| 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 | 50.9 | Low | 80.1 | Confident | 236 Ų | 236 | 86 Ų | 86 | 100% | 1.163 | 42% | 0.418 | S | S | * | . | 0 | 116.7 | 0 | -87.2 | 170.6 | 174.8 | 0 | 0 | 104.6 | E3 | M1-E3 PolarHBondContact O-N 3.49Å; M1-E3 VanDerWaalsContact O-N 3.08Å | |||
| 2 | S | 53.3 | Low | 79.5 | Confident | 89 Ų | 89 | 91.6 Ų | 91.6 | 62% | 0.622 | 45% | 0.451 | S | S | * | . | trans | -63.2 | 112.3 | 178.4 | -47.5 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 3 | E | 83.8 | Confident | 79.4 | Confident | 107 Ų | 107 | 91.2 Ų | 91.2 | 50% | 0.5 | 45% | 0.452 | S | S | . | . | trans | -80.9 | 163 | 175 | -154 | 168.5 | 104.1 | 0 | 0 | 107.9 | M1 S20 | M1-E3 PolarHBondContact O-N 3.49Å; M1-E3 VanDerWaalsContact O-N 3.08Å; E3-S20 PolarHBondContact N-OG 3.49Å; E3-S20 WeakPolarHBondContact O-CB 3.36Å; E3-S20 PolarHBondContact O-N 2.79Å; E3-S20 PolarHBondContact O-OG 2.98Å | ||
| 4 | Y | 89.1 | Confident | 79.8 | Confident | 117 Ų | 117 | 97.7 Ų | 97.7 | 46% | 0.459 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 153.1 | 177 | 61.1 | -94.8 | 0 | 0 | 0 | 109.4 | E17 I18 | Y4-E17 HydrophobicContact CD2-CB 3.89Å; Y4-E17 HydrophobicContact CD2-CG 3.62Å; Y4-E17 HydrophobicContact CE2-CB 4.49Å; Y4-E17 HydrophobicContact CE2-CG 3.77Å; Y4-E17 WeakPolarHBondContact CE2-OE1 3.45Å; Y4-E17 HydrophobicContact CG-CB 4.4Å; Y4-I18 CarbonylContact C-O 3.47Å; Y4-I18 WeakPolarHBondContact CA-O 3.37Å |
| 5 | I | 92.9 | Very high | 80.5 | Confident | 0 Ų | 0 | 94.5 Ų | 94.5 | 0% | 0 | 47% | 0.47 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 145.6 | 178.9 | 68.3 | 156.5 | 0 | 0 | 0 | 109.8 | V7 E17 I18 V26 L41 W68 | I5-V7 HydrophobicContact CD1-CG2 3.5Å; I5-V7 HydrophobicContact CG1-CG2 3.75Å; I5-E17 CarbonylContact O-C 3.58Å; I5-E17 WeakPolarHBondContact O-CA 3.39Å; I5-I18 HydrophobicContact CG1-CB 3.95Å; I5-I18 PolarHBondContact N-O 3.33Å; I5-I18 PolarHBondContact O-N 3.26Å; I5-V26 HydrophobicContact CD1-CB 4.3Å; I5-V26 HydrophobicContact CD1-CG1 4.02Å; I5-V26 HydrophobicContact CD1-CG2 3.88Å; I5-V26 HydrophobicContact CG1-CG1 4.5Å; I5-V26 HydrophobicContact CG1-CG2 4.06Å; I5-V26 HydrophobicContact CG2-CG2 3.96Å; I5-L41 HydrophobicContact CD1-CD1 3.74Å; I5-W68 HydrophobicContact CB-CE3 4.42Å; I5-W68 HydrophobicContact CD1-CE3 4.36Å; I5-W68 HydrophobicContact CD1-CH2 4.5Å; I5-W68 HydrophobicContact CD1-CZ3 4.16Å; I5-W68 HydrophobicContact CG2-CB 3.7Å; I5-W68 HydrophobicContact CG2-CD2 3.43Å; I5-W68 VanDerWaalsContact CG2-CD2 3.43Å; I5-W68 HydrophobicContact CG2-CE3 3.75Å; I5-W68 HydrophobicContact CG2-CG 3.38Å |
| 6 | R | 92.9 | Very high | 81.1 | Confident | 78 Ų | 78 | 93.1 Ų | 93.1 | 29% | 0.294 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.6 | 115.3 | 179.7 | -69.2 | -170.6 | -61.7 | 175.2 | 0.5 | 110 | P15 E17 N70 Y73 | R6-P15 HydrophobicContact CB-CB 4.01Å; R6-P15 HydrophobicContact CB-CG 4.41Å; R6-E17 HydrophobicContact CG-CG 4.14Å; R6-N70 PolarHBondContact NH2-O 3.21Å; R6-Y73 PolarHBondContact O-N 3.06Å |
| 7 | V | 93 | Very high | 81.8 | Confident | 0 Ų | 0 | 94 Ų | 94 | 0% | 0 | 47% | 0.466 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.5 | 133.5 | -173.2 | -173.7 | 0 | 0 | 0 | 0 | 110.4 | I5 P15 I16 I18 F35 L41 Y73 V75 | I5-V7 HydrophobicContact CD1-CG2 3.5Å; I5-V7 HydrophobicContact CG1-CG2 3.75Å; V7-P15 CarbonylContact O-C 3.59Å; V7-P15 WeakPolarHBondContact O-CA 3.46Å; V7-I16 PolarHBondContact N-O 3.45Å; V7-I16 PolarHBondContact O-N 3.14Å; V7-I18 HydrophobicContact CB-CG1 3.92Å; V7-I18 HydrophobicContact CG2-CB 4.24Å; V7-I18 HydrophobicContact CG2-CG1 3.65Å; V7-F35 HydrophobicContact CB-CE2 3.89Å; V7-F35 HydrophobicContact CB-CZ 4.4Å; V7-F35 HydrophobicContact CG1-CD2 4.04Å; V7-F35 HydrophobicContact CG1-CE2 3.54Å; V7-F35 HydrophobicContact CG1-CZ 4.09Å; V7-L41 HydrophobicContact CG1-CD2 3.77Å; V7-L41 HydrophobicContact CG2-CD1 4.28Å; V7-Y73 CarbonylContact C-O 3.58Å; V7-Y73 VanDerWaalsContact CA-O 3.25Å; V7-Y73 WeakPolarHBondContact CA-O 3.2Å; V7-V75 HydrophobicContact CG1-CG1 3.52Å |
| 8 | T | 92.3 | Very high | 82.4 | Confident | 4 Ų | 4 | 88.9 Ų | 88.9 | 3% | 0.025 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 160.3 | 176.8 | -172.1 | 0 | 0 | 0 | 0 | 111.1 | D10 D13 V72 Y73 V74 V75 | T8-D10 WeakPolarHBondContact CG2-O 3.38Å; T8-D10 PolarHBondContact OG1-N 2.74Å; T8-D10 PolarHBondContact OG1-O 2.64Å; T8-D13 PolarHBondContact OG1-O 3.4Å; T8-V72 HydrophobicContact CG2-CG1 3.63Å; T8-Y73 PolarHBondContact N-O 3.1Å; T8-V74 HydrophobicContact CG2-CG2 4.14Å; T8-V74 CarbonylContact O-C 3.56Å; T8-V74 VanDerWaalsContact O-CA 3.27Å; T8-V74 WeakPolarHBondContact O-CA 3.3Å; T8-V75 PolarHBondContact O-N 3.49Å |
| 9 | E | 84.8 | Confident | 82.9 | Confident | 98 Ų | 98 | 88.2 Ų | 88.2 | 46% | 0.458 | 44% | 0.444 | S | S | . | . | S | Bend | trans | -81 | -39.1 | 170.2 | 65.2 | -175.6 | 114.4 | 0 | 0 | 112.9 | F35 V74 V75 Y77 | E9-F35 HydrophobicContact CB-CE1 4.45Å; E9-V74 WeakPolarHBondContact O-CG1 3.24Å; E9-V75 HydrophobicContact CB-CG2 4.01Å; E9-Y77 HydrophobicContact CB-CE2 4.47Å |
| 10 | D | 77.5 | Confident | 83.3 | Confident | 88 Ų | 88 | 84.3 Ų | 84.3 | 47% | 0.471 | 43% | 0.425 | S | S | . | . | S | Bend | trans | -132.6 | 150.2 | -176.9 | -101.6 | -74.9 | 0 | 0 | 0 | 110.7 | T8 N12 D13 | T8-D10 WeakPolarHBondContact CG2-O 3.38Å; T8-D10 PolarHBondContact OG1-N 2.74Å; T8-D10 PolarHBondContact OG1-O 2.64Å; D10-N12 PolarHBondContact O-N 3.43Å; D10-D13 PolarHBondContact O-N 3.15Å; D10-D13 VanDerWaalsContact O-N 3.16Å |
| 11 | E | 70.2 | Confident | 83.7 | Confident | 129 Ų | 129 | 84 Ų | 84 | 60% | 0.603 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | -12 | 179.6 | -68.4 | -175.1 | 109.1 | 0 | 0 | 113.1 | R44 V74 | E11-R44 IonicContact OE1-NH1 2.85Å; E11-V74 HydrophobicContact CG-CG2 4.32Å |
| 12 | N | 72.8 | Confident | 85.4 | Confident | 153 Ų | 153 | 80.1 Ų | 80.1 | 82% | 0.818 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.9 | -9.7 | -179.7 | -56.9 | -70.2 | 0 | 0 | 0 | 113.6 | D10 | D10-N12 PolarHBondContact O-N 3.43Š|
| 13 | D | 79.1 | Confident | 86.9 | Confident | 86 Ų | 86 | 81.4 Ų | 81.4 | 46% | 0.46 | 41% | 0.406 | S | S | . | . | S | Bend | trans | -94.3 | 154.7 | -178.6 | -77.9 | -55.2 | 0 | 0 | 0 | 112.4 | T8 D10 | T8-D13 PolarHBondContact OG1-O 3.4Å; D10-D13 PolarHBondContact O-N 3.15Å; D10-D13 VanDerWaalsContact O-N 3.16Å |
| 14 | E | 84.9 | Confident | 87 | Confident | 183 Ų | 183 | 77.7 Ų | 77.7 | 86% | 0.855 | 40% | 0.396 | S | S | * | . | P | Polyproline II helix | trans | -67.1 | 125.4 | 175.9 | -68.5 | -170.9 | 165 | 0 | 0 | 110.1 | ||
| 15 | P | 89.6 | Confident | 87.2 | Confident | 50 Ų | 50 | 72.6 Ų | 72.6 | 33% | 0.325 | 38% | 0.377 | S | S | . | . | P | Polyproline II helix | trans | -73.1 | 141.1 | -177.8 | 30 | -34.6 | 0 | 0 | 0 | 111.5 | R6 V7 V72 | R6-P15 HydrophobicContact CB-CB 4.01Å; R6-P15 HydrophobicContact CB-CG 4.41Å; V7-P15 CarbonylContact O-C 3.59Å; V7-P15 WeakPolarHBondContact O-CA 3.46Å; P15-V72 HydrophobicContact CB-CG1 4.17Å |
| 16 | I | 90.3 | Very high | 87.2 | Confident | 72 Ų | 72 | 72.6 Ų | 72.6 | 37% | 0.369 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 137.5 | 174.2 | -59.9 | 179.1 | 0 | 0 | 0 | 109.4 | V7 I18 F35 | V7-I16 PolarHBondContact N-O 3.45Å; V7-I16 PolarHBondContact O-N 3.14Å; I16-I18 HydrophobicContact CG2-CD1 3.92Å; I16-F35 HydrophobicContact CB-CZ 4.22Å; I16-F35 HydrophobicContact CD1-CE1 4.35Å; I16-F35 HydrophobicContact CD1-CZ 3.86Å; I16-F35 HydrophobicContact CG1-CZ 4.26Å |
| 17 | E | 93.3 | Very high | 87.2 | Confident | 108 Ų | 108 | 71.1 Ų | 71.1 | 51% | 0.505 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.3 | 118.8 | 174.1 | -66.5 | -178.1 | 167.2 | 0 | 0 | 110.5 | Y4 I5 R6 | Y4-E17 HydrophobicContact CD2-CB 3.89Å; Y4-E17 HydrophobicContact CD2-CG 3.62Å; Y4-E17 HydrophobicContact CE2-CB 4.49Å; Y4-E17 HydrophobicContact CE2-CG 3.77Å; Y4-E17 WeakPolarHBondContact CE2-OE1 3.45Å; Y4-E17 HydrophobicContact CG-CB 4.4Å; I5-E17 CarbonylContact O-C 3.58Å; I5-E17 WeakPolarHBondContact O-CA 3.39Å; R6-E17 HydrophobicContact CG-CG 4.14Å |
| 18 | I | 91.8 | Very high | 87.1 | Confident | 3 Ų | 3 | 72.5 Ų | 72.5 | 2% | 0.015 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 126.1 | 178.1 | -53.3 | -61.2 | 0 | 0 | 0 | 108.5 | Y4 I5 V7 I16 V26 T30 V31 Q34 F35 | Y4-I18 CarbonylContact C-O 3.47Å; Y4-I18 WeakPolarHBondContact CA-O 3.37Å; I5-I18 HydrophobicContact CG1-CB 3.95Å; I5-I18 PolarHBondContact N-O 3.33Å; I5-I18 PolarHBondContact O-N 3.26Å; V7-I18 HydrophobicContact CB-CG1 3.92Å; V7-I18 HydrophobicContact CG2-CB 4.24Å; V7-I18 HydrophobicContact CG2-CG1 3.65Å; I16-I18 HydrophobicContact CG2-CD1 3.92Å; I18-V26 HydrophobicContact CG2-CG1 4.17Å; I18-T30 HydrophobicContact CG2-CG2 3.63Å; I18-V31 HydrophobicContact CG2-CG2 4.37Å; I18-Q34 HydrophobicContact CD1-CB 4.07Å; I18-Q34 HydrophobicContact CD1-CG 3.54Å; I18-F35 HydrophobicContact CD1-CE2 4.3Å |
| 19 | P | 91.9 | Very high | 87 | Confident | 75 Ų | 75 | 75.8 Ų | 75.8 | 49% | 0.487 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.7 | 144.1 | -179.1 | 28 | -34.4 | 0 | 0 | 0 | 111.6 | T30 | P19-T30 HydrophobicContact CG-CG2 4.06Å |
| 20 | S | 91.4 | Very high | 87.3 | Confident | 9 Ų | 9 | 72.8 Ų | 72.8 | 6% | 0.063 | 39% | 0.394 | C | S | . | . | P | Polyproline II helix | trans | -93.5 | 158.3 | 169.6 | 80.1 | 0 | 0 | 0 | 0 | 111.7 | E3 T25 | E3-S20 PolarHBondContact N-OG 3.49Å; E3-S20 WeakPolarHBondContact O-CB 3.36Å; E3-S20 PolarHBondContact O-N 2.79Å; E3-S20 PolarHBondContact O-OG 2.98Å; S20-T25 WeakPolarHBondContact CA-O 3.46Å; S20-T25 WeakPolarHBondContact CB-O 3.25Å |
| 21 | E | 91.4 | Very high | 88.1 | Confident | 80 Ų | 80 | 68.6 Ų | 68.6 | 37% | 0.374 | 37% | 0.371 | S | S | . | . | P | Polyproline II helix | trans | -71.9 | 168 | 170.7 | -60 | -62.4 | 114.9 | 0 | 0 | 110.9 | D23 G24 T25 L27 | E21-D23 VanDerWaalsContact CB-OD1 3.32Å; E21-D23 WeakPolarHBondContact CB-OD1 3.42Å; E21-D23 PolarHBondContact O-N 2.96Å; E21-G24 PolarHBondContact O-N 2.71Å; E21-T25 PolarHBondContact N-O 2.98Å; E21-L27 HydrophobicContact CG-CD1 4.32Å; E21-L27 HydrophobicContact CG-CD2 4.47Å; E21-L27 HydrophobicContact CG-CG 3.92Å |
| 22 | D | 86.2 | Confident | 89 | Confident | 154 Ų | 154 | 64.8 Ų | 64.8 | 82% | 0.824 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | -22.8 | -179.5 | -66.9 | -52.8 | 0 | 0 | 0 | 113.5 | G24 | D22-G24 VanDerWaalsContact C-N 3.25Š|
| 23 | D | 85.9 | Confident | 89.9 | Confident | 115 Ų | 115 | 61.1 Ų | 61.1 | 62% | 0.615 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | 1.1 | 175.5 | 70.8 | -6.9 | 0 | 0 | 0 | 113.2 | E21 T25 | E21-D23 VanDerWaalsContact CB-OD1 3.32Å; E21-D23 WeakPolarHBondContact CB-OD1 3.42Å; E21-D23 PolarHBondContact O-N 2.96Å; D23-T25 VanDerWaalsContact C-N 3.29Å; D23-T25 VanDerWaalsContact CG-OG1 3.31Å; D23-T25 VanDerWaalsContact OD1-CB 3.31Å; D23-T25 WeakPolarHBondContact OD1-CB 3.48Å; D23-T25 WeakPolarHBondContact OD1-CG2 3.28Å; D23-T25 PolarHBondContact OD1-N 3.08Å; D23-T25 PolarHBondContact OD1-OG1 2.74Å; D23-T25 PolarHBondContact OD2-OG1 2.91Å |
| 24 | G | 86.2 | Confident | 90.4 | Very high | 29 Ų | 29 | 62.5 Ų | 62.5 | 30% | 0.299 | 35% | 0.351 | S | S | . | . | S | Bend | trans | 78.5 | 8.3 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | E21 D22 W68 | E21-G24 PolarHBondContact O-N 2.71Å; D22-G24 VanDerWaalsContact C-N 3.25Å; G24-W68 PolarHBondContact O-NE1 2.91Å |
| 25 | T | 92.1 | Very high | 90.5 | Very high | 10 Ų | 10 | 54.2 Ų | 54.2 | 6% | 0.061 | 31% | 0.313 | C | S | . | . | trans | -87.7 | 167.6 | 170.6 | 69.8 | 0 | 0 | 0 | 0 | 111.3 | S20 E21 D23 I60 L61 | S20-T25 WeakPolarHBondContact CA-O 3.46Å; S20-T25 WeakPolarHBondContact CB-O 3.25Å; E21-T25 PolarHBondContact N-O 2.98Å; D23-T25 VanDerWaalsContact C-N 3.29Å; D23-T25 VanDerWaalsContact CG-OG1 3.31Å; D23-T25 VanDerWaalsContact OD1-CB 3.31Å; D23-T25 WeakPolarHBondContact OD1-CB 3.48Å; D23-T25 WeakPolarHBondContact OD1-CG2 3.28Å; D23-T25 PolarHBondContact OD1-N 3.08Å; D23-T25 PolarHBondContact OD1-OG1 2.74Å; D23-T25 PolarHBondContact OD2-OG1 2.91Å; T25-I60 VanDerWaalsContact CB-CG2 3.46Å; T25-I60 HydrophobicContact CG2-CG2 3.8Å; T25-I60 WeakPolarHBondContact OG1-CG2 3.35Å; T25-L61 WeakPolarHBondContact CA-O 3.3Å; T25-L61 WeakPolarHBondContact CB-O 3.43Å | ||
| 26 | V | 93.1 | Very high | 90.2 | Very high | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.2 | 129 | 174.9 | 177 | 0 | 0 | 0 | 0 | 108.6 | I5 I18 V31 L61 W68 | I5-V26 HydrophobicContact CD1-CB 4.3Å; I5-V26 HydrophobicContact CD1-CG1 4.02Å; I5-V26 HydrophobicContact CD1-CG2 3.88Å; I5-V26 HydrophobicContact CG1-CG1 4.5Å; I5-V26 HydrophobicContact CG1-CG2 4.06Å; I5-V26 HydrophobicContact CG2-CG2 3.96Å; I18-V26 HydrophobicContact CG2-CG1 4.17Å; V26-V31 HydrophobicContact CG1-CG2 3.98Å; V26-L61 HydrophobicContact CB-CB 4.26Å; V26-L61 HydrophobicContact CG1-CD1 4.36Å; V26-L61 PolarHBondContact N-O 2.91Å; V26-L61 WeakPolarHBondContact O-CA 3.46Å; V26-L61 WeakPolarHBondContact O-CB 3.13Å; V26-L61 PolarHBondContact O-N 2.98Å; V26-W68 HydrophobicContact CB-CH2 4.42Å; V26-W68 HydrophobicContact CB-CZ2 4.07Å; V26-W68 HydrophobicContact CG2-CH2 4.24Å; V26-W68 HydrophobicContact CG2-CZ2 3.64Å |
| 27 | L | 93.1 | Very high | 89.9 | Confident | 48 Ų | 48 | 55.7 Ų | 55.7 | 25% | 0.251 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.1 | 133.4 | 177 | -59.9 | 175.9 | 0 | 0 | 0 | 110.7 | E21 S29 T30 V31 I60 | E21-L27 HydrophobicContact CG-CD1 4.32Å; E21-L27 HydrophobicContact CG-CD2 4.47Å; E21-L27 HydrophobicContact CG-CG 3.92Å; L27-S29 WeakPolarHBondContact CB-OG 3.33Å; L27-S29 PolarHBondContact O-N 3.45Å; L27-T30 WeakPolarHBondContact O-CB 3.37Å; L27-T30 PolarHBondContact O-N 3.39Å; L27-T30 VanDerWaalsContact O-N 3.09Å; L27-V31 PolarHBondContact O-N 3.37Å; L27-I60 HydrophobicContact CD2-CG1 4.01Å |
