| 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 | 33.5 | Very low | 35.4 | Very low | 63 Ų | 63 | 78.4 Ų | 78.4 | 31% | 0.31 | 47% | 0.473 | S | S | . | . | 0 | 77.2 | 0 | -60.3 | -159 | -179.6 | 0 | 0 | 109.6 | F130 L134 F344 I360 | M1-F130 HydrophobicContact CG-CZ 4.33Å; M1-L134 HydrophobicContact CB-CD1 3.86Å; M1-L134 HydrophobicContact CG-CD1 3.55Å; M1-L134 HydrophobicContact SD-CD1 4.3Å; M1-F344 HydrophobicContact CE-CD2 4.09Å; M1-F344 HydrophobicContact CE-CE2 3.94Å; M1-F344 HydrophobicContact CG-CD2 4.48Å; M1-F344 HydrophobicContact CG-CE2 4Å; M1-F344 HydrophobicContact CG-CZ 4.11Å; M1-F344 HydrophobicContact SD-CD2 3.99Å; M1-F344 HydrophobicContact SD-CE2 4.04Å; M1-I360 WeakPolarHBondContact O-CG2 3.16Å | |||
| 2 | G | 27.7 | Very low | 36.6 | Very low | 20 Ų | 20 | 78.4 Ų | 78.4 | 21% | 0.206 | 48% | 0.479 | C | S | . | . | trans | -68 | 142.9 | -170.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | A4 Q131 | G2-A4 PolarHBondContact O-N 3.08Å; G2-Q131 PolarHBondContact O-NE2 2.61Å | ||
| 3 | G | 30.1 | Very low | 38.5 | Very low | 25 Ų | 25 | 75.3 Ų | 75.3 | 26% | 0.258 | 46% | 0.46 | S | S | . | . | trans | -71.2 | 72.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | V5 | G3-V5 PolarHBondContact O-N 3.37Š| ||
| 4 | A | 35.2 | Very low | 40.9 | Very low | 10 Ų | 10 | 83.4 Ų | 83.4 | 8% | 0.083 | 49% | 0.486 | C | S | . | . | trans | -71 | 119.9 | 147.9 | 0 | 0 | 0 | 0 | 0 | 106 | G2 V6 I135 | G2-A4 PolarHBondContact O-N 3.08Å; A4-V6 PolarHBondContact O-N 3.23Å; A4-I135 HydrophobicContact CB-CD1 3.17Å; A4-I135 HydrophobicContact CB-CG1 3.66Å | ||
| 5 | V | 38.3 | Very low | 43.5 | Very low | 62 Ų | 62 | 78.6 Ų | 78.6 | 38% | 0.376 | 46% | 0.46 | S | S | . | . | trans | -29.9 | 99 | 168.9 | -176.9 | 0 | 0 | 0 | 0 | 109.1 | G3 D7 | G3-V5 PolarHBondContact O-N 3.37Å; V5-D7 PolarHBondContact O-N 3.47Å | ||
| 6 | V | 40.4 | Very low | 45.8 | Very low | 87 Ų | 87 | 77.7 Ų | 77.7 | 53% | 0.527 | 46% | 0.457 | S | S | . | . | trans | -74 | 108.6 | 160.2 | -178 | 0 | 0 | 0 | 0 | 101.6 | A4 D8 | A4-V6 PolarHBondContact O-N 3.23Å; V6-D8 PolarHBondContact O-N 2.9Å | ||
| 7 | D | 36.8 | Very low | 47.9 | Very low | 94 Ų | 94 | 74.6 Ų | 74.6 | 50% | 0.503 | 44% | 0.438 | S | S | . | . | trans | -47.1 | 117.4 | 175.2 | -64 | -59.5 | 0 | 0 | 0 | 107.5 | V5 E9 | V5-D7 PolarHBondContact O-N 3.47Å; D7-E9 PolarHBondContact O-N 3.42Å; D7-E9 VanDerWaalsContact O-N 3.12Å | ||
| 8 | D | 34.1 | Very low | 50 | Low | 163 Ų | 163 | 71.2 Ų | 71.2 | 87% | 0.872 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -69.4 | 2.1 | 175.6 | -94.9 | -30.9 | 0 | 0 | 0 | 111.8 | V6 | V6-D8 PolarHBondContact O-N 2.9Š|
| 9 | E | 35.3 | Very low | 52.1 | Low | 162 Ų | 162 | 70.7 Ų | 70.7 | 76% | 0.757 | 43% | 0.433 | S | S | * | . | S | Bend | trans | -89.5 | 135.9 | 168.4 | -71.9 | -172.3 | 162.1 | 0 | 0 | 110.5 | D7 P11 | D7-E9 PolarHBondContact O-N 3.42Å; D7-E9 VanDerWaalsContact O-N 3.12Å; E9-P11 VanDerWaalsContact O-N 3.08Å |
| 10 | A | 35 | Very low | 54.1 | Low | 93 Ų | 93 | 73.9 Ų | 73.9 | 77% | 0.769 | 44% | 0.436 | S | S | * | . | trans | -43.7 | 121.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | S12 | A10-S12 PolarHBondContact O-N 2.94Š| ||
| 11 | P | 43.5 | Very low | 55.8 | Low | 83 Ų | 83 | 70.4 Ų | 70.4 | 54% | 0.539 | 42% | 0.416 | S | S | . | . | trans | -58.4 | 121.7 | -173.1 | 22.5 | -32.5 | 0 | 0 | 0 | 107.9 | E9 V13 | E9-P11 VanDerWaalsContact O-N 3.08Å; P11-V13 WeakPolarHBondContact CB-O 3.32Å; P11-V13 CarbonylContact O-C 3.44Å; P11-V13 PolarHBondContact O-N 2.77Å | ||
| 12 | S | 49.7 | Very low | 58.7 | Low | 79 Ų | 79 | 72.8 Ų | 72.8 | 55% | 0.552 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -55.2 | -13.7 | 178 | 63.7 | 0 | 0 | 0 | 0 | 113.2 | A10 | A10-S12 PolarHBondContact O-N 2.94Š|
| 13 | V | 61.4 | Low | 61.9 | Low | 38 Ų | 38 | 73.2 Ų | 73.2 | 23% | 0.23 | 42% | 0.423 | C | S | . | . | S | Bend | trans | -115.5 | 118.9 | 172.4 | -174.6 | 0 | 0 | 0 | 0 | 109.1 | P11 A15 L200 Q201 | P11-V13 WeakPolarHBondContact CB-O 3.32Å; P11-V13 CarbonylContact O-C 3.44Å; P11-V13 PolarHBondContact O-N 2.77Å; V13-A15 PolarHBondContact O-N 3.33Å; V13-L200 HydrophobicContact CG1-CB 4.33Å; V13-Q201 WeakPolarHBondContact CG2-O 3.38Å |
| 14 | K | 72.3 | Confident | 65 | Low | 189 Ų | 189 | 72 Ų | 72 | 82% | 0.822 | 41% | 0.41 | S | S | * | . | trans | -59.9 | 127.9 | 174.6 | -171.1 | 174.9 | -178.5 | 177.1 | 0 | 109.8 | ||||
| 15 | A | 79.8 | Confident | 67.9 | Low | 11 Ų | 11 | 72.2 Ų | 72.2 | 9% | 0.091 | 41% | 0.41 | C | S | . | . | trans | -59.2 | 132.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | V13 D17 N142 | V13-A15 PolarHBondContact O-N 3.33Å; A15-D17 VanDerWaalsContact C-N 3.3Å; A15-D17 PolarHBondContact O-N 3.37Å; A15-N142 HydrophobicContact CB-CB 3.69Å | ||
| 16 | P | 79.6 | Confident | 70.7 | Confident | 64 Ų | 64 | 71.7 Ų | 71.7 | 42% | 0.416 | 41% | 0.413 | S | S | . | . | trans | -69.6 | -22.3 | -176.2 | 23.8 | -32.9 | 0 | 0 | 0 | 114 | G18 Y140 | P16-G18 PolarHBondContact O-N 2.94Å; P16-Y140 VanDerWaalsContact CD-O 3.28Å; P16-Y140 WeakPolarHBondContact CD-O 3.45Å; P16-Y140 HydrophobicContact CG-CD1 3.64Å; P16-Y140 HydrophobicContact CG-CE1 4.14Å; P16-Y140 HydrophobicContact CG-CG 4.41Å | ||
| 17 | D | 82.1 | Confident | 73.4 | Confident | 26 Ų | 26 | 67.6 Ų | 67.6 | 14% | 0.139 | 39% | 0.388 | C | S | . | . | S | Bend | trans | 49.3 | 29.6 | 178.7 | -83.1 | -54.6 | 0 | 0 | 0 | 114 | A15 Y140 F141 N142 L143 K144 | A15-D17 VanDerWaalsContact C-N 3.3Å; A15-D17 PolarHBondContact O-N 3.37Å; D17-Y140 PolarHBondContact N-O 3.25Å; D17-F141 VanDerWaalsContact OD1-CA 3.32Å; D17-F141 WeakPolarHBondContact OD1-CA 3.41Å; D17-N142 PolarHBondContact OD1-N 3.39Å; D17-N142 PolarHBondContact OD2-N 3.23Å; D17-L143 PolarHBondContact OD1-N 3.49Å; D17-L143 VanDerWaalsContact OD1-N 3.14Å; D17-L143 PolarHBondContact OD2-N 2.91Å; D17-L143 VanDerWaalsContact OD2-N 3.09Å; D17-K144 PolarHBondContact O-NZ 3.02Å; D17-K144 PolarHBondContact OD1-N 3.29Å; D17-K144 VanDerWaalsContact OD1-N 3.17Å |
| 18 | G | 85 | Confident | 76.2 | Confident | 12 Ų | 12 | 63.1 Ų | 63.1 | 12% | 0.124 | 36% | 0.364 | C | S | . | . | S | Bend | trans | 166.2 | -163.5 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | P16 W20 G21 | P16-G18 PolarHBondContact O-N 2.94Å; G18-W20 PolarHBondContact O-N 3.18Å; G18-G21 PolarHBondContact O-N 2.79Å |
| 19 | G | 90 | Very high | 79.2 | Confident | 63 Ų | 63 | 58.1 Ų | 58.1 | 65% | 0.649 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.4 | -125.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | G21 W22 | G19-G21 PolarHBondContact O-N 3.27Å; G19-G21 VanDerWaalsContact O-N 3.1Å; G19-W22 PolarHBondContact O-N 2.61Å; G19-W22 VanDerWaalsContact O-N 3.12Å |
| 20 | W | 91.7 | Very high | 82.1 | Confident | 134 Ų | 134 | 52.1 Ų | 52.1 | 51% | 0.508 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61.3 | -17.7 | 177 | -161.6 | -96.3 | 0 | 0 | 0 | 113.5 | G18 W22 A23 V24 Y140 L196 | G18-W20 PolarHBondContact O-N 3.18Å; W20-W22 PolarHBondContact O-N 2.91Å; W20-A23 HydrophobicContact CD2-CB 4.24Å; W20-A23 WeakPolarHBondContact O-CB 3.38Å; W20-A23 PolarHBondContact O-N 2.61Å; W20-A23 VanDerWaalsContact O-N 3.07Å; W20-V24 PolarHBondContact O-N 3.47Å; W20-Y140 HydrophobicContact CB-CE1 4.25Å; W20-L196 HydrophobicContact CZ2-CD2 4.25Å; W20-L196 PolarHBondContact NE1-O 3.09Å |
| 21 | G | 91 | Very high | 85.1 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.1 | -31.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | G18 G19 V24 L25 F141 | G18-G21 PolarHBondContact O-N 2.79Å; G19-G21 PolarHBondContact O-N 3.27Å; G19-G21 VanDerWaalsContact O-N 3.1Å; G21-V24 PolarHBondContact O-N 3.29Å; G21-L25 WeakPolarHBondContact O-CB 3.26Å; G21-L25 PolarHBondContact O-N 3.03Å; G21-F141 VanDerWaalsContact O-CE2 3.29Å; G21-F141 WeakPolarHBondContact O-CE2 3.24Å; G21-F141 WeakPolarHBondContact O-CZ 3.45Å |
| 22 | W | 94.3 | Very high | 87.6 | Confident | 114 Ų | 114 | 44 Ų | 44 | 43% | 0.432 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -70.3 | -35.3 | 175.4 | -65.4 | 116.8 | 0 | 0 | 0 | 112.8 | G19 W20 L25 A26 F141 | G19-W22 PolarHBondContact O-N 2.61Å; G19-W22 VanDerWaalsContact O-N 3.12Å; W20-W22 PolarHBondContact O-N 2.91Å; W22-L25 HydrophobicContact CE3-CD1 4.1Å; W22-L25 HydrophobicContact CZ3-CD1 4.01Å; W22-L25 PolarHBondContact O-N 3.2Å; W22-A26 PolarHBondContact O-N 3.13Å; W22-F141 HydrophobicContact CD2-CZ 4.42Å; W22-F141 HydrophobicContact CE3-CZ 4.34Å |
| 23 | A | 95.4 | Very high | 89.8 | Confident | 28 Ų | 28 | 40.2 Ų | 40.2 | 23% | 0.231 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -67.7 | -40.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | W20 L25 A26 G27 | W20-A23 HydrophobicContact CD2-CB 4.24Å; W20-A23 WeakPolarHBondContact O-CB 3.38Å; W20-A23 PolarHBondContact O-N 2.61Å; W20-A23 VanDerWaalsContact O-N 3.07Å; A23-L25 VanDerWaalsContact C-N 3.35Å; A23-A26 PolarHBondContact O-N 3.12Å; A23-G27 PolarHBondContact O-N 3.05Å |
| 24 | V | 94.7 | Very high | 91.5 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.4 | -44.9 | 172.4 | 170 | 0 | 0 | 0 | 0 | 110.8 | W20 G21 A26 G27 C28 M136 Y140 M197 | W20-V24 PolarHBondContact O-N 3.47Å; G21-V24 PolarHBondContact O-N 3.29Å; V24-A26 PolarHBondContact O-N 2.88Å; V24-G27 PolarHBondContact O-N 3.11Å; V24-C28 PolarHBondContact O-N 2.92Å; V24-C28 PolarHBondContact O-SG 2.94Å; V24-M136 HydrophobicContact CG1-CB 4.3Å; V24-Y140 HydrophobicContact CB-CG 4.47Å; V24-Y140 HydrophobicContact CG1-CD2 4.29Å; V24-Y140 HydrophobicContact CG1-CG 4.45Å; V24-Y140 HydrophobicContact CG2-CD1 4.28Å; V24-Y140 HydrophobicContact CG2-CD2 4.14Å; V24-Y140 HydrophobicContact CG2-CE1 4.1Å; V24-Y140 HydrophobicContact CG2-CE2 3.97Å; V24-Y140 HydrophobicContact CG2-CG 4.27Å; V24-M197 HydrophobicContact CG1-SD 3.82Å |
| 25 | L | 95.4 | Very high | 92.6 | Very high | 14 Ų | 14 | 30 Ų | 30 | 7% | 0.073 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -60.3 | -43.6 | 176.7 | -177.2 | 151.8 | 0 | 0 | 0 | 112 | G21 W22 A23 G27 C28 F29 L137 F141 A148 L151 | G21-L25 WeakPolarHBondContact O-CB 3.26Å; G21-L25 PolarHBondContact O-N 3.03Å; W22-L25 HydrophobicContact CE3-CD1 4.1Å; W22-L25 HydrophobicContact CZ3-CD1 4.01Å; W22-L25 PolarHBondContact O-N 3.2Å; A23-L25 VanDerWaalsContact C-N 3.35Å; L25-G27 VanDerWaalsContact C-N 3.33Å; L25-G27 PolarHBondContact O-N 3.42Å; L25-C28 PolarHBondContact O-N 3.46Å; L25-F29 WeakPolarHBondContact O-CB 3.27Å; L25-F29 PolarHBondContact O-N 2.95Å; L25-L137 HydrophobicContact CB-CD1 3.96Å; L25-L137 HydrophobicContact CD1-CD1 4.45Å; L25-L137 HydrophobicContact CG-CD1 4.24Å; L25-F141 HydrophobicContact CB-CE2 4.15Å; L25-F141 HydrophobicContact CB-CZ 4.47Å; L25-F141 HydrophobicContact CD1-CE2 4.2Å; L25-F141 HydrophobicContact CD1-CZ 4.25Å; L25-A148 HydrophobicContact CD1-CB 3.92Å; L25-L151 HydrophobicContact CD1-CB 4.25Å; L25-L151 HydrophobicContact CD1-CD2 4.35Å; L25-L151 HydrophobicContact CD2-CB 4.19Å; L25-L151 HydrophobicContact CD2-CD2 4.14Å |
| 26 | A | 96.8 | Very high | 93.2 | Very high | 52 Ų | 52 | 30.9 Ų | 30.9 | 43% | 0.43 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -60.8 | -41.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | W22 A23 V24 F29 V30 | W22-A26 PolarHBondContact O-N 3.13Å; A23-A26 PolarHBondContact O-N 3.12Å; V24-A26 PolarHBondContact O-N 2.88Å; A26-F29 WeakPolarHBondContact O-CB 3.4Å; A26-F29 PolarHBondContact O-N 2.97Å; A26-V30 PolarHBondContact O-N 3.45Å |
| 27 | G | 96.8 | Very high | 94 | Very high | 1 Ų | 1 | 27.8 Ų | 27.8 | 1% | 0.01 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.5 | -41.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | A23 V24 L25 F29 V30 I31 | A23-G27 PolarHBondContact O-N 3.05Å; V24-G27 PolarHBondContact O-N 3.11Å; L25-G27 VanDerWaalsContact C-N 3.33Å; L25-G27 PolarHBondContact O-N 3.42Å; G27-F29 VanDerWaalsContact C-N 3.34Å; G27-V30 PolarHBondContact O-N 3.06Å; G27-I31 WeakPolarHBondContact O-CB 3.22Å; G27-I31 VanDerWaalsContact O-CG1 3.31Å; G27-I31 WeakPolarHBondContact O-CG1 3.5Å; G27-I31 PolarHBondContact O-N 3.27Å |
| 28 | C | 96 | Very high | 94.7 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -65.6 | -36.8 | 176.8 | -62.5 | 0 | 0 | 0 | 0 | 112.1 | V24 L25 I31 T32 S133 L137 S152 | V24-C28 PolarHBondContact O-N 2.92Å; V24-C28 PolarHBondContact O-SG 2.94Å; L25-C28 PolarHBondContact O-N 3.46Å; C28-I31 PolarHBondContact O-N 3.46Å; C28-T32 WeakPolarHBondContact O-CB 3.41Å; C28-T32 PolarHBondContact O-N 3.03Å; C28-T32 PolarHBondContact O-OG1 3.01Å; C28-S133 PolarHBondContact SG-O 3.44Å; C28-L137 HydrophobicContact CB-CD1 4.39Å; C28-L137 HydrophobicContact CB-CD2 4.27Å; C28-S152 VanDerWaalsContact C-OG 3.29Å; C28-S152 VanDerWaalsContact CB-OG 3.28Å; C28-S152 WeakPolarHBondContact CB-OG 3.14Å; C28-S152 PolarHBondContact O-OG 2.95Å |
| 29 | F | 96.9 | Very high | 95.1 | Very high | 58 Ų | 58 | 26.3 Ų | 26.3 | 25% | 0.254 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -58.9 | -49.8 | 174.7 | 179.4 | -86.7 | 0 | 0 | 0 | 111.4 | L25 A26 G27 T32 G33 L151 G155 V158 F159 | L25-F29 WeakPolarHBondContact O-CB 3.27Å; L25-F29 PolarHBondContact O-N 2.95Å; A26-F29 WeakPolarHBondContact O-CB 3.4Å; A26-F29 PolarHBondContact O-N 2.97Å; G27-F29 VanDerWaalsContact C-N 3.34Å; F29-T32 PolarHBondContact O-N 3.33Å; F29-G33 PolarHBondContact O-N 2.93Å; F29-L151 VanDerWaalsContact CD2-O 3.27Å; F29-L151 WeakPolarHBondContact CD2-O 3.42Å; F29-G155 VanDerWaalsContact CE2-N 3.33Å; F29-V158 HydrophobicContact CE1-CG1 4.37Å; F29-V158 HydrophobicContact CZ-CB 3.96Å; F29-V158 HydrophobicContact CZ-CG1 4.03Å; F29-V158 HydrophobicContact CZ-CG2 4.01Å; F29-F159 HydrophobicContact CD1-CE2 4.07Å; F29-F159 HydrophobicContact CE1-CD2 4.26Å; F29-F159 AromaticContact CE1-CE2 3.83Å; F29-F159 HydrophobicContact CE1-CE2 3.83Å |
| 30 | V | 97.6 | Very high | 95.3 | Very high | 36 Ų | 36 | 23.7 Ų | 23.7 | 22% | 0.218 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -64.1 | -45.6 | 179 | 173.8 | 0 | 0 | 0 | 0 | 111.4 | A26 G27 G33 F34 F159 | A26-V30 PolarHBondContact O-N 3.45Å; G27-V30 PolarHBondContact O-N 3.06Å; V30-G33 WeakPolarHBondContact O-CA 3.44Å; V30-G33 PolarHBondContact O-N 2.62Å; V30-F34 HydrophobicContact CG1-CD2 3.76Å; V30-F34 HydrophobicContact CG1-CE2 3.69Å; V30-F34 WeakPolarHBondContact O-CD2 3.38Å; V30-F34 PolarHBondContact O-N 2.92Å; V30-F159 HydrophobicContact CB-CZ 4.09Å; V30-F159 HydrophobicContact CG1-CE1 4.21Å; V30-F159 HydrophobicContact CG1-CZ 3.84Å; V30-F159 HydrophobicContact CG2-CE2 4.47Å; V30-F159 HydrophobicContact CG2-CZ 4.04Å |
| 31 | I | 97.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -63 | -46.9 | 179.2 | -73 | 172.8 | 0 | 0 | 0 | 111 | G27 C28 G33 F34 S35 M91 N129 F130 C193 M197 | G27-I31 WeakPolarHBondContact O-CB 3.22Å; G27-I31 VanDerWaalsContact O-CG1 3.31Å; G27-I31 WeakPolarHBondContact O-CG1 3.5Å; G27-I31 PolarHBondContact O-N 3.27Å; C28-I31 PolarHBondContact O-N 3.46Å; I31-G33 PolarHBondContact O-N 2.71Å; I31-F34 PolarHBondContact O-N 3.22Å; I31-S35 WeakPolarHBondContact O-CB 3.49Å; I31-S35 PolarHBondContact O-N 3.36Å; I31-S35 PolarHBondContact O-OG 3.48Å; I31-M91 HydrophobicContact CD1-CE 3.17Å; I31-N129 HydrophobicContact CD1-CB 4.41Å; I31-N129 HydrophobicContact CG1-CB 4.44Å; I31-N129 HydrophobicContact CG2-CB 3.8Å; I31-F130 HydrophobicContact CG2-CB 4.41Å; I31-C193 HydrophobicContact CD1-CB 3.69Å; I31-C193 HydrophobicContact CG1-CB 3.79Å; I31-M197 HydrophobicContact CD1-CE 4.18Å |
| 32 | T | 95.2 | Very high | 95.7 | Very high | 4 Ų | 4 | 17.6 Ų | 17.6 | 3% | 0.025 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.8 | -38.7 | 176.7 | -55.2 | 0 | 0 | 0 | 0 | 110.8 | C28 F29 Y36 F130 S152 | C28-T32 WeakPolarHBondContact O-CB 3.41Å; C28-T32 PolarHBondContact O-N 3.03Å; C28-T32 PolarHBondContact O-OG1 3.01Å; F29-T32 PolarHBondContact O-N 3.33Å; T32-Y36 HydrophobicContact CG2-CD2 3.87Å; T32-Y36 HydrophobicContact CG2-CE2 4.18Å; T32-Y36 PolarHBondContact O-N 3.32Å; T32-F130 HydrophobicContact CG2-CE2 4.22Å; T32-S152 VanDerWaalsContact CB-O 3.31Å; T32-S152 WeakPolarHBondContact CB-O 3.49Å; T32-S152 WeakPolarHBondContact CG2-O 3.37Å; T32-S152 PolarHBondContact OG1-OG 3.48Å; T32-S152 VanDerWaalsContact OG1-OG 3.07Å |
| 33 | G | 96.4 | Very high | 95.8 | Very high | 0 Ų | 0 | 12.2 Ų | 12.2 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -50.5 | -65.9 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F29 V30 I31 S35 A37 G155 | F29-G33 PolarHBondContact O-N 2.93Å; V30-G33 WeakPolarHBondContact O-CA 3.44Å; V30-G33 PolarHBondContact O-N 2.62Å; I31-G33 PolarHBondContact O-N 2.71Å; G33-S35 PolarHBondContact O-N 2.82Å; G33-A37 WeakPolarHBondContact O-CB 3.29Å; G33-A37 PolarHBondContact O-N 3.3Å; G33-G155 WeakPolarHBondContact CA-O 3.14Å |
| 34 | F | 97.3 | Very high | 95.8 | Very high | 12 Ų | 12 | 10.9 Ų | 10.9 | 5% | 0.053 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -59.7 | -47.7 | -179.9 | -78 | -61.5 | 0 | 0 | 0 | 112.6 | V30 I31 Y36 F38 L126 F159 L163 L186 L187 | V30-F34 HydrophobicContact CG1-CD2 3.76Å; V30-F34 HydrophobicContact CG1-CE2 3.69Å; V30-F34 WeakPolarHBondContact O-CD2 3.38Å; V30-F34 PolarHBondContact O-N 2.92Å; I31-F34 PolarHBondContact O-N 3.22Å; F34-Y36 VanDerWaalsContact C-N 3.31Å; F34-Y36 PolarHBondContact O-N 3.4Å; F34-F38 HydrophobicContact CD1-CD2 4.37Å; F34-F38 WeakPolarHBondContact O-CB 3.38Å; F34-F38 PolarHBondContact O-N 3.44Å; F34-L126 HydrophobicContact CB-CD2 4.06Å; F34-F159 HydrophobicContact CD1-CD1 4.11Å; F34-F159 HydrophobicContact CD1-CE1 4.26Å; F34-F159 HydrophobicContact CD2-CD1 4.31Å; F34-F159 AromaticContact CD2-CE1 3.8Å; F34-F159 HydrophobicContact CD2-CE1 3.8Å; F34-F159 HydrophobicContact CE1-CD1 4.14Å; F34-F159 HydrophobicContact CE1-CE1 4.05Å; F34-F159 HydrophobicContact CE2-CD1 4.35Å; F34-F159 AromaticContact CE2-CE1 3.57Å; F34-F159 HydrophobicContact CE2-CE1 3.57Å; F34-F159 HydrophobicContact CE2-CZ 4.43Å; F34-F159 HydrophobicContact CG-CD1 4.19Å; F34-F159 HydrophobicContact CG-CE1 4.14Å; F34-F159 HydrophobicContact CZ-CD1 4.27Å; F34-F159 AromaticContact CZ-CE1 3.7Å; F34-F159 HydrophobicContact CZ-CE1 3.7Å; F34-L163 HydrophobicContact CD1-CD1 4.09Å; F34-L163 HydrophobicContact CE1-CD1 4.26Å; F34-L163 HydrophobicContact CE1-CD2 4.08Å; F34-L186 HydrophobicContact CE1-CB 4.41Å; F34-L186 HydrophobicContact CZ-CB 4.21Å; F34-L187 HydrophobicContact CB-CD2 4.04Å; F34-L187 HydrophobicContact CD1-CD2 3.65Å; F34-L187 HydrophobicContact CE1-CD2 4.21Å; F34-L187 HydrophobicContact CG-CD2 3.86Å |
| 35 | S | 95.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 11 Ų | 11 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -59.3 | -39.5 | -174.1 | -65.3 | 0 | 0 | 0 | 0 | 113.3 | I31 G33 P39 L71 L126 F130 | I31-S35 WeakPolarHBondContact O-CB 3.49Å; I31-S35 PolarHBondContact O-N 3.36Å; I31-S35 PolarHBondContact O-OG 3.48Å; G33-S35 PolarHBondContact O-N 2.82Å; S35-P39 WeakPolarHBondContact O-CD 3.04Å; S35-P39 WeakPolarHBondContact O-CG 3.35Å; S35-L71 WeakPolarHBondContact O-CD2 3.46Å; S35-L126 PolarHBondContact OG-O 3.45Å; S35-F130 WeakPolarHBondContact OG-CB 3.07Å |
| 36 | Y | 93.1 | Very high | 96 | Very high | 30 Ų | 30 | 10.3 Ų | 10.3 | 12% | 0.118 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -97 | -31 | -178.5 | -75.8 | -75.1 | 0 | 0 | 0 | 115.1 | T32 F34 L71 Y72 F130 S156 | T32-Y36 HydrophobicContact CG2-CD2 3.87Å; T32-Y36 HydrophobicContact CG2-CE2 4.18Å; T32-Y36 PolarHBondContact O-N 3.32Å; F34-Y36 VanDerWaalsContact C-N 3.31Å; F34-Y36 PolarHBondContact O-N 3.4Å; Y36-L71 HydrophobicContact CD1-CD2 4.32Å; Y36-L71 HydrophobicContact CE1-CD2 4.39Å; Y36-Y72 AromaticContact CE1-CE1 3.66Å; Y36-Y72 HydrophobicContact CE1-CE1 3.66Å; Y36-Y72 AromaticContact CE1-CZ 3.99Å; Y36-Y72 WeakPolarHBondContact CE1-OH 3.34Å; Y36-F130 HydrophobicContact CD2-CE2 4.26Å; Y36-F130 HydrophobicContact CD2-CZ 4.45Å; Y36-F130 HydrophobicContact CE2-CD2 4.19Å; Y36-F130 AromaticContact CE2-CE1 3.96Å; Y36-F130 HydrophobicContact CE2-CE1 3.96Å; Y36-F130 AromaticContact CE2-CE2 3.44Å; Y36-F130 HydrophobicContact CE2-CE2 3.44Å; Y36-F130 VanDerWaalsContact CE2-CE2 3.44Å; Y36-F130 AromaticContact CE2-CZ 3.29Å; Y36-F130 HydrophobicContact CE2-CZ 3.29Å; Y36-F130 AromaticContact CZ-CE1 3.95Å; Y36-F130 AromaticContact CZ-CZ 3.63Å; Y36-F130 WeakPolarHBondContact OH-CE1 3.45Å; Y36-F130 VanDerWaalsContact OH-CZ 3.22Å; Y36-F130 WeakPolarHBondContact OH-CZ 3.42Å; Y36-S156 WeakPolarHBondContact CB-OG 3.26Å |
| 37 | A | 95.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 10.4 Ų | 10.4 | 0% | 0 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -82.6 | -37.5 | -178 | 0 | 0 | 0 | 0 | 0 | 112.5 | G33 K40 A41 S156 F159 L160 L163 | G33-A37 WeakPolarHBondContact O-CB 3.29Å; G33-A37 PolarHBondContact O-N 3.3Å; A37-K40 PolarHBondContact O-N 2.84Å; A37-K40 VanDerWaalsContact O-N 3.14Å; A37-A41 PolarHBondContact O-N 3.1Å; A37-S156 WeakPolarHBondContact CB-O 3.47Å; A37-F159 HydrophobicContact CB-CB 3.79Å; A37-L160 HydrophobicContact CB-CB 3.9Å; A37-L160 HydrophobicContact CB-CD1 4.5Å; A37-L163 HydrophobicContact CB-CD1 4.1Å |
| 38 | F | 96.1 | Very high | 95.8 | Very high | 2 Ų | 2 | 11.8 Ų | 11.8 | 1% | 0.009 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -58.4 | -48.4 | -174.6 | -165.2 | -92.7 | 0 | 0 | 0 | 113.6 | F34 K40 A41 V42 L67 M102 T122 L126 L183 L187 | F34-F38 HydrophobicContact CD1-CD2 4.37Å; F34-F38 WeakPolarHBondContact O-CB 3.38Å; F34-F38 PolarHBondContact O-N 3.44Å; F38-K40 PolarHBondContact O-N 2.95Å; F38-K40 VanDerWaalsContact O-N 3.12Å; F38-A41 PolarHBondContact O-N 3.18Å; F38-A41 VanDerWaalsContact O-N 3.12Å; F38-V42 HydrophobicContact CD1-CG2 3.76Å; F38-V42 HydrophobicContact CE1-CG2 3.47Å; F38-V42 VanDerWaalsContact CE1-CG2 3.47Å; F38-V42 HydrophobicContact CG-CG2 4.43Å; F38-V42 HydrophobicContact CZ-CG2 3.94Å; F38-V42 VanDerWaalsContact O-CG2 3.32Å; F38-V42 WeakPolarHBondContact O-CG2 3.19Å; F38-V42 PolarHBondContact O-N 2.97Å; F38-L67 HydrophobicContact CD1-CD1 4.05Å; F38-L67 HydrophobicContact CE1-CD1 4.33Å; F38-M102 HydrophobicContact CE1-CE 4.3Å; F38-M102 HydrophobicContact CE1-CG 4.25Å; F38-M102 HydrophobicContact CE1-SD 3.62Å; F38-M102 HydrophobicContact CZ-CE 3.8Å; F38-M102 HydrophobicContact CZ-CG 3.9Å; F38-M102 HydrophobicContact CZ-SD 3.58Å; F38-M102 VanDerWaalsContact CZ-SD 3.58Å; F38-T122 HydrophobicContact CE1-CG2 4.2Å; F38-L126 HydrophobicContact CB-CD1 4.44Å; F38-L126 HydrophobicContact CD1-CD1 4.33Å; F38-L183 HydrophobicContact CE2-CB 4.09Å; F38-L183 HydrophobicContact CE2-CD1 4.14Å; F38-L183 HydrophobicContact CE2-CD2 4.28Å; F38-L183 HydrophobicContact CE2-CG 4.4Å; F38-L183 HydrophobicContact CZ-CB 4.24Å; F38-L183 HydrophobicContact CZ-CD1 4.23Å; F38-L187 HydrophobicContact CD2-CD2 4.22Å; F38-L187 HydrophobicContact CE1-CD1 4.1Å; F38-L187 HydrophobicContact CE2-CD1 4.01Å; F38-L187 HydrophobicContact CE2-CD2 4.35Å; F38-L187 HydrophobicContact CE2-CG 4.17Å; F38-L187 HydrophobicContact CZ-CD1 3.77Å; F38-L187 HydrophobicContact CZ-CG 4.43Å |
| 39 | P | 94.7 | Very high | 95.8 | Very high | 4 Ų | 4 | 11.8 Ų | 11.8 | 3% | 0.026 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -51.1 | -38.3 | 175.2 | -5.8 | -5.1 | 0 | 0 | 0 | 114.1 | S35 S64 L67 L68 | S35-P39 WeakPolarHBondContact O-CD 3.04Å; S35-P39 WeakPolarHBondContact O-CG 3.35Å; P39-S64 WeakPolarHBondContact O-CB 3.48Å; P39-L67 HydrophobicContact CB-CD2 3.71Å; P39-L67 HydrophobicContact CG-CD2 3.48Å; P39-L67 VanDerWaalsContact CG-CD2 3.48Å; P39-L68 HydrophobicContact CB-CD1 4.02Å; P39-L68 HydrophobicContact CG-CD1 3.52Å |
| 40 | K | 94.3 | Very high | 95.7 | Very high | 8 Ų | 8 | 10.5 Ų | 10.5 | 4% | 0.035 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -77.3 | -43.7 | 179.8 | -57.5 | 173.2 | -170.7 | 176.7 | 0 | 111.1 | A37 F38 V42 S43 L160 P250 Y336 | A37-K40 PolarHBondContact O-N 2.84Å; A37-K40 VanDerWaalsContact O-N 3.14Å; F38-K40 PolarHBondContact O-N 2.95Å; F38-K40 VanDerWaalsContact O-N 3.12Å; K40-V42 VanDerWaalsContact C-N 3.26Å; K40-V42 PolarHBondContact O-N 3.37Å; K40-S43 VanDerWaalsContact O-CB 3.24Å; K40-S43 WeakPolarHBondContact O-CB 3.35Å; K40-S43 PolarHBondContact O-N 3.28Å; K40-S43 PolarHBondContact O-OG 3.19Å; K40-L160 HydrophobicContact CB-CD1 3.86Å; K40-L160 HydrophobicContact CD-CD1 4.39Å; K40-L160 HydrophobicContact CD-CD2 4.09Å; K40-P250 HydrophobicContact CD-CB 4.34Å; K40-Y336 WeakPolarHBondContact CE-OH 3.31Å; K40-Y336 VanDerWaalsContact NZ-CZ 3.29Å; K40-Y336 PolarHBondContact NZ-OH 2.92Å |
| 41 | A | 95.4 | Very high | 95.6 | Very high | 6 Ų | 6 | 15.4 Ų | 15.4 | 5% | 0.05 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -64.2 | -29.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | A37 F38 S43 V44 L163 | A37-A41 PolarHBondContact O-N 3.1Å; F38-A41 PolarHBondContact O-N 3.18Å; F38-A41 VanDerWaalsContact O-N 3.12Å; A41-S43 PolarHBondContact O-N 3.43Å; A41-V44 WeakPolarHBondContact O-CB 3.36Å; A41-V44 VanDerWaalsContact O-CG2 3.32Å; A41-V44 WeakPolarHBondContact O-CG2 3.15Å; A41-V44 PolarHBondContact O-N 2.91Å; A41-L163 HydrophobicContact CB-CB 3.82Å |
| 42 | V | 95.6 | Very high | 95.5 | Very high | 1 Ų | 1 | 20.1 Ų | 20.1 | 1% | 0.006 | 9% | 0.094 | C | C | . | . | G | 310 helix | trans | -62.8 | -20.7 | 174.5 | 173.3 | 0 | 0 | 0 | 0 | 112.4 | F38 K40 V44 F45 F46 I63 T118 | F38-V42 HydrophobicContact CD1-CG2 3.76Å; F38-V42 HydrophobicContact CE1-CG2 3.47Å; F38-V42 VanDerWaalsContact CE1-CG2 3.47Å; F38-V42 HydrophobicContact CG-CG2 4.43Å; F38-V42 HydrophobicContact CZ-CG2 3.94Å; F38-V42 VanDerWaalsContact O-CG2 3.32Å; F38-V42 WeakPolarHBondContact O-CG2 3.19Å; F38-V42 PolarHBondContact O-N 2.97Å; K40-V42 VanDerWaalsContact C-N 3.26Å; K40-V42 PolarHBondContact O-N 3.37Å; V42-V44 PolarHBondContact O-N 3.41Å; V42-F45 WeakPolarHBondContact O-CD2 3.27Å; V42-F45 PolarHBondContact O-N 3.43Å; V42-F46 HydrophobicContact CG1-CE1 4.1Å; V42-F46 WeakPolarHBondContact O-CD1 3.45Å; V42-I63 HydrophobicContact CG1-CG2 4.19Å; V42-T118 HydrophobicContact CG1-CG2 4.45Å |
| 43 | S | 95.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 10% | 0.102 | C | C | . | . | G | 310 helix | trans | -62 | -22.6 | 175.8 | 69.2 | 0 | 0 | 0 | 0 | 114 | K40 A41 F45 F46 V251 | K40-S43 VanDerWaalsContact O-CB 3.24Å; K40-S43 WeakPolarHBondContact O-CB 3.35Å; K40-S43 PolarHBondContact O-N 3.28Å; K40-S43 PolarHBondContact O-OG 3.19Å; A41-S43 PolarHBondContact O-N 3.43Å; S43-F45 PolarHBondContact O-N 3.04Å; S43-F45 VanDerWaalsContact O-N 3.16Å; S43-F46 VanDerWaalsContact O-CB 3.32Å; S43-F46 WeakPolarHBondContact O-CB 3.37Å; S43-F46 WeakPolarHBondContact O-CG 3.48Å; S43-F46 PolarHBondContact O-N 3.2Å; S43-V251 VanDerWaalsContact CB-O 3.28Å; S43-V251 WeakPolarHBondContact CB-O 3.15Å |
| 44 | V | 96.8 | Very high | 95.5 | Very high | 1 Ų | 1 | 25.3 Ų | 25.3 | 1% | 0.006 | 14% | 0.137 | C | C | . | . | G | 310 helix | trans | -56.8 | -32.5 | 177.3 | 175 | 0 | 0 | 0 | 0 | 111.8 | A41 V42 Q168 Q171 V254 K258 A268 L271 | A41-V44 WeakPolarHBondContact O-CB 3.36Å; A41-V44 VanDerWaalsContact O-CG2 3.32Å; A41-V44 WeakPolarHBondContact O-CG2 3.15Å; A41-V44 PolarHBondContact O-N 2.91Å; V42-V44 PolarHBondContact O-N 3.41Å; V44-Q168 HydrophobicContact CG1-CB 3.85Å; V44-Q168 HydrophobicContact CG1-CG 4.49Å; V44-Q171 PolarHBondContact O-OE1 3.19Å; V44-V254 HydrophobicContact CG2-CG1 4.5Å; V44-K258 PolarHBondContact O-NZ 2.89Å; V44-A268 HydrophobicContact CG2-CB 4.44Å; V44-L271 HydrophobicContact CG2-CD1 4.49Å |
| 45 | F | 97 | Very high | 95.5 | Very high | 1 Ų | 1 | 26.3 Ų | 26.3 | 0% | 0.004 | 14% | 0.144 | C | C | . | . | G | 310 helix | trans | -86 | -4.4 | -178.8 | -55.5 | -84 | 0 | 0 | 0 | 114.2 | V42 S43 K47 E48 L49 G167 Q171 W176 F180 L183 | V42-F45 WeakPolarHBondContact O-CD2 3.27Å; V42-F45 PolarHBondContact O-N 3.43Å; S43-F45 PolarHBondContact O-N 3.04Å; S43-F45 VanDerWaalsContact O-N 3.16Å; F45-K47 PolarHBondContact O-N 2.88Å; F45-E48 VanDerWaalsContact C-OE2 3.3Å; F45-E48 WeakPolarHBondContact CA-OE2 3.35Å; F45-E48 PolarHBondContact O-N 2.97Å; F45-L49 HydrophobicContact CB-CD1 4.41Å; F45-L49 VanDerWaalsContact O-CG 3.26Å; F45-L49 WeakPolarHBondContact O-CG 3.49Å; F45-L49 PolarHBondContact O-N 3.35Å; F45-G167 WeakPolarHBondContact CZ-O 3.31Å; F45-Q171 VanDerWaalsContact CA-OE1 3.29Å; F45-Q171 HydrophobicContact CD1-CB 4.14Å; F45-Q171 HydrophobicContact CD1-CG 3.93Å; F45-Q171 HydrophobicContact CE1-CB 3.76Å; F45-Q171 HydrophobicContact CE1-CG 4.06Å; F45-W176 HydrophobicContact CD1-CB 4.07Å; F45-F180 HydrophobicContact CB-CE1 4.3Å; F45-F180 HydrophobicContact CB-CZ 4.43Å; F45-F180 HydrophobicContact CD1-CE1 4.19Å; F45-F180 AromaticContact CD2-CE1 3.81Å; F45-F180 HydrophobicContact CD2-CE1 3.81Å; F45-F180 HydrophobicContact CE2-CE1 4.16Å; F45-F180 AromaticContact CG-CE1 3.83Å; F45-F180 HydrophobicContact CG-CE1 3.83Å; F45-F180 HydrophobicContact CG-CZ 4.43Å; F45-L183 HydrophobicContact CE2-CD1 3.91Å; F45-L183 HydrophobicContact CZ-CD1 4Å |
| 46 | F | 95.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.6 | -40.1 | -169.7 | -76.9 | 4.5 | 0 | 0 | 0 | 113.1 | V42 S43 E48 L49 I50 T60 I63 V251 | V42-F46 HydrophobicContact CG1-CE1 4.1Å; V42-F46 WeakPolarHBondContact O-CD1 3.45Å; S43-F46 VanDerWaalsContact O-CB 3.32Å; S43-F46 WeakPolarHBondContact O-CB 3.37Å; S43-F46 WeakPolarHBondContact O-CG 3.48Å; S43-F46 PolarHBondContact O-N 3.2Å; F46-E48 VanDerWaalsContact C-N 3.27Å; F46-E48 PolarHBondContact O-N 2.94Å; F46-L49 PolarHBondContact O-N 3.06Å; F46-I50 WeakPolarHBondContact O-CD1 3.38Å; F46-I50 WeakPolarHBondContact O-CG1 3.36Å; F46-I50 PolarHBondContact O-N 3.45Å; F46-T60 WeakPolarHBondContact CZ-O 3.4Å; F46-I63 HydrophobicContact CE1-CB 4.26Å; F46-I63 HydrophobicContact CE1-CD1 4.24Å; F46-I63 HydrophobicContact CZ-CB 4.45Å; F46-V251 HydrophobicContact CD2-CG1 4.38Å; F46-V251 HydrophobicContact CE2-CG1 3.61Å; F46-V251 HydrophobicContact CZ-CG1 4.49Å |
| 47 | K | 94.4 | Very high | 95.6 | Very high | 54 Ų | 54 | 27.5 Ų | 27.5 | 24% | 0.235 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -62.5 | -38.9 | -179.3 | -172 | 179.5 | 180 | -176 | 0 | 111.1 | F45 I50 Q51 K258 | F45-K47 PolarHBondContact O-N 2.88Å; K47-I50 WeakPolarHBondContact O-CB 3.48Å; K47-I50 PolarHBondContact O-N 3.39Å; K47-Q51 WeakPolarHBondContact O-CG 3.34Å; K47-Q51 PolarHBondContact O-N 3.35Å; K47-Q51 VanDerWaalsContact O-N 3.15Å; K47-K258 HydrophobicContact CB-CD 4.3Å; K47-K258 HydrophobicContact CD-CB 3.78Å; K47-K258 HydrophobicContact CD-CD 3.72Å; K47-K258 HydrophobicContact CD-CG 4.37Å; K47-K258 PolarHBondContact NZ-O 2.94Å |
| 48 | E | 94.7 | Very high | 95.7 | Very high | 31 Ų | 31 | 28.1 Ų | 28.1 | 15% | 0.145 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -74.9 | -37.5 | -178.9 | -63.3 | 72.3 | -165.2 | 0 | 0 | 110.8 | F45 F46 Q51 E52 Q171 K258 | F45-E48 VanDerWaalsContact C-OE2 3.3Å; F45-E48 WeakPolarHBondContact CA-OE2 3.35Å; F45-E48 PolarHBondContact O-N 2.97Å; F46-E48 VanDerWaalsContact C-N 3.27Å; F46-E48 PolarHBondContact O-N 2.94Å; E48-Q51 PolarHBondContact O-N 3.4Å; E48-E52 WeakPolarHBondContact O-CB 3.5Å; E48-E52 PolarHBondContact O-N 3.48Å; E48-Q171 HydrophobicContact CG-CG 4.48Å; E48-Q171 VanDerWaalsContact CG-NE2 3.27Å; E48-Q171 PolarHBondContact OE1-NE2 2.73Å; E48-Q171 PolarHBondContact OE2-NE2 3.23Å; E48-K258 IonicContact OE1-NZ 3.6Å; E48-K258 PolarHBondContact OE1-NZ 3.39Å; E48-K258 IonicContact OE2-NZ 3.91Å |
| 49 | L | 96.5 | Very high | 95.7 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.4 | -38.1 | 172.3 | -68.5 | 173.9 | 0 | 0 | 0 | 112.4 | F45 F46 Q51 F53 T60 I63 I114 W176 F180 | F45-L49 HydrophobicContact CB-CD1 4.41Å; F45-L49 VanDerWaalsContact O-CG 3.26Å; F45-L49 WeakPolarHBondContact O-CG 3.49Å; F45-L49 PolarHBondContact O-N 3.35Å; F46-L49 PolarHBondContact O-N 3.06Å; L49-Q51 VanDerWaalsContact C-N 3.32Å; L49-F53 HydrophobicContact CB-CD2 4.47Å; L49-F53 HydrophobicContact CD2-CD2 4.15Å; L49-F53 HydrophobicContact CD2-CE2 3.7Å; L49-F53 WeakPolarHBondContact O-CB 3.45Å; L49-F53 WeakPolarHBondContact O-CD2 3.38Å; L49-F53 PolarHBondContact O-N 2.69Å; L49-T60 HydrophobicContact CB-CG2 3.88Å; L49-I63 HydrophobicContact CD1-CD1 3.73Å; L49-I114 HydrophobicContact CD1-CD1 4.47Å; L49-I114 HydrophobicContact CD2-CD1 3.62Å; L49-W176 HydrophobicContact CD2-CD2 3.88Å; L49-W176 HydrophobicContact CD2-CE3 3.94Å; L49-W176 HydrophobicContact CD2-CG 4.28Å; L49-W176 HydrophobicContact CD2-CZ2 4.48Å; L49-W176 HydrophobicContact CD2-CZ3 4.29Å; L49-F180 HydrophobicContact CD1-CZ 4.34Å |
| 50 | I | 95.9 | Very high | 95.8 | Very high | 30 Ų | 30 | 30.6 Ų | 30.6 | 15% | 0.154 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -57.6 | -46.9 | 171.9 | -79 | 157.5 | 0 | 0 | 0 | 110.3 | F46 K47 G54 V55 Y57 T60 | F46-I50 WeakPolarHBondContact O-CD1 3.38Å; F46-I50 WeakPolarHBondContact O-CG1 3.36Å; F46-I50 PolarHBondContact O-N 3.45Å; K47-I50 WeakPolarHBondContact O-CB 3.48Å; K47-I50 PolarHBondContact O-N 3.39Å; I50-G54 VanDerWaalsContact O-CA 3.29Å; I50-G54 WeakPolarHBondContact O-CA 3.36Å; I50-G54 PolarHBondContact O-N 3.4Å; I50-V55 WeakPolarHBondContact CG2-O 3.42Å; I50-V55 PolarHBondContact O-N 2.87Å; I50-Y57 HydrophobicContact CD1-CD1 3.45Å; I50-Y57 VanDerWaalsContact CD1-CD1 3.45Å; I50-Y57 HydrophobicContact CD1-CE1 3.59Å; I50-Y57 HydrophobicContact CD1-CG 4.07Å; I50-T60 HydrophobicContact CD1-CG2 4.37Å; I50-T60 HydrophobicContact CG1-CG2 3.74Å |
| 51 | Q | 94.4 | Very high | 95.9 | Very high | 140 Ų | 140 | 30.2 Ų | 30.2 | 65% | 0.654 | 17% | 0.17 | S | C | * | . | H | α-helix | trans | -67.2 | -44.7 | -179.4 | -71 | 174.7 | 1.2 | 0 | 0 | 112.7 | K47 E48 L49 | K47-Q51 WeakPolarHBondContact O-CG 3.34Å; K47-Q51 PolarHBondContact O-N 3.35Å; K47-Q51 VanDerWaalsContact O-N 3.15Å; E48-Q51 PolarHBondContact O-N 3.4Å; L49-Q51 VanDerWaalsContact C-N 3.32Å |
| 52 | E | 95.7 | Very high | 96.1 | Very high | 98 Ų | 98 | 34.1 Ų | 34.1 | 46% | 0.458 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -66 | -44.3 | -178.5 | 179.6 | 78.5 | 175.8 | 0 | 0 | 112.2 | E48 W176 R177 | E48-E52 WeakPolarHBondContact O-CB 3.5Å; E48-E52 PolarHBondContact O-N 3.48Å; E52-W176 HydrophobicContact CG-CZ2 4.07Å; E52-R177 IonicContact OE1-CZ 2.87Å; E52-R177 VanDerWaalsContact OE1-CZ 3.27Å; E52-R177 IonicContact OE1-NH1 2.85Å; E52-R177 PolarHBondContact OE1-NH1 2.85Å; E52-R177 IonicContact OE1-NH2 3.27Å; E52-R177 PolarHBondContact OE1-NH2 2.76Å |
| 53 | F | 96.4 | Very high | 96.2 | Very high | 42 Ų | 42 | 34.1 Ų | 34.1 | 18% | 0.184 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -97.4 | -8.1 | -173.7 | -65.2 | -66.4 | 0 | 0 | 0 | 114 | L49 V55 T109 I111 I114 W176 | L49-F53 HydrophobicContact CB-CD2 4.47Å; L49-F53 HydrophobicContact CD2-CD2 4.15Å; L49-F53 HydrophobicContact CD2-CE2 3.7Å; L49-F53 WeakPolarHBondContact O-CB 3.45Å; L49-F53 WeakPolarHBondContact O-CD2 3.38Å; L49-F53 PolarHBondContact O-N 2.69Å; F53-V55 VanDerWaalsContact C-N 3.32Å; F53-V55 HydrophobicContact CB-CG1 3.91Å; F53-V55 HydrophobicContact CB-CG2 4.11Å; F53-V55 PolarHBondContact O-N 3.27Å; F53-T109 VanDerWaalsContact CE1-C 3.49Å; F53-I111 HydrophobicContact CD2-CD1 4.26Å; F53-I114 HydrophobicContact CD2-CD1 4.4Å; F53-I114 HydrophobicContact CE2-CD1 3.52Å; F53-I114 HydrophobicContact CZ-CD1 4.01Å; F53-W176 HydrophobicContact CE2-CH2 4.04Å; F53-W176 AromaticContact CE2-CZ2 3.91Å; F53-W176 HydrophobicContact CE2-CZ2 3.91Å; F53-W176 AromaticContact CZ-CH2 3.78Å; F53-W176 HydrophobicContact CZ-CH2 3.78Å; F53-W176 AromaticContact CZ-CZ2 3.77Å; F53-W176 HydrophobicContact CZ-CZ2 3.77Å |
| 54 | G | 95.1 | Very high | 96.2 | Very high | 72 Ų | 72 | 34.4 Ų | 34.4 | 74% | 0.742 | 19% | 0.185 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 64 | 34.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | I50 | I50-G54 VanDerWaalsContact O-CA 3.29Å; I50-G54 WeakPolarHBondContact O-CA 3.36Å; I50-G54 PolarHBondContact O-N 3.4Å |
| 55 | V | 96.2 | Very high | 96.2 | Very high | 32 Ų | 32 | 34.3 Ų | 34.3 | 19% | 0.194 | 19% | 0.185 | C | C | . | . | trans | -107.1 | 169.7 | -174.3 | -63.9 | 0 | 0 | 0 | 0 | 112.3 | I50 F53 D59 T60 I111 | I50-V55 WeakPolarHBondContact CG2-O 3.42Å; I50-V55 PolarHBondContact O-N 2.87Å; F53-V55 VanDerWaalsContact C-N 3.32Å; F53-V55 HydrophobicContact CB-CG1 3.91Å; F53-V55 HydrophobicContact CB-CG2 4.11Å; F53-V55 PolarHBondContact O-N 3.27Å; V55-D59 HydrophobicContact CB-CB 3.79Å; V55-D59 HydrophobicContact CG2-CB 4.03Å; V55-T60 HydrophobicContact CG2-CG2 4.2Å; V55-I111 HydrophobicContact CG1-CB 4.39Å; V55-I111 HydrophobicContact CG1-CG2 4.23Å; V55-I111 HydrophobicContact CG2-CD1 4.36Å; V55-I111 HydrophobicContact CG2-CG1 4.49Å | ||
| 56 | G | 95.8 | Very high | 96.3 | Very high | 18 Ų | 18 | 35.5 Ų | 35.5 | 19% | 0.186 | 19% | 0.191 | C | C | . | . | trans | -84.5 | 176.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | S58 D59 T60 | G56-S58 VanDerWaalsContact C-N 3.31Å; G56-D59 PolarHBondContact N-OD2 3.41Å; G56-D59 VanDerWaalsContact N-OD2 3.07Å; G56-D59 PolarHBondContact O-N 2.98Å; G56-T60 PolarHBondContact O-N 3.18Å | ||
| 57 | Y | 95.9 | Very high | 96.3 | Very high | 37 Ų | 37 | 35.6 Ų | 35.6 | 15% | 0.145 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65 | -35.1 | 170 | -71.8 | -73.2 | 0 | 0 | 0 | 112 | I50 D59 T60 A61 E259 L382 D383 Y388 | I50-Y57 HydrophobicContact CD1-CD1 3.45Å; I50-Y57 VanDerWaalsContact CD1-CD1 3.45Å; I50-Y57 HydrophobicContact CD1-CE1 3.59Å; I50-Y57 HydrophobicContact CD1-CG 4.07Å; Y57-D59 VanDerWaalsContact C-N 3.26Å; Y57-D59 PolarHBondContact O-N 3.01Å; Y57-T60 PolarHBondContact O-OG1 3.26Å; Y57-A61 VanDerWaalsContact O-CB 3.24Å; Y57-A61 WeakPolarHBondContact O-CB 3.45Å; Y57-A61 PolarHBondContact O-N 2.83Å; Y57-E259 PolarHBondContact OH-OE2 3.25Å; Y57-L382 HydrophobicContact CD1-CD2 3.85Å; Y57-L382 HydrophobicContact CD2-CD2 3.59Å; Y57-L382 HydrophobicContact CD2-CG 3.75Å; Y57-L382 HydrophobicContact CE1-CD2 4.25Å; Y57-L382 HydrophobicContact CE2-CD2 3.99Å; Y57-L382 HydrophobicContact CE2-CG 4.17Å; Y57-L382 HydrophobicContact CG-CD2 3.51Å; Y57-L382 HydrophobicContact CG-CG 4.12Å; Y57-D383 WeakPolarHBondContact CD2-OD1 3.49Å; Y57-D383 PolarHBondContact N-OD1 3.12Å; Y57-D383 PolarHBondContact N-OD2 3.32Å; Y57-D383 VanDerWaalsContact N-OD2 3.14Å; Y57-Y388 VanDerWaalsContact CE1-OH 3.31Å; Y57-Y388 WeakPolarHBondContact CE1-OH 3.32Å; Y57-Y388 PolarHBondContact OH-OH 3.06Å |
| 58 | S | 97.2 | Very high | 96.4 | Very high | 13 Ų | 13 | 33.3 Ų | 33.3 | 9% | 0.091 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -58.2 | -40.8 | 173.4 | -175.9 | 0 | 0 | 0 | 0 | 111.8 | G56 W62 P376 D383 | G56-S58 VanDerWaalsContact C-N 3.31Å; S58-W62 PolarHBondContact O-N 3.43Å; S58-P376 PolarHBondContact OG-O 2.85Å; S58-P376 VanDerWaalsContact OG-O 3.09Å; S58-D383 WeakPolarHBondContact CB-OD2 3.5Å; S58-D383 PolarHBondContact N-OD2 3.41Å |
| 59 | D | 97.1 | Very high | 96.5 | Very high | 59 Ų | 59 | 32.4 Ų | 32.4 | 32% | 0.316 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -68.4 | -50.2 | -175.6 | -68.5 | -45 | 0 | 0 | 0 | 110.6 | V55 G56 Y57 A61 W62 Y115 | V55-D59 HydrophobicContact CB-CB 3.79Å; V55-D59 HydrophobicContact CG2-CB 4.03Å; G56-D59 PolarHBondContact N-OD2 3.41Å; G56-D59 VanDerWaalsContact N-OD2 3.07Å; G56-D59 PolarHBondContact O-N 2.98Å; Y57-D59 VanDerWaalsContact C-N 3.26Å; Y57-D59 PolarHBondContact O-N 3.01Å; D59-A61 VanDerWaalsContact C-N 3.31Å; D59-A61 PolarHBondContact O-N 3.25Å; D59-W62 WeakPolarHBondContact O-CB 3.24Å; D59-W62 PolarHBondContact O-N 3.48Å; D59-Y115 WeakPolarHBondContact CA-OH 3.34Å; D59-Y115 VanDerWaalsContact CB-OH 3.27Å; D59-Y115 WeakPolarHBondContact CB-OH 3.42Å; D59-Y115 WeakPolarHBondContact O-CE1 3.24Å; D59-Y115 PolarHBondContact O-OH 3Å |
| 60 | T | 96.6 | Very high | 96.4 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -65.3 | -34 | 177.3 | 50.2 | 0 | 0 | 0 | 0 | 112.9 | F46 L49 I50 V55 G56 Y57 W62 I63 I111 | F46-T60 WeakPolarHBondContact CZ-O 3.4Å; L49-T60 HydrophobicContact CB-CG2 3.88Å; I50-T60 HydrophobicContact CD1-CG2 4.37Å; I50-T60 HydrophobicContact CG1-CG2 3.74Å; V55-T60 HydrophobicContact CG2-CG2 4.2Å; G56-T60 PolarHBondContact O-N 3.18Å; Y57-T60 PolarHBondContact O-OG1 3.26Å; T60-W62 PolarHBondContact O-N 2.99Å; T60-I63 VanDerWaalsContact O-CB 3.3Å; T60-I63 WeakPolarHBondContact O-CB 3.08Å; T60-I63 WeakPolarHBondContact O-CG1 3.34Å; T60-I63 PolarHBondContact O-N 3.3Å; T60-I111 HydrophobicContact CG2-CD1 4.44Å |
| 61 | A | 97.2 | Very high | 96.3 | Very high | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.1 | -28.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y57 D59 I63 S64 S65 F252 P375 P376 | Y57-A61 VanDerWaalsContact O-CB 3.24Å; Y57-A61 WeakPolarHBondContact O-CB 3.45Å; Y57-A61 PolarHBondContact O-N 2.83Å; D59-A61 VanDerWaalsContact C-N 3.31Å; D59-A61 PolarHBondContact O-N 3.25Å; A61-I63 PolarHBondContact O-N 3.06Å; A61-S64 PolarHBondContact O-N 3.34Å; A61-S64 PolarHBondContact O-OG 2.93Å; A61-S65 WeakPolarHBondContact O-CB 3.38Å; A61-S65 PolarHBondContact O-N 2.91Å; A61-S65 PolarHBondContact O-OG 2.9Å; A61-F252 HydrophobicContact CB-CE1 4.35Å; A61-F252 HydrophobicContact CB-CE2 4.46Å; A61-F252 HydrophobicContact CB-CZ 3.68Å; A61-P375 HydrophobicContact CB-CB 4.12Å; A61-P376 HydrophobicContact CB-CG 4.49Å |
