T184 PolarHBondContact O-N 2.87Å; I180-T184 PolarHBondContact O-OG1 2.94Å; I180-A214 HydrophobicContact CG2-CB 4.41Å; I180-A218 HydrophobicContact CD1-CB 3.4Å |
| 181 | Y | 70.8 | Confident | 70.2 | Confident | 84 Ų | 84 | 43.2 Ų | 43.2 | 33% | 0.329 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -57.4 | -51.9 | 175.5 | 179.2 | -95.1 | 0 | 0 | 0 | 111.3 | T177 V178 T184 Y185 A211 | T177-Y181 WeakPolarHBondContact O-CB 3.17Å; T177-Y181 PolarHBondContact O-N 3.05Å; V178-Y181 WeakPolarHBondContact O-CB 3.29Å; V178-Y181 PolarHBondContact O-N 3.37Å; Y181-T184 PolarHBondContact O-N 3.23Å; Y181-Y185 WeakPolarHBondContact O-CB 3.44Å; Y181-Y185 PolarHBondContact O-N 3.45Å; Y181-A211 HydrophobicContact CD2-CB 4.04Å; Y181-A211 HydrophobicContact CE2-CB 4.08Å |
| 182 | F | 68.2 | Low | 69.8 | Low | 23 Ų | 23 | 50 Ų | 50 | 10% | 0.101 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -67.4 | -42 | -178.3 | -83 | -72.1 | 0 | 0 | 0 | 113.1 | Y77 I102 V178 G179 T184 E186 | Y77-F182 HydrophobicContact CD1-CZ 4.49Å; Y77-F182 HydrophobicContact CD2-CD2 4.4Å; Y77-F182 HydrophobicContact CD2-CE1 4.1Å; Y77-F182 AromaticContact CD2-CE2 3.89Å; Y77-F182 HydrophobicContact CD2-CE2 3.89Å; Y77-F182 AromaticContact CD2-CZ 3.73Å; Y77-F182 HydrophobicContact CD2-CZ 3.73Å; Y77-F182 HydrophobicContact CE1-CE1 4.09Å; Y77-F182 HydrophobicContact CE1-CZ 4.44Å; Y77-F182 AromaticContact CE2-CD1 3.74Å; Y77-F182 HydrophobicContact CE2-CD1 3.74Å; Y77-F182 HydrophobicContact CE2-CD2 4.11Å; Y77-F182 AromaticContact CE2-CE1 3.56Å; Y77-F182 HydrophobicContact CE2-CE1 3.56Å; Y77-F182 AromaticContact CE2-CE2 3.95Å; Y77-F182 HydrophobicContact CE2-CE2 3.95Å; Y77-F182 HydrophobicContact CE2-CG 4.02Å; Y77-F182 AromaticContact CE2-CZ 3.67Å; Y77-F182 HydrophobicContact CE2-CZ 3.67Å; Y77-F182 HydrophobicContact CG-CZ 4.14Å; Y77-F182 AromaticContact CZ-CD1 3.84Å; Y77-F182 AromaticContact CZ-CE1 3.55Å; I102-F182 HydrophobicContact CG2-CB 3.82Å; V178-F182 HydrophobicContact CG1-CD2 3.71Å; V178-F182 HydrophobicContact CG1-CE2 3.68Å; V178-F182 WeakPolarHBondContact O-CD2 3.36Å; V178-F182 PolarHBondContact O-N 2.89Å; G179-F182 PolarHBondContact O-N 3.2Å; F182-T184 VanDerWaalsContact C-N 3.34Å; F182-T184 PolarHBondContact O-N 3.49Å; F182-E186 WeakPolarHBondContact O-CB 2.98Å; F182-E186 PolarHBondContact O-N 3.37Å |
| 183 | I | 74.5 | Confident | 69.3 | Low | 61 Ų | 61 | 47.9 Ų | 47.9 | 31% | 0.313 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -57.3 | -49.6 | 173.7 | -73.7 | 179.3 | 0 | 0 | 0 | 110.5 | F103 G179 E186 G187 | F103-I183 HydrophobicContact CB-CD1 3.68Å; F103-I183 HydrophobicContact CB-CG1 3.83Å; F103-I183 HydrophobicContact CD2-CD1 3.2Å; F103-I183 HydrophobicContact CD2-CG1 3.82Å; F103-I183 HydrophobicContact CE2-CD1 4Å; F103-I183 HydrophobicContact CG-CD1 3.65Å; F103-I183 HydrophobicContact CG-CG1 4.23Å; G179-I183 WeakPolarHBondContact O-CG1 3.4Å; G179-I183 PolarHBondContact O-N 3.33Å; I183-E186 PolarHBondContact O-N 3.12Å; I183-G187 PolarHBondContact O-N 3.46Å |
| 184 | T | 70.4 | Confident | 68.7 | Low | 37 Ų | 37 | 49.7 Ų | 49.7 | 23% | 0.227 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -68.4 | -42 | -173.6 | -51.5 | 0 | 0 | 0 | 0 | 110.6 | I180 Y181 F182 L188 A211 A214 | I180-T184 VanDerWaalsContact O-CB 3.29Å; I180-T184 WeakPolarHBondContact O-CB 3.1Å; I180-T184 PolarHBondContact O-N 2.87Å; I180-T184 PolarHBondContact O-OG1 2.94Å; Y181-T184 PolarHBondContact O-N 3.23Å; F182-T184 VanDerWaalsContact C-N 3.34Å; F182-T184 PolarHBondContact O-N 3.49Å; T184-L188 HydrophobicContact CG2-CD1 3.94Å; T184-L188 WeakPolarHBondContact O-CB 3.05Å; T184-L188 VanDerWaalsContact O-CG 3.27Å; T184-L188 WeakPolarHBondContact O-CG 3.41Å; T184-L188 PolarHBondContact O-N 2.89Å; T184-A211 HydrophobicContact CG2-CB 4.12Å; T184-A214 HydrophobicContact CG2-CB 3.96Å |
| 185 | Y | 68 | Low | 67.7 | Low | 65 Ų | 65 | 58.7 Ų | 58.7 | 26% | 0.255 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.2 | -48.6 | 176 | 177 | -99.5 | 0 | 0 | 0 | 111.3 | Y181 L188 C189 V204 A207 | Y181-Y185 WeakPolarHBondContact O-CB 3.44Å; Y181-Y185 PolarHBondContact O-N 3.45Å; Y185-L188 PolarHBondContact O-N 2.88Å; Y185-C189 WeakPolarHBondContact O-CB 3.47Å; Y185-C189 PolarHBondContact O-N 3.2Å; Y185-C189 PolarHBondContact O-SG 3.48Å; Y185-C189 VanDerWaalsContact O-SG 3.36Å; Y185-V204 HydrophobicContact CE2-CG1 4.36Å; Y185-A207 HydrophobicContact CD2-CB 4.22Å; Y185-A207 HydrophobicContact CE2-CB 4.38Å |
| 186 | E | 67.4 | Low | 66.6 | Low | 34 Ų | 34 | 61.3 Ų | 61.3 | 16% | 0.159 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -74.7 | -34.5 | -176.6 | -168.2 | 148.5 | -179.8 | 0 | 0 | 112.9 | I102 F182 I183 R190 | I102-E186 HydrophobicContact CD1-CG 3.99Å; I102-E186 VanDerWaalsContact CD1-OE1 3.29Å; I102-E186 WeakPolarHBondContact CD1-OE1 3.13Å; I102-E186 WeakPolarHBondContact CD1-OE2 3.22Å; I102-E186 WeakPolarHBondContact CG1-OE2 3.42Å; I102-E186 WeakPolarHBondContact CG2-OE2 3.11Å; F182-E186 WeakPolarHBondContact O-CB 2.98Å; F182-E186 PolarHBondContact O-N 3.37Å; I183-E186 PolarHBondContact O-N 3.12Å; E186-R190 WeakPolarHBondContact O-CB 3.21Å; E186-R190 VanDerWaalsContact O-CG 3.3Å; E186-R190 WeakPolarHBondContact O-CG 3.39Å; E186-R190 PolarHBondContact O-N 2.98Å; E186-R190 IonicContact OE1-CZ 2.88Å; E186-R190 IonicContact OE1-NE 3.35Å; E186-R190 IonicContact OE1-NH2 3.91Å; E186-R190 PolarHBondContact OE1-NH2 2.84Å |
| 187 | G | 68.9 | Low | 65.8 | Low | 20 Ų | 20 | 65.9 Ų | 65.9 | 21% | 0.206 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.1 | -47.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | I183 R190 Q191 | I183-G187 PolarHBondContact O-N 3.46Å; G187-R190 PolarHBondContact O-N 3.14Å; G187-Q191 WeakPolarHBondContact O-CB 3.4Å; G187-Q191 PolarHBondContact O-N 3.34Å; G187-Q191 VanDerWaalsContact O-N 3.1Å |
| 188 | L | 68.7 | Low | 65 | Low | 34 Ų | 34 | 72 Ų | 72 | 18% | 0.178 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -69.1 | -44.4 | 178 | -69.3 | 169.7 | 0 | 0 | 0 | 111.7 | T184 Y185 R190 Q191 Y192 A207 F210 | T184-L188 HydrophobicContact CG2-CD1 3.94Å; T184-L188 WeakPolarHBondContact O-CB 3.05Å; T184-L188 VanDerWaalsContact O-CG 3.27Å; T184-L188 WeakPolarHBondContact O-CG 3.41Å; T184-L188 PolarHBondContact O-N 2.89Å; Y185-L188 PolarHBondContact O-N 2.88Å; L188-R190 VanDerWaalsContact C-N 3.28Å; L188-R190 PolarHBondContact O-N 2.8Å; L188-Q191 PolarHBondContact O-N 3.37Å; L188-Y192 HydrophobicContact CD2-CD2 4.31Å; L188-Y192 HydrophobicContact CD2-CE2 3.84Å; L188-Y192 VanDerWaalsContact O-CD2 3.28Å; L188-Y192 WeakPolarHBondContact O-CD2 3.48Å; L188-Y192 PolarHBondContact O-N 3.44Å; L188-A207 HydrophobicContact CB-CB 3.75Å; L188-F210 HydrophobicContact CD1-CB 3.42Å; L188-F210 VanDerWaalsContact CD1-CB 3.42Å; L188-F210 HydrophobicContact CD1-CG 4.33Å |
| 189 | C | 65.2 | Low | 64.5 | Low | 17 Ų | 17 | 73.5 Ų | 73.5 | 12% | 0.115 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -58.6 | -39.6 | 176.5 | -78.4 | 0 | 0 | 0 | 0 | 112.1 | Y185 T193 | Y185-C189 WeakPolarHBondContact O-CB 3.47Å; Y185-C189 PolarHBondContact O-N 3.2Å; Y185-C189 PolarHBondContact O-SG 3.48Å; Y185-C189 VanDerWaalsContact O-SG 3.36Å; C189-T193 WeakPolarHBondContact O-CB 3.26Å; C189-T193 PolarHBondContact O-N 2.9Å; C189-T193 VanDerWaalsContact O-N 3.08Å; C189-T193 PolarHBondContact O-OG1 3.39Å |
| 190 | R | 68.4 | Low | 64.4 | Low | 69 Ų | 69 | 77 Ų | 77 | 26% | 0.26 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -71.3 | -35.1 | 177.6 | -73.5 | 177.4 | -171.9 | -170.8 | 3.2 | 113.8 | P97 Y99 E186 G187 L188 | P97-R190 VanDerWaalsContact O-CZ 3.28Å; P97-R190 PolarHBondContact O-NH1 2.92Å; P97-R190 PolarHBondContact O-NH2 2.93Å; Y99-R190 WeakPolarHBondContact OH-CD 3.35Å; E186-R190 WeakPolarHBondContact O-CB 3.21Å; E186-R190 VanDerWaalsContact O-CG 3.3Å; E186-R190 WeakPolarHBondContact O-CG 3.39Å; E186-R190 PolarHBondContact O-N 2.98Å; E186-R190 IonicContact OE1-CZ 2.88Å; E186-R190 IonicContact OE1-NE 3.35Å; E186-R190 IonicContact OE1-NH2 3.91Å; E186-R190 PolarHBondContact OE1-NH2 2.84Å; G187-R190 PolarHBondContact O-N 3.14Å; L188-R190 VanDerWaalsContact C-N 3.28Å; L188-R190 PolarHBondContact O-N 2.8Å |