| 28 | L | 91.1 | Very high | 89.6 | Confident | 29 Ų | 29 | 50.9 Ų | 50.9 | 15% | 0.152 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.8 | -32.5 | 173 | -178.5 | 63.9 | 0 | 0 | 0 | 110.7 | T30 V31 T32 L56 G59 L61 | L28-T30 VanDerWaalsContact C-N 3.31Å; L28-T30 PolarHBondContact O-N 3.33Å; L28-V31 HydrophobicContact CD1-CB 4.48Å; L28-V31 PolarHBondContact O-N 3.31Å; L28-T32 HydrophobicContact CD1-CG2 4.3Å; L28-T32 HydrophobicContact CG-CG2 4.16Å; L28-T32 WeakPolarHBondContact O-CG2 3.17Å; L28-T32 PolarHBondContact O-N 3.33Å; L28-T32 PolarHBondContact O-OG1 3.19Å; L28-L56 HydrophobicContact CB-CD1 4.21Å; L28-L56 HydrophobicContact CD2-CD1 4.22Å; L28-L56 HydrophobicContact CD2-CD2 4.08Å; L28-G59 WeakPolarHBondContact CB-O 3.34Å; L28-G59 PolarHBondContact N-O 2.88Å; L28-L61 HydrophobicContact CD1-CD1 4.46Å |
| 29 | S | 90.1 | Very high | 89.4 | Confident | 72 Ų | 72 | 53.5 Ų | 53.5 | 50% | 0.503 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -57 | -44.1 | 174.1 | 51.3 | 0 | 0 | 0 | 0 | 112 | L27 V31 T32 A33 | L27-S29 WeakPolarHBondContact CB-OG 3.33Å; L27-S29 PolarHBondContact O-N 3.45Å; S29-V31 VanDerWaalsContact C-N 3.35Å; S29-V31 PolarHBondContact O-N 3.28Å; S29-T32 VanDerWaalsContact CA-OG1 3.29Å; S29-T32 WeakPolarHBondContact CA-OG1 3.48Å; S29-T32 PolarHBondContact O-N 3.03Å; S29-T32 PolarHBondContact O-OG1 3.23Å; S29-A33 PolarHBondContact O-N 3.39Å |
| 30 | T | 92.4 | Very high | 89.4 | Confident | 36 Ų | 36 | 50.3 Ų | 50.3 | 22% | 0.221 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -63.6 | -40.3 | 176.8 | -46.5 | 0 | 0 | 0 | 0 | 111.5 | I18 P19 L27 L28 A33 | I18-T30 HydrophobicContact CG2-CG2 3.63Å; P19-T30 HydrophobicContact CG-CG2 4.06Å; L27-T30 WeakPolarHBondContact O-CB 3.37Å; L27-T30 PolarHBondContact O-N 3.39Å; L27-T30 VanDerWaalsContact O-N 3.09Å; L28-T30 VanDerWaalsContact C-N 3.31Å; L28-T30 PolarHBondContact O-N 3.33Å; T30-A33 WeakPolarHBondContact O-CB 3.36Å; T30-A33 PolarHBondContact O-N 2.8Å |
| 31 | V | 92.4 | Very high | 89.4 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64.6 | -46 | 173.2 | 178.9 | 0 | 0 | 0 | 0 | 110.6 | I18 V26 L27 L28 S29 A33 Q34 F35 A38 L41 L61 V75 | I18-V31 HydrophobicContact CG2-CG2 4.37Å; V26-V31 HydrophobicContact CG1-CG2 3.98Å; L27-V31 PolarHBondContact O-N 3.37Å; L28-V31 HydrophobicContact CD1-CB 4.48Å; L28-V31 PolarHBondContact O-N 3.31Å; S29-V31 VanDerWaalsContact C-N 3.35Å; S29-V31 PolarHBondContact O-N 3.28Å; V31-A33 PolarHBondContact O-N 3.15Å; V31-Q34 PolarHBondContact O-N 3.42Å; V31-F35 HydrophobicContact CG1-CD2 4.13Å; V31-F35 WeakPolarHBondContact O-CB 3.16Å; V31-F35 WeakPolarHBondContact O-CD2 3.47Å; V31-F35 PolarHBondContact O-N 2.99Å; V31-A38 HydrophobicContact CG1-CB 4.13Å; V31-L41 HydrophobicContact CG1-CD2 4.04Å; V31-L41 HydrophobicContact CG2-CD1 4.31Å; V31-L61 HydrophobicContact CG2-CD1 3.79Å; V31-V75 HydrophobicContact CG1-CG1 3.85Å |
| 32 | T | 90.7 | Very high | 89.5 | Confident | 48 Ų | 48 | 51.2 Ų | 51.2 | 29% | 0.294 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -68.3 | -20.2 | -179.4 | 57.7 | 0 | 0 | 0 | 0 | 114.1 | L28 S29 Q34 F35 P36 A38 | L28-T32 HydrophobicContact CD1-CG2 4.3Å; L28-T32 HydrophobicContact CG-CG2 4.16Å; L28-T32 WeakPolarHBondContact O-CG2 3.17Å; L28-T32 PolarHBondContact O-N 3.33Å; L28-T32 PolarHBondContact O-OG1 3.19Å; S29-T32 VanDerWaalsContact CA-OG1 3.29Å; S29-T32 WeakPolarHBondContact CA-OG1 3.48Å; S29-T32 PolarHBondContact O-N 3.03Å; S29-T32 PolarHBondContact O-OG1 3.23Å; T32-Q34 VanDerWaalsContact C-N 3.31Å; T32-F35 WeakPolarHBondContact CA-O 3.49Å; T32-F35 CarbonylContact O-C 3.57Å; T32-P36 WeakPolarHBondContact O-CA 3.36Å; T32-A38 HydrophobicContact CG2-CB 4.28Å; T32-A38 VanDerWaalsContact CG2-O 3.29Å; T32-A38 WeakPolarHBondContact CG2-O 3.4Å |
| 33 | A | 90.5 | Very high | 89.7 | Confident | 76 Ų | 76 | 44.3 Ų | 44.3 | 63% | 0.628 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -66.6 | -34.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | S29 T30 V31 | S29-A33 PolarHBondContact O-N 3.39Å; T30-A33 WeakPolarHBondContact O-CB 3.36Å; T30-A33 PolarHBondContact O-N 2.8Å; V31-A33 PolarHBondContact O-N 3.15Å |
| 34 | Q | 89 | Confident | 89.7 | Confident | 115 Ų | 115 | 44.5 Ų | 44.5 | 54% | 0.537 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -93.4 | -35.2 | 174 | -56.7 | -57.1 | -16.7 | 0 | 0 | 112.2 | I18 V31 T32 P36 | I18-Q34 HydrophobicContact CD1-CB 4.07Å; I18-Q34 HydrophobicContact CD1-CG 3.54Å; V31-Q34 PolarHBondContact O-N 3.42Å; T32-Q34 VanDerWaalsContact C-N 3.31Å; Q34-P36 VanDerWaalsContact O-CD 3.31Å; Q34-P36 WeakPolarHBondContact O-CD 3.25Å |
| 35 | F | 88.1 | Confident | 89.7 | Confident | 10 Ų | 10 | 44.7 Ų | 44.7 | 4% | 0.044 | 26% | 0.261 | C | S | . | . | S | Bend | trans | -119.2 | 79.4 | -175.7 | -58.3 | -76.8 | 0 | 0 | 0 | 110.3 | V7 E9 I16 I18 V31 T32 G37 A38 V75 Y77 | V7-F35 HydrophobicContact CB-CE2 3.89Å; V7-F35 HydrophobicContact CB-CZ 4.4Å; V7-F35 HydrophobicContact CG1-CD2 4.04Å; V7-F35 HydrophobicContact CG1-CE2 3.54Å; V7-F35 HydrophobicContact CG1-CZ 4.09Å; E9-F35 HydrophobicContact CB-CE1 4.45Å; I16-F35 HydrophobicContact CB-CZ 4.22Å; I16-F35 HydrophobicContact CD1-CE1 4.35Å; I16-F35 HydrophobicContact CD1-CZ 3.86Å; I16-F35 HydrophobicContact CG1-CZ 4.26Å; I18-F35 HydrophobicContact CD1-CE2 4.3Å; V31-F35 HydrophobicContact CG1-CD2 4.13Å; V31-F35 WeakPolarHBondContact O-CB 3.16Å; V31-F35 WeakPolarHBondContact O-CD2 3.47Å; V31-F35 PolarHBondContact O-N 2.99Å; T32-F35 WeakPolarHBondContact CA-O 3.49Å; T32-F35 CarbonylContact O-C 3.57Å; F35-G37 PolarHBondContact O-N 2.85Å; F35-A38 HydrophobicContact CB-CB 4.04Å; F35-A38 VanDerWaalsContact O-CB 3.29Å; F35-A38 WeakPolarHBondContact O-CB 3.14Å; F35-A38 PolarHBondContact O-N 3.49Å; F35-V75 HydrophobicContact CB-CG1 3.96Å; F35-V75 HydrophobicContact CB-CG2 4.47Å; F35-V75 HydrophobicContact CD1-CG1 4.31Å; F35-V75 HydrophobicContact CD1-CG2 4.1Å; F35-V75 HydrophobicContact CD2-CG1 3.83Å; F35-V75 HydrophobicContact CE2-CG1 4.41Å; F35-V75 HydrophobicContact CG-CG1 3.76Å; F35-V75 HydrophobicContact CG-CG2 4.29Å; F35-Y77 HydrophobicContact CB-CE1 4.49Å |
| 36 | P | 84 | Confident | 89.2 | Confident | 105 Ų | 105 | 48.1 Ų | 48.1 | 68% | 0.682 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | 127.5 | -174 | 23.5 | -33.4 | 0 | 0 | 0 | 111.4 | T32 Q34 Y77 | T32-P36 WeakPolarHBondContact O-CA 3.36Å; Q34-P36 VanDerWaalsContact O-CD 3.31Å; Q34-P36 WeakPolarHBondContact O-CD 3.25Å; P36-Y77 WeakPolarHBondContact O-CE1 3.49Å |
| 37 | G | 82.9 | Confident | 88.6 | Confident | 48 Ų | 48 | 54.4 Ų | 54.4 | 50% | 0.495 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.2 | 0.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | F35 C39 P78 | F35-G37 PolarHBondContact O-N 2.85Å; G37-C39 PolarHBondContact O-N 3.41Å; G37-P78 WeakPolarHBondContact O-CD 3.14Å |
| 38 | A | 87.7 | Confident | 88.1 | Confident | 6 Ų | 6 | 55 Ų | 55 | 5% | 0.05 | 33% | 0.329 | C | S | . | . | trans | -58.1 | 135 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | V31 T32 F35 V75 Y77 | V31-A38 HydrophobicContact CG1-CB 4.13Å; T32-A38 HydrophobicContact CG2-CB 4.28Å; T32-A38 VanDerWaalsContact CG2-O 3.29Å; T32-A38 WeakPolarHBondContact CG2-O 3.4Å; F35-A38 HydrophobicContact CB-CB 4.04Å; F35-A38 VanDerWaalsContact O-CB 3.29Å; F35-A38 WeakPolarHBondContact O-CB 3.14Å; F35-A38 PolarHBondContact O-N 3.49Å; A38-V75 HydrophobicContact CB-CB 4.24Å; A38-V75 HydrophobicContact CB-CG1 4.15Å; A38-Y77 HydrophobicContact CB-CE1 4.26Å | ||
| 39 | C | 87.5 | Confident | 87.7 | Confident | 59 Ų | 59 | 58.6 Ų | 58.6 | 40% | 0.399 | 35% | 0.345 | S | S | . | . | trans | -112.2 | -1.8 | 179.2 | 67.7 | 0 | 0 | 0 | 0 | 113.7 | G37 L56 N76 P78 | G37-C39 PolarHBondContact O-N 3.41Å; C39-L56 VanDerWaalsContact O-CD2 3.3Å; C39-L56 WeakPolarHBondContact O-CD2 3.46Å; C39-N76 PolarHBondContact N-O 3.19Å; C39-N76 PolarHBondContact SG-O 2.9Å; C39-P78 HydrophobicContact CB-CG 4.46Å | ||
| 40 | G | 91.2 | Very high | 87.2 | Confident | 8 Ų | 8 | 58.7 Ų | 58.7 | 8% | 0.082 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 168 | -176.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | N76 | G40-N76 PolarHBondContact O-N 3.36Å |
| 41 | L | 92.5 | Very high | 86.9 | Confident | 3 Ų | 3 | 61 Ų | 61 | 2% | 0.016 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 153.5 | -179.3 | -62.6 | -177.1 | 0 | 0 | 0 | 111.5 | I5 V7 V31 V54 L61 V75 | I5-L41 HydrophobicContact CD1-CD1 3.74Å; V7-L41 HydrophobicContact CG1-CD2 3.77Å; V7-L41 HydrophobicContact CG2-CD1 4.28Å; V31-L41 HydrophobicContact CG1-CD2 4.04Å; V31-L41 HydrophobicContact CG2-CD1 4.31Å; L41-V54 HydrophobicContact CB-CB 3.96Å; L41-V54 HydrophobicContact CB-CG2 3.7Å; L41-V54 PolarHBondContact O-N 3.28Å; L41-L61 HydrophobicContact CD1-CD1 3.73Å; L41-L61 HydrophobicContact CG-CD1 3.96Å; L41-L61 HydrophobicContact CG-CD2 4.43Å; L41-V75 HydrophobicContact CD2-CB 4.29Å; L41-V75 HydrophobicContact CD2-CG1 3.56Å |
| 42 | R | 92.9 | Very high | 86.6 | Confident | 104 Ų | 104 | 66.3 Ų | 66.3 | 39% | 0.392 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.7 | 157.5 | 168.8 | 60.1 | 179.3 | -179.6 | -175.1 | 1.7 | 109.7 | M51 R52 Y73 V74 N76 | R42-M51 HydrophobicContact CB-CE 4.32Å; R42-M51 HydrophobicContact CG-CE 3.68Å; R42-R52 CarbonylContact C-O 3.59Å; R42-R52 VanDerWaalsContact CA-O 3.23Å; R42-R52 WeakPolarHBondContact CA-O 3.31Å; R42-R52 WeakPolarHBondContact CB-O 3.48Å; R42-Y73 CarbonylContact O-C 3.59Å; R42-Y73 WeakPolarHBondContact O-CA 3.47Å; R42-V74 HydrophobicContact CG-CB 4.1Å; R42-V74 WeakPolarHBondContact CG-O 3.1Å; R42-V74 PolarHBondContact N-O 3.3Å; R42-V74 PolarHBondContact O-N 3.48Å; R42-N76 WeakPolarHBondContact CD-OD1 3.45Å; R42-N76 WeakPolarHBondContact CG-OD1 3.33Å; R42-N76 PolarHBondContact NE-OD1 3.48Å |
| 43 | Y | 90.6 | Very high | 86.6 | Confident | 9 Ų | 9 | 66.6 Ų | 66.6 | 4% | 0.035 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.5 | 159.5 | 177.2 | 69.8 | -79.6 | 0 | 0 | 0 | 110.5 | M51 R52 V54 P64 L71 Y73 | Y43-M51 CarbonylContact O-C 3.44Å; Y43-M51 WeakPolarHBondContact O-CA 3.16Å; Y43-R52 HydrophobicContact CD1-CB 4.21Å; Y43-R52 WeakPolarHBondContact CD1-O 3.44Å; Y43-R52 HydrophobicContact CE1-CB 3.76Å; Y43-R52 HydrophobicContact CE1-CG 3.74Å; Y43-R52 HydrophobicContact CE2-CB 4.38Å; Y43-R52 PolarHBondContact N-O 3.32Å; Y43-R52 PolarHBondContact O-N 3.06Å; Y43-R52 VanDerWaalsContact OH-CD 3.27Å; Y43-R52 WeakPolarHBondContact OH-CD 3.41Å; Y43-V54 HydrophobicContact CD1-CG2 4.06Å; Y43-P64 HydrophobicContact CE1-CG 3.73Å; Y43-P64 WeakPolarHBondContact OH-CB 3.43Å; Y43-L71 HydrophobicContact CD2-CD1 3.67Å; Y43-L71 HydrophobicContact CE2-CD1 3.76Å; Y43-Y73 HydrophobicContact CD1-CD1 4.2Å; Y43-Y73 AromaticContact CD1-CE1 3.68Å; Y43-Y73 HydrophobicContact CD1-CE1 3.68Å; Y43-Y73 HydrophobicContact CE1-CE1 4.47Å; Y43-Y73 HydrophobicContact CG-CD1 4.22Å; Y43-Y73 AromaticContact CG-CE1 3.78Å; Y43-Y73 HydrophobicContact CG-CE1 3.78Å |
| 44 | R | 86.4 | Confident | 86.7 | Confident | 119 Ų | 119 | 63.8 Ų | 63.8 | 45% | 0.449 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | 122.8 | 174.5 | -167.8 | 168.5 | -178.2 | 170.3 | -6.8 | 109.7 | E11 P46 Q49 M51 | E11-R44 IonicContact OE1-NH1 2.85Å; R44-P46 WeakPolarHBondContact O-CD 3.39Å; R44-Q49 VanDerWaalsContact CZ-OE1 3.26Å; R44-M51 HydrophobicContact CB-SD 3.95Å; R44-M51 HydrophobicContact CG-SD 4.3Å |
| 45 | N | 85.5 | Confident | 86.9 | Confident | 34 Ų | 34 | 67.1 Ų | 67.1 | 18% | 0.182 | 37% | 0.369 | C | S | . | . | trans | -69.9 | 121.4 | 175.4 | -178.3 | 5.5 | 0 | 0 | 0 | 109.6 | V47 S48 Q49 C50 | N45-V47 PolarHBondContact O-N 3.27Å; N45-V47 PolarHBondContact OD1-N 3.48Å; N45-S48 WeakPolarHBondContact CB-OG 3.48Å; N45-S48 PolarHBondContact ND2-OG 3.49Å; N45-Q49 VanDerWaalsContact O-CA 3.22Å; N45-Q49 WeakPolarHBondContact O-CA 3.38Å; N45-Q49 PolarHBondContact O-N 2.94Å; N45-C50 PolarHBondContact N-O 3.32Å | ||
| 46 | P | 81.2 | Confident | 87.1 | Confident | 81 Ų | 81 | 69.9 Ų | 69.9 | 53% | 0.526 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.7 | -31.3 | -178 | 23.4 | -34.3 | 0 | 0 | 0 | 112.9 | R44 Q49 L71 | R44-P46 WeakPolarHBondContact O-CD 3.39Å; P46-Q49 PolarHBondContact O-NE2 3Å; P46-L71 HydrophobicContact CG-CD2 4.3Å |
| 47 | V | 81.6 | Confident | 87.4 | Confident | 133 Ų | 133 | 68.2 Ų | 68.2 | 81% | 0.806 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.4 | -55.9 | -178.1 | -177.1 | 0 | 0 | 0 | 0 | 111.4 | N45 | N45-V47 PolarHBondContact O-N 3.27Å; N45-V47 PolarHBondContact OD1-N 3.48Å |
| 48 | S | 82.9 | Confident | 87.8 | Confident | 60 Ų | 60 | 75.1 Ų | 75.1 | 42% | 0.42 | 39% | 0.391 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | -10.7 | -174.2 | 75.1 | 0 | 0 | 0 | 0 | 113.9 | N45 C50 | N45-S48 WeakPolarHBondContact CB-OG 3.48Å; N45-S48 PolarHBondContact ND2-OG 3.49Å; S48-C50 PolarHBondContact O-N 2.85Å; S48-C50 PolarHBondContact O-SG 3.48Å; S48-C50 VanDerWaalsContact O-SG 3.34Å; S48-C50 PolarHBondContact OG-N 2.95Å |
| 49 | Q | 82.2 | Confident | 87.7 | Confident | 104 Ų | 104 | 76.1 Ų | 76.1 | 49% | 0.486 | 40% | 0.402 | S | S | . | . | trans | 58.5 | 9.6 | -173.4 | -63.7 | -68.1 | -52.8 | 0 | 0 | 114.6 | R44 N45 P46 | R44-Q49 VanDerWaalsContact CZ-OE1 3.26Å; N45-Q49 VanDerWaalsContact O-CA 3.22Å; N45-Q49 WeakPolarHBondContact O-CA 3.38Å; N45-Q49 PolarHBondContact O-N 2.94Å; P46-Q49 PolarHBondContact O-NE2 3Å | ||
| 50 | C | 79.4 | Confident | 87.9 | Confident | 74 Ų | 74 | 75.9 Ų | 75.9 | 50% | 0.5 | 40% | 0.397 | S | S | . | . | trans | -86.8 | 149.1 | 176.9 | -53.7 | 0 | 0 | 0 | 0 | 111 | N45 S48 R52 | N45-C50 PolarHBondContact N-O 3.32Å; S48-C50 PolarHBondContact O-N 2.85Å; S48-C50 PolarHBondContact O-SG 3.48Å; S48-C50 VanDerWaalsContact O-SG 3.34Å; S48-C50 PolarHBondContact OG-N 2.95Å; C50-R52 PolarHBondContact O-N 3.19Å | ||
| 51 | M | 85.9 | Confident | 88 | Confident | 86 Ų | 86 | 75.5 Ų | 75.5 | 42% | 0.424 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 126.5 | 166.6 | -63.6 | -57.5 | -73.6 | 0 | 0 | 109.6 | R42 Y43 R44 | R42-M51 HydrophobicContact CB-CE 4.32Å; R42-M51 HydrophobicContact CG-CE 3.68Å; Y43-M51 CarbonylContact O-C 3.44Å; Y43-M51 WeakPolarHBondContact O-CA 3.16Å; R44-M51 HydrophobicContact CB-SD 3.95Å; R44-M51 HydrophobicContact CG-SD 4.3Å |