| 62 | W | 97.9 | Very high | 96.2 | Very high | 88 Ų | 88 | 28 Ų | 28 | 33% | 0.333 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -58.9 | -30 | 173.1 | -82 | 107.1 | 0 | 0 | 0 | 112.5 | S58 D59 T60 S65 I66 Y115 L372 P376 | S58-W62 PolarHBondContact O-N 3.43Å; D59-W62 WeakPolarHBondContact O-CB 3.24Å; D59-W62 PolarHBondContact O-N 3.48Å; T60-W62 PolarHBondContact O-N 2.99Å; W62-S65 PolarHBondContact O-N 3.16Å; W62-I66 HydrophobicContact CB-CD1 4.2Å; W62-I66 HydrophobicContact CE3-CD1 4.21Å; W62-I66 HydrophobicContact CE3-CG1 4.01Å; W62-I66 WeakPolarHBondContact O-CB 3.3Å; W62-I66 WeakPolarHBondContact O-CD1 3.17Å; W62-I66 WeakPolarHBondContact O-CG1 3.3Å; W62-I66 PolarHBondContact O-N 2.74Å; W62-Y115 HydrophobicContact CB-CD1 4.27Å; W62-Y115 HydrophobicContact CB-CE1 3.78Å; W62-Y115 HydrophobicContact CB-CE2 4.49Å; W62-L372 HydrophobicContact CE3-CD1 4.06Å; W62-L372 HydrophobicContact CZ3-CD1 3.66Å; W62-L372 HydrophobicContact CZ3-CG 3.8Å; W62-L372 WeakPolarHBondContact CZ3-O 3.47Å; W62-P376 HydrophobicContact CB-CG 4.43Å; W62-P376 HydrophobicContact CD2-CB 3.8Å; W62-P376 HydrophobicContact CD2-CG 3.58Å; W62-P376 VanDerWaalsContact CE2-CB 3.5Å; W62-P376 HydrophobicContact CE3-CG 3.94Å; W62-P376 HydrophobicContact CG-CB 3.96Å; W62-P376 HydrophobicContact CG-CG 3.82Å; W62-P376 HydrophobicContact CZ2-CB 3.99Å; W62-P376 HydrophobicContact CZ2-CG 4.33Å; W62-P376 HydrophobicContact CZ3-CG 4.46Å |
| 63 | I | 97.5 | Very high | 95.9 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.4 | -56.2 | -178.8 | -57.2 | 166.4 | 0 | 0 | 0 | 110.6 | V42 F46 L49 T60 A61 S65 L67 I111 I114 Y115 T118 | V42-I63 HydrophobicContact CG1-CG2 4.19Å; F46-I63 HydrophobicContact CE1-CB 4.26Å; F46-I63 HydrophobicContact CE1-CD1 4.24Å; F46-I63 HydrophobicContact CZ-CB 4.45Å; L49-I63 HydrophobicContact CD1-CD1 3.73Å; T60-I63 VanDerWaalsContact O-CB 3.3Å; T60-I63 WeakPolarHBondContact O-CB 3.08Å; T60-I63 WeakPolarHBondContact O-CG1 3.34Å; T60-I63 PolarHBondContact O-N 3.3Å; A61-I63 PolarHBondContact O-N 3.06Å; I63-S65 VanDerWaalsContact C-N 3.3Å; I63-S65 PolarHBondContact O-N 3.41Å; I63-L67 WeakPolarHBondContact O-CB 3.28Å; I63-L67 PolarHBondContact O-N 3.42Å; I63-L67 VanDerWaalsContact O-N 3.12Å; I63-I111 HydrophobicContact CD1-CD1 4.07Å; I63-I114 HydrophobicContact CD1-CG2 3.64Å; I63-I114 HydrophobicContact CG1-CG2 3.89Å; I63-I114 HydrophobicContact CG2-CG2 4.1Å; I63-Y115 HydrophobicContact CG1-CD1 3.78Å; I63-Y115 HydrophobicContact CG1-CE1 3.79Å; I63-T118 HydrophobicContact CG2-CG2 3.69Å |
| 64 | S | 95.8 | Very high | 95.6 | Very high | 6 Ų | 6 | 23.2 Ų | 23.2 | 4% | 0.042 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -66 | -35 | -179.8 | 64.6 | 0 | 0 | 0 | 0 | 112.1 | P39 A61 L67 L68 | P39-S64 WeakPolarHBondContact O-CB 3.48Å; A61-S64 PolarHBondContact O-N 3.34Å; A61-S64 PolarHBondContact O-OG 2.93Å; S64-L67 PolarHBondContact O-N 3.12Å; S64-L68 WeakPolarHBondContact O-CB 3.41Å; S64-L68 PolarHBondContact O-N 3.37Å |
| 65 | S | 97.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -70.7 | -45.2 | -177.5 | -53.8 | 0 | 0 | 0 | 0 | 112.2 | A61 W62 I63 L67 L68 A69 V371 P375 P376 | A61-S65 WeakPolarHBondContact O-CB 3.38Å; A61-S65 PolarHBondContact O-N 2.91Å; A61-S65 PolarHBondContact O-OG 2.9Å; W62-S65 PolarHBondContact O-N 3.16Å; I63-S65 VanDerWaalsContact C-N 3.3Å; I63-S65 PolarHBondContact O-N 3.41Å; S65-L67 VanDerWaalsContact C-N 3.33Å; S65-L68 PolarHBondContact O-N 3.09Å; S65-A69 WeakPolarHBondContact O-CB 3.47Å; S65-A69 PolarHBondContact O-N 3.04Å; S65-V371 WeakPolarHBondContact CB-O 3.28Å; S65-P375 WeakPolarHBondContact OG-CB 3.46Å; S65-P375 WeakPolarHBondContact OG-CG 3.44Å; S65-P376 VanDerWaalsContact OG-CD 3.24Å; S65-P376 WeakPolarHBondContact OG-CD 3.42Å |
| 66 | I | 98.2 | Very high | 94.5 | Very high | 26 Ų | 26 | 21.6 Ų | 21.6 | 13% | 0.133 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -62.2 | -45.2 | 173.3 | -65.5 | 164.6 | 0 | 0 | 0 | 109.4 | W62 L68 A69 M70 Y115 V120 L372 | W62-I66 HydrophobicContact CB-CD1 4.2Å; W62-I66 HydrophobicContact CE3-CD1 4.21Å; W62-I66 HydrophobicContact CE3-CG1 4.01Å; W62-I66 WeakPolarHBondContact O-CB 3.3Å; W62-I66 WeakPolarHBondContact O-CD1 3.17Å; W62-I66 WeakPolarHBondContact O-CG1 3.3Å; W62-I66 PolarHBondContact O-N 2.74Å; I66-L68 PolarHBondContact O-N 3.31Å; I66-A69 PolarHBondContact O-N 2.71Å; I66-M70 HydrophobicContact CG2-CG 4.33Å; I66-M70 WeakPolarHBondContact O-CB 3.38Å; I66-M70 VanDerWaalsContact O-CG 3.25Å; I66-M70 WeakPolarHBondContact O-CG 3.38Å; I66-M70 PolarHBondContact O-N 3.5Å; I66-Y115 HydrophobicContact CD1-CD1 4.4Å; I66-Y115 HydrophobicContact CD1-CG 4.08Å; I66-V120 HydrophobicContact CG2-CG2 3.7Å; I66-L372 HydrophobicContact CB-CD1 4.42Å; I66-L372 HydrophobicContact CG1-CD1 3.8Å |
| 67 | L | 96.9 | Very high | 94.2 | Very high | 1 Ų | 1 | 24.9 Ų | 24.9 | 1% | 0.005 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -58.7 | -46.8 | 179.9 | -165.6 | 159.7 | 0 | 0 | 0 | 111.5 | F38 P39 I63 S64 S65 M70 L71 T118 G119 T122 L126 | F38-L67 HydrophobicContact CD1-CD1 4.05Å; F38-L67 HydrophobicContact CE1-CD1 4.33Å; P39-L67 HydrophobicContact CB-CD2 3.71Å; P39-L67 HydrophobicContact CG-CD2 3.48Å; P39-L67 VanDerWaalsContact CG-CD2 3.48Å; I63-L67 WeakPolarHBondContact O-CB 3.28Å; I63-L67 PolarHBondContact O-N 3.42Å; I63-L67 VanDerWaalsContact O-N 3.12Å; S64-L67 PolarHBondContact O-N 3.12Å; S65-L67 VanDerWaalsContact C-N 3.33Å; L67-M70 PolarHBondContact O-N 2.9Å; L67-L71 PolarHBondContact O-N 3.2Å; L67-L71 VanDerWaalsContact O-N 3.13Å; L67-T118 HydrophobicContact CD1-CG2 4.11Å; L67-T118 WeakPolarHBondContact CD1-O 3.39Å; L67-G119 WeakPolarHBondContact CA-O 3.24Å; L67-T122 HydrophobicContact CD1-CG2 4.33Å; L67-L126 HydrophobicContact CD2-CD1 3.91Å |
| 68 | L | 95.3 | Very high | 93.7 | Very high | 6 Ų | 6 | 23.1 Ų | 23.1 | 3% | 0.031 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -72.8 | -36.4 | 178.7 | -152.6 | 78.4 | 0 | 0 | 0 | 112.9 | P39 S64 S65 I66 M70 L71 Y72 F247 V371 | P39-L68 HydrophobicContact CB-CD1 4.02Å; P39-L68 HydrophobicContact CG-CD1 3.52Å; S64-L68 WeakPolarHBondContact O-CB 3.41Å; S64-L68 PolarHBondContact O-N 3.37Å; S65-L68 PolarHBondContact O-N 3.09Å; I66-L68 PolarHBondContact O-N 3.31Å; L68-M70 VanDerWaalsContact C-N 3.29Å; L68-M70 PolarHBondContact O-N 3.07Å; L68-L71 HydrophobicContact CD1-CD2 3.96Å; L68-L71 WeakPolarHBondContact O-CB 3.25Å; L68-L71 PolarHBondContact O-N 3.37Å; L68-L71 VanDerWaalsContact O-N 3.15Å; L68-Y72 HydrophobicContact CD2-CE2 4.05Å; L68-Y72 HydrophobicContact CG-CE2 4.29Å; L68-Y72 PolarHBondContact O-N 3.45Å; L68-F247 HydrophobicContact CD2-CD1 3.71Å; L68-F247 HydrophobicContact CD2-CD2 4.18Å; L68-F247 HydrophobicContact CD2-CE1 3.55Å; L68-F247 HydrophobicContact CD2-CE2 4.02Å; L68-F247 HydrophobicContact CD2-CG 4.04Å; L68-F247 HydrophobicContact CD2-CZ 3.72Å; L68-V371 HydrophobicContact CB-CG1 4.18Å; L68-V371 HydrophobicContact CB-CG2 4.21Å; L68-V371 HydrophobicContact CD2-CB 4.22Å; L68-V371 HydrophobicContact CD2-CG1 4.15Å; L68-V371 HydrophobicContact CD2-CG2 3.42Å; L68-V371 VanDerWaalsContact CD2-CG2 3.42Å; L68-V371 HydrophobicContact CG-CG1 4.42Å; L68-V371 HydrophobicContact CG-CG2 4.35Å |
| 69 | A | 96.7 | Very high | 93 | Very high | 13 Ų | 13 | 22.7 Ų | 22.7 | 11% | 0.107 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -62.3 | -38.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | S65 I66 Y72 G73 A368 V371 L372 | S65-A69 WeakPolarHBondContact O-CB 3.47Å; S65-A69 PolarHBondContact O-N 3.04Å; I66-A69 PolarHBondContact O-N 2.71Å; A69-Y72 PolarHBondContact O-N 3.35Å; A69-G73 WeakPolarHBondContact O-CA 3.29Å; A69-G73 PolarHBondContact O-N 3.04Å; A69-A368 WeakPolarHBondContact CB-O 3.44Å; A69-V371 HydrophobicContact CB-CG1 4.27Å; A69-L372 HydrophobicContact CB-CB 3.83Å; A69-L372 HydrophobicContact CB-CD1 3.88Å; A69-L372 HydrophobicContact CB-CG 4.31Å |
| 70 | M | 96.2 | Very high | 92.3 | Very high | 43 Ų | 43 | 23.3 Ų | 23.3 | 21% | 0.212 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -65.2 | -39.7 | 173 | -71.5 | -58.5 | -68.4 | 0 | 0 | 112 | I66 L67 L68 Y72 T74 V120 L124 | I66-M70 HydrophobicContact CG2-CG 4.33Å; I66-M70 WeakPolarHBondContact O-CB 3.38Å; I66-M70 VanDerWaalsContact O-CG 3.25Å; I66-M70 WeakPolarHBondContact O-CG 3.38Å; I66-M70 PolarHBondContact O-N 3.5Å; L67-M70 PolarHBondContact O-N 2.9Å; L68-M70 VanDerWaalsContact C-N 3.29Å; L68-M70 PolarHBondContact O-N 3.07Å; M70-Y72 VanDerWaalsContact C-N 3.32Å; M70-Y72 PolarHBondContact O-N 3.48Å; M70-T74 HydrophobicContact CE-CG2 3.62Å; M70-T74 WeakPolarHBondContact O-CB 3.31Å; M70-T74 VanDerWaalsContact O-CG2 3.32Å; M70-T74 WeakPolarHBondContact O-CG2 3.36Å; M70-T74 PolarHBondContact O-N 2.81Å; M70-T74 PolarHBondContact O-OG1 3.34Å; M70-T74 HydrophobicContact SD-CG2 4.25Å; M70-V120 HydrophobicContact CE-CG1 4.07Å; M70-V120 HydrophobicContact SD-CG1 4.48Å; M70-L124 HydrophobicContact CE-CB 3.82Å; M70-L124 HydrophobicContact CE-CD1 4.18Å; M70-L124 HydrophobicContact CE-CG 4.48Å |
| 71 | L | 93.8 | Very high | 91.8 | Very high | 10 Ų | 10 | 25.6 Ų | 25.6 | 5% | 0.052 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.7 | -40.6 | 176 | -179.1 | 63.1 | 0 | 0 | 0 | 112.5 | S35 Y36 L67 L68 A127 F130 | S35-L71 WeakPolarHBondContact O-CD2 3.46Å; Y36-L71 HydrophobicContact CD1-CD2 4.32Å; Y36-L71 HydrophobicContact CE1-CD2 4.39Å; L67-L71 PolarHBondContact O-N 3.2Å; L67-L71 VanDerWaalsContact O-N 3.13Å; L68-L71 HydrophobicContact CD1-CD2 3.96Å; L68-L71 WeakPolarHBondContact O-CB 3.25Å; L68-L71 PolarHBondContact O-N 3.37Å; L68-L71 VanDerWaalsContact O-N 3.15Å; L71-A127 HydrophobicContact CD1-CB 4.31Å; L71-F130 HydrophobicContact CD1-CB 3.93Å; L71-F130 HydrophobicContact CD1-CD1 4.04Å; L71-F130 HydrophobicContact CD1-CG 4.24Å |
| 72 | Y | 90.9 | Very high | 91.1 | Very high | 25 Ų | 25 | 26 Ų | 26 | 10% | 0.098 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -89.3 | -38.7 | -177.5 | -67.6 | -6.1 | 0 | 0 | 0 | 113.5 | Y36 L68 A69 M70 F247 E367 V371 | Y36-Y72 AromaticContact CE1-CE1 3.66Å; Y36-Y72 HydrophobicContact CE1-CE1 3.66Å; Y36-Y72 AromaticContact CE1-CZ 3.99Å; Y36-Y72 WeakPolarHBondContact CE1-OH 3.34Å; L68-Y72 HydrophobicContact CD2-CE2 4.05Å; L68-Y72 HydrophobicContact CG-CE2 4.29Å; L68-Y72 PolarHBondContact O-N 3.45Å; A69-Y72 PolarHBondContact O-N 3.35Å; M70-Y72 VanDerWaalsContact C-N 3.32Å; M70-Y72 PolarHBondContact O-N 3.48Å; Y72-F247 HydrophobicContact CE2-CE2 4.44Å; Y72-F247 HydrophobicContact CE2-CZ 4.35Å; Y72-F247 WeakPolarHBondContact OH-CZ 3.37Å; Y72-E367 HydrophobicContact CD2-CB 4.21Å; Y72-V371 HydrophobicContact CD2-CG1 4.41Å |
| 73 | G | 90.8 | Very high | 90.3 | Very high | 23 Ų | 23 | 26.7 Ų | 26.7 | 24% | 0.237 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -80.7 | -19.5 | -170.4 | 0 | 0 | 0 | 0 | 0 | 115 | A69 G75 | A69-G73 WeakPolarHBondContact O-CA 3.29Å; A69-G73 PolarHBondContact O-N 3.04Å; G73-G75 VanDerWaalsContact C-N 3.32Å; G73-G75 PolarHBondContact O-N 3.14Å |
| 74 | T | 89.9 | Confident | 89.7 | Confident | 16 Ų | 16 | 36.1 Ų | 36.1 | 10% | 0.098 | 19% | 0.192 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.6 | 12.7 | -175.9 | 60.3 | 0 | 0 | 0 | 0 | 114.3 | M70 L77 C78 L124 A127 | M70-T74 HydrophobicContact CE-CG2 3.62Å; M70-T74 WeakPolarHBondContact O-CB 3.31Å; M70-T74 VanDerWaalsContact O-CG2 3.32Å; M70-T74 WeakPolarHBondContact O-CG2 3.36Å; M70-T74 PolarHBondContact O-N 2.81Å; M70-T74 PolarHBondContact O-OG1 3.34Å; M70-T74 HydrophobicContact SD-CG2 4.25Å; T74-L77 WeakPolarHBondContact O-CB 3.44Å; T74-L77 PolarHBondContact O-N 2.86Å; T74-C78 PolarHBondContact O-N 2.88Å; T74-L124 HydrophobicContact CG2-CD1 3.95Å; T74-A127 WeakPolarHBondContact OG1-CB 3.34Å |
| 75 | G | 84.8 | Confident | 89.3 | Confident | 18 Ų | 18 | 41.3 Ų | 41.3 | 19% | 0.186 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -50.8 | -52.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | G73 L77 C78 S79 | G73-G75 VanDerWaalsContact C-N 3.32Å; G73-G75 PolarHBondContact O-N 3.14Å; G75-L77 PolarHBondContact O-N 2.91Å; G75-C78 PolarHBondContact O-N 3.35Å; G75-S79 PolarHBondContact O-N 3.08Å |
| 76 | P | 83.5 | Confident | 88.8 | Confident | 51 Ų | 51 | 42.8 Ų | 42.8 | 33% | 0.331 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -61.4 | -41.3 | 178.6 | -25.3 | 35.1 | 0 | 0 | 0 | 113.2 | S79 V80 L222 | P76-S79 WeakPolarHBondContact O-CB 3.5Å; P76-S79 PolarHBondContact O-N 3.36Å; P76-V80 WeakPolarHBondContact O-CG2 3.37Å; P76-V80 PolarHBondContact O-N 2.87Å; P76-L222 HydrophobicContact CG-CD1 4.47Å |
| 77 | L | 87.7 | Confident | 88.3 | Confident | 87 Ų | 87 | 41.9 Ų | 41.9 | 46% | 0.455 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -60.5 | -47.7 | 176.8 | 175.7 | 63.5 | 0 | 0 | 0 | 110.6 | T74 G75 S79 V80 M81 L124 | T74-L77 WeakPolarHBondContact O-CB 3.44Å; T74-L77 PolarHBondContact O-N 2.86Å; G75-L77 PolarHBondContact O-N 2.91Å; L77-S79 VanDerWaalsContact C-N 3.33Å; L77-S79 PolarHBondContact O-N 3.23Å; L77-V80 PolarHBondContact O-N 3.07Å; L77-M81 HydrophobicContact CD1-SD 4.45Å; L77-M81 HydrophobicContact CG-SD 4.34Å; L77-M81 WeakPolarHBondContact O-CG 3.48Å; L77-M81 PolarHBondContact O-N 3.47Å; L77-L124 HydrophobicContact CD2-CD1 4.11Å |
| 78 | C | 86.6 | Confident | 88.1 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.5 | -42.5 | 177.1 | -173.4 | 0 | 0 | 0 | 0 | 111.7 | T74 G75 V80 M81 V82 L128 Q131 P132 | T74-C78 PolarHBondContact O-N 2.88Å; G75-C78 PolarHBondContact O-N 3.35Å; C78-V80 VanDerWaalsContact C-N 3.33Å; C78-V80 PolarHBondContact O-N 3.49Å; C78-M81 PolarHBondContact O-N 2.85Å; C78-V82 WeakPolarHBondContact O-CG2 3.48Å; C78-V82 PolarHBondContact O-N 3.21Å; C78-L128 HydrophobicContact CB-CD2 4.02Å; C78-Q131 HydrophobicContact CB-CB 4.14Å; C78-Q131 HydrophobicContact CB-CG 3.97Å; C78-Q131 VanDerWaalsContact SG-CB 3.54Å; C78-P132 VanDerWaalsContact SG-CG 3.59Å |
| 79 | S | 81.5 | Confident | 88.1 | Confident | 5 Ų | 5 | 49.9 Ų | 49.9 | 4% | 0.035 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58.7 | -43.8 | 176.9 | -171.8 | 0 | 0 | 0 | 0 | 112.2 | G75 P76 L77 V82 N83 | G75-S79 PolarHBondContact O-N 3.08Å; P76-S79 WeakPolarHBondContact O-CB 3.5Å; P76-S79 PolarHBondContact O-N 3.36Å; L77-S79 VanDerWaalsContact C-N 3.33Å; L77-S79 PolarHBondContact O-N 3.23Å; S79-V82 PolarHBondContact O-N 3.06Å; S79-N83 WeakPolarHBondContact O-CB 3.38Å; S79-N83 PolarHBondContact O-N 3.24Å; S79-N83 PolarHBondContact O-ND2 3.29Å |
| 80 | V | 83.8 | Confident | 88 | Confident | 72 Ų | 72 | 49.4 Ų | 49.4 | 44% | 0.436 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 177.2 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | P76 L77 C78 N83 R84 L221 | P76-V80 WeakPolarHBondContact O-CG2 3.37Å; P76-V80 PolarHBondContact O-N 2.87Å; L77-V80 PolarHBondContact O-N 3.07Å; C78-V80 VanDerWaalsContact C-N 3.33Å; C78-V80 PolarHBondContact O-N 3.49Å; V80-N83 PolarHBondContact O-N 3.35Å; V80-R84 WeakPolarHBondContact O-CB 3.47Å; V80-R84 PolarHBondContact O-N 3.23Å; V80-R84 VanDerWaalsContact O-N 3.09Å; V80-L221 HydrophobicContact CG2-CD1 3.87Å |
| 81 | M | 84.8 | Confident | 88 | Confident | 47 Ų | 47 | 47.4 Ų | 47.4 | 23% | 0.232 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -64.7 | -43.4 | 179 | -68 | -177.2 | 78.2 | 0 | 0 | 112.2 | L77 C78 R84 F85 V90 L128 | L77-M81 HydrophobicContact CD1-SD 4.45Å; L77-M81 HydrophobicContact CG-SD 4.34Å; L77-M81 WeakPolarHBondContact O-CG 3.48Å; L77-M81 PolarHBondContact O-N 3.47Å; C78-M81 PolarHBondContact O-N 2.85Å; M81-R84 PolarHBondContact O-N 2.68Å; M81-F85 HydrophobicContact CB-CD2 4.45Å; M81-F85 WeakPolarHBondContact O-CB 3.44Å; M81-F85 WeakPolarHBondContact O-CD2 3.27Å; M81-F85 PolarHBondContact O-N 3.27Å; M81-V90 HydrophobicContact CB-CG1 4.33Å; M81-V90 HydrophobicContact CB-CG2 3.96Å; M81-L128 HydrophobicContact CE-CD1 4.43Å; M81-L128 HydrophobicContact SD-CD1 4.32Å; M81-L128 HydrophobicContact SD-CD2 3.72Å |
| 82 | V | 83.4 | Confident | 88.2 | Confident | 8 Ų | 8 | 50.4 Ų | 50.4 | 5% | 0.048 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.8 | -40.5 | 177.4 | 170.9 | 0 | 0 | 0 | 0 | 111.5 | C78 S79 R84 G86 C87 V90 P132 I135 | C78-V82 WeakPolarHBondContact O-CG2 3.48Å; C78-V82 PolarHBondContact O-N 3.21Å; S79-V82 PolarHBondContact O-N 3.06Å; V82-R84 VanDerWaalsContact C-N 3.28Å; V82-R84 PolarHBondContact O-N 3.32Å; V82-G86 WeakPolarHBondContact O-CA 3.37Å; V82-G86 PolarHBondContact O-N 3.26Å; V82-C87 WeakPolarHBondContact CG1-SG 3.04Å; V82-V90 HydrophobicContact CG2-CB 4.36Å; V82-V90 HydrophobicContact CG2-CG1 4.14Å; V82-V90 HydrophobicContact CG2-CG2 4.39Å; V82-P132 HydrophobicContact CG2-CB 3.71Å; V82-P132 HydrophobicContact CG2-CG 3.47Å; V82-P132 VanDerWaalsContact CG2-CG 3.47Å; V82-I135 HydrophobicContact CG1-CD1 4.06Å |
| 83 | N | 80.5 | Confident | 88.5 | Confident | 103 Ų | 103 | 52.1 Ų | 52.1 | 55% | 0.551 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -65 | -35 | 178.3 | -72.6 | -13.8 | 0 | 0 | 0 | 111.9 | S79 V80 | S79-N83 WeakPolarHBondContact O-CB 3.38Å; S79-N83 PolarHBondContact O-N 3.24Å; S79-N83 PolarHBondContact O-ND2 3.29Å; V80-N83 PolarHBondContact O-N 3.35Å |
| 84 | R | 85.6 | Confident | 88.8 | Confident | 199 Ų | 199 | 51 Ų | 51 | 75% | 0.751 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -84.4 | -39.4 | -178.8 | -171.5 | 172 | -176.9 | 172.4 | 1.9 | 113.8 | V80 M81 V82 | V80-R84 WeakPolarHBondContact O-CB 3.47Å; V80-R84 PolarHBondContact O-N 3.23Å; V80-R84 VanDerWaalsContact O-N 3.09Å; M81-R84 PolarHBondContact O-N 2.68Å; V82-R84 VanDerWaalsContact C-N 3.28Å; V82-R84 PolarHBondContact O-N 3.32Å |
| 85 | F | 86.9 | Confident | 89.2 | Confident | 114 Ų | 114 | 50.2 Ų | 50.2 | 50% | 0.5 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -116.6 | -5.9 | -169 | -56.6 | -64.9 | 0 | 0 | 0 | 113.9 | M81 P89 V90 | M81-F85 HydrophobicContact CB-CD2 4.45Å; M81-F85 WeakPolarHBondContact O-CB 3.44Å; M81-F85 WeakPolarHBondContact O-CD2 3.27Å; M81-F85 PolarHBondContact O-N 3.27Å; F85-P89 WeakPolarHBondContact O-CD 3.48Å; F85-P89 WeakPolarHBondContact O-CG 3.4Å; F85-V90 HydrophobicContact CB-CG2 4.07Å |
| 86 | G | 86.9 | Confident | 89.8 | Confident | 31 Ų | 31 | 54 Ų | 54 | 32% | 0.32 | 28% | 0.277 | S | S | . | . | trans | 79.8 | 167.1 | -173.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | V82 V90 | V82-G86 WeakPolarHBondContact O-CA 3.37Å; V82-G86 PolarHBondContact O-N 3.26Å; G86-V90 WeakPolarHBondContact O-CG2 3.3Å | ||
| 87 | C | 88.1 | Confident | 90.5 | Very high | 8 Ų | 8 | 55.3 Ų | 55.3 | 5% | 0.054 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -68.3 | -44.5 | -176.4 | -65.7 | 0 | 0 | 0 | 0 | 112.7 | V82 V90 M91 P132 M136 | V82-C87 WeakPolarHBondContact CG1-SG 3.04Å; C87-V90 PolarHBondContact O-N 2.86Å; C87-M91 HydrophobicContact CB-SD 4.45Å; C87-M91 WeakPolarHBondContact O-CG 3.35Å; C87-M91 PolarHBondContact O-N 3.42Å; C87-P132 HydrophobicContact CB-CB 3.95Å; C87-M136 HydrophobicContact CB-CG 3.58Å; C87-M136 HydrophobicContact CB-SD 3.7Å |
| 88 | R | 93.4 | Very high | 90.9 | Very high | 108 Ų | 108 | 51.1 Ų | 51.1 | 41% | 0.408 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.3 | -52.6 | -172 | 174.8 | 173.6 | 177.7 | -179 | 3.5 | 113.7 | V90 M91 M92 M197 | R88-V90 VanDerWaalsContact C-N 3.33Å; R88-V90 PolarHBondContact O-N 3.2Å; R88-M91 PolarHBondContact O-N 3.33Å; R88-M92 HydrophobicContact CG-SD 4.17Å; R88-M92 WeakPolarHBondContact O-CG 3.2Å; R88-M92 PolarHBondContact O-N 3.41Å; R88-M92 VanDerWaalsContact O-N 3.08Å; R88-M197 HydrophobicContact CB-CB 4.49Å; R88-M197 WeakPolarHBondContact CB-O 3.44Å |
| 89 | P | 94.7 | Very high | 91.5 | Very high | 66 Ų | 66 | 51.4 Ų | 51.4 | 43% | 0.429 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.2 | -39 | 178.8 | -23.8 | 36.7 | 0 | 0 | 0 | 112.5 | F85 M91 M92 V93 | F85-P89 WeakPolarHBondContact O-CD 3.48Å; F85-P89 WeakPolarHBondContact O-CG 3.4Å; P89-M91 PolarHBondContact O-N 3.26Å; P89-M92 PolarHBondContact O-N 2.97Å; P89-V93 WeakPolarHBondContact O-CG2 3.25Å; P89-V93 PolarHBondContact O-N 2.89Å |
| 90 | V | 95.2 | Very high | 92.3 | Very high | 4 Ų | 4 | 55 Ų | 55 | 2% | 0.024 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.7 | -44.2 | 179.2 | 174.7 | 0 | 0 | 0 | 0 | 111.3 | M81 V82 F85 G86 C87 R88 V93 G94 L128 P132 | M81-V90 HydrophobicContact CB-CG1 4.33Å; M81-V90 HydrophobicContact CB-CG2 3.96Å; V82-V90 HydrophobicContact CG2-CB 4.36Å; V82-V90 HydrophobicContact CG2-CG1 4.14Å; V82-V90 HydrophobicContact CG2-CG2 4.39Å; F85-V90 HydrophobicContact CB-CG2 4.07Å; G86-V90 WeakPolarHBondContact O-CG2 3.3Å; C87-V90 PolarHBondContact O-N 2.86Å; R88-V90 VanDerWaalsContact C-N 3.33Å; R88-V90 PolarHBondContact O-N 3.2Å; V90-V93 PolarHBondContact O-N 2.84Å; V90-G94 PolarHBondContact O-N 3.31Å; V90-L128 HydrophobicContact CG1-CB 4.25Å; V90-L128 HydrophobicContact CG1-CD2 4.03Å; V90-P132 HydrophobicContact CG1-CG 4.06Å |
| 91 | M | 96.1 | Very high | 93 | Very high | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -67.6 | -40.5 | 177.8 | -66.2 | 171.8 | 71.4 | 0 | 0 | 112 | I31 C87 R88 P89 V93 G94 G95 N129 P132 M197 | I31-M91 HydrophobicContact CD1-CE 3.17Å; C87-M91 HydrophobicContact CB-SD 4.45Å; C87-M91 WeakPolarHBondContact O-CG 3.35Å; C87-M91 PolarHBondContact O-N 3.42Å; R88-M91 PolarHBondContact O-N 3.33Å; P89-M91 PolarHBondContact O-N 3.26Å; M91-V93 PolarHBondContact O-N 3.41Å; M91-G94 PolarHBondContact O-N 2.98Å; M91-G95 PolarHBondContact O-N 3.08Å; M91-N129 PolarHBondContact O-OD1 3.03Å; M91-N129 VanDerWaalsContact O-OD1 3.06Å; M91-P132 HydrophobicContact CG-CB 3.71Å; M91-P132 HydrophobicContact CG-CG 3.85Å; M91-P132 HydrophobicContact SD-CB 3.78Å; M91-M197 HydrophobicContact CE-CE 3.6Å; M91-M197 HydrophobicContact CE-CG 3.66Å; M91-M197 HydrophobicContact CE-SD 4.06Å; M91-M197 HydrophobicContact SD-CB 4.28Å; M91-M197 HydrophobicContact SD-CG 3.62Å; M91-M197 HydrophobicContact SD-SD 4.33Å |
| 92 | M | 97.2 | Very high | 93.6 | Very high | 73 Ų | 73 | 49.3 Ų | 49.3 | 36% | 0.36 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.7 | -44.4 | 175.7 | -69.5 | 179.4 | 69.3 | 0 | 0 | 111.9 | R88 P89 G94 G95 L96 C191 A195 | R88-M92 HydrophobicContact CG-SD 4.17Å; R88-M92 WeakPolarHBondContact O-CG 3.2Å; R88-M92 PolarHBondContact O-N 3.41Å; R88-M92 VanDerWaalsContact O-N 3.08Å; P89-M92 PolarHBondContact O-N 2.97Å; M92-G94 VanDerWaalsContact C-N 3.34Å; M92-G95 PolarHBondContact O-N 2.99Å; M92-L96 WeakPolarHBondContact O-CG 3.45Å; M92-L96 PolarHBondContact O-N 3.5Å; M92-L96 VanDerWaalsContact O-N 3.15Å; M92-C191 PolarHBondContact O-SG 2.91Å; M92-A195 HydrophobicContact SD-CB 4.46Å |
| 93 | V | 97.1 | Very high | 94.3 | Very high | 61 Ų | 61 | 51.6 Ų | 51.6 | 37% | 0.37 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -64.6 | -40.3 | 174.1 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | P89 V90 M91 G95 L96 F97 | P89-V93 WeakPolarHBondContact O-CG2 3.25Å; P89-V93 PolarHBondContact O-N 2.89Å; V90-V93 PolarHBondContact O-N 2.84Å; M91-V93 PolarHBondContact O-N 3.41Å; V93-G95 VanDerWaalsContact C-N 3.3Å; V93-G95 PolarHBondContact O-N 2.76Å; V93-L96 WeakPolarHBondContact O-CB 3.41Å; V93-L96 PolarHBondContact O-N 3Å; V93-F97 HydrophobicContact CG1-CD2 4.13Å; V93-F97 HydrophobicContact CG1-CE2 3.95Å; V93-F97 HydrophobicContact CG1-CZ 4.48Å; V93-F97 PolarHBondContact O-N 2.76Å |
| 94 | G | 97 | Very high | 95.1 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -57.1 | -43.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | V90 M91 M92 L96 F97 A98 G125 N129 | V90-G94 PolarHBondContact O-N 3.31Å; M91-G94 PolarHBondContact O-N 2.98Å; M92-G94 VanDerWaalsContact C-N 3.34Å; G94-L96 VanDerWaalsContact C-N 3.35Å; G94-F97 PolarHBondContact O-N 2.8Å; G94-A98 WeakPolarHBondContact O-CB 3.24Å; G94-A98 PolarHBondContact O-N 3.43Å; G94-G125 CarbonylContact C-O 3.19Å; G94-G125 WeakPolarHBondContact CA-O 3.27Å; G94-G125 CarbonylContact O-C 3.5Å; G94-G125 WeakPolarHBondContact O-CA 3.16Å; G94-N129 PolarHBondContact O-ND2 3.39Å |
| 95 | G | 97.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -66.6 | -37.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | M91 M92 V93 A98 S99 N129 C191 | M91-G95 PolarHBondContact O-N 3.08Å; M92-G95 PolarHBondContact O-N 2.99Å; V93-G95 VanDerWaalsContact C-N 3.3Å; V93-G95 PolarHBondContact O-N 2.76Å; G95-A98 PolarHBondContact O-N 3.43Å; G95-S99 WeakPolarHBondContact O-CB 3.44Å; G95-S99 PolarHBondContact O-N 3.43Å; G95-N129 WeakPolarHBondContact CA-ND2 3.42Å; G95-N129 PolarHBondContact N-ND2 3.29Å; G95-C191 VanDerWaalsContact CA-SG 3.53Å |
| 96 | L | 98 | Very high | 96.2 | Very high | 97 Ų | 97 | 36 Ų | 36 | 51% | 0.508 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -63.4 | -43.6 | 173.1 | -69.5 | 172.4 | 0 | 0 | 0 | 111.4 | M92 V93 G94 S99 L100 L188 C191 | M92-L96 WeakPolarHBondContact O-CG 3.45Å; M92-L96 PolarHBondContact O-N 3.5Å; M92-L96 VanDerWaalsContact O-N 3.15Å; V93-L96 WeakPolarHBondContact O-CB 3.41Å; V93-L96 PolarHBondContact O-N 3Å; G94-L96 VanDerWaalsContact C-N 3.35Å; L96-S99 PolarHBondContact O-N 2.91Å; L96-L100 WeakPolarHBondContact O-CB 3.29Å; L96-L100 PolarHBondContact O-N 2.84Å; L96-L188 HydrophobicContact CD2-CD1 3.76Å; L96-C191 PolarHBondContact N-SG 3.12Å |
| 97 | F | 97.7 | Very high | 96.7 | Very high | 78 Ų | 78 | 41.6 Ų | 41.6 | 34% | 0.342 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -65.3 | -41.9 | 174.3 | -78.3 | -29.6 | 0 | 0 | 0 | 112.5 | V93 G94 S99 L100 G101 I121 L128 | V93-F97 HydrophobicContact CG1-CD2 4.13Å; V93-F97 HydrophobicContact CG1-CE2 3.95Å; V93-F97 HydrophobicContact CG1-CZ 4.48Å; V93-F97 PolarHBondContact O-N 2.76Å; G94-F97 PolarHBondContact O-N 2.8Å; F97-S99 VanDerWaalsContact C-N 3.32Å; F97-S99 PolarHBondContact O-N 2.88Å; F97-L100 PolarHBondContact O-N 3.16Å; F97-G101 PolarHBondContact O-N 3.17Å; F97-I121 HydrophobicContact CB-CG2 4.34Å; F97-I121 WeakPolarHBondContact O-CG2 3.49Å; F97-L128 HydrophobicContact CD2-CD1 4.27Å |
| 98 | A | 97.8 | Very high | 97.1 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -56.6 | -47.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | G94 G95 T122 L126 L187 | G94-A98 WeakPolarHBondContact O-CB 3.24Å; G94-A98 PolarHBondContact O-N 3.43Å; G95-A98 PolarHBondContact O-N 3.43Å; A98-T122 PolarHBondContact O-OG1 3.04Å; A98-L126 HydrophobicContact CB-CD2 4.37Å; A98-L126 HydrophobicContact CB-CG 4.37Å; A98-L187 HydrophobicContact CB-CB 4.21Å; A98-L187 HydrophobicContact CB-CD1 4.25Å; A98-L187 WeakPolarHBondContact O-CD1 3.41Å |
| 99 | S | 98.3 | Very high | 97.1 | Very high | 6 Ų | 6 | 41.3 Ų | 41.3 | 4% | 0.042 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -66.1 | -48.9 | 176 | 175.4 | 0 | 0 | 0 | 0 | 112.5 | G95 L96 F97 G101 M102 I103 G184 | G95-S99 WeakPolarHBondContact O-CB 3.44Å; G95-S99 PolarHBondContact O-N 3.43Å; L96-S99 PolarHBondContact O-N 2.91Å; F97-S99 VanDerWaalsContact C-N 3.32Å; F97-S99 PolarHBondContact O-N 2.88Å; S99-G101 VanDerWaalsContact C-N 3.32Å; S99-G101 PolarHBondContact O-N 3.26Å; S99-M102 PolarHBondContact O-N 2.9Å; S99-M102 VanDerWaalsContact O-N 3.13Å; S99-I103 WeakPolarHBondContact O-CG1 3.32Å; S99-I103 PolarHBondContact O-N 3.37Å; S99-I103 WeakPolarHBondContact OG-CD1 3.48Å; S99-G184 WeakPolarHBondContact CA-O 3.45Å; S99-G184 WeakPolarHBondContact CB-O 3.4Å; S99-G184 PolarHBondContact OG-O 3.41Å |
| 100 | L | 98.3 | Very high | 97.2 | Very high | 80 Ų | 80 | 40 Ų | 40 | 42% | 0.419 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.3 | -42.2 | -178 | -179.4 | 63.3 | 0 | 0 | 0 | 111.8 | L96 F97 M102 I103 L104 | L96-L100 WeakPolarHBondContact O-CB 3.29Å; L96-L100 PolarHBondContact O-N 2.84Å; F97-L100 PolarHBondContact O-N 3.16Å; L100-M102 VanDerWaalsContact C-N 3.33Å; L100-M102 PolarHBondContact O-N 3.04Å; L100-I103 PolarHBondContact O-N 3.26Å; L100-L104 HydrophobicContact CD1-CD1 4.11Å; L100-L104 HydrophobicContact CD1-CG 4.03Å; L100-L104 HydrophobicContact CG-CD1 3.88Å; L100-L104 HydrophobicContact CG-CG 4.24Å; L100-L104 WeakPolarHBondContact O-CB 3.42Å; L100-L104 VanDerWaalsContact O-CG 3.23Å; L100-L104 WeakPolarHBondContact O-CG 3.25Å; L100-L104 PolarHBondContact O-N 2.75Å |
| 101 | G | 98.1 | Very high | 97.2 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -59.4 | -42.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | F97 S99 A105 S117 T122 | F97-G101 PolarHBondContact O-N 3.17Å; S99-G101 VanDerWaalsContact C-N 3.32Å; S99-G101 PolarHBondContact O-N 3.26Å; G101-A105 WeakPolarHBondContact O-CB 3.49Å; G101-A105 PolarHBondContact O-N 3.16Å; G101-S117 WeakPolarHBondContact CA-O 3.48Å; G101-S117 VanDerWaalsContact O-CB 3.31Å; G101-S117 WeakPolarHBondContact O-CB 3.2Å; G101-T122 VanDerWaalsContact CA-OG1 3.27Å; G101-T122 WeakPolarHBondContact CA-OG1 3.49Å |
| 102 | M | 97.8 | Very high | 97.2 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -70.9 | -39 | 177.2 | -70 | -52.7 | -58.7 | 0 | 0 | 113.1 | F38 S99 L100 A105 S106 T118 T122 F180 L183 L187 | F38-M102 HydrophobicContact CE1-CE 4.3Å; F38-M102 HydrophobicContact CE1-CG 4.25Å; F38-M102 HydrophobicContact CE1-SD 3.62Å; F38-M102 HydrophobicContact CZ-CE 3.8Å; F38-M102 HydrophobicContact CZ-CG 3.9Å; F38-M102 HydrophobicContact CZ-SD 3.58Å; F38-M102 VanDerWaalsContact CZ-SD 3.58Å; S99-M102 PolarHBondContact O-N 2.9Å; S99-M102 VanDerWaalsContact O-N 3.13Å; L100-M102 VanDerWaalsContact C-N 3.33Å; L100-M102 PolarHBondContact O-N 3.04Å; M102-A105 WeakPolarHBondContact O-CB 3.41Å; M102-A105 PolarHBondContact O-N 3Å; M102-S106 PolarHBondContact O-N 2.87Å; M102-T118 HydrophobicContact SD-CG2 3.77Å; M102-T122 HydrophobicContact CG-CG2 4.13Å; M102-T122 PolarHBondContact N-OG1 3.38Å; M102-T122 HydrophobicContact SD-CG2 4.28Å; M102-F180 HydrophobicContact CE-CB 3.75Å; M102-F180 HydrophobicContact CE-CD1 3.48Å; M102-F180 VanDerWaalsContact CE-CD1 3.48Å; M102-F180 HydrophobicContact CE-CD2 4.2Å; M102-F180 HydrophobicContact CE-CE1 4.08Å; M102-F180 HydrophobicContact CE-CG 3.54Å; M102-L183 HydrophobicContact CE-CB 4.24Å; M102-L183 HydrophobicContact CE-CD1 4.35Å; M102-L187 HydrophobicContact CB-CD1 4.48Å; M102-L187 HydrophobicContact CG-CD1 3.46Å; M102-L187 VanDerWaalsContact CG-CD1 3.46Å |
| 103 | I | 98.2 | Very high | 97.2 | Very high | 56 Ų | 56 | 46.5 Ų | 46.5 | 29% | 0.287 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.1 | -46.3 | 175.5 | -65.4 | 168.4 | 0 | 0 | 0 | 109.9 | S99 L100 A105 S106 F107 L181 | S99-I103 WeakPolarHBondContact O-CG1 3.32Å; S99-I103 PolarHBondContact O-N 3.37Å; S99-I103 WeakPolarHBondContact OG-CD1 3.48Å; L100-I103 PolarHBondContact O-N 3.26Å; I103-A105 VanDerWaalsContact C-N 3.28Å; I103-A105 PolarHBondContact O-N 3.41Å; I103-S106 WeakPolarHBondContact O-CB 3.28Å; I103-S106 PolarHBondContact O-N 2.88Å; I103-S106 VanDerWaalsContact O-N 3.15Å; I103-S106 PolarHBondContact O-OG 3.45Å; I103-F107 HydrophobicContact CG2-CE2 4.18Å; I103-F107 VanDerWaalsContact O-CD2 3.25Å; I103-F107 WeakPolarHBondContact O-CD2 3.28Å; I103-L181 HydrophobicContact CB-CD1 4.39Å; I103-L181 HydrophobicContact CG1-CD1 4.11Å; I103-L181 HydrophobicContact CG2-CD1 3.93Å |
| 104 | L | 97.9 | Very high | 97.2 | Very high | 82 Ų | 82 | 43.6 Ų | 43.6 | 43% | 0.429 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.4 | -37.3 | 176 | -70.9 | 174.8 | 0 | 0 | 0 | 111.9 | L100 S106 F107 I121 | L100-L104 HydrophobicContact CD1-CD1 4.11Å; L100-L104 HydrophobicContact CD1-CG 4.03Å; L100-L104 HydrophobicContact CG-CD1 3.88Å; L100-L104 HydrophobicContact CG-CG 4.24Å; L100-L104 WeakPolarHBondContact O-CB 3.42Å; L100-L104 VanDerWaalsContact O-CG 3.23Å; L100-L104 WeakPolarHBondContact O-CG 3.25Å; L100-L104 PolarHBondContact O-N 2.75Å; L104-S106 VanDerWaalsContact C-N 3.26Å; L104-S106 PolarHBondContact O-N 3.49Å; L104-F107 PolarHBondContact O-N 3.01Å; L104-I121 HydrophobicContact CD1-CD1 4.14Å |
| 105 | A | 97.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61.6 | -32.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | G101 M102 I103 F107 S108 S117 T118 W176 F180 | G101-A105 WeakPolarHBondContact O-CB 3.49Å; G101-A105 PolarHBondContact O-N 3.16Å; M102-A105 WeakPolarHBondContact O-CB 3.41Å; M102-A105 PolarHBondContact O-N 3Å; I103-A105 VanDerWaalsContact C-N 3.28Å; I103-A105 PolarHBondContact O-N 3.41Å; A105-F107 PolarHBondContact O-N 3.29Å; A105-S108 VanDerWaalsContact O-CB 3.22Å; A105-S108 WeakPolarHBondContact O-CB 3.36Å; A105-S108 PolarHBondContact O-N 3.44Å; A105-S108 PolarHBondContact O-OG 3.38Å; A105-S117 WeakPolarHBondContact CA-OG 3.43Å; A105-S117 WeakPolarHBondContact CB-OG 3.31Å; A105-T118 WeakPolarHBondContact CB-OG1 3.49Å; A105-W176 WeakPolarHBondContact O-CZ3 3.33Å; A105-F180 HydrophobicContact CB-CD2 3.69Å; A105-F180 HydrophobicContact CB-CE2 4.28Å |
| 106 | S | 97.8 | Very high | 97.3 | Very high | 7 Ų | 7 | 49.9 Ų | 49.9 | 5% | 0.049 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.4 | -24.3 | 178.1 | 74.3 | 0 | 0 | 0 | 0 | 114.1 | M102 I103 L104 R177 | M102-S106 PolarHBondContact O-N 2.87Å; I103-S106 WeakPolarHBondContact O-CB 3.28Å; I103-S106 PolarHBondContact O-N 2.88Å; I103-S106 VanDerWaalsContact O-N 3.15Å; I103-S106 PolarHBondContact O-OG 3.45Å; L104-S106 VanDerWaalsContact C-N 3.26Å; L104-S106 PolarHBondContact O-N 3.49Å; S106-R177 WeakPolarHBondContact CB-O 3.46Å; S106-R177 WeakPolarHBondContact O-CD 3.37Å; S106-R177 VanDerWaalsContact O-CG 3.3Å; S106-R177 WeakPolarHBondContact O-CG 3.47Å |
| 107 | F | 96.9 | Very high | 97.3 | Very high | 148 Ų | 148 | 45.7 Ų | 45.7 | 65% | 0.649 | 23% | 0.234 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -99.4 | 10.6 | 177.4 | -58.3 | -77.6 | 0 | 0 | 0 | 112.9 | I103 L104 A105 | I103-F107 HydrophobicContact CG2-CE2 4.18Å; I103-F107 VanDerWaalsContact O-CD2 3.25Å; I103-F107 WeakPolarHBondContact O-CD2 3.28Å; L104-F107 PolarHBondContact O-N 3.01Å; A105-F107 PolarHBondContact O-N 3.29Å |
| 108 | S | 96.1 | Very high | 97.3 | Very high | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.007 | 22% | 0.218 | C | C | . | . | trans | -70.3 | 139.3 | -176.5 | 62.4 | 0 | 0 | 0 | 0 | 112.3 | A105 I114 W176 | A105-S108 VanDerWaalsContact O-CB 3.22Å; A105-S108 WeakPolarHBondContact O-CB 3.36Å; A105-S108 PolarHBondContact O-N 3.44Å; A105-S108 PolarHBondContact O-OG 3.38Å; S108-I114 WeakPolarHBondContact OG-CD1 3.33Å; S108-I114 WeakPolarHBondContact OG-CG1 3.46Å; S108-W176 VanDerWaalsContact OG-CH2 3.29Å; S108-W176 WeakPolarHBondContact OG-CH2 3.13Å; S108-W176 WeakPolarHBondContact OG-CZ3 3.5Å | ||
| 109 | T | 94.8 | Very high | 97.2 | Very high | 108 Ų | 108 | 42 Ų | 42 | 66% | 0.663 | 22% | 0.218 | S | C | * | . | S | Bend | trans | -114.9 | -2.1 | 179 | 54 | 0 | 0 | 0 | 0 | 112.4 | F53 | F53-T109 VanDerWaalsContact CE1-C 3.49Š|
| 110 | S | 95.3 | Very high | 97.2 | Very high | 40 Ų | 40 | 44.2 Ų | 44.2 | 28% | 0.28 | 23% | 0.231 | S | C | . | . | S | Bend | trans | -149 | 148.9 | 178.9 | 173.1 | 0 | 0 | 0 | 0 | 109.8 | I112 H113 I114 | S110-I112 PolarHBondContact O-N 3.48Å; S110-I112 PolarHBondContact OG-N 2.98Å; S110-H113 WeakPolarHBondContact O-CB 3.38Å; S110-H113 PolarHBondContact O-N 2.93Å; S110-I114 PolarHBondContact O-N 3.36Å |
| 111 | I | 95.8 | Very high | 97.2 | Very high | 17 Ų | 17 | 42.9 Ų | 42.9 | 9% | 0.087 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -57.7 | -31.6 | 176 | -162.1 | 66.6 | 0 | 0 | 0 | 112.3 | F53 V55 T60 I63 H113 I114 Y115 | F53-I111 HydrophobicContact CD2-CD1 4.26Å; V55-I111 HydrophobicContact CG1-CB 4.39Å; V55-I111 HydrophobicContact CG1-CG2 4.23Å; V55-I111 HydrophobicContact CG2-CD1 4.36Å; V55-I111 HydrophobicContact CG2-CG1 4.49Å; T60-I111 HydrophobicContact CG2-CD1 4.44Å; I63-I111 HydrophobicContact CD1-CD1 4.07Å; I111-H113 VanDerWaalsContact C-N 3.31Å; I111-H113 PolarHBondContact O-N 3.5Å; I111-I114 HydrophobicContact CD1-CD1 4.39Å; I111-I114 WeakPolarHBondContact O-CA 3.48Å; I111-I114 WeakPolarHBondContact O-CB 3.27Å; I111-I114 PolarHBondContact O-N 3.41Å; I111-Y115 HydrophobicContact CD1-CE1 4.27Å; I111-Y115 HydrophobicContact CG1-CD1 4.41Å; I111-Y115 HydrophobicContact CG1-CE1 3.6Å; I111-Y115 HydrophobicContact CG1-CE2 4.49Å; I111-Y115 WeakPolarHBondContact CG1-OH 3.39Å; I111-Y115 HydrophobicContact CG2-CE2 4.4Å; I111-Y115 WeakPolarHBondContact O-CD1 3.5Å; I111-Y115 PolarHBondContact O-N 3.3Å |
| 112 | I | 96.3 | Very high | 97.2 | Very high | 99 Ų | 99 | 42.9 Ų | 42.9 | 51% | 0.508 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -65.1 | -37.1 | 177.6 | -58.7 | 174.6 | 0 | 0 | 0 | 110.8 | S110 I114 Y115 L116 | S110-I112 PolarHBondContact O-N 3.48Å; S110-I112 PolarHBondContact OG-N 2.98Å; I112-I114 VanDerWaalsContact C-N 3.25Å; I112-I114 PolarHBondContact O-N 3.28Å; I112-Y115 WeakPolarHBondContact O-CB 3.26Å; I112-Y115 PolarHBondContact O-N 2.85Å; I112-L116 HydrophobicContact CG2-CD1 4.44Å; I112-L116 WeakPolarHBondContact O-CG 3.43Å; I112-L116 PolarHBondContact O-N 3Å |
| 113 | H | 96.5 | Very high | 97.2 | Very high | 96 Ų | 96 | 42.9 Ų | 42.9 | 44% | 0.444 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.3 | -35.4 | 174 | -68 | 172.8 | 0 | 0 | 0 | 110.9 | S110 I111 L116 S117 | S110-H113 WeakPolarHBondContact O-CB 3.38Å; S110-H113 PolarHBondContact O-N 2.93Å; I111-H113 VanDerWaalsContact C-N 3.31Å; I111-H113 PolarHBondContact O-N 3.5Å; H113-L116 PolarHBondContact O-N 3.15Å; H113-S117 WeakPolarHBondContact O-CB 3.47Å; H113-S117 PolarHBondContact O-N 2.98Å; H113-S117 PolarHBondContact O-OG 3.45Å |
| 114 | I | 97.7 | Very high | 97.2 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -68.6 | -40.2 | 175.5 | -59.6 | -178.7 | 0 | 0 | 0 | 110.9 | L49 F53 I63 S108 S110 I111 I112 L116 S117 T118 G119 W176 | L49-I114 HydrophobicContact CD1-CD1 4.47Å; L49-I114 HydrophobicContact CD2-CD1 3.62Å; F53-I114 HydrophobicContact CD2-CD1 4.4Å; F53-I114 HydrophobicContact CE2-CD1 3.52Å; F53-I114 HydrophobicContact CZ-CD1 4.01Å; I63-I114 HydrophobicContact CD1-CG2 3.64Å; I63-I114 HydrophobicContact CG1-CG2 3.89Å; I63-I114 HydrophobicContact CG2-CG2 4.1Å; S108-I114 WeakPolarHBondContact OG-CD1 3.33Å; S108-I114 WeakPolarHBondContact OG-CG1 3.46Å; S110-I114 PolarHBondContact O-N 3.36Å; I111-I114 HydrophobicContact CD1-CD1 4.39Å; I111-I114 WeakPolarHBondContact O-CA 3.48Å; I111-I114 WeakPolarHBondContact O-CB 3.27Å; I111-I114 PolarHBondContact O-N 3.41Å; I112-I114 VanDerWaalsContact C-N 3.25Å; I112-I114 PolarHBondContact O-N 3.28Å; I114-L116 VanDerWaalsContact C-N 3.35Å; I114-L116 PolarHBondContact O-N 3.08Å; I114-S117 WeakPolarHBondContact CA-OG 3.42Å; I114-S117 PolarHBondContact O-N 3.32Å; I114-T118 WeakPolarHBondContact O-CA 3.34Å; I114-T118 WeakPolarHBondContact O-CB 3.24Å; I114-T118 PolarHBondContact O-N 2.91Å; I114-G119 PolarHBondContact O-N 3.32Å; I114-W176 HydrophobicContact CD1-CH2 4.34Å; I114-W176 HydrophobicContact CD1-CZ3 4.15Å |
| 115 | Y | 98.1 | Very high | 97.2 | Very high | 35 Ų | 35 | 38 Ų | 38 | 14% | 0.137 | 20% | 0.199 | C | C | . | . | I | π-helix | trans | -58.6 | -45.6 | 173.9 | -60.8 | -16.8 | 0 | 0 | 0 | 112.1 | D59 W62 I63 I66 I111 I112 G119 V120 | D59-Y115 WeakPolarHBondContact CA-OH 3.34Å; D59-Y115 VanDerWaalsContact CB-OH 3.27Å; D59-Y115 WeakPolarHBondContact CB-OH 3.42Å; D59-Y115 WeakPolarHBondContact O-CE1 3.24Å; D59-Y115 PolarHBondContact O-OH 3Å; W62-Y115 HydrophobicContact CB-CD1 4.27Å; W62-Y115 HydrophobicContact CB-CE1 3.78Å; W62-Y115 HydrophobicContact CB-CE2 4.49Å; I63-Y115 HydrophobicContact CG1-CD1 3.78Å; I63-Y115 HydrophobicContact CG1-CE1 3.79Å; I66-Y115 HydrophobicContact CD1-CD1 4.4Å; I66-Y115 HydrophobicContact CD1-CG 4.08Å; I111-Y115 HydrophobicContact CD1-CE1 4.27Å; I111-Y115 HydrophobicContact CG1-CD1 4.41Å; I111-Y115 HydrophobicContact CG1-CE1 3.6Å; I111-Y115 HydrophobicContact CG1-CE2 4.49Å; I111-Y115 WeakPolarHBondContact CG1-OH 3.39Å; I111-Y115 HydrophobicContact CG2-CE2 4.4Å; I111-Y115 WeakPolarHBondContact O-CD1 3.5Å; I111-Y115 PolarHBondContact O-N 3.3Å; I112-Y115 WeakPolarHBondContact O-CB 3.26Å; I112-Y115 PolarHBondContact O-N 2.85Å; Y115-G119 CarbonylContact O-C 3.55Å; Y115-G119 WeakPolarHBondContact O-CA 3.31Å; Y115-G119 PolarHBondContact O-N 3.38Å; Y115-G119 VanDerWaalsContact O-N 3.15Å; Y115-V120 PolarHBondContact O-N 3.09Å |
| 116 | L | 98.1 | Very high | 97.1 | Very high | 98 Ų | 98 | 38 Ų | 38 | 51% | 0.513 | 20% | 0.199 | S | C | . | . | I | π-helix | trans | -70.5 | -42.4 | 179.8 | -66.1 | 176.6 | 0 | 0 | 0 | 112 | I112 H113 I114 V120 I121 | I112-L116 HydrophobicContact CG2-CD1 4.44Å; I112-L116 WeakPolarHBondContact O-CG 3.43Å; I112-L116 PolarHBondContact O-N 3Å; H113-L116 PolarHBondContact O-N 3.15Å; I114-L116 VanDerWaalsContact C-N 3.35Å; I114-L116 PolarHBondContact O-N 3.08Å; L116-V120 WeakPolarHBondContact O-CB 3.29Å; L116-V120 PolarHBondContact O-N 3.03Å; L116-I121 WeakPolarHBondContact O-CG1 3.29Å; L116-I121 PolarHBondContact O-N 2.91Å |
| 117 | S | 98 | Very high | 97 | Very high | 8 Ų | 8 | 37.8 Ų | 37.8 | 6% | 0.056 | 20% | 0.197 | C | C | . | . | I | π-helix | trans | -80.7 | -63.2 | -175.1 | 61.1 | 0 | 0 | 0 | 0 | 112.6 | G101 A105 H113 I114 I121 T122 | G101-S117 WeakPolarHBondContact CA-O 3.48Å; G101-S117 VanDerWaalsContact O-CB 3.31Å; G101-S117 WeakPolarHBondContact O-CB 3.2Å; A105-S117 WeakPolarHBondContact CA-OG 3.43Å; A105-S117 WeakPolarHBondContact CB-OG 3.31Å; H113-S117 WeakPolarHBondContact O-CB 3.47Å; H113-S117 PolarHBondContact O-N 2.98Å; H113-S117 PolarHBondContact O-OG 3.45Å; I114-S117 WeakPolarHBondContact CA-OG 3.42Å; I114-S117 PolarHBondContact O-N 3.32Å; S117-I121 WeakPolarHBondContact O-CB 3.3Å; S117-I121 PolarHBondContact O-N 3.5Å; S117-T122 PolarHBondContact O-N 3.28Å; S117-T122 PolarHBondContact O-OG1 3.15Å |
| 118 | T | 97.3 | Very high | 97 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 17% | 0.167 | C | C | . | . | I | π-helix | trans | -74 | -41.8 | -179.8 | -57.3 | 0 | 0 | 0 | 0 | 111.6 | V42 I63 L67 M102 A105 I114 T122 | V42-T118 HydrophobicContact CG1-CG2 4.45Å; I63-T118 HydrophobicContact CG2-CG2 3.69Å; L67-T118 HydrophobicContact CD1-CG2 4.11Å; L67-T118 WeakPolarHBondContact CD1-O 3.39Å; M102-T118 HydrophobicContact SD-CG2 3.77Å; A105-T118 WeakPolarHBondContact CB-OG1 3.49Å; I114-T118 WeakPolarHBondContact O-CA 3.34Å; I114-T118 WeakPolarHBondContact O-CB 3.24Å; I114-T118 PolarHBondContact O-N 2.91Å; T118-T122 VanDerWaalsContact O-CB 3.32Å; T118-T122 WeakPolarHBondContact O-CB 3.36Å |