| 191 | Q | 71.3 | Confident | 63.8 | Low | 150 Ų | 150 | 79.6 Ų | 79.6 | 70% | 0.701 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -75.1 | -30.4 | -179.1 | -170.1 | 171.8 | -0.7 | 0 | 0 | 112.6 | G187 L188 | G187-Q191 WeakPolarHBondContact O-CB 3.4Å; G187-Q191 PolarHBondContact O-N 3.34Å; G187-Q191 VanDerWaalsContact O-N 3.1Å; L188-Q191 PolarHBondContact O-N 3.37Å |
| 192 | Y | 65.1 | Low | 63.4 | Low | 152 Ų | 152 | 78.6 Ų | 78.6 | 60% | 0.596 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -105.2 | 0.9 | -176.2 | -70 | -80.7 | 0 | 0 | 0 | 114.3 | L188 | L188-Y192 HydrophobicContact CD2-CD2 4.31Å; L188-Y192 HydrophobicContact CD2-CE2 3.84Å; L188-Y192 VanDerWaalsContact O-CD2 3.28Å; L188-Y192 WeakPolarHBondContact O-CD2 3.48Å; L188-Y192 PolarHBondContact O-N 3.44Å |
| 193 | T | 61 | Low | 63.3 | Low | 28 Ų | 28 | 79 Ų | 79 | 17% | 0.172 | 45% | 0.445 | C | S | . | . | S | Bend | trans | -111.8 | 121.3 | 175.9 | -49.5 | 0 | 0 | 0 | 0 | 109.9 | C189 Q197 P199 | C189-T193 WeakPolarHBondContact O-CB 3.26Å; C189-T193 PolarHBondContact O-N 2.9Å; C189-T193 VanDerWaalsContact O-N 3.08Å; C189-T193 PolarHBondContact O-OG1 3.39Å; T193-Q197 WeakPolarHBondContact CG2-O 3.38Å; T193-P199 HydrophobicContact CG2-CB 4.41Å |
| 194 | P | 58.1 | Low | 62.9 | Low | 84 Ų | 84 | 78.3 Ų | 78.3 | 55% | 0.545 | 44% | 0.444 | S | S | . | . | trans | -60.6 | 145.1 | 173.3 | -17.9 | 29.6 | 0 | 0 | 0 | 111.4 | G196 Q197 | P194-G196 PolarHBondContact O-N 3.04Å; P194-G196 VanDerWaalsContact O-N 3.15Å; P194-Q197 PolarHBondContact O-N 2.7Å | ||
| 195 | E | 48.8 | Very low | 62.7 | Low | 205 Ų | 205 | 80.1 Ų | 80.1 | 96% | 0.958 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.8 | 120.8 | 178.4 | -68.8 | -171.5 | 165.9 | 0 | 0 | 111.2 | ||
| 196 | G | 51.9 | Low | 62.7 | Low | 87 Ų | 87 | 80.6 Ų | 80.6 | 90% | 0.897 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 97.2 | 0.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | P194 | P194-G196 PolarHBondContact O-N 3.04Å; P194-G196 VanDerWaalsContact O-N 3.15Å |
| 197 | Q | 53.9 | Low | 62.7 | Low | 139 Ų | 139 | 79.1 Ų | 79.1 | 65% | 0.65 | 46% | 0.455 | S | S | * | . | S | Bend | trans | -110.4 | 148.1 | 173.6 | -72.4 | -176.4 | -2.8 | 0 | 0 | 112.5 | T193 P194 | T193-Q197 WeakPolarHBondContact CG2-O 3.38Å; P194-Q197 PolarHBondContact O-N 2.7Å |
| 198 | N | 54.6 | Low | 62.5 | Low | 149 Ų | 149 | 79 Ų | 79 | 80% | 0.797 | 45% | 0.454 | S | S | * | . | P | Polyproline II helix | trans | -66.7 | 141.9 | 169.1 | -70.9 | -31.4 | 0 | 0 | 0 | 109.1 | S200 | N198-S200 PolarHBondContact O-N 2.97Š|
| 199 | P | 59.2 | Low | 62.4 | Low | 53 Ų | 53 | 78.8 Ų | 78.8 | 34% | 0.344 | 46% | 0.459 | S | S | . | . | P | Polyproline II helix | trans | -61 | 128.9 | 179.4 | 26.5 | -34.3 | 0 | 0 | 0 | 109.7 | T193 V204 | T193-P199 HydrophobicContact CG2-CB 4.41Å; P199-V204 HydrophobicContact CB-CG2 3.68Å; P199-V204 HydrophobicContact CG-CG2 3.68Å |
| 200 | S | 64.8 | Low | 62.7 | Low | 74 Ų | 74 | 83.9 Ų | 83.9 | 52% | 0.517 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -56.6 | 146.1 | 173.8 | 174.9 | 0 | 0 | 0 | 0 | 110 | N198 A202 T203 V204 | N198-S200 PolarHBondContact O-N 2.97Å; S200-A202 PolarHBondContact O-N 3.3Å; S200-T203 WeakPolarHBondContact O-CA 3.43Å; S200-T203 WeakPolarHBondContact O-CB 3.42Å; S200-T203 PolarHBondContact O-N 3.3Å; S200-V204 PolarHBondContact O-N 2.84Å |
| 201 | S | 60.8 | Low | 62.6 | Low | 106 Ų | 106 | 80.6 Ų | 80.6 | 74% | 0.741 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -52.4 | -33 | 178.7 | -53.4 | 0 | 0 | 0 | 0 | 112.4 | L205 | S201-L205 VanDerWaalsContact O-CB 3.26Å; S201-L205 WeakPolarHBondContact O-CB 3.24Å; S201-L205 PolarHBondContact O-N 2.97Å |
| 202 | A | 61.8 | Low | 62.3 | Low | 63 Ų | 63 | 74.1 Ų | 74.1 | 52% | 0.521 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -68.2 | -41.1 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | S200 L205 V206 | S200-A202 PolarHBondContact O-N 3.3Å; A202-L205 PolarHBondContact O-N 3.06Å; A202-V206 WeakPolarHBondContact O-CB 3.09Å; A202-V206 VanDerWaalsContact O-CG2 3.29Å; A202-V206 WeakPolarHBondContact O-CG2 3.47Å; A202-V206 PolarHBondContact O-N 3.42Å |
| 203 | T | 66.6 | Low | 62.5 | Low | 31 Ų | 31 | 71.3 Ų | 71.3 | 19% | 0.19 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -65.5 | -43.8 | 176.6 | -53.8 | 0 | 0 | 0 | 0 | 111 | S200 L205 V206 A207 | S200-T203 WeakPolarHBondContact O-CA 3.43Å; S200-T203 WeakPolarHBondContact O-CB 3.42Å; S200-T203 PolarHBondContact O-N 3.3Å; T203-L205 VanDerWaalsContact C-N 3.29Å; T203-L205 PolarHBondContact O-N 3.33Å; T203-V206 PolarHBondContact O-N 2.84Å; T203-A207 WeakPolarHBondContact O-CB 3.12Å; T203-A207 PolarHBondContact O-N 2.91Å |
| 204 | V | 67.3 | Low | 62.9 | Low | 48 Ų | 48 | 71.5 Ų | 71.5 | 29% | 0.291 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -59.7 | -42.1 | 174.9 | 175.2 | 0 | 0 | 0 | 0 | 111 | Y185 P199 S200 G208 | Y185-V204 HydrophobicContact CE2-CG1 4.36Å; P199-V204 HydrophobicContact CB-CG2 3.68Å; P199-V204 HydrophobicContact CG-CG2 3.68Å; S200-V204 PolarHBondContact O-N 2.84Å; V204-G208 PolarHBondContact O-N 2.62Å |
| 205 | L | 64.6 | Low | 63.4 | Low | 74 Ų | 74 | 68 Ų | 68 | 39% | 0.387 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -69.2 | -44.1 | -178.7 | -167.1 | 133.2 | 0 | 0 | 0 | 112.4 | S201 A202 T203 G209 F277 | S201-L205 VanDerWaalsContact O-CB 3.26Å; S201-L205 WeakPolarHBondContact O-CB 3.24Å; S201-L205 PolarHBondContact O-N 2.97Å; A202-L205 PolarHBondContact O-N 3.06Å; T203-L205 VanDerWaalsContact C-N 3.29Å; T203-L205 PolarHBondContact O-N 3.33Å; L205-G209 PolarHBondContact O-N 2.82Å; L205-F277 HydrophobicContact CD1-CD1 3.51Å; L205-F277 HydrophobicContact CD1-CD2 4.11Å; L205-F277 HydrophobicContact CD1-CE1 3.37Å; L205-F277 HydrophobicContact CD1-CE2 3.99Å; L205-F277 HydrophobicContact CD1-CG 3.9Å; L205-F277 HydrophobicContact CD1-CZ 3.63Å; L205-F277 HydrophobicContact CG-CE1 4.04Å; L205-F277 HydrophobicContact CG-CE2 4.13Å; L205-F277 HydrophobicContact CG-CZ 3.81Å |
| 206 | V | 69.4 | Low | 64.4 | Low | 75 Ų | 75 | 62.8 Ų | 62.8 | 46% | 0.455 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66.7 | -46.5 | 176.1 | 173 | 0 | 0 | 0 | 0 | 110.6 | A202 T203 G208 G209 F210 | A202-V206 WeakPolarHBondContact O-CB 3.09Å; A202-V206 VanDerWaalsContact O-CG2 3.29Å; A202-V206 WeakPolarHBondContact O-CG2 3.47Å; A202-V206 PolarHBondContact O-N 3.42Å; T203-V206 PolarHBondContact O-N 2.84Å; V206-G208 PolarHBondContact O-N 2.88Å; V206-G209 PolarHBondContact O-N 3.38Å; V206-F210 HydrophobicContact CG1-CD2 3.74Å; V206-F210 HydrophobicContact CG1-CE2 3.81Å; V206-F210 WeakPolarHBondContact O-CD2 3.28Å; V206-F210 PolarHBondContact O-N 3.21Å |
| 207 | A | 66.4 | Low | 65.3 | Low | 3 Ų | 3 | 61.4 Ų | 61.4 | 3% | 0.025 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.8 | -44.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y185 L188 T203 A211 | Y185-A207 HydrophobicContact CD2-CB 4.22Å; Y185-A207 HydrophobicContact CE2-CB 4.38Å; L188-A207 HydrophobicContact CB-CB 3.75Å; T203-A207 WeakPolarHBondContact O-CB 3.12Å; T203-A207 PolarHBondContact O-N 2.91Å; A207-A211 WeakPolarHBondContact O-CB 3.28Å; A207-A211 PolarHBondContact O-N 3.11Å |
| 208 | G | 65.3 | Low | 66.1 | Low | 18 Ų | 18 | 56.1 Ų | 56.1 | 19% | 0.186 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -62.3 | -39.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113 | V204 V206 G212 | V204-G208 PolarHBondContact O-N 2.62Å; V206-G208 PolarHBondContact O-N 2.88Å; G208-G212 PolarHBondContact O-N 3.47Å |