| 52 | R | 86.8 | Confident | 88 | Confident | 111 Ų | 111 | 78.6 Ų | 78.6 | 42% | 0.419 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 133.2 | 178.2 | -173.9 | 160.3 | 175.4 | -169.4 | 1.7 | 109 | R42 Y43 C50 D65 | R42-R52 CarbonylContact C-O 3.59Å; R42-R52 VanDerWaalsContact CA-O 3.23Å; R42-R52 WeakPolarHBondContact CA-O 3.31Å; R42-R52 WeakPolarHBondContact CB-O 3.48Å; Y43-R52 HydrophobicContact CD1-CB 4.21Å; Y43-R52 WeakPolarHBondContact CD1-O 3.44Å; Y43-R52 HydrophobicContact CE1-CB 3.76Å; Y43-R52 HydrophobicContact CE1-CG 3.74Å; Y43-R52 HydrophobicContact CE2-CB 4.38Å; Y43-R52 PolarHBondContact N-O 3.32Å; Y43-R52 PolarHBondContact O-N 3.06Å; Y43-R52 VanDerWaalsContact OH-CD 3.27Å; Y43-R52 WeakPolarHBondContact OH-CD 3.41Å; C50-R52 PolarHBondContact O-N 3.19Å; R52-D65 IonicContact NH2-OD2 3.99Å |
| 53 | G | 89.8 | Confident | 87.8 | Confident | 54 Ų | 54 | 75.5 Ų | 75.5 | 56% | 0.557 | 40% | 0.404 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75.5 | 146.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 54 | V | 93.1 | Very high | 87.7 | Confident | 16 Ų | 16 | 76 Ų | 76 | 10% | 0.097 | 41% | 0.408 | C | S | . | . | P | Polyproline II helix | trans | -83 | 137.7 | 167.1 | -179.5 | 0 | 0 | 0 | 0 | 108.3 | L41 Y43 L56 L61 H62 W68 Y73 | L41-V54 HydrophobicContact CB-CB 3.96Å; L41-V54 HydrophobicContact CB-CG2 3.7Å; L41-V54 PolarHBondContact O-N 3.28Å; Y43-V54 HydrophobicContact CD1-CG2 4.06Å; V54-L56 PolarHBondContact O-N 3.39Å; V54-L61 HydrophobicContact CB-CD2 4.4Å; V54-L61 HydrophobicContact CG1-CB 4.1Å; V54-L61 HydrophobicContact CG1-CD2 3.96Å; V54-H62 WeakPolarHBondContact CG1-O 3.23Å; V54-W68 HydrophobicContact CG1-CH2 3.62Å; V54-W68 HydrophobicContact CG1-CZ3 3.83Å; V54-W68 HydrophobicContact CG2-CZ3 4.24Å; V54-Y73 HydrophobicContact CG2-CD1 3.56Å; V54-Y73 HydrophobicContact CG2-CE1 3.66Å |
| 55 | R | 92.4 | Very high | 87.4 | Confident | 185 Ų | 185 | 77.9 Ų | 77.9 | 70% | 0.698 | 43% | 0.427 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 127.9 | 178.7 | 170.9 | 178.8 | -85.9 | -175.7 | -4.7 | 108.9 | V57 L61 H62 | R55-V57 HydrophobicContact CG-CG2 3.97Å; R55-L61 CarbonylContact O-C 3.58Å; R55-L61 WeakPolarHBondContact O-CA 3.2Å; R55-H62 HydrophobicContact CB-CB 4.24Å; R55-H62 HydrophobicContact CG-CB 4.31Å; R55-H62 PolarHBondContact O-N 2.95Å |
| 56 | L | 91.8 | Very high | 87.3 | Confident | 69 Ų | 69 | 81 Ų | 81 | 36% | 0.361 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 123.9 | 175 | 176.9 | 66.3 | 0 | 0 | 0 | 108.9 | L28 C39 V54 I60 L61 | L28-L56 HydrophobicContact CB-CD1 4.21Å; L28-L56 HydrophobicContact CD2-CD1 4.22Å; L28-L56 HydrophobicContact CD2-CD2 4.08Å; C39-L56 VanDerWaalsContact O-CD2 3.3Å; C39-L56 WeakPolarHBondContact O-CD2 3.46Å; V54-L56 PolarHBondContact O-N 3.39Å; L56-I60 WeakPolarHBondContact CA-O 3.49Å; L56-L61 HydrophobicContact CB-CD2 4.04Å; L56-L61 HydrophobicContact CD1-CD2 3.8Å; L56-L61 HydrophobicContact CD1-CG 3.98Å; L56-L61 HydrophobicContact CG-CD2 4.45Å |
| 57 | V | 91.1 | Very high | 87.6 | Confident | 70 Ų | 70 | 78.6 Ų | 78.6 | 42% | 0.424 | 45% | 0.447 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 120 | 176.2 | -178.2 | 0 | 0 | 0 | 0 | 107.7 | R55 G59 I60 | R55-V57 HydrophobicContact CG-CG2 3.97Å; V57-G59 PolarHBondContact O-N 2.64Å; V57-G59 VanDerWaalsContact O-N 3.08Å; V57-I60 PolarHBondContact N-O 2.85Å; V57-I60 WeakPolarHBondContact O-CA 3.24Å; V57-I60 WeakPolarHBondContact O-CB 3.5Å; V57-I60 PolarHBondContact O-N 3.46Å |
| 58 | E | 90.9 | Very high | 87.9 | Confident | 192 Ų | 192 | 72.4 Ų | 72.4 | 90% | 0.897 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.9 | 35.1 | 176.9 | -59.5 | -171 | 147.2 | 0 | 0 | 115.1 | I60 | E58-I60 VanDerWaalsContact C-N 3.31Š|
| 59 | G | 86.9 | Confident | 88.1 | Confident | 27 Ų | 27 | 71.5 Ų | 71.5 | 28% | 0.278 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.3 | 3.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | L28 V57 | L28-G59 WeakPolarHBondContact CB-O 3.34Å; L28-G59 PolarHBondContact N-O 2.88Å; V57-G59 PolarHBondContact O-N 2.64Å; V57-G59 VanDerWaalsContact O-N 3.08Å |
| 60 | I | 91.4 | Very high | 88.3 | Confident | 55 Ų | 55 | 73.1 Ų | 73.1 | 28% | 0.282 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.2 | 122.3 | 178.2 | -53.3 | 176 | 0 | 0 | 0 | 109.1 | T25 L27 L56 V57 E58 | T25-I60 VanDerWaalsContact CB-CG2 3.46Å; T25-I60 HydrophobicContact CG2-CG2 3.8Å; T25-I60 WeakPolarHBondContact OG1-CG2 3.35Å; L27-I60 HydrophobicContact CD2-CG1 4.01Å; L56-I60 WeakPolarHBondContact CA-O 3.49Å; V57-I60 PolarHBondContact N-O 2.85Å; V57-I60 WeakPolarHBondContact O-CA 3.24Å; V57-I60 WeakPolarHBondContact O-CB 3.5Å; V57-I60 PolarHBondContact O-N 3.46Å; E58-I60 VanDerWaalsContact C-N 3.31Å |
| 61 | L | 93.3 | Very high | 88.6 | Confident | 0 Ų | 0 | 71.8 Ų | 71.8 | 0% | 0 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.7 | 119.5 | 175.4 | -63.8 | 157.1 | 0 | 0 | 0 | 108.9 | T25 V26 L28 V31 L41 V54 R55 L56 W68 | T25-L61 WeakPolarHBondContact CA-O 3.3Å; T25-L61 WeakPolarHBondContact CB-O 3.43Å; V26-L61 HydrophobicContact CB-CB 4.26Å; V26-L61 HydrophobicContact CG1-CD1 4.36Å; V26-L61 PolarHBondContact N-O 2.91Å; V26-L61 WeakPolarHBondContact O-CA 3.46Å; V26-L61 WeakPolarHBondContact O-CB 3.13Å; V26-L61 PolarHBondContact O-N 2.98Å; L28-L61 HydrophobicContact CD1-CD1 4.46Å; V31-L61 HydrophobicContact CG2-CD1 3.79Å; L41-L61 HydrophobicContact CD1-CD1 3.73Å; L41-L61 HydrophobicContact CG-CD1 3.96Å; L41-L61 HydrophobicContact CG-CD2 4.43Å; V54-L61 HydrophobicContact CB-CD2 4.4Å; V54-L61 HydrophobicContact CG1-CB 4.1Å; V54-L61 HydrophobicContact CG1-CD2 3.96Å; R55-L61 CarbonylContact O-C 3.58Å; R55-L61 WeakPolarHBondContact O-CA 3.2Å; L56-L61 HydrophobicContact CB-CD2 4.04Å; L56-L61 HydrophobicContact CD1-CD2 3.8Å; L56-L61 HydrophobicContact CD1-CG 3.98Å; L56-L61 HydrophobicContact CG-CD2 4.45Å; L61-W68 HydrophobicContact CB-CH2 4.01Å; L61-W68 HydrophobicContact CB-CZ2 4.49Å |
| 62 | H | 92.3 | Very high | 88.8 | Confident | 67 Ų | 67 | 70.5 Ų | 70.5 | 31% | 0.31 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.8 | 134.8 | 179.1 | -69.5 | -90.5 | 0 | 0 | 0 | 110.9 | V54 R55 | V54-H62 WeakPolarHBondContact CG1-O 3.23Å; R55-H62 HydrophobicContact CB-CB 4.24Å; R55-H62 HydrophobicContact CG-CB 4.31Å; R55-H62 PolarHBondContact O-N 2.95Å |
| 63 | A | 89.5 | Confident | 89.1 | Confident | 39 Ų | 39 | 65.2 Ų | 65.2 | 32% | 0.322 | 39% | 0.386 | S | S | . | . | P | Polyproline II helix | trans | -57 | 146.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | W68 | A63-W68 HydrophobicContact CB-CD2 4.03Å; A63-W68 HydrophobicContact CB-CG 4.14Å; A63-W68 HydrophobicContact CB-CZ2 4.13Å |
| 64 | P | 87.1 | Confident | 89.1 | Confident | 21 Ų | 21 | 63.1 Ų | 63.1 | 14% | 0.136 | 36% | 0.363 | C | S | . | . | P | Polyproline II helix | trans | -58.4 | 164 | 166 | -21.6 | 33.1 | 0 | 0 | 0 | 112.3 | Y43 A66 G67 | Y43-P64 HydrophobicContact CE1-CG 3.73Å; Y43-P64 WeakPolarHBondContact OH-CB 3.43Å; P64-A66 PolarHBondContact O-N 3.2Å; P64-G67 WeakPolarHBondContact O-CA 3.46Å; P64-G67 PolarHBondContact O-N 3.02Å |
| 65 | D | 81.3 | Confident | 89.1 | Confident | 158 Ų | 158 | 62.6 Ų | 62.6 | 85% | 0.845 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.3 | -22.5 | 179.6 | -48.9 | -56.7 | 0 | 0 | 0 | 113.7 | R52 | R52-D65 IonicContact NH2-OD2 3.99Š|
| 66 | A | 82.3 | Confident | 88.8 | Confident | 100 Ų | 100 | 56 Ų | 56 | 83% | 0.826 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.4 | 5.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | P64 | P64-A66 PolarHBondContact O-N 3.2Š|
| 67 | G | 87.3 | Confident | 88.5 | Confident | 29 Ų | 29 | 57.2 Ų | 57.2 | 30% | 0.299 | 34% | 0.339 | S | S | . | . | trans | 78.5 | 180 | -170.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | P64 | P64-G67 WeakPolarHBondContact O-CA 3.46Å; P64-G67 PolarHBondContact O-N 3.02Å | ||
| 68 | W | 88.8 | Confident | 87.9 | Confident | 3 Ų | 3 | 56.9 Ų | 56.9 | 1% | 0.011 | 34% | 0.338 | C | S | . | . | S | Bend | trans | -70.3 | -42.9 | 177.9 | -66.5 | 110 | 0 | 0 | 0 | 112 | I5 G24 V26 V54 L61 A63 Y73 | I5-W68 HydrophobicContact CB-CE3 4.42Å; I5-W68 HydrophobicContact CD1-CE3 4.36Å; I5-W68 HydrophobicContact CD1-CH2 4.5Å; I5-W68 HydrophobicContact CD1-CZ3 4.16Å; I5-W68 HydrophobicContact CG2-CB 3.7Å; I5-W68 HydrophobicContact CG2-CD2 3.43Å; I5-W68 VanDerWaalsContact CG2-CD2 3.43Å; I5-W68 HydrophobicContact CG2-CE3 3.75Å; I5-W68 HydrophobicContact CG2-CG 3.38Å; G24-W68 PolarHBondContact O-NE1 2.91Å; V26-W68 HydrophobicContact CB-CH2 4.42Å; V26-W68 HydrophobicContact CB-CZ2 4.07Å; V26-W68 HydrophobicContact CG2-CH2 4.24Å; V26-W68 HydrophobicContact CG2-CZ2 3.64Å; V54-W68 HydrophobicContact CG1-CH2 3.62Å; V54-W68 HydrophobicContact CG1-CZ3 3.83Å; V54-W68 HydrophobicContact CG2-CZ3 4.24Å; L61-W68 HydrophobicContact CB-CH2 4.01Å; L61-W68 HydrophobicContact CB-CZ2 4.49Å; A63-W68 HydrophobicContact CB-CD2 4.03Å; A63-W68 HydrophobicContact CB-CG 4.14Å; A63-W68 HydrophobicContact CB-CZ2 4.13Å; W68-Y73 WeakPolarHBondContact CA-OH 3.39Å; W68-Y73 HydrophobicContact CE3-CD1 4.39Å; W68-Y73 HydrophobicContact CE3-CD2 4.46Å; W68-Y73 AromaticContact CE3-CE1 3.73Å; W68-Y73 HydrophobicContact CE3-CE1 3.73Å; W68-Y73 AromaticContact CE3-CE2 3.81Å; W68-Y73 HydrophobicContact CE3-CE2 3.81Å; W68-Y73 AromaticContact CE3-CZ 3.42Å; W68-Y73 VanDerWaalsContact CE3-CZ 3.42Å; W68-Y73 HydrophobicContact CZ3-CD1 4.15Å; W68-Y73 AromaticContact CZ3-CE1 3.75Å; W68-Y73 HydrophobicContact CZ3-CE1 3.75Å; W68-Y73 HydrophobicContact CZ3-CE2 4.48Å; W68-Y73 AromaticContact CZ3-CZ 3.97Å; W68-Y73 PolarHBondContact O-OH 3.22Å |
| 69 | G | 86 | Confident | 86.9 | Confident | 42 Ų | 42 | 57 Ų | 57 | 43% | 0.433 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 56.3 | -166.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | L71 | G69-L71 PolarHBondContact O-N 3.49Å; G69-L71 VanDerWaalsContact O-N 3.08Å |
| 70 | N | 86.3 | Confident | 84.9 | Confident | 137 Ų | 137 | 62.6 Ų | 62.6 | 73% | 0.733 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.2 | 37.8 | 176.9 | -69.2 | -25.7 | 0 | 0 | 0 | 111.9 | R6 | R6-N70 PolarHBondContact NH2-O 3.21Š|
| 71 | L | 87.6 | Confident | 82.5 | Confident | 46 Ų | 46 | 65.9 Ų | 65.9 | 24% | 0.241 | 38% | 0.377 | C | S | . | . | P | Polyproline II helix | trans | -86.6 | 154.2 | 177.1 | -62.3 | 173 | 0 | 0 | 0 | 110.4 | Y43 P46 G69 Y73 | Y43-L71 HydrophobicContact CD2-CD1 3.67Å; Y43-L71 HydrophobicContact CE2-CD1 3.76Å; P46-L71 HydrophobicContact CG-CD2 4.3Å; G69-L71 PolarHBondContact O-N 3.49Å; G69-L71 VanDerWaalsContact O-N 3.08Å; L71-Y73 HydrophobicContact CB-CE2 3.87Å |
| 72 | V | 89.3 | Confident | 79.8 | Confident | 60 Ų | 60 | 75.2 Ų | 75.2 | 36% | 0.364 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99 | 124.9 | 172.1 | -179 | 0 | 0 | 0 | 0 | 108 | T8 P15 | T8-V72 HydrophobicContact CG2-CG1 3.63Å; P15-V72 HydrophobicContact CB-CG1 4.17Å |
| 73 | Y | 92.2 | Very high | 77.5 | Confident | 0 Ų | 0 | 80.7 Ų | 80.7 | 0% | 0 | 44% | 0.436 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 134.9 | 179.3 | -65.2 | -92.4 | 0 | 0 | 0 | 109.1 | R6 V7 T8 R42 Y43 V54 W68 L71 | R6-Y73 PolarHBondContact O-N 3.06Å; V7-Y73 CarbonylContact C-O 3.58Å; V7-Y73 VanDerWaalsContact CA-O 3.25Å; V7-Y73 WeakPolarHBondContact CA-O 3.2Å; T8-Y73 PolarHBondContact N-O 3.1Å; R42-Y73 CarbonylContact O-C 3.59Å; R42-Y73 WeakPolarHBondContact O-CA 3.47Å; Y43-Y73 HydrophobicContact CD1-CD1 4.2Å; Y43-Y73 AromaticContact CD1-CE1 3.68Å; Y43-Y73 HydrophobicContact CD1-CE1 3.68Å; Y43-Y73 HydrophobicContact CE1-CE1 4.47Å; Y43-Y73 HydrophobicContact CG-CD1 4.22Å; Y43-Y73 AromaticContact CG-CE1 3.78Å; Y43-Y73 HydrophobicContact CG-CE1 3.78Å; V54-Y73 HydrophobicContact CG2-CD1 3.56Å; V54-Y73 HydrophobicContact CG2-CE1 3.66Å; W68-Y73 WeakPolarHBondContact CA-OH 3.39Å; W68-Y73 HydrophobicContact CE3-CD1 4.39Å; W68-Y73 HydrophobicContact CE3-CD2 4.46Å; W68-Y73 AromaticContact CE3-CE1 3.73Å; W68-Y73 HydrophobicContact CE3-CE1 3.73Å; W68-Y73 AromaticContact CE3-CE2 3.81Å; W68-Y73 HydrophobicContact CE3-CE2 3.81Å; W68-Y73 AromaticContact CE3-CZ 3.42Å; W68-Y73 VanDerWaalsContact CE3-CZ 3.42Å; W68-Y73 HydrophobicContact CZ3-CD1 4.15Å; W68-Y73 AromaticContact CZ3-CE1 3.75Å; W68-Y73 HydrophobicContact CZ3-CE1 3.75Å; W68-Y73 HydrophobicContact CZ3-CE2 4.48Å; W68-Y73 AromaticContact CZ3-CZ 3.97Å; W68-Y73 PolarHBondContact O-OH 3.22Å; L71-Y73 HydrophobicContact CB-CE2 3.87Å |
| 74 | V | 91 | Very high | 75 | Confident | 9 Ų | 9 | 88.3 Ų | 88.3 | 6% | 0.055 | 46% | 0.462 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.3 | 128.8 | 178.6 | -175.9 | 0 | 0 | 0 | 0 | 108.6 | T8 E9 E11 R42 | T8-V74 HydrophobicContact CG2-CG2 4.14Å; T8-V74 CarbonylContact O-C 3.56Å; T8-V74 VanDerWaalsContact O-CA 3.27Å; T8-V74 WeakPolarHBondContact O-CA 3.3Å; E9-V74 WeakPolarHBondContact O-CG1 3.24Å; E11-V74 HydrophobicContact CG-CG2 4.32Å; R42-V74 HydrophobicContact CG-CB 4.1Å; R42-V74 WeakPolarHBondContact CG-O 3.1Å; R42-V74 PolarHBondContact N-O 3.3Å; R42-V74 PolarHBondContact O-N 3.48Å |
| 75 | V | 91.8 | Very high | 72.6 | Confident | 5 Ų | 5 | 96 Ų | 96 | 3% | 0.03 | 50% | 0.498 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67 | 140.3 | 174.9 | -72 | 0 | 0 | 0 | 0 | 111.2 | V7 T8 E9 V31 F35 A38 L41 Y77 | V7-V75 HydrophobicContact CG1-CG1 3.52Å; T8-V75 PolarHBondContact O-N 3.49Å; E9-V75 HydrophobicContact CB-CG2 4.01Å; V31-V75 HydrophobicContact CG1-CG1 3.85Å; F35-V75 HydrophobicContact CB-CG1 3.96Å; F35-V75 HydrophobicContact CB-CG2 4.47Å; F35-V75 HydrophobicContact CD1-CG1 4.31Å; F35-V75 HydrophobicContact CD1-CG2 4.1Å; F35-V75 HydrophobicContact CD2-CG1 3.83Å; F35-V75 HydrophobicContact CE2-CG1 4.41Å; F35-V75 HydrophobicContact CG-CG1 3.76Å; F35-V75 HydrophobicContact CG-CG2 4.29Å; A38-V75 HydrophobicContact CB-CB 4.24Å; A38-V75 HydrophobicContact CB-CG1 4.15Å; L41-V75 HydrophobicContact CD2-CB 4.29Å; L41-V75 HydrophobicContact CD2-CG1 3.56Å; V75-Y77 HydrophobicContact CB-CE2 4.43Å; V75-Y77 HydrophobicContact CG2-CD2 4.32Å; V75-Y77 HydrophobicContact CG2-CE2 3.5Å |