| 119 | G | 97.3 | Very high | 96.9 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 17% | 0.167 | C | C | . | . | I | π-helix | trans | -69 | -67.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112 | L67 I114 Y115 G123 | L67-G119 WeakPolarHBondContact CA-O 3.24Å; I114-G119 PolarHBondContact O-N 3.32Å; Y115-G119 CarbonylContact O-C 3.55Å; Y115-G119 WeakPolarHBondContact O-CA 3.31Å; Y115-G119 PolarHBondContact O-N 3.38Å; Y115-G119 VanDerWaalsContact O-N 3.15Å; G119-G123 WeakPolarHBondContact O-CA 3.4Å; G119-G123 PolarHBondContact O-N 3.47Å; G119-G123 VanDerWaalsContact O-N 3.15Å |
| 120 | V | 98.1 | Very high | 96.8 | Very high | 54 Ų | 54 | 25.9 Ų | 25.9 | 33% | 0.327 | 14% | 0.136 | S | C | . | . | I | π-helix | trans | -77.8 | -56.2 | -169.9 | -177.8 | 0 | 0 | 0 | 0 | 112.7 | I66 M70 Y115 L116 L124 | I66-V120 HydrophobicContact CG2-CG2 3.7Å; M70-V120 HydrophobicContact CE-CG1 4.07Å; M70-V120 HydrophobicContact SD-CG1 4.48Å; Y115-V120 PolarHBondContact O-N 3.09Å; L116-V120 WeakPolarHBondContact O-CB 3.29Å; L116-V120 PolarHBondContact O-N 3.03Å; V120-L124 VanDerWaalsContact O-CB 3.25Å; V120-L124 WeakPolarHBondContact O-CB 3.19Å; V120-L124 PolarHBondContact O-N 3.02Å |
| 121 | I | 98.3 | Very high | 96.5 | Very high | 51 Ų | 51 | 24.5 Ų | 24.5 | 26% | 0.262 | 13% | 0.125 | S | C | . | . | I | π-helix | trans | -67.9 | -50.3 | -173.7 | -64 | 170 | 0 | 0 | 0 | 110.6 | F97 L104 L116 S117 L124 G125 | F97-I121 HydrophobicContact CB-CG2 4.34Å; F97-I121 WeakPolarHBondContact O-CG2 3.49Å; L104-I121 HydrophobicContact CD1-CD1 4.14Å; L116-I121 WeakPolarHBondContact O-CG1 3.29Å; L116-I121 PolarHBondContact O-N 2.91Å; S117-I121 WeakPolarHBondContact O-CB 3.3Å; S117-I121 PolarHBondContact O-N 3.5Å; I121-L124 PolarHBondContact O-N 2.96Å; I121-G125 PolarHBondContact O-N 2.89Å |
| 122 | T | 98.3 | Very high | 96.2 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 12% | 0.121 | C | C | . | . | I | π-helix | trans | -67 | -40.1 | 178.2 | -63.5 | 0 | 0 | 0 | 0 | 111.9 | F38 L67 A98 G101 M102 S117 T118 G125 L126 L187 | F38-T122 HydrophobicContact CE1-CG2 4.2Å; L67-T122 HydrophobicContact CD1-CG2 4.33Å; A98-T122 PolarHBondContact O-OG1 3.04Å; G101-T122 VanDerWaalsContact CA-OG1 3.27Å; G101-T122 WeakPolarHBondContact CA-OG1 3.49Å; M102-T122 HydrophobicContact CG-CG2 4.13Å; M102-T122 PolarHBondContact N-OG1 3.38Å; M102-T122 HydrophobicContact SD-CG2 4.28Å; S117-T122 PolarHBondContact O-N 3.28Å; S117-T122 PolarHBondContact O-OG1 3.15Å; T118-T122 VanDerWaalsContact O-CB 3.32Å; T118-T122 WeakPolarHBondContact O-CB 3.36Å; T122-G125 PolarHBondContact O-N 2.62Å; T122-L126 HydrophobicContact CG2-CD1 4.06Å; T122-L126 HydrophobicContact CG2-CG 4.37Å; T122-L126 WeakPolarHBondContact O-CG 3.36Å; T122-L126 PolarHBondContact O-N 3.34Å; T122-L187 HydrophobicContact CG2-CD1 3.78Å |
| 123 | G | 97.5 | Very high | 96.1 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.6 | -45.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | G119 G125 L126 A127 | G119-G123 WeakPolarHBondContact O-CA 3.4Å; G119-G123 PolarHBondContact O-N 3.47Å; G119-G123 VanDerWaalsContact O-N 3.15Å; G123-G125 PolarHBondContact O-N 3.24Å; G123-L126 PolarHBondContact O-N 3.44Å; G123-A127 WeakPolarHBondContact O-CB 3.27Å; G123-A127 PolarHBondContact O-N 3.05Å |
| 124 | L | 97.2 | Very high | 95.6 | Very high | 37 Ų | 37 | 15 Ų | 15 | 19% | 0.194 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -61.2 | -44 | 174.1 | -179.9 | 63.3 | 0 | 0 | 0 | 111.4 | M70 T74 L77 V120 I121 L126 A127 L128 | M70-L124 HydrophobicContact CE-CB 3.82Å; M70-L124 HydrophobicContact CE-CD1 4.18Å; M70-L124 HydrophobicContact CE-CG 4.48Å; T74-L124 HydrophobicContact CG2-CD1 3.95Å; L77-L124 HydrophobicContact CD2-CD1 4.11Å; V120-L124 VanDerWaalsContact O-CB 3.25Å; V120-L124 WeakPolarHBondContact O-CB 3.19Å; V120-L124 PolarHBondContact O-N 3.02Å; I121-L124 PolarHBondContact O-N 2.96Å; L124-L126 PolarHBondContact O-N 3.04Å; L124-A127 WeakPolarHBondContact O-CB 3.49Å; L124-A127 PolarHBondContact O-N 3.35Å; L124-L128 HydrophobicContact CD1-CD1 4.34Å; L124-L128 HydrophobicContact CD1-CG 4.27Å; L124-L128 HydrophobicContact CG-CD1 4.16Å; L124-L128 HydrophobicContact CG-CG 4.46Å; L124-L128 WeakPolarHBondContact O-CG 3.18Å; L124-L128 PolarHBondContact O-N 3.24Å |
| 125 | G | 97.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -59.4 | -44.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | G94 I121 T122 G123 A127 L128 N129 | G94-G125 CarbonylContact C-O 3.19Å; G94-G125 WeakPolarHBondContact CA-O 3.27Å; G94-G125 CarbonylContact O-C 3.5Å; G94-G125 WeakPolarHBondContact O-CA 3.16Å; I121-G125 PolarHBondContact O-N 2.89Å; T122-G125 PolarHBondContact O-N 2.62Å; G123-G125 PolarHBondContact O-N 3.24Å; G125-A127 VanDerWaalsContact C-N 3.34Å; G125-L128 PolarHBondContact O-N 2.99Å; G125-N129 PolarHBondContact O-N 3.31Å; G125-N129 VanDerWaalsContact O-N 3.15Å; G125-N129 PolarHBondContact O-ND2 3.04Å |
| 126 | L | 97.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -66.3 | -34.5 | 175.5 | -72.2 | 173.7 | 0 | 0 | 0 | 112.4 | F34 S35 F38 L67 A98 T122 G123 L124 N129 F130 L187 | F34-L126 HydrophobicContact CB-CD2 4.06Å; S35-L126 PolarHBondContact OG-O 3.45Å; F38-L126 HydrophobicContact CB-CD1 4.44Å; F38-L126 HydrophobicContact CD1-CD1 4.33Å; L67-L126 HydrophobicContact CD2-CD1 3.91Å; A98-L126 HydrophobicContact CB-CD2 4.37Å; A98-L126 HydrophobicContact CB-CG 4.37Å; T122-L126 HydrophobicContact CG2-CD1 4.06Å; T122-L126 HydrophobicContact CG2-CG 4.37Å; T122-L126 WeakPolarHBondContact O-CG 3.36Å; T122-L126 PolarHBondContact O-N 3.34Å; G123-L126 PolarHBondContact O-N 3.44Å; L124-L126 PolarHBondContact O-N 3.04Å; L126-N129 PolarHBondContact O-N 2.74Å; L126-F130 VanDerWaalsContact O-CB 3.31Å; L126-F130 WeakPolarHBondContact O-CB 3.22Å; L126-F130 PolarHBondContact O-N 3.22Å; L126-L187 HydrophobicContact CD2-CD2 3.93Å |
| 127 | A | 95.4 | Very high | 94 | Very high | 2 Ų | 2 | 9.8 Ų | 9.8 | 2% | 0.017 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -66.2 | -45.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L71 T74 G123 L124 G125 N129 F130 Q131 | L71-A127 HydrophobicContact CD1-CB 4.31Å; T74-A127 WeakPolarHBondContact OG1-CB 3.34Å; G123-A127 WeakPolarHBondContact O-CB 3.27Å; G123-A127 PolarHBondContact O-N 3.05Å; L124-A127 WeakPolarHBondContact O-CB 3.49Å; L124-A127 PolarHBondContact O-N 3.35Å; G125-A127 VanDerWaalsContact C-N 3.34Å; A127-N129 PolarHBondContact O-N 3.35Å; A127-F130 PolarHBondContact O-N 2.9Å; A127-Q131 WeakPolarHBondContact O-CB 3.31Å; A127-Q131 PolarHBondContact O-N 2.98Å |
| 128 | L | 95.6 | Very high | 93.3 | Very high | 2 Ų | 2 | 11.6 Ų | 11.6 | 1% | 0.01 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -67.3 | -17.3 | 176.8 | -66.4 | 178.5 | 0 | 0 | 0 | 113.1 | C78 M81 V90 F97 L124 G125 P132 | C78-L128 HydrophobicContact CB-CD2 4.02Å; M81-L128 HydrophobicContact CE-CD1 4.43Å; M81-L128 HydrophobicContact SD-CD1 4.32Å; M81-L128 HydrophobicContact SD-CD2 3.72Å; V90-L128 HydrophobicContact CG1-CB 4.25Å; V90-L128 HydrophobicContact CG1-CD2 4.03Å; F97-L128 HydrophobicContact CD2-CD1 4.27Å; L124-L128 HydrophobicContact CD1-CD1 4.34Å; L124-L128 HydrophobicContact CD1-CG 4.27Å; L124-L128 HydrophobicContact CG-CD1 4.16Å; L124-L128 HydrophobicContact CG-CG 4.46Å; L124-L128 WeakPolarHBondContact O-CG 3.18Å; L124-L128 PolarHBondContact O-N 3.24Å; G125-L128 PolarHBondContact O-N 2.99Å; L128-P132 WeakPolarHBondContact O-CD 3.46Å; L128-P132 WeakPolarHBondContact O-CG 3.34Å |
| 129 | N | 95.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -86.1 | -51 | 168.2 | -82.8 | -78.2 | 0 | 0 | 0 | 112.5 | I31 M91 G94 G95 G125 L126 A127 P132 S133 | I31-N129 HydrophobicContact CD1-CB 4.41Å; I31-N129 HydrophobicContact CG1-CB 4.44Å; I31-N129 HydrophobicContact CG2-CB 3.8Å; M91-N129 PolarHBondContact O-OD1 3.03Å; M91-N129 VanDerWaalsContact O-OD1 3.06Å; G94-N129 PolarHBondContact O-ND2 3.39Å; G95-N129 WeakPolarHBondContact CA-ND2 3.42Å; G95-N129 PolarHBondContact N-ND2 3.29Å; G125-N129 PolarHBondContact O-N 3.31Å; G125-N129 VanDerWaalsContact O-N 3.15Å; G125-N129 PolarHBondContact O-ND2 3.04Å; L126-N129 PolarHBondContact O-N 2.74Å; A127-N129 PolarHBondContact O-N 3.35Å; N129-P132 WeakPolarHBondContact O-CD 3.34Å; N129-S133 WeakPolarHBondContact O-CB 3.44Å; N129-S133 PolarHBondContact O-N 2.83Å |
| 130 | F | 93.1 | Very high | 92.2 | Very high | 4 Ų | 4 | 17.6 Ų | 17.6 | 2% | 0.018 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -62.4 | -50.7 | -171.6 | 176 | -120.4 | 0 | 0 | 0 | 111.9 | M1 I31 T32 S35 Y36 L71 L126 A127 S133 L134 | M1-F130 HydrophobicContact CG-CZ 4.33Å; I31-F130 HydrophobicContact CG2-CB 4.41Å; T32-F130 HydrophobicContact CG2-CE2 4.22Å; S35-F130 WeakPolarHBondContact OG-CB 3.07Å; Y36-F130 HydrophobicContact CD2-CE2 4.26Å; Y36-F130 HydrophobicContact CD2-CZ 4.45Å; Y36-F130 HydrophobicContact CE2-CD2 4.19Å; Y36-F130 AromaticContact CE2-CE1 3.96Å; Y36-F130 HydrophobicContact CE2-CE1 3.96Å; Y36-F130 AromaticContact CE2-CE2 3.44Å; Y36-F130 HydrophobicContact CE2-CE2 3.44Å; Y36-F130 VanDerWaalsContact CE2-CE2 3.44Å; Y36-F130 AromaticContact CE2-CZ 3.29Å; Y36-F130 HydrophobicContact CE2-CZ 3.29Å; Y36-F130 AromaticContact CZ-CE1 3.95Å; Y36-F130 AromaticContact CZ-CZ 3.63Å; Y36-F130 WeakPolarHBondContact OH-CE1 3.45Å; Y36-F130 VanDerWaalsContact OH-CZ 3.22Å; Y36-F130 WeakPolarHBondContact OH-CZ 3.42Å; L71-F130 HydrophobicContact CD1-CB 3.93Å; L71-F130 HydrophobicContact CD1-CD1 4.04Å; L71-F130 HydrophobicContact CD1-CG 4.24Å; L126-F130 VanDerWaalsContact O-CB 3.31Å; L126-F130 WeakPolarHBondContact O-CB 3.22Å; L126-F130 PolarHBondContact O-N 3.22Å; A127-F130 PolarHBondContact O-N 2.9Å; F130-S133 PolarHBondContact O-N 3.37Å; F130-S133 PolarHBondContact O-OG 3.03Å; F130-L134 HydrophobicContact CD2-CD1 4.49Å; F130-L134 HydrophobicContact CE1-CD1 3.88Å; F130-L134 HydrophobicContact CE2-CD1 3.76Å; F130-L134 HydrophobicContact CE2-CD2 4.44Å; F130-L134 HydrophobicContact CE2-CG 4.07Å; F130-L134 HydrophobicContact CZ-CD1 3.42Å; F130-L134 VanDerWaalsContact CZ-CD1 3.42Å; F130-L134 HydrophobicContact CZ-CG 4.24Å; F130-L134 PolarHBondContact O-N 3.35Å |
| 131 | Q | 89.1 | Confident | 91.5 | Very high | 12 Ų | 12 | 15.1 Ų | 15.1 | 6% | 0.056 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -63 | -47.8 | -171.3 | -179.7 | 57.8 | 40.3 | 0 | 0 | 112.6 | G2 C78 A127 S133 L134 I135 | G2-Q131 PolarHBondContact O-NE2 2.61Å; C78-Q131 HydrophobicContact CB-CB 4.14Å; C78-Q131 HydrophobicContact CB-CG 3.97Å; C78-Q131 VanDerWaalsContact SG-CB 3.54Å; A127-Q131 WeakPolarHBondContact O-CB 3.31Å; A127-Q131 PolarHBondContact O-N 2.98Å; Q131-S133 VanDerWaalsContact C-N 3.34Å; Q131-S133 PolarHBondContact O-N 3.09Å; Q131-L134 PolarHBondContact O-N 3.47Å; Q131-I135 WeakPolarHBondContact O-CG1 3.45Å |
| 132 | P | 89.2 | Confident | 90.7 | Very high | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -74 | -23.9 | 178.2 | -11.1 | 28 | 0 | 0 | 0 | 113.4 | C78 V82 C87 V90 M91 L128 N129 L134 I135 M136 | C78-P132 VanDerWaalsContact SG-CG 3.59Å; V82-P132 HydrophobicContact CG2-CB 3.71Å; V82-P132 HydrophobicContact CG2-CG 3.47Å; V82-P132 VanDerWaalsContact CG2-CG 3.47Å; C87-P132 HydrophobicContact CB-CB 3.95Å; V90-P132 HydrophobicContact CG1-CG 4.06Å; M91-P132 HydrophobicContact CG-CB 3.71Å; M91-P132 HydrophobicContact CG-CG 3.85Å; M91-P132 HydrophobicContact SD-CB 3.78Å; L128-P132 WeakPolarHBondContact O-CD 3.46Å; L128-P132 WeakPolarHBondContact O-CG 3.34Å; N129-P132 WeakPolarHBondContact O-CD 3.34Å; P132-L134 VanDerWaalsContact C-N 3.31Å; P132-L134 PolarHBondContact O-N 2.99Å; P132-I135 WeakPolarHBondContact O-CB 3.4Å; P132-I135 PolarHBondContact O-N 3.44Å; P132-M136 WeakPolarHBondContact O-CG 3.41Å; P132-M136 PolarHBondContact O-N 2.84Å |
| 133 | S | 93.1 | Very high | 89.8 | Confident | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59.6 | -42.5 | 174.5 | 76.9 | 0 | 0 | 0 | 0 | 111.6 | C28 N129 F130 Q131 I135 M136 L137 | C28-S133 PolarHBondContact SG-O 3.44Å; N129-S133 WeakPolarHBondContact O-CB 3.44Å; N129-S133 PolarHBondContact O-N 2.83Å; F130-S133 PolarHBondContact O-N 3.37Å; F130-S133 PolarHBondContact O-OG 3.03Å; Q131-S133 VanDerWaalsContact C-N 3.34Å; Q131-S133 PolarHBondContact O-N 3.09Å; S133-I135 PolarHBondContact O-N 3.12Å; S133-M136 PolarHBondContact O-N 3.09Å; S133-L137 WeakPolarHBondContact O-CB 3.45Å; S133-L137 PolarHBondContact O-N 3.48Å |
| 134 | L | 87 | Confident | 89.1 | Confident | 11 Ų | 11 | 27.6 Ų | 27.6 | 6% | 0.058 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -65.8 | -36.6 | 176.3 | -70.8 | 174.3 | 0 | 0 | 0 | 112.8 | M1 F130 Q131 P132 N138 | M1-L134 HydrophobicContact CB-CD1 3.86Å; M1-L134 HydrophobicContact CG-CD1 3.55Å; M1-L134 HydrophobicContact SD-CD1 4.3Å; F130-L134 HydrophobicContact CD2-CD1 4.49Å; F130-L134 HydrophobicContact CE1-CD1 3.88Å; F130-L134 HydrophobicContact CE2-CD1 3.76Å; F130-L134 HydrophobicContact CE2-CD2 4.44Å; F130-L134 HydrophobicContact CE2-CG 4.07Å; F130-L134 HydrophobicContact CZ-CD1 3.42Å; F130-L134 VanDerWaalsContact CZ-CD1 3.42Å; F130-L134 HydrophobicContact CZ-CG 4.24Å; F130-L134 PolarHBondContact O-N 3.35Å; Q131-L134 PolarHBondContact O-N 3.47Å; P132-L134 VanDerWaalsContact C-N 3.31Å; P132-L134 PolarHBondContact O-N 2.99Å; L134-N138 PolarHBondContact O-N 3.21Å; L134-N138 VanDerWaalsContact O-N 3.11Å; L134-N138 PolarHBondContact O-ND2 3.47Å |
| 135 | I | 86.4 | Confident | 88.2 | Confident | 19 Ų | 19 | 29.4 Ų | 29.4 | 10% | 0.097 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -62.5 | -49.1 | 175.9 | -57.1 | 171.1 | 0 | 0 | 0 | 109.4 | A4 V82 Q131 P132 S133 L137 N138 R139 | A4-I135 HydrophobicContact CB-CD1 3.17Å; A4-I135 HydrophobicContact CB-CG1 3.66Å; V82-I135 HydrophobicContact CG1-CD1 4.06Å; Q131-I135 WeakPolarHBondContact O-CG1 3.45Å; P132-I135 WeakPolarHBondContact O-CB 3.4Å; P132-I135 PolarHBondContact O-N 3.44Å; S133-I135 PolarHBondContact O-N 3.12Å; I135-L137 PolarHBondContact O-N 3.4Å; I135-N138 PolarHBondContact O-N 3.38Å; I135-R139 WeakPolarHBondContact O-CG 3.31Å; I135-R139 PolarHBondContact O-N 3.46Å |
| 136 | M | 86.2 | Confident | 87.4 | Confident | 6 Ų | 6 | 34.3 Ų | 34.3 | 3% | 0.03 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -62.6 | -42.8 | -180 | -71.6 | -58.3 | -62.6 | 0 | 0 | 111.8 | V24 C87 P132 S133 N138 R139 Y140 M197 K198 | V24-M136 HydrophobicContact CG1-CB 4.3Å; C87-M136 HydrophobicContact CB-CG 3.58Å; C87-M136 HydrophobicContact CB-SD 3.7Å; P132-M136 WeakPolarHBondContact O-CG 3.41Å; P132-M136 PolarHBondContact O-N 2.84Å; S133-M136 PolarHBondContact O-N 3.09Å; M136-N138 PolarHBondContact O-N 3.06Å; M136-R139 PolarHBondContact O-N 2.94Å; M136-Y140 HydrophobicContact CE-CD2 4.14Å; M136-Y140 HydrophobicContact CE-CE2 3.58Å; M136-Y140 WeakPolarHBondContact O-CD2 3.37Å; M136-Y140 PolarHBondContact O-N 3.33Å; M136-M197 HydrophobicContact CB-SD 3.82Å; M136-M197 HydrophobicContact CE-CB 4.32Å; M136-M197 HydrophobicContact CG-CB 4.26Å; M136-M197 HydrophobicContact CG-SD 4.15Å; M136-K198 VanDerWaalsContact CE-O 3.27Å; M136-K198 WeakPolarHBondContact CE-O 3.35Å |
| 137 | L | 87.5 | Confident | 86.8 | Confident | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -58.1 | -47.4 | 177.1 | -167.9 | 63.1 | 0 | 0 | 0 | 111.9 | L25 C28 S133 I135 R139 Y140 F141 A148 N149 | L25-L137 HydrophobicContact CB-CD1 3.96Å; L25-L137 HydrophobicContact CD1-CD1 4.45Å; L25-L137 HydrophobicContact CG-CD1 4.24Å; C28-L137 HydrophobicContact CB-CD1 4.39Å; C28-L137 HydrophobicContact CB-CD2 4.27Å; S133-L137 WeakPolarHBondContact O-CB 3.45Å; S133-L137 PolarHBondContact O-N 3.48Å; I135-L137 PolarHBondContact O-N 3.4Å; L137-R139 VanDerWaalsContact C-N 3.28Å; L137-R139 PolarHBondContact O-N 3.16Å; L137-Y140 PolarHBondContact O-N 2.82Å; L137-F141 HydrophobicContact CD1-CD2 3.91Å; L137-F141 HydrophobicContact CD1-CE2 3.91Å; L137-F141 PolarHBondContact O-N 2.91Å; L137-F141 VanDerWaalsContact O-N 3.12Å; L137-A148 HydrophobicContact CD1-CB 4.03Å; L137-A148 HydrophobicContact CD2-CB 4.48Å; L137-A148 HydrophobicContact CG-CB 4.14Å; L137-N149 WeakPolarHBondContact CD2-OD1 3.4Å |
| 138 | N | 83.2 | Confident | 86.4 | Confident | 45 Ų | 45 | 38.6 Ų | 38.6 | 24% | 0.241 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -72.6 | -17.5 | 179.8 | -71.3 | -54.9 | 0 | 0 | 0 | 114 | L134 I135 M136 F141 R145 N149 | L134-N138 PolarHBondContact O-N 3.21Å; L134-N138 VanDerWaalsContact O-N 3.11Å; L134-N138 PolarHBondContact O-ND2 3.47Å; I135-N138 PolarHBondContact O-N 3.38Å; M136-N138 PolarHBondContact O-N 3.06Å; N138-F141 CarbonylContact C-O 3.5Å; N138-R145 PolarHBondContact O-NE 3.35Å; N138-R145 VanDerWaalsContact O-NE 3.15Å; N138-R145 PolarHBondContact O-NH2 3.2Å; N138-N149 PolarHBondContact OD1-ND2 3.1Å |
| 139 | R | 84.8 | Confident | 86 | Confident | 122 Ų | 122 | 40.5 Ų | 40.5 | 46% | 0.46 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -80.1 | -34.5 | 170.1 | -74.6 | 177.2 | 175.8 | -171.1 | -2.4 | 112.5 | I135 M136 L137 | I135-R139 WeakPolarHBondContact O-CG 3.31Å; I135-R139 PolarHBondContact O-N 3.46Å; M136-R139 PolarHBondContact O-N 2.94Å; L137-R139 VanDerWaalsContact C-N 3.28Å; L137-R139 PolarHBondContact O-N 3.16Å |
| 140 | Y | 86.4 | Confident | 85.6 | Confident | 5 Ų | 5 | 42.4 Ų | 42.4 | 2% | 0.02 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -80.7 | -29.3 | -178.2 | -93.4 | -97.4 | 0 | 0 | 0 | 113.9 | P16 D17 W20 V24 M136 L137 K198 L200 | P16-Y140 VanDerWaalsContact CD-O 3.28Å; P16-Y140 WeakPolarHBondContact CD-O 3.45Å; P16-Y140 HydrophobicContact CG-CD1 3.64Å; P16-Y140 HydrophobicContact CG-CE1 4.14Å; P16-Y140 HydrophobicContact CG-CG 4.41Å; D17-Y140 PolarHBondContact N-O 3.25Å; W20-Y140 HydrophobicContact CB-CE1 4.25Å; V24-Y140 HydrophobicContact CB-CG 4.47Å; V24-Y140 HydrophobicContact CG1-CD2 4.29Å; V24-Y140 HydrophobicContact CG1-CG 4.45Å; V24-Y140 HydrophobicContact CG2-CD1 4.28Å; V24-Y140 HydrophobicContact CG2-CD2 4.14Å; V24-Y140 HydrophobicContact CG2-CE1 4.1Å; V24-Y140 HydrophobicContact CG2-CE2 3.97Å; V24-Y140 HydrophobicContact CG2-CG 4.27Å; M136-Y140 HydrophobicContact CE-CD2 4.14Å; M136-Y140 HydrophobicContact CE-CE2 3.58Å; M136-Y140 WeakPolarHBondContact O-CD2 3.37Å; M136-Y140 PolarHBondContact O-N 3.33Å; L137-Y140 PolarHBondContact O-N 2.82Å; Y140-K198 WeakPolarHBondContact CE2-O 3.32Å; Y140-K198 PolarHBondContact OH-O 2.76Å; Y140-L200 HydrophobicContact CD2-CD1 4.16Å; Y140-L200 HydrophobicContact CD2-CG 4.37Å; Y140-L200 HydrophobicContact CE1-CD2 3.94Å; Y140-L200 HydrophobicContact CE2-CD1 4.12Å; Y140-L200 HydrophobicContact CE2-CD2 4.07Å; Y140-L200 HydrophobicContact CE2-CG 3.81Å |
| 141 | F | 84.1 | Confident | 85.5 | Confident | 1 Ų | 1 | 45.7 Ų | 45.7 | 0% | 0.004 | 24% | 0.238 | C | C | . | . | trans | -114.6 | 137.6 | 176.9 | -63.7 | -81.1 | 0 | 0 | 0 | 109.7 | D17 G21 W22 L25 L137 N138 K144 R145 A148 | D17-F141 VanDerWaalsContact OD1-CA 3.32Å; D17-F141 WeakPolarHBondContact OD1-CA 3.41Å; G21-F141 VanDerWaalsContact O-CE2 3.29Å; G21-F141 WeakPolarHBondContact O-CE2 3.24Å; G21-F141 WeakPolarHBondContact O-CZ 3.45Å; W22-F141 HydrophobicContact CD2-CZ 4.42Å; W22-F141 HydrophobicContact CE3-CZ 4.34Å; L25-F141 HydrophobicContact CB-CE2 4.15Å; L25-F141 HydrophobicContact CB-CZ 4.47Å; L25-F141 HydrophobicContact CD1-CE2 4.2Å; L25-F141 HydrophobicContact CD1-CZ 4.25Å; L137-F141 HydrophobicContact CD1-CD2 3.91Å; L137-F141 HydrophobicContact CD1-CE2 3.91Å; L137-F141 PolarHBondContact O-N 2.91Å; L137-F141 VanDerWaalsContact O-N 3.12Å; N138-F141 CarbonylContact C-O 3.5Å; F141-K144 HydrophobicContact CD1-CB 3.94Å; F141-R145 HydrophobicContact CB-CG 4.25Å; F141-R145 WeakPolarHBondContact O-CD 3.28Å; F141-R145 WeakPolarHBondContact O-CG 3.26Å; F141-R145 PolarHBondContact O-NE 2.75Å; F141-A148 HydrophobicContact CB-CB 4.09Å; F141-A148 HydrophobicContact CD1-CB 4.38Å; F141-A148 HydrophobicContact CD2-CB 3.52Å; F141-A148 HydrophobicContact CE2-CB 4Å; F141-A148 HydrophobicContact CG-CB 3.73Å | ||
| 142 | N | 81.1 | Confident | 85.6 | Confident | 76 Ų | 76 | 45.2 Ų | 45.2 | 41% | 0.406 | 24% | 0.236 | S | C | . | . | S | Bend | trans | -118.9 | -62.9 | 169.2 | -170 | 20.4 | 0 | 0 | 0 | 109.9 | A15 D17 K144 R145 | A15-N142 HydrophobicContact CB-CB 3.69Å; D17-N142 PolarHBondContact OD1-N 3.39Å; D17-N142 PolarHBondContact OD2-N 3.23Å; N142-K144 VanDerWaalsContact C-N 3.33Å; N142-K144 PolarHBondContact O-N 3.48Å; N142-R145 WeakPolarHBondContact O-CD 3.14Å; N142-R145 VanDerWaalsContact O-CG 3.29Å; N142-R145 WeakPolarHBondContact O-CG 3.39Å; N142-R145 PolarHBondContact O-N 3.04Å; N142-R145 VanDerWaalsContact OD1-CZ 3.31Å; N142-R145 PolarHBondContact OD1-NH1 3.06Å |
| 143 | L | 78.8 | Confident | 85.6 | Confident | 150 Ų | 150 | 46.3 Ų | 46.3 | 79% | 0.785 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -67.4 | -35.5 | 179.1 | -64.6 | 174.4 | 0 | 0 | 0 | 112 | D17 | D17-L143 PolarHBondContact OD1-N 3.49Å; D17-L143 VanDerWaalsContact OD1-N 3.14Å; D17-L143 PolarHBondContact OD2-N 2.91Å; D17-L143 VanDerWaalsContact OD2-N 3.09Å |
| 144 | K | 82.3 | Confident | 85.5 | Confident | 87 Ų | 87 | 47.3 Ų | 47.3 | 38% | 0.378 | 25% | 0.253 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.7 | 18.3 | -178.4 | -59.3 | 174.6 | -173.4 | 163 | 0 | 113.2 | D17 F141 N142 L147 A148 | D17-K144 PolarHBondContact O-NZ 3.02Å; D17-K144 PolarHBondContact OD1-N 3.29Å; D17-K144 VanDerWaalsContact OD1-N 3.17Å; F141-K144 HydrophobicContact CD1-CB 3.94Å; N142-K144 VanDerWaalsContact C-N 3.33Å; N142-K144 PolarHBondContact O-N 3.48Å; K144-L147 PolarHBondContact O-N 3.44Å; K144-A148 WeakPolarHBondContact O-CB 3.18Å; K144-A148 PolarHBondContact O-N 3.13Å |
| 145 | R | 79.8 | Confident | 85.8 | Confident | 75 Ų | 75 | 46.8 Ų | 46.8 | 28% | 0.283 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -52.5 | -48.6 | -179.9 | -79.7 | 173.6 | 178.6 | 170.6 | 1.8 | 114 | N138 F141 N142 L147 A148 N149 | N138-R145 PolarHBondContact O-NE 3.35Å; N138-R145 VanDerWaalsContact O-NE 3.15Å; N138-R145 PolarHBondContact O-NH2 3.2Å; F141-R145 HydrophobicContact CB-CG 4.25Å; F141-R145 WeakPolarHBondContact O-CD 3.28Å; F141-R145 WeakPolarHBondContact O-CG 3.26Å; F141-R145 PolarHBondContact O-NE 2.75Å; N142-R145 WeakPolarHBondContact O-CD 3.14Å; N142-R145 VanDerWaalsContact O-CG 3.29Å; N142-R145 WeakPolarHBondContact O-CG 3.39Å; N142-R145 PolarHBondContact O-N 3.04Å; N142-R145 VanDerWaalsContact OD1-CZ 3.31Å; N142-R145 PolarHBondContact OD1-NH1 3.06Å; R145-L147 VanDerWaalsContact C-N 3.32Å; R145-L147 PolarHBondContact O-N 2.96Å; R145-A148 PolarHBondContact O-N 3.35Å; R145-N149 WeakPolarHBondContact O-CB 2.92Å; R145-N149 PolarHBondContact O-N 2.94Å; R145-N149 PolarHBondContact O-ND2 2.91Å |
| 146 | P | 79.3 | Confident | 86.2 | Confident | 103 Ų | 103 | 46.3 Ų | 46.3 | 67% | 0.669 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -63 | -40.2 | -179.1 | -22.8 | 35.2 | 0 | 0 | 0 | 112.1 | G150 | P146-G150 PolarHBondContact O-N 3.37Å |
| 147 | L | 85.1 | Confident | 86.6 | Confident | 89 Ų | 89 | 46.1 Ų | 46.1 | 47% | 0.466 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -63.6 | -47.4 | 176 | -179.6 | 68.3 | 0 | 0 | 0 | 111.1 | K144 R145 G150 L151 | K144-L147 PolarHBondContact O-N 3.44Å; R145-L147 VanDerWaalsContact C-N 3.32Å; R145-L147 PolarHBondContact O-N 2.96Å; L147-G150 PolarHBondContact O-N 3.32Å; L147-L151 HydrophobicContact CD1-CD1 3.7Å; L147-L151 HydrophobicContact CG-CD1 4.23Å; L147-L151 WeakPolarHBondContact O-CD1 3.3Å; L147-L151 PolarHBondContact O-N 3.43Å |
| 148 | A | 86.9 | Confident | 87 | Confident | 3 Ų | 3 | 48.7 Ų | 48.7 | 3% | 0.025 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62.5 | -47.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L25 L137 F141 K144 R145 L151 S152 | L25-A148 HydrophobicContact CD1-CB 3.92Å; L137-A148 HydrophobicContact CD1-CB 4.03Å; L137-A148 HydrophobicContact CD2-CB 4.48Å; L137-A148 HydrophobicContact CG-CB 4.14Å; F141-A148 HydrophobicContact CB-CB 4.09Å; F141-A148 HydrophobicContact CD1-CB 4.38Å; F141-A148 HydrophobicContact CD2-CB 3.52Å; F141-A148 HydrophobicContact CE2-CB 4Å; F141-A148 HydrophobicContact CG-CB 3.73Å; K144-A148 WeakPolarHBondContact O-CB 3.18Å; K144-A148 PolarHBondContact O-N 3.13Å; R145-A148 PolarHBondContact O-N 3.35Å; A148-L151 PolarHBondContact O-N 3.49Å; A148-S152 WeakPolarHBondContact O-CB 3.23Å; A148-S152 PolarHBondContact O-N 3.27Å |
| 149 | N | 87.4 | Confident | 87.7 | Confident | 42 Ų | 42 | 48.4 Ų | 48.4 | 23% | 0.225 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.4 | -40.8 | 176 | -74.4 | -40.9 | 0 | 0 | 0 | 111.6 | L137 N138 R145 S152 A153 | L137-N149 WeakPolarHBondContact CD2-OD1 3.4Å; N138-N149 PolarHBondContact OD1-ND2 3.1Å; R145-N149 WeakPolarHBondContact O-CB 2.92Å; R145-N149 PolarHBondContact O-N 2.94Å; R145-N149 PolarHBondContact O-ND2 2.91Å; N149-S152 PolarHBondContact O-N 3.36Å; N149-A153 VanDerWaalsContact O-CB 3.25Å; N149-A153 WeakPolarHBondContact O-CB 3.21Å; N149-A153 PolarHBondContact O-N 3.37Å |
| 150 | G | 85.9 | Confident | 88.2 | Confident | 40 Ų | 40 | 42.7 Ų | 42.7 | 41% | 0.412 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.3 | -47.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | P146 L147 A153 A154 | P146-G150 PolarHBondContact O-N 3.37Å; L147-G150 PolarHBondContact O-N 3.32Å; G150-A153 PolarHBondContact O-N 2.92Å; G150-A154 PolarHBondContact O-N 3.26Å; G150-A154 VanDerWaalsContact O-N 3.08Å |
| 151 | L | 91 | Very high | 88.6 | Confident | 74 Ų | 74 | 43.5 Ų | 43.5 | 39% | 0.387 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.5 | -46.6 | 175.8 | -98.6 | 66.7 | 0 | 0 | 0 | 111.4 | L25 F29 L147 A148 A153 A154 | L25-L151 HydrophobicContact CD1-CB 4.25Å; L25-L151 HydrophobicContact CD1-CD2 4.35Å; L25-L151 HydrophobicContact CD2-CB 4.19Å; L25-L151 HydrophobicContact CD2-CD2 4.14Å; F29-L151 VanDerWaalsContact CD2-O 3.27Å; F29-L151 WeakPolarHBondContact CD2-O 3.42Å; L147-L151 HydrophobicContact CD1-CD1 3.7Å; L147-L151 HydrophobicContact CG-CD1 4.23Å; L147-L151 WeakPolarHBondContact O-CD1 3.3Å; L147-L151 PolarHBondContact O-N 3.43Å; A148-L151 PolarHBondContact O-N 3.49Å; L151-A153 VanDerWaalsContact C-N 3.31Å; L151-A153 PolarHBondContact O-N 3.36Å; L151-A154 WeakPolarHBondContact O-CB 3.39Å; L151-A154 PolarHBondContact O-N 3.18Å |
| 152 | S | 92.8 | Very high | 89.2 | Confident | 1 Ų | 1 | 45.5 Ų | 45.5 | 1% | 0.007 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.3 | -42.8 | 177.6 | -171.6 | 0 | 0 | 0 | 0 | 111.8 | C28 T32 A148 N149 A154 G155 | C28-S152 VanDerWaalsContact C-OG 3.29Å; C28-S152 VanDerWaalsContact CB-OG 3.28Å; C28-S152 WeakPolarHBondContact CB-OG 3.14Å; C28-S152 PolarHBondContact O-OG 2.95Å; T32-S152 VanDerWaalsContact CB-O 3.31Å; T32-S152 WeakPolarHBondContact CB-O 3.49Å; T32-S152 WeakPolarHBondContact CG2-O 3.37Å; T32-S152 PolarHBondContact OG1-OG 3.48Å; T32-S152 VanDerWaalsContact OG1-OG 3.07Å; A148-S152 WeakPolarHBondContact O-CB 3.23Å; A148-S152 PolarHBondContact O-N 3.27Å; N149-S152 PolarHBondContact O-N 3.36Å; S152-A154 VanDerWaalsContact C-N 3.32Å; S152-A154 PolarHBondContact O-N 3.44Å; S152-G155 PolarHBondContact O-N 2.97Å; S152-G155 VanDerWaalsContact O-N 3.14Å |
| 153 | A | 89 | Confident | 89.9 | Confident | 24 Ų | 24 | 42.4 Ų | 42.4 | 20% | 0.198 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.9 | -34.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | N149 G150 L151 G155 S156 | N149-A153 VanDerWaalsContact O-CB 3.25Å; N149-A153 WeakPolarHBondContact O-CB 3.21Å; N149-A153 PolarHBondContact O-N 3.37Å; G150-A153 PolarHBondContact O-N 2.92Å; L151-A153 VanDerWaalsContact C-N 3.31Å; L151-A153 PolarHBondContact O-N 3.36Å; A153-G155 PolarHBondContact O-N 2.89Å; A153-G155 VanDerWaalsContact O-N 3.15Å; A153-S156 PolarHBondContact O-N 3.21Å |
| 154 | A | 90.1 | Very high | 90.7 | Very high | 20 Ų | 20 | 35.2 Ų | 35.2 | 17% | 0.165 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.3 | -16.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | G150 L151 S152 S156 P157 V158 | G150-A154 PolarHBondContact O-N 3.26Å; G150-A154 VanDerWaalsContact O-N 3.08Å; L151-A154 WeakPolarHBondContact O-CB 3.39Å; L151-A154 PolarHBondContact O-N 3.18Å; S152-A154 VanDerWaalsContact C-N 3.32Å; S152-A154 PolarHBondContact O-N 3.44Å; A154-S156 VanDerWaalsContact C-N 3.28Å; A154-S156 PolarHBondContact O-N 3.19Å; A154-P157 VanDerWaalsContact O-CD 3.23Å; A154-P157 WeakPolarHBondContact O-CD 3.06Å; A154-P157 WeakPolarHBondContact O-CG 3.46Å; A154-V158 WeakPolarHBondContact O-CG2 3.35Å; A154-V158 PolarHBondContact O-N 2.6Å |
| 155 | G | 94.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -59.9 | -35.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | F29 G33 S152 A153 V158 F159 | F29-G155 VanDerWaalsContact CE2-N 3.33Å; G33-G155 WeakPolarHBondContact CA-O 3.14Å; S152-G155 PolarHBondContact O-N 2.97Å; S152-G155 VanDerWaalsContact O-N 3.14Å; A153-G155 PolarHBondContact O-N 2.89Å; A153-G155 VanDerWaalsContact O-N 3.15Å; G155-V158 PolarHBondContact O-N 3.2Å; G155-F159 WeakPolarHBondContact O-CB 3.32Å; G155-F159 VanDerWaalsContact O-CD2 3.32Å; G155-F159 WeakPolarHBondContact O-CD2 3.34Å; G155-F159 PolarHBondContact O-N 2.93Å |
| 156 | S | 94.1 | Very high | 92.1 | Very high | 10 Ų | 10 | 32.4 Ų | 32.4 | 7% | 0.07 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -56.9 | -58.1 | 179.8 | 173.9 | 0 | 0 | 0 | 0 | 113.2 | Y36 A37 A153 A154 V158 F159 L160 | Y36-S156 WeakPolarHBondContact CB-OG 3.26Å; A37-S156 WeakPolarHBondContact CB-O 3.47Å; A153-S156 PolarHBondContact O-N 3.21Å; A154-S156 VanDerWaalsContact C-N 3.28Å; A154-S156 PolarHBondContact O-N 3.19Å; S156-V158 VanDerWaalsContact C-N 3.34Å; S156-V158 PolarHBondContact O-N 3.33Å; S156-F159 PolarHBondContact O-N 3.14Å; S156-L160 PolarHBondContact O-N 3.39Å |
| 157 | P | 94.7 | Very high | 92.9 | Very high | 1 Ų | 1 | 27.5 Ų | 27.5 | 1% | 0.006 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -67.7 | -32.4 | -179.1 | 25.8 | -36 | 0 | 0 | 0 | 113.2 | A154 L160 C161 G275 D278 I279 | A154-P157 VanDerWaalsContact O-CD 3.23Å; A154-P157 WeakPolarHBondContact O-CD 3.06Å; A154-P157 WeakPolarHBondContact O-CG 3.46Å; P157-L160 PolarHBondContact O-N 2.9Å; P157-C161 PolarHBondContact O-N 3.42Å; P157-C161 PolarHBondContact O-SG 3.4Å; P157-G275 VanDerWaalsContact CB-O 3.31Å; P157-G275 WeakPolarHBondContact CB-O 3.45Å; P157-D278 HydrophobicContact CB-CB 3.83Å; P157-D278 HydrophobicContact CG-CB 4.48Å; P157-I279 HydrophobicContact CB-CG1 3.78Å; P157-I279 HydrophobicContact CG-CG1 3.95Å |
| 158 | V | 96.3 | Very high | 93.5 | Very high | 55 Ų | 55 | 23.3 Ų | 23.3 | 33% | 0.333 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -61.7 | -46.6 | 174.7 | 173 | 0 | 0 | 0 | 0 | 111.3 | F29 A154 G155 S156 L160 C161 G162 I279 | F29-V158 HydrophobicContact CE1-CG1 4.37Å; F29-V158 HydrophobicContact CZ-CB 3.96Å; F29-V158 HydrophobicContact CZ-CG1 4.03Å; F29-V158 HydrophobicContact CZ-CG2 4.01Å; A154-V158 WeakPolarHBondContact O-CG2 3.35Å; A154-V158 PolarHBondContact O-N 2.6Å; G155-V158 PolarHBondContact O-N 3.2Å; S156-V158 VanDerWaalsContact C-N 3.34Å; S156-V158 PolarHBondContact O-N 3.33Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 3.06Å; V158-C161 WeakPolarHBondContact O-CB 3.46Å; V158-C161 PolarHBondContact O-N 3.21Å; V158-G162 PolarHBondContact O-N 3.25Å; V158-I279 HydrophobicContact CG2-CD1 3.72Å; V158-I279 HydrophobicContact CG2-CG1 3.95Å |
| 159 | F | 97.3 | Very high | 94 | Very high | 39 Ų | 39 | 28 Ų | 28 | 17% | 0.171 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -67.2 | -35.6 | 177.6 | -88.9 | -114.3 | 0 | 0 | 0 | 111.8 | F29 V30 F34 A37 G155 S156 C161 G162 L163 | F29-F159 HydrophobicContact CD1-CE2 4.07Å; F29-F159 HydrophobicContact CE1-CD2 4.26Å; F29-F159 AromaticContact CE1-CE2 3.83Å; F29-F159 HydrophobicContact CE1-CE2 3.83Å; V30-F159 HydrophobicContact CB-CZ 4.09Å; V30-F159 HydrophobicContact CG1-CE1 4.21Å; V30-F159 HydrophobicContact CG1-CZ 3.84Å; V30-F159 HydrophobicContact CG2-CE2 4.47Å; V30-F159 HydrophobicContact CG2-CZ 4.04Å; F34-F159 HydrophobicContact CD1-CD1 4.11Å; F34-F159 HydrophobicContact CD1-CE1 4.26Å; F34-F159 HydrophobicContact CD2-CD1 4.31Å; F34-F159 AromaticContact CD2-CE1 3.8Å; F34-F159 HydrophobicContact CD2-CE1 3.8Å; F34-F159 HydrophobicContact CE1-CD1 4.14Å; F34-F159 HydrophobicContact CE1-CE1 4.05Å; F34-F159 HydrophobicContact CE2-CD1 4.35Å; F34-F159 AromaticContact CE2-CE1 3.57Å; F34-F159 HydrophobicContact CE2-CE1 3.57Å; F34-F159 HydrophobicContact CE2-CZ 4.43Å; F34-F159 HydrophobicContact CG-CD1 4.19Å; F34-F159 HydrophobicContact CG-CE1 4.14Å; F34-F159 HydrophobicContact CZ-CD1 4.27Å; F34-F159 AromaticContact CZ-CE1 3.7Å; F34-F159 HydrophobicContact CZ-CE1 3.7Å; A37-F159 HydrophobicContact CB-CB 3.79Å; G155-F159 WeakPolarHBondContact O-CB 3.32Å; G155-F159 VanDerWaalsContact O-CD2 3.32Å; G155-F159 WeakPolarHBondContact O-CD2 3.34Å; G155-F159 PolarHBondContact O-N 2.93Å; S156-F159 PolarHBondContact O-N 3.14Å; F159-C161 VanDerWaalsContact C-N 3.3Å; F159-C161 PolarHBondContact O-N 2.99Å; F159-G162 PolarHBondContact O-N 3.05Å; F159-L163 HydrophobicContact CB-CD1 4.09Å; F159-L163 HydrophobicContact CD1-CD1 4.09Å; F159-L163 HydrophobicContact CD1-CG 4.5Å; F159-L163 WeakPolarHBondContact O-CB 3.24Å; F159-L163 VanDerWaalsContact O-CG 3.22Å; F159-L163 WeakPolarHBondContact O-CG 3.34Å; F159-L163 PolarHBondContact O-N 3.39Å |
| 160 | L | 95.3 | Very high | 94.5 | Very high | 1 Ų | 1 | 26.5 Ų | 26.5 | 1% | 0.005 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.5 | -40.7 | 175.5 | -174.7 | 60.5 | 0 | 0 | 0 | 111.7 | A37 K40 S156 P157 V158 G162 S164 L271 L274 | A37-L160 HydrophobicContact CB-CB 3.9Å; A37-L160 HydrophobicContact CB-CD1 4.5Å; K40-L160 HydrophobicContact CB-CD1 3.86Å; K40-L160 HydrophobicContact CD-CD1 4.39Å; K40-L160 HydrophobicContact CD-CD2 4.09Å; S156-L160 PolarHBondContact O-N 3.39Å; P157-L160 PolarHBondContact O-N 2.9Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 3.06Å; L160-G162 VanDerWaalsContact C-N 3.3Å; L160-G162 PolarHBondContact O-N 2.91Å; L160-S164 PolarHBondContact O-N 3.45Å; L160-L271 HydrophobicContact CD1-CB 4.34Å; L160-L274 HydrophobicContact CD2-CD2 4.01Å |
| 161 | C | 95.6 | Very high | 94.9 | Very high | 22 Ų | 22 | 25.2 Ų | 25.2 | 15% | 0.149 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -58.2 | -40.9 | 176.5 | -65.8 | 0 | 0 | 0 | 0 | 113.3 | P157 V158 F159 P165 T272 F276 | P157-C161 PolarHBondContact O-N 3.42Å; P157-C161 PolarHBondContact O-SG 3.4Å; V158-C161 WeakPolarHBondContact O-CB 3.46Å; V158-C161 PolarHBondContact O-N 3.21Å; F159-C161 VanDerWaalsContact C-N 3.3Å; F159-C161 PolarHBondContact O-N 2.99Å; C161-P165 WeakPolarHBondContact O-CD 3.3Å; C161-P165 WeakPolarHBondContact O-CG 3.42Å; C161-T272 HydrophobicContact CB-CG2 4.05Å; C161-T272 WeakPolarHBondContact O-CG2 3.31Å; C161-T272 PolarHBondContact O-OG1 3.47Å; C161-T272 PolarHBondContact SG-O 3.04Å; C161-T272 VanDerWaalsContact SG-O 3.4Å; C161-F276 VanDerWaalsContact SG-CA 3.6Å; C161-F276 PolarHBondContact SG-N 3.3Å |
| 162 | G | 95.8 | Very high | 95.1 | Very high | 43 Ų | 43 | 25.6 Ų | 25.6 | 44% | 0.443 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -86.5 | -40.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114 | V158 F159 L160 P165 L166 | V158-G162 PolarHBondContact O-N 3.25Å; F159-G162 PolarHBondContact O-N 3.05Å; L160-G162 VanDerWaalsContact C-N 3.3Å; L160-G162 PolarHBondContact O-N 2.91Å; G162-P165 WeakPolarHBondContact O-CD 3.33Å; G162-L166 WeakPolarHBondContact O-CB 3.44Å; G162-L166 PolarHBondContact O-N 2.77Å; G162-L166 VanDerWaalsContact O-N 3.15Å |
| 163 | L | 96.4 | Very high | 95.3 | Very high | 11 Ų | 11 | 33.5 Ų | 33.5 | 6% | 0.058 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -71.7 | -31.8 | -173.8 | -72.4 | 172.8 | 0 | 0 | 0 | 112.9 | F34 A37 A41 F159 L166 G167 | F34-L163 HydrophobicContact CD1-CD1 4.09Å; F34-L163 HydrophobicContact CE1-CD1 4.26Å; F34-L163 HydrophobicContact CE1-CD2 4.08Å; A37-L163 HydrophobicContact CB-CD1 4.1Å; A41-L163 HydrophobicContact CB-CB 3.82Å; F159-L163 HydrophobicContact CB-CD1 4.09Å; F159-L163 HydrophobicContact CD1-CD1 4.09Å; F159-L163 HydrophobicContact CD1-CG 4.5Å; F159-L163 WeakPolarHBondContact O-CB 3.24Å; F159-L163 VanDerWaalsContact O-CG 3.22Å; F159-L163 WeakPolarHBondContact O-CG 3.34Å; F159-L163 PolarHBondContact O-N 3.39Å; L163-L166 HydrophobicContact CD2-CD2 4.5Å; L163-G167 WeakPolarHBondContact O-CA 3.39Å; L163-G167 PolarHBondContact O-N 2.92Å |
| 164 | S | 95.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -66.6 | -54.2 | 179.7 | 179.8 | 0 | 0 | 0 | 0 | 112.3 | L160 L166 G167 Q168 A268 | L160-S164 PolarHBondContact O-N 3.45Å; S164-L166 VanDerWaalsContact C-N 3.34Å; S164-L166 PolarHBondContact O-N 3.33Å; S164-G167 PolarHBondContact O-N 3.47Å; S164-Q168 PolarHBondContact O-N 3.29Å; S164-A268 PolarHBondContact OG-O 3.43Å |
| 165 | P | 95.9 | Very high | 96 | Very high | 38 Ų | 38 | 39.6 Ų | 39.6 | 25% | 0.247 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.1 | -36 | 176.1 | -20.9 | 34.7 | 0 | 0 | 0 | 112.6 | C161 G162 G167 Q168 F169 L269 T272 | C161-P165 WeakPolarHBondContact O-CD 3.3Å; C161-P165 WeakPolarHBondContact O-CG 3.42Å; G162-P165 WeakPolarHBondContact O-CD 3.33Å; P165-G167 VanDerWaalsContact C-N 3.32Å; P165-Q168 PolarHBondContact O-N 3.41Å; P165-F169 WeakPolarHBondContact O-CB 3.24Å; P165-F169 PolarHBondContact O-N 3.34Å; P165-L269 HydrophobicContact CG-CD2 4.11Å; P165-T272 VanDerWaalsContact CD-OG1 3.22Å; P165-T272 WeakPolarHBondContact CD-OG1 3.06Å; P165-T272 WeakPolarHBondContact CG-OG1 3.41Å |
| 166 | L | 96.9 | Very high | 96.1 | Very high | 64 Ų | 64 | 40.4 Ų | 40.4 | 34% | 0.335 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -61.7 | -42.9 | 173.7 | 178.8 | 62.5 | 0 | 0 | 0 | 111.1 | G162 L163 S164 F169 L170 L186 | G162-L166 WeakPolarHBondContact O-CB 3.44Å; G162-L166 PolarHBondContact O-N 2.77Å; G162-L166 VanDerWaalsContact O-N 3.15Å; L163-L166 HydrophobicContact CD2-CD2 4.5Å; S164-L166 VanDerWaalsContact C-N 3.34Å; S164-L166 PolarHBondContact O-N 3.33Å; L166-F169 PolarHBondContact O-N 3.17Å; L166-L170 HydrophobicContact CD1-CD1 4.34Å; L166-L170 HydrophobicContact CD1-CG 4.17Å; L166-L170 HydrophobicContact CG-CD1 4.17Å; L166-L170 HydrophobicContact CG-CG 4.4Å; L166-L170 WeakPolarHBondContact O-CB 3.29Å; L166-L170 VanDerWaalsContact O-CG 3.25Å; L166-L170 WeakPolarHBondContact O-CG 3.46Å; L166-L170 PolarHBondContact O-N 2.84Å; L166-L186 HydrophobicContact CD2-CD1 3.82Å |
| 167 | G | 96.3 | Very high | 96.3 | Very high | 1 Ų | 1 | 44.5 Ų | 44.5 | 1% | 0.01 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.2 | -47.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | F45 L163 S164 P165 L170 Q171 | F45-G167 WeakPolarHBondContact CZ-O 3.31Å; L163-G167 WeakPolarHBondContact O-CA 3.39Å; L163-G167 PolarHBondContact O-N 2.92Å; S164-G167 PolarHBondContact O-N 3.47Å; P165-G167 VanDerWaalsContact C-N 3.32Å; G167-L170 PolarHBondContact O-N 3.34Å; G167-Q171 WeakPolarHBondContact O-CB 3.22Å; G167-Q171 PolarHBondContact O-N 2.92Å |
| 168 | Q | 96.4 | Very high | 96.4 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.6 | -44.6 | 176.9 | -171.9 | 58.2 | 58.6 | 0 | 0 | 112 | V44 S164 P165 L170 Q171 D172 D264 A268 | V44-Q168 HydrophobicContact CG1-CB 3.85Å; V44-Q168 HydrophobicContact CG1-CG 4.49Å; S164-Q168 PolarHBondContact O-N 3.29Å; P165-Q168 PolarHBondContact O-N 3.41Å; Q168-L170 PolarHBondContact O-N 2.99Å; Q168-Q171 VanDerWaalsContact O-CB 3.31Å; Q168-Q171 WeakPolarHBondContact O-CB 3.49Å; Q168-Q171 PolarHBondContact O-N 2.94Å; Q168-Q171 VanDerWaalsContact O-N 3.13Å; Q168-D172 PolarHBondContact NE2-OD1 3.2Å; Q168-D172 PolarHBondContact O-N 3.45Å; Q168-D264 HydrophobicContact CG-CB 4.32Å; Q168-D264 VanDerWaalsContact NE2-CB 3.33Å; Q168-A268 HydrophobicContact CB-CB 3.7Å; Q168-A268 HydrophobicContact CG-CB 4.11Å |
| 169 | F | 97.3 | Very high | 96.5 | Very high | 103 Ų | 103 | 42.8 Ų | 42.8 | 45% | 0.452 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -57.9 | -47.2 | 175 | 174.2 | -93.1 | 0 | 0 | 0 | 111.9 | P165 L166 Q171 D172 Y173 | P165-F169 WeakPolarHBondContact O-CB 3.24Å; P165-F169 PolarHBondContact O-N 3.34Å; L166-F169 PolarHBondContact O-N 3.17Å; F169-Q171 PolarHBondContact O-N 3.38Å; F169-D172 PolarHBondContact O-N 3.38Å; F169-Y173 AromaticContact CD2-CD2 3.83Å; F169-Y173 HydrophobicContact CD2-CD2 3.83Å; F169-Y173 AromaticContact CD2-CE2 3.61Å; F169-Y173 HydrophobicContact CD2-CE2 3.61Å; F169-Y173 HydrophobicContact CE1-CD2 4.3Å; F169-Y173 AromaticContact CE2-CD2 3.56Å; F169-Y173 HydrophobicContact CE2-CD2 3.56Å; F169-Y173 AromaticContact CE2-CE2 3.18Å; F169-Y173 HydrophobicContact CE2-CE2 3.18Å; F169-Y173 AromaticContact CE2-CZ 3.97Å; F169-Y173 HydrophobicContact CG-CD2 4.32Å; F169-Y173 AromaticContact CZ-CD2 3.81Å; F169-Y173 HydrophobicContact CZ-CD2 3.81Å; F169-Y173 AromaticContact CZ-CE2 3.81Å; F169-Y173 HydrophobicContact CZ-CE2 3.81Å; F169-Y173 HydrophobicContact CZ-CG 4.47Å; F169-Y173 WeakPolarHBondContact O-CD2 3.47Å; F169-Y173 PolarHBondContact O-N 3.49Å |
| 170 | L | 97.4 | Very high | 96.5 | Very high | 9 Ų | 9 | 41 Ų | 41 | 5% | 0.047 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.6 | -36.4 | 177.7 | -69.6 | 177.7 | 0 | 0 | 0 | 111.5 | L166 G167 Q168 Y174 S179 I182 L183 | L166-L170 HydrophobicContact CD1-CD1 4.34Å; L166-L170 HydrophobicContact CD1-CG 4.17Å; L166-L170 HydrophobicContact CG-CD1 4.17Å; L166-L170 HydrophobicContact CG-CG 4.4Å; L166-L170 WeakPolarHBondContact O-CB 3.29Å; L166-L170 VanDerWaalsContact O-CG 3.25Å; L166-L170 WeakPolarHBondContact O-CG 3.46Å; L166-L170 PolarHBondContact O-N 2.84Å; G167-L170 PolarHBondContact O-N 3.34Å; Q168-L170 PolarHBondContact O-N 2.99Å; L170-Y174 HydrophobicContact CD2-CD2 3.97Å; L170-Y174 HydrophobicContact CD2-CE2 4.16Å; L170-Y174 WeakPolarHBondContact O-CA 3.48Å; L170-Y174 WeakPolarHBondContact O-CB 3.47Å; L170-Y174 PolarHBondContact O-N 3.48Å; L170-S179 VanDerWaalsContact CB-OG 3.28Å; L170-S179 WeakPolarHBondContact CB-OG 3.39Å; L170-S179 PolarHBondContact O-OG 3.35Å; L170-S179 VanDerWaalsContact O-OG 3.06Å; L170-I182 HydrophobicContact CD1-CB 4.16Å; L170-I182 HydrophobicContact CD1-CG2 3.78Å; L170-I182 HydrophobicContact CD2-CD1 3.74Å; L170-I182 HydrophobicContact CD2-CG2 4.11Å; L170-L183 HydrophobicContact CD1-CD2 4.23Å; L170-L183 HydrophobicContact CD1-CG 4.38Å |