| 209 | G | 66.1 | Low | 66.7 | Low | 29 Ų | 29 | 49.3 Ų | 49.3 | 30% | 0.299 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -63.6 | -50.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | L205 V206 G212 I213 | L205-G209 PolarHBondContact O-N 2.82Å; V206-G209 PolarHBondContact O-N 3.38Å; G209-G212 PolarHBondContact O-N 2.82Å; G209-I213 WeakPolarHBondContact O-CG1 3.5Å; G209-I213 PolarHBondContact O-N 3.17Å |
| 210 | F | 70.7 | Confident | 67.2 | Low | 124 Ų | 124 | 46.9 Ų | 46.9 | 54% | 0.544 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -67.6 | -40.6 | 177.3 | -83.7 | -77.4 | 0 | 0 | 0 | 112.5 | L188 V206 G212 I213 A214 | L188-F210 HydrophobicContact CD1-CB 3.42Å; L188-F210 VanDerWaalsContact CD1-CB 3.42Å; L188-F210 HydrophobicContact CD1-CG 4.33Å; V206-F210 HydrophobicContact CG1-CD2 3.74Å; V206-F210 HydrophobicContact CG1-CE2 3.81Å; V206-F210 WeakPolarHBondContact O-CD2 3.28Å; V206-F210 PolarHBondContact O-N 3.21Å; F210-G212 VanDerWaalsContact C-N 3.29Å; F210-G212 PolarHBondContact O-N 3.32Å; F210-I213 PolarHBondContact O-N 3.1Å; F210-A214 WeakPolarHBondContact O-CB 3.35Å; F210-A214 PolarHBondContact O-N 3.42Å |
| 211 | A | 67.5 | Low | 67.4 | Low | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.6 | -40.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y181 T184 A207 S215 | Y181-A211 HydrophobicContact CD2-CB 4.04Å; Y181-A211 HydrophobicContact CE2-CB 4.08Å; T184-A211 HydrophobicContact CG2-CB 4.12Å; A207-A211 WeakPolarHBondContact O-CB 3.28Å; A207-A211 PolarHBondContact O-N 3.11Å; A211-S215 WeakPolarHBondContact O-CB 3.46Å; A211-S215 PolarHBondContact O-N 3.28Å |
| 212 | G | 65.4 | Low | 67.9 | Low | 15 Ų | 15 | 41.8 Ų | 41.8 | 16% | 0.155 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -57.3 | -53.7 | 171 | 0 | 0 | 0 | 0 | 0 | 111.4 | G208 G209 F210 A214 S215 W216 | G208-G212 PolarHBondContact O-N 3.47Å; G209-G212 PolarHBondContact O-N 2.82Å; F210-G212 VanDerWaalsContact C-N 3.29Å; F210-G212 PolarHBondContact O-N 3.32Å; G212-A214 PolarHBondContact O-N 3.14Å; G212-S215 WeakPolarHBondContact O-CB 3.36Å; G212-S215 PolarHBondContact O-N 2.95Å; G212-W216 PolarHBondContact O-N 3.46Å |
| 213 | I | 68.1 | Low | 68.3 | Low | 92 Ų | 92 | 39.4 Ų | 39.4 | 47% | 0.472 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -58.3 | -47.2 | 179.9 | -66.4 | 165.7 | 0 | 0 | 0 | 111.3 | G209 F210 S215 W216 V217 | G209-I213 WeakPolarHBondContact O-CG1 3.5Å; G209-I213 PolarHBondContact O-N 3.17Å; F210-I213 PolarHBondContact O-N 3.1Å; I213-S215 VanDerWaalsContact C-N 3.33Å; I213-S215 PolarHBondContact O-N 3.12Å; I213-W216 PolarHBondContact O-N 2.97Å; I213-V217 HydrophobicContact CG2-CG2 4.41Å; I213-V217 VanDerWaalsContact O-CG2 3.31Å; I213-V217 WeakPolarHBondContact O-CG2 3.23Å; I213-V217 PolarHBondContact O-N 3.35Å |
| 214 | A | 70.3 | Confident | 68.3 | Low | 32 Ų | 32 | 38.7 Ų | 38.7 | 26% | 0.264 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -60.7 | -43.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | I180 T184 F210 G212 V217 A218 | I180-A214 HydrophobicContact CG2-CB 4.41Å; T184-A214 HydrophobicContact CG2-CB 3.96Å; F210-A214 WeakPolarHBondContact O-CB 3.35Å; F210-A214 PolarHBondContact O-N 3.42Å; G212-A214 PolarHBondContact O-N 3.14Å; A214-V217 PolarHBondContact O-N 3.39Å; A214-A218 PolarHBondContact O-N 3.38Å; A214-A218 VanDerWaalsContact O-N 3.09Å |
| 215 | S | 69.1 | Low | 68.3 | Low | 11 Ų | 11 | 36.7 Ų | 36.7 | 8% | 0.077 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.5 | -45.3 | 175.2 | -174.2 | 0 | 0 | 0 | 0 | 111.6 | T177 A211 G212 I213 V217 A218 A219 | T177-S215 WeakPolarHBondContact CG2-OG 3.24Å; T177-S215 PolarHBondContact O-OG 3.46Å; A211-S215 WeakPolarHBondContact O-CB 3.46Å; A211-S215 PolarHBondContact O-N 3.28Å; G212-S215 WeakPolarHBondContact O-CB 3.36Å; G212-S215 PolarHBondContact O-N 2.95Å; I213-S215 VanDerWaalsContact C-N 3.33Å; I213-S215 PolarHBondContact O-N 3.12Å; S215-V217 PolarHBondContact O-N 3.48Å; S215-A218 PolarHBondContact O-N 3.1Å; S215-A219 VanDerWaalsContact O-CB 3.32Å; S215-A219 WeakPolarHBondContact O-CB 3.4Å; S215-A219 PolarHBondContact O-N 3.15Å |
| 216 | W | 67.9 | Low | 68.5 | Low | 95 Ų | 95 | 34 Ų | 34 | 36% | 0.36 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -65.5 | -37.7 | 177 | -80.6 | 105.6 | 0 | 0 | 0 | 112.8 | G212 I213 A218 A219 T220 N265 | G212-W216 PolarHBondContact O-N 3.46Å; I213-W216 PolarHBondContact O-N 2.97Å; W216-A218 VanDerWaalsContact C-N 3.32Å; W216-A218 PolarHBondContact O-N 3.24Å; W216-A219 PolarHBondContact O-N 3.26Å; W216-T220 WeakPolarHBondContact O-CB 3.22Å; W216-T220 PolarHBondContact O-N 2.98Å; W216-T220 PolarHBondContact O-OG1 3.22Å; W216-N265 HydrophobicContact CE3-CB 3.98Å; W216-N265 HydrophobicContact CZ3-CB 4.41Å |
| 217 | V | 72 | Confident | 68.1 | Low | 59 Ų | 59 | 31.4 Ų | 31.4 | 36% | 0.358 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -62.3 | -41.7 | 174.7 | 169.6 | 0 | 0 | 0 | 0 | 110.7 | I213 A214 S215 P221 V262 | I213-V217 HydrophobicContact CG2-CG2 4.41Å; I213-V217 VanDerWaalsContact O-CG2 3.31Å; I213-V217 WeakPolarHBondContact O-CG2 3.23Å; I213-V217 PolarHBondContact O-N 3.35Å; A214-V217 PolarHBondContact O-N 3.39Å; S215-V217 PolarHBondContact O-N 3.48Å; V217-P221 WeakPolarHBondContact O-CD 3.5Å; V217-V262 HydrophobicContact CG2-CG1 4.37Å |
| 218 | A | 69.4 | Low | 68.1 | Low | 28 Ų | 28 | 33.8 Ų | 33.8 | 23% | 0.231 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -71.5 | -33.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | I180 A214 S215 W216 P221 | I180-A218 HydrophobicContact CD1-CB 3.4Å; A214-A218 PolarHBondContact O-N 3.38Å; A214-A218 VanDerWaalsContact O-N 3.09Å; S215-A218 PolarHBondContact O-N 3.1Å; W216-A218 VanDerWaalsContact C-N 3.32Å; W216-A218 PolarHBondContact O-N 3.24Å; A218-P221 WeakPolarHBondContact O-CD 3.26Å; A218-P221 VanDerWaalsContact O-CG 3.26Å; A218-P221 WeakPolarHBondContact O-CG 3.48Å |
| 219 | A | 68.6 | Low | 68 | Low | 6 Ų | 6 | 35.5 Ų | 35.5 | 5% | 0.05 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -75 | -33.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | T177 S215 W216 L222 D223 | T177-A219 HydrophobicContact CG2-CB 3.75Å; T177-A219 WeakPolarHBondContact OG1-CB 3.34Å; S215-A219 VanDerWaalsContact O-CB 3.32Å; S215-A219 WeakPolarHBondContact O-CB 3.4Å; S215-A219 PolarHBondContact O-N 3.15Å; W216-A219 PolarHBondContact O-N 3.26Å; A219-L222 PolarHBondContact O-N 2.86Å; A219-L222 VanDerWaalsContact O-N 3.09Å; A219-D223 PolarHBondContact O-N 3.48Å |
| 220 | T | 70 | Confident | 67.5 | Low | 2 Ų | 2 | 37.8 Ų | 37.8 | 1% | 0.012 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -55.8 | -44.9 | -174.4 | -55.6 | 0 | 0 | 0 | 0 | 114.2 | W216 L222 D223 V224 F258 V262 N265 | W216-T220 WeakPolarHBondContact O-CB 3.22Å; W216-T220 PolarHBondContact O-N 2.98Å; W216-T220 PolarHBondContact O-OG1 3.22Å; T220-L222 VanDerWaalsContact C-N 3.3Å; T220-L222 PolarHBondContact O-N 2.68Å; T220-D223 WeakPolarHBondContact O-CB 3.22Å; T220-D223 PolarHBondContact O-N 2.99Å; T220-V224 WeakPolarHBondContact O-CG2 3.3Å; T220-V224 PolarHBondContact O-N 3.22Å; T220-F258 VanDerWaalsContact CG2-O 3.22Å; T220-F258 WeakPolarHBondContact CG2-O 3.03Å; T220-V262 HydrophobicContact CG2-CG2 3.83Å; T220-N265 PolarHBondContact OG1-ND2 3.02Å |
| 221 | P | 68 | Low | 66.6 | Low | 35 Ų | 35 | 34 Ų | 34 | 23% | 0.227 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.6 | -42.2 | 175.3 | 17.1 | -29.9 | 0 | 0 | 0 | 112.7 | V217 A218 V224 I225 F258 | V217-P221 WeakPolarHBondContact O-CD 3.5Å; A218-P221 WeakPolarHBondContact O-CD 3.26Å; A218-P221 VanDerWaalsContact O-CG 3.26Å; A218-P221 WeakPolarHBondContact O-CG 3.48Å; P221-V224 PolarHBondContact O-N 2.97Å; P221-I225 VanDerWaalsContact O-CG1 3.31Å; P221-I225 WeakPolarHBondContact O-CG1 3.47Å; P221-I225 PolarHBondContact O-N 3.47Å; P221-I225 VanDerWaalsContact O-N 3.1Å; P221-F258 HydrophobicContact CB-CB 3.89Å; P221-F258 HydrophobicContact CB-CD1 3.72Å; P221-F258 HydrophobicContact CB-CG 4.04Å |