| 76 | N | 87.3 | Confident | 70.5 | Confident | 48 Ų | 48 | 95.3 Ų | 95.3 | 26% | 0.257 | 49% | 0.494 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 121.2 | 167.9 | -64.7 | -45 | 0 | 0 | 0 | 107.6 | C39 G40 R42 | C39-N76 PolarHBondContact N-O 3.19Å; C39-N76 PolarHBondContact SG-O 2.9Å; G40-N76 PolarHBondContact O-N 3.36Å; R42-N76 WeakPolarHBondContact CD-OD1 3.45Å; R42-N76 WeakPolarHBondContact CG-OD1 3.33Å; R42-N76 PolarHBondContact NE-OD1 3.48Å |
| 77 | Y | 85.6 | Confident | 68.7 | Low | 94 Ų | 94 | 99.1 Ų | 99.1 | 37% | 0.369 | 50% | 0.495 | S | S | . | . | P | Polyproline II helix | trans | -87.1 | 143 | 165.4 | -63.1 | -76.3 | 0 | 0 | 0 | 109 | E9 F35 P36 A38 V75 K79 | E9-Y77 HydrophobicContact CB-CE2 4.47Å; F35-Y77 HydrophobicContact CB-CE1 4.49Å; P36-Y77 WeakPolarHBondContact O-CE1 3.49Å; A38-Y77 HydrophobicContact CB-CE1 4.26Å; V75-Y77 HydrophobicContact CB-CE2 4.43Å; V75-Y77 HydrophobicContact CG2-CD2 4.32Å; V75-Y77 HydrophobicContact CG2-CE2 3.5Å; Y77-K79 PolarHBondContact O-N 2.93Å |
| 78 | P | 78.3 | Confident | 66.2 | Low | 63 Ų | 63 | 104 Ų | 104 | 41% | 0.409 | 52% | 0.519 | S | S | . | . | P | Polyproline II helix | trans | -54.9 | 123 | 162.1 | 26.7 | -29 | 0 | 0 | 0 | 104.4 | G37 C39 D80 | G37-P78 WeakPolarHBondContact O-CD 3.14Å; C39-P78 HydrophobicContact CB-CG 4.46Å; P78-D80 PolarHBondContact O-N 3.22Å |
| 79 | K | 69.1 | Low | 63.6 | Low | 194 Ų | 194 | 111 Ų | 111 | 84% | 0.843 | 56% | 0.557 | S | S | * | * | trans | -61 | 104.3 | 166.6 | -77.9 | -178 | 177.4 | -176.2 | 0 | 104.4 | Y77 N81 | Y77-K79 PolarHBondContact O-N 2.93Å; K79-N81 PolarHBondContact O-N 2.98Å | ||
| 80 | D | 45.7 | Very low | 61.2 | Low | 144 Ų | 144 | 112.7 Ų | 112.7 | 77% | 0.77 | 57% | 0.566 | S | S | * | * | trans | -56 | 88.4 | 156.3 | -82.7 | -55.9 | 0 | 0 | 0 | 104.9 | P78 K82 | P78-D80 PolarHBondContact O-N 3.22Å; D80-K82 PolarHBondContact O-N 3.35Å | ||
| 81 | N | 40.1 | Very low | 58.7 | Low | 124 Ų | 124 | 111.4 Ų | 111.4 | 66% | 0.663 | 57% | 0.568 | S | S | * | * | trans | -57.1 | 90.2 | 141.8 | -107.6 | 65.2 | 0 | 0 | 0 | 102.4 | K79 R83 | K79-N81 PolarHBondContact O-N 2.98Å; N81-R83 HydrophobicContact CB-CG 4.36Å; N81-R83 PolarHBondContact O-N 2.96Å | ||
| 82 | K | 36.3 | Very low | 56.4 | Low | 197 Ų | 197 | 114.3 Ų | 114.3 | 86% | 0.857 | 59% | 0.592 | S | S | * | * | trans | -57.6 | 66.9 | 161.3 | -168.2 | 170.3 | -174 | 163.1 | 0 | 106.3 | D80 K84 | D80-K82 PolarHBondContact O-N 3.35Å; K82-K84 VanDerWaalsContact C-N 3.27Å; K82-K84 PolarHBondContact O-N 3.47Å | ||
| 83 | R | 44.5 | Very low | 54.3 | Low | 181 Ų | 181 | 116.1 Ų | 116.1 | 68% | 0.683 | 61% | 0.613 | S | S | * | * | trans | -61.2 | 103.9 | 158.4 | -78.4 | -176 | -92 | 152.9 | -5.4 | 101 | N81 M85 | N81-R83 HydrophobicContact CB-CG 4.36Å; N81-R83 PolarHBondContact O-N 2.96Å; R83-M85 PolarHBondContact O-N 3.14Å | ||
| 84 | K | 37.7 | Very low | 51.8 | Low | 200 Ų | 200 | 122.1 Ų | 122.1 | 87% | 0.87 | 65% | 0.65 | S | S | * | * | trans | -37.4 | 112.7 | 163.1 | -82.4 | 179.1 | 171.7 | -178 | 0 | 106.3 | K82 D86 | K82-K84 VanDerWaalsContact C-N 3.27Å; K82-K84 PolarHBondContact O-N 3.47Å; K84-D86 PolarHBondContact O-N 3.38Å; K84-D86 VanDerWaalsContact O-N 3.11Å | ||
| 85 | M | 36.4 | Very low | 49.1 | Very low | 183 Ų | 183 | 131.1 Ų | 131.1 | 90% | 0.901 | 69% | 0.688 | S | S | * | * | trans | -68.5 | 103.3 | 169.4 | -161.8 | 163.2 | 89.1 | 0 | 0 | 104 | R83 | R83-M85 PolarHBondContact O-N 3.14Š| ||
| 86 | D | 36.9 | Very low | 46.5 | Very low | 142 Ų | 142 | 136.6 Ų | 136.6 | 76% | 0.759 | 72% | 0.722 | S | S | * | * | trans | -101.7 | 112.7 | 161.5 | -158.1 | -111.7 | 0 | 0 | 0 | 104.8 | K84 T88 | K84-D86 PolarHBondContact O-N 3.38Å; K84-D86 VanDerWaalsContact O-N 3.11Å; D86-T88 PolarHBondContact O-N 2.89Å | ||
| 87 | E | 45.4 | Very low | 44.1 | Very low | 180 Ų | 180 | 142.5 Ų | 142.5 | 84% | 0.841 | 75% | 0.745 | S | S | * | * | trans | -55.3 | 114.8 | 166.8 | -89.5 | -167.4 | 87.8 | 0 | 0 | 108.1 | ||||
| 88 | T | 34.5 | Very low | 41.6 | Very low | 131 Ų | 131 | 147.2 Ų | 147.2 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | trans | -152.8 | 129.8 | 140.8 | -60.5 | 0 | 0 | 0 | 0 | 109.7 | D86 | D86-T88 PolarHBondContact O-N 2.89Š| ||
| 89 | D | 33.4 | Very low | 39.6 | Very low | 151 Ų | 151 | 147.9 Ų | 147.9 | 81% | 0.807 | 77% | 0.773 | S | S | * | * | trans | -45.8 | 159.9 | -176.6 | -153.2 | -125.4 | 0 | 0 | 0 | 119 | ||||
| 90 | A | 35.2 | Very low | 38.1 | Very low | 77 Ų | 77 | 145.4 Ų | 145.4 | 64% | 0.636 | 77% | 0.774 | S | S | * | * | trans | 67.7 | 108.8 | 148.9 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 91 | S | 34.5 | Very low | 37.9 | Very low | 110 Ų | 110 | 144.5 Ų | 144.5 | 77% | 0.769 | 77% | 0.765 | S | S | * | * | 86.4 | 127.1 | 127.5 | -158.7 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 92 | S | 38.9 | Very low | 38.2 | Very low | 107 Ų | 107 | 147.7 Ų | 147.7 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | trans | 82.4 | 84.4 | 153.9 | -53.4 | 0 | 0 | 0 | 0 | 117.7 | V94 | S92-V94 PolarHBondContact O-N 2.84Š| ||
| 93 | A | 46.3 | Very low | 38.9 | Very low | 98 Ų | 98 | 139.4 Ų | 139.4 | 81% | 0.81 | 74% | 0.739 | S | S | * | * | trans | 7.3 | 109.8 | 131.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 94 | V | 39.4 | Very low | 40 | Very low | 127 Ų | 127 | 133.6 Ų | 133.6 | 77% | 0.77 | 73% | 0.726 | S | S | * | * | 170.8 | 98 | 107.5 | 174.3 | 0 | 0 | 0 | 0 | 105.4 | S92 | S92-V94 PolarHBondContact O-N 2.84Š| |||
| 95 | K | 33.4 | Very low | 41.8 | Very low | 197 Ų | 197 | 126.3 Ų | 126.3 | 86% | 0.857 | 70% | 0.696 | S | S | * | * | trans | -141.8 | 89.5 | 160 | -122.8 | 170.4 | -174.3 | 175 | 0 | 108.9 | K97 | K95-K97 PolarHBondContact O-N 2.73Š| ||
| 96 | V | 36.9 | Very low | 44 | Very low | 121 Ų | 121 | 117.6 Ų | 117.6 | 73% | 0.733 | 65% | 0.653 | S | S | * | * | trans | -42.8 | 101.7 | 162.1 | 177.5 | 0 | 0 | 0 | 0 | 107.5 | R98 | V96-R98 PolarHBondContact O-N 3.11Š| ||
| 97 | K | 38.1 | Very low | 46.2 | Very low | 172 Ų | 172 | 110.9 Ų | 110.9 | 75% | 0.748 | 62% | 0.618 | S | S | * | * | trans | -74.6 | 86.7 | 174.4 | -68.2 | -177.3 | -178.8 | 175.4 | 0 | 106.7 | K95 A99 | K95-K97 PolarHBondContact O-N 2.73Å; K97-A99 PolarHBondContact O-N 2.91Å | ||
| 98 | R | 33.4 | Very low | 48 | Very low | 193 Ų | 193 | 102.4 Ų | 102.4 | 73% | 0.728 | 58% | 0.578 | S | S | * | * | trans | -46.2 | 124.6 | 163.1 | -75 | -179.4 | 175 | 172.3 | -1.6 | 107 | V96 V100 E154 | V96-R98 PolarHBondContact O-N 3.11Å; R98-V100 PolarHBondContact O-N 2.79Å; R98-V100 VanDerWaalsContact O-N 3.12Å; R98-E154 IonicContact NH1-OE1 2.91Å; R98-E154 PolarHBondContact NH1-OE1 2.84Å | ||
| 99 | A | 35.4 | Very low | 50.4 | Low | 77 Ų | 77 | 98.9 Ų | 98.9 | 64% | 0.636 | 55% | 0.554 | S | S | * | * | trans | -45.2 | 122 | 170 | 0 | 0 | 0 | 0 | 0 | 108.2 | K97 Q101 | K97-A99 PolarHBondContact O-N 2.91Å; A99-Q101 PolarHBondContact O-N 2.88Å | ||
| 100 | V | 38.5 | Very low | 52.6 | Low | 142 Ų | 142 | 93.1 Ų | 93.1 | 86% | 0.861 | 53% | 0.53 | S | S | * | . | trans | -68.4 | 85 | 165.9 | 178.7 | 0 | 0 | 0 | 0 | 105.6 | R98 K102 | R98-V100 PolarHBondContact O-N 2.79Å; R98-V100 VanDerWaalsContact O-N 3.12Å; V100-K102 PolarHBondContact O-N 3.3Å | ||
| 101 | Q | 40.1 | Very low | 54.9 | Low | 124 Ų | 124 | 89.6 Ų | 89.6 | 58% | 0.579 | 50% | 0.501 | S | S | * | . | trans | -52 | 124.8 | 162.3 | -73 | -74.6 | -18.1 | 0 | 0 | 106.2 | A99 T103 | A99-Q101 PolarHBondContact O-N 2.88Å; Q101-T103 PolarHBondContact O-N 3.07Å | ||
| 102 | K | 47.2 | Very low | 57.1 | Low | 191 Ų | 191 | 84.9 Ų | 84.9 | 83% | 0.83 | 47% | 0.467 | S | S | * | . | trans | -61 | 96 | 178 | -69.7 | 176 | 178.9 | 177.7 | 0 | 109 | V100 S104 | V100-K102 PolarHBondContact O-N 3.3Å; K102-S104 PolarHBondContact O-N 2.9Å | ||
| 103 | T | 50.7 | Low | 59.1 | Low | 23 Ų | 23 | 88.8 Ų | 88.8 | 14% | 0.141 | 47% | 0.466 | C | S | . | . | P | Polyproline II helix | trans | -70.6 | 126.3 | 172.3 | 51.7 | 0 | 0 | 0 | 0 | 109.2 | Q101 F152 T153 | Q101-T103 PolarHBondContact O-N 3.07Å; T103-F152 WeakPolarHBondContact CB-O 3.32Å; T103-F152 VanDerWaalsContact CG2-O 3.24Å; T103-F152 WeakPolarHBondContact CG2-O 3.38Å; T103-F152 PolarHBondContact OG1-O 2.76Å; T103-T153 VanDerWaalsContact CG2-O 3.3Å; T103-T153 WeakPolarHBondContact CG2-O 3.31Å |
| 104 | S | 67.1 | Low | 60.7 | Low | 59 Ų | 59 | 90.5 Ų | 90.5 | 41% | 0.413 | 46% | 0.455 | S | S | . | . | P | Polyproline II helix | trans | -87.9 | 149.5 | -179.9 | -57.4 | 0 | 0 | 0 | 0 | 110.5 | K102 L106 Q158 | K102-S104 PolarHBondContact O-N 2.9Å; S104-L106 PolarHBondContact O-N 2.79Å; S104-Q158 VanDerWaalsContact N-OE1 3.08Å; S104-Q158 PolarHBondContact O-NE2 3.41Å; S104-Q158 PolarHBondContact O-OE1 3.45Å |
| 105 | D | 76.9 | Confident | 62.7 | Low | 47 Ų | 47 | 84.6 Ų | 84.6 | 25% | 0.251 | 42% | 0.419 | S | S | . | . | P | Polyproline II helix | trans | -65.8 | 120.5 | 175.4 | -65.1 | -31.6 | 0 | 0 | 0 | 109.8 | R151 P178 | D105-R151 IonicContact OD1-CZ 3.92Å; D105-R151 IonicContact OD1-NE 3.08Å; D105-R151 PolarHBondContact OD1-NE 2.92Å; D105-R151 IonicContact OD1-NH2 3.64Å; D105-R151 PolarHBondContact OD1-NH2 3.46Å; D105-R151 IonicContact OD2-CZ 3.51Å; D105-R151 IonicContact OD2-NH2 3.22Å; D105-R151 PolarHBondContact OD2-NH2 3.47Å; D105-P178 WeakPolarHBondContact O-CD 2.88Å; D105-P178 VanDerWaalsContact O-CG 3.25Å; D105-P178 WeakPolarHBondContact O-CG 3.39Å |
| 106 | L | 80.8 | Confident | 65 | Low | 0 Ų | 0 | 77.7 Ų | 77.7 | 0% | 0 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.8 | 141.4 | 172.3 | -67.1 | -176.2 | 0 | 0 | 0 | 110 | S104 F149 V150 F152 Q158 V161 M162 L177 | S104-L106 PolarHBondContact O-N 2.79Å; L106-F149 CarbonylContact O-C 3.53Å; L106-F149 WeakPolarHBondContact O-CA 3.25Å; L106-V150 HydrophobicContact CB-CG1 3.79Å; L106-V150 HydrophobicContact CD1-CG1 4.45Å; L106-V150 PolarHBondContact N-O 3.41Å; L106-V150 PolarHBondContact O-N 3.15Å; L106-F152 HydrophobicContact CD1-CD2 4.2Å; L106-F152 HydrophobicContact CD1-CE2 4.01Å; L106-Q158 HydrophobicContact CD1-CG 3.53Å; L106-Q158 HydrophobicContact CD2-CG 3.73Å; L106-Q158 VanDerWaalsContact CD2-NE2 3.28Å; L106-Q158 HydrophobicContact CG-CG 3.62Å; L106-V161 HydrophobicContact CD1-CG1 4.08Å; L106-M162 HydrophobicContact CD1-CG 3.99Å; L106-M162 HydrophobicContact CD2-CG 3.58Å; L106-M162 HydrophobicContact CD2-SD 3.46Å; L106-M162 WeakPolarHBondContact CD2-SD 3.38Å; L106-M162 HydrophobicContact CG-CG 4.46Å; L106-L177 HydrophobicContact CD2-CD2 3.94Å; L106-L177 HydrophobicContact CD2-CG 4.22Å |
| 107 | I | 83.8 | Confident | 67.1 | Low | 2 Ų | 2 | 75.9 Ų | 75.9 | 1% | 0.01 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.3 | 128.3 | 167.2 | -171.8 | 169 | 0 | 0 | 0 | 109.5 | L109 F147 G148 F149 C175 K176 P178 L186 | I107-L109 HydrophobicContact CD1-CD2 3.87Å; I107-L109 HydrophobicContact CG1-CD2 4.03Å; I107-L109 HydrophobicContact CG1-CG 4.29Å; I107-F147 HydrophobicContact CD1-CD2 4.13Å; I107-G148 CarbonylContact C-O 3.53Å; I107-G148 WeakPolarHBondContact CA-O 3.29Å; I107-F149 HydrophobicContact CB-CD1 4.14Å; I107-F149 HydrophobicContact CB-CE1 3.93Å; I107-F149 HydrophobicContact CD1-CE1 4.06Å; I107-F149 HydrophobicContact CD1-CZ 4.07Å; I107-F149 HydrophobicContact CG1-CD1 4.41Å; I107-F149 HydrophobicContact CG1-CE1 4.03Å; I107-F149 HydrophobicContact CG1-CZ 4.37Å; I107-C175 WeakPolarHBondContact O-CA 3.31Å; I107-K176 HydrophobicContact CG2-CB 4.31Å; I107-K176 VanDerWaalsContact CG2-O 3.3Å; I107-K176 WeakPolarHBondContact CG2-O 3.39Å; I107-K176 PolarHBondContact N-O 2.75Å; I107-K176 PolarHBondContact O-N 3.05Å; I107-P178 HydrophobicContact CB-CB 4.15Å; I107-P178 HydrophobicContact CB-CG 4.47Å; I107-P178 HydrophobicContact CG2-CB 3.93Å; I107-P178 HydrophobicContact CG2-CG 4.47Å; I107-L186 HydrophobicContact CD1-CD1 3.57Å |
| 108 | V | 84.3 | Confident | 69.1 | Low | 1 Ų | 1 | 72.6 Ų | 72.6 | 1% | 0.006 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 117.3 | 174.7 | -169 | 0 | 0 | 0 | 0 | 107.8 | L111 F124 F147 G148 V150 C173 | V108-L111 HydrophobicContact CB-CD1 4.27Å; V108-L111 HydrophobicContact CB-CG 4.43Å; V108-L111 HydrophobicContact CG1-CD1 4.29Å; V108-L111 HydrophobicContact CG1-CD2 3.72Å; V108-L111 HydrophobicContact CG1-CG 3.95Å; V108-F124 HydrophobicContact CG1-CE2 4.49Å; V108-F124 HydrophobicContact CG1-CZ 4.17Å; V108-F124 HydrophobicContact CG2-CE2 3.86Å; V108-F124 HydrophobicContact CG2-CZ 3.84Å; V108-F147 CarbonylContact O-C 3.57Å; V108-F147 WeakPolarHBondContact O-CA 3.09Å; V108-F147 WeakPolarHBondContact O-CB 3.15Å; V108-G148 PolarHBondContact N-O 3.29Å; V108-G148 PolarHBondContact O-N 3.4Å; V108-V150 HydrophobicContact CG2-CB 4.4Å; V108-V150 HydrophobicContact CG2-CG1 3.68Å; V108-C173 HydrophobicContact CG1-CB 4.21Å |
| 109 | L | 83.9 | Confident | 71.6 | Confident | 57 Ų | 57 | 66.5 Ų | 66.5 | 30% | 0.298 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 145.8 | -177.6 | -63.9 | 170 | 0 | 0 | 0 | 110.3 | I107 F147 C173 D174 | I107-L109 HydrophobicContact CD1-CD2 3.87Å; I107-L109 HydrophobicContact CG1-CD2 4.03Å; I107-L109 HydrophobicContact CG1-CG 4.29Å; L109-F147 HydrophobicContact CD2-CB 3.96Å; L109-C173 WeakPolarHBondContact O-CA 3.33Å; L109-D174 PolarHBondContact N-O 2.82Å; L109-D174 PolarHBondContact O-N 2.94Å |
| 110 | G | 79.6 | Confident | 74 | Confident | 30 Ų | 30 | 62.9 Ų | 62.9 | 31% | 0.309 | 32% | 0.317 | S | S | . | . | S | Bend | trans | 86.7 | 21.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | G146 R171 C173 | G110-G146 PolarHBondContact N-O 2.83Å; G110-R171 WeakPolarHBondContact O-CD 3.37Å; G110-R171 WeakPolarHBondContact O-CG 3.28Å; G110-R171 PolarHBondContact O-NE 3.2Å; G110-C173 PolarHBondContact O-SG 2.64Å |