| 171 | Q | 95.8 | Very high | 96.7 | Very high | 14 Ų | 14 | 44.8 Ų | 44.8 | 7% | 0.065 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64.6 | -43.8 | 178.4 | -166.4 | -179.2 | -70.5 | 0 | 0 | 112 | V44 F45 E48 G167 Q168 F169 Y173 G175 S179 | V44-Q171 PolarHBondContact O-OE1 3.19Å; F45-Q171 VanDerWaalsContact CA-OE1 3.29Å; F45-Q171 HydrophobicContact CD1-CB 4.14Å; F45-Q171 HydrophobicContact CD1-CG 3.93Å; F45-Q171 HydrophobicContact CE1-CB 3.76Å; F45-Q171 HydrophobicContact CE1-CG 4.06Å; E48-Q171 HydrophobicContact CG-CG 4.48Å; E48-Q171 VanDerWaalsContact CG-NE2 3.27Å; E48-Q171 PolarHBondContact OE1-NE2 2.73Å; E48-Q171 PolarHBondContact OE2-NE2 3.23Å; G167-Q171 WeakPolarHBondContact O-CB 3.22Å; G167-Q171 PolarHBondContact O-N 2.92Å; Q168-Q171 VanDerWaalsContact O-CB 3.31Å; Q168-Q171 WeakPolarHBondContact O-CB 3.49Å; Q168-Q171 PolarHBondContact O-N 2.94Å; Q168-Q171 VanDerWaalsContact O-N 3.13Å; F169-Q171 PolarHBondContact O-N 3.38Å; Q171-Y173 PolarHBondContact O-N 3.25Å; Q171-G175 WeakPolarHBondContact O-CA 3.4Å; Q171-G175 PolarHBondContact O-N 3.27Å; Q171-S179 WeakPolarHBondContact CA-OG 3.34Å; Q171-S179 PolarHBondContact N-OG 2.87Å; Q171-S179 VanDerWaalsContact N-OG 3.1Å |
| 172 | D | 95.6 | Very high | 96.8 | Very high | 82 Ų | 82 | 46.8 Ų | 46.8 | 44% | 0.439 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -65.8 | -39 | -178 | -62.7 | -22.8 | 0 | 0 | 0 | 111.8 | Q168 F169 | Q168-D172 PolarHBondContact NE2-OD1 3.2Å; Q168-D172 PolarHBondContact O-N 3.45Å; F169-D172 PolarHBondContact O-N 3.38Å |
| 173 | Y | 96.4 | Very high | 96.9 | Very high | 166 Ų | 166 | 45 Ų | 45 | 65% | 0.651 | 22% | 0.219 | S | C | * | . | H | α-helix | trans | -91.3 | -35.1 | -176.1 | -76.7 | -89.1 | 0 | 0 | 0 | 114.5 | F169 Q171 | F169-Y173 AromaticContact CD2-CD2 3.83Å; F169-Y173 HydrophobicContact CD2-CD2 3.83Å; F169-Y173 AromaticContact CD2-CE2 3.61Å; F169-Y173 HydrophobicContact CD2-CE2 3.61Å; F169-Y173 HydrophobicContact CE1-CD2 4.3Å; F169-Y173 AromaticContact CE2-CD2 3.56Å; F169-Y173 HydrophobicContact CE2-CD2 3.56Å; F169-Y173 AromaticContact CE2-CE2 3.18Å; F169-Y173 HydrophobicContact CE2-CE2 3.18Å; F169-Y173 AromaticContact CE2-CZ 3.97Å; F169-Y173 HydrophobicContact CG-CD2 4.32Å; F169-Y173 AromaticContact CZ-CD2 3.81Å; F169-Y173 HydrophobicContact CZ-CD2 3.81Å; F169-Y173 AromaticContact CZ-CE2 3.81Å; F169-Y173 HydrophobicContact CZ-CE2 3.81Å; F169-Y173 HydrophobicContact CZ-CG 4.47Å; F169-Y173 WeakPolarHBondContact O-CD2 3.47Å; F169-Y173 PolarHBondContact O-N 3.49Å; Q171-Y173 PolarHBondContact O-N 3.25Å |
| 174 | Y | 96.7 | Very high | 96.9 | Very high | 142 Ų | 142 | 44.5 Ų | 44.5 | 56% | 0.557 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -120 | -2.2 | -171.4 | -59.2 | -77 | 0 | 0 | 0 | 113.7 | L170 G178 I182 | L170-Y174 HydrophobicContact CD2-CD2 3.97Å; L170-Y174 HydrophobicContact CD2-CE2 4.16Å; L170-Y174 WeakPolarHBondContact O-CA 3.48Å; L170-Y174 WeakPolarHBondContact O-CB 3.47Å; L170-Y174 PolarHBondContact O-N 3.48Å; Y174-G178 PolarHBondContact O-N 3.04Å; Y174-I182 HydrophobicContact CD2-CD1 3.92Å; Y174-I182 HydrophobicContact CE2-CD1 4.12Å; Y174-I182 HydrophobicContact CG-CD1 4.21Å |
| 175 | G | 96.8 | Very high | 97 | Very high | 31 Ų | 31 | 46.4 Ų | 46.4 | 32% | 0.32 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | 66.3 | 176.7 | -171 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q171 R177 S179 | Q171-G175 WeakPolarHBondContact O-CA 3.4Å; Q171-G175 PolarHBondContact O-N 3.27Å; G175-R177 VanDerWaalsContact C-N 3.33Å; G175-R177 PolarHBondContact O-N 3.18Å; G175-S179 VanDerWaalsContact O-CB 3.28Å; G175-S179 WeakPolarHBondContact O-CB 3.25Å; G175-S179 PolarHBondContact O-N 2.98Å; G175-S179 PolarHBondContact O-OG 3.38Å |
| 176 | W | 96.4 | Very high | 97.1 | Very high | 17 Ų | 17 | 47.1 Ų | 47.1 | 6% | 0.064 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.5 | -34.5 | -178.2 | 69.6 | -96.5 | 0 | 0 | 0 | 112.9 | F45 L49 E52 F53 A105 S108 I114 S179 F180 | F45-W176 HydrophobicContact CD1-CB 4.07Å; L49-W176 HydrophobicContact CD2-CD2 3.88Å; L49-W176 HydrophobicContact CD2-CE3 3.94Å; L49-W176 HydrophobicContact CD2-CG 4.28Å; L49-W176 HydrophobicContact CD2-CZ2 4.48Å; L49-W176 HydrophobicContact CD2-CZ3 4.29Å; E52-W176 HydrophobicContact CG-CZ2 4.07Å; F53-W176 HydrophobicContact CE2-CH2 4.04Å; F53-W176 AromaticContact CE2-CZ2 3.91Å; F53-W176 HydrophobicContact CE2-CZ2 3.91Å; F53-W176 AromaticContact CZ-CH2 3.78Å; F53-W176 HydrophobicContact CZ-CH2 3.78Å; F53-W176 AromaticContact CZ-CZ2 3.77Å; F53-W176 HydrophobicContact CZ-CZ2 3.77Å; A105-W176 WeakPolarHBondContact O-CZ3 3.33Å; S108-W176 VanDerWaalsContact OG-CH2 3.29Å; S108-W176 WeakPolarHBondContact OG-CH2 3.13Å; S108-W176 WeakPolarHBondContact OG-CZ3 3.5Å; I114-W176 HydrophobicContact CD1-CH2 4.34Å; I114-W176 HydrophobicContact CD1-CZ3 4.15Å; W176-S179 WeakPolarHBondContact O-CB 3.24Å; W176-S179 PolarHBondContact O-N 3.08Å; W176-F180 AromaticContact CE3-CD2 3.76Å; W176-F180 HydrophobicContact CE3-CD2 3.76Å; W176-F180 AromaticContact CE3-CE2 3.72Å; W176-F180 HydrophobicContact CE3-CE2 3.72Å; W176-F180 HydrophobicContact CE3-CZ 4.44Å; W176-F180 AromaticContact CZ3-CD2 4Å; W176-F180 HydrophobicContact CZ3-CD2 4Å; W176-F180 HydrophobicContact CZ3-CE2 4.04Å; W176-F180 WeakPolarHBondContact O-CD1 3.37Å; W176-F180 WeakPolarHBondContact O-CG 3.45Å; W176-F180 PolarHBondContact O-N 3.33Å |
| 177 | R | 97.7 | Very high | 97.1 | Very high | 95 Ų | 95 | 44 Ų | 44 | 36% | 0.358 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -64.6 | -52.2 | 178.4 | -67.9 | -172.4 | 172 | 90.5 | 0.5 | 111.7 | E52 S106 G175 S179 F180 L181 | E52-R177 IonicContact OE1-CZ 2.87Å; E52-R177 VanDerWaalsContact OE1-CZ 3.27Å; E52-R177 IonicContact OE1-NH1 2.85Å; E52-R177 PolarHBondContact OE1-NH1 2.85Å; E52-R177 IonicContact OE1-NH2 3.27Å; E52-R177 PolarHBondContact OE1-NH2 2.76Å; S106-R177 WeakPolarHBondContact CB-O 3.46Å; S106-R177 WeakPolarHBondContact O-CD 3.37Å; S106-R177 VanDerWaalsContact O-CG 3.3Å; S106-R177 WeakPolarHBondContact O-CG 3.47Å; G175-R177 VanDerWaalsContact C-N 3.33Å; G175-R177 PolarHBondContact O-N 3.18Å; R177-S179 VanDerWaalsContact C-N 3.3Å; R177-S179 PolarHBondContact O-N 3.1Å; R177-F180 PolarHBondContact O-N 3.36Å; R177-L181 PolarHBondContact O-N 3.33Å |
| 178 | G | 97.6 | Very high | 97.1 | Very high | 21 Ų | 21 | 47.5 Ų | 47.5 | 22% | 0.216 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64 | -37.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y174 L181 I182 | Y174-G178 PolarHBondContact O-N 3.04Å; G178-L181 WeakPolarHBondContact O-CB 3.23Å; G178-L181 PolarHBondContact O-N 3.1Å; G178-I182 WeakPolarHBondContact O-CG1 3.44Å; G178-I182 PolarHBondContact O-N 2.85Å; G178-I182 VanDerWaalsContact O-N 3.07Å |
| 179 | S | 97.9 | Very high | 97.1 | Very high | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58.7 | -48.7 | 174.2 | -60.8 | 0 | 0 | 0 | 0 | 112.4 | L170 Q171 G175 W176 R177 L181 I182 L183 | L170-S179 VanDerWaalsContact CB-OG 3.28Å; L170-S179 WeakPolarHBondContact CB-OG 3.39Å; L170-S179 PolarHBondContact O-OG 3.35Å; L170-S179 VanDerWaalsContact O-OG 3.06Å; Q171-S179 WeakPolarHBondContact CA-OG 3.34Å; Q171-S179 PolarHBondContact N-OG 2.87Å; Q171-S179 VanDerWaalsContact N-OG 3.1Å; G175-S179 VanDerWaalsContact O-CB 3.28Å; G175-S179 WeakPolarHBondContact O-CB 3.25Å; G175-S179 PolarHBondContact O-N 2.98Å; G175-S179 PolarHBondContact O-OG 3.38Å; W176-S179 WeakPolarHBondContact O-CB 3.24Å; W176-S179 PolarHBondContact O-N 3.08Å; R177-S179 VanDerWaalsContact C-N 3.3Å; R177-S179 PolarHBondContact O-N 3.1Å; S179-L181 VanDerWaalsContact C-N 3.29Å; S179-L181 PolarHBondContact O-N 3.08Å; S179-I182 PolarHBondContact O-N 3.38Å; S179-L183 WeakPolarHBondContact O-CB 3.26Å; S179-L183 VanDerWaalsContact O-CG 3.27Å; S179-L183 WeakPolarHBondContact O-CG 3.26Å; S179-L183 PolarHBondContact O-N 2.97Å |
| 180 | F | 98.1 | Very high | 97.1 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.4 | -36.6 | 179.4 | -74.2 | 1.8 | 0 | 0 | 0 | 112.3 | F45 L49 M102 A105 W176 R177 L183 G184 | F45-F180 HydrophobicContact CB-CE1 4.3Å; F45-F180 HydrophobicContact CB-CZ 4.43Å; F45-F180 HydrophobicContact CD1-CE1 4.19Å; F45-F180 AromaticContact CD2-CE1 3.81Å; F45-F180 HydrophobicContact CD2-CE1 3.81Å; F45-F180 HydrophobicContact CE2-CE1 4.16Å; F45-F180 AromaticContact CG-CE1 3.83Å; F45-F180 HydrophobicContact CG-CE1 3.83Å; F45-F180 HydrophobicContact CG-CZ 4.43Å; L49-F180 HydrophobicContact CD1-CZ 4.34Å; M102-F180 HydrophobicContact CE-CB 3.75Å; M102-F180 HydrophobicContact CE-CD1 3.48Å; M102-F180 VanDerWaalsContact CE-CD1 3.48Å; M102-F180 HydrophobicContact CE-CD2 4.2Å; M102-F180 HydrophobicContact CE-CE1 4.08Å; M102-F180 HydrophobicContact CE-CG 3.54Å; A105-F180 HydrophobicContact CB-CD2 3.69Å; A105-F180 HydrophobicContact CB-CE2 4.28Å; W176-F180 AromaticContact CE3-CD2 3.76Å; W176-F180 HydrophobicContact CE3-CD2 3.76Å; W176-F180 AromaticContact CE3-CE2 3.72Å; W176-F180 HydrophobicContact CE3-CE2 3.72Å; W176-F180 HydrophobicContact CE3-CZ 4.44Å; W176-F180 AromaticContact CZ3-CD2 4Å; W176-F180 HydrophobicContact CZ3-CD2 4Å; W176-F180 HydrophobicContact CZ3-CE2 4.04Å; W176-F180 WeakPolarHBondContact O-CD1 3.37Å; W176-F180 WeakPolarHBondContact O-CG 3.45Å; W176-F180 PolarHBondContact O-N 3.33Å; R177-F180 PolarHBondContact O-N 3.36Å; F180-L183 HydrophobicContact CD1-CD1 4.39Å; F180-G184 PolarHBondContact O-N 3.04Å |
| 181 | L | 98.1 | Very high | 97 | Very high | 82 Ų | 82 | 46.9 Ų | 46.9 | 43% | 0.429 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.4 | -47 | 174.2 | -172.1 | 70.2 | 0 | 0 | 0 | 111.8 | I103 R177 G178 S179 G184 G185 | I103-L181 HydrophobicContact CB-CD1 4.39Å; I103-L181 HydrophobicContact CG1-CD1 4.11Å; I103-L181 HydrophobicContact CG2-CD1 3.93Å; R177-L181 PolarHBondContact O-N 3.33Å; G178-L181 WeakPolarHBondContact O-CB 3.23Å; G178-L181 PolarHBondContact O-N 3.1Å; S179-L181 VanDerWaalsContact C-N 3.29Å; S179-L181 PolarHBondContact O-N 3.08Å; L181-G184 PolarHBondContact O-N 3.09Å; L181-G185 PolarHBondContact O-N 3.02Å; L181-G185 VanDerWaalsContact O-N 3.11Å |
| 182 | I | 98.3 | Very high | 97.1 | Very high | 63 Ų | 63 | 50.5 Ų | 50.5 | 32% | 0.323 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -66.8 | -43.9 | 179.2 | -66.4 | 167.5 | 0 | 0 | 0 | 111 | L170 Y174 G178 S179 G184 G185 L186 | L170-I182 HydrophobicContact CD1-CB 4.16Å; L170-I182 HydrophobicContact CD1-CG2 3.78Å; L170-I182 HydrophobicContact CD2-CD1 3.74Å; L170-I182 HydrophobicContact CD2-CG2 4.11Å; Y174-I182 HydrophobicContact CD2-CD1 3.92Å; Y174-I182 HydrophobicContact CE2-CD1 4.12Å; Y174-I182 HydrophobicContact CG-CD1 4.21Å; G178-I182 WeakPolarHBondContact O-CG1 3.44Å; G178-I182 PolarHBondContact O-N 2.85Å; G178-I182 VanDerWaalsContact O-N 3.07Å; S179-I182 PolarHBondContact O-N 3.38Å; I182-G184 PolarHBondContact O-N 3.21Å; I182-G185 WeakPolarHBondContact O-CA 3.41Å; I182-G185 PolarHBondContact O-N 3.43Å; I182-L186 PolarHBondContact O-N 2.91Å |
| 183 | L | 97.3 | Very high | 97.1 | Very high | 7 Ų | 7 | 47.1 Ų | 47.1 | 4% | 0.037 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.6 | -35.3 | 174.1 | -70.8 | 179.7 | 0 | 0 | 0 | 111.6 | F38 F45 M102 L170 S179 F180 G185 L186 L187 | F38-L183 HydrophobicContact CE2-CB 4.09Å; F38-L183 HydrophobicContact CE2-CD1 4.14Å; F38-L183 HydrophobicContact CE2-CD2 4.28Å; F38-L183 HydrophobicContact CE2-CG 4.4Å; F38-L183 HydrophobicContact CZ-CB 4.24Å; F38-L183 HydrophobicContact CZ-CD1 4.23Å; F45-L183 HydrophobicContact CE2-CD1 3.91Å; F45-L183 HydrophobicContact CZ-CD1 4Å; M102-L183 HydrophobicContact CE-CB 4.24Å; M102-L183 HydrophobicContact CE-CD1 4.35Å; L170-L183 HydrophobicContact CD1-CD2 4.23Å; L170-L183 HydrophobicContact CD1-CG 4.38Å; S179-L183 WeakPolarHBondContact O-CB 3.26Å; S179-L183 VanDerWaalsContact O-CG 3.27Å; S179-L183 WeakPolarHBondContact O-CG 3.26Å; S179-L183 PolarHBondContact O-N 2.97Å; F180-L183 HydrophobicContact CD1-CD1 4.39Å; L183-G185 VanDerWaalsContact C-N 3.34Å; L183-L186 HydrophobicContact CD2-CD1 4.01Å; L183-L186 PolarHBondContact O-N 3.47Å; L183-L187 WeakPolarHBondContact O-CG 3.37Å; L183-L187 PolarHBondContact O-N 3.22Å |
| 184 | G | 97.6 | Very high | 96.9 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.1 | -39.1 | 171.2 | 0 | 0 | 0 | 0 | 0 | 113 | S99 F180 L181 I182 L187 L188 | S99-G184 WeakPolarHBondContact CA-O 3.45Å; S99-G184 WeakPolarHBondContact CB-O 3.4Å; S99-G184 PolarHBondContact OG-O 3.41Å; F180-G184 PolarHBondContact O-N 3.04Å; L181-G184 PolarHBondContact O-N 3.09Å; I182-G184 PolarHBondContact O-N 3.21Å; G184-L187 PolarHBondContact O-N 3.41Å; G184-L188 PolarHBondContact O-N 3.48Å; G184-L188 VanDerWaalsContact O-N 3.14Å |
| 185 | G | 97.2 | Very high | 96.9 | Very high | 39 Ų | 39 | 34.1 Ų | 34.1 | 40% | 0.402 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -65.2 | -39.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L181 I182 L183 L188 | L181-G185 PolarHBondContact O-N 3.02Å; L181-G185 VanDerWaalsContact O-N 3.11Å; I182-G185 WeakPolarHBondContact O-CA 3.41Å; I182-G185 PolarHBondContact O-N 3.43Å; L183-G185 VanDerWaalsContact C-N 3.34Å; G185-L188 VanDerWaalsContact O-CB 3.31Å; G185-L188 WeakPolarHBondContact O-CB 3.31Å; G185-L188 PolarHBondContact O-N 2.67Å |
| 186 | L | 96.9 | Very high | 96.7 | Very high | 53 Ų | 53 | 35.3 Ų | 35.3 | 28% | 0.277 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -63.6 | -44.8 | 174.5 | -70.1 | 177.9 | 0 | 0 | 0 | 111.7 | F34 L166 I182 L183 L188 N189 | F34-L186 HydrophobicContact CE1-CB 4.41Å; F34-L186 HydrophobicContact CZ-CB 4.21Å; L166-L186 HydrophobicContact CD2-CD1 3.82Å; I182-L186 PolarHBondContact O-N 2.91Å; L183-L186 HydrophobicContact CD2-CD1 4.01Å; L183-L186 PolarHBondContact O-N 3.47Å; L186-L188 PolarHBondContact O-N 3.44Å; L186-N189 VanDerWaalsContact O-CB 3.27Å; L186-N189 WeakPolarHBondContact O-CB 3.5Å; L186-N189 PolarHBondContact O-N 2.84Å; L186-N189 PolarHBondContact O-ND2 3.49Å |
| 187 | L | 97.4 | Very high | 96.4 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63.9 | -26 | 177.2 | -74.1 | 177.1 | 0 | 0 | 0 | 113 | F34 F38 A98 M102 T122 L126 L183 G184 N189 C190 | F34-L187 HydrophobicContact CB-CD2 4.04Å; F34-L187 HydrophobicContact CD1-CD2 3.65Å; F34-L187 HydrophobicContact CE1-CD2 4.21Å; F34-L187 HydrophobicContact CG-CD2 3.86Å; F38-L187 HydrophobicContact CD2-CD2 4.22Å; F38-L187 HydrophobicContact CE1-CD1 4.1Å; F38-L187 HydrophobicContact CE2-CD1 4.01Å; F38-L187 HydrophobicContact CE2-CD2 4.35Å; F38-L187 HydrophobicContact CE2-CG 4.17Å; F38-L187 HydrophobicContact CZ-CD1 3.77Å; F38-L187 HydrophobicContact CZ-CG 4.43Å; A98-L187 HydrophobicContact CB-CB 4.21Å; A98-L187 HydrophobicContact CB-CD1 4.25Å; A98-L187 WeakPolarHBondContact O-CD1 3.41Å; M102-L187 HydrophobicContact CB-CD1 4.48Å; M102-L187 HydrophobicContact CG-CD1 3.46Å; M102-L187 VanDerWaalsContact CG-CD1 3.46Å; T122-L187 HydrophobicContact CG2-CD1 3.78Å; L126-L187 HydrophobicContact CD2-CD2 3.93Å; L183-L187 WeakPolarHBondContact O-CG 3.37Å; L183-L187 PolarHBondContact O-N 3.22Å; G184-L187 PolarHBondContact O-N 3.41Å; L187-N189 PolarHBondContact O-N 3.25Å; L187-C190 WeakPolarHBondContact O-CB 3.14Å; L187-C190 PolarHBondContact O-N 2.87Å; L187-C190 PolarHBondContact O-SG 3.48Å |
| 188 | L | 96.8 | Very high | 95.9 | Very high | 74 Ų | 74 | 36 Ų | 36 | 39% | 0.387 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.1 | -23.6 | 173.7 | -166.2 | 65.4 | 0 | 0 | 0 | 112.3 | L96 G184 G185 L186 C190 C191 | L96-L188 HydrophobicContact CD2-CD1 3.76Å; G184-L188 PolarHBondContact O-N 3.48Å; G184-L188 VanDerWaalsContact O-N 3.14Å; G185-L188 VanDerWaalsContact O-CB 3.31Å; G185-L188 WeakPolarHBondContact O-CB 3.31Å; G185-L188 PolarHBondContact O-N 2.67Å; L186-L188 PolarHBondContact O-N 3.44Å; L188-C190 PolarHBondContact O-N 3.45Å; L188-C191 WeakPolarHBondContact O-CB 3.49Å; L188-C191 PolarHBondContact O-N 3.09Å |
| 189 | N | 96.8 | Very high | 95.1 | Very high | 78 Ų | 78 | 39.1 Ų | 39.1 | 42% | 0.417 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -64.1 | -16.7 | 171.7 | -67.4 | -72.1 | 0 | 0 | 0 | 113.1 | L186 L187 C191 V192 C193 | L186-N189 VanDerWaalsContact O-CB 3.27Å; L186-N189 WeakPolarHBondContact O-CB 3.5Å; L186-N189 PolarHBondContact O-N 2.84Å; L186-N189 PolarHBondContact O-ND2 3.49Å; L187-N189 PolarHBondContact O-N 3.25Å; N189-C191 PolarHBondContact O-N 3.29Å; N189-V192 WeakPolarHBondContact O-CB 3.09Å; N189-V192 PolarHBondContact O-N 2.97Å; N189-V192 VanDerWaalsContact O-N 3.12Å; N189-C193 PolarHBondContact O-N 3.34Å; N189-C193 PolarHBondContact O-SG 3.02Å |
| 190 | C | 96.1 | Very high | 94.3 | Very high | 1 Ų | 1 | 41.9 Ų | 41.9 | 1% | 0.007 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.7 | -32.1 | 168.9 | -61.2 | 0 | 0 | 0 | 0 | 111.3 | L187 L188 V192 C193 G194 | L187-C190 WeakPolarHBondContact O-CB 3.14Å; L187-C190 PolarHBondContact O-N 2.87Å; L187-C190 PolarHBondContact O-SG 3.48Å; L188-C190 PolarHBondContact O-N 3.45Å; C190-V192 VanDerWaalsContact C-N 3.34Å; C190-V192 PolarHBondContact O-N 3.38Å; C190-C193 PolarHBondContact O-N 3.23Å; C190-G194 PolarHBondContact O-N 3.46Å |
| 191 | C | 96.3 | Very high | 92.6 | Very high | 19 Ų | 19 | 50.1 Ų | 50.1 | 13% | 0.128 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.8 | -41.4 | 173.1 | -61.6 | 0 | 0 | 0 | 0 | 111.9 | M92 G95 L96 L188 N189 G194 A195 | M92-C191 PolarHBondContact O-SG 2.91Å; G95-C191 VanDerWaalsContact CA-SG 3.53Å; L96-C191 PolarHBondContact N-SG 3.12Å; L188-C191 WeakPolarHBondContact O-CB 3.49Å; L188-C191 PolarHBondContact O-N 3.09Å; N189-C191 PolarHBondContact O-N 3.29Å; C191-G194 PolarHBondContact O-N 3.12Å; C191-A195 PolarHBondContact O-N 3.35Å |
| 192 | V | 96.6 | Very high | 90.6 | Very high | 90 Ų | 90 | 51.3 Ų | 51.3 | 55% | 0.545 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.2 | -44.3 | 176.6 | -177.5 | 0 | 0 | 0 | 0 | 109.8 | N189 C190 G194 A195 L196 | N189-V192 WeakPolarHBondContact O-CB 3.09Å; N189-V192 PolarHBondContact O-N 2.97Å; N189-V192 VanDerWaalsContact O-N 3.12Å; C190-V192 VanDerWaalsContact C-N 3.34Å; C190-V192 PolarHBondContact O-N 3.38Å; V192-G194 VanDerWaalsContact C-N 3.31Å; V192-G194 PolarHBondContact O-N 3.14Å; V192-A195 WeakPolarHBondContact O-CB 3.34Å; V192-A195 PolarHBondContact O-N 3.37Å; V192-A195 VanDerWaalsContact O-N 3.09Å; V192-L196 PolarHBondContact O-N 3.16Å |
| 193 | C | 95.8 | Very high | 87.8 | Confident | 12 Ų | 12 | 55.8 Ų | 55.8 | 8% | 0.081 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.9 | -40.5 | 174.4 | -61.4 | 0 | 0 | 0 | 0 | 111.8 | I31 N189 C190 A195 L196 | I31-C193 HydrophobicContact CD1-CB 3.69Å; I31-C193 HydrophobicContact CG1-CB 3.79Å; N189-C193 PolarHBondContact O-N 3.34Å; N189-C193 PolarHBondContact O-SG 3.02Å; C190-C193 PolarHBondContact O-N 3.23Å; C193-A195 VanDerWaalsContact C-N 3.33Å; C193-A195 PolarHBondContact O-N 3.36Å; C193-L196 WeakPolarHBondContact O-CB 3.26Å; C193-L196 PolarHBondContact O-N 3.42Å |
| 194 | G | 93.7 | Very high | 84.8 | Confident | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.8 | -36.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113 | C190 C191 V192 L196 M197 | C190-G194 PolarHBondContact O-N 3.46Å; C191-G194 PolarHBondContact O-N 3.12Å; V192-G194 VanDerWaalsContact C-N 3.31Å; V192-G194 PolarHBondContact O-N 3.14Å; G194-L196 VanDerWaalsContact C-N 3.28Å; G194-L196 PolarHBondContact O-N 3.15Å; G194-M197 VanDerWaalsContact O-CB 3.24Å; G194-M197 WeakPolarHBondContact O-CB 3.27Å; G194-M197 WeakPolarHBondContact O-CG 3.25Å; G194-M197 PolarHBondContact O-N 3.27Å; G194-M197 VanDerWaalsContact O-N 3.15Å |
| 195 | A | 94.7 | Very high | 81.9 | Confident | 35 Ų | 35 | 64.8 Ų | 64.8 | 29% | 0.289 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.8 | -27.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | M92 C191 V192 C193 M197 | M92-A195 HydrophobicContact SD-CB 4.46Å; C191-A195 PolarHBondContact O-N 3.35Å; V192-A195 WeakPolarHBondContact O-CB 3.34Å; V192-A195 PolarHBondContact O-N 3.37Å; V192-A195 VanDerWaalsContact O-N 3.09Å; C193-A195 VanDerWaalsContact C-N 3.33Å; C193-A195 PolarHBondContact O-N 3.36Å; A195-M197 PolarHBondContact O-N 3.38Å |
| 196 | L | 94.2 | Very high | 79.2 | Confident | 55 Ų | 55 | 66.5 Ų | 66.5 | 29% | 0.288 | 37% | 0.368 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.1 | -19.1 | 174.2 | -64.6 | 173 | 0 | 0 | 0 | 113.2 | W20 V192 C193 G194 K198 | W20-L196 HydrophobicContact CZ2-CD2 4.25Å; W20-L196 PolarHBondContact NE1-O 3.09Å; V192-L196 PolarHBondContact O-N 3.16Å; C193-L196 WeakPolarHBondContact O-CB 3.26Å; C193-L196 PolarHBondContact O-N 3.42Å; G194-L196 VanDerWaalsContact C-N 3.28Å; G194-L196 PolarHBondContact O-N 3.15Å; L196-K198 VanDerWaalsContact C-N 3.26Å; L196-K198 PolarHBondContact O-N 2.87Å |
| 197 | M | 89.7 | Confident | 76.2 | Confident | 0 Ų | 0 | 72.1 Ų | 72.1 | 0% | 0 | 39% | 0.392 | C | S | . | . | trans | -75.9 | 74.5 | -174.5 | -55.6 | -70.8 | 168.4 | 0 | 0 | 110.8 | V24 I31 R88 M91 M136 G194 A195 P199 | V24-M197 HydrophobicContact CG1-SD 3.82Å; I31-M197 HydrophobicContact CD1-CE 4.18Å; R88-M197 HydrophobicContact CB-CB 4.49Å; R88-M197 WeakPolarHBondContact CB-O 3.44Å; M91-M197 HydrophobicContact CE-CE 3.6Å; M91-M197 HydrophobicContact CE-CG 3.66Å; M91-M197 HydrophobicContact CE-SD 4.06Å; M91-M197 HydrophobicContact SD-CB 4.28Å; M91-M197 HydrophobicContact SD-CG 3.62Å; M91-M197 HydrophobicContact SD-SD 4.33Å; M136-M197 HydrophobicContact CB-SD 3.82Å; M136-M197 HydrophobicContact CE-CB 4.32Å; M136-M197 HydrophobicContact CG-CB 4.26Å; M136-M197 HydrophobicContact CG-SD 4.15Å; G194-M197 VanDerWaalsContact O-CB 3.24Å; G194-M197 WeakPolarHBondContact O-CB 3.27Å; G194-M197 WeakPolarHBondContact O-CG 3.25Å; G194-M197 PolarHBondContact O-N 3.27Å; G194-M197 VanDerWaalsContact O-N 3.15Å; A195-M197 PolarHBondContact O-N 3.38Å; M197-P199 WeakPolarHBondContact O-CD 3.46Å | ||
| 198 | K | 87.6 | Confident | 73.4 | Confident | 128 Ų | 128 | 77.6 Ų | 77.6 | 56% | 0.557 | 42% | 0.418 | S | S | * | . | P | Polyproline II helix | trans | -70 | 120.2 | 178.8 | -175 | 179.2 | -177.8 | -176.7 | 0 | 109.4 | M136 Y140 L196 L200 | M136-K198 VanDerWaalsContact CE-O 3.27Å; M136-K198 WeakPolarHBondContact CE-O 3.35Å; Y140-K198 WeakPolarHBondContact CE2-O 3.32Å; Y140-K198 PolarHBondContact OH-O 2.76Å; L196-K198 VanDerWaalsContact C-N 3.26Å; L196-K198 PolarHBondContact O-N 2.87Å; K198-L200 PolarHBondContact O-N 3.16Å |
| 199 | P | 81.3 | Confident | 70.7 | Confident | 86 Ų | 86 | 78.7 Ų | 78.7 | 56% | 0.558 | 42% | 0.421 | S | S | * | . | P | Polyproline II helix | trans | -64.8 | 135.5 | 175 | 26.6 | -32.1 | 0 | 0 | 0 | 109.6 | M197 Q201 | M197-P199 WeakPolarHBondContact O-CD 3.46Å; P199-Q201 PolarHBondContact O-N 2.98Å |
| 200 | L | 80.3 | Confident | 67.8 | Low | 57 Ų | 57 | 81.7 Ų | 81.7 | 30% | 0.298 | 43% | 0.432 | S | S | . | . | P | Polyproline II helix | trans | -74.6 | 122.4 | 169.5 | -62.6 | 173.3 | 0 | 0 | 0 | 107.2 | V13 Y140 K198 N202 | V13-L200 HydrophobicContact CG1-CB 4.33Å; Y140-L200 HydrophobicContact CD2-CD1 4.16Å; Y140-L200 HydrophobicContact CD2-CG 4.37Å; Y140-L200 HydrophobicContact CE1-CD2 3.94Å; Y140-L200 HydrophobicContact CE2-CD1 4.12Å; Y140-L200 HydrophobicContact CE2-CD2 4.07Å; Y140-L200 HydrophobicContact CE2-CG 3.81Å; K198-L200 PolarHBondContact O-N 3.16Å; L200-N202 PolarHBondContact O-N 3.12Å |
| 201 | Q | 61.7 | Low | 64.9 | Low | 173 Ų | 173 | 88 Ų | 88 | 81% | 0.808 | 47% | 0.466 | S | S | * | . | P | Polyproline II helix | trans | -70 | 125.2 | -177.6 | -106.3 | 167.8 | -20.8 | 0 | 0 | 110.5 | V13 P199 L203 | V13-Q201 WeakPolarHBondContact CG2-O 3.38Å; P199-Q201 PolarHBondContact O-N 2.98Å; Q201-L203 PolarHBondContact O-N 3.39Å |
| 202 | N | 56.9 | Low | 62.1 | Low | 107 Ų | 107 | 92.5 Ų | 92.5 | 57% | 0.572 | 49% | 0.485 | S | S | * | . | P | Polyproline II helix | trans | -71.5 | 117.8 | 168.6 | -71.1 | -19.3 | 0 | 0 | 0 | 109 | L200 K204 | L200-N202 PolarHBondContact O-N 3.12Å; N202-K204 PolarHBondContact O-N 3.2Å |
| 203 | L | 38.8 | Very low | 59.4 | Low | 157 Ų | 157 | 94.9 Ų | 94.9 | 82% | 0.822 | 49% | 0.49 | S | S | * | . | trans | -80.4 | 51.5 | 176.8 | -70.7 | 169 | 0 | 0 | 0 | 112.4 | Q201 | Q201-L203 PolarHBondContact O-N 3.39Š| ||
| 204 | K | 35.3 | Very low | 56.6 | Low | 101 Ų | 101 | 101.6 Ų | 101.6 | 44% | 0.439 | 53% | 0.526 | S | S | . | . | trans | -118.7 | 129.4 | 167.6 | -79.1 | -170.9 | 178.8 | -179.7 | 0 | 110.9 | N202 | N202-K204 PolarHBondContact O-N 3.2Š| ||
| 205 | P | 35.5 | Very low | 53.9 | Low | 95 Ų | 95 | 110.5 Ų | 110.5 | 62% | 0.617 | 56% | 0.564 | S | S | * | * | trans | -58.5 | 141.3 | 174.6 | -21.2 | 31.6 | 0 | 0 | 0 | 111.7 | E207 Q208 | P205-E207 PolarHBondContact O-N 3.03Å; P205-Q208 PolarHBondContact O-N 2.82Å | ||
| 206 | A | 40.2 | Very low | 51.4 | Low | 76 Ų | 76 | 116.3 Ų | 116.3 | 63% | 0.628 | 58% | 0.583 | S | S | * | * | G | 310 helix | trans | -57.5 | -14.5 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | Q209 | A206-Q209 PolarHBondContact O-N 3.07Š|
| 207 | E | 35.8 | Very low | 48.8 | Very low | 170 Ų | 170 | 122.6 Ų | 122.6 | 79% | 0.794 | 61% | 0.608 | S | S | * | * | G | 310 helix | trans | -76 | -19.4 | -179.3 | -71 | 177.1 | 157.5 | 0 | 0 | 113.9 | P205 | P205-E207 PolarHBondContact O-N 3.03Š|
| 208 | Q | 37.9 | Very low | 46.6 | Very low | 116 Ų | 116 | 132.4 Ų | 132.4 | 54% | 0.542 | 65% | 0.65 | S | S | . | * | G | 310 helix | trans | -95 | -6.7 | 174.7 | -73 | -176.1 | -9.9 | 0 | 0 | 114 | P205 Q212 | P205-Q208 PolarHBondContact O-N 2.82Å; Q208-Q212 WeakPolarHBondContact O-CG 3.5Å |
| 209 | Q | 39.5 | Very low | 45 | Very low | 96 Ų | 96 | 133.1 Ų | 133.1 | 45% | 0.449 | 66% | 0.656 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.2 | -33.7 | 178.1 | -74.2 | 178.1 | -20.2 | 0 | 0 | 111.6 | A206 D211 Q212 E213 | A206-Q209 PolarHBondContact O-N 3.07Å; Q209-D211 PolarHBondContact O-N 2.85Å; Q209-Q212 PolarHBondContact O-N 3.06Å; Q209-E213 WeakPolarHBondContact O-CG 3.19Å; Q209-E213 PolarHBondContact O-N 3.3Å; Q209-E213 VanDerWaalsContact O-N 3.16Å |
| 210 | H | 36.8 | Very low | 43.9 | Very low | 142 Ų | 142 | 137.3 Ų | 137.3 | 66% | 0.657 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | -28.6 | -176.9 | -143.6 | -45.8 | 0 | 0 | 0 | 113.4 | ||
| 211 | D | 34.7 | Very low | 43 | Very low | 134 Ų | 134 | 139.1 Ų | 139.1 | 72% | 0.717 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -13.5 | 176.6 | -74.2 | -22.5 | 0 | 0 | 0 | 113.7 | Q209 | Q209-D211 PolarHBondContact O-N 2.85Š|
| 212 | Q | 37.4 | Very low | 43.3 | Very low | 113 Ų | 113 | 132.7 Ų | 132.7 | 53% | 0.528 | 65% | 0.646 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.4 | -20.9 | 176.9 | -75.9 | -168.3 | -24.1 | 0 | 0 | 113.7 | Q208 Q209 D214 K215 K216 | Q208-Q212 WeakPolarHBondContact O-CG 3.5Å; Q209-Q212 PolarHBondContact O-N 3.06Å; Q212-D214 VanDerWaalsContact C-N 3.29Å; Q212-D214 PolarHBondContact O-N 3.43Å; Q212-K215 PolarHBondContact O-N 3.3Å; Q212-K216 PolarHBondContact O-N 2.81Å |
| 213 | E | 40.7 | Very low | 44.2 | Very low | 140 Ų | 140 | 130.5 Ų | 130.5 | 65% | 0.654 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -64.4 | -31.6 | 176.1 | -84.1 | -175.5 | 165 | 0 | 0 | 112.8 | Q209 K215 | Q209-E213 WeakPolarHBondContact O-CG 3.19Å; Q209-E213 PolarHBondContact O-N 3.3Å; Q209-E213 VanDerWaalsContact O-N 3.16Å; E213-K215 VanDerWaalsContact C-N 3.28Å; E213-K215 PolarHBondContact O-N 3.04Å |
| 214 | D | 35.7 | Very low | 46.3 | Very low | 153 Ų | 153 | 129.1 Ų | 129.1 | 82% | 0.818 | 62% | 0.622 | S | S | * | * | G | 310 helix | trans | -76.7 | -10.1 | 177 | -80.3 | -30.8 | 0 | 0 | 0 | 114.3 | Q212 | Q212-D214 VanDerWaalsContact C-N 3.29Å; Q212-D214 PolarHBondContact O-N 3.43Å |
| 215 | K | 37.6 | Very low | 48.4 | Very low | 187 Ų | 187 | 126 Ų | 126 | 81% | 0.813 | 61% | 0.613 | S | S | * | * | G | 310 helix | trans | -111.5 | 4.2 | 177.4 | -79 | -174.7 | -179.3 | 173.7 | 0 | 114.8 | Q212 E213 K217 | Q212-K215 PolarHBondContact O-N 3.3Å; E213-K215 VanDerWaalsContact C-N 3.28Å; E213-K215 PolarHBondContact O-N 3.04Å; K215-K217 PolarHBondContact O-N 2.78Å |
| 216 | K | 42.7 | Very low | 50.5 | Low | 156 Ų | 156 | 121.7 Ų | 121.7 | 68% | 0.678 | 59% | 0.585 | S | S | * | * | trans | -70.6 | 100.9 | 164.1 | -83.8 | -173 | 175.3 | -174 | 0 | 108.2 | Q212 K218 | Q212-K216 PolarHBondContact O-N 2.81Å; K216-K218 PolarHBondContact O-N 2.87Å; K216-K218 VanDerWaalsContact O-N 3.12Å | ||
| 217 | K | 39.5 | Very low | 52.7 | Low | 188 Ų | 188 | 122.4 Ų | 122.4 | 82% | 0.817 | 57% | 0.574 | S | S | * | * | trans | -42 | 125.7 | 160.9 | -96.7 | 177.5 | 175.6 | 173.7 | 0 | 106.7 | K215 E219 | K215-K217 PolarHBondContact O-N 2.78Å; K217-E219 PolarHBondContact O-N 3.06Å | ||
| 218 | K | 43.4 | Very low | 55 | Low | 205 Ų | 205 | 123.2 Ų | 123.2 | 89% | 0.891 | 57% | 0.574 | S | S | * | * | trans | -61.7 | 81.9 | 168.6 | -71.3 | -179.1 | -179.4 | 177.8 | 0 | 107.6 | K216 K220 | K216-K218 PolarHBondContact O-N 2.87Å; K216-K218 VanDerWaalsContact O-N 3.12Å; K218-K220 PolarHBondContact O-N 2.87Å | ||
| 219 | E | 53 | Low | 57.1 | Low | 144 Ų | 144 | 121.1 Ų | 121.1 | 67% | 0.673 | 57% | 0.567 | S | S | * | * | trans | -59.8 | 125.6 | 170.5 | -71.9 | -172 | 165.7 | 0 | 0 | 106.8 | K217 L221 | K217-E219 PolarHBondContact O-N 3.06Å; E219-L221 PolarHBondContact O-N 3.15Å | ||
| 220 | K | 58.8 | Low | 59.3 | Low | 174 Ų | 174 | 125.5 Ų | 125.5 | 76% | 0.757 | 58% | 0.58 | S | S | * | * | trans | -65.9 | 123.5 | -178.1 | -66.1 | 178.7 | -179.8 | 178.9 | 0 | 107.2 | K218 L222 | K218-K220 PolarHBondContact O-N 2.87Å; K220-L222 PolarHBondContact O-N 3.34Å | ||
| 221 | L | 60.6 | Low | 61.6 | Low | 94 Ų | 94 | 120 Ų | 120 | 49% | 0.492 | 56% | 0.562 | S | S | . | * | S | Bend | trans | -52.7 | -27.4 | 177.9 | -71.4 | 168.2 | 0 | 0 | 0 | 113 | V80 E219 | V80-L221 HydrophobicContact CG2-CD1 3.87Å; E219-L221 PolarHBondContact O-N 3.15Å |
| 222 | L | 68.1 | Low | 64.1 | Low | 39 Ų | 39 | 113.7 Ų | 113.7 | 20% | 0.204 | 53% | 0.527 | C | S | . | . | S | Bend | trans | -132.3 | 114.8 | 170.9 | -64.2 | 171.9 | 0 | 0 | 0 | 108.4 | P76 K220 F224 L362 | P76-L222 HydrophobicContact CG-CD1 4.47Å; K220-L222 PolarHBondContact O-N 3.34Å; L222-F224 HydrophobicContact CB-CD2 4.29Å; L222-F224 HydrophobicContact CB-CE2 3.76Å; L222-F224 HydrophobicContact CB-CZ 4.32Å; L222-F224 HydrophobicContact CD1-CE2 4.44Å; L222-F224 HydrophobicContact CD1-CZ 4.31Å; L222-L362 HydrophobicContact CB-CD2 4.37Å; L222-L362 HydrophobicContact CD1-CD2 4.31Å; L222-L362 HydrophobicContact CD2-CD2 4.11Å; L222-L362 HydrophobicContact CD2-CG 4.22Å |
| 223 | D | 75.8 | Confident | 66.7 | Low | 61 Ų | 61 | 111 Ų | 111 | 33% | 0.326 | 52% | 0.518 | S | S | . | . | trans | -90.6 | 104 | 169.1 | -175.6 | 13.5 | 0 | 0 | 0 | 109.7 | S225 V226 S358 | D223-S225 PolarHBondContact O-N 2.88Å; D223-S225 WeakPolarHBondContact OD1-CB 3.25Å; D223-S225 PolarHBondContact OD1-N 3.14Å; D223-S225 PolarHBondContact OD1-OG 3.37Å; D223-S225 WeakPolarHBondContact OD2-CB 3.46Å; D223-S225 PolarHBondContact OD2-OG 3.26Å; D223-V226 WeakPolarHBondContact O-CG2 3.37Å; D223-S358 WeakPolarHBondContact CA-OG 3.02Å; D223-S358 PolarHBondContact N-OG 3.35Å; D223-S358 PolarHBondContact O-OG 3.48Å | ||
| 224 | F | 82.6 | Confident | 69 | Low | 128 Ų | 128 | 106 Ų | 106 | 56% | 0.561 | 50% | 0.496 | S | S | * | . | G | 310 helix | trans | -72.1 | -3.4 | 176.2 | -70.1 | -95.1 | 0 | 0 | 0 | 113 | L222 V226 F227 L362 | L222-F224 HydrophobicContact CB-CD2 4.29Å; L222-F224 HydrophobicContact CB-CE2 3.76Å; L222-F224 HydrophobicContact CB-CZ 4.32Å; L222-F224 HydrophobicContact CD1-CE2 4.44Å; L222-F224 HydrophobicContact CD1-CZ 4.31Å; F224-V226 PolarHBondContact O-N 3.01Å; F224-V226 VanDerWaalsContact O-N 3.13Å; F224-F227 HydrophobicContact CB-CD2 4.25Å; F224-F227 AromaticContact CD1-CD2 3.84Å; F224-F227 HydrophobicContact CD1-CD2 3.84Å; F224-F227 AromaticContact CD1-CE2 3.56Å; F224-F227 HydrophobicContact CD1-CE2 3.56Å; F224-F227 HydrophobicContact CE1-CE2 4.09Å; F224-F227 PolarHBondContact O-N 3.4Å; F224-F227 VanDerWaalsContact O-N 3.16Å; F224-L362 HydrophobicContact CD1-CD2 4.16Å; F224-L362 HydrophobicContact CE1-CD2 3.72Å; F224-L362 HydrophobicContact CZ-CD2 3.99Å |
| 225 | S | 80.8 | Confident | 71.7 | Confident | 36 Ų | 36 | 98.7 Ų | 98.7 | 25% | 0.252 | 46% | 0.457 | S | S | . | . | G | 310 helix | trans | -59.3 | -22.9 | 175.4 | 84.2 | 0 | 0 | 0 | 0 | 113 | D223 F227 K228 | D223-S225 PolarHBondContact O-N 2.88Å; D223-S225 WeakPolarHBondContact OD1-CB 3.25Å; D223-S225 PolarHBondContact OD1-N 3.14Å; D223-S225 PolarHBondContact OD1-OG 3.37Å; D223-S225 WeakPolarHBondContact OD2-CB 3.46Å; D223-S225 PolarHBondContact OD2-OG 3.26Å; S225-F227 PolarHBondContact O-N 2.81Å; S225-K228 WeakPolarHBondContact O-CB 3.45Å; S225-K228 PolarHBondContact O-N 3.14Å; S225-K228 VanDerWaalsContact O-N 3.11Å |
| 226 | V | 79.9 | Confident | 74.3 | Confident | 4 Ų | 4 | 90.3 Ų | 90.3 | 2% | 0.024 | 42% | 0.422 | C | S | . | . | G | 310 helix | trans | -62.7 | -28.9 | 178.4 | -166.1 | 0 | 0 | 0 | 0 | 111.9 | D223 F224 K228 D229 F232 V351 K355 A359 | D223-V226 WeakPolarHBondContact O-CG2 3.37Å; F224-V226 PolarHBondContact O-N 3.01Å; F224-V226 VanDerWaalsContact O-N 3.13Å; V226-K228 PolarHBondContact O-N 3.38Å; V226-D229 WeakPolarHBondContact O-CB 3.28Å; V226-D229 PolarHBondContact O-N 2.92Å; V226-F232 HydrophobicContact CB-CD1 4.09Å; V226-F232 HydrophobicContact CB-CE1 4.08Å; V226-F232 HydrophobicContact CB-CG 4.47Å; V226-F232 HydrophobicContact CB-CZ 4.47Å; V226-F232 HydrophobicContact CG1-CB 4Å; V226-F232 HydrophobicContact CG1-CD1 3.49Å; V226-F232 VanDerWaalsContact CG1-CD1 3.49Å; V226-F232 HydrophobicContact CG1-CD2 3.64Å; V226-F232 HydrophobicContact CG1-CE1 3.77Å; V226-F232 HydrophobicContact CG1-CE2 3.91Å; V226-F232 HydrophobicContact CG1-CG 3.4Å; V226-F232 VanDerWaalsContact CG1-CG 3.4Å; V226-F232 HydrophobicContact CG1-CZ 3.97Å; V226-F232 WeakPolarHBondContact O-CD1 3.42Å; V226-V351 HydrophobicContact CG1-CG1 4.29Å; V226-V351 HydrophobicContact CG1-CG2 4.28Å; V226-K355 HydrophobicContact CG2-CB 4.3Å; V226-K355 HydrophobicContact CG2-CD 4.38Å; V226-A359 HydrophobicContact CG1-CB 4.02Å |
| 227 | F | 85.8 | Confident | 76.7 | Confident | 90 Ų | 90 | 86.6 Ų | 86.6 | 40% | 0.395 | 41% | 0.412 | S | S | . | . | G | 310 helix | trans | -65.4 | -10.4 | 175.5 | -73.3 | -73.8 | 0 | 0 | 0 | 114.1 | F224 S225 D229 F232 V233 L362 | F224-F227 HydrophobicContact CB-CD2 4.25Å; F224-F227 AromaticContact CD1-CD2 3.84Å; F224-F227 HydrophobicContact CD1-CD2 3.84Å; F224-F227 AromaticContact CD1-CE2 3.56Å; F224-F227 HydrophobicContact CD1-CE2 3.56Å; F224-F227 HydrophobicContact CE1-CE2 4.09Å; F224-F227 PolarHBondContact O-N 3.4Å; F224-F227 VanDerWaalsContact O-N 3.16Å; S225-F227 PolarHBondContact O-N 2.81Å; F227-D229 VanDerWaalsContact C-N 3.29Å; F227-F232 HydrophobicContact CD1-CD1 4.31Å; F227-F232 AromaticContact CD1-CE1 3.95Å; F227-F232 HydrophobicContact CD1-CE1 3.95Å; F227-F232 AromaticContact CE1-CE1 3.9Å; F227-F232 HydrophobicContact CE1-CE1 3.9Å; F227-F232 HydrophobicContact CG-CE1 4.32Å; F227-F232 HydrophobicContact CZ-CE1 4.23Å; F227-V233 HydrophobicContact CD1-CG2 4.21Å; F227-V233 WeakPolarHBondContact O-CG2 3.43Å; F227-L362 HydrophobicContact CD2-CD1 4.2Å; F227-L362 HydrophobicContact CE2-CD1 3.62Å; F227-L362 HydrophobicContact CE2-CD2 4.01Å; F227-L362 HydrophobicContact CE2-CG 4.28Å; F227-L362 HydrophobicContact CZ-CB 4.45Å; F227-L362 HydrophobicContact CZ-CD1 4.26Å; F227-L362 HydrophobicContact CZ-CD2 4.44Å |
| 228 | K | 84.1 | Confident | 79.3 | Confident | 187 Ų | 187 | 77.6 Ų | 77.6 | 81% | 0.813 | 37% | 0.373 | S | S | * | . | G | 310 helix | trans | -73.9 | -22.7 | 170.7 | -64.8 | -178 | 178 | -179.1 | 0 | 112.4 | S225 V226 R230 | S225-K228 WeakPolarHBondContact O-CB 3.45Å; S225-K228 PolarHBondContact O-N 3.14Å; S225-K228 VanDerWaalsContact O-N 3.11Å; V226-K228 PolarHBondContact O-N 3.38Å; K228-R230 PolarHBondContact O-N 2.97Å |
| 229 | D | 82.5 | Confident | 81.7 | Confident | 73 Ų | 73 | 68 Ų | 68 | 39% | 0.39 | 33% | 0.331 | S | S | . | . | trans | -78.6 | 118.3 | 176.4 | -169.7 | -63.9 | 0 | 0 | 0 | 110.2 | V226 F227 G231 F232 V233 | V226-D229 WeakPolarHBondContact O-CB 3.28Å; V226-D229 PolarHBondContact O-N 2.92Å; F227-D229 VanDerWaalsContact C-N 3.29Å; D229-G231 VanDerWaalsContact C-N 3.3Å; D229-G231 PolarHBondContact O-N 3.12Å; D229-G231 VanDerWaalsContact OD1-CA 3.28Å; D229-G231 WeakPolarHBondContact OD1-CA 3.45Å; D229-G231 PolarHBondContact OD1-N 3.12Å; D229-F232 HydrophobicContact CB-CB 4Å; D229-F232 PolarHBondContact O-N 2.66Å; D229-F232 PolarHBondContact OD1-N 3.45Å; D229-V233 WeakPolarHBondContact O-CG2 3.37Å; D229-V233 PolarHBondContact O-N 3.45Å; D229-V233 VanDerWaalsContact O-N 3.12Å | ||
| 230 | R | 84.8 | Confident | 83.7 | Confident | 188 Ų | 188 | 62.4 Ų | 62.4 | 71% | 0.709 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -64.1 | -35.4 | -178.6 | -64.6 | -177.1 | -178.3 | 179.9 | 0.1 | 112.3 | K228 V233 I234 | K228-R230 PolarHBondContact O-N 2.97Å; R230-V233 PolarHBondContact O-N 2.98Å; R230-I234 WeakPolarHBondContact O-CB 3.49Å; R230-I234 VanDerWaalsContact O-CD1 3.31Å; R230-I234 WeakPolarHBondContact O-CD1 3.32Å; R230-I234 WeakPolarHBondContact O-CG1 3.44Å; R230-I234 PolarHBondContact O-N 3.4Å; R230-I234 VanDerWaalsContact O-N 3.1Å |
| 231 | G | 85.1 | Confident | 85.5 | Confident | 27 Ų | 27 | 56 Ų | 56 | 28% | 0.278 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -65 | -42.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | D229 Y235 | D229-G231 VanDerWaalsContact C-N 3.3Å; D229-G231 PolarHBondContact O-N 3.12Å; D229-G231 VanDerWaalsContact OD1-CA 3.28Å; D229-G231 WeakPolarHBondContact OD1-CA 3.45Å; D229-G231 PolarHBondContact OD1-N 3.12Å; G231-Y235 VanDerWaalsContact O-CB 3.3Å; G231-Y235 WeakPolarHBondContact O-CB 3.46Å; G231-Y235 PolarHBondContact O-N 2.9Å |
| 232 | F | 88.3 | Confident | 87.2 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.1 | -44.9 | 175.4 | 176.3 | -104.8 | 0 | 0 | 0 | 112.9 | V226 F227 D229 Y235 T236 L347 V351 A359 L362 V363 | V226-F232 HydrophobicContact CB-CD1 4.09Å; V226-F232 HydrophobicContact CB-CE1 4.08Å; V226-F232 HydrophobicContact CB-CG 4.47Å; V226-F232 HydrophobicContact CB-CZ 4.47Å; V226-F232 HydrophobicContact CG1-CB 4Å; V226-F232 HydrophobicContact CG1-CD1 3.49Å; V226-F232 VanDerWaalsContact CG1-CD1 3.49Å; V226-F232 HydrophobicContact CG1-CD2 3.64Å; V226-F232 HydrophobicContact CG1-CE1 3.77Å; V226-F232 HydrophobicContact CG1-CE2 3.91Å; V226-F232 HydrophobicContact CG1-CG 3.4Å; V226-F232 VanDerWaalsContact CG1-CG 3.4Å; V226-F232 HydrophobicContact CG1-CZ 3.97Å; V226-F232 WeakPolarHBondContact O-CD1 3.42Å; F227-F232 HydrophobicContact CD1-CD1 4.31Å; F227-F232 AromaticContact CD1-CE1 3.95Å; F227-F232 HydrophobicContact CD1-CE1 3.95Å; F227-F232 AromaticContact CE1-CE1 3.9Å; F227-F232 HydrophobicContact CE1-CE1 3.9Å; F227-F232 HydrophobicContact CG-CE1 4.32Å; F227-F232 HydrophobicContact CZ-CE1 4.23Å; D229-F232 HydrophobicContact CB-CB 4Å; D229-F232 PolarHBondContact O-N 2.66Å; D229-F232 PolarHBondContact OD1-N 3.45Å; F232-Y235 PolarHBondContact O-N 2.69Å; F232-T236 WeakPolarHBondContact CZ-OG1 3.18Å; F232-T236 WeakPolarHBondContact O-CB 3.32Å; F232-T236 PolarHBondContact O-N 3.33Å; F232-T236 PolarHBondContact O-OG1 2.94Å; F232-L347 HydrophobicContact CD2-CD1 4.09Å; F232-L347 HydrophobicContact CE2-CD1 4.14Å; F232-V351 HydrophobicContact CB-CG2 4.22Å; F232-V351 HydrophobicContact CD2-CG2 3.61Å; F232-V351 HydrophobicContact CE2-CG2 4.43Å; F232-V351 HydrophobicContact CG-CG2 4.28Å; F232-A359 HydrophobicContact CD2-CB 4.11Å; F232-A359 HydrophobicContact CE2-CB 3.6Å; F232-A359 HydrophobicContact CZ-CB 4.32Å; F232-L362 HydrophobicContact CZ-CB 4.08Å; F232-L362 HydrophobicContact CZ-CD1 4.41Å; F232-V363 HydrophobicContact CE2-CG2 3.58Å; F232-V363 HydrophobicContact CZ-CG2 3.97Å |
| 233 | V | 90.5 | Very high | 88.5 | Confident | 56 Ų | 56 | 49.7 Ų | 49.7 | 34% | 0.339 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61 | -47.9 | 178.9 | 175.1 | 0 | 0 | 0 | 0 | 110.8 | F227 D229 R230 Y235 T236 V237 | F227-V233 HydrophobicContact CD1-CG2 4.21Å; F227-V233 WeakPolarHBondContact O-CG2 3.43Å; D229-V233 WeakPolarHBondContact O-CG2 3.37Å; D229-V233 PolarHBondContact O-N 3.45Å; D229-V233 VanDerWaalsContact O-N 3.12Å; R230-V233 PolarHBondContact O-N 2.98Å; V233-Y235 VanDerWaalsContact C-N 3.35Å; V233-Y235 PolarHBondContact O-N 3.07Å; V233-T236 PolarHBondContact O-N 3.22Å; V233-V237 WeakPolarHBondContact O-CG2 3.39Å; V233-V237 PolarHBondContact O-N 3.34Å |
| 234 | I | 89.9 | Confident | 89.4 | Confident | 35 Ų | 35 | 48.9 Ų | 48.9 | 18% | 0.179 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.1 | -47.1 | 177.9 | -69.9 | 163.1 | 0 | 0 | 0 | 110.7 | R230 T236 V237 A238 V405 C409 F413 | R230-I234 WeakPolarHBondContact O-CB 3.49Å; R230-I234 VanDerWaalsContact O-CD1 3.31Å; R230-I234 WeakPolarHBondContact O-CD1 3.32Å; R230-I234 WeakPolarHBondContact O-CG1 3.44Å; R230-I234 PolarHBondContact O-N 3.4Å; R230-I234 VanDerWaalsContact O-N 3.1Å; I234-T236 VanDerWaalsContact C-N 3.33Å; I234-T236 PolarHBondContact O-N 3.43Å; I234-V237 PolarHBondContact O-N 3.39Å; I234-A238 WeakPolarHBondContact O-CB 3.49Å; I234-A238 PolarHBondContact O-N 3.48Å; I234-V405 HydrophobicContact CG2-CG1 4.31Å; I234-C409 HydrophobicContact CD1-CB 4.11Å; I234-C409 HydrophobicContact CG2-CB 3.67Å; I234-C409 WeakPolarHBondContact CG2-SG 3.37Å; I234-F413 HydrophobicContact CD1-CD2 4.14Å; I234-F413 HydrophobicContact CD1-CE2 3.43Å; I234-F413 VanDerWaalsContact CD1-CE2 3.43Å; I234-F413 HydrophobicContact CD1-CZ 4.12Å |