| 222 | L | 71.1 | Confident | 65.8 | Low | 37 Ų | 37 | 35 Ų | 35 | 19% | 0.194 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -72.7 | -35.1 | -177.5 | -64.9 | 166.6 | 0 | 0 | 0 | 111.4 | R173 P176 A219 T220 I225 K226 | R173-L222 HydrophobicContact CB-CB 3.94Å; R173-L222 HydrophobicContact CB-CD1 4.48Å; R173-L222 HydrophobicContact CG-CB 3.77Å; P176-L222 HydrophobicContact CG-CD1 3.79Å; A219-L222 PolarHBondContact O-N 2.86Å; A219-L222 VanDerWaalsContact O-N 3.09Å; T220-L222 VanDerWaalsContact C-N 3.3Å; T220-L222 PolarHBondContact O-N 2.68Å; L222-I225 PolarHBondContact O-N 2.93Å; L222-K226 VanDerWaalsContact O-CB 3.32Å; L222-K226 WeakPolarHBondContact O-CB 3.45Å; L222-K226 PolarHBondContact O-N 3.06Å |
| 223 | D | 69.9 | Low | 65 | Low | 14 Ų | 14 | 37.3 Ų | 37.3 | 8% | 0.075 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.3 | -45.7 | 169.6 | -95.3 | 0.4 | 0 | 0 | 0 | 111.5 | K27 R173 A219 T220 K226 S227 | K27-D223 IonicContact NZ-OD2 2.84Å; K27-D223 PolarHBondContact NZ-OD2 3.44Å; R173-D223 WeakPolarHBondContact CD-OD1 3.09Å; R173-D223 IonicContact CZ-OD1 3.51Å; R173-D223 IonicContact NE-OD1 2.7Å; R173-D223 IonicContact NH1-OD1 3.29Å; R173-D223 PolarHBondContact NH1-OD1 3.45Å; A219-D223 PolarHBondContact O-N 3.48Å; T220-D223 WeakPolarHBondContact O-CB 3.22Å; T220-D223 PolarHBondContact O-N 2.99Å; D223-K226 PolarHBondContact O-N 2.95Å; D223-S227 PolarHBondContact O-N 3.42Å; D223-S227 PolarHBondContact O-OG 3.35Å |
| 224 | V | 66.4 | Low | 64 | Low | 16 Ų | 16 | 37.9 Ų | 37.9 | 10% | 0.097 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.6 | -43.3 | 179.2 | 173.1 | 0 | 0 | 0 | 0 | 111 | T220 P221 S227 R228 V257 | T220-V224 WeakPolarHBondContact O-CG2 3.3Å; T220-V224 PolarHBondContact O-N 3.22Å; P221-V224 PolarHBondContact O-N 2.97Å; V224-S227 PolarHBondContact O-N 3.46Å; V224-R228 WeakPolarHBondContact O-CG 3.31Å; V224-R228 PolarHBondContact O-N 3.3Å; V224-R228 VanDerWaalsContact O-N 3.1Å; V224-V257 HydrophobicContact CG1-CG1 3.98Å |
| 225 | I | 68.5 | Low | 62.8 | Low | 5 Ų | 5 | 46.2 Ų | 46.2 | 3% | 0.026 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.8 | -44.3 | 177.5 | -62.4 | 162.1 | 0 | 0 | 0 | 110.5 | P221 L222 S227 R228 M229 V242 C245 M246 F258 | P221-I225 VanDerWaalsContact O-CG1 3.31Å; P221-I225 WeakPolarHBondContact O-CG1 3.47Å; P221-I225 PolarHBondContact O-N 3.47Å; P221-I225 VanDerWaalsContact O-N 3.1Å; L222-I225 PolarHBondContact O-N 2.93Å; I225-S227 PolarHBondContact O-N 3.3Å; I225-R228 PolarHBondContact O-N 3.34Å; I225-M229 HydrophobicContact CG2-CG 4.32Å; I225-M229 HydrophobicContact CG2-SD 4.11Å; I225-M229 WeakPolarHBondContact O-CG 3.42Å; I225-M229 PolarHBondContact O-N 3.04Å; I225-V242 HydrophobicContact CG2-CG1 3.72Å; I225-C245 HydrophobicContact CG2-CB 4.31Å; I225-M246 HydrophobicContact CD1-CB 3.99Å; I225-M246 HydrophobicContact CD1-CG 3.92Å; I225-M246 HydrophobicContact CD1-SD 4.17Å; I225-F258 HydrophobicContact CD1-CE1 3.91Å; I225-F258 HydrophobicContact CG1-CE1 3.81Å |
| 226 | K | 68.4 | Low | 61.9 | Low | 17 Ų | 17 | 55.8 Ų | 55.8 | 7% | 0.074 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -57.5 | -49.8 | 176.6 | -179.6 | -179.2 | 176.1 | -178.5 | 0 | 111 | D121 L222 D223 R228 M229 Q230 | D121-K226 IonicContact OD2-NZ 3.97Å; D121-K226 PolarHBondContact OD2-NZ 3.15Å; L222-K226 VanDerWaalsContact O-CB 3.32Å; L222-K226 WeakPolarHBondContact O-CB 3.45Å; L222-K226 PolarHBondContact O-N 3.06Å; D223-K226 PolarHBondContact O-N 2.95Å; K226-R228 VanDerWaalsContact C-N 3.34Å; K226-R228 PolarHBondContact O-N 2.85Å; K226-M229 PolarHBondContact O-N 3.23Å; K226-Q230 VanDerWaalsContact CE-NE2 3.32Å; K226-Q230 HydrophobicContact CG-CG 4.38Å; K226-Q230 WeakPolarHBondContact O-CB 3.1Å; K226-Q230 WeakPolarHBondContact O-CG 3.21Å; K226-Q230 PolarHBondContact O-N 3.1Å |
| 227 | S | 62.1 | Low | 61.3 | Low | 21 Ų | 21 | 61.2 Ų | 61.2 | 15% | 0.147 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -60.3 | -42.3 | 179.5 | -65 | 0 | 0 | 0 | 0 | 112 | Q31 D223 V224 I225 M231 | Q31-S227 PolarHBondContact OE1-OG 3.33Å; D223-S227 PolarHBondContact O-N 3.42Å; D223-S227 PolarHBondContact O-OG 3.35Å; V224-S227 PolarHBondContact O-N 3.46Å; I225-S227 PolarHBondContact O-N 3.3Å; S227-M231 VanDerWaalsContact O-CG 3.28Å; S227-M231 WeakPolarHBondContact O-CG 3.35Å; S227-M231 PolarHBondContact O-N 3.31Å; S227-M231 VanDerWaalsContact O-N 3.16Å |
| 228 | R | 65.6 | Low | 60.6 | Low | 54 Ų | 54 | 63.1 Ų | 63.1 | 20% | 0.204 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.5 | -44.8 | 176.5 | -72 | -178.9 | -177.4 | -135.2 | -11.8 | 112.5 | V224 I225 K226 M231 D232 S249 E253 V257 | V224-R228 WeakPolarHBondContact O-CG 3.31Å; V224-R228 PolarHBondContact O-N 3.3Å; V224-R228 VanDerWaalsContact O-N 3.1Å; I225-R228 PolarHBondContact O-N 3.34Å; K226-R228 VanDerWaalsContact C-N 3.34Å; K226-R228 PolarHBondContact O-N 2.85Å; R228-M231 PolarHBondContact O-N 2.76Å; R228-D232 PolarHBondContact O-N 3.08Å; R228-D232 VanDerWaalsContact O-N 3.11Å; R228-S249 WeakPolarHBondContact CD-OG 3.43Å; R228-S249 PolarHBondContact NH1-OG 3.31Å; R228-E253 IonicContact CZ-OE1 3.49Å; R228-E253 VanDerWaalsContact CZ-OE1 3.25Å; R228-E253 IonicContact CZ-OE2 2.92Å; R228-E253 IonicContact NH1-OE1 3.87Å; R228-E253 PolarHBondContact NH1-OE1 2.84Å; R228-E253 IonicContact NH2-OE1 3.83Å; R228-E253 PolarHBondContact NH2-OE1 3.36Å; R228-E253 IonicContact NH2-OE2 3.78Å; R228-E253 PolarHBondContact NH2-OE2 2.92Å; R228-V257 VanDerWaalsContact NH2-CG1 3.3Å |
| 229 | M | 63.7 | Low | 60.2 | Low | 54 Ų | 54 | 63.9 Ų | 63.9 | 27% | 0.266 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -66.8 | -37.6 | 178.7 | -72.6 | -172.8 | 76.4 | 0 | 0 | 113 | I225 K226 M231 D232 V242 C245 | I225-M229 HydrophobicContact CG2-CG 4.32Å; I225-M229 HydrophobicContact CG2-SD 4.11Å; I225-M229 WeakPolarHBondContact O-CG 3.42Å; I225-M229 PolarHBondContact O-N 3.04Å; K226-M229 PolarHBondContact O-N 3.23Å; M229-M231 PolarHBondContact O-N 3.48Å; M229-D232 WeakPolarHBondContact O-CB 3.35Å; M229-D232 PolarHBondContact O-N 2.97Å; M229-V242 HydrophobicContact CE-CG2 3.96Å; M229-V242 VanDerWaalsContact SD-CA 3.5Å; M229-V242 HydrophobicContact SD-CB 3.98Å; M229-V242 HydrophobicContact SD-CG1 4.46Å; M229-V242 HydrophobicContact SD-CG2 3.55Å; M229-V242 VanDerWaalsContact SD-CG2 3.55Å; M229-C245 HydrophobicContact CG-CB 4.01Å |
| 230 | Q | 54.5 | Low | 59.8 | Low | 76 Ų | 76 | 72.8 Ų | 72.8 | 36% | 0.355 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -66.1 | -30.7 | 176 | -74.3 | -177.2 | -20.7 | 0 | 0 | 111.8 | K226 | K226-Q230 VanDerWaalsContact CE-NE2 3.32Å; K226-Q230 HydrophobicContact CG-CG 4.38Å; K226-Q230 WeakPolarHBondContact O-CB 3.1Å; K226-Q230 WeakPolarHBondContact O-CG 3.21Å; K226-Q230 PolarHBondContact O-N 3.1Å |
| 231 | M | 52.3 | Low | 59.6 | Low | 45 Ų | 45 | 73.8 Ų | 73.8 | 22% | 0.222 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -77.1 | -28.2 | 176.3 | -74.9 | -55.8 | -57 | 0 | 0 | 114.7 | T32 S227 R228 M229 G233 L234 | T32-M231 VanDerWaalsContact CA-SD 3.57Å; T32-M231 WeakPolarHBondContact CB-SD 3.38Å; T32-M231 HydrophobicContact CG2-CG 3.78Å; T32-M231 HydrophobicContact CG2-SD 3.33Å; T32-M231 WeakPolarHBondContact CG2-SD 3.16Å; T32-M231 WeakPolarHBondContact O-CE 3.33Å; S227-M231 VanDerWaalsContact O-CG 3.28Å; S227-M231 WeakPolarHBondContact O-CG 3.35Å; S227-M231 PolarHBondContact O-N 3.31Å; S227-M231 VanDerWaalsContact O-N 3.16Å; R228-M231 PolarHBondContact O-N 2.76Å; M229-M231 PolarHBondContact O-N 3.48Å; M231-G233 PolarHBondContact O-N 2.85Å; M231-L234 HydrophobicContact CE-CD1 3.9Å; M231-L234 PolarHBondContact O-N 3.45Å; M231-L234 HydrophobicContact SD-CD1 3.85Å |