| 111 | L | 84.1 | Confident | 76.1 | Confident | 4 Ų | 4 | 60.8 Ų | 60.8 | 2% | 0.021 | 30% | 0.296 | C | S | . | . | trans | -66 | 139.8 | 178.8 | -68.7 | 171.7 | 0 | 0 | 0 | 111.7 | V108 T115 L120 G146 I168 | V108-L111 HydrophobicContact CB-CD1 4.27Å; V108-L111 HydrophobicContact CB-CG 4.43Å; V108-L111 HydrophobicContact CG1-CD1 4.29Å; V108-L111 HydrophobicContact CG1-CD2 3.72Å; V108-L111 HydrophobicContact CG1-CG 3.95Å; L111-T115 HydrophobicContact CD2-CG2 4.5Å; L111-L120 HydrophobicContact CD1-CD1 3.67Å; L111-L120 HydrophobicContact CD1-CD2 4.36Å; L111-L120 HydrophobicContact CD2-CD1 4.19Å; L111-L120 HydrophobicContact CD2-CD2 3.43Å; L111-L120 VanDerWaalsContact CD2-CD2 3.43Å; L111-L120 HydrophobicContact CD2-CG 4.24Å; L111-G146 PolarHBondContact N-O 2.95Å; L111-G146 VanDerWaalsContact O-CA 3.31Å; L111-G146 WeakPolarHBondContact O-CA 3.28Å; L111-I168 HydrophobicContact CD2-CD1 4.07Å | ||
| 112 | P | 80.6 | Confident | 78.2 | Confident | 10 Ų | 10 | 59.1 Ų | 59.1 | 7% | 0.065 | 29% | 0.291 | C | S | . | . | trans | -59.8 | 149.1 | 168.4 | -14.4 | 24.6 | 0 | 0 | 0 | 111.7 | K114 T115 D169 R171 | P112-K114 HydrophobicContact CB-CG 3.93Å; P112-K114 PolarHBondContact O-N 2.78Å; P112-T115 WeakPolarHBondContact CB-OG1 3.38Å; P112-T115 VanDerWaalsContact CD-OG1 3.25Å; P112-T115 WeakPolarHBondContact CD-OG1 3.27Å; P112-T115 WeakPolarHBondContact CG-OG1 3.48Å; P112-T115 WeakPolarHBondContact O-CB 3.14Å; P112-T115 PolarHBondContact O-N 3.48Å; P112-D169 HydrophobicContact CB-CB 4.36Å; P112-D169 HydrophobicContact CG-CB 3.61Å; P112-R171 HydrophobicContact CG-CB 3.83Å | ||
| 113 | W | 80.9 | Confident | 80.1 | Confident | 189 Ų | 189 | 52.9 Ų | 52.9 | 72% | 0.716 | 26% | 0.263 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.2 | -27.5 | 179.9 | -60.8 | -43 | 0 | 0 | 0 | 113.9 | T115 S144 | W113-T115 VanDerWaalsContact C-N 3.32Å; W113-S144 PolarHBondContact NE1-O 2.88Å; W113-S144 WeakPolarHBondContact O-CB 3.18Å; W113-S144 PolarHBondContact O-OG 3.05Å |
| 114 | K | 80.1 | Confident | 81.8 | Confident | 135 Ų | 135 | 51.8 Ų | 51.8 | 59% | 0.587 | 26% | 0.256 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.8 | -20 | 176.7 | 61.1 | 169.4 | 177.7 | 150.4 | 0 | 113.9 | P112 T116 D169 | P112-K114 HydrophobicContact CB-CG 3.93Å; P112-K114 PolarHBondContact O-N 2.78Å; K114-T116 PolarHBondContact O-N 2.84Å; K114-D169 VanDerWaalsContact CE-CG 3.48Å; K114-D169 WeakPolarHBondContact CE-OD1 3.48Å; K114-D169 VanDerWaalsContact NZ-CG 3.33Å; K114-D169 PolarHBondContact NZ-O 2.79Å; K114-D169 VanDerWaalsContact NZ-O 3.14Å; K114-D169 IonicContact NZ-OD1 2.74Å; K114-D169 PolarHBondContact NZ-OD1 3.49Å |
| 115 | T | 80.4 | Confident | 82.5 | Confident | 2 Ų | 2 | 52.3 Ų | 52.3 | 1% | 0.012 | 26% | 0.26 | C | S | . | . | trans | -72 | 129 | -172 | -58.8 | 0 | 0 | 0 | 0 | 110.6 | L111 P112 W113 D119 L120 I168 D169 | L111-T115 HydrophobicContact CD2-CG2 4.5Å; P112-T115 WeakPolarHBondContact CB-OG1 3.38Å; P112-T115 VanDerWaalsContact CD-OG1 3.25Å; P112-T115 WeakPolarHBondContact CD-OG1 3.27Å; P112-T115 WeakPolarHBondContact CG-OG1 3.48Å; P112-T115 WeakPolarHBondContact O-CB 3.14Å; P112-T115 PolarHBondContact O-N 3.48Å; W113-T115 VanDerWaalsContact C-N 3.32Å; T115-D119 HydrophobicContact CG2-CB 4.07Å; T115-L120 HydrophobicContact CG2-CD1 4.37Å; T115-L120 HydrophobicContact CG2-CD2 4.34Å; T115-L120 HydrophobicContact CG2-CG 3.85Å; T115-I168 HydrophobicContact CG2-CG2 3.98Å; T115-D169 PolarHBondContact OG1-OD2 3.29Å | ||
| 116 | T | 82.3 | Confident | 82.8 | Confident | 53 Ų | 53 | 55.1 Ų | 55.1 | 33% | 0.325 | 28% | 0.279 | S | S | . | . | trans | -97.1 | 169 | 179.3 | 69.2 | 0 | 0 | 0 | 0 | 111.9 | K114 Q118 D119 L120 | K114-T116 PolarHBondContact O-N 2.84Å; T116-Q118 PolarHBondContact O-N 3.19Å; T116-Q118 PolarHBondContact OG1-N 2.86Å; T116-D119 WeakPolarHBondContact CB-OD2 3.23Å; T116-D119 PolarHBondContact N-OD2 3.28Å; T116-D119 PolarHBondContact O-N 3.28Å; T116-D119 PolarHBondContact OG1-N 2.85Å; T116-D119 PolarHBondContact OG1-OD2 2.71Å; T116-L120 PolarHBondContact O-N 3.02Å | ||
| 117 | E | 81.6 | Confident | 82.8 | Confident | 82 Ų | 82 | 57.6 Ų | 57.6 | 38% | 0.383 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -61.1 | -33.3 | 173.1 | -69.8 | 170 | 152.9 | 0 | 0 | 111.6 | K121 V133 Q134 V135 | E117-K121 WeakPolarHBondContact O-CB 3.37Å; E117-K121 PolarHBondContact O-N 2.95Å; E117-V133 HydrophobicContact CB-CG1 4.24Å; E117-V133 HydrophobicContact CG-CG1 4.48Å; E117-Q134 VanDerWaalsContact OE1-CA 3.29Å; E117-Q134 WeakPolarHBondContact OE1-CA 3.48Å; E117-V135 HydrophobicContact CB-CG2 4.45Å; E117-V135 HydrophobicContact CG-CB 3.77Å; E117-V135 HydrophobicContact CG-CG2 3.61Å; E117-V135 VanDerWaalsContact CG-N 3.35Å; E117-V135 PolarHBondContact OE1-N 2.84Å |
| 118 | Q | 79.9 | Confident | 82.6 | Confident | 103 Ų | 103 | 58.3 Ų | 58.3 | 48% | 0.481 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -67.6 | -47.3 | 178.3 | -169.7 | 59.9 | 41.8 | 0 | 0 | 110.9 | T116 L120 K121 D122 | T116-Q118 PolarHBondContact O-N 3.19Å; T116-Q118 PolarHBondContact OG1-N 2.86Å; Q118-L120 VanDerWaalsContact C-N 3.29Å; Q118-L120 PolarHBondContact O-N 3.11Å; Q118-K121 WeakPolarHBondContact O-CB 3.45Å; Q118-K121 PolarHBondContact O-N 3.41Å; Q118-D122 PolarHBondContact NE2-OD1 3.35Å; Q118-D122 VanDerWaalsContact NE2-OD1 3.15Å; Q118-D122 PolarHBondContact NE2-OD2 3.46Å; Q118-D122 PolarHBondContact O-N 2.99Å |
| 119 | D | 85.3 | Confident | 82.1 | Confident | 66 Ų | 66 | 64.7 Ų | 64.7 | 35% | 0.353 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -59.5 | -41 | 177.9 | -56.4 | -48.5 | 0 | 0 | 0 | 111.9 | T115 T116 Y123 | T115-D119 HydrophobicContact CG2-CB 4.07Å; T116-D119 WeakPolarHBondContact CB-OD2 3.23Å; T116-D119 PolarHBondContact N-OD2 3.28Å; T116-D119 PolarHBondContact O-N 3.28Å; T116-D119 PolarHBondContact OG1-N 2.85Å; T116-D119 PolarHBondContact OG1-OD2 2.71Å; D119-Y123 VanDerWaalsContact O-CB 3.28Å; D119-Y123 WeakPolarHBondContact O-CB 3.46Å; D119-Y123 PolarHBondContact O-N 3.37Å |
| 120 | L | 85.3 | Confident | 82 | Confident | 1 Ų | 1 | 62.7 Ų | 62.7 | 1% | 0.005 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 175 | -79.8 | 167.4 | 0 | 0 | 0 | 112 | L111 T115 T116 Q118 Y123 F124 V133 V135 I168 | L111-L120 HydrophobicContact CD1-CD1 3.67Å; L111-L120 HydrophobicContact CD1-CD2 4.36Å; L111-L120 HydrophobicContact CD2-CD1 4.19Å; L111-L120 HydrophobicContact CD2-CD2 3.43Å; L111-L120 VanDerWaalsContact CD2-CD2 3.43Å; L111-L120 HydrophobicContact CD2-CG 4.24Å; T115-L120 HydrophobicContact CG2-CD1 4.37Å; T115-L120 HydrophobicContact CG2-CD2 4.34Å; T115-L120 HydrophobicContact CG2-CG 3.85Å; T116-L120 PolarHBondContact O-N 3.02Å; Q118-L120 VanDerWaalsContact C-N 3.29Å; Q118-L120 PolarHBondContact O-N 3.11Å; L120-Y123 PolarHBondContact O-N 3.06Å; L120-F124 HydrophobicContact CB-CD2 4.29Å; L120-F124 HydrophobicContact CB-CE2 4.43Å; L120-F124 HydrophobicContact CD2-CD2 4.15Å; L120-F124 HydrophobicContact CD2-CE2 3.51Å; L120-F124 HydrophobicContact CD2-CZ 4.39Å; L120-F124 WeakPolarHBondContact O-CB 3.48Å; L120-F124 WeakPolarHBondContact O-CD2 3.37Å; L120-F124 PolarHBondContact O-N 3.44Å; L120-V133 HydrophobicContact CB-CG1 3.67Å; L120-V133 HydrophobicContact CD1-CG1 4.08Å; L120-V135 HydrophobicContact CD1-CG2 3.3Å; L120-I168 HydrophobicContact CD2-CD1 3.53Å; L120-I168 HydrophobicContact CD2-CG2 4.44Å |
| 121 | K | 84.1 | Confident | 81.7 | Confident | 98 Ų | 98 | 66.1 Ų | 66.1 | 43% | 0.426 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.6 | -48.2 | 177.7 | -172.5 | -179 | 179.1 | -175.7 | 0 | 110.4 | E117 Q118 Y123 F124 S125 V133 | E117-K121 WeakPolarHBondContact O-CB 3.37Å; E117-K121 PolarHBondContact O-N 2.95Å; Q118-K121 WeakPolarHBondContact O-CB 3.45Å; Q118-K121 PolarHBondContact O-N 3.41Å; K121-Y123 PolarHBondContact O-N 3.02Å; K121-F124 PolarHBondContact O-N 2.96Å; K121-S125 WeakPolarHBondContact O-CB 3.42Å; K121-S125 PolarHBondContact O-N 2.93Å; K121-V133 HydrophobicContact CB-CG2 3.86Å; K121-V133 HydrophobicContact CG-CG2 4.27Å |
| 122 | D | 84.6 | Confident | 81.1 | Confident | 89 Ų | 89 | 68.6 Ų | 68.6 | 48% | 0.476 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -64.3 | -42 | -179.3 | -65.9 | -30.6 | 0 | 0 | 0 | 111 | Q118 | Q118-D122 PolarHBondContact NE2-OD1 3.35Å; Q118-D122 VanDerWaalsContact NE2-OD1 3.15Å; Q118-D122 PolarHBondContact NE2-OD2 3.46Å; Q118-D122 PolarHBondContact O-N 2.99Å |
| 123 | Y | 86.4 | Confident | 81.2 | Confident | 60 Ų | 60 | 69.2 Ų | 69.2 | 24% | 0.235 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -63.2 | -51.5 | 174.8 | -179.9 | -91.8 | 0 | 0 | 0 | 112.2 | D119 L120 K121 S125 T126 F127 H166 M167 I168 | D119-Y123 VanDerWaalsContact O-CB 3.28Å; D119-Y123 WeakPolarHBondContact O-CB 3.46Å; D119-Y123 PolarHBondContact O-N 3.37Å; L120-Y123 PolarHBondContact O-N 3.06Å; K121-Y123 PolarHBondContact O-N 3.02Å; Y123-S125 VanDerWaalsContact C-N 3.29Å; Y123-S125 PolarHBondContact O-N 3.48Å; Y123-T126 WeakPolarHBondContact O-CB 3.3Å; Y123-T126 PolarHBondContact O-N 2.92Å; Y123-T126 PolarHBondContact O-OG1 2.9Å; Y123-F127 HydrophobicContact CD1-CE2 4.16Å; Y123-F127 HydrophobicContact CE1-CD2 4.49Å; Y123-F127 AromaticContact CE1-CE2 3.57Å; Y123-F127 HydrophobicContact CE1-CE2 3.57Å; Y123-F127 HydrophobicContact CE1-CZ 4.32Å; Y123-F127 AromaticContact CZ-CE2 3.83Å; Y123-H166 HydrophobicContact CE1-CB 3.74Å; Y123-H166 AromaticContact CE1-CG 3.83Å; Y123-H166 AromaticContact CE1-ND1 3.37Å; Y123-H166 WeakPolarHBondContact CE1-ND1 3.47Å; Y123-H166 AromaticContact CZ-ND1 3.73Å; Y123-H166 WeakPolarHBondContact OH-CA 3.22Å; Y123-H166 WeakPolarHBondContact OH-CB 3.37Å; Y123-H166 PolarHBondContact OH-ND1 2.82Å; Y123-H166 VanDerWaalsContact OH-ND1 3.15Å; Y123-M167 WeakPolarHBondContact CE2-O 3.48Å; Y123-M167 PolarHBondContact OH-N 2.93Å; Y123-I168 HydrophobicContact CD1-CD1 3.82Å; Y123-I168 HydrophobicContact CD1-CG1 3.92Å; Y123-I168 HydrophobicContact CD2-CG1 4.36Å; Y123-I168 HydrophobicContact CE1-CD1 3.98Å; Y123-I168 HydrophobicContact CE1-CG1 3.86Å; Y123-I168 HydrophobicContact CE2-CG1 4.29Å; Y123-I168 HydrophobicContact CG-CD1 4.4Å; Y123-I168 HydrophobicContact CG-CG1 4.19Å |
| 124 | F | 85.4 | Confident | 81.2 | Confident | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -71.5 | -23.9 | -178 | -74.5 | -57.4 | 0 | 0 | 0 | 113.4 | V108 L120 K121 T126 F127 G128 V130 V150 F152 V161 I168 | V108-F124 HydrophobicContact CG1-CE2 4.49Å; V108-F124 HydrophobicContact CG1-CZ 4.17Å; V108-F124 HydrophobicContact CG2-CE2 3.86Å; V108-F124 HydrophobicContact CG2-CZ 3.84Å; L120-F124 HydrophobicContact CB-CD2 4.29Å; L120-F124 HydrophobicContact CB-CE2 4.43Å; L120-F124 HydrophobicContact CD2-CD2 4.15Å; L120-F124 HydrophobicContact CD2-CE2 3.51Å; L120-F124 HydrophobicContact CD2-CZ 4.39Å; L120-F124 WeakPolarHBondContact O-CB 3.48Å; L120-F124 WeakPolarHBondContact O-CD2 3.37Å; L120-F124 PolarHBondContact O-N 3.44Å; K121-F124 PolarHBondContact O-N 2.96Å; F124-T126 PolarHBondContact O-N 3.22Å; F124-F127 HydrophobicContact CD1-CD2 4.34Å; F124-F127 PolarHBondContact O-N 3.12Å; F124-G128 PolarHBondContact O-N 2.75Å; F124-V130 HydrophobicContact CB-CG2 3.67Å; F124-V150 HydrophobicContact CB-CG2 4.45Å; F124-V150 HydrophobicContact CD2-CB 4.38Å; F124-V150 HydrophobicContact CD2-CG1 4.45Å; F124-V150 HydrophobicContact CD2-CG2 4.03Å; F124-V150 HydrophobicContact CE2-CG1 4.28Å; F124-V150 HydrophobicContact CG-CG2 4.32Å; F124-F152 HydrophobicContact CB-CE1 3.93Å; F124-F152 HydrophobicContact CB-CZ 3.72Å; F124-F152 AromaticContact CD1-CZ 3.73Å; F124-F152 HydrophobicContact CD1-CZ 3.73Å; F124-F152 AromaticContact CG-CZ 3.86Å; F124-F152 HydrophobicContact CG-CZ 3.86Å; F124-V161 HydrophobicContact CD1-CG1 4.17Å; F124-V161 HydrophobicContact CE1-CG1 3.78Å; F124-I168 HydrophobicContact CE2-CD1 4.27Å; F124-I168 HydrophobicContact CZ-CD1 4.05Å |
| 125 | S | 82.4 | Confident | 81.3 | Confident | 70 Ų | 70 | 56.1 Ų | 56.1 | 49% | 0.49 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -19.8 | 173.5 | -166.8 | 0 | 0 | 0 | 0 | 112.9 | K121 Y123 F127 G128 | K121-S125 WeakPolarHBondContact O-CB 3.42Å; K121-S125 PolarHBondContact O-N 2.93Å; Y123-S125 VanDerWaalsContact C-N 3.29Å; Y123-S125 PolarHBondContact O-N 3.48Å; S125-F127 VanDerWaalsContact C-N 3.28Å; S125-G128 WeakPolarHBondContact CA-O 3.43Å |
| 126 | T | 83.8 | Confident | 81.3 | Confident | 106 Ų | 106 | 58 Ų | 58 | 65% | 0.65 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -23 | 173.4 | 66.9 | 0 | 0 | 0 | 0 | 113.3 | Y123 F124 | Y123-T126 WeakPolarHBondContact O-CB 3.3Å; Y123-T126 PolarHBondContact O-N 2.92Å; Y123-T126 PolarHBondContact O-OG1 2.9Å; F124-T126 PolarHBondContact O-N 3.22Å |
| 127 | F | 80.1 | Confident | 81 | Confident | 51 Ų | 51 | 59.9 Ų | 59.9 | 22% | 0.224 | 31% | 0.305 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.8 | -32.3 | 179 | -62.1 | -81.8 | 0 | 0 | 0 | 112.3 | Y123 F124 S125 T157 V161 H166 | Y123-F127 HydrophobicContact CD1-CE2 4.16Å; Y123-F127 HydrophobicContact CE1-CD2 4.49Å; Y123-F127 AromaticContact CE1-CE2 3.57Å; Y123-F127 HydrophobicContact CE1-CE2 3.57Å; Y123-F127 HydrophobicContact CE1-CZ 4.32Å; Y123-F127 AromaticContact CZ-CE2 3.83Å; F124-F127 HydrophobicContact CD1-CD2 4.34Å; F124-F127 PolarHBondContact O-N 3.12Å; S125-F127 VanDerWaalsContact C-N 3.28Å; F127-T157 HydrophobicContact CB-CG2 4.07Å; F127-T157 WeakPolarHBondContact O-CG2 3.47Å; F127-V161 HydrophobicContact CB-CG2 3.88Å; F127-V161 HydrophobicContact CD2-CG2 4.46Å; F127-V161 HydrophobicContact CG-CG2 4.03Å; F127-H166 AromaticContact CE2-ND1 3.84Å; F127-H166 AromaticContact CZ-CE1 3.96Å; F127-H166 AromaticContact CZ-ND1 3.8Å |
| 128 | G | 78.8 | Confident | 80.5 | Confident | 18 Ų | 18 | 58.5 Ų | 58.5 | 19% | 0.186 | 30% | 0.3 | C | S | . | . | S | Bend | trans | 172.5 | 179.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | F124 S125 V130 | F124-G128 PolarHBondContact O-N 2.75Å; S125-G128 WeakPolarHBondContact CA-O 3.43Å; G128-V130 PolarHBondContact O-N 2.84Å |