| 235 | Y | 91.5 | Very high | 90 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.2 | -44.5 | 178 | 176.4 | -88 | 0 | 0 | 0 | 111.5 | G231 F232 V233 A238 A239 F302 Q343 V346 L347 I350 V363 L406 | G231-Y235 VanDerWaalsContact O-CB 3.3Å; G231-Y235 WeakPolarHBondContact O-CB 3.46Å; G231-Y235 PolarHBondContact O-N 2.9Å; F232-Y235 PolarHBondContact O-N 2.69Å; V233-Y235 VanDerWaalsContact C-N 3.35Å; V233-Y235 PolarHBondContact O-N 3.07Å; Y235-A238 PolarHBondContact O-N 2.84Å; Y235-A239 HydrophobicContact CE1-CB 4.13Å; Y235-A239 WeakPolarHBondContact O-CB 3.49Å; Y235-A239 PolarHBondContact O-N 3.28Å; Y235-F302 AromaticContact CE2-CE1 3.99Å; Y235-F302 HydrophobicContact CE2-CE1 3.99Å; Y235-Q343 WeakPolarHBondContact OH-CG 3.28Å; Y235-Q343 PolarHBondContact OH-O 2.95Å; Y235-V346 HydrophobicContact CD2-CG1 3.98Å; Y235-V346 HydrophobicContact CE2-CB 4.31Å; Y235-V346 HydrophobicContact CE2-CG1 3.79Å; Y235-L347 HydrophobicContact CD1-CD1 3.83Å; Y235-L347 HydrophobicContact CE1-CB 3.98Å; Y235-L347 HydrophobicContact CE1-CD1 3.79Å; Y235-L347 HydrophobicContact CE1-CD2 4.39Å; Y235-L347 HydrophobicContact CE1-CG 4.26Å; Y235-I350 HydrophobicContact CD2-CD1 3.68Å; Y235-I350 HydrophobicContact CG-CD1 3.93Å; Y235-V363 HydrophobicContact CD1-CG2 4.27Å; Y235-V363 HydrophobicContact CE1-CG1 4.17Å; Y235-V363 HydrophobicContact CE1-CG2 4.19Å; Y235-L406 HydrophobicContact CD2-CD2 4.23Å |
| 236 | T | 92.6 | Very high | 90.8 | Very high | 12 Ų | 12 | 41.3 Ų | 41.3 | 7% | 0.074 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.5 | -46 | -180 | -55.9 | 0 | 0 | 0 | 0 | 111 | F232 V233 I234 A239 S240 V363 A366 | F232-T236 WeakPolarHBondContact CZ-OG1 3.18Å; F232-T236 WeakPolarHBondContact O-CB 3.32Å; F232-T236 PolarHBondContact O-N 3.33Å; F232-T236 PolarHBondContact O-OG1 2.94Å; V233-T236 PolarHBondContact O-N 3.22Å; I234-T236 VanDerWaalsContact C-N 3.33Å; I234-T236 PolarHBondContact O-N 3.43Å; T236-A239 PolarHBondContact O-N 3.45Å; T236-S240 PolarHBondContact O-N 3.32Å; T236-S240 PolarHBondContact O-OG 3.43Å; T236-S240 VanDerWaalsContact O-OG 3.08Å; T236-V363 HydrophobicContact CG2-CG2 4.38Å; T236-A366 HydrophobicContact CG2-CB 3.96Å |
| 237 | V | 93.3 | Very high | 91.5 | Very high | 77 Ų | 77 | 41.8 Ų | 41.8 | 47% | 0.467 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -61.8 | -46.6 | 176.6 | 172.1 | 0 | 0 | 0 | 0 | 111 | V233 I234 S240 I241 | V233-V237 WeakPolarHBondContact O-CG2 3.39Å; V233-V237 PolarHBondContact O-N 3.34Å; I234-V237 PolarHBondContact O-N 3.39Å; V237-S240 PolarHBondContact O-N 2.84Å; V237-I241 HydrophobicContact CG1-CD1 3.9Å; V237-I241 VanDerWaalsContact O-CG1 3.31Å; V237-I241 WeakPolarHBondContact O-CG1 3.3Å; V237-I241 PolarHBondContact O-N 3.12Å |
| 238 | A | 93.9 | Very high | 92 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.6 | -43.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I234 Y235 S240 I241 M242 S402 V405 L406 | I234-A238 WeakPolarHBondContact O-CB 3.49Å; I234-A238 PolarHBondContact O-N 3.48Å; Y235-A238 PolarHBondContact O-N 2.84Å; A238-S240 PolarHBondContact O-N 3.45Å; A238-I241 PolarHBondContact O-N 3.15Å; A238-M242 WeakPolarHBondContact O-CB 3.14Å; A238-M242 PolarHBondContact O-N 3.2Å; A238-S402 VanDerWaalsContact C-OG 3.24Å; A238-S402 WeakPolarHBondContact O-CB 3.46Å; A238-S402 PolarHBondContact O-OG 2.99Å; A238-V405 HydrophobicContact CB-CG1 4.22Å; A238-L406 HydrophobicContact CB-CD1 3.64Å; A238-L406 HydrophobicContact CB-CD2 4.3Å; A238-L406 HydrophobicContact CB-CG 3.55Å |
| 239 | A | 93.4 | Very high | 92.6 | Very high | 3 Ų | 3 | 28.7 Ų | 28.7 | 3% | 0.025 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.1 | -41.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y235 T236 M242 V243 | Y235-A239 HydrophobicContact CE1-CB 4.13Å; Y235-A239 WeakPolarHBondContact O-CB 3.49Å; Y235-A239 PolarHBondContact O-N 3.28Å; T236-A239 PolarHBondContact O-N 3.45Å; A239-M242 WeakPolarHBondContact O-CB 3.28Å; A239-M242 PolarHBondContact O-N 3.04Å; A239-V243 WeakPolarHBondContact O-CB 3.36Å; A239-V243 WeakPolarHBondContact O-CG2 3.46Å; A239-V243 PolarHBondContact O-N 3.29Å |
| 240 | S | 95.2 | Very high | 93.3 | Very high | 27 Ų | 27 | 25.3 Ų | 25.3 | 19% | 0.189 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.3 | -44.5 | 174.1 | -63.5 | 0 | 0 | 0 | 0 | 112.5 | T236 V237 A238 V243 L244 A366 A370 | T236-S240 PolarHBondContact O-N 3.32Å; T236-S240 PolarHBondContact O-OG 3.43Å; T236-S240 VanDerWaalsContact O-OG 3.08Å; V237-S240 PolarHBondContact O-N 2.84Å; A238-S240 PolarHBondContact O-N 3.45Å; S240-V243 PolarHBondContact O-N 2.93Å; S240-L244 PolarHBondContact O-N 3.42Å; S240-A366 WeakPolarHBondContact OG-CB 3.33Å; S240-A370 WeakPolarHBondContact O-CB 3.47Å |
| 241 | I | 96.1 | Very high | 93.8 | Very high | 38 Ų | 38 | 16.7 Ų | 16.7 | 20% | 0.195 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63 | -42.8 | 176 | -65.5 | 167.1 | 0 | 0 | 0 | 110.8 | V237 A238 V243 L244 E398 L401 | V237-I241 HydrophobicContact CG1-CD1 3.9Å; V237-I241 VanDerWaalsContact O-CG1 3.31Å; V237-I241 WeakPolarHBondContact O-CG1 3.3Å; V237-I241 PolarHBondContact O-N 3.12Å; A238-I241 PolarHBondContact O-N 3.15Å; I241-V243 VanDerWaalsContact C-N 3.33Å; I241-V243 PolarHBondContact O-N 3.21Å; I241-L244 WeakPolarHBondContact O-CB 3.41Å; I241-L244 PolarHBondContact O-N 2.66Å; I241-E398 HydrophobicContact CG2-CB 4.37Å; I241-E398 VanDerWaalsContact CG2-O 3.29Å; I241-E398 WeakPolarHBondContact CG2-O 2.96Å; I241-L401 HydrophobicContact CG2-CD2 4.43Å |
| 242 | M | 96.3 | Very high | 94.4 | Very high | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -58.8 | -46.5 | 176.7 | 178.7 | -169.6 | 71 | 0 | 0 | 110.9 | A238 A239 L244 G245 L246 F302 M306 V339 | A238-M242 WeakPolarHBondContact O-CB 3.14Å; A238-M242 PolarHBondContact O-N 3.2Å; A239-M242 WeakPolarHBondContact O-CB 3.28Å; A239-M242 PolarHBondContact O-N 3.04Å; M242-L244 VanDerWaalsContact C-N 3.3Å; M242-L244 PolarHBondContact O-N 2.76Å; M242-G245 PolarHBondContact O-N 3.4Å; M242-L246 HydrophobicContact CE-CD2 4.28Å; M242-L246 HydrophobicContact CG-CB 4.39Å; M242-L246 HydrophobicContact CG-CD2 4.34Å; M242-L246 WeakPolarHBondContact O-CB 3.48Å; M242-L246 PolarHBondContact O-N 3.29Å; M242-L246 HydrophobicContact SD-CD2 4.45Å; M242-F302 HydrophobicContact SD-CZ 4.1Å; M242-M306 HydrophobicContact CG-SD 4.35Å; M242-M306 HydrophobicContact SD-CG 3.96Å; M242-M306 HydrophobicContact SD-SD 3.77Å; M242-V339 HydrophobicContact CE-CG1 4.13Å; M242-V339 HydrophobicContact SD-CG1 3.58Å; M242-V339 VanDerWaalsContact SD-CG1 3.58Å |
| 243 | V | 95.3 | Very high | 94.8 | Very high | 1 Ų | 1 | 15.5 Ų | 15.5 | 1% | 0.006 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -67.7 | -27.6 | -177 | 165.6 | 0 | 0 | 0 | 0 | 113 | A239 S240 I241 G245 F247 E367 A370 V371 | A239-V243 WeakPolarHBondContact O-CB 3.36Å; A239-V243 WeakPolarHBondContact O-CG2 3.46Å; A239-V243 PolarHBondContact O-N 3.29Å; S240-V243 PolarHBondContact O-N 2.93Å; I241-V243 VanDerWaalsContact C-N 3.33Å; I241-V243 PolarHBondContact O-N 3.21Å; V243-G245 VanDerWaalsContact C-N 3.31Å; V243-G245 PolarHBondContact O-N 3.48Å; V243-F247 HydrophobicContact CB-CE2 4.42Å; V243-F247 HydrophobicContact CG1-CD2 3.87Å; V243-F247 HydrophobicContact CG1-CE2 3.84Å; V243-F247 HydrophobicContact CG2-CE2 4.14Å; V243-E367 HydrophobicContact CB-CG 4.46Å; V243-E367 HydrophobicContact CG1-CB 4.3Å; V243-E367 WeakPolarHBondContact CG1-O 3.3Å; V243-E367 HydrophobicContact CG2-CB 4.19Å; V243-E367 HydrophobicContact CG2-CG 3.8Å; V243-A370 HydrophobicContact CB-CB 4.08Å; V243-A370 HydrophobicContact CG1-CB 3.79Å; V243-V371 HydrophobicContact CG1-CB 3.75Å |
| 244 | L | 95.3 | Very high | 95.1 | Very high | 44 Ų | 44 | 12.9 Ų | 12.9 | 23% | 0.23 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -57 | -45.3 | 172.4 | -74.8 | 168.9 | 0 | 0 | 0 | 111.5 | S240 I241 M242 V248 A370 V373 G374 E398 | S240-L244 PolarHBondContact O-N 3.42Å; I241-L244 WeakPolarHBondContact O-CB 3.41Å; I241-L244 PolarHBondContact O-N 2.66Å; M242-L244 VanDerWaalsContact C-N 3.3Å; M242-L244 PolarHBondContact O-N 2.76Å; L244-V248 VanDerWaalsContact O-CG2 3.31Å; L244-V248 WeakPolarHBondContact O-CG2 3.44Å; L244-A370 HydrophobicContact CD2-CB 4.14Å; L244-A370 VanDerWaalsContact CD2-O 3.29Å; L244-A370 WeakPolarHBondContact CD2-O 3.21Å; L244-A370 HydrophobicContact CG-CB 4.02Å; L244-V373 HydrophobicContact CD2-CB 4.29Å; L244-V373 HydrophobicContact CD2-CG1 4.47Å; L244-G374 WeakPolarHBondContact O-CA 3.31Å; L244-E398 VanDerWaalsContact C-OE2 3.23Å; L244-E398 VanDerWaalsContact CB-OE2 3.3Å; L244-E398 WeakPolarHBondContact CB-OE2 3.24Å |
| 245 | G | 95.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -90.2 | -39.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | M242 V243 F247 V248 P249 E398 | M242-G245 PolarHBondContact O-N 3.4Å; V243-G245 VanDerWaalsContact C-N 3.31Å; V243-G245 PolarHBondContact O-N 3.48Å; G245-F247 VanDerWaalsContact C-N 3.25Å; G245-F247 PolarHBondContact O-N 3.48Å; G245-F247 VanDerWaalsContact O-N 3.09Å; G245-V248 WeakPolarHBondContact O-CB 3.34Å; G245-V248 PolarHBondContact O-N 3.12Å; G245-P249 WeakPolarHBondContact O-CD 3.47Å; G245-E398 VanDerWaalsContact CA-OE2 3.28Å; G245-E398 WeakPolarHBondContact CA-OE2 3.17Å; G245-E398 PolarHBondContact N-OE2 3.41Å |
| 246 | L | 96.8 | Very high | 95.5 | Very high | 6 Ų | 6 | 12.1 Ų | 12.1 | 3% | 0.031 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -59.4 | -30.5 | -168.6 | -176.3 | 69.3 | 0 | 0 | 0 | 114.2 | M242 N309 F332 Y336 V339 V399 | M242-L246 HydrophobicContact CE-CD2 4.28Å; M242-L246 HydrophobicContact CG-CB 4.39Å; M242-L246 HydrophobicContact CG-CD2 4.34Å; M242-L246 WeakPolarHBondContact O-CB 3.48Å; M242-L246 PolarHBondContact O-N 3.29Å; M242-L246 HydrophobicContact SD-CD2 4.45Å; L246-N309 VanDerWaalsContact CD1-OD1 3.25Å; L246-N309 WeakPolarHBondContact CD1-OD1 3.34Å; L246-F332 HydrophobicContact CD1-CZ 4.4Å; L246-Y336 HydrophobicContact CD1-CD2 3.69Å; L246-Y336 HydrophobicContact CD1-CE2 3.99Å; L246-Y336 HydrophobicContact CD2-CD2 4.48Å; L246-Y336 HydrophobicContact CD2-CE2 4.09Å; L246-Y336 HydrophobicContact CG-CD2 4.05Å; L246-Y336 HydrophobicContact CG-CE2 3.8Å; L246-V339 HydrophobicContact CD2-CG1 3.98Å; L246-V399 HydrophobicContact CB-CG2 4.31Å |
| 247 | F | 94.9 | Very high | 95.6 | Very high | 13 Ų | 13 | 11.6 Ų | 11.6 | 6% | 0.057 | 7% | 0.065 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | -10.5 | -179.6 | -70 | -76.2 | 0 | 0 | 0 | 113.8 | L68 Y72 V243 G245 V251 Y336 V371 | L68-F247 HydrophobicContact CD2-CD1 3.71Å; L68-F247 HydrophobicContact CD2-CD2 4.18Å; L68-F247 HydrophobicContact CD2-CE1 3.55Å; L68-F247 HydrophobicContact CD2-CE2 4.02Å; L68-F247 HydrophobicContact CD2-CG 4.04Å; L68-F247 HydrophobicContact CD2-CZ 3.72Å; Y72-F247 HydrophobicContact CE2-CE2 4.44Å; Y72-F247 HydrophobicContact CE2-CZ 4.35Å; Y72-F247 WeakPolarHBondContact OH-CZ 3.37Å; V243-F247 HydrophobicContact CB-CE2 4.42Å; V243-F247 HydrophobicContact CG1-CD2 3.87Å; V243-F247 HydrophobicContact CG1-CE2 3.84Å; V243-F247 HydrophobicContact CG2-CE2 4.14Å; G245-F247 VanDerWaalsContact C-N 3.25Å; G245-F247 PolarHBondContact O-N 3.48Å; G245-F247 VanDerWaalsContact O-N 3.09Å; F247-V251 WeakPolarHBondContact O-CG2 3.49Å; F247-V251 PolarHBondContact O-N 3.32Å; F247-Y336 WeakPolarHBondContact CE1-OH 3.49Å; F247-V371 HydrophobicContact CB-CG2 4.03Å; F247-V371 HydrophobicContact CD2-CB 4.36Å; F247-V371 HydrophobicContact CD2-CG2 3.7Å; F247-V371 HydrophobicContact CE2-CG2 4.37Å; F247-V371 HydrophobicContact CG-CG2 3.89Å |
| 248 | V | 97.1 | Very high | 95.7 | Very high | 3 Ų | 3 | 8.1 Ų | 8.1 | 2% | 0.018 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -67.3 | -54 | -177 | 173.9 | 0 | 0 | 0 | 0 | 111.5 | L244 G245 V251 F252 A378 V391 A395 | L244-V248 VanDerWaalsContact O-CG2 3.31Å; L244-V248 WeakPolarHBondContact O-CG2 3.44Å; G245-V248 WeakPolarHBondContact O-CB 3.34Å; G245-V248 PolarHBondContact O-N 3.12Å; V248-V251 PolarHBondContact O-N 2.83Å; V248-V251 VanDerWaalsContact O-N 3.08Å; V248-F252 HydrophobicContact CG1-CD2 3.76Å; V248-F252 HydrophobicContact CG1-CE2 4.1Å; V248-F252 WeakPolarHBondContact O-CD2 3.12Å; V248-F252 PolarHBondContact O-N 3.11Å; V248-F252 VanDerWaalsContact O-N 3.15Å; V248-A378 HydrophobicContact CB-CB 4.4Å; V248-A378 HydrophobicContact CG1-CB 3.53Å; V248-A378 HydrophobicContact CG2-CB 3.92Å; V248-V391 HydrophobicContact CG1-CG1 3.5Å; V248-A395 HydrophobicContact CB-CB 3.97Å; V248-A395 HydrophobicContact CG1-CB 4.17Å |
| 249 | P | 96.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 12.2 Ų | 12.2 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -60.2 | -45.2 | -176.7 | -20.2 | 30.4 | 0 | 0 | 0 | 114.1 | G245 V251 F252 V253 D313 F328 F332 F392 A395 | G245-P249 WeakPolarHBondContact O-CD 3.47Å; P249-V251 PolarHBondContact O-N 3.06Å; P249-V251 VanDerWaalsContact O-N 3.17Å; P249-F252 PolarHBondContact O-N 2.79Å; P249-F252 VanDerWaalsContact O-N 3.16Å; P249-V253 VanDerWaalsContact O-CB 3.24Å; P249-V253 WeakPolarHBondContact O-CB 3.16Å; P249-V253 WeakPolarHBondContact O-CG1 3.4Å; P249-V253 PolarHBondContact O-N 3.36Å; P249-D313 WeakPolarHBondContact CG-OD1 3.34Å; P249-F328 HydrophobicContact CB-CE1 4.25Å; P249-F328 HydrophobicContact CB-CZ 3.7Å; P249-F328 HydrophobicContact CG-CZ 4.44Å; P249-F332 HydrophobicContact CB-CE2 4.16Å; P249-F332 HydrophobicContact CB-CZ 4.42Å; P249-F332 HydrophobicContact CG-CE2 3.96Å; P249-F332 HydrophobicContact CG-CZ 4.42Å; P249-F392 HydrophobicContact CB-CD1 4.26Å; P249-F392 HydrophobicContact CB-CE1 3.8Å; P249-F392 HydrophobicContact CB-CZ 4.15Å; P249-A395 HydrophobicContact CG-CB 4.16Å |
| 250 | P | 95.9 | Very high | 95.5 | Very high | 1 Ų | 1 | 15.1 Ų | 15.1 | 1% | 0.006 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -61 | -25.2 | 176.5 | -25.3 | 35.4 | 0 | 0 | 0 | 114.4 | K40 L271 L274 F332 | K40-P250 HydrophobicContact CD-CB 4.34Å; P250-L271 HydrophobicContact CB-CD2 4.48Å; P250-L271 WeakPolarHBondContact O-CD2 3.21Å; P250-L274 HydrophobicContact CB-CD1 4.49Å; P250-L274 HydrophobicContact CG-CD1 4.28Å; P250-F332 HydrophobicContact CG-CE1 3.62Å; P250-F332 HydrophobicContact CG-CZ 3.81Å |
| 251 | V | 96.4 | Very high | 95.4 | Very high | 7 Ų | 7 | 16.9 Ų | 16.9 | 4% | 0.042 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -80.5 | -34.1 | 178 | 171.3 | 0 | 0 | 0 | 0 | 111.5 | S43 F46 F247 V248 P249 P375 | S43-V251 VanDerWaalsContact CB-O 3.28Å; S43-V251 WeakPolarHBondContact CB-O 3.15Å; F46-V251 HydrophobicContact CD2-CG1 4.38Å; F46-V251 HydrophobicContact CE2-CG1 3.61Å; F46-V251 HydrophobicContact CZ-CG1 4.49Å; F247-V251 WeakPolarHBondContact O-CG2 3.49Å; F247-V251 PolarHBondContact O-N 3.32Å; V248-V251 PolarHBondContact O-N 2.83Å; V248-V251 VanDerWaalsContact O-N 3.08Å; P249-V251 PolarHBondContact O-N 3.06Å; P249-V251 VanDerWaalsContact O-N 3.17Å; V251-P375 HydrophobicContact CG1-CB 4.29Å; V251-P375 HydrophobicContact CG2-CG 4.42Å |
| 252 | F | 97 | Very high | 95.3 | Very high | 1 Ų | 1 | 17.2 Ų | 17.2 | 0% | 0.004 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -103.6 | -14.8 | -174 | -71.2 | -71.6 | 0 | 0 | 0 | 115 | A61 V248 P249 V254 S255 Y256 P375 A378 L382 Y388 V391 F392 | A61-F252 HydrophobicContact CB-CE1 4.35Å; A61-F252 HydrophobicContact CB-CE2 4.46Å; A61-F252 HydrophobicContact CB-CZ 3.68Å; V248-F252 HydrophobicContact CG1-CD2 3.76Å; V248-F252 HydrophobicContact CG1-CE2 4.1Å; V248-F252 WeakPolarHBondContact O-CD2 3.12Å; V248-F252 PolarHBondContact O-N 3.11Å; V248-F252 VanDerWaalsContact O-N 3.15Å; P249-F252 PolarHBondContact O-N 2.79Å; P249-F252 VanDerWaalsContact O-N 3.16Å; F252-V254 VanDerWaalsContact C-N 3.31Å; F252-V254 PolarHBondContact O-N 3.32Å; F252-S255 PolarHBondContact O-N 3.31Å; F252-Y256 WeakPolarHBondContact O-CB 3.49Å; F252-Y256 PolarHBondContact O-N 3.49Å; F252-P375 HydrophobicContact CE2-CB 4.3Å; F252-P375 WeakPolarHBondContact CE2-O 3.34Å; F252-P375 WeakPolarHBondContact CZ-O 3.14Å; F252-A378 HydrophobicContact CE2-CB 4.18Å; F252-L382 HydrophobicContact CD1-CD2 4.23Å; F252-L382 HydrophobicContact CE1-CD2 4.37Å; F252-Y388 HydrophobicContact CB-CD1 4.33Å; F252-Y388 HydrophobicContact CB-CE1 4.12Å; F252-Y388 HydrophobicContact CD1-CE1 4.3Å; F252-V391 HydrophobicContact CD2-CG1 4.11Å; F252-V391 HydrophobicContact CG-CG1 4.5Å; F252-F392 HydrophobicContact CB-CE2 4.37Å |
| 253 | V | 96.8 | Very high | 95.3 | Very high | 1 Ų | 1 | 23.2 Ų | 23.2 | 1% | 0.006 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -60.3 | -36.6 | -173.1 | 66.9 | 0 | 0 | 0 | 0 | 113.6 | P249 Y256 A257 L270 L271 F328 F392 | P249-V253 VanDerWaalsContact O-CB 3.24Å; P249-V253 WeakPolarHBondContact O-CB 3.16Å; P249-V253 WeakPolarHBondContact O-CG1 3.4Å; P249-V253 PolarHBondContact O-N 3.36Å; V253-Y256 PolarHBondContact O-N 3.44Å; V253-A257 PolarHBondContact O-N 2.95Å; V253-L270 HydrophobicContact CG2-CB 4.38Å; V253-L270 HydrophobicContact CG2-CD1 4.02Å; V253-L271 HydrophobicContact CG1-CD2 3.71Å; V253-L271 HydrophobicContact CG1-CG 4.28Å; V253-F328 HydrophobicContact CG2-CD1 4.45Å; V253-F328 HydrophobicContact CG2-CE1 4.32Å; V253-F392 HydrophobicContact CB-CZ 4.46Å |
| 254 | V | 96.4 | Very high | 95.2 | Very high | 1 Ų | 1 | 25.6 Ų | 25.6 | 1% | 0.006 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -68.1 | -48.6 | 177.1 | -179.8 | 0 | 0 | 0 | 0 | 110.2 | V44 F252 Y256 A257 K258 L271 | V44-V254 HydrophobicContact CG2-CG1 4.5Å; F252-V254 VanDerWaalsContact C-N 3.31Å; F252-V254 PolarHBondContact O-N 3.32Å; V254-Y256 PolarHBondContact O-N 3.09Å; V254-A257 PolarHBondContact O-N 3.43Å; V254-K258 HydrophobicContact CG1-CD 4.36Å; V254-K258 HydrophobicContact CG1-CG 4.48Å; V254-K258 WeakPolarHBondContact O-CG 3.4Å; V254-K258 PolarHBondContact O-N 3.24Å; V254-L271 HydrophobicContact CG2-CD1 3.54Å; V254-L271 HydrophobicContact CG2-CG 3.61Å |
| 255 | S | 95.1 | Very high | 95.1 | Very high | 2 Ų | 2 | 26.4 Ų | 26.4 | 1% | 0.014 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.4 | -37.6 | 175.7 | -58.3 | 0 | 0 | 0 | 0 | 111.8 | F252 K258 E259 Y388 | F252-S255 PolarHBondContact O-N 3.31Å; S255-K258 PolarHBondContact O-N 3.42Å; S255-E259 WeakPolarHBondContact O-CB 3.44Å; S255-E259 PolarHBondContact O-N 3.32Å; S255-Y388 WeakPolarHBondContact CB-OH 3.46Å; S255-Y388 PolarHBondContact O-OH 2.83Å |
| 256 | Y | 95.1 | Very high | 95.1 | Very high | 18 Ų | 18 | 28.1 Ų | 28.1 | 7% | 0.071 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62.8 | -48.7 | 176.9 | -172.2 | -165.6 | 0 | 0 | 0 | 111.6 | F252 V253 V254 K258 E259 L260 A319 L325 Y388 F392 | F252-Y256 WeakPolarHBondContact O-CB 3.49Å; F252-Y256 PolarHBondContact O-N 3.49Å; V253-Y256 PolarHBondContact O-N 3.44Å; V254-Y256 PolarHBondContact O-N 3.09Å; Y256-K258 VanDerWaalsContact C-N 3.32Å; Y256-K258 PolarHBondContact O-N 3.4Å; Y256-E259 PolarHBondContact O-N 2.89Å; Y256-E259 VanDerWaalsContact O-N 3.11Å; Y256-L260 HydrophobicContact CD2-CD1 4.3Å; Y256-L260 HydrophobicContact CD2-CG 4.14Å; Y256-L260 HydrophobicContact CE2-CD1 4.05Å; Y256-L260 HydrophobicContact CE2-CD2 4.1Å; Y256-L260 HydrophobicContact CE2-CG 3.94Å; Y256-L260 PolarHBondContact O-N 2.94Å; Y256-A319 PolarHBondContact OH-O 3.29Å; Y256-L325 HydrophobicContact CD1-CD1 4.36Å; Y256-L325 HydrophobicContact CD1-CD2 3.62Å; Y256-L325 HydrophobicContact CE1-CD2 3.77Å; Y256-Y388 HydrophobicContact CD1-CG 4.19Å; Y256-Y388 HydrophobicContact CD2-CD1 4.3Å; Y256-Y388 AromaticContact CD2-CD2 3.17Å; Y256-Y388 HydrophobicContact CD2-CD2 3.17Å; Y256-Y388 AromaticContact CD2-CE2 3.74Å; Y256-Y388 HydrophobicContact CD2-CE2 3.74Å; Y256-Y388 AromaticContact CD2-CG 3.5Å; Y256-Y388 HydrophobicContact CD2-CG 3.5Å; Y256-Y388 VanDerWaalsContact CD2-CG 3.5Å; Y256-Y388 AromaticContact CE2-CD2 3.67Å; Y256-Y388 HydrophobicContact CE2-CD2 3.67Å; Y256-Y388 AromaticContact CE2-CG 3.98Å; Y256-Y388 HydrophobicContact CE2-CG 3.98Å; Y256-Y388 HydrophobicContact CG-CD1 4.02Å; Y256-Y388 AromaticContact CG-CD2 3.75Å; Y256-Y388 HydrophobicContact CG-CD2 3.75Å; Y256-Y388 HydrophobicContact CG-CE2 4.26Å; Y256-Y388 AromaticContact CG-CG 3.61Å; Y256-Y388 HydrophobicContact CG-CG 3.61Å; Y256-F392 HydrophobicContact CD1-CE2 4.15Å; Y256-F392 HydrophobicContact CD1-CZ 4.12Å |
| 257 | A | 96 | Very high | 95 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.1 | -41 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V253 V254 E259 L260 N262 S267 L270 L325 | V253-A257 PolarHBondContact O-N 2.95Å; V254-A257 PolarHBondContact O-N 3.43Å; A257-E259 VanDerWaalsContact C-N 3.27Å; A257-E259 PolarHBondContact O-N 3.47Å; A257-L260 PolarHBondContact O-N 3.05Å; A257-N262 WeakPolarHBondContact O-CB 3.22Å; A257-N262 PolarHBondContact O-N 2.98Å; A257-N262 PolarHBondContact O-ND2 3.45Å; A257-S267 WeakPolarHBondContact CB-OG 3.15Å; A257-L270 HydrophobicContact CB-CD1 3.49Å; A257-L270 VanDerWaalsContact CB-CD1 3.49Å; A257-L325 HydrophobicContact CB-CD1 3.82Å |
| 258 | K | 94.3 | Very high | 95.1 | Very high | 4 Ų | 4 | 27.2 Ų | 27.2 | 2% | 0.017 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.8 | -25.8 | 175.4 | -70.7 | -171.9 | 175.3 | -173.7 | 0 | 113 | V44 K47 E48 V254 S255 Y256 D264 S267 | V44-K258 PolarHBondContact O-NZ 2.89Å; K47-K258 HydrophobicContact CB-CD 4.3Å; K47-K258 HydrophobicContact CD-CB 3.78Å; K47-K258 HydrophobicContact CD-CD 3.72Å; K47-K258 HydrophobicContact CD-CG 4.37Å; K47-K258 PolarHBondContact NZ-O 2.94Å; E48-K258 IonicContact OE1-NZ 3.6Å; E48-K258 PolarHBondContact OE1-NZ 3.39Å; E48-K258 IonicContact OE2-NZ 3.91Å; V254-K258 HydrophobicContact CG1-CD 4.36Å; V254-K258 HydrophobicContact CG1-CG 4.48Å; V254-K258 WeakPolarHBondContact O-CG 3.4Å; V254-K258 PolarHBondContact O-N 3.24Å; S255-K258 PolarHBondContact O-N 3.42Å; Y256-K258 VanDerWaalsContact C-N 3.32Å; Y256-K258 PolarHBondContact O-N 3.4Å; K258-D264 VanDerWaalsContact CD-OD1 3.24Å; K258-D264 WeakPolarHBondContact CD-OD1 3.44Å; K258-D264 VanDerWaalsContact CE-OD1 3.24Å; K258-D264 WeakPolarHBondContact CE-OD1 3.48Å; K258-D264 WeakPolarHBondContact CG-OD1 3.49Å; K258-D264 IonicContact NZ-OD1 2.85Å; K258-S267 PolarHBondContact N-OG 2.89Å |
| 259 | E | 91.3 | Very high | 95.1 | Very high | 86 Ų | 86 | 30.3 Ų | 30.3 | 40% | 0.402 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -83.4 | -30 | 177.4 | -167.9 | 163.3 | 152.2 | 0 | 0 | 112.2 | Y57 S255 Y256 A257 G261 Y388 | Y57-E259 PolarHBondContact OH-OE2 3.25Å; S255-E259 WeakPolarHBondContact O-CB 3.44Å; S255-E259 PolarHBondContact O-N 3.32Å; Y256-E259 PolarHBondContact O-N 2.89Å; Y256-E259 VanDerWaalsContact O-N 3.11Å; A257-E259 VanDerWaalsContact C-N 3.27Å; A257-E259 PolarHBondContact O-N 3.47Å; E259-G261 PolarHBondContact O-N 3.22Å; E259-G261 VanDerWaalsContact O-N 3.13Å; E259-Y388 HydrophobicContact CB-CE2 3.87Å; E259-Y388 VanDerWaalsContact CD-CE2 3.47Å; E259-Y388 HydrophobicContact CG-CE2 4.16Å; E259-Y388 WeakPolarHBondContact OE2-CE2 3.29Å; E259-Y388 PolarHBondContact OE2-OH 3.06Å |
| 260 | L | 92.3 | Very high | 95.1 | Very high | 65 Ų | 65 | 30.3 Ų | 30.3 | 34% | 0.34 | 17% | 0.174 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68 | -2.1 | 167.8 | -68.1 | 174.8 | 0 | 0 | 0 | 113.4 | Y256 A257 N262 L325 | Y256-L260 HydrophobicContact CD2-CD1 4.3Å; Y256-L260 HydrophobicContact CD2-CG 4.14Å; Y256-L260 HydrophobicContact CE2-CD1 4.05Å; Y256-L260 HydrophobicContact CE2-CD2 4.1Å; Y256-L260 HydrophobicContact CE2-CG 3.94Å; Y256-L260 PolarHBondContact O-N 2.94Å; A257-L260 PolarHBondContact O-N 3.05Å; L260-N262 WeakPolarHBondContact CB-ND2 3.44Å; L260-L325 HydrophobicContact CD1-CD1 3.76Å; L260-L325 HydrophobicContact CD1-CG 4.48Å |
| 261 | G | 92.1 | Very high | 95.2 | Very high | 64 Ų | 64 | 30.3 Ų | 30.3 | 66% | 0.66 | 17% | 0.174 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 85.6 | 15.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | E259 | E259-G261 PolarHBondContact O-N 3.22Å; E259-G261 VanDerWaalsContact O-N 3.13Å |
| 262 | N | 95.6 | Very high | 95.2 | Very high | 45 Ų | 45 | 31.4 Ų | 31.4 | 24% | 0.241 | 18% | 0.18 | C | C | . | . | trans | -75.5 | 153.9 | 175 | -60.4 | -74.4 | 0 | 0 | 0 | 111.4 | A257 L260 Y322 | A257-N262 WeakPolarHBondContact O-CB 3.22Å; A257-N262 PolarHBondContact O-N 2.98Å; A257-N262 PolarHBondContact O-ND2 3.45Å; L260-N262 WeakPolarHBondContact CB-ND2 3.44Å; N262-Y322 HydrophobicContact CB-CD2 4.26Å; N262-Y322 WeakPolarHBondContact OD1-CB 3.32Å | ||
| 263 | E | 94.6 | Very high | 95.2 | Very high | 126 Ų | 126 | 33.4 Ų | 33.4 | 59% | 0.589 | 19% | 0.191 | S | C | * | . | trans | -57.7 | 142.6 | 174.7 | -174.6 | -179.7 | -158 | 0 | 0 | 111.3 | T265 S266 S267 | E263-T265 VanDerWaalsContact C-N 3.34Å; E263-T265 PolarHBondContact O-N 3.44Å; E263-S266 PolarHBondContact O-N 3.31Å; E263-S266 PolarHBondContact OE2-OG 3.49Å; E263-S267 WeakPolarHBondContact O-CB 3.4Å; E263-S267 PolarHBondContact O-N 3.28Å; E263-S267 PolarHBondContact O-OG 3.22Å | ||
| 264 | D | 93.4 | Very high | 95.2 | Very high | 50 Ų | 50 | 33.5 Ų | 33.5 | 27% | 0.267 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -63.7 | -40.3 | -175.5 | -66.2 | -28.1 | 0 | 0 | 0 | 111.8 | Q168 K258 S267 A268 | Q168-D264 HydrophobicContact CG-CB 4.32Å; Q168-D264 VanDerWaalsContact NE2-CB 3.33Å; K258-D264 VanDerWaalsContact CD-OD1 3.24Å; K258-D264 WeakPolarHBondContact CD-OD1 3.44Å; K258-D264 VanDerWaalsContact CE-OD1 3.24Å; K258-D264 WeakPolarHBondContact CE-OD1 3.48Å; K258-D264 WeakPolarHBondContact CG-OD1 3.49Å; K258-D264 IonicContact NZ-OD1 2.85Å; D264-S267 WeakPolarHBondContact O-CB 3.36Å; D264-S267 PolarHBondContact O-N 3.26Å; D264-A268 PolarHBondContact O-N 3.08Å |
| 265 | T | 94 | Very high | 95.2 | Very high | 62 Ų | 62 | 33.4 Ų | 33.4 | 38% | 0.38 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -59.8 | -47.5 | 173.4 | -45.5 | 0 | 0 | 0 | 0 | 111.6 | E263 S267 A268 L269 | E263-T265 VanDerWaalsContact C-N 3.34Å; E263-T265 PolarHBondContact O-N 3.44Å; T265-S267 VanDerWaalsContact C-N 3.3Å; T265-S267 PolarHBondContact O-N 3.2Å; T265-A268 PolarHBondContact O-N 3.43Å; T265-L269 WeakPolarHBondContact O-CG 3.45Å; T265-L269 PolarHBondContact O-N 3.37Å |
| 266 | S | 94.4 | Very high | 95.3 | Very high | 36 Ų | 36 | 38.7 Ų | 38.7 | 25% | 0.252 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -64 | -36.2 | 177.3 | -67.6 | 0 | 0 | 0 | 0 | 112 | E263 L269 Y322 | E263-S266 PolarHBondContact O-N 3.31Å; E263-S266 PolarHBondContact OE2-OG 3.49Å; S266-L269 WeakPolarHBondContact O-CB 3.25Å; S266-L269 PolarHBondContact O-N 3.22Å; S266-Y322 WeakPolarHBondContact O-CE2 3.25Å; S266-Y322 PolarHBondContact O-OH 3.24Å |
| 267 | S | 96.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -66.3 | -41.2 | 177 | -59.4 | 0 | 0 | 0 | 0 | 112.1 | A257 K258 E263 D264 T265 L269 L270 | A257-S267 WeakPolarHBondContact CB-OG 3.15Å; K258-S267 PolarHBondContact N-OG 2.89Å; E263-S267 WeakPolarHBondContact O-CB 3.4Å; E263-S267 PolarHBondContact O-N 3.28Å; E263-S267 PolarHBondContact O-OG 3.22Å; D264-S267 WeakPolarHBondContact O-CB 3.36Å; D264-S267 PolarHBondContact O-N 3.26Å; T265-S267 VanDerWaalsContact C-N 3.3Å; T265-S267 PolarHBondContact O-N 3.2Å; S267-L269 VanDerWaalsContact C-N 3.25Å; S267-L269 PolarHBondContact O-N 3.15Å; S267-L270 WeakPolarHBondContact O-CB 3.49Å; S267-L270 PolarHBondContact O-N 2.96Å |
| 268 | A | 95.5 | Very high | 95.4 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.4 | -28.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113 | V44 S164 Q168 D264 T265 L270 L271 | V44-A268 HydrophobicContact CG2-CB 4.44Å; S164-A268 PolarHBondContact OG-O 3.43Å; Q168-A268 HydrophobicContact CB-CB 3.7Å; Q168-A268 HydrophobicContact CG-CB 4.11Å; D264-A268 PolarHBondContact O-N 3.08Å; T265-A268 PolarHBondContact O-N 3.43Å; A268-L270 PolarHBondContact O-N 2.95Å; A268-L271 PolarHBondContact O-N 3.29Å |
| 269 | L | 96.8 | Very high | 95.4 | Very high | 68 Ų | 68 | 41.5 Ų | 41.5 | 36% | 0.356 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64.9 | -19.5 | 176.2 | -68.2 | 174.6 | 0 | 0 | 0 | 113.5 | P165 T265 S266 S267 L271 T272 I273 | P165-L269 HydrophobicContact CG-CD2 4.11Å; T265-L269 WeakPolarHBondContact O-CG 3.45Å; T265-L269 PolarHBondContact O-N 3.37Å; S266-L269 WeakPolarHBondContact O-CB 3.25Å; S266-L269 PolarHBondContact O-N 3.22Å; S267-L269 VanDerWaalsContact C-N 3.25Å; S267-L269 PolarHBondContact O-N 3.15Å; L269-L271 VanDerWaalsContact C-N 3.34Å; L269-L271 PolarHBondContact O-N 3.38Å; L269-T272 CarbonylContact O-C 3.58Å; L269-T272 WeakPolarHBondContact O-CA 3.47Å; L269-T272 VanDerWaalsContact O-CB 3.31Å; L269-T272 WeakPolarHBondContact O-CB 3.22Å; L269-T272 PolarHBondContact O-N 3.47Å; L269-I273 WeakPolarHBondContact O-CG1 3.28Å; L269-I273 PolarHBondContact O-N 2.88Å |
| 270 | L | 97.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.4 | -40.9 | 175.9 | -69 | 175.1 | 0 | 0 | 0 | 112.1 | V253 A257 S267 A268 T272 I273 L274 Y322 L325 V326 | V253-L270 HydrophobicContact CG2-CB 4.38Å; V253-L270 HydrophobicContact CG2-CD1 4.02Å; A257-L270 HydrophobicContact CB-CD1 3.49Å; A257-L270 VanDerWaalsContact CB-CD1 3.49Å; S267-L270 WeakPolarHBondContact O-CB 3.49Å; S267-L270 PolarHBondContact O-N 2.96Å; A268-L270 PolarHBondContact O-N 2.95Å; L270-T272 VanDerWaalsContact C-N 3.27Å; L270-T272 PolarHBondContact O-N 3.23Å; L270-I273 HydrophobicContact CD2-CD1 4.47Å; L270-I273 PolarHBondContact O-N 2.83Å; L270-L274 PolarHBondContact O-N 3.36Å; L270-Y322 HydrophobicContact CD1-CE2 4.13Å; L270-Y322 HydrophobicContact CD2-CE2 3.97Å; L270-Y322 HydrophobicContact CG-CE2 3.95Å; L270-L325 HydrophobicContact CD1-CB 4.05Å; L270-L325 HydrophobicContact CD1-CD1 4.15Å; L270-L325 HydrophobicContact CD2-CB 4.2Å; L270-V326 HydrophobicContact CD2-CB 4.42Å; L270-V326 HydrophobicContact CD2-CG2 3.64Å |
| 271 | L | 96.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -68.1 | -30.2 | 172.7 | -69.4 | -179.6 | 0 | 0 | 0 | 112.1 | V44 L160 P250 V253 V254 A268 L269 G275 | V44-L271 HydrophobicContact CG2-CD1 4.49Å; L160-L271 HydrophobicContact CD1-CB 4.34Å; P250-L271 HydrophobicContact CB-CD2 4.48Å; P250-L271 WeakPolarHBondContact O-CD2 3.21Å; V253-L271 HydrophobicContact CG1-CD2 3.71Å; V253-L271 HydrophobicContact CG1-CG 4.28Å; V254-L271 HydrophobicContact CG2-CD1 3.54Å; V254-L271 HydrophobicContact CG2-CG 3.61Å; A268-L271 PolarHBondContact O-N 3.29Å; L269-L271 VanDerWaalsContact C-N 3.34Å; L269-L271 PolarHBondContact O-N 3.38Å; L271-G275 PolarHBondContact O-N 3.07Å |
| 272 | T | 97.3 | Very high | 95.6 | Very high | 30 Ų | 30 | 39.7 Ų | 39.7 | 18% | 0.184 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -66.9 | -43.4 | 172.7 | -60.4 | 0 | 0 | 0 | 0 | 111.8 | C161 P165 L269 L270 G275 F276 | C161-T272 HydrophobicContact CB-CG2 4.05Å; C161-T272 WeakPolarHBondContact O-CG2 3.31Å; C161-T272 PolarHBondContact O-OG1 3.47Å; C161-T272 PolarHBondContact SG-O 3.04Å; C161-T272 VanDerWaalsContact SG-O 3.4Å; P165-T272 VanDerWaalsContact CD-OG1 3.22Å; P165-T272 WeakPolarHBondContact CD-OG1 3.06Å; P165-T272 WeakPolarHBondContact CG-OG1 3.41Å; L269-T272 CarbonylContact O-C 3.58Å; L269-T272 WeakPolarHBondContact O-CA 3.47Å; L269-T272 VanDerWaalsContact O-CB 3.31Å; L269-T272 WeakPolarHBondContact O-CB 3.22Å; L269-T272 PolarHBondContact O-N 3.47Å; L270-T272 VanDerWaalsContact C-N 3.27Å; L270-T272 PolarHBondContact O-N 3.23Å; T272-G275 PolarHBondContact O-N 2.92Å; T272-F276 VanDerWaalsContact O-CB 3.27Å; T272-F276 WeakPolarHBondContact O-CB 3.33Å; T272-F276 PolarHBondContact O-N 3.24Å |
| 273 | I | 97.6 | Very high | 95.4 | Very high | 44 Ų | 44 | 40.5 Ų | 40.5 | 23% | 0.226 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.6 | -48 | 175.5 | -67.7 | 160.6 | 0 | 0 | 0 | 110.1 | L269 L270 G275 F276 I277 V326 C329 I330 | L269-I273 WeakPolarHBondContact O-CG1 3.28Å; L269-I273 PolarHBondContact O-N 2.88Å; L270-I273 HydrophobicContact CD2-CD1 4.47Å; L270-I273 PolarHBondContact O-N 2.83Å; I273-G275 PolarHBondContact O-N 3.2Å; I273-F276 PolarHBondContact O-N 3.07Å; I273-I277 WeakPolarHBondContact O-CG1 3.46Å; I273-I277 PolarHBondContact O-N 3.01Å; I273-V326 HydrophobicContact CD1-CG1 4.09Å; I273-V326 HydrophobicContact CD1-CG2 4Å; I273-C329 HydrophobicContact CB-CB 4.47Å; I273-C329 HydrophobicContact CG2-CB 4.11Å; I273-I330 HydrophobicContact CG2-CG1 3.77Å |
| 274 | L | 96.6 | Very high | 95.3 | Very high | 2 Ų | 2 | 38.2 Ų | 38.2 | 1% | 0.01 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -56 | -50.7 | 176.6 | -174.8 | 164.8 | 0 | 0 | 0 | 111.2 | L160 P250 L270 F276 I277 D278 C329 F332 | L160-L274 HydrophobicContact CD2-CD2 4.01Å; P250-L274 HydrophobicContact CB-CD1 4.49Å; P250-L274 HydrophobicContact CG-CD1 4.28Å; L270-L274 PolarHBondContact O-N 3.36Å; L274-F276 PolarHBondContact O-N 3.3Å; L274-I277 PolarHBondContact O-N 3.42Å; L274-D278 PolarHBondContact O-N 3.02Å; L274-D278 VanDerWaalsContact O-N 3.09Å; L274-C329 HydrophobicContact CB-CB 4.48Å; L274-F332 HydrophobicContact CD1-CD1 3.55Å; L274-F332 HydrophobicContact CD1-CE1 3.88Å; L274-F332 HydrophobicContact CG-CD1 4.04Å |
| 275 | G | 96.2 | Very high | 95.2 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -58.4 | -46.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | P157 L271 T272 I273 I277 D278 I279 | P157-G275 VanDerWaalsContact CB-O 3.31Å; P157-G275 WeakPolarHBondContact CB-O 3.45Å; L271-G275 PolarHBondContact O-N 3.07Å; T272-G275 PolarHBondContact O-N 2.92Å; I273-G275 PolarHBondContact O-N 3.2Å; G275-I277 VanDerWaalsContact C-N 3.32Å; G275-I277 PolarHBondContact O-N 3.15Å; G275-D278 WeakPolarHBondContact O-CB 3.34Å; G275-D278 PolarHBondContact O-N 3.04Å; G275-D278 VanDerWaalsContact O-N 3.12Å; G275-I279 WeakPolarHBondContact O-CG1 3.23Å; G275-I279 PolarHBondContact O-N 3.1Å |
| 276 | F | 97 | Very high | 94.9 | Very high | 112 Ų | 112 | 34.6 Ų | 34.6 | 49% | 0.491 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -62.2 | -41.7 | -175.2 | -178.1 | -97.6 | 0 | 0 | 0 | 111.6 | C161 T272 I273 L274 I279 F280 | C161-F276 VanDerWaalsContact SG-CA 3.6Å; C161-F276 PolarHBondContact SG-N 3.3Å; T272-F276 VanDerWaalsContact O-CB 3.27Å; T272-F276 WeakPolarHBondContact O-CB 3.33Å; T272-F276 PolarHBondContact O-N 3.24Å; I273-F276 PolarHBondContact O-N 3.07Å; L274-F276 PolarHBondContact O-N 3.3Å; F276-I279 WeakPolarHBondContact O-CB 3.35Å; F276-I279 PolarHBondContact O-N 2.88Å; F276-F280 HydrophobicContact CD1-CE2 4.26Å; F276-F280 HydrophobicContact CD2-CE2 4.35Å; F276-F280 HydrophobicContact CE1-CD2 4.4Å; F276-F280 AromaticContact CE1-CE2 3.77Å; F276-F280 HydrophobicContact CE1-CE2 3.77Å; F276-F280 AromaticContact CE2-CE2 3.87Å; F276-F280 HydrophobicContact CE2-CE2 3.87Å; F276-F280 HydrophobicContact CE2-CZ 4.44Å; F276-F280 AromaticContact CZ-CE2 3.57Å; F276-F280 HydrophobicContact CZ-CE2 3.57Å; F276-F280 HydrophobicContact CZ-CZ 4.18Å; F276-F280 VanDerWaalsContact O-CD2 3.25Å; F276-F280 WeakPolarHBondContact O-CD2 3.34Å |
| 277 | I | 97.6 | Very high | 94.7 | Very high | 38 Ų | 38 | 37.8 Ų | 37.8 | 20% | 0.195 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -67.4 | -40.9 | 176.2 | -61.8 | -62.2 | 0 | 0 | 0 | 111.4 | I273 L274 G275 I279 F280 A281 I330 V334 | I273-I277 WeakPolarHBondContact O-CG1 3.46Å; I273-I277 PolarHBondContact O-N 3.01Å; L274-I277 PolarHBondContact O-N 3.42Å; G275-I277 VanDerWaalsContact C-N 3.32Å; G275-I277 PolarHBondContact O-N 3.15Å; I277-I279 VanDerWaalsContact C-N 3.29Å; I277-I279 PolarHBondContact O-N 3.38Å; I277-F280 PolarHBondContact O-N 3.34Å; I277-F280 VanDerWaalsContact O-N 3.16Å; I277-A281 WeakPolarHBondContact O-CB 3.32Å; I277-A281 PolarHBondContact O-N 3.19Å; I277-I330 HydrophobicContact CD1-CG2 4.34Å; I277-I330 HydrophobicContact CG1-CG1 4.39Å; I277-I330 HydrophobicContact CG1-CG2 4.4Å; I277-V334 HydrophobicContact CG2-CB 4.29Å; I277-V334 HydrophobicContact CG2-CG2 3.4Å; I277-V334 VanDerWaalsContact CG2-CG2 3.4Å |
| 278 | D | 95.2 | Very high | 94.4 | Very high | 2 Ų | 2 | 41.2 Ų | 41.2 | 1% | 0.011 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60.4 | -35.9 | 176.8 | -175.7 | 2.7 | 0 | 0 | 0 | 112 | P157 L274 G275 F280 A281 R282 G337 | P157-D278 HydrophobicContact CB-CB 3.83Å; P157-D278 HydrophobicContact CG-CB 4.48Å; L274-D278 PolarHBondContact O-N 3.02Å; L274-D278 VanDerWaalsContact O-N 3.09Å; G275-D278 WeakPolarHBondContact O-CB 3.34Å; G275-D278 PolarHBondContact O-N 3.04Å; G275-D278 VanDerWaalsContact O-N 3.12Å; D278-F280 PolarHBondContact O-N 2.94Å; D278-F280 VanDerWaalsContact O-N 3.12Å; D278-A281 PolarHBondContact O-N 3.26Å; D278-R282 WeakPolarHBondContact O-CB 3.31Å; D278-R282 PolarHBondContact O-N 2.62Å; D278-R282 VanDerWaalsContact O-N 3.09Å; D278-R282 WeakPolarHBondContact OD1-CB 3.49Å; D278-R282 IonicContact OD1-CZ 3.73Å; D278-R282 IonicContact OD1-NE 3.78Å; D278-R282 PolarHBondContact OD1-NE 3.33Å; D278-R282 IonicContact OD1-NH2 2.82Å; D278-R282 PolarHBondContact OD1-NH2 3.05Å; D278-R282 IonicContact OD2-CZ 2.76Å; D278-R282 IonicContact OD2-NE 3.07Å; D278-R282 IonicContact OD2-NH2 3.37Å; D278-R282 PolarHBondContact OD2-NH2 3.43Å; D278-G337 VanDerWaalsContact OD1-CA 3.25Å; D278-G337 WeakPolarHBondContact OD1-CA 3.41Å |
| 279 | I | 94.8 | Very high | 94 | Very high | 42 Ų | 42 | 41.2 Ų | 41.2 | 22% | 0.215 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -50.3 | -41 | 175 | -64.1 | 172.1 | 0 | 0 | 0 | 111.4 | P157 V158 G275 F276 I277 P283 | P157-I279 HydrophobicContact CB-CG1 3.78Å; P157-I279 HydrophobicContact CG-CG1 3.95Å; V158-I279 HydrophobicContact CG2-CD1 3.72Å; V158-I279 HydrophobicContact CG2-CG1 3.95Å; G275-I279 WeakPolarHBondContact O-CG1 3.23Å; G275-I279 PolarHBondContact O-N 3.1Å; F276-I279 WeakPolarHBondContact O-CB 3.35Å; F276-I279 PolarHBondContact O-N 2.88Å; I277-I279 VanDerWaalsContact C-N 3.29Å; I277-I279 PolarHBondContact O-N 3.38Å; I279-P283 WeakPolarHBondContact O-CD 3.43Å; I279-P283 VanDerWaalsContact O-CG 3.28Å; I279-P283 WeakPolarHBondContact O-CG 3.39Å |
| 280 | F | 94.4 | Very high | 93.4 | Very high | 117 Ų | 117 | 40.2 Ų | 40.2 | 51% | 0.513 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -92.2 | -38.5 | -179.2 | -60.2 | -78.3 | 0 | 0 | 0 | 112.7 | F276 I277 D278 R282 T284 | F276-F280 HydrophobicContact CD1-CE2 4.26Å; F276-F280 HydrophobicContact CD2-CE2 4.35Å; F276-F280 HydrophobicContact CE1-CD2 4.4Å; F276-F280 AromaticContact CE1-CE2 3.77Å; F276-F280 HydrophobicContact CE1-CE2 3.77Å; F276-F280 AromaticContact CE2-CE2 3.87Å; F276-F280 HydrophobicContact CE2-CE2 3.87Å; F276-F280 HydrophobicContact CE2-CZ 4.44Å; F276-F280 AromaticContact CZ-CE2 3.57Å; F276-F280 HydrophobicContact CZ-CE2 3.57Å; F276-F280 HydrophobicContact CZ-CZ 4.18Å; F276-F280 VanDerWaalsContact O-CD2 3.25Å; F276-F280 WeakPolarHBondContact O-CD2 3.34Å; I277-F280 PolarHBondContact O-N 3.34Å; I277-F280 VanDerWaalsContact O-N 3.16Å; D278-F280 PolarHBondContact O-N 2.94Å; D278-F280 VanDerWaalsContact O-N 3.12Å; F280-R282 PolarHBondContact O-N 2.87Å; F280-T284 VanDerWaalsContact O-CB 3.23Å; F280-T284 WeakPolarHBondContact O-CB 3.22Å; F280-T284 PolarHBondContact O-N 3.41Å; F280-T284 PolarHBondContact O-OG1 3.15Å |
| 281 | A | 94.8 | Very high | 92.9 | Very high | 15 Ų | 15 | 44.6 Ų | 44.6 | 12% | 0.124 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.6 | -42.8 | -174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | I277 D278 C285 V334 | I277-A281 WeakPolarHBondContact O-CB 3.32Å; I277-A281 PolarHBondContact O-N 3.19Å; D278-A281 PolarHBondContact O-N 3.26Å; A281-C285 VanDerWaalsContact O-CB 3.26Å; A281-C285 WeakPolarHBondContact O-CB 3.45Å; A281-C285 PolarHBondContact O-N 2.96Å; A281-V334 HydrophobicContact CB-CB 4.47Å; A281-V334 HydrophobicContact CB-CG1 4.4Å |
| 282 | R | 91.9 | Very high | 92.3 | Very high | 44 Ų | 44 | 53.5 Ų | 53.5 | 17% | 0.166 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -68.1 | -51.3 | -175 | 176.7 | -172.5 | -54 | -95.5 | -3.9 | 113.4 | D278 F280 T284 C285 G286 G340 A341 | D278-R282 WeakPolarHBondContact O-CB 3.31Å; D278-R282 PolarHBondContact O-N 2.62Å; D278-R282 VanDerWaalsContact O-N 3.09Å; D278-R282 WeakPolarHBondContact OD1-CB 3.49Å; D278-R282 IonicContact OD1-CZ 3.73Å; D278-R282 IonicContact OD1-NE 3.78Å; D278-R282 PolarHBondContact OD1-NE 3.33Å; D278-R282 IonicContact OD1-NH2 2.82Å; D278-R282 PolarHBondContact OD1-NH2 3.05Å; D278-R282 IonicContact OD2-CZ 2.76Å; D278-R282 IonicContact OD2-NE 3.07Å; D278-R282 IonicContact OD2-NH2 3.37Å; D278-R282 PolarHBondContact OD2-NH2 3.43Å; F280-R282 PolarHBondContact O-N 2.87Å; R282-T284 VanDerWaalsContact C-N 3.33Å; R282-T284 PolarHBondContact O-N 3.43Å; R282-C285 PolarHBondContact O-N 3.49Å; R282-G286 PolarHBondContact O-N 3.36Å; R282-G340 VanDerWaalsContact NH1-C 3.32Å; R282-G340 VanDerWaalsContact NH1-CA 3.32Å; R282-G340 PolarHBondContact NH1-O 3.41Å; R282-A341 HydrophobicContact CG-CB 4.08Å |
| 283 | P | 90.4 | Very high | 91.7 | Very high | 63 Ų | 63 | 62.3 Ų | 62.3 | 41% | 0.409 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.5 | -41.2 | 174.2 | -23.5 | 34.9 | 0 | 0 | 0 | 112.4 | I279 C285 G286 V287 | I279-P283 WeakPolarHBondContact O-CD 3.43Å; I279-P283 VanDerWaalsContact O-CG 3.28Å; I279-P283 WeakPolarHBondContact O-CG 3.39Å; P283-C285 VanDerWaalsContact C-N 3.35Å; P283-C285 PolarHBondContact O-N 3.2Å; P283-G286 PolarHBondContact O-N 3.43Å; P283-V287 WeakPolarHBondContact O-CG2 3.47Å; P283-V287 PolarHBondContact O-N 2.97Å |
| 284 | T | 91.9 | Very high | 91.2 | Very high | 78 Ų | 78 | 61.9 Ų | 61.9 | 48% | 0.479 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -60.6 | -45.8 | 178.6 | -57.4 | 0 | 0 | 0 | 0 | 110.9 | F280 R282 G286 V287 I288 | F280-T284 VanDerWaalsContact O-CB 3.23Å; F280-T284 WeakPolarHBondContact O-CB 3.22Å; F280-T284 PolarHBondContact O-N 3.41Å; F280-T284 PolarHBondContact O-OG1 3.15Å; R282-T284 VanDerWaalsContact C-N 3.33Å; R282-T284 PolarHBondContact O-N 3.43Å; T284-G286 PolarHBondContact O-N 3.15Å; T284-V287 PolarHBondContact O-N 3.13Å; T284-I288 HydrophobicContact CG2-CD1 3.94Å; T284-I288 VanDerWaalsContact O-CG1 3.26Å; T284-I288 WeakPolarHBondContact O-CG1 3.27Å; T284-I288 PolarHBondContact O-N 3.48Å |