| 232 | D | 50.1 | Low | 59.6 | Low | 22 Ų | 22 | 73.4 Ų | 73.4 | 12% | 0.118 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62 | -27.4 | 179.2 | -161.4 | 47.3 | 0 | 0 | 0 | 112.8 | R228 M229 L234 R236 R237 V238 Y239 | R228-D232 PolarHBondContact O-N 3.08Å; R228-D232 VanDerWaalsContact O-N 3.11Å; M229-D232 WeakPolarHBondContact O-CB 3.35Å; M229-D232 PolarHBondContact O-N 2.97Å; D232-L234 PolarHBondContact O-N 3.38Å; D232-R236 CarbonylContact O-C 3.31Å; D232-R236 VanDerWaalsContact O-C 3.31Å; D232-R237 WeakPolarHBondContact OD2-CA 3.29Å; D232-V238 WeakPolarHBondContact OD1-CA 3.39Å; D232-V238 WeakPolarHBondContact OD1-CB 3.25Å; D232-V238 WeakPolarHBondContact OD1-CG2 3.18Å; D232-V238 PolarHBondContact OD1-N 2.63Å; D232-V238 PolarHBondContact OD2-N 2.91Å; D232-Y239 HydrophobicContact CB-CD2 3.86Å; D232-Y239 HydrophobicContact CB-CE2 4.46Å; D232-Y239 VanDerWaalsContact CG-CD2 3.46Å; D232-Y239 PolarHBondContact OD2-N 3.48Å |
| 233 | G | 48.5 | Very low | 59.5 | Low | 63 Ų | 63 | 78.1 Ų | 78.1 | 65% | 0.649 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -18 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | M231 | M231-G233 PolarHBondContact O-N 2.85Š|
| 234 | L | 47.9 | Very low | 59.7 | Low | 103 Ų | 103 | 80.8 Ų | 80.8 | 54% | 0.539 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | -19.5 | -169.7 | -73.4 | 158.1 | 0 | 0 | 0 | 115 | N129 M231 D232 | N129-L234 WeakPolarHBondContact ND2-CD1 3.48Å; M231-L234 HydrophobicContact CE-CD1 3.9Å; M231-L234 PolarHBondContact O-N 3.45Å; M231-L234 HydrophobicContact SD-CD1 3.85Å; D232-L234 PolarHBondContact O-N 3.38Å |
| 235 | R | 44.7 | Very low | 59.9 | Low | 208 Ų | 208 | 80 Ų | 80 | 79% | 0.785 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -123.8 | -37.2 | -174.8 | -76.3 | -178.5 | 173.1 | 171.1 | -1.7 | 113.8 | ||
| 236 | R | 50.9 | Low | 60 | Low | 211 Ų | 211 | 83.6 Ų | 83.6 | 80% | 0.796 | 41% | 0.405 | S | S | * | . | trans | 174.1 | 144.3 | 173.8 | -114 | 171 | 169.8 | 169 | -3.3 | 107 | D232 V238 | D232-R236 CarbonylContact O-C 3.31Å; D232-R236 VanDerWaalsContact O-C 3.31Å; R236-V238 PolarHBondContact O-N 3.43Å | ||
| 237 | R | 54.2 | Low | 60.3 | Low | 209 Ų | 209 | 89.4 Ų | 89.4 | 79% | 0.789 | 43% | 0.434 | S | S | * | . | trans | -65.4 | 98.2 | 172.5 | -69.2 | -171.8 | -168 | -174.2 | 4.3 | 109.9 | D232 | D232-R237 WeakPolarHBondContact OD2-CA 3.29Š| ||
| 238 | V | 58.4 | Low | 60.9 | Low | 99 Ų | 99 | 89.8 Ų | 89.8 | 60% | 0.6 | 44% | 0.437 | S | S | * | . | trans | -88.9 | -26.7 | 172.2 | -174.3 | 0 | 0 | 0 | 0 | 110.6 | D232 R236 | D232-V238 WeakPolarHBondContact OD1-CA 3.39Å; D232-V238 WeakPolarHBondContact OD1-CB 3.25Å; D232-V238 WeakPolarHBondContact OD1-CG2 3.18Å; D232-V238 PolarHBondContact OD1-N 2.63Å; D232-V238 PolarHBondContact OD2-N 2.91Å; R236-V238 PolarHBondContact O-N 3.43Å | ||
| 239 | Y | 60.1 | Low | 61.2 | Low | 45 Ų | 45 | 87.2 Ų | 87.2 | 18% | 0.176 | 43% | 0.427 | C | S | . | . | trans | -112.6 | 128.9 | -177.1 | -54.6 | -69.1 | 0 | 0 | 0 | 112.1 | D232 C245 | D232-Y239 HydrophobicContact CB-CD2 3.86Å; D232-Y239 HydrophobicContact CB-CE2 4.46Å; D232-Y239 VanDerWaalsContact CG-CD2 3.46Å; D232-Y239 PolarHBondContact OD2-N 3.48Å; Y239-C245 VanDerWaalsContact CD1-CA 3.47Å; Y239-C245 HydrophobicContact CD1-CB 3.8Å; Y239-C245 HydrophobicContact CD2-CB 4.4Å; Y239-C245 HydrophobicContact CE1-CB 4.32Å; Y239-C245 HydrophobicContact CG-CB 3.84Å | ||
| 240 | Q | 60.2 | Low | 61.9 | Low | 193 Ų | 193 | 87.2 Ų | 87.2 | 90% | 0.902 | 43% | 0.43 | S | S | * | . | S | Bend | trans | -82.5 | -14.8 | 176.6 | -65.8 | -159.7 | -9.2 | 0 | 0 | 113.3 | D244 | Q240-D244 PolarHBondContact N-OD2 2.91Š|
| 241 | G | 66.8 | Low | 62.9 | Low | 23 Ų | 23 | 94.5 Ų | 94.5 | 24% | 0.237 | 45% | 0.454 | C | S | . | . | S | Bend | trans | -176.8 | -179.2 | 178 | 0 | 0 | 0 | 0 | 0 | 114.2 | L243 D244 C245 | G241-L243 VanDerWaalsContact C-N 3.32Å; G241-L243 PolarHBondContact O-N 3.05Å; G241-D244 PolarHBondContact O-N 3.47Å; G241-C245 WeakPolarHBondContact O-CB 3.47Å; G241-C245 PolarHBondContact O-N 3.45Å |
| 242 | V | 66.9 | Low | 64.1 | Low | 26 Ų | 26 | 98.6 Ų | 98.6 | 16% | 0.158 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -59.4 | -43.7 | 179.9 | -176 | 0 | 0 | 0 | 0 | 111.3 | L172 I225 M229 C245 M246 | L172-V242 HydrophobicContact CD2-CG1 3.86Å; I225-V242 HydrophobicContact CG2-CG1 3.72Å; M229-V242 HydrophobicContact CE-CG2 3.96Å; M229-V242 VanDerWaalsContact SD-CA 3.5Å; M229-V242 HydrophobicContact SD-CB 3.98Å; M229-V242 HydrophobicContact SD-CG1 4.46Å; M229-V242 HydrophobicContact SD-CG2 3.55Å; M229-V242 VanDerWaalsContact SD-CG2 3.55Å; V242-C245 PolarHBondContact O-N 3.42Å; V242-M246 WeakPolarHBondContact O-CB 3.14Å; V242-M246 PolarHBondContact O-N 3.36Å |
| 243 | L | 69.9 | Low | 65 | Low | 137 Ų | 137 | 101.7 Ų | 101.7 | 72% | 0.717 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -68.6 | -38.5 | -178.2 | -65.3 | 175 | 0 | 0 | 0 | 112.4 | G241 M246 M247 | G241-L243 VanDerWaalsContact C-N 3.32Å; G241-L243 PolarHBondContact O-N 3.05Å; L243-M246 PolarHBondContact O-N 2.98Å; L243-M247 WeakPolarHBondContact O-CB 3.15Å; L243-M247 PolarHBondContact O-N 3.16Å |
| 244 | D | 74.8 | Confident | 66.3 | Low | 70 Ų | 70 | 100 Ų | 100 | 37% | 0.374 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -67.6 | -43.8 | 177.5 | -173.2 | 29.9 | 0 | 0 | 0 | 111 | Q240 G241 M246 M247 S248 | Q240-D244 PolarHBondContact N-OD2 2.91Å; G241-D244 PolarHBondContact O-N 3.47Å; D244-M246 PolarHBondContact O-N 3.07Å; D244-M247 PolarHBondContact O-N 2.97Å; D244-S248 WeakPolarHBondContact O-CB 3.35Å; D244-S248 PolarHBondContact O-N 3.41Å |
| 245 | C | 69.5 | Low | 67.4 | Low | 0 Ų | 0 | 101 Ų | 101 | 0% | 0 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -60.2 | -43.4 | 171.7 | -177.4 | 0 | 0 | 0 | 0 | 112.2 | I225 M229 Y239 G241 V242 S249 | I225-C245 HydrophobicContact CG2-CB 4.31Å; M229-C245 HydrophobicContact CG-CB 4.01Å; Y239-C245 VanDerWaalsContact CD1-CA 3.47Å; Y239-C245 HydrophobicContact CD1-CB 3.8Å; Y239-C245 HydrophobicContact CD2-CB 4.4Å; Y239-C245 HydrophobicContact CE1-CB 4.32Å; Y239-C245 HydrophobicContact CG-CB 3.84Å; G241-C245 WeakPolarHBondContact O-CB 3.47Å; G241-C245 PolarHBondContact O-N 3.45Å; V242-C245 PolarHBondContact O-N 3.42Å; C245-S249 WeakPolarHBondContact O-CB 3.1Å; C245-S249 PolarHBondContact O-N 2.67Å; C245-S249 PolarHBondContact O-OG 2.89Å |
| 246 | M | 70.4 | Confident | 68.3 | Low | 80 Ų | 80 | 93.4 Ų | 93.4 | 39% | 0.394 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63.5 | -50.4 | 178.6 | -173.8 | 178.3 | -176 | 0 | 0 | 111.4 | I225 V242 L243 D244 S249 V250 F258 | I225-M246 HydrophobicContact CD1-CB 3.99Å; I225-M246 HydrophobicContact CD1-CG 3.92Å; I225-M246 HydrophobicContact CD1-SD 4.17Å; V242-M246 WeakPolarHBondContact O-CB 3.14Å; V242-M246 PolarHBondContact O-N 3.36Å; L243-M246 PolarHBondContact O-N 2.98Å; D244-M246 PolarHBondContact O-N 3.07Å; M246-S249 PolarHBondContact O-N 2.88Å; M246-V250 VanDerWaalsContact O-CG2 3.24Å; M246-V250 WeakPolarHBondContact O-CG2 3.45Å; M246-V250 PolarHBondContact O-N 3.41Å; M246-F258 HydrophobicContact CG-CE1 4.44Å; M246-F258 HydrophobicContact CG-CZ 4.04Å |
| 247 | M | 75.9 | Confident | 69.1 | Low | 139 Ų | 139 | 83.7 Ų | 83.7 | 69% | 0.685 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -66.8 | -41.2 | -177.5 | -163.7 | 178 | -68 | 0 | 0 | 111.7 | L243 D244 V250 R251 | L243-M247 WeakPolarHBondContact O-CB 3.15Å; L243-M247 PolarHBondContact O-N 3.16Å; D244-M247 PolarHBondContact O-N 2.97Å; M247-V250 PolarHBondContact O-N 3.44Å; M247-R251 WeakPolarHBondContact O-CB 3.19Å; M247-R251 PolarHBondContact O-N 3.42Å |
| 248 | S | 73.8 | Confident | 69.6 | Low | 29 Ų | 29 | 74.3 Ų | 74.3 | 20% | 0.203 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -63.7 | -42.2 | 174.6 | -170.4 | 0 | 0 | 0 | 0 | 111.7 | D244 R251 Q252 | D244-S248 WeakPolarHBondContact O-CB 3.35Å; D244-S248 PolarHBondContact O-N 3.41Å; S248-R251 PolarHBondContact O-N 2.91Å; S248-Q252 WeakPolarHBondContact O-CB 3.46Å; S248-Q252 VanDerWaalsContact O-CG 3.31Å; S248-Q252 WeakPolarHBondContact O-CG 3.31Å; S248-Q252 PolarHBondContact O-N 3.28Å; S248-Q252 PolarHBondContact OG-NE2 2.82Å |