| 129 | E | 75.3 | Confident | 79.6 | Confident | 134 Ų | 134 | 62 Ų | 62 | 63% | 0.626 | 32% | 0.321 | S | S | * | . | trans | -70.2 | 125.3 | -174.9 | -177.5 | -176.4 | -173.4 | 0 | 0 | 111.6 | T153 | E129-T153 HydrophobicContact CB-CG2 3.97Å; E129-T153 WeakPolarHBondContact CB-OG1 2.83Å; E129-T153 HydrophobicContact CG-CG2 3.68Å; E129-T153 PolarHBondContact O-N 3.33Å; E129-T153 PolarHBondContact O-OG1 3.26Å | ||
| 130 | V | 80.8 | Confident | 78.5 | Confident | 16 Ų | 16 | 68.2 Ų | 68.2 | 10% | 0.097 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 118.5 | -177.4 | -174.7 | 0 | 0 | 0 | 0 | 109.5 | F124 G128 V133 V150 R151 F152 | F124-V130 HydrophobicContact CB-CG2 3.67Å; G128-V130 PolarHBondContact O-N 2.84Å; V130-V133 HydrophobicContact CG1-CG2 3.44Å; V130-V133 VanDerWaalsContact CG1-CG2 3.44Å; V130-V150 HydrophobicContact CG1-CG2 3.66Å; V130-R151 CarbonylContact C-O 3.56Å; V130-R151 WeakPolarHBondContact CG1-O 3.4Å; V130-F152 HydrophobicContact CG2-CD1 4.06Å; V130-F152 HydrophobicContact CG2-CE1 3.71Å; V130-F152 HydrophobicContact CG2-CZ 4.46Å |
| 131 | L | 73.5 | Confident | 77.8 | Confident | 101 Ų | 101 | 72.2 Ų | 72.2 | 53% | 0.529 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.3 | -43 | 176.4 | -76.2 | 177.1 | 0 | 0 | 0 | 112.2 | R151 F152 T153 | L131-R151 HydrophobicContact CB-CB 4.28Å; L131-R151 HydrophobicContact CB-CG 4.11Å; L131-R151 HydrophobicContact CD1-CG 4.07Å; L131-R151 PolarHBondContact N-O 2.64Å; L131-F152 WeakPolarHBondContact CD1-O 3.49Å; L131-T153 HydrophobicContact CD1-CG2 4.22Å; L131-T153 HydrophobicContact CD2-CG2 3.52Å; L131-T153 HydrophobicContact CG-CG2 3.52Å |
| 132 | M | 72.1 | Confident | 76.9 | Confident | 57 Ų | 57 | 70 Ų | 70 | 28% | 0.281 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.7 | 140.9 | -174.3 | -176.1 | 174.9 | -171.7 | 0 | 0 | 110.6 | Q134 V150 R151 I200 | M132-Q134 HydrophobicContact CE-CB 4.4Å; M132-V150 CarbonylContact O-C 3.48Å; M132-V150 WeakPolarHBondContact O-CA 3.48Å; M132-R151 HydrophobicContact CB-CB 4.15Å; M132-R151 PolarHBondContact N-O 2.98Å; M132-R151 PolarHBondContact O-N 2.81Å; M132-I200 HydrophobicContact CE-CB 4.02Å; M132-I200 HydrophobicContact CE-CG2 4.42Å |
| 133 | V | 81.8 | Confident | 76.1 | Confident | 22 Ų | 22 | 72.2 Ų | 72.2 | 13% | 0.133 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 138 | 167.9 | -178 | 0 | 0 | 0 | 0 | 107.9 | E117 L120 K121 V130 F149 V150 | E117-V133 HydrophobicContact CB-CG1 4.24Å; E117-V133 HydrophobicContact CG-CG1 4.48Å; L120-V133 HydrophobicContact CB-CG1 3.67Å; L120-V133 HydrophobicContact CD1-CG1 4.08Å; K121-V133 HydrophobicContact CB-CG2 3.86Å; K121-V133 HydrophobicContact CG-CG2 4.27Å; V130-V133 HydrophobicContact CG1-CG2 3.44Å; V130-V133 VanDerWaalsContact CG1-CG2 3.44Å; V133-F149 CarbonylContact C-O 3.56Å; V133-F149 WeakPolarHBondContact CA-O 3.5Å; V133-V150 HydrophobicContact CG2-CG2 4.14Å |
| 134 | Q | 80.4 | Confident | 75.6 | Confident | 39 Ų | 39 | 70 Ų | 70 | 18% | 0.182 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.9 | 121.9 | 172.7 | -176.7 | 169.9 | 76.1 | 0 | 0 | 111.2 | E117 M132 G148 F149 | E117-Q134 VanDerWaalsContact OE1-CA 3.29Å; E117-Q134 WeakPolarHBondContact OE1-CA 3.48Å; M132-Q134 HydrophobicContact CE-CB 4.4Å; Q134-G148 CarbonylContact O-C 3.4Å; Q134-G148 WeakPolarHBondContact O-CA 3.39Å; Q134-F149 PolarHBondContact N-O 3.19Å; Q134-F149 PolarHBondContact O-N 3.15Å |
| 135 | V | 83.7 | Confident | 74.9 | Confident | 10 Ų | 10 | 74.9 Ų | 74.9 | 6% | 0.061 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.5 | 124.3 | 174.9 | 175.7 | 0 | 0 | 0 | 0 | 108.6 | E117 L120 K137 | E117-V135 HydrophobicContact CB-CG2 4.45Å; E117-V135 HydrophobicContact CG-CB 3.77Å; E117-V135 HydrophobicContact CG-CG2 3.61Å; E117-V135 VanDerWaalsContact CG-N 3.35Å; E117-V135 PolarHBondContact OE1-N 2.84Å; L120-V135 HydrophobicContact CD1-CG2 3.3Å; V135-K137 HydrophobicContact CG1-CG 4.2Å; V135-K137 PolarHBondContact O-N 3.23Å |
| 136 | K | 79.1 | Confident | 74.7 | Confident | 41 Ų | 41 | 72.1 Ų | 72.1 | 18% | 0.178 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.8 | 115.1 | 176.1 | -68.6 | -55.7 | -165.7 | -172.4 | 0 | 109.6 | K145 F147 F149 | K136-K145 PolarHBondContact O-N 3.48Å; K136-F147 HydrophobicContact CB-CD2 4.07Å; K136-F147 HydrophobicContact CB-CE1 4.36Å; K136-F147 HydrophobicContact CB-CE2 3.57Å; K136-F147 HydrophobicContact CB-CZ 3.73Å; K136-F147 HydrophobicContact CG-CD2 4.13Å; K136-F147 HydrophobicContact CG-CE2 3.51Å; K136-F147 HydrophobicContact CG-CZ 4.05Å; K136-F147 PolarHBondContact N-O 3.34Å; K136-F147 VanDerWaalsContact N-O 3.07Å; K136-F149 HydrophobicContact CD-CE2 4.45Å; K136-F149 HydrophobicContact CG-CD2 4.14Å; K136-F149 HydrophobicContact CG-CE2 3.84Å |
| 137 | K | 77.6 | Confident | 74.7 | Confident | 94 Ų | 94 | 67.7 Ų | 67.7 | 41% | 0.409 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 149.3 | 172.9 | -54.6 | -177.1 | -178.7 | 178.2 | 0 | 109.4 | V135 H143 | V135-K137 HydrophobicContact CG1-CG 4.2Å; V135-K137 PolarHBondContact O-N 3.23Å; K137-H143 CarbonylContact C-O 3.58Å; K137-H143 WeakPolarHBondContact CA-O 3.45Å |
| 138 | D | 70.2 | Confident | 74.9 | Confident | 52 Ų | 52 | 65.3 Ų | 65.3 | 28% | 0.278 | 34% | 0.34 | S | S | . | . | trans | -70.1 | 128.6 | 173.4 | -161.1 | -60.4 | 0 | 0 | 0 | 109.5 | K140 G142 H143 K145 | D138-K140 PolarHBondContact O-N 3.35Å; D138-K140 PolarHBondContact OD1-N 2.8Å; D138-G142 WeakPolarHBondContact O-CA 3.44Å; D138-G142 PolarHBondContact O-N 3.33Å; D138-H143 PolarHBondContact N-O 3.25Å; D138-K145 HydrophobicContact CB-CG 4.38Å; D138-K145 WeakPolarHBondContact OD2-CE 3.14Å | ||
| 139 | L | 60.5 | Low | 75.2 | Confident | 176 Ų | 176 | 66 Ų | 66 | 92% | 0.921 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | -22 | -177.2 | -79.4 | 79.4 | 0 | 0 | 0 | 112.5 | ||
| 140 | K | 63 | Low | 75.6 | Confident | 198 Ų | 198 | 59.7 Ų | 59.7 | 86% | 0.861 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.2 | -36 | -177.4 | -66.5 | -177 | 178 | 179.4 | 0 | 112.6 | D138 | D138-K140 PolarHBondContact O-N 3.35Å; D138-K140 PolarHBondContact OD1-N 2.8Å |
| 141 | T | 69.4 | Low | 75.6 | Confident | 85 Ų | 85 | 61 Ų | 61 | 52% | 0.521 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.8 | -13.3 | -176.2 | 61.7 | 0 | 0 | 0 | 0 | 113.1 | H143 | T141-H143 PolarHBondContact O-CD2 3.02Å; T141-H143 PolarHBondContact O-N 3.09Å; T141-H143 VanDerWaalsContact O-N 3.15Å; T141-H143 PolarHBondContact OG1-N 2.98Å |
| 142 | G | 65.1 | Low | 76 | Confident | 50 Ų | 50 | 56.2 Ų | 56.2 | 52% | 0.515 | 29% | 0.286 | S | S | . | . | trans | 69.7 | 0.1 | -172.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | D138 | D138-G142 WeakPolarHBondContact O-CA 3.44Å; D138-G142 PolarHBondContact O-N 3.33Å | ||
| 143 | H | 68.9 | Low | 76.1 | Confident | 137 Ų | 137 | 55.5 Ų | 55.5 | 63% | 0.634 | 29% | 0.285 | S | S | * | . | trans | -80.5 | 137.8 | -176.8 | -68.5 | -166.6 | 0 | 0 | 0 | 110.6 | K137 D138 T141 K145 | K137-H143 CarbonylContact C-O 3.58Å; K137-H143 WeakPolarHBondContact CA-O 3.45Å; D138-H143 PolarHBondContact N-O 3.25Å; T141-H143 PolarHBondContact O-CD2 3.02Å; T141-H143 PolarHBondContact O-N 3.09Å; T141-H143 VanDerWaalsContact O-N 3.15Å; T141-H143 PolarHBondContact OG1-N 2.98Å; H143-K145 PolarHBondContact O-N 3.41Å | ||
| 144 | S | 75.2 | Confident | 75.7 | Confident | 12 Ų | 12 | 58.2 Ų | 58.2 | 8% | 0.084 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.8 | 134.2 | 175.8 | -59.2 | 0 | 0 | 0 | 0 | 111 | W113 G146 | W113-S144 PolarHBondContact NE1-O 2.88Å; W113-S144 WeakPolarHBondContact O-CB 3.18Å; W113-S144 PolarHBondContact O-OG 3.05Å; S144-G146 PolarHBondContact O-N 3Å |
| 145 | K | 71.4 | Confident | 75.4 | Confident | 104 Ų | 104 | 62 Ų | 62 | 45% | 0.452 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.1 | 2.8 | 176.3 | -67.5 | -167.2 | 172.2 | -172.7 | 0 | 113.4 | K136 D138 H143 F147 | K136-K145 PolarHBondContact O-N 3.48Å; D138-K145 HydrophobicContact CB-CG 4.38Å; D138-K145 WeakPolarHBondContact OD2-CE 3.14Å; H143-K145 PolarHBondContact O-N 3.41Å; K145-F147 VanDerWaalsContact C-N 3.31Å; K145-F147 HydrophobicContact CB-CD1 3.61Å; K145-F147 HydrophobicContact CB-CE1 3.35Å; K145-F147 HydrophobicContact CB-CZ 4.31Å; K145-F147 HydrophobicContact CD-CE1 3.78Å; K145-F147 HydrophobicContact CD-CZ 4.19Å; K145-F147 HydrophobicContact CG-CE1 4.19Å |
| 146 | G | 77.9 | Confident | 75 | Confident | 12 Ų | 12 | 69.2 Ų | 69.2 | 12% | 0.124 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 75 | 19.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | G110 L111 S144 | G110-G146 PolarHBondContact N-O 2.83Å; L111-G146 PolarHBondContact N-O 2.95Å; L111-G146 VanDerWaalsContact O-CA 3.31Å; L111-G146 WeakPolarHBondContact O-CA 3.28Å; S144-G146 PolarHBondContact O-N 3Å |
| 147 | F | 83.3 | Confident | 74.9 | Confident | 13 Ų | 13 | 67.8 Ų | 67.8 | 6% | 0.057 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.3 | 157.4 | 172.3 | 71.8 | -88.9 | 0 | 0 | 0 | 112.2 | I107 V108 L109 K136 K145 F149 L186 | I107-F147 HydrophobicContact CD1-CD2 4.13Å; V108-F147 CarbonylContact O-C 3.57Å; V108-F147 WeakPolarHBondContact O-CA 3.09Å; V108-F147 WeakPolarHBondContact O-CB 3.15Å; L109-F147 HydrophobicContact CD2-CB 3.96Å; K136-F147 HydrophobicContact CB-CD2 4.07Å; K136-F147 HydrophobicContact CB-CE1 4.36Å; K136-F147 HydrophobicContact CB-CE2 3.57Å; K136-F147 HydrophobicContact CB-CZ 3.73Å; K136-F147 HydrophobicContact CG-CD2 4.13Å; K136-F147 HydrophobicContact CG-CE2 3.51Å; K136-F147 HydrophobicContact CG-CZ 4.05Å; K136-F147 PolarHBondContact N-O 3.34Å; K136-F147 VanDerWaalsContact N-O 3.07Å; K145-F147 VanDerWaalsContact C-N 3.31Å; K145-F147 HydrophobicContact CB-CD1 3.61Å; K145-F147 HydrophobicContact CB-CE1 3.35Å; K145-F147 HydrophobicContact CB-CZ 4.31Å; K145-F147 HydrophobicContact CD-CE1 3.78Å; K145-F147 HydrophobicContact CD-CZ 4.19Å; K145-F147 HydrophobicContact CG-CE1 4.19Å; F147-F149 HydrophobicContact CD2-CE2 4.31Å; F147-F149 HydrophobicContact CE2-CE2 4.08Å; F147-F149 HydrophobicContact CE2-CZ 4.46Å; F147-L186 HydrophobicContact CE1-CD2 4.4Å; F147-L186 HydrophobicContact CE2-CB 4.2Å; F147-L186 HydrophobicContact CZ-CB 3.96Å |
| 148 | G | 85.1 | Confident | 75.1 | Confident | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.2 | 174.9 | -179 | 0 | 0 | 0 | 0 | 0 | 111.6 | I107 V108 Q134 | I107-G148 CarbonylContact C-O 3.53Å; I107-G148 WeakPolarHBondContact CA-O 3.29Å; V108-G148 PolarHBondContact N-O 3.29Å; V108-G148 PolarHBondContact O-N 3.4Å; Q134-G148 CarbonylContact O-C 3.4Å; Q134-G148 WeakPolarHBondContact O-CA 3.39Å |
| 149 | F | 84.9 | Confident | 75.4 | Confident | 32 Ų | 32 | 64.2 Ų | 64.2 | 14% | 0.14 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 141.7 | 177.9 | -64.1 | -85.2 | 0 | 0 | 0 | 110 | L106 I107 V133 Q134 K136 F147 P178 | L106-F149 CarbonylContact O-C 3.53Å; L106-F149 WeakPolarHBondContact O-CA 3.25Å; I107-F149 HydrophobicContact CB-CD1 4.14Å; I107-F149 HydrophobicContact CB-CE1 3.93Å; I107-F149 HydrophobicContact CD1-CE1 4.06Å; I107-F149 HydrophobicContact CD1-CZ 4.07Å; I107-F149 HydrophobicContact CG1-CD1 4.41Å; I107-F149 HydrophobicContact CG1-CE1 4.03Å; I107-F149 HydrophobicContact CG1-CZ 4.37Å; V133-F149 CarbonylContact C-O 3.56Å; V133-F149 WeakPolarHBondContact CA-O 3.5Å; Q134-F149 PolarHBondContact N-O 3.19Å; Q134-F149 PolarHBondContact O-N 3.15Å; K136-F149 HydrophobicContact CD-CE2 4.45Å; K136-F149 HydrophobicContact CG-CD2 4.14Å; K136-F149 HydrophobicContact CG-CE2 3.84Å; F147-F149 HydrophobicContact CD2-CE2 4.31Å; F147-F149 HydrophobicContact CE2-CE2 4.08Å; F147-F149 HydrophobicContact CE2-CZ 4.46Å; F149-P178 HydrophobicContact CE1-CB 4.35Å; F149-P178 HydrophobicContact CE1-CG 4.39Å |
| 150 | V | 84.4 | Confident | 76.4 | Confident | 2 Ų | 2 | 62 Ų | 62 | 1% | 0.012 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.7 | 136.1 | 175.4 | 63 | 0 | 0 | 0 | 0 | 110.1 | L106 V108 F124 V130 M132 V133 F152 | L106-V150 HydrophobicContact CB-CG1 3.79Å; L106-V150 HydrophobicContact CD1-CG1 4.45Å; L106-V150 PolarHBondContact N-O 3.41Å; L106-V150 PolarHBondContact O-N 3.15Å; V108-V150 HydrophobicContact CG2-CB 4.4Å; V108-V150 HydrophobicContact CG2-CG1 3.68Å; F124-V150 HydrophobicContact CB-CG2 4.45Å; F124-V150 HydrophobicContact CD2-CB 4.38Å; F124-V150 HydrophobicContact CD2-CG1 4.45Å; F124-V150 HydrophobicContact CD2-CG2 4.03Å; F124-V150 HydrophobicContact CE2-CG1 4.28Å; F124-V150 HydrophobicContact CG-CG2 4.32Å; V130-V150 HydrophobicContact CG1-CG2 3.66Å; M132-V150 CarbonylContact O-C 3.48Å; M132-V150 WeakPolarHBondContact O-CA 3.48Å; V133-V150 HydrophobicContact CG2-CG2 4.14Å; V150-F152 HydrophobicContact CB-CE2 4.49Å; V150-F152 HydrophobicContact CG1-CE2 3.85Å; V150-F152 HydrophobicContact CG2-CD2 4.34Å; V150-F152 HydrophobicContact CG2-CE2 3.79Å; V150-F152 HydrophobicContact CG2-CZ 3.97Å |
| 151 | R | 80.6 | Confident | 77.4 | Confident | 44 Ų | 44 | 52.6 Ų | 52.6 | 17% | 0.166 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.5 | 126.9 | 174.7 | -174.5 | -176.8 | -68.8 | -179.1 | -0.2 | 109 | D105 V130 L131 M132 | D105-R151 IonicContact OD1-CZ 3.92Å; D105-R151 IonicContact OD1-NE 3.08Å; D105-R151 PolarHBondContact OD1-NE 2.92Å; D105-R151 IonicContact OD1-NH2 3.64Å; D105-R151 PolarHBondContact OD1-NH2 3.46Å; D105-R151 IonicContact OD2-CZ 3.51Å; D105-R151 IonicContact OD2-NH2 3.22Å; D105-R151 PolarHBondContact OD2-NH2 3.47Å; V130-R151 CarbonylContact C-O 3.56Å; V130-R151 WeakPolarHBondContact CG1-O 3.4Å; L131-R151 HydrophobicContact CB-CB 4.28Å; L131-R151 HydrophobicContact CB-CG 4.11Å; L131-R151 HydrophobicContact CD1-CG 4.07Å; L131-R151 PolarHBondContact N-O 2.64Å; M132-R151 HydrophobicContact CB-CB 4.15Å; M132-R151 PolarHBondContact N-O 2.98Å; M132-R151 PolarHBondContact O-N 2.81Å |