| 285 | C | 92.7 | Very high | 90.4 | Very high | 5 Ų | 5 | 70.2 Ų | 70.2 | 3% | 0.034 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.4 | -41.2 | 176.2 | -170.9 | 0 | 0 | 0 | 0 | 112.2 | A281 R282 P283 V287 I288 A289 M338 A341 | A281-C285 VanDerWaalsContact O-CB 3.26Å; A281-C285 WeakPolarHBondContact O-CB 3.45Å; A281-C285 PolarHBondContact O-N 2.96Å; R282-C285 PolarHBondContact O-N 3.49Å; P283-C285 VanDerWaalsContact C-N 3.35Å; P283-C285 PolarHBondContact O-N 3.2Å; C285-V287 PolarHBondContact O-N 2.85Å; C285-I288 PolarHBondContact O-N 2.62Å; C285-A289 WeakPolarHBondContact O-CB 3.46Å; C285-A289 PolarHBondContact O-N 3.38Å; C285-M338 HydrophobicContact CB-CB 4.38Å; C285-M338 HydrophobicContact CB-CG 3.97Å; C285-A341 HydrophobicContact CB-CB 4.11Å |
| 286 | G | 87.6 | Confident | 89.7 | Confident | 30 Ų | 30 | 75.2 Ų | 75.2 | 31% | 0.309 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -62 | -40.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113 | R282 P283 T284 A289 G290 | R282-G286 PolarHBondContact O-N 3.36Å; P283-G286 PolarHBondContact O-N 3.43Å; T284-G286 PolarHBondContact O-N 3.15Å; G286-A289 PolarHBondContact O-N 3.21Å; G286-G290 PolarHBondContact O-N 2.96Å |
| 287 | V | 88.8 | Confident | 89.2 | Confident | 103 Ų | 103 | 77 Ų | 77 | 62% | 0.624 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -64.4 | -44.7 | 173.7 | 173 | 0 | 0 | 0 | 0 | 110.9 | P283 T284 C285 A289 G290 L291 | P283-V287 WeakPolarHBondContact O-CG2 3.47Å; P283-V287 PolarHBondContact O-N 2.97Å; T284-V287 PolarHBondContact O-N 3.13Å; C285-V287 PolarHBondContact O-N 2.85Å; V287-A289 VanDerWaalsContact C-N 3.34Å; V287-A289 PolarHBondContact O-N 2.86Å; V287-G290 PolarHBondContact O-N 3.07Å; V287-L291 PolarHBondContact O-N 2.94Å |
| 288 | I | 90.8 | Very high | 88.6 | Confident | 72 Ų | 72 | 75.3 Ų | 75.3 | 37% | 0.369 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -60.4 | -44.4 | 177.2 | -69.4 | 166.6 | 0 | 0 | 0 | 110.8 | T284 C285 G290 L291 V294 L301 | T284-I288 HydrophobicContact CG2-CD1 3.94Å; T284-I288 VanDerWaalsContact O-CG1 3.26Å; T284-I288 WeakPolarHBondContact O-CG1 3.27Å; T284-I288 PolarHBondContact O-N 3.48Å; C285-I288 PolarHBondContact O-N 2.62Å; I288-G290 VanDerWaalsContact C-N 3.29Å; I288-G290 PolarHBondContact O-N 3.34Å; I288-L291 WeakPolarHBondContact O-CB 3.15Å; I288-L291 WeakPolarHBondContact O-CG 3.07Å; I288-L291 PolarHBondContact O-N 3.15Å; I288-V294 HydrophobicContact CG2-CG1 4.34Å; I288-V294 HydrophobicContact CG2-CG2 4.43Å; I288-V294 VanDerWaalsContact O-CB 3.24Å; I288-V294 WeakPolarHBondContact O-CB 3.42Å; I288-V294 WeakPolarHBondContact O-CG1 2.93Å; I288-L301 HydrophobicContact CG2-CD2 4.14Å |
| 289 | A | 86.4 | Confident | 88.2 | Confident | 0 Ų | 0 | 76.3 Ų | 76.3 | 0% | 0 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62.2 | -36.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | C285 G286 V287 L291 R295 L301 L342 E345 | C285-A289 WeakPolarHBondContact O-CB 3.46Å; C285-A289 PolarHBondContact O-N 3.38Å; G286-A289 PolarHBondContact O-N 3.21Å; V287-A289 VanDerWaalsContact C-N 3.34Å; V287-A289 PolarHBondContact O-N 2.86Å; A289-L291 VanDerWaalsContact C-N 3.27Å; A289-L291 PolarHBondContact O-N 3.36Å; A289-R295 VanDerWaalsContact O-CA 3.31Å; A289-R295 WeakPolarHBondContact O-CA 3.49Å; A289-R295 WeakPolarHBondContact O-CB 3.44Å; A289-R295 PolarHBondContact O-N 2.68Å; A289-L301 HydrophobicContact CB-CD2 4.44Å; A289-L342 HydrophobicContact CB-CD2 3.59Å; A289-E345 WeakPolarHBondContact CB-OE2 3.36Å |
| 290 | G | 84.6 | Confident | 87.9 | Confident | 47 Ų | 47 | 78.5 Ų | 78.5 | 49% | 0.485 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -69.9 | -14 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | G286 V287 I288 | G286-G290 PolarHBondContact O-N 2.96Å; V287-G290 PolarHBondContact O-N 3.07Å; I288-G290 VanDerWaalsContact C-N 3.29Å; I288-G290 PolarHBondContact O-N 3.34Å |
| 291 | L | 87 | Confident | 87.8 | Confident | 93 Ų | 93 | 74.5 Ų | 74.5 | 49% | 0.487 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -62.3 | 137.6 | 178.3 | -65.4 | 173.9 | 0 | 0 | 0 | 110.9 | V287 I288 A289 W293 V294 R295 | V287-L291 PolarHBondContact O-N 2.94Å; I288-L291 WeakPolarHBondContact O-CB 3.15Å; I288-L291 WeakPolarHBondContact O-CG 3.07Å; I288-L291 PolarHBondContact O-N 3.15Å; A289-L291 VanDerWaalsContact C-N 3.27Å; A289-L291 PolarHBondContact O-N 3.36Å; L291-W293 PolarHBondContact O-N 3.1Å; L291-V294 HydrophobicContact CB-CB 4.26Å; L291-V294 HydrophobicContact CB-CG2 4.05Å; L291-V294 HydrophobicContact CD1-CG2 4.36Å; L291-V294 PolarHBondContact O-N 3.16Å; L291-R295 PolarHBondContact O-N 3.35Å |
| 292 | K | 84 | Confident | 87.7 | Confident | 186 Ų | 186 | 73.9 Ų | 73.9 | 81% | 0.809 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | -29.2 | -176.4 | -64.5 | -176 | -179.4 | -178.4 | 0 | 114 | P296 | K292-P296 VanDerWaalsContact O-CD 3.31Å; K292-P296 WeakPolarHBondContact O-CD 3.38Å |
| 293 | W | 85.8 | Confident | 87.7 | Confident | 216 Ų | 216 | 72 Ų | 72 | 82% | 0.818 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -24.8 | -177.5 | -63.4 | 59.6 | 0 | 0 | 0 | 112.9 | L291 | L291-W293 PolarHBondContact O-N 3.1Š|
| 294 | V | 86.3 | Confident | 87.9 | Confident | 35 Ų | 35 | 74.4 Ų | 74.4 | 21% | 0.212 | 37% | 0.369 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | -36.8 | -175.9 | -178.3 | 0 | 0 | 0 | 0 | 110.8 | I288 L291 P296 R297 C298 L301 | I288-V294 HydrophobicContact CG2-CG1 4.34Å; I288-V294 HydrophobicContact CG2-CG2 4.43Å; I288-V294 VanDerWaalsContact O-CB 3.24Å; I288-V294 WeakPolarHBondContact O-CB 3.42Å; I288-V294 WeakPolarHBondContact O-CG1 2.93Å; L291-V294 HydrophobicContact CB-CB 4.26Å; L291-V294 HydrophobicContact CB-CG2 4.05Å; L291-V294 HydrophobicContact CD1-CG2 4.36Å; L291-V294 PolarHBondContact O-N 3.16Å; V294-P296 VanDerWaalsContact C-CD 3.48Å; V294-R297 CarbonylContact O-C 3.59Å; V294-R297 VanDerWaalsContact O-CA 3.26Å; V294-R297 WeakPolarHBondContact O-CA 3.4Å; V294-R297 PolarHBondContact O-N 3Å; V294-C298 PolarHBondContact O-N 2.78Å; V294-L301 HydrophobicContact CG1-CD2 3.83Å |
| 295 | R | 80.6 | Confident | 88.2 | Confident | 177 Ų | 177 | 70.7 Ų | 70.7 | 67% | 0.668 | 35% | 0.346 | S | S | * | . | G | 310 helix | trans | -49.6 | -45.4 | -179.1 | -171.3 | 177.4 | -179.6 | -174.3 | -0.7 | 114 | A289 L291 R297 C298 | A289-R295 VanDerWaalsContact O-CA 3.31Å; A289-R295 WeakPolarHBondContact O-CA 3.49Å; A289-R295 WeakPolarHBondContact O-CB 3.44Å; A289-R295 PolarHBondContact O-N 2.68Å; L291-R295 PolarHBondContact O-N 3.35Å; R295-R297 PolarHBondContact O-N 3.44Å; R295-R297 VanDerWaalsContact O-N 3.16Å; R295-C298 WeakPolarHBondContact O-CB 3.22Å; R295-C298 PolarHBondContact O-N 3.38Å |
| 296 | P | 81.8 | Confident | 88.3 | Confident | 105 Ų | 105 | 70.5 Ų | 70.5 | 68% | 0.682 | 35% | 0.345 | S | S | * | . | G | 310 helix | trans | -68.2 | -13.3 | 176.4 | -18.1 | 32.7 | 0 | 0 | 0 | 114.1 | K292 V294 | K292-P296 VanDerWaalsContact O-CD 3.31Å; K292-P296 WeakPolarHBondContact O-CD 3.38Å; V294-P296 VanDerWaalsContact C-CD 3.48Å |
| 297 | R | 85.2 | Confident | 88.7 | Confident | 148 Ų | 148 | 71.9 Ų | 71.9 | 56% | 0.558 | 35% | 0.345 | S | S | * | . | G | 310 helix | trans | -116.5 | 14.5 | -177.9 | -59.9 | 178.2 | -176.4 | 149.9 | -0.7 | 111.8 | V294 R295 V299 Y300 L301 | V294-R297 CarbonylContact O-C 3.59Å; V294-R297 VanDerWaalsContact O-CA 3.26Å; V294-R297 WeakPolarHBondContact O-CA 3.4Å; V294-R297 PolarHBondContact O-N 3Å; R295-R297 PolarHBondContact O-N 3.44Å; R295-R297 VanDerWaalsContact O-N 3.16Å; R297-V299 PolarHBondContact O-N 3.11Å; R297-V299 VanDerWaalsContact O-N 3.15Å; R297-Y300 HydrophobicContact CB-CD2 4.09Å; R297-Y300 HydrophobicContact CG-CD2 4.48Å; R297-Y300 WeakPolarHBondContact O-CB 3.42Å; R297-Y300 PolarHBondContact O-N 3.16Å; R297-L301 PolarHBondContact O-N 3.45Å |
| 298 | C | 84.9 | Confident | 89.2 | Confident | 3 Ų | 3 | 69.7 Ų | 69.7 | 2% | 0.02 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -55.8 | -35.4 | -175.7 | -171.1 | 0 | 0 | 0 | 0 | 112.4 | V294 R295 Y300 L301 F302 E345 | V294-C298 PolarHBondContact O-N 2.78Å; R295-C298 WeakPolarHBondContact O-CB 3.22Å; R295-C298 PolarHBondContact O-N 3.38Å; C298-Y300 VanDerWaalsContact C-N 3.33Å; C298-Y300 PolarHBondContact O-N 3.13Å; C298-L301 WeakPolarHBondContact O-CB 3.33Å; C298-L301 PolarHBondContact O-N 2.9Å; C298-L301 VanDerWaalsContact O-N 3.16Å; C298-F302 PolarHBondContact O-N 3.37Å; C298-E345 PolarHBondContact SG-OE1 3.32Å |
| 299 | V | 86.4 | Confident | 89.5 | Confident | 23 Ų | 23 | 66.2 Ų | 66.2 | 14% | 0.139 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60 | -38.7 | 174 | -170.6 | 0 | 0 | 0 | 0 | 112.7 | R297 F302 S303 V346 N410 | R297-V299 PolarHBondContact O-N 3.11Å; R297-V299 VanDerWaalsContact O-N 3.15Å; V299-F302 PolarHBondContact O-N 2.89Å; V299-S303 PolarHBondContact O-N 2.95Å; V299-S303 PolarHBondContact O-OG 3.32Å; V299-V346 HydrophobicContact CG1-CG1 4.35Å; V299-V346 HydrophobicContact CG2-CG1 4.14Å; V299-V346 HydrophobicContact CG2-CG2 4.45Å; V299-N410 WeakPolarHBondContact CB-ND2 3.19Å; V299-N410 HydrophobicContact CG1-CB 4.18Å; V299-N410 VanDerWaalsContact CG1-ND2 3.3Å; V299-N410 WeakPolarHBondContact CG1-ND2 3.42Å |
| 300 | Y | 88.9 | Confident | 90 | Very high | 89 Ų | 89 | 66.2 Ų | 66.2 | 35% | 0.349 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -70.5 | -36.9 | 176.3 | -67.7 | -76.3 | 0 | 0 | 0 | 112 | R297 C298 F302 S303 F304 I414 | R297-Y300 HydrophobicContact CB-CD2 4.09Å; R297-Y300 HydrophobicContact CG-CD2 4.48Å; R297-Y300 WeakPolarHBondContact O-CB 3.42Å; R297-Y300 PolarHBondContact O-N 3.16Å; C298-Y300 VanDerWaalsContact C-N 3.33Å; C298-Y300 PolarHBondContact O-N 3.13Å; Y300-F302 VanDerWaalsContact C-N 3.27Å; Y300-F302 PolarHBondContact O-N 3.44Å; Y300-S303 PolarHBondContact O-N 3.14Å; Y300-F304 PolarHBondContact O-N 3.2Å; Y300-I414 HydrophobicContact CE2-CD1 3.64Å; Y300-I414 WeakPolarHBondContact OH-CD1 3.42Å |
| 301 | L | 92.1 | Very high | 90.6 | Very high | 33 Ų | 33 | 67.2 Ų | 67.2 | 17% | 0.173 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.7 | -37.6 | 174.4 | -174.9 | 64.1 | 0 | 0 | 0 | 110.8 | I288 A289 V294 R297 C298 F304 A305 M338 L342 | I288-L301 HydrophobicContact CG2-CD2 4.14Å; A289-L301 HydrophobicContact CB-CD2 4.44Å; V294-L301 HydrophobicContact CG1-CD2 3.83Å; R297-L301 PolarHBondContact O-N 3.45Å; C298-L301 WeakPolarHBondContact O-CB 3.33Å; C298-L301 PolarHBondContact O-N 2.9Å; C298-L301 VanDerWaalsContact O-N 3.16Å; L301-F304 HydrophobicContact CD1-CD1 4.48Å; L301-F304 PolarHBondContact O-N 2.93Å; L301-A305 PolarHBondContact O-N 3.4Å; L301-M338 HydrophobicContact CD1-CE 4.19Å; L301-L342 HydrophobicContact CB-CD1 4.31Å; L301-L342 HydrophobicContact CD2-CD1 4.13Å; L301-L342 HydrophobicContact CD2-CD2 4.12Å; L301-L342 HydrophobicContact CG-CD1 3.81Å |
| 302 | F | 93 | Very high | 91.1 | Very high | 2 Ų | 2 | 63.3 Ų | 63.3 | 1% | 0.009 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -67.8 | -42.8 | 174.3 | -174.2 | -125.2 | 0 | 0 | 0 | 112.7 | Y235 M242 C298 V299 Y300 F304 A305 M306 V339 L342 Q343 V346 L406 | Y235-F302 AromaticContact CE2-CE1 3.99Å; Y235-F302 HydrophobicContact CE2-CE1 3.99Å; M242-F302 HydrophobicContact SD-CZ 4.1Å; C298-F302 PolarHBondContact O-N 3.37Å; V299-F302 PolarHBondContact O-N 2.89Å; Y300-F302 VanDerWaalsContact C-N 3.27Å; Y300-F302 PolarHBondContact O-N 3.44Å; F302-F304 VanDerWaalsContact C-N 3.31Å; F302-F304 PolarHBondContact O-N 3.41Å; F302-A305 WeakPolarHBondContact O-CB 3.25Å; F302-A305 PolarHBondContact O-N 2.69Å; F302-M306 HydrophobicContact CD1-CE 3.7Å; F302-M306 HydrophobicContact CE1-CE 3.72Å; F302-M306 HydrophobicContact CE1-SD 3.98Å; F302-M306 HydrophobicContact CE2-CG 4.48Å; F302-M306 HydrophobicContact CG-CE 4.24Å; F302-M306 HydrophobicContact CZ-CE 4.29Å; F302-M306 HydrophobicContact CZ-CG 4.47Å; F302-M306 HydrophobicContact CZ-SD 4.05Å; F302-M306 PolarHBondContact O-N 2.83Å; F302-V339 HydrophobicContact CE2-CB 4.47Å; F302-V339 HydrophobicContact CE2-CG1 4.06Å; F302-L342 HydrophobicContact CB-CB 4.1Å; F302-L342 HydrophobicContact CB-CD1 4.14Å; F302-L342 HydrophobicContact CD2-CB 3.51Å; F302-L342 HydrophobicContact CD2-CD1 4.33Å; F302-L342 HydrophobicContact CE2-CB 4.29Å; F302-L342 HydrophobicContact CG-CB 4.14Å; F302-Q343 HydrophobicContact CE2-CB 4.21Å; F302-Q343 HydrophobicContact CZ-CB 4.28Å; F302-V346 HydrophobicContact CB-CG2 3.66Å; F302-V346 HydrophobicContact CD1-CB 4.26Å; F302-V346 HydrophobicContact CD1-CG1 4.17Å; F302-V346 HydrophobicContact CD1-CG2 4.05Å; F302-V346 HydrophobicContact CG-CG2 3.94Å; F302-L406 HydrophobicContact CD1-CD1 4.07Å; F302-L406 HydrophobicContact CE1-CD1 3.73Å |
| 303 | S | 93.3 | Very high | 91.7 | Very high | 4 Ų | 4 | 54.5 Ų | 54.5 | 3% | 0.028 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -56.4 | -45.2 | 170.5 | -67.2 | 0 | 0 | 0 | 0 | 112.1 | V299 Y300 M306 L307 A407 | V299-S303 PolarHBondContact O-N 2.95Å; V299-S303 PolarHBondContact O-OG 3.32Å; Y300-S303 PolarHBondContact O-N 3.14Å; S303-M306 PolarHBondContact O-N 3.38Å; S303-L307 VanDerWaalsContact O-CG 3.3Å; S303-L307 WeakPolarHBondContact O-CG 3.36Å; S303-L307 PolarHBondContact O-N 2.93Å; S303-A407 PolarHBondContact OG-N 3.09Å |
| 304 | F | 94.8 | Very high | 92.2 | Very high | 114 Ų | 114 | 47 Ų | 47 | 50% | 0.5 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61 | -44.5 | 174.6 | 170.9 | -98.9 | 0 | 0 | 0 | 112 | Y300 L301 F302 M306 L307 F308 M338 | Y300-F304 PolarHBondContact O-N 3.2Å; L301-F304 HydrophobicContact CD1-CD1 4.48Å; L301-F304 PolarHBondContact O-N 2.93Å; F302-F304 VanDerWaalsContact C-N 3.31Å; F302-F304 PolarHBondContact O-N 3.41Å; F304-M306 VanDerWaalsContact C-N 3.35Å; F304-M306 PolarHBondContact O-N 2.87Å; F304-L307 PolarHBondContact O-N 3.49Å; F304-F308 HydrophobicContact CZ-CB 4.45Å; F304-F308 VanDerWaalsContact O-CB 3.27Å; F304-F308 WeakPolarHBondContact O-CB 3.46Å; F304-F308 PolarHBondContact O-N 2.88Å; F304-M338 HydrophobicContact CD1-CE 3.81Å; F304-M338 HydrophobicContact CE1-CE 3.89Å |
| 305 | A | 96.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -58.2 | -44.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L301 F302 F308 N309 M338 V339 L342 | L301-A305 PolarHBondContact O-N 3.4Å; F302-A305 WeakPolarHBondContact O-CB 3.25Å; F302-A305 PolarHBondContact O-N 2.69Å; A305-F308 PolarHBondContact O-N 3.39Å; A305-N309 WeakPolarHBondContact O-CB 3.32Å; A305-N309 PolarHBondContact O-N 3.03Å; A305-M338 HydrophobicContact CB-CB 3.69Å; A305-M338 HydrophobicContact CB-CE 4.07Å; A305-V339 HydrophobicContact CB-CG2 3.95Å; A305-L342 HydrophobicContact CB-CD1 4.28Å |
| 306 | M | 95.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -68.6 | -41.9 | 176.5 | -67.1 | -180 | -73.6 | 0 | 0 | 112.3 | M242 F302 S303 F304 F308 N309 G310 V339 V399 L406 | M242-M306 HydrophobicContact CG-SD 4.35Å; M242-M306 HydrophobicContact SD-CG 3.96Å; M242-M306 HydrophobicContact SD-SD 3.77Å; F302-M306 HydrophobicContact CD1-CE 3.7Å; F302-M306 HydrophobicContact CE1-CE 3.72Å; F302-M306 HydrophobicContact CE1-SD 3.98Å; F302-M306 HydrophobicContact CE2-CG 4.48Å; F302-M306 HydrophobicContact CG-CE 4.24Å; F302-M306 HydrophobicContact CZ-CE 4.29Å; F302-M306 HydrophobicContact CZ-CG 4.47Å; F302-M306 HydrophobicContact CZ-SD 4.05Å; F302-M306 PolarHBondContact O-N 2.83Å; S303-M306 PolarHBondContact O-N 3.38Å; F304-M306 VanDerWaalsContact C-N 3.35Å; F304-M306 PolarHBondContact O-N 2.87Å; M306-F308 VanDerWaalsContact C-N 3.29Å; M306-F308 PolarHBondContact O-N 3.23Å; M306-N309 PolarHBondContact O-N 3.47Å; M306-G310 PolarHBondContact O-N 3.21Å; M306-V339 HydrophobicContact CG-CG2 4.14Å; M306-V399 HydrophobicContact CB-CG1 4.31Å; M306-V399 WeakPolarHBondContact O-CG1 3.39Å; M306-L406 HydrophobicContact CE-CB 3.94Å; M306-L406 HydrophobicContact CE-CD1 3.27Å; M306-L406 HydrophobicContact CE-CG 4.21Å; M306-L406 HydrophobicContact SD-CD1 3.92Å |
| 307 | L | 96.8 | Very high | 93.8 | Very high | 60 Ų | 60 | 37.2 Ų | 37.2 | 31% | 0.314 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -61.8 | -41.4 | 176.7 | -71.3 | 174.5 | 0 | 0 | 0 | 111.4 | S303 F304 T311 L400 V404 | S303-L307 VanDerWaalsContact O-CG 3.3Å; S303-L307 WeakPolarHBondContact O-CG 3.36Å; S303-L307 PolarHBondContact O-N 2.93Å; F304-L307 PolarHBondContact O-N 3.49Å; L307-T311 VanDerWaalsContact O-CB 3.3Å; L307-T311 WeakPolarHBondContact O-CB 3.27Å; L307-T311 PolarHBondContact O-N 3.06Å; L307-T311 PolarHBondContact O-OG1 3.29Å; L307-L400 HydrophobicContact CB-CD2 4.47Å; L307-L400 HydrophobicContact CD2-CD2 3.87Å; L307-L400 VanDerWaalsContact O-CD2 3.3Å; L307-L400 WeakPolarHBondContact O-CD2 3.48Å; L307-V404 HydrophobicContact CD2-CG2 3.92Å |
| 308 | F | 97.8 | Very high | 94.1 | Very high | 56 Ų | 56 | 35.5 Ų | 35.5 | 25% | 0.246 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.2 | -43.2 | 175.6 | 178.8 | -139.4 | 0 | 0 | 0 | 111.7 | F304 A305 M306 T311 A312 F331 V334 S335 M338 | F304-F308 HydrophobicContact CZ-CB 4.45Å; F304-F308 VanDerWaalsContact O-CB 3.27Å; F304-F308 WeakPolarHBondContact O-CB 3.46Å; F304-F308 PolarHBondContact O-N 2.88Å; A305-F308 PolarHBondContact O-N 3.39Å; M306-F308 VanDerWaalsContact C-N 3.29Å; M306-F308 PolarHBondContact O-N 3.23Å; F308-T311 PolarHBondContact O-N 3.04Å; F308-A312 WeakPolarHBondContact O-CB 3.36Å; F308-A312 PolarHBondContact O-N 3.03Å; F308-F331 HydrophobicContact CE2-CD1 4.21Å; F308-F331 HydrophobicContact CZ-CB 4.34Å; F308-F331 AromaticContact CZ-CD1 3.87Å; F308-F331 HydrophobicContact CZ-CD1 3.87Å; F308-V334 HydrophobicContact CE1-CB 4.19Å; F308-V334 HydrophobicContact CE1-CG1 3.95Å; F308-S335 VanDerWaalsContact CD1-CB 3.43Å; F308-M338 HydrophobicContact CD1-SD 4.37Å |
| 309 | N | 98 | Very high | 94.5 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62 | -52.9 | 176.6 | -171.8 | -102.5 | 0 | 0 | 0 | 112.1 | L246 A305 M306 T311 A312 D313 F332 S335 V399 | L246-N309 VanDerWaalsContact CD1-OD1 3.25Å; L246-N309 WeakPolarHBondContact CD1-OD1 3.34Å; A305-N309 WeakPolarHBondContact O-CB 3.32Å; A305-N309 PolarHBondContact O-N 3.03Å; M306-N309 PolarHBondContact O-N 3.47Å; N309-T311 VanDerWaalsContact C-N 3.29Å; N309-T311 PolarHBondContact O-N 3.29Å; N309-A312 WeakPolarHBondContact O-CB 3.49Å; N309-A312 PolarHBondContact O-N 3.11Å; N309-D313 PolarHBondContact O-N 3.36Å; N309-F332 WeakPolarHBondContact ND2-CE2 3.31Å; N309-S335 WeakPolarHBondContact CA-OG 3.42Å; N309-S335 PolarHBondContact ND2-OG 3.22Å; N309-V399 HydrophobicContact CB-CG1 4.15Å |
| 310 | G | 97.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -65.3 | -31 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | M306 D313 L314 | M306-G310 PolarHBondContact O-N 3.21Å; G310-D313 PolarHBondContact O-N 2.9Å; G310-L314 WeakPolarHBondContact O-CG 3.31Å; G310-L314 PolarHBondContact O-N 3.5Å |
| 311 | T | 97.1 | Very high | 95 | Very high | 68 Ų | 68 | 39.4 Ų | 39.4 | 42% | 0.417 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -67.8 | -41 | 171.2 | -55.4 | 0 | 0 | 0 | 0 | 111.4 | L307 F308 N309 D313 L314 V315 | L307-T311 VanDerWaalsContact O-CB 3.3Å; L307-T311 WeakPolarHBondContact O-CB 3.27Å; L307-T311 PolarHBondContact O-N 3.06Å; L307-T311 PolarHBondContact O-OG1 3.29Å; F308-T311 PolarHBondContact O-N 3.04Å; N309-T311 VanDerWaalsContact C-N 3.29Å; N309-T311 PolarHBondContact O-N 3.29Å; T311-D313 VanDerWaalsContact C-N 3.27Å; T311-D313 PolarHBondContact O-N 3.22Å; T311-L314 PolarHBondContact O-N 2.94Å; T311-V315 HydrophobicContact CG2-CG2 4.4Å; T311-V315 WeakPolarHBondContact O-CG2 3.39Å; T311-V315 PolarHBondContact O-N 2.93Å |
| 312 | A | 97.3 | Very high | 95.2 | Very high | 11 Ų | 11 | 40.4 Ų | 40.4 | 9% | 0.091 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -59.9 | -39.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | F308 N309 G316 F328 F331 | F308-A312 WeakPolarHBondContact O-CB 3.36Å; F308-A312 PolarHBondContact O-N 3.03Å; N309-A312 WeakPolarHBondContact O-CB 3.49Å; N309-A312 PolarHBondContact O-N 3.11Å; A312-G316 WeakPolarHBondContact O-CA 3.35Å; A312-G316 PolarHBondContact O-N 2.77Å; A312-F328 WeakPolarHBondContact O-CD2 3.48Å; A312-F331 HydrophobicContact CB-CB 4.21Å |
| 313 | D | 96.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64.4 | -45.1 | 174.1 | -72.8 | -13.6 | 0 | 0 | 0 | 112.8 | P249 N309 G310 T311 V315 G316 S317 F328 F332 G396 | P249-D313 WeakPolarHBondContact CG-OD1 3.34Å; N309-D313 PolarHBondContact O-N 3.36Å; G310-D313 PolarHBondContact O-N 2.9Å; T311-D313 VanDerWaalsContact C-N 3.27Å; T311-D313 PolarHBondContact O-N 3.22Å; D313-V315 PolarHBondContact O-N 3.21Å; D313-G316 CarbonylContact O-C 3.35Å; D313-G316 PolarHBondContact O-N 3.35Å; D313-S317 PolarHBondContact O-N 3.13Å; D313-F328 WeakPolarHBondContact OD1-CE2 3.37Å; D313-F332 WeakPolarHBondContact OD1-CD2 3.42Å; D313-F332 WeakPolarHBondContact OD1-CE2 3.44Å; D313-G396 VanDerWaalsContact CB-CA 3.43Å |
| 314 | L | 96.3 | Very high | 95.5 | Very high | 58 Ų | 58 | 46.5 Ų | 46.5 | 30% | 0.304 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62.2 | -42.8 | 176.6 | -70.8 | -169.3 | 0 | 0 | 0 | 112.3 | G310 T311 S317 L393 L400 | G310-L314 WeakPolarHBondContact O-CG 3.31Å; G310-L314 PolarHBondContact O-N 3.5Å; T311-L314 PolarHBondContact O-N 2.94Å; L314-S317 WeakPolarHBondContact O-CB 3.37Å; L314-S317 PolarHBondContact O-N 3.26Å; L314-S317 PolarHBondContact O-OG 2.99Å; L314-L393 HydrophobicContact CD2-CG 4.12Å; L314-L400 HydrophobicContact CD1-CD1 3.34Å; L314-L400 HydrophobicContact CG-CD1 3.96Å |
| 315 | V | 94.6 | Very high | 95.6 | Very high | 104 Ų | 104 | 41.1 Ų | 41.1 | 63% | 0.63 | 23% | 0.225 | S | C | * | . | H | α-helix | trans | -68.1 | -41.5 | 175.9 | 175 | 0 | 0 | 0 | 0 | 110.3 | T311 D313 S317 Q318 | T311-V315 HydrophobicContact CG2-CG2 4.4Å; T311-V315 WeakPolarHBondContact O-CG2 3.39Å; T311-V315 PolarHBondContact O-N 2.93Å; D313-V315 PolarHBondContact O-N 3.21Å; V315-S317 PolarHBondContact O-N 3.37Å; V315-Q318 PolarHBondContact O-N 2.9Å; V315-Q318 VanDerWaalsContact O-N 3.09Å |
| 316 | G | 92.6 | Very high | 95.6 | Very high | 4 Ų | 4 | 42.6 Ų | 42.6 | 4% | 0.041 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61 | -28.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | A312 D313 Q318 A319 | A312-G316 WeakPolarHBondContact O-CA 3.35Å; A312-G316 PolarHBondContact O-N 2.77Å; D313-G316 CarbonylContact O-C 3.35Å; D313-G316 PolarHBondContact O-N 3.35Å; G316-Q318 PolarHBondContact O-N 3.5Å; G316-Q318 VanDerWaalsContact O-N 3.12Å; G316-A319 WeakPolarHBondContact O-CB 3.44Å; G316-A319 PolarHBondContact O-N 3.45Å |
| 317 | S | 93.5 | Very high | 95.7 | Very high | 4 Ų | 4 | 46.5 Ų | 46.5 | 3% | 0.028 | 25% | 0.254 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -22 | 174.5 | 78.7 | 0 | 0 | 0 | 0 | 113.6 | D313 L314 V315 M389 | D313-S317 PolarHBondContact O-N 3.13Å; L314-S317 WeakPolarHBondContact O-CB 3.37Å; L314-S317 PolarHBondContact O-N 3.26Å; L314-S317 PolarHBondContact O-OG 2.99Å; V315-S317 PolarHBondContact O-N 3.37Å; S317-M389 WeakPolarHBondContact CB-O 3.25Å; S317-M389 WeakPolarHBondContact O-CG 3.45Å |
| 318 | Q | 93.3 | Very high | 95.8 | Very high | 113 Ų | 113 | 44.1 Ų | 44.1 | 53% | 0.528 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -95 | 5.2 | 179 | -56.8 | -63.8 | -13.3 | 0 | 0 | 113.3 | V315 G316 N320 | V315-Q318 PolarHBondContact O-N 2.9Å; V315-Q318 VanDerWaalsContact O-N 3.09Å; G316-Q318 PolarHBondContact O-N 3.5Å; G316-Q318 VanDerWaalsContact O-N 3.12Å; Q318-N320 PolarHBondContact O-N 3.4Å; Q318-N320 PolarHBondContact O-ND2 2.93Å; Q318-N320 VanDerWaalsContact O-ND2 3.08Å |
| 319 | A | 92.4 | Very high | 95.8 | Very high | 4 Ų | 4 | 41.4 Ų | 41.4 | 3% | 0.033 | 23% | 0.23 | C | C | . | . | trans | -68.7 | 123.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | Y256 G316 L325 | Y256-A319 PolarHBondContact OH-O 3.29Å; G316-A319 WeakPolarHBondContact O-CB 3.44Å; G316-A319 PolarHBondContact O-N 3.45Å; A319-L325 HydrophobicContact CB-CD2 3.77Å; A319-L325 HydrophobicContact CB-CG 4.16Å | ||
| 320 | N | 92.5 | Very high | 95.8 | Very high | 124 Ų | 124 | 44.5 Ų | 44.5 | 66% | 0.663 | 25% | 0.245 | S | C | * | . | trans | -114 | -0.9 | -179.2 | -65.9 | -61.3 | 0 | 0 | 0 | 113.2 | Q318 | Q318-N320 PolarHBondContact O-N 3.4Å; Q318-N320 PolarHBondContact O-ND2 2.93Å; Q318-N320 VanDerWaalsContact O-ND2 3.08Å | ||
| 321 | D | 94.3 | Very high | 95.8 | Very high | 69 Ų | 69 | 49.6 Ų | 49.6 | 37% | 0.369 | 27% | 0.268 | S | S | . | . | S | Bend | trans | -147.4 | 164.1 | -173.5 | 67.5 | -81.4 | 0 | 0 | 0 | 110.3 | V323 S324 L325 | D321-V323 VanDerWaalsContact C-N 3.32Å; D321-V323 PolarHBondContact O-N 3.41Å; D321-V323 WeakPolarHBondContact OD2-CA 3.4Å; D321-V323 VanDerWaalsContact OD2-CB 3.27Å; D321-V323 WeakPolarHBondContact OD2-CB 3.37Å; D321-V323 PolarHBondContact OD2-N 3.4Å; D321-S324 PolarHBondContact O-N 3.02Å; D321-S324 VanDerWaalsContact OD1-CB 3.32Å; D321-S324 WeakPolarHBondContact OD1-CB 3.42Å; D321-S324 PolarHBondContact OD1-OG 3.48Å; D321-S324 PolarHBondContact OD2-N 3.37Å; D321-L325 PolarHBondContact O-N 2.9Å |
| 322 | Y | 95.3 | Very high | 95.8 | Very high | 54 Ų | 54 | 46.4 Ų | 46.4 | 21% | 0.212 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.2 | -36.7 | -177.2 | -174.4 | -101.5 | 0 | 0 | 0 | 113.2 | N262 S266 L270 L325 V326 | N262-Y322 HydrophobicContact CB-CD2 4.26Å; N262-Y322 WeakPolarHBondContact OD1-CB 3.32Å; S266-Y322 WeakPolarHBondContact O-CE2 3.25Å; S266-Y322 PolarHBondContact O-OH 3.24Å; L270-Y322 HydrophobicContact CD1-CE2 4.13Å; L270-Y322 HydrophobicContact CD2-CE2 3.97Å; L270-Y322 HydrophobicContact CG-CE2 3.95Å; Y322-L325 WeakPolarHBondContact O-CB 3.45Å; Y322-L325 PolarHBondContact O-N 3.34Å; Y322-V326 HydrophobicContact CD1-CG2 3.93Å; Y322-V326 HydrophobicContact CE1-CG2 3.54Å; Y322-V326 WeakPolarHBondContact O-CG2 3.44Å; Y322-V326 PolarHBondContact O-N 2.97Å |
| 323 | V | 96.1 | Very high | 95.8 | Very high | 92 Ų | 92 | 45.9 Ų | 45.9 | 56% | 0.558 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -66.9 | -41.9 | -178.8 | -178 | 0 | 0 | 0 | 0 | 109.9 | D321 L325 V326 I327 | D321-V323 VanDerWaalsContact C-N 3.32Å; D321-V323 PolarHBondContact O-N 3.41Å; D321-V323 WeakPolarHBondContact OD2-CA 3.4Å; D321-V323 VanDerWaalsContact OD2-CB 3.27Å; D321-V323 WeakPolarHBondContact OD2-CB 3.37Å; D321-V323 PolarHBondContact OD2-N 3.4Å; V323-L325 VanDerWaalsContact C-N 3.3Å; V323-L325 PolarHBondContact O-N 3.2Å; V323-V326 WeakPolarHBondContact O-CB 3.46Å; V323-V326 PolarHBondContact O-N 3.47Å; V323-I327 HydrophobicContact CG1-CD1 4.18Å; V323-I327 WeakPolarHBondContact O-CG1 3.25Å; V323-I327 PolarHBondContact O-N 3.43Å |
| 324 | S | 96.1 | Very high | 95.9 | Very high | 42 Ų | 42 | 48.2 Ų | 48.2 | 29% | 0.294 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.1 | -39.8 | 172.8 | -65.9 | 0 | 0 | 0 | 0 | 112.4 | D321 I327 F328 | D321-S324 PolarHBondContact O-N 3.02Å; D321-S324 VanDerWaalsContact OD1-CB 3.32Å; D321-S324 WeakPolarHBondContact OD1-CB 3.42Å; D321-S324 PolarHBondContact OD1-OG 3.48Å; D321-S324 PolarHBondContact OD2-N 3.37Å; S324-I327 PolarHBondContact O-N 2.95Å; S324-F328 WeakPolarHBondContact O-CB 3.36Å; S324-F328 PolarHBondContact O-N 3.49Å |
| 325 | L | 96.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67 | -37.7 | 174.5 | -70.8 | 178.6 | 0 | 0 | 0 | 113.1 | Y256 A257 L260 L270 A319 D321 Y322 V323 F328 C329 | Y256-L325 HydrophobicContact CD1-CD1 4.36Å; Y256-L325 HydrophobicContact CD1-CD2 3.62Å; Y256-L325 HydrophobicContact CE1-CD2 3.77Å; A257-L325 HydrophobicContact CB-CD1 3.82Å; L260-L325 HydrophobicContact CD1-CD1 3.76Å; L260-L325 HydrophobicContact CD1-CG 4.48Å; L270-L325 HydrophobicContact CD1-CB 4.05Å; L270-L325 HydrophobicContact CD1-CD1 4.15Å; L270-L325 HydrophobicContact CD2-CB 4.2Å; A319-L325 HydrophobicContact CB-CD2 3.77Å; A319-L325 HydrophobicContact CB-CG 4.16Å; D321-L325 PolarHBondContact O-N 2.9Å; Y322-L325 WeakPolarHBondContact O-CB 3.45Å; Y322-L325 PolarHBondContact O-N 3.34Å; V323-L325 VanDerWaalsContact C-N 3.3Å; V323-L325 PolarHBondContact O-N 3.2Å; L325-F328 WeakPolarHBondContact O-CB 3.42Å; L325-F328 PolarHBondContact O-N 3.23Å; L325-C329 PolarHBondContact O-N 3.45Å; L325-C329 PolarHBondContact O-SG 3.2Å; L325-C329 VanDerWaalsContact O-SG 3.39Å |
| 326 | V | 97.8 | Very high | 96 | Very high | 31 Ų | 31 | 41.2 Ų | 41.2 | 19% | 0.188 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.9 | -47.2 | 173.8 | 167.8 | 0 | 0 | 0 | 0 | 110.7 | L270 I273 Y322 V323 F328 C329 I330 | L270-V326 HydrophobicContact CD2-CB 4.42Å; L270-V326 HydrophobicContact CD2-CG2 3.64Å; I273-V326 HydrophobicContact CD1-CG1 4.09Å; I273-V326 HydrophobicContact CD1-CG2 4Å; Y322-V326 HydrophobicContact CD1-CG2 3.93Å; Y322-V326 HydrophobicContact CE1-CG2 3.54Å; Y322-V326 WeakPolarHBondContact O-CG2 3.44Å; Y322-V326 PolarHBondContact O-N 2.97Å; V323-V326 WeakPolarHBondContact O-CB 3.46Å; V323-V326 PolarHBondContact O-N 3.47Å; V326-F328 VanDerWaalsContact C-N 3.31Å; V326-F328 PolarHBondContact O-N 2.98Å; V326-C329 PolarHBondContact O-N 3.37Å; V326-I330 HydrophobicContact CG1-CD1 4.13Å; V326-I330 WeakPolarHBondContact O-CG1 3.27Å; V326-I330 PolarHBondContact O-N 2.91Å |
| 327 | I | 97.6 | Very high | 96.1 | Very high | 83 Ų | 83 | 41 Ų | 41 | 43% | 0.426 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -60.2 | -44.1 | 177.4 | -67 | 168.2 | 0 | 0 | 0 | 110.3 | V323 S324 I330 F331 | V323-I327 HydrophobicContact CG1-CD1 4.18Å; V323-I327 WeakPolarHBondContact O-CG1 3.25Å; V323-I327 PolarHBondContact O-N 3.43Å; S324-I327 PolarHBondContact O-N 2.95Å; I327-I330 PolarHBondContact O-N 2.89Å; I327-F331 HydrophobicContact CG2-CD2 3.73Å; I327-F331 HydrophobicContact CG2-CE2 3.54Å; I327-F331 VanDerWaalsContact O-CD2 3.27Å; I327-F331 WeakPolarHBondContact O-CD2 3.34Å; I327-F331 PolarHBondContact O-N 3.46Å |
| 328 | F | 97.7 | Very high | 96.2 | Very high | 9 Ų | 9 | 42 Ų | 42 | 4% | 0.039 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -55.6 | -51.8 | 172.8 | 163.4 | -101.8 | 0 | 0 | 0 | 111.7 | P249 V253 A312 D313 S324 L325 V326 I330 F331 F332 F392 | P249-F328 HydrophobicContact CB-CE1 4.25Å; P249-F328 HydrophobicContact CB-CZ 3.7Å; P249-F328 HydrophobicContact CG-CZ 4.44Å; V253-F328 HydrophobicContact CG2-CD1 4.45Å; V253-F328 HydrophobicContact CG2-CE1 4.32Å; A312-F328 WeakPolarHBondContact O-CD2 3.48Å; D313-F328 WeakPolarHBondContact OD1-CE2 3.37Å; S324-F328 WeakPolarHBondContact O-CB 3.36Å; S324-F328 PolarHBondContact O-N 3.49Å; L325-F328 WeakPolarHBondContact O-CB 3.42Å; L325-F328 PolarHBondContact O-N 3.23Å; V326-F328 VanDerWaalsContact C-N 3.31Å; V326-F328 PolarHBondContact O-N 2.98Å; F328-I330 PolarHBondContact O-N 2.93Å; F328-F331 PolarHBondContact O-N 2.89Å; F328-F332 HydrophobicContact CD2-CB 4.43Å; F328-F332 HydrophobicContact CE1-CB 4.36Å; F328-F332 HydrophobicContact CE2-CB 3.97Å; F328-F332 AromaticContact CE2-CD2 3.88Å; F328-F332 HydrophobicContact CE2-CD2 3.88Å; F328-F332 HydrophobicContact CE2-CG 4.24Å; F328-F332 HydrophobicContact CZ-CB 3.92Å; F328-F332 AromaticContact CZ-CD2 3.67Å; F328-F332 HydrophobicContact CZ-CD2 3.67Å; F328-F332 HydrophobicContact CZ-CE2 4.42Å; F328-F332 AromaticContact CZ-CG 3.89Å; F328-F332 HydrophobicContact CZ-CG 3.89Å; F328-F332 WeakPolarHBondContact O-CB 3.46Å; F328-F332 PolarHBondContact O-N 2.96Å; F328-F392 HydrophobicContact CD1-CE1 4.35Å; F328-F392 HydrophobicContact CE1-CD1 4.47Å; F328-F392 AromaticContact CE1-CE1 3.7Å; F328-F392 HydrophobicContact CE1-CE1 3.7Å; F328-F392 HydrophobicContact CE2-CD1 4.4Å; F328-F392 HydrophobicContact CE2-CE1 4.4Å; F328-F392 HydrophobicContact CZ-CD1 4.11Å; F328-F392 AromaticContact CZ-CE1 3.73Å; F328-F392 HydrophobicContact CZ-CE1 3.73Å |
| 329 | C | 97.8 | Very high | 96.2 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.1 | -32.9 | 179.7 | -76.6 | 0 | 0 | 0 | 0 | 113.2 | I273 L274 L325 V326 G333 | I273-C329 HydrophobicContact CB-CB 4.47Å; I273-C329 HydrophobicContact CG2-CB 4.11Å; L274-C329 HydrophobicContact CB-CB 4.48Å; L325-C329 PolarHBondContact O-N 3.45Å; L325-C329 PolarHBondContact O-SG 3.2Å; L325-C329 VanDerWaalsContact O-SG 3.39Å; V326-C329 PolarHBondContact O-N 3.37Å; C329-G333 WeakPolarHBondContact O-CA 3.31Å; C329-G333 PolarHBondContact O-N 2.85Å |
| 330 | I | 98.2 | Very high | 96.1 | Very high | 65 Ų | 65 | 37.3 Ų | 37.3 | 33% | 0.333 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -66.4 | -55.3 | 175.6 | -66.7 | 165.4 | 0 | 0 | 0 | 110.4 | I273 I277 V326 I327 F328 F332 G333 V334 | I273-I330 HydrophobicContact CG2-CG1 3.77Å; I277-I330 HydrophobicContact CD1-CG2 4.34Å; I277-I330 HydrophobicContact CG1-CG1 4.39Å; I277-I330 HydrophobicContact CG1-CG2 4.4Å; V326-I330 HydrophobicContact CG1-CD1 4.13Å; V326-I330 WeakPolarHBondContact O-CG1 3.27Å; V326-I330 PolarHBondContact O-N 2.91Å; I327-I330 PolarHBondContact O-N 2.89Å; F328-I330 PolarHBondContact O-N 2.93Å; I330-F332 PolarHBondContact O-N 3.33Å; I330-G333 PolarHBondContact O-N 2.82Å; I330-V334 WeakPolarHBondContact O-CG2 3.22Å; I330-V334 PolarHBondContact O-N 3.04Å |
| 331 | F | 98.1 | Very high | 96 | Very high | 107 Ų | 107 | 32.6 Ų | 32.6 | 47% | 0.469 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -67.2 | -37.9 | -178.7 | -70.8 | -62.9 | 0 | 0 | 0 | 112.6 | F308 A312 I327 F328 V334 S335 | F308-F331 HydrophobicContact CE2-CD1 4.21Å; F308-F331 HydrophobicContact CZ-CB 4.34Å; F308-F331 AromaticContact CZ-CD1 3.87Å; F308-F331 HydrophobicContact CZ-CD1 3.87Å; A312-F331 HydrophobicContact CB-CB 4.21Å; I327-F331 HydrophobicContact CG2-CD2 3.73Å; I327-F331 HydrophobicContact CG2-CE2 3.54Å; I327-F331 VanDerWaalsContact O-CD2 3.27Å; I327-F331 WeakPolarHBondContact O-CD2 3.34Å; I327-F331 PolarHBondContact O-N 3.46Å; F328-F331 PolarHBondContact O-N 2.89Å; F331-V334 PolarHBondContact O-N 2.6Å; F331-S335 PolarHBondContact O-N 3.42Å; F331-S335 VanDerWaalsContact O-N 3.08Å; F331-S335 PolarHBondContact O-OG 3.31Å |
| 332 | F | 97.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61.3 | -46.7 | 171.9 | -171.2 | -86.1 | 0 | 0 | 0 | 110.7 | L246 P249 P250 L274 N309 D313 F328 I330 V334 S335 Y336 | L246-F332 HydrophobicContact CD1-CZ 4.4Å; P249-F332 HydrophobicContact CB-CE2 4.16Å; P249-F332 HydrophobicContact CB-CZ 4.42Å; P249-F332 HydrophobicContact CG-CE2 3.96Å; P249-F332 HydrophobicContact CG-CZ 4.42Å; P250-F332 HydrophobicContact CG-CE1 3.62Å; P250-F332 HydrophobicContact CG-CZ 3.81Å; L274-F332 HydrophobicContact CD1-CD1 3.55Å; L274-F332 HydrophobicContact CD1-CE1 3.88Å; L274-F332 HydrophobicContact CG-CD1 4.04Å; N309-F332 WeakPolarHBondContact ND2-CE2 3.31Å; D313-F332 WeakPolarHBondContact OD1-CD2 3.42Å; D313-F332 WeakPolarHBondContact OD1-CE2 3.44Å; F328-F332 HydrophobicContact CD2-CB 4.43Å; F328-F332 HydrophobicContact CE1-CB 4.36Å; F328-F332 HydrophobicContact CE2-CB 3.97Å; F328-F332 AromaticContact CE2-CD2 3.88Å; F328-F332 HydrophobicContact CE2-CD2 3.88Å; F328-F332 HydrophobicContact CE2-CG 4.24Å; F328-F332 HydrophobicContact CZ-CB 3.92Å; F328-F332 AromaticContact CZ-CD2 3.67Å; F328-F332 HydrophobicContact CZ-CD2 3.67Å; F328-F332 HydrophobicContact CZ-CE2 4.42Å; F328-F332 AromaticContact CZ-CG 3.89Å; F328-F332 HydrophobicContact CZ-CG 3.89Å; F328-F332 WeakPolarHBondContact O-CB 3.46Å; F328-F332 PolarHBondContact O-N 2.96Å; I330-F332 PolarHBondContact O-N 3.33Å; F332-V334 VanDerWaalsContact C-N 3.34Å; F332-V334 PolarHBondContact O-N 2.91Å; F332-S335 WeakPolarHBondContact CA-OG 3.37Å; F332-S335 PolarHBondContact O-N 3.21Å; F332-S335 PolarHBondContact O-OG 2.98Å; F332-Y336 HydrophobicContact CD1-CD2 4.5Å; F332-Y336 HydrophobicContact CD1-CG 4.48Å; F332-Y336 AromaticContact CE1-CD2 3.51Å; F332-Y336 HydrophobicContact CE1-CD2 3.51Å; F332-Y336 HydrophobicContact CE1-CE2 4.32Å; F332-Y336 AromaticContact CE1-CG 3.87Å; F332-Y336 HydrophobicContact CE1-CG 3.87Å; F332-Y336 AromaticContact CZ-CD2 3.78Å; F332-Y336 HydrophobicContact CZ-CD2 3.78Å; F332-Y336 HydrophobicContact CZ-CE2 4.48Å; F332-Y336 WeakPolarHBondContact O-CB 3.27Å; F332-Y336 PolarHBondContact O-N 3.23Å |
| 333 | G | 97.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -58.1 | -42.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | C329 I330 G337 | C329-G333 WeakPolarHBondContact O-CA 3.31Å; C329-G333 PolarHBondContact O-N 2.85Å; I330-G333 PolarHBondContact O-N 2.82Å; G333-G337 PolarHBondContact O-N 3.29Å |
| 334 | V | 97.8 | Very high | 95.1 | Very high | 49 Ų | 49 | 25 Ų | 25 | 30% | 0.297 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -61.8 | -55.1 | 175.9 | 177.9 | 0 | 0 | 0 | 0 | 110.6 | I277 A281 F308 I330 F331 F332 Y336 G337 M338 | I277-V334 HydrophobicContact CG2-CB 4.29Å; I277-V334 HydrophobicContact CG2-CG2 3.4Å; I277-V334 VanDerWaalsContact CG2-CG2 3.4Å; A281-V334 HydrophobicContact CB-CB 4.47Å; A281-V334 HydrophobicContact CB-CG1 4.4Å; F308-V334 HydrophobicContact CE1-CB 4.19Å; F308-V334 HydrophobicContact CE1-CG1 3.95Å; I330-V334 WeakPolarHBondContact O-CG2 3.22Å; I330-V334 PolarHBondContact O-N 3.04Å; F331-V334 PolarHBondContact O-N 2.6Å; F332-V334 VanDerWaalsContact C-N 3.34Å; F332-V334 PolarHBondContact O-N 2.91Å; V334-Y336 PolarHBondContact O-N 3.23Å; V334-G337 PolarHBondContact O-N 3.33Å; V334-M338 HydrophobicContact CG1-SD 4.2Å; V334-M338 WeakPolarHBondContact O-CG 3.13Å; V334-M338 PolarHBondContact O-N 3.23Å |
| 335 | S | 97 | Very high | 94.6 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -65.9 | -38.3 | -176 | 60.1 | 0 | 0 | 0 | 0 | 112.6 | F308 N309 F331 F332 M338 V339 | F308-S335 VanDerWaalsContact CD1-CB 3.43Å; N309-S335 WeakPolarHBondContact CA-OG 3.42Å; N309-S335 PolarHBondContact ND2-OG 3.22Å; F331-S335 PolarHBondContact O-N 3.42Å; F331-S335 VanDerWaalsContact O-N 3.08Å; F331-S335 PolarHBondContact O-OG 3.31Å; F332-S335 WeakPolarHBondContact CA-OG 3.37Å; F332-S335 PolarHBondContact O-N 3.21Å; F332-S335 PolarHBondContact O-OG 2.98Å; S335-M338 WeakPolarHBondContact O-CB 3.43Å; S335-M338 PolarHBondContact O-N 3.24Å; S335-V339 WeakPolarHBondContact O-CG2 3.42Å; S335-V339 PolarHBondContact O-N 3.41Å |
| 336 | Y | 95.8 | Very high | 94.1 | Very high | 16 Ų | 16 | 25.6 Ų | 25.6 | 6% | 0.063 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -62 | -43.5 | 174.6 | -171.5 | -94.3 | 0 | 0 | 0 | 111.7 | K40 L246 F247 F332 V334 M338 V339 G340 | K40-Y336 WeakPolarHBondContact CE-OH 3.31Å; K40-Y336 VanDerWaalsContact NZ-CZ 3.29Å; K40-Y336 PolarHBondContact NZ-OH 2.92Å; L246-Y336 HydrophobicContact CD1-CD2 3.69Å; L246-Y336 HydrophobicContact CD1-CE2 3.99Å; L246-Y336 HydrophobicContact CD2-CD2 4.48Å; L246-Y336 HydrophobicContact CD2-CE2 4.09Å; L246-Y336 HydrophobicContact CG-CD2 4.05Å; L246-Y336 HydrophobicContact CG-CE2 3.8Å; F247-Y336 WeakPolarHBondContact CE1-OH 3.49Å; F332-Y336 HydrophobicContact CD1-CD2 4.5Å; F332-Y336 HydrophobicContact CD1-CG 4.48Å; F332-Y336 AromaticContact CE1-CD2 3.51Å; F332-Y336 HydrophobicContact CE1-CD2 3.51Å; F332-Y336 HydrophobicContact CE1-CE2 4.32Å; F332-Y336 AromaticContact CE1-CG 3.87Å; F332-Y336 HydrophobicContact CE1-CG 3.87Å; F332-Y336 AromaticContact CZ-CD2 3.78Å; F332-Y336 HydrophobicContact CZ-CD2 3.78Å; F332-Y336 HydrophobicContact CZ-CE2 4.48Å; F332-Y336 WeakPolarHBondContact O-CB 3.27Å; F332-Y336 PolarHBondContact O-N 3.23Å; V334-Y336 PolarHBondContact O-N 3.23Å; Y336-M338 VanDerWaalsContact C-N 3.34Å; Y336-M338 PolarHBondContact O-N 3.07Å; Y336-V339 PolarHBondContact O-N 2.88Å; Y336-G340 PolarHBondContact O-N 3.44Å |
| 337 | G | 94.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.5 | -39.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | D278 G333 V334 A341 | D278-G337 VanDerWaalsContact OD1-CA 3.25Å; D278-G337 WeakPolarHBondContact OD1-CA 3.41Å; G333-G337 PolarHBondContact O-N 3.29Å; V334-G337 PolarHBondContact O-N 3.33Å; G337-A341 WeakPolarHBondContact O-CB 3.47Å; G337-A341 PolarHBondContact O-N 2.89Å |
| 338 | M | 95.4 | Very high | 92.8 | Very high | 23 Ų | 23 | 24.1 Ų | 24.1 | 11% | 0.113 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -64.3 | -50 | 174.5 | -66.1 | 174.5 | 68.1 | 0 | 0 | 112.2 | C285 L301 F304 A305 F308 V334 S335 Y336 G340 A341 L342 | C285-M338 HydrophobicContact CB-CB 4.38Å; C285-M338 HydrophobicContact CB-CG 3.97Å; L301-M338 HydrophobicContact CD1-CE 4.19Å; F304-M338 HydrophobicContact CD1-CE 3.81Å; F304-M338 HydrophobicContact CE1-CE 3.89Å; A305-M338 HydrophobicContact CB-CB 3.69Å; A305-M338 HydrophobicContact CB-CE 4.07Å; F308-M338 HydrophobicContact CD1-SD 4.37Å; V334-M338 HydrophobicContact CG1-SD 4.2Å; V334-M338 WeakPolarHBondContact O-CG 3.13Å; V334-M338 PolarHBondContact O-N 3.23Å; S335-M338 WeakPolarHBondContact O-CB 3.43Å; S335-M338 PolarHBondContact O-N 3.24Å; Y336-M338 VanDerWaalsContact C-N 3.34Å; Y336-M338 PolarHBondContact O-N 3.07Å; M338-G340 VanDerWaalsContact C-N 3.3Å; M338-G340 PolarHBondContact O-N 2.84Å; M338-A341 PolarHBondContact O-N 3.35Å; M338-L342 WeakPolarHBondContact O-CB 3.46Å; M338-L342 VanDerWaalsContact O-CG 3.27Å; M338-L342 WeakPolarHBondContact O-CG 3.35Å; M338-L342 PolarHBondContact O-N 3.17Å; M338-L342 VanDerWaalsContact O-N 3.12Å |
| 339 | V | 94.9 | Very high | 92.1 | Very high | 1 Ų | 1 | 27.1 Ų | 27.1 | 1% | 0.006 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56 | -48.3 | 177.6 | 168.2 | 0 | 0 | 0 | 0 | 110.1 | M242 L246 F302 A305 M306 S335 Y336 A341 L342 Q343 | M242-V339 HydrophobicContact CE-CG1 4.13Å; M242-V339 HydrophobicContact SD-CG1 3.58Å; M242-V339 VanDerWaalsContact SD-CG1 3.58Å; L246-V339 HydrophobicContact CD2-CG1 3.98Å; F302-V339 HydrophobicContact CE2-CB 4.47Å; F302-V339 HydrophobicContact CE2-CG1 4.06Å; A305-V339 HydrophobicContact CB-CG2 3.95Å; M306-V339 HydrophobicContact CG-CG2 4.14Å; S335-V339 WeakPolarHBondContact O-CG2 3.42Å; S335-V339 PolarHBondContact O-N 3.41Å; Y336-V339 PolarHBondContact O-N 2.88Å; V339-A341 VanDerWaalsContact C-N 3.32Å; V339-A341 PolarHBondContact O-N 3.47Å; V339-L342 PolarHBondContact O-N 3.34Å; V339-Q343 WeakPolarHBondContact O-CB 3.49Å; V339-Q343 PolarHBondContact O-N 3.29Å |