| 249 | S | 71.2 | Confident | 70 | Confident | 0 Ų | 0 | 75.3 Ų | 75.3 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -65.6 | -41.5 | 177.7 | -62.1 | 0 | 0 | 0 | 0 | 112.6 | R228 C245 M246 R251 E253 | R228-S249 WeakPolarHBondContact CD-OG 3.43Å; R228-S249 PolarHBondContact NH1-OG 3.31Å; C245-S249 WeakPolarHBondContact O-CB 3.1Å; C245-S249 PolarHBondContact O-N 2.67Å; C245-S249 PolarHBondContact O-OG 2.89Å; M246-S249 PolarHBondContact O-N 2.88Å; S249-R251 VanDerWaalsContact C-N 3.33Å; S249-R251 PolarHBondContact O-N 3.39Å; S249-E253 PolarHBondContact O-N 3.39Å; S249-E253 VanDerWaalsContact O-N 3.08Å |
| 250 | V | 79.1 | Confident | 70 | Confident | 54 Ų | 54 | 82.2 Ų | 82.2 | 33% | 0.327 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 173.9 | 174.3 | 0 | 0 | 0 | 0 | 110.5 | M246 M247 G254 L255 F258 | M246-V250 VanDerWaalsContact O-CG2 3.24Å; M246-V250 WeakPolarHBondContact O-CG2 3.45Å; M246-V250 PolarHBondContact O-N 3.41Å; M247-V250 PolarHBondContact O-N 3.44Å; V250-G254 WeakPolarHBondContact O-CA 3.38Å; V250-G254 PolarHBondContact O-N 2.9Å; V250-L255 HydrophobicContact CG1-CD2 4.34Å; V250-L255 HydrophobicContact CG2-CD2 4.37Å; V250-F258 HydrophobicContact CG2-CE2 3.52Å; V250-F258 HydrophobicContact CG2-CZ 3.81Å |
| 251 | R | 76.3 | Confident | 70 | Confident | 228 Ų | 228 | 73.2 Ų | 73.2 | 86% | 0.86 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -71.2 | -33.8 | -175.6 | -168.6 | 175.6 | -179.3 | -177.5 | 0.4 | 113.1 | M247 S248 S249 | M247-R251 WeakPolarHBondContact O-CB 3.19Å; M247-R251 PolarHBondContact O-N 3.42Å; S248-R251 PolarHBondContact O-N 2.91Å; S249-R251 VanDerWaalsContact C-N 3.33Å; S249-R251 PolarHBondContact O-N 3.39Å |
| 252 | Q | 76.4 | Confident | 70 | Confident | 132 Ų | 132 | 73.5 Ų | 73.5 | 62% | 0.617 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -87.1 | -37.7 | -176.4 | -69.8 | 179.8 | 11.5 | 0 | 0 | 113.6 | S248 | S248-Q252 WeakPolarHBondContact O-CB 3.46Å; S248-Q252 VanDerWaalsContact O-CG 3.31Å; S248-Q252 WeakPolarHBondContact O-CG 3.31Å; S248-Q252 PolarHBondContact O-N 3.28Å; S248-Q252 PolarHBondContact OG-NE2 2.82Å |
| 253 | E | 68.4 | Low | 69.8 | Low | 87 Ų | 87 | 77.7 Ų | 77.7 | 41% | 0.407 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -129.5 | -3.4 | -168.9 | -70.8 | 174.6 | -120.2 | 0 | 0 | 113.3 | R228 S249 V257 | R228-E253 IonicContact CZ-OE1 3.49Å; R228-E253 VanDerWaalsContact CZ-OE1 3.25Å; R228-E253 IonicContact CZ-OE2 2.92Å; R228-E253 IonicContact NH1-OE1 3.87Å; R228-E253 PolarHBondContact NH1-OE1 2.84Å; R228-E253 IonicContact NH2-OE1 3.83Å; R228-E253 PolarHBondContact NH2-OE1 3.36Å; R228-E253 IonicContact NH2-OE2 3.78Å; R228-E253 PolarHBondContact NH2-OE2 2.92Å; S249-E253 PolarHBondContact O-N 3.39Å; S249-E253 VanDerWaalsContact O-N 3.08Å; E253-V257 HydrophobicContact CB-CG2 3.14Å; E253-V257 HydrophobicContact CG-CG2 4.18Å; E253-V257 WeakPolarHBondContact OE2-CG2 3.45Å |
| 254 | G | 76.3 | Confident | 69.4 | Low | 28 Ų | 28 | 73.1 Ų | 73.1 | 29% | 0.289 | 37% | 0.37 | S | S | . | . | trans | 79.8 | -178.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | V250 G256 V257 | V250-G254 WeakPolarHBondContact O-CA 3.38Å; V250-G254 PolarHBondContact O-N 2.9Å; G254-G256 VanDerWaalsContact C-N 3.3Å; G254-G256 PolarHBondContact O-N 3.3Å; G254-V257 WeakPolarHBondContact O-CG2 3.48Å | ||
| 255 | L | 71.4 | Confident | 68.9 | Low | 122 Ų | 122 | 70 Ų | 70 | 64% | 0.639 | 35% | 0.353 | S | S | * | . | G | 310 helix | trans | -70 | -22.5 | -177.5 | -67.9 | 172 | 0 | 0 | 0 | 113.7 | V250 V257 F258 | V250-L255 HydrophobicContact CG1-CD2 4.34Å; V250-L255 HydrophobicContact CG2-CD2 4.37Å; L255-V257 PolarHBondContact O-N 2.91Å; L255-V257 VanDerWaalsContact O-N 3.15Å; L255-F258 PolarHBondContact O-N 2.89Å |
| 256 | G | 63.3 | Low | 68.7 | Low | 50 Ų | 50 | 72.6 Ų | 72.6 | 52% | 0.515 | 37% | 0.372 | S | S | . | . | G | 310 helix | trans | -64.2 | -18.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | G254 F258 F259 R260 | G254-G256 VanDerWaalsContact C-N 3.3Å; G254-G256 PolarHBondContact O-N 3.3Å; G256-F258 VanDerWaalsContact C-N 3.32Å; G256-F258 PolarHBondContact O-N 2.94Å; G256-F259 PolarHBondContact O-N 3.47Å; G256-R260 PolarHBondContact O-N 3.35Å |
| 257 | V | 67.1 | Low | 68.4 | Low | 6 Ų | 6 | 71.8 Ų | 71.8 | 4% | 0.036 | 38% | 0.377 | C | S | . | . | G | 310 helix | trans | -62.9 | -37.6 | 178.2 | 174.8 | 0 | 0 | 0 | 0 | 112.6 | V224 R228 E253 G254 L255 F259 R260 | V224-V257 HydrophobicContact CG1-CG1 3.98Å; R228-V257 VanDerWaalsContact NH2-CG1 3.3Å; E253-V257 HydrophobicContact CB-CG2 3.14Å; E253-V257 HydrophobicContact CG-CG2 4.18Å; E253-V257 WeakPolarHBondContact OE2-CG2 3.45Å; G254-V257 WeakPolarHBondContact O-CG2 3.48Å; L255-V257 PolarHBondContact O-N 2.91Å; L255-V257 VanDerWaalsContact O-N 3.15Å; V257-F259 PolarHBondContact O-N 3.47Å; V257-R260 PolarHBondContact O-N 3.04Å |
| 258 | F | 65.9 | Low | 68 | Low | 12 Ų | 12 | 66.8 Ų | 66.8 | 5% | 0.053 | 35% | 0.351 | C | S | . | . | G | 310 helix | trans | -71.5 | -20.5 | -179.6 | -61.7 | -68.4 | 0 | 0 | 0 | 112.5 | T220 P221 I225 M246 V250 L255 G256 | T220-F258 VanDerWaalsContact CG2-O 3.22Å; T220-F258 WeakPolarHBondContact CG2-O 3.03Å; P221-F258 HydrophobicContact CB-CB 3.89Å; P221-F258 HydrophobicContact CB-CD1 3.72Å; P221-F258 HydrophobicContact CB-CG 4.04Å; I225-F258 HydrophobicContact CD1-CE1 3.91Å; I225-F258 HydrophobicContact CG1-CE1 3.81Å; M246-F258 HydrophobicContact CG-CE1 4.44Å; M246-F258 HydrophobicContact CG-CZ 4.04Å; V250-F258 HydrophobicContact CG2-CE2 3.52Å; V250-F258 HydrophobicContact CG2-CZ 3.81Å; L255-F258 PolarHBondContact O-N 2.89Å; G256-F258 VanDerWaalsContact C-N 3.32Å; G256-F258 PolarHBondContact O-N 2.94Å |
| 259 | F | 65.6 | Low | 67.5 | Low | 120 Ų | 120 | 66.3 Ų | 66.3 | 53% | 0.526 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.2 | -10.9 | 179.7 | -65.5 | -80.8 | 0 | 0 | 0 | 113.5 | G256 V257 G261 V262 | G256-F259 PolarHBondContact O-N 3.47Å; V257-F259 PolarHBondContact O-N 3.47Å; F259-G261 PolarHBondContact O-N 3.5Å; F259-V262 HydrophobicContact CD1-CG2 4.06Å; F259-V262 PolarHBondContact O-N 3.27Å |
| 260 | R | 61.8 | Low | 67.2 | Low | 191 Ų | 191 | 74.3 Ų | 74.3 | 72% | 0.721 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.1 | -13.8 | -179.6 | -113.7 | 178.5 | 171.3 | 167.8 | -2.1 | 114.4 | G256 V257 | G256-R260 PolarHBondContact O-N 3.35Å; V257-R260 PolarHBondContact O-N 3.04Å |
| 261 | G | 59.7 | Low | 66.7 | Low | 4 Ų | 4 | 74.3 Ų | 74.3 | 4% | 0.041 | 39% | 0.385 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100.3 | -13.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | F259 T263 I264 N265 | F259-G261 PolarHBondContact O-N 3.5Å; G261-T263 PolarHBondContact O-N 3.35Å; G261-I264 PolarHBondContact O-N 2.68Å; G261-N265 WeakPolarHBondContact O-CB 3.36Å; G261-N265 PolarHBondContact O-N 3.38Å |
| 262 | V | 65.3 | Low | 66.2 | Low | 29 Ų | 29 | 64.5 Ų | 64.5 | 18% | 0.176 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.3 | -47 | -173 | 175.7 | 0 | 0 | 0 | 0 | 110.5 | V217 T220 F259 I264 N265 S266 | V217-V262 HydrophobicContact CG2-CG1 4.37Å; T220-V262 HydrophobicContact CG2-CG2 3.83Å; F259-V262 HydrophobicContact CD1-CG2 4.06Å; F259-V262 PolarHBondContact O-N 3.27Å; V262-I264 VanDerWaalsContact C-N 3.29Å; V262-I264 PolarHBondContact O-N 3.02Å; V262-N265 PolarHBondContact O-N 2.93Å; V262-S266 WeakPolarHBondContact O-CB 3.26Å; V262-S266 PolarHBondContact O-N 3.41Å; V262-S266 PolarHBondContact O-OG 3.15Å; V262-S266 VanDerWaalsContact O-OG 3.05Å |
| 263 | T | 63.2 | Low | 65.7 | Low | 113 Ų | 113 | 61.8 Ų | 61.8 | 69% | 0.693 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -60 | -38.5 | 179.5 | -45.8 | 0 | 0 | 0 | 0 | 112.5 | G261 A267 | G261-T263 PolarHBondContact O-N 3.35Å; T263-A267 VanDerWaalsContact O-CB 3.24Å; T263-A267 WeakPolarHBondContact O-CB 3.21Å; T263-A267 PolarHBondContact O-N 2.67Å |