| 152 | F | 81.4 | Confident | 78 | Confident | 1 Ų | 1 | 51.8 Ų | 51.8 | 0% | 0.004 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.8 | 160.8 | 175.4 | -70.2 | -84.2 | 0 | 0 | 0 | 111.3 | T103 L106 F124 V130 L131 V150 T157 V161 | T103-F152 WeakPolarHBondContact CB-O 3.32Å; T103-F152 VanDerWaalsContact CG2-O 3.24Å; T103-F152 WeakPolarHBondContact CG2-O 3.38Å; T103-F152 PolarHBondContact OG1-O 2.76Å; L106-F152 HydrophobicContact CD1-CD2 4.2Å; L106-F152 HydrophobicContact CD1-CE2 4.01Å; F124-F152 HydrophobicContact CB-CE1 3.93Å; F124-F152 HydrophobicContact CB-CZ 3.72Å; F124-F152 AromaticContact CD1-CZ 3.73Å; F124-F152 HydrophobicContact CD1-CZ 3.73Å; F124-F152 AromaticContact CG-CZ 3.86Å; F124-F152 HydrophobicContact CG-CZ 3.86Å; V130-F152 HydrophobicContact CG2-CD1 4.06Å; V130-F152 HydrophobicContact CG2-CE1 3.71Å; V130-F152 HydrophobicContact CG2-CZ 4.46Å; L131-F152 WeakPolarHBondContact CD1-O 3.49Å; V150-F152 HydrophobicContact CB-CE2 4.49Å; V150-F152 HydrophobicContact CG1-CE2 3.85Å; V150-F152 HydrophobicContact CG2-CD2 4.34Å; V150-F152 HydrophobicContact CG2-CE2 3.79Å; V150-F152 HydrophobicContact CG2-CZ 3.97Å; F152-T157 HydrophobicContact CD1-CG2 3.52Å; F152-T157 HydrophobicContact CE1-CG2 3.77Å; F152-T157 HydrophobicContact CG-CG2 4.07Å; F152-V161 HydrophobicContact CE1-CG2 4.44Å; F152-V161 HydrophobicContact CE2-CB 4.35Å; F152-V161 HydrophobicContact CE2-CG1 4.11Å; F152-V161 HydrophobicContact CE2-CG2 4.19Å; F152-V161 HydrophobicContact CZ-CB 4.45Å; F152-V161 HydrophobicContact CZ-CG1 4.26Å; F152-V161 HydrophobicContact CZ-CG2 3.84Å |
| 153 | T | 74.2 | Confident | 78.8 | Confident | 42 Ų | 42 | 54.5 Ų | 54.5 | 26% | 0.258 | 27% | 0.27 | S | S | . | . | S | Bend | trans | -75.8 | -34.5 | 168.9 | 53 | 0 | 0 | 0 | 0 | 112.4 | T103 E129 L131 | T103-T153 VanDerWaalsContact CG2-O 3.3Å; T103-T153 WeakPolarHBondContact CG2-O 3.31Å; E129-T153 HydrophobicContact CB-CG2 3.97Å; E129-T153 WeakPolarHBondContact CB-OG1 2.83Å; E129-T153 HydrophobicContact CG-CG2 3.68Å; E129-T153 PolarHBondContact O-N 3.33Å; E129-T153 PolarHBondContact O-OG1 3.26Å; L131-T153 HydrophobicContact CD1-CG2 4.22Å; L131-T153 HydrophobicContact CD2-CG2 3.52Å; L131-T153 HydrophobicContact CG-CG2 3.52Å |
| 154 | E | 73.6 | Confident | 79.2 | Confident | 78 Ų | 78 | 51.1 Ų | 51.1 | 36% | 0.364 | 25% | 0.254 | S | S | . | . | trans | -110.3 | 132.5 | -174.5 | -66.3 | -172.1 | 161.2 | 0 | 0 | 112.2 | R98 T157 Q158 | R98-E154 IonicContact NH1-OE1 2.91Å; R98-E154 PolarHBondContact NH1-OE1 2.84Å; E154-T157 PolarHBondContact O-N 2.94Å; E154-Q158 PolarHBondContact O-N 3.24Å | ||
| 155 | Y | 73.6 | Confident | 79.4 | Confident | 120 Ų | 120 | 57 Ų | 57 | 47% | 0.471 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -67.5 | -34.2 | 177 | -179.9 | -103.3 | 0 | 0 | 0 | 112.5 | T157 Q158 V159 | Y155-T157 PolarHBondContact O-N 2.88Å; Y155-Q158 WeakPolarHBondContact O-CA 3.21Å; Y155-Q158 VanDerWaalsContact O-CB 3.24Å; Y155-Q158 WeakPolarHBondContact O-CB 3.29Å; Y155-Q158 PolarHBondContact O-N 2.9Å; Y155-Q158 VanDerWaalsContact O-N 3.14Å; Y155-V159 HydrophobicContact CD1-CG2 4.06Å; Y155-V159 HydrophobicContact CE1-CG2 3.55Å; Y155-V159 HydrophobicContact CE2-CG2 4.19Å; Y155-V159 WeakPolarHBondContact O-CG2 3.25Å; Y155-V159 PolarHBondContact O-N 3.11Å |
| 156 | E | 75.1 | Confident | 80 | Confident | 160 Ų | 160 | 52 Ų | 52 | 75% | 0.748 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -62.4 | -44.1 | 177.9 | -64.1 | -176.5 | 175.7 | 0 | 0 | 111.4 | Q158 V159 K160 | E156-Q158 VanDerWaalsContact C-N 3.29Å; E156-Q158 PolarHBondContact O-N 2.86Å; E156-V159 PolarHBondContact O-N 3.1Å; E156-K160 WeakPolarHBondContact O-CB 3.46Å; E156-K160 PolarHBondContact O-N 2.95Å |
| 157 | T | 78.4 | Confident | 80.2 | Confident | 11 Ų | 11 | 55.2 Ų | 55.2 | 7% | 0.067 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.4 | -42.9 | 172.5 | -60.7 | 0 | 0 | 0 | 0 | 111.1 | F127 F152 E154 Y155 V159 K160 V161 | F127-T157 HydrophobicContact CB-CG2 4.07Å; F127-T157 WeakPolarHBondContact O-CG2 3.47Å; F152-T157 HydrophobicContact CD1-CG2 3.52Å; F152-T157 HydrophobicContact CE1-CG2 3.77Å; F152-T157 HydrophobicContact CG-CG2 4.07Å; E154-T157 PolarHBondContact O-N 2.94Å; Y155-T157 PolarHBondContact O-N 2.88Å; T157-V159 PolarHBondContact O-N 3.01Å; T157-K160 PolarHBondContact O-N 2.91Å; T157-V161 HydrophobicContact CG2-CG2 4.33Å; T157-V161 WeakPolarHBondContact O-CB 3.45Å; T157-V161 VanDerWaalsContact O-CG2 3.25Å; T157-V161 WeakPolarHBondContact O-CG2 3.41Å; T157-V161 PolarHBondContact O-N 2.93Å |
| 158 | Q | 79.9 | Confident | 80.3 | Confident | 3 Ų | 3 | 54.9 Ų | 54.9 | 1% | 0.014 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58.2 | -48.7 | 176.8 | -167.4 | -172.8 | -22.8 | 0 | 0 | 112 | S104 L106 E154 Y155 E156 K160 V161 M162 | S104-Q158 VanDerWaalsContact N-OE1 3.08Å; S104-Q158 PolarHBondContact O-NE2 3.41Å; S104-Q158 PolarHBondContact O-OE1 3.45Å; L106-Q158 HydrophobicContact CD1-CG 3.53Å; L106-Q158 HydrophobicContact CD2-CG 3.73Å; L106-Q158 VanDerWaalsContact CD2-NE2 3.28Å; L106-Q158 HydrophobicContact CG-CG 3.62Å; E154-Q158 PolarHBondContact O-N 3.24Å; Y155-Q158 WeakPolarHBondContact O-CA 3.21Å; Y155-Q158 VanDerWaalsContact O-CB 3.24Å; Y155-Q158 WeakPolarHBondContact O-CB 3.29Å; Y155-Q158 PolarHBondContact O-N 2.9Å; Y155-Q158 VanDerWaalsContact O-N 3.14Å; E156-Q158 VanDerWaalsContact C-N 3.29Å; E156-Q158 PolarHBondContact O-N 2.86Å; Q158-K160 PolarHBondContact O-N 3.03Å; Q158-V161 PolarHBondContact O-N 3.21Å; Q158-M162 WeakPolarHBondContact O-CG 3.4Å; Q158-M162 PolarHBondContact O-N 2.95Å |
| 159 | V | 76.8 | Confident | 80 | Confident | 68 Ų | 68 | 58.3 Ų | 58.3 | 41% | 0.412 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -63.4 | -42 | 179.1 | 175.4 | 0 | 0 | 0 | 0 | 111 | Y155 E156 T157 M162 S163 | Y155-V159 HydrophobicContact CD1-CG2 4.06Å; Y155-V159 HydrophobicContact CE1-CG2 3.55Å; Y155-V159 HydrophobicContact CE2-CG2 4.19Å; Y155-V159 WeakPolarHBondContact O-CG2 3.25Å; Y155-V159 PolarHBondContact O-N 3.11Å; E156-V159 PolarHBondContact O-N 3.1Å; T157-V159 PolarHBondContact O-N 3.01Å; V159-M162 PolarHBondContact O-N 2.84Å; V159-S163 WeakPolarHBondContact O-CB 3.27Å; V159-S163 PolarHBondContact O-N 3.08Å |
| 160 | K | 82.4 | Confident | 79.6 | Confident | 131 Ų | 131 | 60.1 Ų | 60.1 | 57% | 0.57 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -62.3 | -44.4 | 177.3 | -170.7 | 177.5 | -178 | -178.7 | 0 | 111.9 | E156 T157 Q158 M162 S163 Q164 | E156-K160 WeakPolarHBondContact O-CB 3.46Å; E156-K160 PolarHBondContact O-N 2.95Å; T157-K160 PolarHBondContact O-N 2.91Å; Q158-K160 PolarHBondContact O-N 3.03Å; K160-M162 VanDerWaalsContact C-N 3.35Å; K160-S163 PolarHBondContact O-N 2.86Å; K160-Q164 WeakPolarHBondContact O-CG 3.29Å; K160-Q164 PolarHBondContact O-N 2.76Å; K160-Q164 PolarHBondContact O-NE2 2.76Å |
| 161 | V | 84.8 | Confident | 79.4 | Confident | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64.1 | -38.5 | 176.2 | 168.6 | 0 | 0 | 0 | 0 | 111.3 | L106 F124 F127 F152 T157 Q158 S163 Q164 H166 C175 | L106-V161 HydrophobicContact CD1-CG1 4.08Å; F124-V161 HydrophobicContact CD1-CG1 4.17Å; F124-V161 HydrophobicContact CE1-CG1 3.78Å; F127-V161 HydrophobicContact CB-CG2 3.88Å; F127-V161 HydrophobicContact CD2-CG2 4.46Å; F127-V161 HydrophobicContact CG-CG2 4.03Å; F152-V161 HydrophobicContact CE1-CG2 4.44Å; F152-V161 HydrophobicContact CE2-CB 4.35Å; F152-V161 HydrophobicContact CE2-CG1 4.11Å; F152-V161 HydrophobicContact CE2-CG2 4.19Å; F152-V161 HydrophobicContact CZ-CB 4.45Å; F152-V161 HydrophobicContact CZ-CG1 4.26Å; F152-V161 HydrophobicContact CZ-CG2 3.84Å; T157-V161 HydrophobicContact CG2-CG2 4.33Å; T157-V161 WeakPolarHBondContact O-CB 3.45Å; T157-V161 VanDerWaalsContact O-CG2 3.25Å; T157-V161 WeakPolarHBondContact O-CG2 3.41Å; T157-V161 PolarHBondContact O-N 2.93Å; Q158-V161 PolarHBondContact O-N 3.21Å; V161-S163 VanDerWaalsContact C-N 3.35Å; V161-Q164 VanDerWaalsContact O-O 3.13Å; V161-H166 WeakPolarHBondContact CG1-NE2 3.35Å; V161-H166 PolarHBondContact O-NE2 2.74Å; V161-C175 HydrophobicContact CG1-CB 3.89Å |
| 162 | M | 81.9 | Confident | 79.6 | Confident | 67 Ų | 67 | 70.7 Ų | 70.7 | 33% | 0.33 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -69.2 | -30.5 | 175.8 | -73.5 | 179.9 | 65.4 | 0 | 0 | 113.9 | L106 Q158 V159 K160 Q164 L177 | L106-M162 HydrophobicContact CD1-CG 3.99Å; L106-M162 HydrophobicContact CD2-CG 3.58Å; L106-M162 HydrophobicContact CD2-SD 3.46Å; L106-M162 WeakPolarHBondContact CD2-SD 3.38Å; L106-M162 HydrophobicContact CG-CG 4.46Å; Q158-M162 WeakPolarHBondContact O-CG 3.4Å; Q158-M162 PolarHBondContact O-N 2.95Å; V159-M162 PolarHBondContact O-N 2.84Å; K160-M162 VanDerWaalsContact C-N 3.35Å; M162-Q164 VanDerWaalsContact C-N 3.31Å; M162-L177 HydrophobicContact CE-CB 4.27Å; M162-L177 HydrophobicContact CE-CD1 3.89Å; M162-L177 HydrophobicContact CE-CG 3.67Å; M162-L177 HydrophobicContact SD-CD1 4.2Å; M162-L177 HydrophobicContact SD-CD2 4.5Å; M162-L177 HydrophobicContact SD-CG 3.82Å |
| 163 | S | 80.1 | Confident | 79.7 | Confident | 108 Ų | 108 | 70.6 Ų | 70.6 | 76% | 0.755 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -80 | -12 | -176.4 | -169.1 | 0 | 0 | 0 | 0 | 113.8 | V159 K160 V161 | V159-S163 WeakPolarHBondContact O-CB 3.27Å; V159-S163 PolarHBondContact O-N 3.08Å; K160-S163 PolarHBondContact O-N 2.86Å; V161-S163 VanDerWaalsContact C-N 3.35Å |
| 164 | Q | 77.7 | Confident | 80 | Confident | 66 Ų | 66 | 71.1 Ų | 71.1 | 31% | 0.308 | 35% | 0.351 | S | S | . | . | S | Bend | trans | -120.5 | 151.1 | -177 | 71 | -171.4 | -33.5 | 0 | 0 | 111.5 | K160 V161 M162 H166 | K160-Q164 WeakPolarHBondContact O-CG 3.29Å; K160-Q164 PolarHBondContact O-N 2.76Å; K160-Q164 PolarHBondContact O-NE2 2.76Å; V161-Q164 VanDerWaalsContact O-O 3.13Å; M162-Q164 VanDerWaalsContact C-N 3.31Å; Q164-H166 WeakPolarHBondContact CG-CE1 3.41Å; Q164-H166 WeakPolarHBondContact CG-NE2 3.36Å; Q164-H166 PolarHBondContact NE2-CE1 2.98Å; Q164-H166 PolarHBondContact O-CD2 2.76Å; Q164-H166 PolarHBondContact O-NE2 2.67Å |
| 165 | R | 79.4 | Confident | 80.5 | Confident | 135 Ų | 135 | 67.7 Ų | 67.7 | 51% | 0.509 | 34% | 0.335 | S | S | . | . | trans | -84.8 | 143.8 | 169.5 | -58.5 | -168.4 | 79 | -158.2 | 1 | 109.6 | W172 D174 | R165-W172 HydrophobicContact CB-CE3 3.76Å; R165-W172 HydrophobicContact CB-CZ3 3.94Å; R165-D174 IonicContact CZ-OD1 3.94Å; R165-D174 IonicContact CZ-OD2 3.65Å; R165-D174 IonicContact NE-OD1 2.84Å; R165-D174 PolarHBondContact NE-OD1 3.43Å; R165-D174 VanDerWaalsContact NE-OD1 3.08Å; R165-D174 IonicContact NE-OD2 3.15Å; R165-D174 IonicContact NH2-OD1 2.64Å; R165-D174 IonicContact NH2-OD2 3.88Å; R165-D174 PolarHBondContact NH2-OD2 2.79Å | ||
| 166 | H | 83.9 | Confident | 80.8 | Confident | 0 Ų | 0 | 67.5 Ų | 67.5 | 0% | 0 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 132 | -175.3 | -64.1 | -79.5 | 0 | 0 | 0 | 110.3 | Y123 F127 V161 Q164 I168 W172 C173 C175 | Y123-H166 HydrophobicContact CE1-CB 3.74Å; Y123-H166 AromaticContact CE1-CG 3.83Å; Y123-H166 AromaticContact CE1-ND1 3.37Å; Y123-H166 WeakPolarHBondContact CE1-ND1 3.47Å; Y123-H166 AromaticContact CZ-ND1 3.73Å; Y123-H166 WeakPolarHBondContact OH-CA 3.22Å; Y123-H166 WeakPolarHBondContact OH-CB 3.37Å; Y123-H166 PolarHBondContact OH-ND1 2.82Å; Y123-H166 VanDerWaalsContact OH-ND1 3.15Å; F127-H166 AromaticContact CE2-ND1 3.84Å; F127-H166 AromaticContact CZ-CE1 3.96Å; F127-H166 AromaticContact CZ-ND1 3.8Å; V161-H166 WeakPolarHBondContact CG1-NE2 3.35Å; V161-H166 PolarHBondContact O-NE2 2.74Å; Q164-H166 WeakPolarHBondContact CG-CE1 3.41Å; Q164-H166 WeakPolarHBondContact CG-NE2 3.36Å; Q164-H166 PolarHBondContact NE2-CE1 2.98Å; Q164-H166 PolarHBondContact O-CD2 2.76Å; Q164-H166 PolarHBondContact O-NE2 2.67Å; H166-I168 HydrophobicContact CB-CD1 4.24Å; H166-I168 HydrophobicContact CB-CG1 4.11Å; H166-W172 CarbonylContact O-C 3.57Å; H166-W172 WeakPolarHBondContact O-CA 3.49Å; H166-C173 HydrophobicContact CB-CB 4.37Å; H166-C173 PolarHBondContact N-O 2.61Å; H166-C173 PolarHBondContact O-N 2.94Å; H166-C175 PolarHBondContact CD2-SG 3.05Å |
| 167 | M | 83.4 | Confident | 80.9 | Confident | 79 Ų | 79 | 64 Ų | 64 | 39% | 0.389 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.1 | 100 | 173.9 | -178.1 | 67.3 | 78.1 | 0 | 0 | 108.2 | Y123 R171 W172 | Y123-M167 WeakPolarHBondContact CE2-O 3.48Å; Y123-M167 PolarHBondContact OH-N 2.93Å; M167-R171 VanDerWaalsContact SD-C 3.56Å; M167-R171 PolarHBondContact SD-N 2.98Å; M167-W172 HydrophobicContact CB-CE3 4.44Å; M167-W172 HydrophobicContact CB-CZ3 4.37Å; M167-W172 HydrophobicContact CE-CD2 3.57Å; M167-W172 HydrophobicContact CE-CE3 4.15Å; M167-W172 HydrophobicContact CE-CG 4Å; M167-W172 HydrophobicContact CE-CH2 4.05Å; M167-W172 HydrophobicContact CE-CZ2 3.44Å; M167-W172 VanDerWaalsContact CE-CZ2 3.44Å; M167-W172 HydrophobicContact CE-CZ3 4.37Å; M167-W172 VanDerWaalsContact CE-NE1 3.33Å; M167-W172 HydrophobicContact SD-CD2 4.36Å; M167-W172 HydrophobicContact SD-CG 4.47Å |
| 168 | I | 84 | Confident | 80.3 | Confident | 5 Ų | 5 | 65.1 Ų | 65.1 | 3% | 0.026 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 120.8 | -178.6 | -52.1 | -178 | 0 | 0 | 0 | 107.2 | L111 T115 L120 Y123 F124 H166 G170 R171 C173 | L111-I168 HydrophobicContact CD2-CD1 4.07Å; T115-I168 HydrophobicContact CG2-CG2 3.98Å; L120-I168 HydrophobicContact CD2-CD1 3.53Å; L120-I168 HydrophobicContact CD2-CG2 4.44Å; Y123-I168 HydrophobicContact CD1-CD1 3.82Å; Y123-I168 HydrophobicContact CD1-CG1 3.92Å; Y123-I168 HydrophobicContact CD2-CG1 4.36Å; Y123-I168 HydrophobicContact CE1-CD1 3.98Å; Y123-I168 HydrophobicContact CE1-CG1 3.86Å; Y123-I168 HydrophobicContact CE2-CG1 4.29Å; Y123-I168 HydrophobicContact CG-CD1 4.4Å; Y123-I168 HydrophobicContact CG-CG1 4.19Å; F124-I168 HydrophobicContact CE2-CD1 4.27Å; F124-I168 HydrophobicContact CZ-CD1 4.05Å; H166-I168 HydrophobicContact CB-CD1 4.24Å; H166-I168 HydrophobicContact CB-CG1 4.11Å; I168-G170 PolarHBondContact O-N 2.89Å; I168-R171 PolarHBondContact N-O 3.19Å; I168-R171 PolarHBondContact O-N 3.26Å; I168-C173 HydrophobicContact CD1-CB 4.22Å; I168-C173 HydrophobicContact CG1-CB 4.41Å |