| 340 | G | 90.3 | Very high | 91.4 | Very high | 19 Ų | 19 | 29.4 Ų | 29.4 | 20% | 0.196 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -69.1 | -24.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | R282 Y336 M338 | R282-G340 VanDerWaalsContact NH1-C 3.32Å; R282-G340 VanDerWaalsContact NH1-CA 3.32Å; R282-G340 PolarHBondContact NH1-O 3.41Å; Y336-G340 PolarHBondContact O-N 3.44Å; M338-G340 VanDerWaalsContact C-N 3.3Å; M338-G340 PolarHBondContact O-N 2.84Å |
| 341 | A | 90.1 | Very high | 90.5 | Very high | 24 Ų | 24 | 27.4 Ų | 27.4 | 20% | 0.198 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -74.8 | -38.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112 | R282 C285 G337 M338 V339 | R282-A341 HydrophobicContact CG-CB 4.08Å; C285-A341 HydrophobicContact CB-CB 4.11Å; G337-A341 WeakPolarHBondContact O-CB 3.47Å; G337-A341 PolarHBondContact O-N 2.89Å; M338-A341 PolarHBondContact O-N 3.35Å; V339-A341 VanDerWaalsContact C-N 3.32Å; V339-A341 PolarHBondContact O-N 3.47Å |
| 342 | L | 90.8 | Very high | 89.4 | Confident | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -94.1 | -24.1 | -167.2 | -65.3 | 173.1 | 0 | 0 | 0 | 114.3 | A289 L301 F302 A305 M338 V339 F344 E345 V346 | A289-L342 HydrophobicContact CB-CD2 3.59Å; L301-L342 HydrophobicContact CB-CD1 4.31Å; L301-L342 HydrophobicContact CD2-CD1 4.13Å; L301-L342 HydrophobicContact CD2-CD2 4.12Å; L301-L342 HydrophobicContact CG-CD1 3.81Å; F302-L342 HydrophobicContact CB-CB 4.1Å; F302-L342 HydrophobicContact CB-CD1 4.14Å; F302-L342 HydrophobicContact CD2-CB 3.51Å; F302-L342 HydrophobicContact CD2-CD1 4.33Å; F302-L342 HydrophobicContact CE2-CB 4.29Å; F302-L342 HydrophobicContact CG-CB 4.14Å; A305-L342 HydrophobicContact CB-CD1 4.28Å; M338-L342 WeakPolarHBondContact O-CB 3.46Å; M338-L342 VanDerWaalsContact O-CG 3.27Å; M338-L342 WeakPolarHBondContact O-CG 3.35Å; M338-L342 PolarHBondContact O-N 3.17Å; M338-L342 VanDerWaalsContact O-N 3.12Å; V339-L342 PolarHBondContact O-N 3.34Å; L342-F344 PolarHBondContact O-N 3.45Å; L342-E345 PolarHBondContact O-N 3.21Å; L342-E345 VanDerWaalsContact O-N 3.14Å; L342-V346 WeakPolarHBondContact O-CG2 3.31Å; L342-V346 PolarHBondContact O-N 3.05Å |
| 343 | Q | 90.9 | Very high | 88.2 | Confident | 20 Ų | 20 | 29.2 Ų | 29.2 | 9% | 0.093 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -50.5 | -56.8 | -175.2 | -176.2 | -176.6 | -11 | 0 | 0 | 112.4 | Y235 F302 V339 E345 L347 E367 | Y235-Q343 WeakPolarHBondContact OH-CG 3.28Å; Y235-Q343 PolarHBondContact OH-O 2.95Å; F302-Q343 HydrophobicContact CE2-CB 4.21Å; F302-Q343 HydrophobicContact CZ-CB 4.28Å; V339-Q343 WeakPolarHBondContact O-CB 3.49Å; V339-Q343 PolarHBondContact O-N 3.29Å; Q343-E345 PolarHBondContact O-N 2.86Å; Q343-L347 PolarHBondContact O-N 3.46Å; Q343-L347 VanDerWaalsContact O-N 3.1Å; Q343-E367 PolarHBondContact NE2-OE1 3.03Å; Q343-E367 PolarHBondContact NE2-OE2 2.91Å; Q343-E367 VanDerWaalsContact NE2-OE2 3.07Å |
| 344 | F | 84.8 | Confident | 86.9 | Confident | 35 Ų | 35 | 37.5 Ų | 37.5 | 15% | 0.154 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -73.1 | -27 | -178.8 | -60.1 | -59.8 | 0 | 0 | 0 | 113.4 | M1 L342 M348 I360 L364 | M1-F344 HydrophobicContact CE-CD2 4.09Å; M1-F344 HydrophobicContact CE-CE2 3.94Å; M1-F344 HydrophobicContact CG-CD2 4.48Å; M1-F344 HydrophobicContact CG-CE2 4Å; M1-F344 HydrophobicContact CG-CZ 4.11Å; M1-F344 HydrophobicContact SD-CD2 3.99Å; M1-F344 HydrophobicContact SD-CE2 4.04Å; L342-F344 PolarHBondContact O-N 3.45Å; F344-M348 WeakPolarHBondContact O-CB 3.46Å; F344-M348 PolarHBondContact O-N 2.65Å; F344-I360 HydrophobicContact CE1-CG2 4.3Å; F344-L364 HydrophobicContact CE1-CD2 4.35Å; F344-L364 HydrophobicContact CZ-CD2 4.4Å |
| 345 | E | 84.4 | Confident | 85.9 | Confident | 55 Ų | 55 | 39.5 Ų | 39.5 | 26% | 0.257 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -68.6 | -44.5 | 176.4 | -170.4 | -179.4 | 154.6 | 0 | 0 | 111.1 | A289 C298 L342 Q343 M348 A349 | A289-E345 WeakPolarHBondContact CB-OE2 3.36Å; C298-E345 PolarHBondContact SG-OE1 3.32Å; L342-E345 PolarHBondContact O-N 3.21Å; L342-E345 VanDerWaalsContact O-N 3.14Å; Q343-E345 PolarHBondContact O-N 2.86Å; E345-M348 WeakPolarHBondContact O-CB 3.46Å; E345-M348 PolarHBondContact O-N 3.11Å; E345-A349 PolarHBondContact O-N 2.92Å |
| 346 | V | 87.6 | Confident | 84.9 | Confident | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.4 | -42.3 | 175.7 | 169.6 | 0 | 0 | 0 | 0 | 111.1 | Y235 V299 F302 L342 M348 A349 I350 | Y235-V346 HydrophobicContact CD2-CG1 3.98Å; Y235-V346 HydrophobicContact CE2-CB 4.31Å; Y235-V346 HydrophobicContact CE2-CG1 3.79Å; V299-V346 HydrophobicContact CG1-CG1 4.35Å; V299-V346 HydrophobicContact CG2-CG1 4.14Å; V299-V346 HydrophobicContact CG2-CG2 4.45Å; F302-V346 HydrophobicContact CB-CG2 3.66Å; F302-V346 HydrophobicContact CD1-CB 4.26Å; F302-V346 HydrophobicContact CD1-CG1 4.17Å; F302-V346 HydrophobicContact CD1-CG2 4.05Å; F302-V346 HydrophobicContact CG-CG2 3.94Å; L342-V346 WeakPolarHBondContact O-CG2 3.31Å; L342-V346 PolarHBondContact O-N 3.05Å; V346-M348 VanDerWaalsContact C-N 3.29Å; V346-M348 PolarHBondContact O-N 3.34Å; V346-A349 PolarHBondContact O-N 3.3Å; V346-A349 VanDerWaalsContact O-N 3.15Å; V346-I350 HydrophobicContact CG1-CD1 3.79Å; V346-I350 HydrophobicContact CG1-CG1 4.41Å; V346-I350 WeakPolarHBondContact O-CG1 3.37Å; V346-I350 PolarHBondContact O-N 3.49Å |
| 347 | L | 86.1 | Confident | 83.8 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.8 | -43.4 | 174.5 | 178.8 | 58.5 | 0 | 0 | 0 | 111.6 | F232 Y235 Q343 A349 I350 V351 F356 A359 I360 V363 | F232-L347 HydrophobicContact CD2-CD1 4.09Å; F232-L347 HydrophobicContact CE2-CD1 4.14Å; Y235-L347 HydrophobicContact CD1-CD1 3.83Å; Y235-L347 HydrophobicContact CE1-CB 3.98Å; Y235-L347 HydrophobicContact CE1-CD1 3.79Å; Y235-L347 HydrophobicContact CE1-CD2 4.39Å; Y235-L347 HydrophobicContact CE1-CG 4.26Å; Q343-L347 PolarHBondContact O-N 3.46Å; Q343-L347 VanDerWaalsContact O-N 3.1Å; L347-A349 VanDerWaalsContact C-N 3.35Å; L347-I350 PolarHBondContact O-N 2.82Å; L347-V351 HydrophobicContact CD1-CG2 3.89Å; L347-V351 PolarHBondContact O-N 3.29Å; L347-F356 HydrophobicContact CB-CE2 4.33Å; L347-F356 HydrophobicContact CD2-CE2 4.33Å; L347-F356 HydrophobicContact CG-CD2 4.42Å; L347-F356 HydrophobicContact CG-CE2 4.09Å; L347-A359 HydrophobicContact CD1-CB 4.36Å; L347-I360 HydrophobicContact CD2-CB 4.27Å; L347-I360 HydrophobicContact CD2-CG1 3.6Å; L347-V363 HydrophobicContact CD1-CG2 4.21Å; L347-V363 HydrophobicContact CD2-CB 4.45Å; L347-V363 HydrophobicContact CD2-CG2 4.27Å |
| 348 | M | 82.2 | Confident | 83.1 | Confident | 84 Ų | 84 | 43.6 Ų | 43.6 | 41% | 0.414 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -63.1 | -41 | 176.2 | -169.5 | -177.9 | -69 | 0 | 0 | 111.8 | F344 E345 V346 I350 G352 F356 | F344-M348 WeakPolarHBondContact O-CB 3.46Å; F344-M348 PolarHBondContact O-N 2.65Å; E345-M348 WeakPolarHBondContact O-CB 3.46Å; E345-M348 PolarHBondContact O-N 3.11Å; V346-M348 VanDerWaalsContact C-N 3.29Å; V346-M348 PolarHBondContact O-N 3.34Å; M348-I350 VanDerWaalsContact C-N 3.3Å; M348-I350 PolarHBondContact O-N 2.91Å; M348-G352 WeakPolarHBondContact O-CA 2.99Å; M348-G352 PolarHBondContact O-N 2.95Å; M348-F356 HydrophobicContact CB-CD2 3.86Å; M348-F356 HydrophobicContact CB-CE2 3.5Å; M348-F356 VanDerWaalsContact CB-CE2 3.5Å; M348-F356 HydrophobicContact CB-CZ 4.04Å; M348-F356 HydrophobicContact CE-CD1 4.01Å; M348-F356 HydrophobicContact CE-CE1 3.48Å; M348-F356 VanDerWaalsContact CE-CE1 3.48Å; M348-F356 HydrophobicContact CE-CE2 4.14Å; M348-F356 HydrophobicContact CE-CZ 3.55Å; M348-F356 HydrophobicContact CG-CD2 4.12Å; M348-F356 HydrophobicContact CG-CE2 4.13Å; M348-F356 HydrophobicContact CG-CZ 4.48Å |
| 349 | A | 82.4 | Confident | 82.6 | Confident | 72 Ų | 72 | 42.5 Ų | 42.5 | 60% | 0.595 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -66.3 | -29.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | E345 V346 L347 | E345-A349 PolarHBondContact O-N 2.92Å; V346-A349 PolarHBondContact O-N 3.3Å; V346-A349 VanDerWaalsContact O-N 3.15Å; L347-A349 VanDerWaalsContact C-N 3.35Å |
| 350 | I | 82.6 | Confident | 82.1 | Confident | 47 Ų | 47 | 42.8 Ų | 42.8 | 24% | 0.241 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -80.4 | -49 | 179.2 | -67.7 | 169.3 | 0 | 0 | 0 | 111.3 | Y235 V346 L347 M348 | Y235-I350 HydrophobicContact CD2-CD1 3.68Å; Y235-I350 HydrophobicContact CG-CD1 3.93Å; V346-I350 HydrophobicContact CG1-CD1 3.79Å; V346-I350 HydrophobicContact CG1-CG1 4.41Å; V346-I350 WeakPolarHBondContact O-CG1 3.37Å; V346-I350 PolarHBondContact O-N 3.49Å; L347-I350 PolarHBondContact O-N 2.82Å; M348-I350 VanDerWaalsContact C-N 3.3Å; M348-I350 PolarHBondContact O-N 2.91Å |
| 351 | V | 79.9 | Confident | 81.9 | Confident | 24 Ų | 24 | 42.8 Ų | 42.8 | 15% | 0.145 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -89.6 | -24.5 | -169.8 | 174.2 | 0 | 0 | 0 | 0 | 112.7 | V226 F232 L347 K355 A359 | V226-V351 HydrophobicContact CG1-CG1 4.29Å; V226-V351 HydrophobicContact CG1-CG2 4.28Å; F232-V351 HydrophobicContact CB-CG2 4.22Å; F232-V351 HydrophobicContact CD2-CG2 3.61Å; F232-V351 HydrophobicContact CE2-CG2 4.43Å; F232-V351 HydrophobicContact CG-CG2 4.28Å; L347-V351 HydrophobicContact CD1-CG2 3.89Å; L347-V351 PolarHBondContact O-N 3.29Å; V351-K355 HydrophobicContact CG1-CB 3.43Å; V351-K355 VanDerWaalsContact CG1-CB 3.43Å; V351-A359 HydrophobicContact CB-CB 4.25Å; V351-A359 HydrophobicContact CG1-CB 3.76Å; V351-A359 HydrophobicContact CG2-CB 3.87Å |
| 352 | G | 75.3 | Confident | 81.8 | Confident | 32 Ų | 32 | 42 Ų | 42 | 33% | 0.33 | 24% | 0.239 | S | C | . | . | trans | 77.2 | 172.1 | -170.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | M348 F356 | M348-G352 WeakPolarHBondContact O-CA 2.99Å; M348-G352 PolarHBondContact O-N 2.95Å; G352-F356 WeakPolarHBondContact O-CB 3.4Å; G352-F356 PolarHBondContact O-N 3.14Å | ||
| 353 | T | 71.6 | Confident | 81.9 | Confident | 113 Ų | 113 | 42 Ų | 42 | 69% | 0.693 | 24% | 0.239 | S | C | * | . | S | Bend | trans | -69.8 | -41.5 | -171.9 | 46.6 | 0 | 0 | 0 | 0 | 113.2 | K355 F356 | T353-K355 VanDerWaalsContact C-N 3.33Å; T353-K355 PolarHBondContact O-N 3.18Å; T353-F356 WeakPolarHBondContact O-CB 3.45Å; T353-F356 PolarHBondContact O-N 3.21Å |
| 354 | E | 71.4 | Confident | 81.8 | Confident | 173 Ų | 173 | 41.5 Ų | 41.5 | 81% | 0.808 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -61.1 | -37.6 | -173.5 | -63.3 | -176.2 | 171.2 | 0 | 0 | 113.4 | ||
| 355 | K | 75.3 | Confident | 82.2 | Confident | 91 Ų | 91 | 43.1 Ų | 43.1 | 40% | 0.396 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -102.5 | 1.8 | -176.7 | -66.8 | -177 | -175.4 | -174 | 0 | 113.5 | V226 V351 T353 S357 S358 A359 | V226-K355 HydrophobicContact CG2-CB 4.3Å; V226-K355 HydrophobicContact CG2-CD 4.38Å; V351-K355 HydrophobicContact CG1-CB 3.43Å; V351-K355 VanDerWaalsContact CG1-CB 3.43Å; T353-K355 VanDerWaalsContact C-N 3.33Å; T353-K355 PolarHBondContact O-N 3.18Å; K355-S357 PolarHBondContact O-N 3Å; K355-S358 PolarHBondContact O-N 3.12Å; K355-A359 WeakPolarHBondContact O-CB 3.45Å; K355-A359 PolarHBondContact O-N 3.19Å |
| 356 | F | 76.1 | Confident | 82.7 | Confident | 35 Ų | 35 | 41.7 Ų | 41.7 | 15% | 0.154 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.4 | -46.1 | -171.1 | -173.6 | -121 | 0 | 0 | 0 | 112.8 | L347 M348 G352 T353 S358 A359 I360 | L347-F356 HydrophobicContact CB-CE2 4.33Å; L347-F356 HydrophobicContact CD2-CE2 4.33Å; L347-F356 HydrophobicContact CG-CD2 4.42Å; L347-F356 HydrophobicContact CG-CE2 4.09Å; M348-F356 HydrophobicContact CB-CD2 3.86Å; M348-F356 HydrophobicContact CB-CE2 3.5Å; M348-F356 VanDerWaalsContact CB-CE2 3.5Å; M348-F356 HydrophobicContact CB-CZ 4.04Å; M348-F356 HydrophobicContact CE-CD1 4.01Å; M348-F356 HydrophobicContact CE-CE1 3.48Å; M348-F356 VanDerWaalsContact CE-CE1 3.48Å; M348-F356 HydrophobicContact CE-CE2 4.14Å; M348-F356 HydrophobicContact CE-CZ 3.55Å; M348-F356 HydrophobicContact CG-CD2 4.12Å; M348-F356 HydrophobicContact CG-CE2 4.13Å; M348-F356 HydrophobicContact CG-CZ 4.48Å; G352-F356 WeakPolarHBondContact O-CB 3.4Å; G352-F356 PolarHBondContact O-N 3.14Å; T353-F356 WeakPolarHBondContact O-CB 3.45Å; T353-F356 PolarHBondContact O-N 3.21Å; F356-S358 PolarHBondContact O-N 3.49Å; F356-A359 PolarHBondContact O-N 3.43Å; F356-I360 HydrophobicContact CD1-CD1 3.48Å; F356-I360 VanDerWaalsContact CD1-CD1 3.48Å; F356-I360 HydrophobicContact CD1-CG1 4.36Å; F356-I360 HydrophobicContact CD2-CD1 4.04Å; F356-I360 HydrophobicContact CD2-CG1 4.06Å; F356-I360 HydrophobicContact CE1-CD1 3.12Å; F356-I360 HydrophobicContact CE1-CG1 4.12Å; F356-I360 HydrophobicContact CE2-CD1 3.71Å; F356-I360 HydrophobicContact CE2-CG1 3.77Å; F356-I360 HydrophobicContact CG-CD1 3.93Å; F356-I360 HydrophobicContact CG-CG1 4.34Å; F356-I360 HydrophobicContact CZ-CD1 3.25Å; F356-I360 HydrophobicContact CZ-CG1 3.82Å; F356-I360 VanDerWaalsContact O-CG1 3.31Å; F356-I360 WeakPolarHBondContact O-CG1 3.49Å; F356-I360 PolarHBondContact O-N 3.07Å |
| 357 | S | 73.1 | Confident | 83 | Confident | 47 Ų | 47 | 41.8 Ų | 41.8 | 33% | 0.329 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -60.3 | -43.5 | -178.2 | -62.6 | 0 | 0 | 0 | 0 | 112.9 | K355 G361 | K355-S357 PolarHBondContact O-N 3Å; S357-G361 PolarHBondContact O-N 3.42Å |
| 358 | S | 79.8 | Confident | 83.5 | Confident | 20 Ų | 20 | 42.1 Ų | 42.1 | 14% | 0.14 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -67.9 | -44.8 | 175.9 | -176.4 | 0 | 0 | 0 | 0 | 111.4 | D223 K355 F356 I360 G361 L362 | D223-S358 WeakPolarHBondContact CA-OG 3.02Å; D223-S358 PolarHBondContact N-OG 3.35Å; D223-S358 PolarHBondContact O-OG 3.48Å; K355-S358 PolarHBondContact O-N 3.12Å; F356-S358 PolarHBondContact O-N 3.49Å; S358-I360 PolarHBondContact O-N 3.34Å; S358-G361 PolarHBondContact O-N 2.92Å; S358-L362 PolarHBondContact O-N 2.9Å; S358-L362 VanDerWaalsContact O-N 3.1Å |
| 359 | A | 85 | Confident | 84.1 | Confident | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.7 | -44.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | V226 F232 L347 V351 K355 F356 G361 L362 V363 | V226-A359 HydrophobicContact CG1-CB 4.02Å; F232-A359 HydrophobicContact CD2-CB 4.11Å; F232-A359 HydrophobicContact CE2-CB 3.6Å; F232-A359 HydrophobicContact CZ-CB 4.32Å; L347-A359 HydrophobicContact CD1-CB 4.36Å; V351-A359 HydrophobicContact CB-CB 4.25Å; V351-A359 HydrophobicContact CG1-CB 3.76Å; V351-A359 HydrophobicContact CG2-CB 3.87Å; K355-A359 WeakPolarHBondContact O-CB 3.45Å; K355-A359 PolarHBondContact O-N 3.19Å; F356-A359 PolarHBondContact O-N 3.43Å; A359-G361 VanDerWaalsContact C-N 3.32Å; A359-G361 PolarHBondContact O-N 3.15Å; A359-L362 PolarHBondContact O-N 3.25Å; A359-V363 WeakPolarHBondContact O-CB 3.39Å; A359-V363 WeakPolarHBondContact O-CG2 3.23Å; A359-V363 PolarHBondContact O-N 3.23Å |
| 360 | I | 84.6 | Confident | 84.8 | Confident | 8 Ų | 8 | 40.4 Ų | 40.4 | 4% | 0.041 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.2 | -42.9 | 175.3 | -63.5 | 163.2 | 0 | 0 | 0 | 110.8 | M1 F344 L347 F356 S358 L362 V363 L364 | M1-I360 WeakPolarHBondContact O-CG2 3.16Å; F344-I360 HydrophobicContact CE1-CG2 4.3Å; L347-I360 HydrophobicContact CD2-CB 4.27Å; L347-I360 HydrophobicContact CD2-CG1 3.6Å; F356-I360 HydrophobicContact CD1-CD1 3.48Å; F356-I360 VanDerWaalsContact CD1-CD1 3.48Å; F356-I360 HydrophobicContact CD1-CG1 4.36Å; F356-I360 HydrophobicContact CD2-CD1 4.04Å; F356-I360 HydrophobicContact CD2-CG1 4.06Å; F356-I360 HydrophobicContact CE1-CD1 3.12Å; F356-I360 HydrophobicContact CE1-CG1 4.12Å; F356-I360 HydrophobicContact CE2-CD1 3.71Å; F356-I360 HydrophobicContact CE2-CG1 3.77Å; F356-I360 HydrophobicContact CG-CD1 3.93Å; F356-I360 HydrophobicContact CG-CG1 4.34Å; F356-I360 HydrophobicContact CZ-CD1 3.25Å; F356-I360 HydrophobicContact CZ-CG1 3.82Å; F356-I360 VanDerWaalsContact O-CG1 3.31Å; F356-I360 WeakPolarHBondContact O-CG1 3.49Å; F356-I360 PolarHBondContact O-N 3.07Å; S358-I360 PolarHBondContact O-N 3.34Å; I360-L362 VanDerWaalsContact C-N 3.32Å; I360-L362 PolarHBondContact O-N 3.06Å; I360-V363 PolarHBondContact O-N 2.86Å; I360-L364 HydrophobicContact CG2-CD1 3.48Å; I360-L364 VanDerWaalsContact CG2-CD1 3.48Å; I360-L364 HydrophobicContact CG2-CG 3.88Å; I360-L364 WeakPolarHBondContact O-CB 3.35Å; I360-L364 VanDerWaalsContact O-CG 3.25Å; I360-L364 WeakPolarHBondContact O-CG 3.04Å; I360-L364 PolarHBondContact O-N 3.3Å |
| 361 | G | 85.3 | Confident | 85.4 | Confident | 18 Ų | 18 | 38.2 Ų | 38.2 | 19% | 0.186 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -58.4 | -44 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S357 S358 A359 L365 | S357-G361 PolarHBondContact O-N 3.42Å; S358-G361 PolarHBondContact O-N 2.92Å; A359-G361 VanDerWaalsContact C-N 3.32Å; A359-G361 PolarHBondContact O-N 3.15Å; G361-L365 PolarHBondContact O-N 3.27Å; G361-L365 VanDerWaalsContact O-N 3.16Å |
| 362 | L | 89.3 | Confident | 86.2 | Confident | 8 Ų | 8 | 39.8 Ų | 39.8 | 4% | 0.042 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -68.9 | -42.6 | 177.2 | -69.6 | 170.8 | 0 | 0 | 0 | 112.7 | L222 F224 F227 F232 S358 A359 I360 L365 A366 | L222-L362 HydrophobicContact CB-CD2 4.37Å; L222-L362 HydrophobicContact CD1-CD2 4.31Å; L222-L362 HydrophobicContact CD2-CD2 4.11Å; L222-L362 HydrophobicContact CD2-CG 4.22Å; F224-L362 HydrophobicContact CD1-CD2 4.16Å; F224-L362 HydrophobicContact CE1-CD2 3.72Å; F224-L362 HydrophobicContact CZ-CD2 3.99Å; F227-L362 HydrophobicContact CD2-CD1 4.2Å; F227-L362 HydrophobicContact CE2-CD1 3.62Å; F227-L362 HydrophobicContact CE2-CD2 4.01Å; F227-L362 HydrophobicContact CE2-CG 4.28Å; F227-L362 HydrophobicContact CZ-CB 4.45Å; F227-L362 HydrophobicContact CZ-CD1 4.26Å; F227-L362 HydrophobicContact CZ-CD2 4.44Å; F232-L362 HydrophobicContact CZ-CB 4.08Å; F232-L362 HydrophobicContact CZ-CD1 4.41Å; S358-L362 PolarHBondContact O-N 2.9Å; S358-L362 VanDerWaalsContact O-N 3.1Å; A359-L362 PolarHBondContact O-N 3.25Å; I360-L362 VanDerWaalsContact C-N 3.32Å; I360-L362 PolarHBondContact O-N 3.06Å; L362-L365 PolarHBondContact O-N 3.31Å; L362-A366 PolarHBondContact O-N 3.28Å; L362-A366 VanDerWaalsContact O-N 3.09Å |
| 363 | V | 91.4 | Very high | 87.3 | Confident | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.006 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.9 | -48.2 | 176.8 | 165.9 | 0 | 0 | 0 | 0 | 110.7 | F232 Y235 T236 L347 A359 I360 L365 A366 E367 | F232-V363 HydrophobicContact CE2-CG2 3.58Å; F232-V363 HydrophobicContact CZ-CG2 3.97Å; Y235-V363 HydrophobicContact CD1-CG2 4.27Å; Y235-V363 HydrophobicContact CE1-CG1 4.17Å; Y235-V363 HydrophobicContact CE1-CG2 4.19Å; T236-V363 HydrophobicContact CG2-CG2 4.38Å; L347-V363 HydrophobicContact CD1-CG2 4.21Å; L347-V363 HydrophobicContact CD2-CB 4.45Å; L347-V363 HydrophobicContact CD2-CG2 4.27Å; A359-V363 WeakPolarHBondContact O-CB 3.39Å; A359-V363 WeakPolarHBondContact O-CG2 3.23Å; A359-V363 PolarHBondContact O-N 3.23Å; I360-V363 PolarHBondContact O-N 2.86Å; V363-L365 VanDerWaalsContact C-N 3.27Å; V363-L365 PolarHBondContact O-N 3.39Å; V363-A366 WeakPolarHBondContact O-CB 3.43Å; V363-A366 PolarHBondContact O-N 3.49Å; V363-A366 VanDerWaalsContact O-N 3.11Å; V363-E367 HydrophobicContact CG1-CG 4.22Å; V363-E367 WeakPolarHBondContact CG1-OE1 3.42Å; V363-E367 WeakPolarHBondContact O-CG 3.14Å; V363-E367 PolarHBondContact O-N 3.22Å |
| 364 | L | 90.6 | Very high | 88.4 | Confident | 8 Ų | 8 | 36.2 Ų | 36.2 | 4% | 0.042 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.8 | -34 | 179.1 | -69.9 | 172.7 | 0 | 0 | 0 | 112.5 | F344 I360 E367 A368 | F344-L364 HydrophobicContact CE1-CD2 4.35Å; F344-L364 HydrophobicContact CZ-CD2 4.4Å; I360-L364 HydrophobicContact CG2-CD1 3.48Å; I360-L364 VanDerWaalsContact CG2-CD1 3.48Å; I360-L364 HydrophobicContact CG2-CG 3.88Å; I360-L364 WeakPolarHBondContact O-CB 3.35Å; I360-L364 VanDerWaalsContact O-CG 3.25Å; I360-L364 WeakPolarHBondContact O-CG 3.04Å; I360-L364 PolarHBondContact O-N 3.3Å; L364-E367 PolarHBondContact O-N 3.15Å; L364-A368 WeakPolarHBondContact O-CB 3.35Å; L364-A368 PolarHBondContact O-N 3.3Å |
| 365 | L | 92.6 | Very high | 89.6 | Confident | 70 Ų | 70 | 28 Ų | 28 | 37% | 0.366 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -66.5 | -41 | 174.7 | -171.4 | 67.8 | 0 | 0 | 0 | 111.5 | G361 L362 V363 A368 I369 | G361-L365 PolarHBondContact O-N 3.27Å; G361-L365 VanDerWaalsContact O-N 3.16Å; L362-L365 PolarHBondContact O-N 3.31Å; V363-L365 VanDerWaalsContact C-N 3.27Å; V363-L365 PolarHBondContact O-N 3.39Å; L365-A368 WeakPolarHBondContact O-CB 3.39Å; L365-A368 PolarHBondContact O-N 2.91Å; L365-I369 PolarHBondContact O-N 3.3Å |
| 366 | A | 94.1 | Very high | 90.7 | Very high | 24 Ų | 24 | 23.9 Ų | 23.9 | 20% | 0.198 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -66.6 | -40.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | T236 S240 L362 V363 A368 I369 A370 | T236-A366 HydrophobicContact CG2-CB 3.96Å; S240-A366 WeakPolarHBondContact OG-CB 3.33Å; L362-A366 PolarHBondContact O-N 3.28Å; L362-A366 VanDerWaalsContact O-N 3.09Å; V363-A366 WeakPolarHBondContact O-CB 3.43Å; V363-A366 PolarHBondContact O-N 3.49Å; V363-A366 VanDerWaalsContact O-N 3.11Å; A366-A368 VanDerWaalsContact C-N 3.32Å; A366-A368 PolarHBondContact O-N 2.83Å; A366-I369 PolarHBondContact O-N 2.86Å; A366-A370 PolarHBondContact O-N 2.94Å; A366-A370 VanDerWaalsContact O-N 3.1Å |
| 367 | E | 94.5 | Very high | 91.7 | Very high | 2 Ų | 2 | 24.4 Ų | 24.4 | 1% | 0.009 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -64.3 | -35 | 173.8 | -69.8 | 179.1 | -172.1 | 0 | 0 | 112.2 | Y72 V243 Q343 V363 L364 I369 A370 V371 | Y72-E367 HydrophobicContact CD2-CB 4.21Å; V243-E367 HydrophobicContact CB-CG 4.46Å; V243-E367 HydrophobicContact CG1-CB 4.3Å; V243-E367 WeakPolarHBondContact CG1-O 3.3Å; V243-E367 HydrophobicContact CG2-CB 4.19Å; V243-E367 HydrophobicContact CG2-CG 3.8Å; Q343-E367 PolarHBondContact NE2-OE1 3.03Å; Q343-E367 PolarHBondContact NE2-OE2 2.91Å; Q343-E367 VanDerWaalsContact NE2-OE2 3.07Å; V363-E367 HydrophobicContact CG1-CG 4.22Å; V363-E367 WeakPolarHBondContact CG1-OE1 3.42Å; V363-E367 WeakPolarHBondContact O-CG 3.14Å; V363-E367 PolarHBondContact O-N 3.22Å; L364-E367 PolarHBondContact O-N 3.15Å; E367-I369 VanDerWaalsContact C-N 3.32Å; E367-I369 PolarHBondContact O-N 3.23Å; E367-A370 PolarHBondContact O-N 3.36Å; E367-V371 WeakPolarHBondContact O-CG1 3.48Å; E367-V371 PolarHBondContact O-N 3.06Å |
| 368 | A | 95.8 | Very high | 92.8 | Very high | 7 Ų | 7 | 22.2 Ų | 22.2 | 6% | 0.058 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -61.3 | -41.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A69 L364 L365 A366 V371 L372 | A69-A368 WeakPolarHBondContact CB-O 3.44Å; L364-A368 WeakPolarHBondContact O-CB 3.35Å; L364-A368 PolarHBondContact O-N 3.3Å; L365-A368 WeakPolarHBondContact O-CB 3.39Å; L365-A368 PolarHBondContact O-N 2.91Å; A366-A368 VanDerWaalsContact C-N 3.32Å; A366-A368 PolarHBondContact O-N 2.83Å; A368-V371 WeakPolarHBondContact O-CG1 3.49Å; A368-L372 WeakPolarHBondContact O-CB 3.42Å; A368-L372 PolarHBondContact O-N 2.95Å; A368-L372 VanDerWaalsContact O-N 3.09Å |
| 369 | I | 96.1 | Very high | 93.6 | Very high | 112 Ų | 112 | 21.2 Ų | 21.2 | 57% | 0.574 | 13% | 0.128 | S | C | * | . | H | α-helix | trans | -67.5 | -44.7 | 176.4 | -62.8 | 167.8 | 0 | 0 | 0 | 110.2 | L365 A366 E367 L372 V373 | L365-I369 PolarHBondContact O-N 3.3Å; A366-I369 PolarHBondContact O-N 2.86Å; E367-I369 VanDerWaalsContact C-N 3.32Å; E367-I369 PolarHBondContact O-N 3.23Å; I369-L372 PolarHBondContact O-N 3.29Å; I369-V373 WeakPolarHBondContact O-CG2 3.36Å; I369-V373 PolarHBondContact O-N 3.43Å |
| 370 | A | 96.6 | Very high | 94.2 | Very high | 8 Ų | 8 | 30 Ų | 30 | 7% | 0.066 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -58.9 | -50.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | S240 V243 L244 A366 E367 L372 V373 G374 | S240-A370 WeakPolarHBondContact O-CB 3.47Å; V243-A370 HydrophobicContact CB-CB 4.08Å; V243-A370 HydrophobicContact CG1-CB 3.79Å; L244-A370 HydrophobicContact CD2-CB 4.14Å; L244-A370 VanDerWaalsContact CD2-O 3.29Å; L244-A370 WeakPolarHBondContact CD2-O 3.21Å; L244-A370 HydrophobicContact CG-CB 4.02Å; A366-A370 PolarHBondContact O-N 2.94Å; A366-A370 VanDerWaalsContact O-N 3.1Å; E367-A370 PolarHBondContact O-N 3.36Å; A370-L372 VanDerWaalsContact C-N 3.28Å; A370-L372 PolarHBondContact O-N 3.44Å; A370-V373 PolarHBondContact O-N 3.05Å; A370-V373 VanDerWaalsContact O-N 3.08Å; A370-G374 PolarHBondContact O-N 3.02Å |
| 371 | V | 95.4 | Very high | 94.8 | Very high | 2 Ų | 2 | 32.3 Ų | 32.3 | 1% | 0.012 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -70.1 | -25.3 | -178.1 | 74.6 | 0 | 0 | 0 | 0 | 113.5 | S65 L68 A69 Y72 V243 F247 E367 A368 V373 P375 | S65-V371 WeakPolarHBondContact CB-O 3.28Å; L68-V371 HydrophobicContact CB-CG1 4.18Å; L68-V371 HydrophobicContact CB-CG2 4.21Å; L68-V371 HydrophobicContact CD2-CB 4.22Å; L68-V371 HydrophobicContact CD2-CG1 4.15Å; L68-V371 HydrophobicContact CD2-CG2 3.42Å; L68-V371 VanDerWaalsContact CD2-CG2 3.42Å; L68-V371 HydrophobicContact CG-CG1 4.42Å; L68-V371 HydrophobicContact CG-CG2 4.35Å; A69-V371 HydrophobicContact CB-CG1 4.27Å; Y72-V371 HydrophobicContact CD2-CG1 4.41Å; V243-V371 HydrophobicContact CG1-CB 3.75Å; F247-V371 HydrophobicContact CB-CG2 4.03Å; F247-V371 HydrophobicContact CD2-CB 4.36Å; F247-V371 HydrophobicContact CD2-CG2 3.7Å; F247-V371 HydrophobicContact CE2-CG2 4.37Å; F247-V371 HydrophobicContact CG-CG2 3.89Å; E367-V371 WeakPolarHBondContact O-CG1 3.48Å; E367-V371 PolarHBondContact O-N 3.06Å; A368-V371 WeakPolarHBondContact O-CG1 3.49Å; V371-V373 PolarHBondContact O-N 3.27Å; V371-P375 VanDerWaalsContact O-CD 3.24Å; V371-P375 WeakPolarHBondContact O-CD 3.2Å |
| 372 | L | 97.1 | Very high | 95.4 | Very high | 57 Ų | 57 | 31.5 Ų | 31.5 | 30% | 0.298 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -63.4 | -32 | 172.8 | -173.3 | 60.3 | 0 | 0 | 0 | 111.7 | W62 I66 A69 A368 I369 A370 P376 | W62-L372 HydrophobicContact CE3-CD1 4.06Å; W62-L372 HydrophobicContact CZ3-CD1 3.66Å; W62-L372 HydrophobicContact CZ3-CG 3.8Å; W62-L372 WeakPolarHBondContact CZ3-O 3.47Å; I66-L372 HydrophobicContact CB-CD1 4.42Å; I66-L372 HydrophobicContact CG1-CD1 3.8Å; A69-L372 HydrophobicContact CB-CB 3.83Å; A69-L372 HydrophobicContact CB-CD1 3.88Å; A69-L372 HydrophobicContact CB-CG 4.31Å; A368-L372 WeakPolarHBondContact O-CB 3.42Å; A368-L372 PolarHBondContact O-N 2.95Å; A368-L372 VanDerWaalsContact O-N 3.09Å; I369-L372 PolarHBondContact O-N 3.29Å; A370-L372 VanDerWaalsContact C-N 3.28Å; A370-L372 PolarHBondContact O-N 3.44Å; L372-P376 WeakPolarHBondContact O-CG 3.49Å |
| 373 | V | 96.8 | Very high | 95.7 | Very high | 69 Ų | 69 | 33 Ų | 33 | 42% | 0.418 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -97 | -34.7 | -174.7 | 178.3 | 0 | 0 | 0 | 0 | 112.8 | L244 I369 A370 V371 P376 S377 | L244-V373 HydrophobicContact CD2-CB 4.29Å; L244-V373 HydrophobicContact CD2-CG1 4.47Å; I369-V373 WeakPolarHBondContact O-CG2 3.36Å; I369-V373 PolarHBondContact O-N 3.43Å; A370-V373 PolarHBondContact O-N 3.05Å; A370-V373 VanDerWaalsContact O-N 3.08Å; V371-V373 PolarHBondContact O-N 3.27Å; V373-P376 WeakPolarHBondContact O-CD 3.42Å; V373-S377 WeakPolarHBondContact O-CB 3.38Å; V373-S377 PolarHBondContact O-N 3.26Å; V373-S377 PolarHBondContact O-OG 3.48Å |
| 374 | G | 96.4 | Very high | 95.9 | Very high | 1 Ų | 1 | 36.9 Ų | 36.9 | 1% | 0.01 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -53.5 | -71.7 | -172.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | L244 A370 S377 A378 | L244-G374 WeakPolarHBondContact O-CA 3.31Å; A370-G374 PolarHBondContact O-N 3.02Å; G374-S377 PolarHBondContact O-N 3.24Å; G374-S377 PolarHBondContact O-OG 3.03Å; G374-A378 PolarHBondContact O-N 3.26Å |
| 375 | P | 96.8 | Very high | 96.2 | Very high | 1 Ų | 1 | 39 Ų | 39 | 1% | 0.006 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.2 | -40.6 | -177.6 | -21 | 31.1 | 0 | 0 | 0 | 115.2 | A61 S65 V251 F252 V371 A378 G379 | A61-P375 HydrophobicContact CB-CB 4.12Å; S65-P375 WeakPolarHBondContact OG-CB 3.46Å; S65-P375 WeakPolarHBondContact OG-CG 3.44Å; V251-P375 HydrophobicContact CG1-CB 4.29Å; V251-P375 HydrophobicContact CG2-CG 4.42Å; F252-P375 HydrophobicContact CE2-CB 4.3Å; F252-P375 WeakPolarHBondContact CE2-O 3.34Å; F252-P375 WeakPolarHBondContact CZ-O 3.14Å; V371-P375 VanDerWaalsContact O-CD 3.24Å; V371-P375 WeakPolarHBondContact O-CD 3.2Å; P375-A378 PolarHBondContact O-N 3.49Å; P375-G379 PolarHBondContact O-N 3.12Å |
| 376 | P | 97.4 | Very high | 96.2 | Very high | 3 Ų | 3 | 42.3 Ų | 42.3 | 2% | 0.019 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -68.9 | -36.9 | 178.1 | -22.5 | 36.6 | 0 | 0 | 0 | 112.5 | S58 A61 W62 S65 L372 V373 A378 G379 R380 | S58-P376 PolarHBondContact OG-O 2.85Å; S58-P376 VanDerWaalsContact OG-O 3.09Å; A61-P376 HydrophobicContact CB-CG 4.49Å; W62-P376 HydrophobicContact CB-CG 4.43Å; W62-P376 HydrophobicContact CD2-CB 3.8Å; W62-P376 HydrophobicContact CD2-CG 3.58Å; W62-P376 VanDerWaalsContact CE2-CB 3.5Å; W62-P376 HydrophobicContact CE3-CG 3.94Å; W62-P376 HydrophobicContact CG-CB 3.96Å; W62-P376 HydrophobicContact CG-CG 3.82Å; W62-P376 HydrophobicContact CZ2-CB 3.99Å; W62-P376 HydrophobicContact CZ2-CG 4.33Å; W62-P376 HydrophobicContact CZ3-CG 4.46Å; S65-P376 VanDerWaalsContact OG-CD 3.24Å; S65-P376 WeakPolarHBondContact OG-CD 3.42Å; L372-P376 WeakPolarHBondContact O-CG 3.49Å; V373-P376 WeakPolarHBondContact O-CD 3.42Å; P376-A378 VanDerWaalsContact C-N 3.31Å; P376-A378 PolarHBondContact O-N 3.07Å; P376-G379 PolarHBondContact O-N 3.24Å; P376-R380 WeakPolarHBondContact O-CB 3.15Å; P376-R380 PolarHBondContact O-N 2.9Å |
| 377 | S | 96.9 | Very high | 96.2 | Very high | 46 Ų | 46 | 43.1 Ų | 43.1 | 32% | 0.322 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.3 | -40.1 | 174.6 | 72.3 | 0 | 0 | 0 | 0 | 111.7 | V373 G374 R380 L381 | V373-S377 WeakPolarHBondContact O-CB 3.38Å; V373-S377 PolarHBondContact O-N 3.26Å; V373-S377 PolarHBondContact O-OG 3.48Å; G374-S377 PolarHBondContact O-N 3.24Å; G374-S377 PolarHBondContact O-OG 3.03Å; S377-R380 PolarHBondContact O-N 3.4Å; S377-L381 PolarHBondContact O-N 3.44Å; S377-L381 VanDerWaalsContact O-N 3.08Å |
| 378 | A | 97.1 | Very high | 96.1 | Very high | 1 Ų | 1 | 43.2 Ų | 43.2 | 1% | 0.008 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -70 | -38.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | V248 F252 G374 P375 P376 R380 L381 L382 V391 | V248-A378 HydrophobicContact CB-CB 4.4Å; V248-A378 HydrophobicContact CG1-CB 3.53Å; V248-A378 HydrophobicContact CG2-CB 3.92Å; F252-A378 HydrophobicContact CE2-CB 4.18Å; G374-A378 PolarHBondContact O-N 3.26Å; P375-A378 PolarHBondContact O-N 3.49Å; P376-A378 VanDerWaalsContact C-N 3.31Å; P376-A378 PolarHBondContact O-N 3.07Å; A378-R380 VanDerWaalsContact C-N 3.32Å; A378-R380 PolarHBondContact O-N 3.39Å; A378-L381 WeakPolarHBondContact O-CB 3.37Å; A378-L381 PolarHBondContact O-N 2.97Å; A378-L382 PolarHBondContact O-N 3.09Å; A378-V391 HydrophobicContact CB-CG1 4.08Å |
| 379 | G | 96.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.6 | -37.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | P375 P376 L381 L382 D383 | P375-G379 PolarHBondContact O-N 3.12Å; P376-G379 PolarHBondContact O-N 3.24Å; G379-L381 VanDerWaalsContact C-N 3.34Å; G379-L382 WeakPolarHBondContact O-CB 3.21Å; G379-L382 PolarHBondContact O-N 3.14Å; G379-D383 VanDerWaalsContact O-CG 3.28Å; G379-D383 PolarHBondContact O-N 2.81Å |
| 380 | R | 97.3 | Very high | 96 | Very high | 184 Ų | 184 | 45.3 Ų | 45.3 | 69% | 0.694 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -66.3 | -37.9 | 174.2 | -169.6 | -178 | -175.6 | 106 | 0.2 | 111.9 | P376 S377 A378 L382 D383 A384 | P376-R380 WeakPolarHBondContact O-CB 3.15Å; P376-R380 PolarHBondContact O-N 2.9Å; S377-R380 PolarHBondContact O-N 3.4Å; A378-R380 VanDerWaalsContact C-N 3.32Å; A378-R380 PolarHBondContact O-N 3.39Å; R380-L382 VanDerWaalsContact C-N 3.33Å; R380-D383 PolarHBondContact O-N 3.35Å; R380-A384 WeakPolarHBondContact O-CB 3.45Å; R380-A384 PolarHBondContact O-N 3.41Å; R380-A384 VanDerWaalsContact O-N 3.1Å |
| 381 | L | 97.3 | Very high | 96 | Very high | 57 Ų | 57 | 44.9 Ų | 44.9 | 30% | 0.298 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.2 | -42.1 | 172.5 | -178.4 | 63.9 | 0 | 0 | 0 | 110.9 | S377 A378 G379 A384 T385 L394 | S377-L381 PolarHBondContact O-N 3.44Å; S377-L381 VanDerWaalsContact O-N 3.08Å; A378-L381 WeakPolarHBondContact O-CB 3.37Å; A378-L381 PolarHBondContact O-N 2.97Å; G379-L381 VanDerWaalsContact C-N 3.34Å; L381-A384 PolarHBondContact O-N 3.17Å; L381-T385 HydrophobicContact CD1-CG2 3.8Å; L381-T385 HydrophobicContact CG-CG2 4.37Å; L381-T385 WeakPolarHBondContact O-CB 3.4Å; L381-T385 WeakPolarHBondContact O-CG2 3.43Å; L381-T385 PolarHBondContact O-N 2.87Å; L381-T385 PolarHBondContact O-OG1 3.12Å; L381-L394 HydrophobicContact CD2-CB 4.27Å; L381-L394 HydrophobicContact CD2-CD2 4.02Å |
| 382 | L | 96.6 | Very high | 96 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.6 | -44.3 | 174.4 | -174.7 | 56.2 | 0 | 0 | 0 | 111.9 | Y57 F252 A378 G379 R380 A384 T385 K386 Y388 V391 | Y57-L382 HydrophobicContact CD1-CD2 3.85Å; Y57-L382 HydrophobicContact CD2-CD2 3.59Å; Y57-L382 HydrophobicContact CD2-CG 3.75Å; Y57-L382 HydrophobicContact CE1-CD2 4.25Å; Y57-L382 HydrophobicContact CE2-CD2 3.99Å; Y57-L382 HydrophobicContact CE2-CG 4.17Å; Y57-L382 HydrophobicContact CG-CD2 3.51Å; Y57-L382 HydrophobicContact CG-CG 4.12Å; F252-L382 HydrophobicContact CD1-CD2 4.23Å; F252-L382 HydrophobicContact CE1-CD2 4.37Å; A378-L382 PolarHBondContact O-N 3.09Å; G379-L382 WeakPolarHBondContact O-CB 3.21Å; G379-L382 PolarHBondContact O-N 3.14Å; R380-L382 VanDerWaalsContact C-N 3.33Å; L382-A384 PolarHBondContact O-N 3.41Å; L382-T385 PolarHBondContact O-N 3.4Å; L382-K386 VanDerWaalsContact O-CA 3.26Å; L382-K386 WeakPolarHBondContact O-CA 3.31Å; L382-K386 PolarHBondContact O-N 3.04Å; L382-Y388 HydrophobicContact CD1-CD1 4.06Å; L382-Y388 HydrophobicContact CD1-CD2 4.08Å; L382-Y388 HydrophobicContact CD1-CE1 4.22Å; L382-Y388 HydrophobicContact CD1-CE2 4.25Å; L382-Y388 HydrophobicContact CD1-CG 3.98Å; L382-Y388 HydrophobicContact CD2-CD1 3.77Å; L382-Y388 HydrophobicContact CD2-CE1 3.26Å; L382-Y388 HydrophobicContact CD2-CE2 4.33Å; L382-Y388 HydrophobicContact CD2-CG 4.48Å; L382-Y388 HydrophobicContact CG-CE1 4.38Å; L382-V391 HydrophobicContact CB-CG2 3.67Å; L382-V391 HydrophobicContact CD1-CG2 4.11Å; L382-V391 HydrophobicContact CG-CG2 4.31Å |
| 383 | D | 96.4 | Very high | 96 | Very high | 40 Ų | 40 | 45.8 Ų | 45.8 | 21% | 0.214 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.5 | -36 | 178.7 | -74.5 | -36.2 | 0 | 0 | 0 | 112.1 | Y57 S58 G379 R380 K386 | Y57-D383 WeakPolarHBondContact CD2-OD1 3.49Å; Y57-D383 PolarHBondContact N-OD1 3.12Å; Y57-D383 PolarHBondContact N-OD2 3.32Å; Y57-D383 VanDerWaalsContact N-OD2 3.14Å; S58-D383 WeakPolarHBondContact CB-OD2 3.5Å; S58-D383 PolarHBondContact N-OD2 3.41Å; G379-D383 VanDerWaalsContact O-CG 3.28Å; G379-D383 PolarHBondContact O-N 2.81Å; R380-D383 PolarHBondContact O-N 3.35Å; D383-K386 WeakPolarHBondContact O-CD 3.4Å; D383-K386 WeakPolarHBondContact O-CE 3.49Å; D383-K386 PolarHBondContact O-NZ 3.04Å |
| 384 | A | 96.1 | Very high | 96 | Very high | 83 Ų | 83 | 44.9 Ų | 44.9 | 69% | 0.686 | 23% | 0.23 | S | C | * | . | H | α-helix | trans | -80.9 | -40 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | R380 L381 L382 | R380-A384 WeakPolarHBondContact O-CB 3.45Å; R380-A384 PolarHBondContact O-N 3.41Å; R380-A384 VanDerWaalsContact O-N 3.1Å; L381-A384 PolarHBondContact O-N 3.17Å; L382-A384 PolarHBondContact O-N 3.41Å |
| 385 | T | 95.6 | Very high | 96.1 | Very high | 53 Ų | 53 | 44.9 Ų | 44.9 | 33% | 0.325 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -95.6 | -21.5 | -173.3 | 59.9 | 0 | 0 | 0 | 0 | 113.9 | L381 L382 S387 Y390 | L381-T385 HydrophobicContact CD1-CG2 3.8Å; L381-T385 HydrophobicContact CG-CG2 4.37Å; L381-T385 WeakPolarHBondContact O-CB 3.4Å; L381-T385 WeakPolarHBondContact O-CG2 3.43Å; L381-T385 PolarHBondContact O-N 2.87Å; L381-T385 PolarHBondContact O-OG1 3.12Å; L382-T385 PolarHBondContact O-N 3.4Å; T385-S387 PolarHBondContact O-N 3.35Å; T385-Y390 HydrophobicContact CG2-CD2 3.9Å; T385-Y390 HydrophobicContact CG2-CE2 4.41Å; T385-Y390 HydrophobicContact CG2-CG 4.45Å |
| 386 | K | 93.2 | Very high | 96.1 | Very high | 139 Ų | 139 | 44.8 Ų | 44.8 | 60% | 0.604 | 23% | 0.23 | S | C | * | . | trans | 55.1 | 27.7 | -172.9 | -53.4 | -54.8 | -169.7 | -163.7 | 0 | 113.8 | L382 D383 | L382-K386 VanDerWaalsContact O-CA 3.26Å; L382-K386 WeakPolarHBondContact O-CA 3.31Å; L382-K386 PolarHBondContact O-N 3.04Å; D383-K386 WeakPolarHBondContact O-CD 3.4Å; D383-K386 WeakPolarHBondContact O-CE 3.49Å; D383-K386 PolarHBondContact O-NZ 3.04Å | ||
| 387 | S | 93.3 | Very high | 96.1 | Very high | 40 Ų | 40 | 47.1 Ų | 47.1 | 28% | 0.28 | 25% | 0.246 | S | C | . | . | trans | -139.6 | 122.3 | 179.9 | 179.5 | 0 | 0 | 0 | 0 | 111.6 | T385 M389 Y390 | T385-S387 PolarHBondContact O-N 3.35Å; S387-M389 PolarHBondContact O-N 3.37Å; S387-M389 PolarHBondContact OG-N 2.84Å; S387-Y390 PolarHBondContact O-N 3.44Å | ||
| 388 | Y | 93.9 | Very high | 96.1 | Very high | 5 Ų | 5 | 46.8 Ų | 46.8 | 2% | 0.02 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -66.8 | -20.1 | 175.6 | -70.1 | -88.1 | 0 | 0 | 0 | 113.4 | Y57 F252 S255 Y256 E259 L382 Y390 V391 F392 | Y57-Y388 VanDerWaalsContact CE1-OH 3.31Å; Y57-Y388 WeakPolarHBondContact CE1-OH 3.32Å; Y57-Y388 PolarHBondContact OH-OH 3.06Å; F252-Y388 HydrophobicContact CB-CD1 4.33Å; F252-Y388 HydrophobicContact CB-CE1 4.12Å; F252-Y388 HydrophobicContact CD1-CE1 4.3Å; S255-Y388 WeakPolarHBondContact CB-OH 3.46Å; S255-Y388 PolarHBondContact O-OH 2.83Å; Y256-Y388 HydrophobicContact CD1-CG 4.19Å; Y256-Y388 HydrophobicContact CD2-CD1 4.3Å; Y256-Y388 AromaticContact CD2-CD2 3.17Å; Y256-Y388 HydrophobicContact CD2-CD2 3.17Å; Y256-Y388 AromaticContact CD2-CE2 3.74Å; Y256-Y388 HydrophobicContact CD2-CE2 3.74Å; Y256-Y388 AromaticContact CD2-CG 3.5Å; Y256-Y388 HydrophobicContact CD2-CG 3.5Å; Y256-Y388 VanDerWaalsContact CD2-CG 3.5Å; Y256-Y388 AromaticContact CE2-CD2 3.67Å; Y256-Y388 HydrophobicContact CE2-CD2 3.67Å; Y256-Y388 AromaticContact CE2-CG 3.98Å; Y256-Y388 HydrophobicContact CE2-CG 3.98Å; Y256-Y388 HydrophobicContact CG-CD1 4.02Å; Y256-Y388 AromaticContact CG-CD2 3.75Å; Y256-Y388 HydrophobicContact CG-CD2 3.75Å; Y256-Y388 HydrophobicContact CG-CE2 4.26Å; Y256-Y388 AromaticContact CG-CG 3.61Å; Y256-Y388 HydrophobicContact CG-CG 3.61Å; E259-Y388 HydrophobicContact CB-CE2 3.87Å; E259-Y388 VanDerWaalsContact CD-CE2 3.47Å; E259-Y388 HydrophobicContact CG-CE2 4.16Å; E259-Y388 WeakPolarHBondContact OE2-CE2 3.29Å; E259-Y388 PolarHBondContact OE2-OH 3.06Å; L382-Y388 HydrophobicContact CD1-CD1 4.06Å; L382-Y388 HydrophobicContact CD1-CD2 4.08Å; L382-Y388 HydrophobicContact CD1-CE1 4.22Å; L382-Y388 HydrophobicContact CD1-CE2 4.25Å; L382-Y388 HydrophobicContact CD1-CG 3.98Å; L382-Y388 HydrophobicContact CD2-CD1 3.77Å; L382-Y388 HydrophobicContact CD2-CE1 3.26Å; L382-Y388 HydrophobicContact CD2-CE2 4.33Å; L382-Y388 HydrophobicContact CD2-CG 4.48Å; L382-Y388 HydrophobicContact CG-CE1 4.38Å; Y388-Y390 PolarHBondContact O-N 3.36Å; Y388-V391 WeakPolarHBondContact O-CB 3.48Å; Y388-V391 PolarHBondContact O-N 3.24Å; Y388-F392 HydrophobicContact CD1-CE2 4.31Å; Y388-F392 WeakPolarHBondContact O-CD2 3.29Å; Y388-F392 PolarHBondContact O-N 3.15Å |
| 389 | M | 94 | Very high | 96.1 | Very high | 49 Ų | 49 | 46.7 Ų | 46.7 | 24% | 0.241 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -53.2 | -45.9 | 176.3 | -177.8 | -171.9 | 73.4 | 0 | 0 | 110.7 | S317 S387 V391 F392 L393 | S317-M389 WeakPolarHBondContact CB-O 3.25Å; S317-M389 WeakPolarHBondContact O-CG 3.45Å; S387-M389 PolarHBondContact O-N 3.37Å; S387-M389 PolarHBondContact OG-N 2.84Å; M389-V391 VanDerWaalsContact C-N 3.34Å; M389-V391 PolarHBondContact O-N 3.48Å; M389-F392 PolarHBondContact O-N 3.18Å; M389-L393 WeakPolarHBondContact O-CB 3.39Å; M389-L393 PolarHBondContact O-N 3.04Å |
| 390 | Y | 95.6 | Very high | 96.1 | Very high | 113 Ų | 113 | 48.4 Ų | 48.4 | 44% | 0.443 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -68.9 | -32.1 | 179.7 | -62.3 | -64.5 | 0 | 0 | 0 | 113.2 | T385 S387 Y388 L394 | T385-Y390 HydrophobicContact CG2-CD2 3.9Å; T385-Y390 HydrophobicContact CG2-CE2 4.41Å; T385-Y390 HydrophobicContact CG2-CG 4.45Å; S387-Y390 PolarHBondContact O-N 3.44Å; Y388-Y390 PolarHBondContact O-N 3.36Å; Y390-L394 WeakPolarHBondContact O-CB 3.43Å; Y390-L394 PolarHBondContact O-N 3.42Å |
| 391 | V | 96.4 | Very high | 96 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.9 | -49.7 | 176.9 | 173.8 | 0 | 0 | 0 | 0 | 110.5 | V248 F252 A378 L382 Y388 M389 L394 A395 | V248-V391 HydrophobicContact CG1-CG1 3.5Å; F252-V391 HydrophobicContact CD2-CG1 4.11Å; F252-V391 HydrophobicContact CG-CG1 4.5Å; A378-V391 HydrophobicContact CB-CG1 4.08Å; L382-V391 HydrophobicContact CB-CG2 3.67Å; L382-V391 HydrophobicContact CD1-CG2 4.11Å; L382-V391 HydrophobicContact CG-CG2 4.31Å; Y388-V391 WeakPolarHBondContact O-CB 3.48Å; Y388-V391 PolarHBondContact O-N 3.24Å; M389-V391 VanDerWaalsContact C-N 3.34Å; M389-V391 PolarHBondContact O-N 3.48Å; V391-L394 PolarHBondContact O-N 3.27Å; V391-A395 PolarHBondContact O-N 3.31Å |