| 264 | I | 62.5 | Low | 65.6 | Low | 42 Ų | 42 | 59.7 Ų | 59.7 | 22% | 0.215 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -70.9 | -44.1 | 178.4 | -61.4 | 174.8 | 0 | 0 | 0 | 110.3 | I39 G261 V262 A267 R268 | I39-I264 HydrophobicContact CD1-CD1 3.79Å; I39-I264 HydrophobicContact CD1-CG1 3.93Å; I39-I264 HydrophobicContact CG1-CD1 4.41Å; G261-I264 PolarHBondContact O-N 2.68Å; V262-I264 VanDerWaalsContact C-N 3.29Å; V262-I264 PolarHBondContact O-N 3.02Å; I264-A267 PolarHBondContact O-N 3.3Å; I264-R268 WeakPolarHBondContact O-CB 3.34Å; I264-R268 PolarHBondContact O-N 2.85Å |
| 265 | N | 64.8 | Low | 65.3 | Low | 3 Ų | 3 | 60.5 Ų | 60.5 | 2% | 0.016 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -62.9 | -41.6 | 176.4 | -74.3 | -18.7 | 0 | 0 | 0 | 111.2 | K27 W216 T220 G261 V262 R268 A269 | K27-N265 PolarHBondContact NZ-OD1 2.98Å; W216-N265 HydrophobicContact CE3-CB 3.98Å; W216-N265 HydrophobicContact CZ3-CB 4.41Å; T220-N265 PolarHBondContact OG1-ND2 3.02Å; G261-N265 WeakPolarHBondContact O-CB 3.36Å; G261-N265 PolarHBondContact O-N 3.38Å; V262-N265 PolarHBondContact O-N 2.93Å; N265-R268 PolarHBondContact O-N 3.49Å; N265-A269 WeakPolarHBondContact O-CB 3.29Å; N265-A269 PolarHBondContact O-N 2.95Å |
| 266 | S | 63.5 | Low | 65 | Low | 56 Ų | 56 | 56.5 Ų | 56.5 | 39% | 0.392 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -66.8 | -43.3 | 176.4 | -62.2 | 0 | 0 | 0 | 0 | 112.3 | V262 R268 A269 F270 | V262-S266 WeakPolarHBondContact O-CB 3.26Å; V262-S266 PolarHBondContact O-N 3.41Å; V262-S266 PolarHBondContact O-OG 3.15Å; V262-S266 VanDerWaalsContact O-OG 3.05Å; S266-R268 VanDerWaalsContact C-N 3.26Å; S266-R268 PolarHBondContact O-N 3.33Å; S266-A269 PolarHBondContact O-N 3.32Å; S266-F270 PolarHBondContact O-N 2.91Å |
| 267 | A | 65.6 | Low | 65.2 | Low | 62 Ų | 62 | 58.5 Ų | 58.5 | 51% | 0.512 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.2 | -32.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | T263 I264 P271 | T263-A267 VanDerWaalsContact O-CB 3.24Å; T263-A267 WeakPolarHBondContact O-CB 3.21Å; T263-A267 PolarHBondContact O-N 2.67Å; I264-A267 PolarHBondContact O-N 3.3Å; A267-P271 WeakPolarHBondContact O-CD 3.37Å |
| 268 | R | 66.8 | Low | 65.4 | Low | 34 Ų | 34 | 63.7 Ų | 63.7 | 13% | 0.128 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -73.7 | -40.8 | 171.8 | 176 | -163.1 | 166.4 | 179.6 | 15.1 | 112.5 | F23 D24 I264 N265 S266 F270 P271 V272 | F23-R268 HydrophobicContact CB-CB 4.25Å; F23-R268 HydrophobicContact CB-CG 3.96Å; F23-R268 HydrophobicContact CD2-CG 4.42Å; F23-R268 HydrophobicContact CG-CB 4.34Å; F23-R268 HydrophobicContact CG-CG 4.27Å; D24-R268 VanDerWaalsContact CG-CZ 3.48Å; D24-R268 VanDerWaalsContact CG-NH2 3.28Å; D24-R268 IonicContact OD1-CZ 2.71Å; D24-R268 IonicContact OD1-NE 3.36Å; D24-R268 IonicContact OD1-NH1 2.91Å; D24-R268 PolarHBondContact OD1-NH1 3.45Å; D24-R268 IonicContact OD1-NH2 2.72Å; D24-R268 PolarHBondContact OD1-NH2 2.89Å; D24-R268 IonicContact OD2-CZ 3.14Å; D24-R268 IonicContact OD2-NH1 3.51Å; D24-R268 IonicContact OD2-NH2 3.56Å; D24-R268 PolarHBondContact OD2-NH2 2.83Å; I264-R268 WeakPolarHBondContact O-CB 3.34Å; I264-R268 PolarHBondContact O-N 2.85Å; N265-R268 PolarHBondContact O-N 3.49Å; S266-R268 VanDerWaalsContact C-N 3.26Å; S266-R268 PolarHBondContact O-N 3.33Å; R268-F270 PolarHBondContact O-N 3.41Å; R268-P271 VanDerWaalsContact O-CD 3.31Å; R268-P271 WeakPolarHBondContact O-CD 3.39Å; R268-V272 HydrophobicContact CG-CG2 3.98Å; R268-V272 WeakPolarHBondContact O-CB 3.18Å; R268-V272 VanDerWaalsContact O-CG2 3.28Å; R268-V272 WeakPolarHBondContact O-CG2 3.14Å; R268-V272 PolarHBondContact O-N 2.87Å |
| 269 | A | 63.3 | Low | 65.6 | Low | 20 Ų | 20 | 64 Ų | 64 | 17% | 0.165 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.4 | -35.5 | -174.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | N265 S266 N273 | N265-A269 WeakPolarHBondContact O-CB 3.29Å; N265-A269 PolarHBondContact O-N 2.95Å; S266-A269 PolarHBondContact O-N 3.32Å; A269-N273 WeakPolarHBondContact O-CB 3.25Å; A269-N273 PolarHBondContact O-N 3.1Å; A269-N273 PolarHBondContact O-ND2 2.92Å |
| 270 | F | 65.6 | Low | 65.8 | Low | 168 Ų | 168 | 62.2 Ų | 62.2 | 74% | 0.737 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -65.8 | -54.1 | -176.7 | -164.6 | -84.9 | 0 | 0 | 0 | 113.4 | S266 R268 V272 A274 | S266-F270 PolarHBondContact O-N 2.91Å; R268-F270 PolarHBondContact O-N 3.41Å; F270-V272 PolarHBondContact O-N 2.96Å; F270-A274 VanDerWaalsContact O-CB 3.27Å; F270-A274 WeakPolarHBondContact O-CB 3.36Å; F270-A274 PolarHBondContact O-N 3.26Å |
| 271 | P | 68.6 | Low | 66.1 | Low | 54 Ų | 54 | 57.5 Ų | 57.5 | 35% | 0.351 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 173.9 | -22 | 29.8 | 0 | 0 | 0 | 113.9 | A267 R268 A274 V275 | A267-P271 WeakPolarHBondContact O-CD 3.37Å; R268-P271 VanDerWaalsContact O-CD 3.31Å; R268-P271 WeakPolarHBondContact O-CD 3.39Å; P271-A274 PolarHBondContact O-N 2.87Å; P271-V275 PolarHBondContact O-N 2.72Å; P271-V275 VanDerWaalsContact O-N 3.1Å |
| 272 | V | 65.1 | Low | 66.8 | Low | 22 Ų | 22 | 65.1 Ų | 65.1 | 13% | 0.133 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -65.3 | -46.9 | -176.7 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | G20 R268 F270 T276 | G20-V272 VanDerWaalsContact CA-CG2 3.47Å; R268-V272 HydrophobicContact CG-CG2 3.98Å; R268-V272 WeakPolarHBondContact O-CB 3.18Å; R268-V272 VanDerWaalsContact O-CG2 3.28Å; R268-V272 WeakPolarHBondContact O-CG2 3.14Å; R268-V272 PolarHBondContact O-N 2.87Å; F270-V272 PolarHBondContact O-N 2.96Å; V272-T276 WeakPolarHBondContact O-CB 3.19Å; V272-T276 PolarHBondContact O-N 3.44Å; V272-T276 PolarHBondContact O-OG1 3Å |
| 273 | N | 65.3 | Low | 67.2 | Low | 74 Ų | 74 | 65.1 Ų | 65.1 | 40% | 0.396 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -66.5 | -43.7 | 178.4 | -68.1 | -16.4 | 0 | 0 | 0 | 111.2 | A269 V275 T276 F277 | A269-N273 WeakPolarHBondContact O-CB 3.25Å; A269-N273 PolarHBondContact O-N 3.1Å; A269-N273 PolarHBondContact O-ND2 2.92Å; N273-V275 VanDerWaalsContact C-N 3.34Å; N273-V275 PolarHBondContact O-N 2.76Å; N273-T276 PolarHBondContact O-N 3.34Å; N273-F277 HydrophobicContact CB-CD2 4.44Å; N273-F277 WeakPolarHBondContact O-CD2 3.43Å; N273-F277 PolarHBondContact O-N 3.44Å |
| 274 | A | 66.5 | Low | 67.5 | Low | 43 Ų | 43 | 62.9 Ų | 62.9 | 36% | 0.355 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -55.8 | -47.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | F270 P271 L278 | F270-A274 VanDerWaalsContact O-CB 3.27Å; F270-A274 WeakPolarHBondContact O-CB 3.36Å; F270-A274 PolarHBondContact O-N 3.26Å; P271-A274 PolarHBondContact O-N 2.87Å; A274-L278 WeakPolarHBondContact O-CB 3.41Å; A274-L278 VanDerWaalsContact O-CG 3.25Å; A274-L278 WeakPolarHBondContact O-CG 3.47Å; A274-L278 PolarHBondContact O-N 2.95Å |
| 275 | V | 70.4 | Confident | 68 | Low | 46 Ų | 46 | 70 Ų | 70 | 28% | 0.279 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -74.8 | -34.7 | -180 | 177.3 | 0 | 0 | 0 | 0 | 112.3 | L19 P271 N273 F277 L278 S279 | L19-V275 HydrophobicContact CD1-CB 3.45Å; L19-V275 VanDerWaalsContact CD1-CB 3.45Å; L19-V275 HydrophobicContact CD1-CG1 3.4Å; L19-V275 VanDerWaalsContact CD1-CG1 3.4Å; L19-V275 HydrophobicContact CD1-CG2 3.42Å; L19-V275 VanDerWaalsContact CD1-CG2 3.42Å; P271-V275 PolarHBondContact O-N 2.72Å; P271-V275 VanDerWaalsContact O-N 3.1Å; N273-V275 VanDerWaalsContact C-N 3.34Å; N273-V275 PolarHBondContact O-N 2.76Å; V275-F277 VanDerWaalsContact C-N 3.33Å; V275-F277 PolarHBondContact O-N 3.35Å; V275-L278 PolarHBondContact O-N 3.5Å; V275-S279 WeakPolarHBondContact O-CB 3.49Å; V275-S279 PolarHBondContact O-N 2.89Å; V275-S279 PolarHBondContact O-OG 3.47Å |
| 276 | T | 65.3 | Low | 68.3 | Low | 38 Ų | 38 | 78.4 Ų | 78.4 | 23% | 0.233 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -61.4 | -45.9 | 176.6 | -55.2 | 0 | 0 | 0 | 0 | 110.3 | V272 N273 Y280 | V272-T276 WeakPolarHBondContact O-CB 3.19Å; V272-T276 PolarHBondContact O-N 3.44Å; V272-T276 PolarHBondContact O-OG1 3Å; N273-T276 PolarHBondContact O-N 3.34Å; T276-Y280 VanDerWaalsContact O-CB 3.31Å; T276-Y280 WeakPolarHBondContact O-CB 3.31Å; T276-Y280 PolarHBondContact O-N 2.88Å |