| 392 | F | 95.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -73.8 | -32.4 | -178.5 | -78.3 | -120.5 | 0 | 0 | 0 | 111.4 | P249 F252 V253 Y256 F328 Y388 M389 G396 | P249-F392 HydrophobicContact CB-CD1 4.26Å; P249-F392 HydrophobicContact CB-CE1 3.8Å; P249-F392 HydrophobicContact CB-CZ 4.15Å; F252-F392 HydrophobicContact CB-CE2 4.37Å; V253-F392 HydrophobicContact CB-CZ 4.46Å; Y256-F392 HydrophobicContact CD1-CE2 4.15Å; Y256-F392 HydrophobicContact CD1-CZ 4.12Å; F328-F392 HydrophobicContact CD1-CE1 4.35Å; F328-F392 HydrophobicContact CE1-CD1 4.47Å; F328-F392 AromaticContact CE1-CE1 3.7Å; F328-F392 HydrophobicContact CE1-CE1 3.7Å; F328-F392 HydrophobicContact CE2-CD1 4.4Å; F328-F392 HydrophobicContact CE2-CE1 4.4Å; F328-F392 HydrophobicContact CZ-CD1 4.11Å; F328-F392 AromaticContact CZ-CE1 3.73Å; F328-F392 HydrophobicContact CZ-CE1 3.73Å; Y388-F392 HydrophobicContact CD1-CE2 4.31Å; Y388-F392 WeakPolarHBondContact O-CD2 3.29Å; Y388-F392 PolarHBondContact O-N 3.15Å; M389-F392 PolarHBondContact O-N 3.18Å; F392-G396 PolarHBondContact O-N 2.88Å |
| 393 | L | 96.8 | Very high | 95.8 | Very high | 77 Ų | 77 | 41.4 Ų | 41.4 | 40% | 0.403 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -65.7 | -42.1 | 173.4 | -172 | 140.7 | 0 | 0 | 0 | 111.9 | L314 M389 S397 | L314-L393 HydrophobicContact CD2-CG 4.12Å; M389-L393 WeakPolarHBondContact O-CB 3.39Å; M389-L393 PolarHBondContact O-N 3.04Å; L393-S397 VanDerWaalsContact O-CB 3.29Å; L393-S397 WeakPolarHBondContact O-CB 3.43Å; L393-S397 PolarHBondContact O-N 3.15Å; L393-S397 PolarHBondContact O-OG 3.38Å |
| 394 | L | 96.8 | Very high | 95.6 | Very high | 50 Ų | 50 | 42.9 Ų | 42.9 | 26% | 0.262 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -60.3 | -54.4 | 173.4 | 178.6 | 66.9 | 0 | 0 | 0 | 110.5 | L381 Y390 V391 G396 S397 E398 | L381-L394 HydrophobicContact CD2-CB 4.27Å; L381-L394 HydrophobicContact CD2-CD2 4.02Å; Y390-L394 WeakPolarHBondContact O-CB 3.43Å; Y390-L394 PolarHBondContact O-N 3.42Å; V391-L394 PolarHBondContact O-N 3.27Å; L394-G396 PolarHBondContact O-N 3.23Å; L394-S397 PolarHBondContact O-N 3.39Å; L394-S397 VanDerWaalsContact O-N 3.12Å; L394-S397 PolarHBondContact O-OG 3.08Å; L394-E398 HydrophobicContact CD1-CG 4.46Å; L394-E398 WeakPolarHBondContact O-CG 3.36Å; L394-E398 PolarHBondContact O-N 3.01Å |
| 395 | A | 97.1 | Very high | 95.4 | Very high | 1 Ų | 1 | 41 Ų | 41 | 1% | 0.008 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -55.4 | -48.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | V248 P249 V391 S397 E398 V399 | V248-A395 HydrophobicContact CB-CB 3.97Å; V248-A395 HydrophobicContact CG1-CB 4.17Å; P249-A395 HydrophobicContact CG-CB 4.16Å; V391-A395 PolarHBondContact O-N 3.31Å; A395-S397 VanDerWaalsContact C-N 3.34Å; A395-S397 PolarHBondContact O-N 3.43Å; A395-E398 PolarHBondContact O-N 3.49Å; A395-V399 WeakPolarHBondContact O-CG2 3.46Å; A395-V399 PolarHBondContact O-N 3.09Å; A395-V399 VanDerWaalsContact O-N 3.09Å |
| 396 | G | 97.1 | Very high | 95 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63 | -39 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | D313 F392 L394 V399 L400 | D313-G396 VanDerWaalsContact CB-CA 3.43Å; F392-G396 PolarHBondContact O-N 2.88Å; L394-G396 PolarHBondContact O-N 3.23Å; G396-V399 PolarHBondContact O-N 2.99Å; G396-L400 VanDerWaalsContact O-CB 3.28Å; G396-L400 WeakPolarHBondContact O-CB 3.41Å; G396-L400 VanDerWaalsContact O-CG 3.24Å; G396-L400 WeakPolarHBondContact O-CG 3.36Å; G396-L400 PolarHBondContact O-N 3.01Å |
| 397 | S | 97.1 | Very high | 94.8 | Very high | 52 Ų | 52 | 33.5 Ų | 33.5 | 36% | 0.364 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -65.1 | -38.8 | 177.6 | 74.7 | 0 | 0 | 0 | 0 | 112.9 | L393 L394 A395 L401 | L393-S397 VanDerWaalsContact O-CB 3.29Å; L393-S397 WeakPolarHBondContact O-CB 3.43Å; L393-S397 PolarHBondContact O-N 3.15Å; L393-S397 PolarHBondContact O-OG 3.38Å; L394-S397 PolarHBondContact O-N 3.39Å; L394-S397 VanDerWaalsContact O-N 3.12Å; L394-S397 PolarHBondContact O-OG 3.08Å; A395-S397 VanDerWaalsContact C-N 3.34Å; A395-S397 PolarHBondContact O-N 3.43Å; S397-L401 VanDerWaalsContact O-CB 3.25Å; S397-L401 WeakPolarHBondContact O-CB 3.44Å; S397-L401 PolarHBondContact O-N 3.47Å |
| 398 | E | 96.9 | Very high | 94.3 | Very high | 38 Ų | 38 | 34.9 Ų | 34.9 | 18% | 0.178 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -67.1 | -47.2 | 177.2 | -69.3 | 175.4 | 165.7 | 0 | 0 | 111.1 | I241 L244 G245 L394 A395 L401 S402 | I241-E398 HydrophobicContact CG2-CB 4.37Å; I241-E398 VanDerWaalsContact CG2-O 3.29Å; I241-E398 WeakPolarHBondContact CG2-O 2.96Å; L244-E398 VanDerWaalsContact C-OE2 3.23Å; L244-E398 VanDerWaalsContact CB-OE2 3.3Å; L244-E398 WeakPolarHBondContact CB-OE2 3.24Å; G245-E398 VanDerWaalsContact CA-OE2 3.28Å; G245-E398 WeakPolarHBondContact CA-OE2 3.17Å; G245-E398 PolarHBondContact N-OE2 3.41Å; L394-E398 HydrophobicContact CD1-CG 4.46Å; L394-E398 WeakPolarHBondContact O-CG 3.36Å; L394-E398 PolarHBondContact O-N 3.01Å; A395-E398 PolarHBondContact O-N 3.49Å; E398-L401 PolarHBondContact O-N 3.46Å; E398-S402 PolarHBondContact O-N 2.95Å |
| 399 | V | 97.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.7 | -41.5 | 178.6 | 179.7 | 0 | 0 | 0 | 0 | 111.3 | L246 M306 N309 A395 G396 S402 G403 | L246-V399 HydrophobicContact CB-CG2 4.31Å; M306-V399 HydrophobicContact CB-CG1 4.31Å; M306-V399 WeakPolarHBondContact O-CG1 3.39Å; N309-V399 HydrophobicContact CB-CG1 4.15Å; A395-V399 WeakPolarHBondContact O-CG2 3.46Å; A395-V399 PolarHBondContact O-N 3.09Å; A395-V399 VanDerWaalsContact O-N 3.09Å; G396-V399 PolarHBondContact O-N 2.99Å; V399-S402 WeakPolarHBondContact O-CB 3.38Å; V399-S402 PolarHBondContact O-N 3.31Å; V399-G403 PolarHBondContact O-N 3.48Å |
| 400 | L | 96.8 | Very high | 92.5 | Very high | 35 Ų | 35 | 34.8 Ų | 34.8 | 18% | 0.183 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.7 | -45.7 | 173.9 | -78.8 | 179 | 0 | 0 | 0 | 111.9 | L307 L314 G396 S402 G403 V404 | L307-L400 HydrophobicContact CB-CD2 4.47Å; L307-L400 HydrophobicContact CD2-CD2 3.87Å; L307-L400 VanDerWaalsContact O-CD2 3.3Å; L307-L400 WeakPolarHBondContact O-CD2 3.48Å; L314-L400 HydrophobicContact CD1-CD1 3.34Å; L314-L400 HydrophobicContact CG-CD1 3.96Å; G396-L400 VanDerWaalsContact O-CB 3.28Å; G396-L400 WeakPolarHBondContact O-CB 3.41Å; G396-L400 VanDerWaalsContact O-CG 3.24Å; G396-L400 WeakPolarHBondContact O-CG 3.36Å; G396-L400 PolarHBondContact O-N 3.01Å; L400-S402 VanDerWaalsContact C-N 3.3Å; L400-S402 PolarHBondContact O-N 2.83Å; L400-G403 PolarHBondContact O-N 3.27Å; L400-G403 VanDerWaalsContact O-N 3.16Å; L400-V404 WeakPolarHBondContact O-CG2 3.37Å; L400-V404 PolarHBondContact O-N 3.39Å |
| 401 | L | 96.1 | Very high | 91.4 | Very high | 94 Ų | 94 | 34.9 Ų | 34.9 | 49% | 0.492 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -58 | -45 | 177.7 | 177.5 | 61.6 | 0 | 0 | 0 | 110.8 | I241 S397 E398 G403 V404 V405 | I241-L401 HydrophobicContact CG2-CD2 4.43Å; S397-L401 VanDerWaalsContact O-CB 3.25Å; S397-L401 WeakPolarHBondContact O-CB 3.44Å; S397-L401 PolarHBondContact O-N 3.47Å; E398-L401 PolarHBondContact O-N 3.46Å; L401-G403 PolarHBondContact O-N 3.41Å; L401-V404 PolarHBondContact O-N 2.86Å; L401-V405 HydrophobicContact CD1-CG2 4.26Å; L401-V405 HydrophobicContact CG-CG2 4.49Å; L401-V405 WeakPolarHBondContact O-CB 3.48Å; L401-V405 VanDerWaalsContact O-CG2 3.26Å; L401-V405 WeakPolarHBondContact O-CG2 3.16Å; L401-V405 PolarHBondContact O-N 3.2Å |
| 402 | S | 95.2 | Very high | 90 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59 | -45.9 | 174.7 | -179.4 | 0 | 0 | 0 | 0 | 112.6 | A238 E398 V399 L400 V404 V405 L406 | A238-S402 VanDerWaalsContact C-OG 3.24Å; A238-S402 WeakPolarHBondContact O-CB 3.46Å; A238-S402 PolarHBondContact O-OG 2.99Å; E398-S402 PolarHBondContact O-N 2.95Å; V399-S402 WeakPolarHBondContact O-CB 3.38Å; V399-S402 PolarHBondContact O-N 3.31Å; L400-S402 VanDerWaalsContact C-N 3.3Å; L400-S402 PolarHBondContact O-N 2.83Å; S402-V404 VanDerWaalsContact C-N 3.35Å; S402-V404 PolarHBondContact O-N 2.85Å; S402-V405 PolarHBondContact O-N 3.31Å; S402-L406 PolarHBondContact O-N 3.39Å |
| 403 | G | 94.1 | Very high | 88.5 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -57 | -45.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113 | V399 L400 L401 A407 | V399-G403 PolarHBondContact O-N 3.48Å; L400-G403 PolarHBondContact O-N 3.27Å; L400-G403 VanDerWaalsContact O-N 3.16Å; L401-G403 PolarHBondContact O-N 3.41Å; G403-A407 VanDerWaalsContact O-CB 3.29Å; G403-A407 WeakPolarHBondContact O-CB 3.38Å; G403-A407 PolarHBondContact O-N 3.25Å |
| 404 | V | 92.9 | Very high | 86.5 | Confident | 72 Ų | 72 | 44.2 Ų | 44.2 | 44% | 0.436 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -66.5 | -43.4 | 177.5 | 173 | 0 | 0 | 0 | 0 | 111.6 | L307 L400 L401 S402 L406 A407 T408 | L307-V404 HydrophobicContact CD2-CG2 3.92Å; L400-V404 WeakPolarHBondContact O-CG2 3.37Å; L400-V404 PolarHBondContact O-N 3.39Å; L401-V404 PolarHBondContact O-N 2.86Å; S402-V404 VanDerWaalsContact C-N 3.35Å; S402-V404 PolarHBondContact O-N 2.85Å; V404-L406 PolarHBondContact O-N 3.32Å; V404-A407 PolarHBondContact O-N 2.69Å; V404-T408 VanDerWaalsContact O-CB 3.25Å; V404-T408 WeakPolarHBondContact O-CB 3.21Å; V404-T408 PolarHBondContact O-N 2.89Å; V404-T408 PolarHBondContact O-OG1 2.96Å |
| 405 | V | 90.9 | Very high | 84 | Confident | 42 Ų | 42 | 49.6 Ų | 49.6 | 26% | 0.255 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -58.4 | -50 | 177.2 | 167.8 | 0 | 0 | 0 | 0 | 109.9 | I234 A238 L401 S402 T408 C409 | I234-V405 HydrophobicContact CG2-CG1 4.31Å; A238-V405 HydrophobicContact CB-CG1 4.22Å; L401-V405 HydrophobicContact CD1-CG2 4.26Å; L401-V405 HydrophobicContact CG-CG2 4.49Å; L401-V405 WeakPolarHBondContact O-CB 3.48Å; L401-V405 VanDerWaalsContact O-CG2 3.26Å; L401-V405 WeakPolarHBondContact O-CG2 3.16Å; L401-V405 PolarHBondContact O-N 3.2Å; S402-V405 PolarHBondContact O-N 3.31Å; V405-T408 PolarHBondContact O-N 2.93Å; V405-C409 WeakPolarHBondContact O-CB 3.34Å; V405-C409 PolarHBondContact O-N 3Å; V405-C409 PolarHBondContact O-SG 3.34Å |
| 406 | L | 88.5 | Confident | 81.5 | Confident | 7 Ų | 7 | 58 Ų | 58 | 4% | 0.037 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -65.1 | -42.7 | 178.9 | -86.4 | 166.7 | 0 | 0 | 0 | 112.6 | Y235 A238 F302 M306 S402 V404 T408 N410 | Y235-L406 HydrophobicContact CD2-CD2 4.23Å; A238-L406 HydrophobicContact CB-CD1 3.64Å; A238-L406 HydrophobicContact CB-CD2 4.3Å; A238-L406 HydrophobicContact CB-CG 3.55Å; F302-L406 HydrophobicContact CD1-CD1 4.07Å; F302-L406 HydrophobicContact CE1-CD1 3.73Å; M306-L406 HydrophobicContact CE-CB 3.94Å; M306-L406 HydrophobicContact CE-CD1 3.27Å; M306-L406 HydrophobicContact CE-CG 4.21Å; M306-L406 HydrophobicContact SD-CD1 3.92Å; S402-L406 PolarHBondContact O-N 3.39Å; V404-L406 PolarHBondContact O-N 3.32Å; L406-T408 PolarHBondContact O-N 3.29Å; L406-N410 VanDerWaalsContact O-CB 3.23Å; L406-N410 WeakPolarHBondContact O-CB 3.39Å; L406-N410 PolarHBondContact O-N 3.1Å |
| 407 | A | 87.4 | Confident | 78.8 | Confident | 29 Ų | 29 | 66.4 Ų | 66.4 | 24% | 0.24 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.9 | -45.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S303 G403 V404 N410 F411 | S303-A407 PolarHBondContact OG-N 3.09Å; G403-A407 VanDerWaalsContact O-CB 3.29Å; G403-A407 WeakPolarHBondContact O-CB 3.38Å; G403-A407 PolarHBondContact O-N 3.25Å; V404-A407 PolarHBondContact O-N 2.69Å; A407-N410 PolarHBondContact O-N 3.48Å; A407-F411 PolarHBondContact O-N 3.38Å |
| 408 | T | 83.6 | Confident | 75.9 | Confident | 69 Ų | 69 | 69.5 Ų | 69.5 | 42% | 0.423 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -68.6 | -46.1 | -177.6 | -55.3 | 0 | 0 | 0 | 0 | 111.1 | V404 V405 L406 N410 F411 L412 | V404-T408 VanDerWaalsContact O-CB 3.25Å; V404-T408 WeakPolarHBondContact O-CB 3.21Å; V404-T408 PolarHBondContact O-N 2.89Å; V404-T408 PolarHBondContact O-OG1 2.96Å; V405-T408 PolarHBondContact O-N 2.93Å; L406-T408 PolarHBondContact O-N 3.29Å; T408-N410 VanDerWaalsContact C-N 3.31Å; T408-N410 PolarHBondContact O-N 2.96Å; T408-F411 PolarHBondContact O-N 2.93Å; T408-L412 HydrophobicContact CG2-CD1 3.93Å; T408-L412 HydrophobicContact CG2-CG 4.45Å; T408-L412 VanDerWaalsContact O-CG 3.27Å; T408-L412 WeakPolarHBondContact O-CG 3.48Å; T408-L412 PolarHBondContact O-N 3.45Å |
| 409 | C | 77 | Confident | 73.1 | Confident | 27 Ų | 27 | 78.8 Ų | 78.8 | 18% | 0.182 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 176.4 | -70.8 | 0 | 0 | 0 | 0 | 111 | I234 V405 F411 L412 F413 | I234-C409 HydrophobicContact CD1-CB 4.11Å; I234-C409 HydrophobicContact CG2-CB 3.67Å; I234-C409 WeakPolarHBondContact CG2-SG 3.37Å; V405-C409 WeakPolarHBondContact O-CB 3.34Å; V405-C409 PolarHBondContact O-N 3Å; V405-C409 PolarHBondContact O-SG 3.34Å; C409-F411 VanDerWaalsContact C-N 3.34Å; C409-F411 PolarHBondContact O-N 2.6Å; C409-L412 PolarHBondContact O-N 2.82Å; C409-F413 HydrophobicContact CB-CD2 4.15Å; C409-F413 HydrophobicContact CB-CE2 4.27Å; C409-F413 WeakPolarHBondContact O-CB 3.46Å; C409-F413 WeakPolarHBondContact O-CD2 3.4Å; C409-F413 PolarHBondContact O-N 3.33Å |
| 410 | N | 73.4 | Confident | 70.1 | Confident | 25 Ų | 25 | 87.5 Ų | 87.5 | 13% | 0.134 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -62.7 | -41.7 | 178.9 | -157.9 | 29.6 | 0 | 0 | 0 | 112 | V299 L406 A407 T408 L412 I414 | V299-N410 WeakPolarHBondContact CB-ND2 3.19Å; V299-N410 HydrophobicContact CG1-CB 4.18Å; V299-N410 VanDerWaalsContact CG1-ND2 3.3Å; V299-N410 WeakPolarHBondContact CG1-ND2 3.42Å; L406-N410 VanDerWaalsContact O-CB 3.23Å; L406-N410 WeakPolarHBondContact O-CB 3.39Å; L406-N410 PolarHBondContact O-N 3.1Å; A407-N410 PolarHBondContact O-N 3.48Å; T408-N410 VanDerWaalsContact C-N 3.31Å; T408-N410 PolarHBondContact O-N 2.96Å; N410-L412 PolarHBondContact O-N 3.04Å; N410-I414 WeakPolarHBondContact ND2-CD1 3.28Å; N410-I414 WeakPolarHBondContact O-CB 3.07Å; N410-I414 VanDerWaalsContact O-CG1 3.28Å; N410-I414 WeakPolarHBondContact O-CG1 3.31Å; N410-I414 PolarHBondContact O-N 3.12Å; N410-I414 WeakPolarHBondContact OD1-CD1 3.46Å; N410-I414 VanDerWaalsContact OD1-CG1 3.26Å; N410-I414 WeakPolarHBondContact OD1-CG1 3.16Å |
| 411 | F | 71.4 | Confident | 67.2 | Low | 115 Ų | 115 | 91 Ų | 91 | 50% | 0.504 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -62.4 | -40.2 | 175.5 | -171.9 | -99 | 0 | 0 | 0 | 113 | A407 T408 C409 | A407-F411 PolarHBondContact O-N 3.38Å; T408-F411 PolarHBondContact O-N 2.93Å; C409-F411 VanDerWaalsContact C-N 3.34Å; C409-F411 PolarHBondContact O-N 2.6Å |
| 412 | L | 67.4 | Low | 64.5 | Low | 101 Ų | 101 | 91.2 Ų | 91.2 | 53% | 0.529 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -75.7 | -33.2 | -178.7 | -66.8 | 174.2 | 0 | 0 | 0 | 113.2 | T408 C409 N410 | T408-L412 HydrophobicContact CG2-CD1 3.93Å; T408-L412 HydrophobicContact CG2-CG 4.45Å; T408-L412 VanDerWaalsContact O-CG 3.27Å; T408-L412 WeakPolarHBondContact O-CG 3.48Å; T408-L412 PolarHBondContact O-N 3.45Å; C409-L412 PolarHBondContact O-N 2.82Å; N410-L412 PolarHBondContact O-N 3.04Å |
| 413 | F | 64.3 | Low | 61.7 | Low | 90 Ų | 90 | 95 Ų | 95 | 40% | 0.395 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -93.8 | -30.5 | -177.5 | -67.8 | -67.1 | 0 | 0 | 0 | 113.9 | I234 C409 K415 K416 | I234-F413 HydrophobicContact CD1-CD2 4.14Å; I234-F413 HydrophobicContact CD1-CE2 3.43Å; I234-F413 VanDerWaalsContact CD1-CE2 3.43Å; I234-F413 HydrophobicContact CD1-CZ 4.12Å; C409-F413 HydrophobicContact CB-CD2 4.15Å; C409-F413 HydrophobicContact CB-CE2 4.27Å; C409-F413 WeakPolarHBondContact O-CB 3.46Å; C409-F413 WeakPolarHBondContact O-CD2 3.4Å; C409-F413 PolarHBondContact O-N 3.33Å; F413-K415 VanDerWaalsContact C-N 3.29Å; F413-K415 PolarHBondContact O-N 3.42Å; F413-K416 PolarHBondContact O-N 3.12Å |
| 414 | I | 54.4 | Low | 59.3 | Low | 81 Ų | 81 | 104.2 Ų | 104.2 | 42% | 0.415 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.1 | -33.2 | 174.8 | -76.4 | 177.4 | 0 | 0 | 0 | 111.9 | Y300 N410 K416 | Y300-I414 HydrophobicContact CE2-CD1 3.64Å; Y300-I414 WeakPolarHBondContact OH-CD1 3.42Å; N410-I414 WeakPolarHBondContact ND2-CD1 3.28Å; N410-I414 WeakPolarHBondContact O-CB 3.07Å; N410-I414 VanDerWaalsContact O-CG1 3.28Å; N410-I414 WeakPolarHBondContact O-CG1 3.31Å; N410-I414 PolarHBondContact O-N 3.12Å; N410-I414 WeakPolarHBondContact OD1-CD1 3.46Å; N410-I414 VanDerWaalsContact OD1-CG1 3.26Å; N410-I414 WeakPolarHBondContact OD1-CG1 3.16Å; I414-K416 PolarHBondContact O-N 2.83Å; I414-K416 VanDerWaalsContact O-N 3.14Å |
| 415 | K | 45.3 | Very low | 56.8 | Low | 163 Ų | 163 | 107.2 Ų | 107.2 | 71% | 0.709 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -13.3 | 174.4 | -84.5 | -174.5 | 174.4 | -179.3 | 0 | 113.8 | F413 | F413-K415 VanDerWaalsContact C-N 3.29Å; F413-K415 PolarHBondContact O-N 3.42Å |
| 416 | K | 44.3 | Very low | 54 | Low | 177 Ų | 177 | 108.6 Ų | 108.6 | 77% | 0.77 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.5 | -11.5 | -175 | -78.9 | -176.9 | 171.2 | 179.6 | 0 | 115.3 | F413 I414 | F413-K416 PolarHBondContact O-N 3.12Å; I414-K416 PolarHBondContact O-N 2.83Å; I414-K416 VanDerWaalsContact O-N 3.14Å |
| 417 | K | 40.2 | Very low | 51.5 | Low | 177 Ų | 177 | 113.4 Ų | 113.4 | 77% | 0.77 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -100.3 | 116.5 | 177.9 | -129.1 | 178.5 | -177.6 | -176.8 | 0 | 109.7 | R419 | K417-R419 PolarHBondContact O-N 3Š|
| 418 | P | 36.7 | Very low | 49.1 | Very low | 118 Ų | 118 | 116.7 Ų | 116.7 | 77% | 0.766 | 59% | 0.59 | S | S | * | * | trans | -58.1 | 133.7 | 168.9 | -15.7 | 28.4 | 0 | 0 | 0 | 108.5 | E420 | P418-E420 PolarHBondContact O-N 3.47Š| ||
| 419 | R | 37.4 | Very low | 47 | Very low | 233 Ų | 233 | 116.9 Ų | 116.9 | 88% | 0.879 | 59% | 0.591 | S | S | * | * | trans | -62.4 | 110 | 171.8 | -76.8 | 177.6 | 173 | 160.4 | -0.6 | 107.9 | K417 P421 | K417-R419 PolarHBondContact O-N 3Å; R419-P421 WeakPolarHBondContact O-CD 3.33Å | ||
| 420 | E | 34.5 | Very low | 45 | Very low | 183 Ų | 183 | 119 Ų | 119 | 86% | 0.855 | 60% | 0.604 | S | S | * | * | trans | -64.5 | 124.2 | 160.8 | -82.8 | 176.3 | 162.3 | 0 | 0 | 107.8 | P418 | P418-E420 PolarHBondContact O-N 3.47Š| ||
| 421 | P | 35.8 | Very low | 43.3 | Very low | 107 Ų | 107 | 123 Ų | 123 | 70% | 0.695 | 62% | 0.624 | S | S | * | * | trans | -63.4 | 140.6 | 177 | 23.9 | -29.9 | 0 | 0 | 0 | 109.8 | R419 V423 | R419-P421 WeakPolarHBondContact O-CD 3.33Å; P421-V423 PolarHBondContact O-N 3.05Å | ||
| 422 | A | 39.7 | Very low | 41.9 | Very low | 100 Ų | 100 | 119.7 Ų | 119.7 | 83% | 0.826 | 62% | 0.619 | S | S | * | * | trans | -63.4 | 92.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 423 | V | 37 | Very low | 40.4 | Very low | 78 Ų | 78 | 119.6 Ų | 119.6 | 47% | 0.473 | 62% | 0.618 | S | S | . | * | trans | -82.9 | -15.8 | 174.5 | 175.7 | 0 | 0 | 0 | 0 | 111.9 | P421 L425 S426 | P421-V423 PolarHBondContact O-N 3.05Å; V423-L425 PolarHBondContact O-N 2.62Å; V423-S426 PolarHBondContact O-N 3.01Å | ||
| 424 | Y | 43.5 | Very low | 39.2 | Very low | 195 Ų | 195 | 119.8 Ų | 119.8 | 77% | 0.765 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | 20.4 | -170.9 | -63.7 | -72.6 | 0 | 0 | 0 | 116.9 | T428 | Y424-T428 PolarHBondContact O-OG1 3.16Š|
| 425 | L | 39.9 | Very low | 38.7 | Very low | 134 Ų | 134 | 122.4 Ų | 122.4 | 70% | 0.702 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.9 | -4.8 | 170.2 | -119.7 | 135.1 | 0 | 0 | 0 | 113.4 | V423 V429 | V423-L425 PolarHBondContact O-N 2.62Å; L425-V429 WeakPolarHBondContact O-CG2 3.27Å |
| 426 | S | 31.9 | Very low | 38.3 | Very low | 72 Ų | 72 | 118.8 Ų | 118.8 | 50% | 0.503 | 63% | 0.626 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84 | -41.5 | 169.9 | 111.4 | 0 | 0 | 0 | 0 | 110.3 | V423 T428 V429 T430 | V423-S426 PolarHBondContact O-N 3.01Å; S426-T428 PolarHBondContact O-N 2.95Å; S426-V429 PolarHBondContact O-N 2.87Å; S426-T430 WeakPolarHBondContact O-CB 3.41Å; S426-T430 WeakPolarHBondContact O-CG2 3.46Å; S426-T430 PolarHBondContact O-N 3.46Å; S426-T430 PolarHBondContact O-OG1 3.23Å |
| 427 | E | 36.8 | Very low | 38 | Very low | 107 Ų | 107 | 115.6 Ų | 115.6 | 50% | 0.5 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -67.5 | -34.1 | -178.8 | -80.3 | 179.9 | 156.9 | 0 | 0 | 113.5 | V429 T430 L431 | E427-V429 VanDerWaalsContact C-N 3.32Å; E427-V429 PolarHBondContact O-N 3.49Å; E427-T430 WeakPolarHBondContact CA-OG1 3.41Å; E427-T430 PolarHBondContact O-OG1 3.37Å; E427-L431 WeakPolarHBondContact O-CB 3.48Å; E427-L431 VanDerWaalsContact O-CD1 3.31Å; E427-L431 WeakPolarHBondContact O-CD1 3.14Å; E427-L431 WeakPolarHBondContact O-CG 3.44Å; E427-L431 PolarHBondContact O-N 3.42Å |
| 428 | T | 35.6 | Very low | 37.9 | Very low | 98 Ų | 98 | 113.7 Ų | 113.7 | 60% | 0.601 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -76.7 | -20.6 | 178.8 | -13.2 | 0 | 0 | 0 | 0 | 113.1 | Y424 S426 A432 | Y424-T428 PolarHBondContact O-OG1 3.16Å; S426-T428 PolarHBondContact O-N 2.95Å; T428-A432 VanDerWaalsContact O-CB 3.31Å; T428-A432 WeakPolarHBondContact O-CB 3.46Å; T428-A432 PolarHBondContact O-N 3.33Å |
| 429 | V | 39.4 | Very low | 38.1 | Very low | 73 Ų | 73 | 114.8 Ų | 114.8 | 44% | 0.442 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -90.7 | -40.4 | 175.4 | 179.5 | 0 | 0 | 0 | 0 | 110.2 | L425 S426 E427 A432 D433 | L425-V429 WeakPolarHBondContact O-CG2 3.27Å; S426-V429 PolarHBondContact O-N 2.87Å; E427-V429 VanDerWaalsContact C-N 3.32Å; E427-V429 PolarHBondContact O-N 3.49Å; V429-A432 PolarHBondContact O-N 3.01Å; V429-D433 WeakPolarHBondContact O-CB 3.37Å; V429-D433 PolarHBondContact O-N 3.17Å |
| 430 | T | 36.2 | Very low | 38 | Very low | 73 Ų | 73 | 107.3 Ų | 107.3 | 45% | 0.448 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -68.3 | -35.2 | 175.3 | 53.5 | 0 | 0 | 0 | 0 | 112.5 | S426 E427 D433 D434 | S426-T430 WeakPolarHBondContact O-CB 3.41Å; S426-T430 WeakPolarHBondContact O-CG2 3.46Å; S426-T430 PolarHBondContact O-N 3.46Å; S426-T430 PolarHBondContact O-OG1 3.23Å; E427-T430 WeakPolarHBondContact CA-OG1 3.41Å; E427-T430 PolarHBondContact O-OG1 3.37Å; T430-D433 PolarHBondContact O-N 2.73Å; T430-D434 WeakPolarHBondContact O-CB 3.37Å; T430-D434 PolarHBondContact O-N 3.41Å |
| 431 | L | 38 | Very low | 38 | Very low | 107 Ų | 107 | 102.6 Ų | 102.6 | 56% | 0.56 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -72 | -32.6 | 174 | -68.2 | 169.1 | 0 | 0 | 0 | 112.1 | E427 E435 | E427-L431 WeakPolarHBondContact O-CB 3.48Å; E427-L431 VanDerWaalsContact O-CD1 3.31Å; E427-L431 WeakPolarHBondContact O-CD1 3.14Å; E427-L431 WeakPolarHBondContact O-CG 3.44Å; E427-L431 PolarHBondContact O-N 3.42Å; L431-E435 WeakPolarHBondContact O-CB 3.49Å; L431-E435 WeakPolarHBondContact O-CG 3.42Å; L431-E435 PolarHBondContact O-N 3.09Å |
| 432 | A | 40.6 | Very low | 38 | Very low | 47 Ų | 47 | 106 Ų | 106 | 39% | 0.388 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -70.3 | -36.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | T428 V429 T436 | T428-A432 VanDerWaalsContact O-CB 3.31Å; T428-A432 WeakPolarHBondContact O-CB 3.46Å; T428-A432 PolarHBondContact O-N 3.33Å; V429-A432 PolarHBondContact O-N 3.01Å; A432-T436 WeakPolarHBondContact O-CB 3.47Å; A432-T436 PolarHBondContact O-N 3.38Å; A432-T436 VanDerWaalsContact O-N 3.16Å; A432-T436 PolarHBondContact O-OG1 3.04Å |
| 433 | D | 37.5 | Very low | 37.8 | Very low | 98 Ų | 98 | 103.9 Ų | 103.9 | 52% | 0.524 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -74.9 | -34.4 | 176.6 | -72.9 | -22.3 | 0 | 0 | 0 | 112.4 | V429 T430 N437 | V429-D433 WeakPolarHBondContact O-CB 3.37Å; V429-D433 PolarHBondContact O-N 3.17Å; T430-D433 PolarHBondContact O-N 2.73Å; D433-N437 WeakPolarHBondContact O-CB 3.47Å; D433-N437 PolarHBondContact O-N 3.16Å |
| 434 | D | 39.1 | Very low | 37.7 | Very low | 95 Ų | 95 | 106.7 Ų | 106.7 | 51% | 0.508 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -72.7 | -37.8 | 174.5 | -100.5 | -17.7 | 0 | 0 | 0 | 112.7 | T430 T436 N437 Q438 | T430-D434 WeakPolarHBondContact O-CB 3.37Å; T430-D434 PolarHBondContact O-N 3.41Å; D434-T436 VanDerWaalsContact C-N 3.33Å; D434-N437 PolarHBondContact O-N 3.4Å; D434-Q438 WeakPolarHBondContact O-CB 3.37Å; D434-Q438 WeakPolarHBondContact O-CG 3.22Å; D434-Q438 PolarHBondContact O-N 3.2Å |
| 435 | E | 42.6 | Very low | 37.3 | Very low | 135 Ų | 135 | 99.2 Ų | 99.2 | 63% | 0.631 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68.4 | -33 | 174.7 | -76.9 | -171.5 | 164.5 | 0 | 0 | 112 | L431 H439 | L431-E435 WeakPolarHBondContact O-CB 3.49Å; L431-E435 WeakPolarHBondContact O-CG 3.42Å; L431-E435 PolarHBondContact O-N 3.09Å; E435-H439 WeakPolarHBondContact O-CB 3.46Å; E435-H439 PolarHBondContact O-N 3.49Å; E435-H439 VanDerWaalsContact O-N 3.09Å |
| 436 | T | 38.5 | Very low | 37.1 | Very low | 87 Ų | 87 | 98.9 Ų | 98.9 | 53% | 0.534 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -73.8 | -36.6 | 176.7 | -46.9 | 0 | 0 | 0 | 0 | 111.7 | A432 D434 T440 | A432-T436 WeakPolarHBondContact O-CB 3.47Å; A432-T436 PolarHBondContact O-N 3.38Å; A432-T436 VanDerWaalsContact O-N 3.16Å; A432-T436 PolarHBondContact O-OG1 3.04Å; D434-T436 VanDerWaalsContact C-N 3.33Å; T436-T440 PolarHBondContact O-N 3.32Å; T436-T440 PolarHBondContact O-OG1 3.13Å |
| 437 | N | 37.1 | Very low | 37.3 | Very low | 111 Ų | 111 | 102.5 Ų | 102.5 | 59% | 0.594 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -72.9 | -33.6 | 174.4 | -85.9 | -25.9 | 0 | 0 | 0 | 113.4 | D433 D434 S441 | D433-N437 WeakPolarHBondContact O-CB 3.47Å; D433-N437 PolarHBondContact O-N 3.16Å; D434-N437 PolarHBondContact O-N 3.4Å; N437-S441 WeakPolarHBondContact O-CB 3.48Å; N437-S441 PolarHBondContact O-N 3.5Å; N437-S441 VanDerWaalsContact O-N 3.17Å |
| 438 | Q | 38.9 | Very low | 37.2 | Very low | 136 Ų | 136 | 103.9 Ų | 103.9 | 64% | 0.636 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -71.6 | -34.3 | 174.1 | -76.3 | -175.3 | 8.9 | 0 | 0 | 112.7 | D434 R442 | D434-Q438 WeakPolarHBondContact O-CB 3.37Å; D434-Q438 WeakPolarHBondContact O-CG 3.22Å; D434-Q438 PolarHBondContact O-N 3.2Å; Q438-R442 VanDerWaalsContact O-CB 3.32Å; Q438-R442 WeakPolarHBondContact O-CB 3.32Å; Q438-R442 PolarHBondContact O-N 3.22Å; Q438-R442 VanDerWaalsContact O-N 3.1Å |
| 439 | H | 39.3 | Very low | 37.2 | Very low | 141 Ų | 141 | 103.6 Ų | 103.6 | 65% | 0.653 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -71.8 | -31.7 | 175.5 | -99.8 | -68.7 | 0 | 0 | 0 | 113.5 | E435 A443 | E435-H439 WeakPolarHBondContact O-CB 3.46Å; E435-H439 PolarHBondContact O-N 3.49Å; E435-H439 VanDerWaalsContact O-N 3.09Å; H439-A443 WeakPolarHBondContact O-CB 3.39Å; H439-A443 PolarHBondContact O-N 2.96Å; H439-A443 VanDerWaalsContact O-N 3.13Å |
| 440 | T | 35.6 | Very low | 37 | Very low | 76 Ų | 76 | 107 Ų | 107 | 47% | 0.466 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -73.7 | -39.4 | 177.2 | -43.1 | 0 | 0 | 0 | 0 | 111.5 | T436 R442 E444 | T436-T440 PolarHBondContact O-N 3.32Å; T436-T440 PolarHBondContact O-OG1 3.13Å; T440-R442 PolarHBondContact O-N 3.26Å; T440-E444 PolarHBondContact O-N 3.5Å |
| 441 | S | 34.8 | Very low | 36.9 | Very low | 85 Ų | 85 | 111.4 Ų | 111.4 | 59% | 0.594 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66 | -36.1 | 173.5 | 167.6 | 0 | 0 | 0 | 0 | 113.4 | N437 G445 | N437-S441 WeakPolarHBondContact O-CB 3.48Å; N437-S441 PolarHBondContact O-N 3.5Å; N437-S441 VanDerWaalsContact O-N 3.17Å; S441-G445 PolarHBondContact O-N 3.1Å |
| 442 | R | 35.4 | Very low | 36.7 | Very low | 179 Ų | 179 | 113.7 Ų | 113.7 | 68% | 0.675 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -78.6 | -27.4 | -179 | -148.4 | 173.1 | -171.1 | 177.7 | 2.1 | 113.1 | Q438 T440 Q446 | Q438-R442 VanDerWaalsContact O-CB 3.32Å; Q438-R442 WeakPolarHBondContact O-CB 3.32Å; Q438-R442 PolarHBondContact O-N 3.22Å; Q438-R442 VanDerWaalsContact O-N 3.1Å; T440-R442 PolarHBondContact O-N 3.26Å; R442-Q446 WeakPolarHBondContact O-CG 3.45Å; R442-Q446 PolarHBondContact O-N 2.83Å |
| 443 | A | 36.8 | Very low | 36.4 | Very low | 55 Ų | 55 | 119 Ų | 119 | 46% | 0.455 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -71.6 | -36.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | H439 Q447 | H439-A443 WeakPolarHBondContact O-CB 3.39Å; H439-A443 PolarHBondContact O-N 2.96Å; H439-A443 VanDerWaalsContact O-N 3.13Å; A443-Q447 PolarHBondContact O-N 3.48Å |
| 444 | E | 35.3 | Very low | 36.4 | Very low | 137 Ų | 137 | 119.5 Ų | 119.5 | 64% | 0.64 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -74.1 | -32.6 | 176.2 | -68.8 | -176 | 163.6 | 0 | 0 | 112.6 | T440 | T440-E444 PolarHBondContact O-N 3.5Å |
| 445 | G | 35 | Very low | 36.4 | Very low | 37 Ų | 37 | 120.5 Ų | 120.5 | 38% | 0.381 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -71 | -30.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | S441 T449 | S441-G445 PolarHBondContact O-N 3.1Å; G445-T449 PolarHBondContact O-N 3.38Å; G445-T449 PolarHBondContact O-OG1 3.24Å |
| 446 | Q | 35.6 | Very low | 36 | Very low | 127 Ų | 127 | 119.7 Ų | 119.7 | 59% | 0.593 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -79.7 | -33.1 | -180 | -77.8 | -179.8 | -29.6 | 0 | 0 | 112.9 | R442 M448 T449 E450 | R442-Q446 WeakPolarHBondContact O-CG 3.45Å; R442-Q446 PolarHBondContact O-N 2.83Å; Q446-M448 VanDerWaalsContact C-N 3.3Å; Q446-M448 PolarHBondContact O-N 3.41Å; Q446-T449 PolarHBondContact O-N 3.2Å; Q446-E450 PolarHBondContact O-N 3.24Å |
| 447 | Q | 34.9 | Very low | 35.8 | Very low | 149 Ų | 149 | 123.6 Ų | 123.6 | 70% | 0.696 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -67.6 | -27.1 | 171.3 | -83.9 | -172.3 | -10.3 | 0 | 0 | 113.5 | A443 T449 | A443-Q447 PolarHBondContact O-N 3.48Å; Q447-T449 VanDerWaalsContact C-N 3.34Å |
| 448 | M | 35.2 | Very low | 35.7 | Very low | 136 Ų | 136 | 125.7 Ų | 125.7 | 67% | 0.67 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -77.8 | -20 | 175.4 | -129 | -168 | -78.9 | 0 | 0 | 113.3 | Q446 | Q446-M448 VanDerWaalsContact C-N 3.3Å; Q446-M448 PolarHBondContact O-N 3.41Å |
| 449 | T | 35.4 | Very low | 35.4 | Very low | 91 Ų | 91 | 126.8 Ų | 126.8 | 56% | 0.558 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -91.7 | -32.3 | -178 | -44.6 | 0 | 0 | 0 | 0 | 112 | G445 Q446 Q447 K452 K453 | G445-T449 PolarHBondContact O-N 3.38Å; G445-T449 PolarHBondContact O-OG1 3.24Å; Q446-T449 PolarHBondContact O-N 3.2Å; Q447-T449 VanDerWaalsContact C-N 3.34Å; T449-K452 PolarHBondContact O-N 3.32Å; T449-K453 PolarHBondContact O-N 3.28Å |
| 450 | E | 35.8 | Very low | 35.1 | Very low | 145 Ų | 145 | 127.4 Ų | 127.4 | 68% | 0.678 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -72.1 | -37.2 | 172.9 | -103.5 | 177.5 | 165.3 | 0 | 0 | 112.9 | Q446 K452 K453 V454 | Q446-E450 PolarHBondContact O-N 3.24Å; E450-K452 VanDerWaalsContact C-N 3.27Å; E450-K452 PolarHBondContact O-N 3.27Å; E450-K453 PolarHBondContact O-N 3.34Å; E450-V454 PolarHBondContact O-N 3.44Å |
| 451 | K | 33.4 | Very low | 35 | Very low | 165 Ų | 165 | 130.9 Ų | 130.9 | 72% | 0.717 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -65.3 | -26.9 | 172.6 | -102.1 | -180 | 176.4 | 176.8 | 0 | 113.5 | I455 | K451-I455 WeakPolarHBondContact O-CD1 3.33Å; K451-I455 WeakPolarHBondContact O-CG1 3.37Å |
| 452 | K | 34.2 | Very low | 34.7 | Very low | 156 Ų | 156 | 134.2 Ų | 134.2 | 68% | 0.678 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -81.1 | -24.6 | 175.6 | -86.7 | -178.6 | 176.3 | 175.7 | 0 | 113.8 | T449 E450 | T449-K452 PolarHBondContact O-N 3.32Å; E450-K452 VanDerWaalsContact C-N 3.27Å; E450-K452 PolarHBondContact O-N 3.27Å |
| 453 | K | 33.6 | Very low | 34.3 | Very low | 158 Ų | 158 | 133.7 Ų | 133.7 | 69% | 0.687 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -77 | -37.8 | 176 | -102.4 | -179.5 | 173.1 | -176.2 | 0 | 112.8 | T449 E450 I455 N456 E457 | T449-K453 PolarHBondContact O-N 3.28Å; E450-K453 PolarHBondContact O-N 3.34Å; K453-I455 VanDerWaalsContact C-N 3.3Å; K453-I455 PolarHBondContact O-N 3.4Å; K453-N456 PolarHBondContact O-N 3.24Å; K453-E457 PolarHBondContact O-N 3.41Å |
| 454 | V | 37.4 | Very low | 33.9 | Very low | 108 Ų | 108 | 138.7 Ų | 138.7 | 66% | 0.655 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -70.3 | -26.1 | 177.1 | -179.1 | 0 | 0 | 0 | 0 | 112.5 | E450 | E450-V454 PolarHBondContact O-N 3.44Å |
| 455 | I | 39.7 | Very low | 33.6 | Very low | 116 Ų | 116 | 138.9 Ų | 138.9 | 60% | 0.595 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -78.6 | -22.1 | 175.4 | -66 | 171.6 | 0 | 0 | 0 | 112.3 | K451 K453 | K451-I455 WeakPolarHBondContact O-CD1 3.33Å; K451-I455 WeakPolarHBondContact O-CG1 3.37Å; K453-I455 VanDerWaalsContact C-N 3.3Å; K453-I455 PolarHBondContact O-N 3.4Å |
| 456 | N | 34.9 | Very low | 33.1 | Very low | 118 Ų | 118 | 148.1 Ų | 148.1 | 63% | 0.631 | 73% | 0.733 | S | S | * | * | H | α-helix | trans | -93.9 | -14.6 | -174.6 | -139.5 | 29.4 | 0 | 0 | 0 | 114.1 | K453 | K453-N456 PolarHBondContact O-N 3.24Å |
| 457 | E | 34.4 | Very low | 33.4 | Very low | 169 Ų | 169 | 147 Ų | 147 | 79% | 0.79 | 74% | 0.737 | S | S | * | * | H | α-helix | trans | -84.9 | -17.4 | 174.8 | -83.6 | -178.2 | 160.1 | 0 | 0 | 114 | K453 K459 | K453-E457 PolarHBondContact O-N 3.41Å; E457-K459 VanDerWaalsContact C-N 3.29Å; E457-K459 PolarHBondContact O-N 3.41Å |
| 458 | N | 34.1 | Very low | 32.9 | Very low | 155 Ų | 155 | 149.7 Ų | 149.7 | 83% | 0.829 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | 13.6 | 172.9 | -93.9 | 0.9 | 0 | 0 | 0 | 114.1 | ||
| 459 | K | 32.9 | Very low | 32.4 | Very low | 160 Ų | 160 | 148.1 Ų | 148.1 | 70% | 0.696 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.7 | 7.7 | -175.2 | -104.4 | -175.7 | 178.2 | -178.5 | 0 | 116 | E457 | E457-K459 VanDerWaalsContact C-N 3.29Å; E457-K459 PolarHBondContact O-N 3.41Å |
| 460 | N | 32.5 | Very low | 32 | Very low | 153 Ų | 153 | 150.6 Ų | 150.6 | 82% | 0.818 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -118.4 | 13.2 | -174.2 | -103 | 10.6 | 0 | 0 | 0 | 116.7 | ||
| 461 | N | 34.1 | Very low | 31.5 | Very low | 149 Ų | 149 | 147.5 Ų | 147.5 | 80% | 0.797 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -123.1 | 137.4 | 162.6 | -94.9 | -6.1 | 0 | 0 | 0 | 109.9 | ||
| 462 | D | 28.8 | Very low | 31.3 | Very low | 155 Ų | 155 | 145.9 Ų | 145.9 | 83% | 0.829 | 77% | 0.766 | S | S | * | * | trans | 88.5 | 81.2 | 176.4 | -55.4 | -18.2 | 0 | 0 | 0 | 116.6 | ||||
| 463 | N | 26.1 | Very low | 30.9 | Very low | 169 Ų | 169 | 145.5 Ų | 145.5 | 90% | 0.904 | 77% | 0.772 | S | S | * | * | trans | -132.7 | 101.4 | 142.8 | -91.3 | -34.1 | 0 | 0 | 0 | 107.9 | ||||
| 464 | D | 28 | Very low | 30.9 | Very low | 159 Ų | 159 | 142.9 Ų | 142.9 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | trans | -146 | 143.1 | 141.8 | -139.4 | -12.4 | 0 | 0 | 0 | 111.6 | ||||
| 465 | V | 29.2 | Very low | 30.8 | Very low | 141 Ų | 141 | 146.3 Ų | 146.3 | 86% | 0.855 | 78% | 0.782 | S | S | * | * | trans | 86.1 | 125.1 | 174.3 | -160.9 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 466 | R | 24.6 | Very low | 30.4 | Very low | 231 Ų | 231 | 149.6 Ų | 149.6 | 87% | 0.872 | 80% | 0.795 | S | S | * | * | trans | -96.2 | -173 | -169 | -145.7 | -161 | -82.5 | -158.2 | -6.3 | 111.3 | ||||
| 467 | P | 42.8 | Very low | 30.4 | Very low | 103 Ų | 103 | 151.1 Ų | 151.1 | 67% | 0.669 | 81% | 0.809 | S | S | * | * | -110.4 | 174.6 | -109.8 | 40.2 | -23.7 | 0 | 0 | 0 | 114.4 | |||||
| 468 | K | 23.7 | Very low | 30.3 | Very low | 206 Ų | 206 | 152.1 Ų | 152.1 | 90% | 0.896 | 81% | 0.813 | S | S | * | * | trans | -172.3 | 138.8 | 138.7 | -103.5 | 161.5 | -171 | -176.5 | 0 | 114 | ||||
| 469 | S | 25.6 | Very low | 30.3 | Very low | 103 Ų | 103 | 155.2 Ų | 155.2 | 72% | 0.72 | 81% | 0.813 | S | S | * | * | trans | -20.5 | 149.6 | 165.9 | 55.2 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 470 | V | 26.3 | Very low | 30.2 | Very low | 143 Ų | 143 | 157.1 Ų | 157.1 | 87% | 0.867 | 82% | 0.822 | S | S | * | * | 179.9 | 154.5 | 110.3 | 155.8 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 471 | A | 25.9 | Very low | 30.3 | Very low | 81 Ų | 81 | 158.3 Ų | 158.3 | 67% | 0.669 | 83% | 0.827 | S | S | * | * | trans | -74.5 | 156.4 | -167.8 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 472 | V | 29 | Very low | 30.1 | Very low | 130 Ų | 130 | 160.3 Ų | 160.3 | 79% | 0.788 | 83% | 0.829 | S | S | * | * | trans | 33.7 | 124.5 | 139.2 | -173.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 473 | D | 26.1 | Very low | 30.2 | Very low | 149 Ų | 149 | 161.6 Ų | 161.6 | 80% | 0.797 | 83% | 0.83 | S | S | * | * | -155.2 | 141.6 | 122.9 | -143.5 | -11.7 | 0 | 0 | 0 | 113.9 | |||||
| 474 | S | 33.9 | Very low | 31.2 | Very low | 103 Ų | 103 | 158.9 Ų | 158.9 | 72% | 0.72 | 82% | 0.822 | S | S | * | * | trans | -107.2 | 90 | -178.5 | -62.7 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 475 | Q | 33.9 | Very low | 31.3 | Very low | 180 Ų | 180 | 160.8 Ų | 160.8 | 84% | 0.841 | 83% | 0.825 | S | S | * | * | trans | -169.5 | 79.7 | 168.4 | -115.6 | 176.2 | 17.2 | 0 | 0 | 111.9 | ||||
| 476 | E | 32.2 | Very low | 31.2 | Very low | 185 Ų | 185 | 157.9 Ų | 157.9 | 86% | 0.864 | 82% | 0.816 | S | S | * | * | trans | -160.6 | 19.7 | 157.6 | -120.7 | 172.2 | -175.7 | 0 | 0 | 114.4 | E478 | E476-E478 VanDerWaalsContact C-N 3.27Å; E476-E478 PolarHBondContact O-N 3.47Å | ||
| 477 | V | 34.3 | Very low | 31.3 | Very low | 150 Ų | 150 | 155.1 Ų | 155.1 | 91% | 0.909 | 82% | 0.819 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | 2.7 | -179.6 | 179.5 | 0 | 0 | 0 | 0 | 112.7 | ||
| 478 | E | 33.3 | Very low | 30.6 | Very low | 190 Ų | 190 | 153.2 Ų | 153.2 | 89% | 0.888 | 82% | 0.818 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.2 | 27.3 | -169.1 | -118.9 | -177 | -177.4 | 0 | 0 | 116.2 | E476 | E476-E478 VanDerWaalsContact C-N 3.27Å; E476-E478 PolarHBondContact O-N 3.47Å |
| 479 | R | 32.7 | Very low | 30.8 | Very low | 220 Ų | 220 | 150.8 Ų | 150.8 | 83% | 0.83 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -133.7 | 132.1 | 164 | -76.6 | -175.1 | -175.2 | 173.1 | 3.1 | 109.8 | ||
| 480 | F | 31 | Very low | 30.9 | Very low | 200 Ų | 200 | 154.5 Ų | 154.5 | 88% | 0.877 | 82% | 0.823 | S | S | * | * | trans | 111.5 | 16.9 | 173.9 | -64 | -74.1 | 0 | 0 | 0 | 118.6 | ||||
| 481 | L | 34.4 | Very low | 31.1 | Very low | 178 Ų | 178 | 152.9 Ų | 152.9 | 93% | 0.932 | 82% | 0.824 | S | S | * | * | trans | -100.3 | 89 | 151 | -76 | 171.7 | 0 | 0 | 0 | 110.5 | ||||
| 482 | K | 30.6 | Very low | 31.3 | Very low | 190 Ų | 190 | 153.1 Ų | 153.1 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | trans | 174.7 | 121.3 | 164.7 | -98.4 | 174.3 | -176.2 | -173.6 | 0 | 104.3 | ||||
| 483 | E | 30.6 | Very low | 31.4 | Very low | 183 Ų | 183 | 152.7 Ų | 152.7 | 86% | 0.855 | 83% | 0.827 | S | S | * | * | cis | -164.6 | 175.7 | 24.5 | -110.2 | -180 | 169.7 | 0 | 0 | 108.3 | ||||
| 484 | P | 48.1 | Very low | 32.3 | Very low | 112 Ų | 112 | 150.3 Ų | 150.3 | 73% | 0.727 | 82% | 0.82 | S | S | * | * | trans | -102.7 | 159.1 | -169.6 | 38.8 | -31.2 | 0 | 0 | 0 | 114.9 | ||||
| 485 | Q | 28.9 | Very low | 32.4 | Very low | 199 Ų | 199 | 153.5 Ų | 153.5 | 93% | 0.93 | 82% | 0.823 | S | S | * | * | trans | 155.8 | 160 | 156.4 | -93.9 | 176.3 | -14.7 | 0 | 0 | 108.8 | ||||
| 486 | A | 26.9 | Very low | 32.4 | Very low | 79 Ų | 79 | 151.5 Ų | 151.5 | 65% | 0.653 | 82% | 0.824 | S | S | * | * | cis | -178.8 | 151.6 | -21 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 487 | N | 27.9 | Very low | 32.7 | Very low | 174 Ų | 174 | 148.5 Ų | 148.5 | 93% | 0.93 | 82% | 0.822 | S | S | * | * | trans | 56.1 | 143.6 | 156.2 | -75.7 | -3.3 | 0 | 0 | 0 | 123 | ||||
| 488 | G | 27.4 | Very low | 33 | Very low | 63 Ų | 63 | 153.1 Ų | 153.1 | 65% | 0.649 | 84% | 0.84 | S | S | * | * | trans | 151.7 | 103.3 | 143.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 489 | D | 28.6 | Very low | 33 | Very low | 154 Ų | 154 | 151.3 Ų | 151.3 | 82% | 0.824 | 84% | 0.838 | S | S | * | * | trans | 71.2 | 109.8 | 145.6 | -52.5 | -22.9 | 0 | 0 | 0 | 119.1 | ||||
| 490 | M | 28.1 | Very low | 33 | Very low | 182 Ų | 182 | 147.6 Ų | 147.6 | 90% | 0.897 | 84% | 0.838 | S | S | * | * | 64.8 | 95.6 | 56 | -145 | -158.5 | -55 | 0 | 0 | 113.6 | |||||
| 491 | A | 30 | Very low | 33.1 | Very low | 108 Ų | 108 | 144.7 Ų | 144.7 | 89% | 0.893 | 84% | 0.836 | S | S | * | * | trans | -153.6 | 121.7 | 147.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 492 | A | 30.1 | Very low | 33 | Very low | 86 Ų | 86 | 142.8 Ų | 142.8 | 71% | 0.711 | 83% | 0.83 | S | S | * | * | trans | -108 | 147.3 | -178.1 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 493 | C | 30.1 | Very low | 33.1 | Very low | 121 Ų | 121 | 139.8 Ų | 139.8 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | 70.9 | 167.1 | 142.3 | -76.3 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 494 | P | 46.4 | Very low | 33.3 | Very low | 100 Ų | 100 | 136.9 Ų | 136.9 | 65% | 0.649 | 83% | 0.829 | S | S | * | * | cis | -144.4 | -175.1 | -35.8 | 38.5 | -20 | 0 | 0 | 0 | 115.1 | ||||
| 495 | E | 34.9 | Very low | 32.3 | Very low | 169 Ų | 169 | 138.7 Ų | 138.7 | 79% | 0.79 | 84% | 0.836 | S | S | * | * | trans | 64.7 | 129.6 | 148.9 | -77.7 | 170.1 | -170.1 | 0 | 0 | 120.6 | ||||
| 496 | T | 35 | Very low | 32.5 | Very low | 138 Ų | 138 | 134.1 Ų | 134.1 | 85% | 0.847 | 83% | 0.829 | S | S | * | * | -166.3 | 145.3 | 78.9 | 10.8 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 497 | C | 38.1 | Very low | 33 | Very low | 123 Ų | 123 | 138.7 Ų | 138.7 | 83% | 0.831 | 84% | 0.844 | S | S | * | * | trans | -72.6 | 150.1 | 165.7 | -65.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 498 | L | 39.4 | Very low | 33.5 | Very low | 246 Ų | 246 | 135.5 Ų | 135.5 | 100% | 1.288 | 84% | 0.836 | S | S | * | * | -163.3 | 0 | 116 | -118.1 | 158.6 | 0 | 0 | 0 | 110.6 |
Retrieved 498 of 498 residues in 143.2 ms
(Link to these results)