| 277 | F | 66.9 | Low | 68.5 | Low | 91 Ų | 91 | 80.4 Ų | 80.4 | 40% | 0.399 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.4 | -48.2 | 176.9 | -82.6 | -66 | 0 | 0 | 0 | 112.7 | L205 N273 V275 S279 Y280 E281 | L205-F277 HydrophobicContact CD1-CD1 3.51Å; L205-F277 HydrophobicContact CD1-CD2 4.11Å; L205-F277 HydrophobicContact CD1-CE1 3.37Å; L205-F277 HydrophobicContact CD1-CE2 3.99Å; L205-F277 HydrophobicContact CD1-CG 3.9Å; L205-F277 HydrophobicContact CD1-CZ 3.63Å; L205-F277 HydrophobicContact CG-CE1 4.04Å; L205-F277 HydrophobicContact CG-CE2 4.13Å; L205-F277 HydrophobicContact CG-CZ 3.81Å; N273-F277 HydrophobicContact CB-CD2 4.44Å; N273-F277 WeakPolarHBondContact O-CD2 3.43Å; N273-F277 PolarHBondContact O-N 3.44Å; V275-F277 VanDerWaalsContact C-N 3.33Å; V275-F277 PolarHBondContact O-N 3.35Å; F277-S279 VanDerWaalsContact C-N 3.28Å; F277-S279 PolarHBondContact O-N 2.98Å; F277-Y280 PolarHBondContact O-N 3.01Å; F277-E281 PolarHBondContact O-N 3.34Å |
| 278 | L | 71.4 | Confident | 67.8 | Low | 115 Ų | 115 | 83.1 Ų | 83.1 | 60% | 0.602 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -60 | -40.5 | 178.3 | -76.2 | 169.1 | 0 | 0 | 0 | 111.9 | A274 V275 Y282 | A274-L278 WeakPolarHBondContact O-CB 3.41Å; A274-L278 VanDerWaalsContact O-CG 3.25Å; A274-L278 WeakPolarHBondContact O-CG 3.47Å; A274-L278 PolarHBondContact O-N 2.95Å; V275-L278 PolarHBondContact O-N 3.5Å; L278-Y282 WeakPolarHBondContact O-CB 3.25Å; L278-Y282 PolarHBondContact O-N 3.46Å |
| 279 | S | 70.4 | Confident | 67.8 | Low | 19 Ų | 19 | 85.6 Ų | 85.6 | 13% | 0.133 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -68.1 | -41.6 | 178.6 | -54.9 | 0 | 0 | 0 | 0 | 111.4 | L15 V275 F277 Y282 L283 | L15-S279 WeakPolarHBondContact CD1-OG 3.44Å; V275-S279 WeakPolarHBondContact O-CB 3.49Å; V275-S279 PolarHBondContact O-N 2.89Å; V275-S279 PolarHBondContact O-OG 3.47Å; F277-S279 VanDerWaalsContact C-N 3.28Å; F277-S279 PolarHBondContact O-N 2.98Å; S279-Y282 PolarHBondContact O-N 2.8Å; S279-L283 WeakPolarHBondContact O-CB 3.47Å; S279-L283 WeakPolarHBondContact O-CD1 3.22Å; S279-L283 VanDerWaalsContact O-CG 3.23Å; S279-L283 WeakPolarHBondContact O-CG 3.24Å; S279-L283 PolarHBondContact O-N 2.94Å |
| 280 | Y | 69 | Low | 68.1 | Low | 82 Ų | 82 | 89.1 Ų | 89.1 | 32% | 0.322 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.4 | -48.3 | 177.9 | -177.1 | -105.7 | 0 | 0 | 0 | 111.8 | A8 T276 F277 Y282 L283 L284 | A8-Y280 HydrophobicContact CB-CD2 4.24Å; A8-Y280 HydrophobicContact CB-CE2 4.29Å; T276-Y280 VanDerWaalsContact O-CB 3.31Å; T276-Y280 WeakPolarHBondContact O-CB 3.31Å; T276-Y280 PolarHBondContact O-N 2.88Å; F277-Y280 PolarHBondContact O-N 3.01Å; Y280-Y282 VanDerWaalsContact C-N 3.35Å; Y280-Y282 PolarHBondContact O-N 3.02Å; Y280-L283 PolarHBondContact O-N 3.31Å; Y280-L284 HydrophobicContact CD1-CD1 3.63Å; Y280-L284 HydrophobicContact CD2-CD1 4.25Å; Y280-L284 HydrophobicContact CE1-CD1 3.17Å; Y280-L284 HydrophobicContact CE2-CD1 3.85Å; Y280-L284 HydrophobicContact CG-CD1 4.15Å; Y280-L284 WeakPolarHBondContact O-CB 3.24Å; Y280-L284 PolarHBondContact O-N 2.8Å |
| 281 | E | 69.7 | Low | 68.2 | Low | 92 Ų | 92 | 84.7 Ų | 84.7 | 43% | 0.43 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.4 | -40.8 | 176.8 | -76.6 | -167.9 | 173.3 | 0 | 0 | 112.3 | F277 R285 | F277-E281 PolarHBondContact O-N 3.34Å; E281-R285 WeakPolarHBondContact O-CB 3.38Å; E281-R285 VanDerWaalsContact O-CG 3.3Å; E281-R285 WeakPolarHBondContact O-CG 3.13Å; E281-R285 PolarHBondContact O-N 3.01Å; E281-R285 IonicContact OE2-NH2 3.95Å |
| 282 | Y | 74.4 | Confident | 68.2 | Low | 165 Ų | 165 | 86.5 Ų | 86.5 | 65% | 0.647 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.3 | -42.3 | 179.4 | -169.9 | -93.8 | 0 | 0 | 0 | 112 | L278 S279 Y280 R285 W286 | L278-Y282 WeakPolarHBondContact O-CB 3.25Å; L278-Y282 PolarHBondContact O-N 3.46Å; S279-Y282 PolarHBondContact O-N 2.8Å; Y280-Y282 VanDerWaalsContact C-N 3.35Å; Y280-Y282 PolarHBondContact O-N 3.02Å; Y282-R285 PolarHBondContact O-N 2.95Å; Y282-W286 WeakPolarHBondContact O-CB 3.47Å; Y282-W286 PolarHBondContact O-N 2.65Å; Y282-W286 VanDerWaalsContact O-N 3.07Å |
| 283 | L | 71.9 | Confident | 68.4 | Low | 28 Ų | 28 | 90.5 Ų | 90.5 | 15% | 0.147 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -66.3 | -39.5 | 177.7 | -73.9 | 166.5 | 0 | 0 | 0 | 112.3 | A8 I11 S279 Y280 W286 W287 | A8-L283 HydrophobicContact CB-CB 4.05Å; A8-L283 HydrophobicContact CB-CD1 4.4Å; I11-L283 HydrophobicContact CB-CD1 3.81Å; I11-L283 HydrophobicContact CD1-CD1 4.44Å; I11-L283 HydrophobicContact CG2-CD1 3.68Å; S279-L283 WeakPolarHBondContact O-CB 3.47Å; S279-L283 WeakPolarHBondContact O-CD1 3.22Å; S279-L283 VanDerWaalsContact O-CG 3.23Å; S279-L283 WeakPolarHBondContact O-CG 3.24Å; S279-L283 PolarHBondContact O-N 2.94Å; Y280-L283 PolarHBondContact O-N 3.31Å; L283-W286 PolarHBondContact O-N 3.04Å; L283-W287 HydrophobicContact CB-CE3 4.46Å; L283-W287 HydrophobicContact CB-CZ3 4.4Å; L283-W287 HydrophobicContact CD2-CH2 4.42Å; L283-W287 HydrophobicContact CD2-CZ3 4.35Å; L283-W287 PolarHBondContact O-N 3.04Å; L283-W287 VanDerWaalsContact O-N 3.14Å |
| 284 | L | 71.1 | Confident | 68.6 | Low | 66 Ų | 66 | 91.6 Ų | 91.6 | 35% | 0.346 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 174.9 | -89.6 | 156.8 | 0 | 0 | 0 | 112.6 | Y280 W286 W287 G288 | Y280-L284 HydrophobicContact CD1-CD1 3.63Å; Y280-L284 HydrophobicContact CD2-CD1 4.25Å; Y280-L284 HydrophobicContact CE1-CD1 3.17Å; Y280-L284 HydrophobicContact CE2-CD1 3.85Å; Y280-L284 HydrophobicContact CG-CD1 4.15Å; Y280-L284 WeakPolarHBondContact O-CB 3.24Å; Y280-L284 PolarHBondContact O-N 2.8Å; L284-W286 PolarHBondContact O-N 2.94Å; L284-W287 PolarHBondContact O-N 2.74Å; L284-G288 PolarHBondContact O-N 3.3Å |
| 285 | R | 72.8 | Confident | 68.7 | Low | 191 Ų | 191 | 95.1 Ų | 95.1 | 72% | 0.721 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -68.8 | -23.1 | 176.1 | -74.6 | -179.4 | -171.4 | -178.4 | 8.5 | 113.6 | E281 Y282 | E281-R285 WeakPolarHBondContact O-CB 3.38Å; E281-R285 VanDerWaalsContact O-CG 3.3Å; E281-R285 WeakPolarHBondContact O-CG 3.13Å; E281-R285 PolarHBondContact O-N 3.01Å; E281-R285 IonicContact OE2-NH2 3.95Å; Y282-R285 PolarHBondContact O-N 2.95Å |
| 286 | W | 71.6 | Confident | 68.6 | Low | 180 Ų | 180 | 98.8 Ų | 98.8 | 68% | 0.682 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -87.3 | -25.9 | 179.6 | -165.4 | 73.1 | 0 | 0 | 0 | 112.8 | Y282 L283 L284 | Y282-W286 WeakPolarHBondContact O-CB 3.47Å; Y282-W286 PolarHBondContact O-N 2.65Å; Y282-W286 VanDerWaalsContact O-N 3.07Å; L283-W286 PolarHBondContact O-N 3.04Å; L284-W286 PolarHBondContact O-N 2.94Å |
| 287 | W | 66.3 | Low | 68.9 | Low | 98 Ų | 98 | 103.9 Ų | 103.9 | 37% | 0.371 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -100 | -14.5 | 178 | -80.5 | -36.4 | 0 | 0 | 0 | 115.4 | E4 V7 A8 I11 L283 L284 | E4-W287 HydrophobicContact CB-CE3 4.4Å; V7-W287 HydrophobicContact CB-CH2 4.27Å; V7-W287 HydrophobicContact CB-CZ3 4.38Å; V7-W287 HydrophobicContact CG1-CH2 3.6Å; V7-W287 HydrophobicContact CG1-CZ3 4.13Å; A8-W287 HydrophobicContact CB-CE3 4.41Å; A8-W287 HydrophobicContact CB-CZ3 4.01Å; I11-W287 HydrophobicContact CD1-CH2 4.13Å; L283-W287 HydrophobicContact CB-CE3 4.46Å; L283-W287 HydrophobicContact CB-CZ3 4.4Å; L283-W287 HydrophobicContact CD2-CH2 4.42Å; L283-W287 HydrophobicContact CD2-CZ3 4.35Å; L283-W287 PolarHBondContact O-N 3.04Å; L283-W287 VanDerWaalsContact O-N 3.14Å; L284-W287 PolarHBondContact O-N 2.74Å |
| 288 | G | 50.9 | Low | 69 | Low | 120 Ų | 120 | 105.1 Ų | 105.1 | 100% | 1.237 | 51% | 0.512 | S | S | * | . | trans | -88.1 | 0 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L284 | L284-G288 PolarHBondContact O-N 3.3Š|
Retrieved 288 of 288 residues in 80.8 ms
(Link to these results)