| 169 | D | 78.8 | Confident | 79.5 | Confident | 73 Ų | 73 | 69.2 Ų | 69.2 | 39% | 0.39 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 60.9 | 22.6 | 171.4 | -106.7 | -40.3 | 0 | 0 | 0 | 114.8 | P112 K114 T115 | P112-D169 HydrophobicContact CB-CB 4.36Å; P112-D169 HydrophobicContact CG-CB 3.61Å; K114-D169 VanDerWaalsContact CE-CG 3.48Å; K114-D169 WeakPolarHBondContact CE-OD1 3.48Å; K114-D169 VanDerWaalsContact NZ-CG 3.33Å; K114-D169 PolarHBondContact NZ-O 2.79Å; K114-D169 VanDerWaalsContact NZ-O 3.14Å; K114-D169 IonicContact NZ-OD1 2.74Å; K114-D169 PolarHBondContact NZ-OD1 3.49Å; T115-D169 PolarHBondContact OG1-OD2 3.29Å |
| 170 | G | 77.6 | Confident | 78.5 | Confident | 69 Ų | 69 | 69.5 Ų | 69.5 | 71% | 0.711 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 89.4 | 9.7 | -176 | 0 | 0 | 0 | 0 | 0 | 114.8 | I168 | I168-G170 PolarHBondContact O-N 2.89Š|
| 171 | R | 80.1 | Confident | 77.1 | Confident | 129 Ų | 129 | 71.2 Ų | 71.2 | 49% | 0.487 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.7 | 134.3 | 177.3 | -165.3 | 167.4 | -175.7 | 150.4 | 3.9 | 111.6 | G110 P112 M167 I168 C173 | G110-R171 WeakPolarHBondContact O-CD 3.37Å; G110-R171 WeakPolarHBondContact O-CG 3.28Å; G110-R171 PolarHBondContact O-NE 3.2Å; P112-R171 HydrophobicContact CG-CB 3.83Å; M167-R171 VanDerWaalsContact SD-C 3.56Å; M167-R171 PolarHBondContact SD-N 2.98Å; I168-R171 PolarHBondContact N-O 3.19Å; I168-R171 PolarHBondContact O-N 3.26Å; R171-C173 PolarHBondContact O-N 3.05Å; R171-C173 PolarHBondContact O-SG 3.28Å; R171-C173 VanDerWaalsContact O-SG 3.37Å |
| 172 | W | 84.3 | Confident | 75.7 | Confident | 139 Ų | 139 | 73.7 Ų | 73.7 | 53% | 0.527 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.5 | 124.5 | 170.6 | -70 | 107.1 | 0 | 0 | 0 | 110.7 | R165 H166 M167 | R165-W172 HydrophobicContact CB-CE3 3.76Å; R165-W172 HydrophobicContact CB-CZ3 3.94Å; H166-W172 CarbonylContact O-C 3.57Å; H166-W172 WeakPolarHBondContact O-CA 3.49Å; M167-W172 HydrophobicContact CB-CE3 4.44Å; M167-W172 HydrophobicContact CB-CZ3 4.37Å; M167-W172 HydrophobicContact CE-CD2 3.57Å; M167-W172 HydrophobicContact CE-CE3 4.15Å; M167-W172 HydrophobicContact CE-CG 4Å; M167-W172 HydrophobicContact CE-CH2 4.05Å; M167-W172 HydrophobicContact CE-CZ2 3.44Å; M167-W172 VanDerWaalsContact CE-CZ2 3.44Å; M167-W172 HydrophobicContact CE-CZ3 4.37Å; M167-W172 VanDerWaalsContact CE-NE1 3.33Å; M167-W172 HydrophobicContact SD-CD2 4.36Å; M167-W172 HydrophobicContact SD-CG 4.47Å |
| 173 | C | 84.6 | Confident | 74.4 | Confident | 0 Ų | 0 | 71 Ų | 71 | 0% | 0 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 146 | -179.6 | -57.5 | 0 | 0 | 0 | 0 | 109.8 | V108 L109 G110 H166 I168 R171 | V108-C173 HydrophobicContact CG1-CB 4.21Å; L109-C173 WeakPolarHBondContact O-CA 3.33Å; G110-C173 PolarHBondContact O-SG 2.64Å; H166-C173 HydrophobicContact CB-CB 4.37Å; H166-C173 PolarHBondContact N-O 2.61Å; H166-C173 PolarHBondContact O-N 2.94Å; I168-C173 HydrophobicContact CD1-CB 4.22Å; I168-C173 HydrophobicContact CG1-CB 4.41Å; R171-C173 PolarHBondContact O-N 3.05Å; R171-C173 PolarHBondContact O-SG 3.28Å; R171-C173 VanDerWaalsContact O-SG 3.37Å |
| 174 | D | 80.5 | Confident | 73.3 | Confident | 53 Ų | 53 | 70.3 Ų | 70.3 | 28% | 0.283 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.3 | 128.3 | -177.8 | -71.2 | -77.7 | 0 | 0 | 0 | 109.8 | L109 R165 | L109-D174 PolarHBondContact N-O 2.82Å; L109-D174 PolarHBondContact O-N 2.94Å; R165-D174 IonicContact CZ-OD1 3.94Å; R165-D174 IonicContact CZ-OD2 3.65Å; R165-D174 IonicContact NE-OD1 2.84Å; R165-D174 PolarHBondContact NE-OD1 3.43Å; R165-D174 VanDerWaalsContact NE-OD1 3.08Å; R165-D174 IonicContact NE-OD2 3.15Å; R165-D174 IonicContact NH2-OD1 2.64Å; R165-D174 IonicContact NH2-OD2 3.88Å; R165-D174 PolarHBondContact NH2-OD2 2.79Å |
| 175 | C | 82.6 | Confident | 72.2 | Confident | 5 Ų | 5 | 72.2 Ų | 72.2 | 3% | 0.034 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.1 | 123.9 | 179.3 | -65.4 | 0 | 0 | 0 | 0 | 110.1 | I107 V161 H166 | I107-C175 WeakPolarHBondContact O-CA 3.31Å; V161-C175 HydrophobicContact CG1-CB 3.89Å; H166-C175 PolarHBondContact CD2-SG 3.05Å |
| 176 | K | 79.7 | Confident | 71.2 | Confident | 116 Ų | 116 | 68.5 Ų | 68.5 | 50% | 0.504 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.4 | 162.7 | -177.6 | -63.9 | -173.1 | -179.2 | -178.4 | 0 | 111.5 | I107 | I107-K176 HydrophobicContact CG2-CB 4.31Å; I107-K176 VanDerWaalsContact CG2-O 3.3Å; I107-K176 WeakPolarHBondContact CG2-O 3.39Å; I107-K176 PolarHBondContact N-O 2.75Å; I107-K176 PolarHBondContact O-N 3.05Å |
| 177 | L | 77.4 | Confident | 69.7 | Low | 87 Ų | 87 | 70.1 Ų | 70.1 | 46% | 0.455 | 37% | 0.374 | S | S | . | . | trans | -73.9 | 125.5 | 165.4 | -76.5 | 166 | 0 | 0 | 0 | 108.7 | L106 M162 N179 | L106-L177 HydrophobicContact CD2-CD2 3.94Å; L106-L177 HydrophobicContact CD2-CG 4.22Å; M162-L177 HydrophobicContact CE-CB 4.27Å; M162-L177 HydrophobicContact CE-CD1 3.89Å; M162-L177 HydrophobicContact CE-CG 3.67Å; M162-L177 HydrophobicContact SD-CD1 4.2Å; M162-L177 HydrophobicContact SD-CD2 4.5Å; M162-L177 HydrophobicContact SD-CG 3.82Å; L177-N179 PolarHBondContact O-N 2.82Å; L177-N179 VanDerWaalsContact O-N 3.11Å | ||
| 178 | P | 66.7 | Low | 67.9 | Low | 35 Ų | 35 | 68.3 Ų | 68.3 | 23% | 0.227 | 38% | 0.376 | C | S | . | . | trans | -67.3 | 112.4 | 174.2 | 25.9 | -28.4 | 0 | 0 | 0 | 107.8 | D105 I107 F149 A183 | D105-P178 WeakPolarHBondContact O-CD 2.88Å; D105-P178 VanDerWaalsContact O-CG 3.25Å; D105-P178 WeakPolarHBondContact O-CG 3.39Å; I107-P178 HydrophobicContact CB-CB 4.15Å; I107-P178 HydrophobicContact CB-CG 4.47Å; I107-P178 HydrophobicContact CG2-CB 3.93Å; I107-P178 HydrophobicContact CG2-CG 4.47Å; F149-P178 HydrophobicContact CE1-CB 4.35Å; F149-P178 HydrophobicContact CE1-CG 4.39Å; P178-A183 HydrophobicContact CB-CB 4.15Å | ||
| 179 | N | 63.3 | Low | 66 | Low | 89 Ų | 89 | 78 Ų | 78 | 48% | 0.476 | 42% | 0.421 | S | S | . | . | trans | -70.4 | 149.1 | 168.7 | 73.6 | 43.1 | 0 | 0 | 0 | 108.6 | L177 K181 V182 A183 | L177-N179 PolarHBondContact O-N 2.82Å; L177-N179 VanDerWaalsContact O-N 3.11Å; N179-K181 PolarHBondContact O-N 2.76Å; N179-K181 PolarHBondContact OD1-N 3.08Å; N179-V182 VanDerWaalsContact ND2-CG2 3.28Å; N179-V182 WeakPolarHBondContact ND2-CG2 3.29Å; N179-V182 PolarHBondContact O-N 2.8Å; N179-V182 VanDerWaalsContact O-N 3.11Å; N179-V182 WeakPolarHBondContact OD1-CB 3.43Å; N179-V182 WeakPolarHBondContact OD1-CG2 3.42Å; N179-V182 PolarHBondContact OD1-N 2.69Å; N179-A183 PolarHBondContact O-N 2.91Å | ||
| 180 | S | 55.5 | Low | 64.2 | Low | 74 Ų | 74 | 81.6 Ų | 81.6 | 52% | 0.517 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -54.5 | -29.7 | -174.5 | -171.6 | 0 | 0 | 0 | 0 | 113.1 | Q184 | S180-Q184 WeakPolarHBondContact O-CB 3.35Å; S180-Q184 WeakPolarHBondContact O-CG 3.37Å; S180-Q184 PolarHBondContact O-N 3.26Å; S180-Q184 PolarHBondContact OG-NE2 2.81Å |
| 181 | K | 52.5 | Low | 62.6 | Low | 166 Ų | 166 | 82.8 Ų | 82.8 | 72% | 0.722 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -77.5 | -43.4 | 180 | -64.3 | -177 | 179.1 | -178.1 | 0 | 112.1 | N179 Q184 S185 | N179-K181 PolarHBondContact O-N 2.76Å; N179-K181 PolarHBondContact OD1-N 3.08Å; K181-Q184 PolarHBondContact O-N 3.27Å; K181-S185 PolarHBondContact O-N 3.44Å; K181-S185 PolarHBondContact O-OG 2.93Å; K181-S185 VanDerWaalsContact O-OG 3.06Å |
| 182 | V | 55.5 | Low | 60.8 | Low | 53 Ų | 53 | 79.5 Ų | 79.5 | 32% | 0.321 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -68.3 | -41.2 | 179 | 167.7 | 0 | 0 | 0 | 0 | 110.3 | N179 S185 L186 | N179-V182 VanDerWaalsContact ND2-CG2 3.28Å; N179-V182 WeakPolarHBondContact ND2-CG2 3.29Å; N179-V182 PolarHBondContact O-N 2.8Å; N179-V182 VanDerWaalsContact O-N 3.11Å; N179-V182 WeakPolarHBondContact OD1-CB 3.43Å; N179-V182 WeakPolarHBondContact OD1-CG2 3.42Å; N179-V182 PolarHBondContact OD1-N 2.69Å; V182-S185 PolarHBondContact O-N 3.2Å; V182-L186 HydrophobicContact CG1-CD1 3.6Å; V182-L186 HydrophobicContact CG1-CG 4.34Å; V182-L186 WeakPolarHBondContact O-CB 3.46Å; V182-L186 VanDerWaalsContact O-CG 3.23Å; V182-L186 WeakPolarHBondContact O-CG 3.01Å; V182-L186 PolarHBondContact O-N 3.28Å |
| 183 | A | 55.1 | Low | 58.5 | Low | 10 Ų | 10 | 79.1 Ų | 79.1 | 8% | 0.083 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -62.2 | -45.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | P178 N179 S185 L186 C187 I192 | P178-A183 HydrophobicContact CB-CB 4.15Å; N179-A183 PolarHBondContact O-N 2.91Å; A183-S185 PolarHBondContact O-N 3.09Å; A183-L186 PolarHBondContact O-N 3.42Å; A183-C187 VanDerWaalsContact O-CB 3.28Å; A183-C187 WeakPolarHBondContact O-CB 3.18Å; A183-C187 PolarHBondContact O-N 2.79Å; A183-C187 PolarHBondContact O-SG 3.21Å; A183-I192 HydrophobicContact CB-CD1 3.31Å |
| 184 | Q | 55.8 | Low | 56.2 | Low | 93 Ų | 93 | 88.4 Ų | 88.4 | 44% | 0.435 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60 | -45.3 | 175.7 | -78.7 | 165.3 | 6.6 | 0 | 0 | 112.8 | S180 K181 L186 G188 I192 | S180-Q184 WeakPolarHBondContact O-CB 3.35Å; S180-Q184 WeakPolarHBondContact O-CG 3.37Å; S180-Q184 PolarHBondContact O-N 3.26Å; S180-Q184 PolarHBondContact OG-NE2 2.81Å; K181-Q184 PolarHBondContact O-N 3.27Å; Q184-L186 VanDerWaalsContact C-N 3.35Å; Q184-L186 PolarHBondContact O-N 3.22Å; Q184-G188 PolarHBondContact O-N 2.84Å; Q184-I192 HydrophobicContact CG-CB 4.18Å; Q184-I192 HydrophobicContact CG-CD1 4.1Å; Q184-I192 HydrophobicContact CG-CG1 4.48Å; Q184-I192 HydrophobicContact CG-CG2 4.42Å |
| 185 | S | 55.4 | Low | 54.3 | Low | 106 Ų | 106 | 90 Ų | 90 | 74% | 0.741 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -68.1 | -30.2 | -180 | -59.3 | 0 | 0 | 0 | 0 | 113.9 | K181 V182 A183 | K181-S185 PolarHBondContact O-N 3.44Å; K181-S185 PolarHBondContact O-OG 2.93Å; K181-S185 VanDerWaalsContact O-OG 3.06Å; V182-S185 PolarHBondContact O-N 3.2Å; A183-S185 PolarHBondContact O-N 3.09Å |
| 186 | L | 58.8 | Low | 52.2 | Low | 57 Ų | 57 | 96.3 Ų | 96.3 | 30% | 0.298 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -87.5 | -29.3 | -178.8 | -68 | 171.8 | 0 | 0 | 0 | 113.3 | I107 F147 V182 A183 Q184 | I107-L186 HydrophobicContact CD1-CD1 3.57Å; F147-L186 HydrophobicContact CE1-CD2 4.4Å; F147-L186 HydrophobicContact CE2-CB 4.2Å; F147-L186 HydrophobicContact CZ-CB 3.96Å; V182-L186 HydrophobicContact CG1-CD1 3.6Å; V182-L186 HydrophobicContact CG1-CG 4.34Å; V182-L186 WeakPolarHBondContact O-CB 3.46Å; V182-L186 VanDerWaalsContact O-CG 3.23Å; V182-L186 WeakPolarHBondContact O-CG 3.01Å; V182-L186 PolarHBondContact O-N 3.28Å; A183-L186 PolarHBondContact O-N 3.42Å; Q184-L186 VanDerWaalsContact C-N 3.35Å; Q184-L186 PolarHBondContact O-N 3.22Å |
| 187 | C | 53 | Low | 49.9 | Very low | 35 Ų | 35 | 95.1 Ų | 95.1 | 24% | 0.236 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -89.9 | -19.5 | -174.9 | -56.3 | 0 | 0 | 0 | 0 | 114.1 | A183 L191 | A183-C187 VanDerWaalsContact O-CB 3.28Å; A183-C187 WeakPolarHBondContact O-CB 3.18Å; A183-C187 PolarHBondContact O-N 2.79Å; A183-C187 PolarHBondContact O-SG 3.21Å; C187-L191 HydrophobicContact CB-CB 4.28Å |
| 188 | G | 44.9 | Very low | 48 | Very low | 41 Ų | 41 | 95.2 Ų | 95.2 | 42% | 0.423 | 54% | 0.54 | S | S | . | . | trans | 71.5 | 156.5 | -164.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q184 D190 | Q184-G188 PolarHBondContact O-N 2.84Å; G188-D190 PolarHBondContact O-N 3.49Å | ||
| 189 | E | 44.3 | Very low | 46.5 | Very low | 208 Ų | 208 | 99.9 Ų | 99.9 | 97% | 0.972 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | 2.1 | -165.1 | -97.5 | 170.3 | 141.7 | 0 | 0 | 118.2 | ||
| 190 | D | 41.8 | Very low | 45.5 | Very low | 148 Ų | 148 | 99 Ų | 99 | 79% | 0.791 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.5 | -4.1 | -168.7 | -140.5 | -111.9 | 0 | 0 | 0 | 115.7 | G188 | G188-D190 PolarHBondContact O-N 3.49Š|
| 191 | L | 43.3 | Very low | 44.5 | Very low | 95 Ų | 95 | 99.3 Ų | 99.3 | 50% | 0.497 | 56% | 0.555 | S | S | . | * | S | Bend | trans | -118.2 | 3.5 | -170.4 | -79.7 | 155.8 | 0 | 0 | 0 | 115.8 | C187 | C187-L191 HydrophobicContact CB-CB 4.28Š|
| 192 | I | 42.3 | Very low | 43.7 | Very low | 60 Ų | 60 | 97.9 Ų | 97.9 | 31% | 0.308 | 56% | 0.555 | S | S | . | * | trans | -127.7 | 75.5 | 176.3 | -53.9 | -164.6 | 0 | 0 | 0 | 109.4 | A183 Q184 K194 | A183-I192 HydrophobicContact CB-CD1 3.31Å; Q184-I192 HydrophobicContact CG-CB 4.18Å; Q184-I192 HydrophobicContact CG-CD1 4.1Å; Q184-I192 HydrophobicContact CG-CG1 4.48Å; Q184-I192 HydrophobicContact CG-CG2 4.42Å; I192-K194 PolarHBondContact O-N 3.19Å; I192-K194 VanDerWaalsContact O-N 3.15Å | ||
| 193 | I | 35.3 | Very low | 42.9 | Very low | 131 Ų | 131 | 99.8 Ų | 99.8 | 67% | 0.672 | 58% | 0.576 | S | S | * | * | trans | -74.1 | 106.4 | 164.9 | -57 | 179.1 | 0 | 0 | 0 | 107.4 | ||||
| 194 | K | 37.1 | Very low | 41.9 | Very low | 195 Ų | 195 | 107 Ų | 107 | 85% | 0.848 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 12.3 | 103.9 | 159.6 | -66.6 | 177.2 | 177 | 175.6 | 0 | 116.1 | I192 I196 | I192-K194 PolarHBondContact O-N 3.19Å; I192-K194 VanDerWaalsContact O-N 3.15Å; K194-I196 PolarHBondContact O-N 3.26Å |
| 195 | G | 40.6 | Very low | 41 | Very low | 86 Ų | 86 | 108.3 Ų | 108.3 | 89% | 0.887 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 82.7 | -1.4 | 151.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||
| 196 | I | 37.5 | Very low | 40.1 | Very low | 137 Ų | 137 | 112.9 Ų | 112.9 | 70% | 0.703 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -137.5 | 122.9 | 178.5 | -56.5 | 175.4 | 0 | 0 | 0 | 108.4 | K194 V198 | K194-I196 PolarHBondContact O-N 3.26Å; I196-V198 PolarHBondContact O-N 3.41Å |
| 197 | S | 31.9 | Very low | 39.1 | Very low | 91 Ų | 91 | 118 Ų | 118 | 64% | 0.636 | 65% | 0.654 | S | S | * | * | trans | -54.3 | 105.7 | 170 | 51.2 | 0 | 0 | 0 | 0 | 109.4 | H199 | S197-H199 PolarHBondContact O-N 3.08Š| ||
| 198 | V | 36.9 | Very low | 38.2 | Very low | 90 Ų | 90 | 123 Ų | 123 | 55% | 0.545 | 68% | 0.678 | S | S | . | * | trans | -70.5 | 119 | 176.2 | 179.8 | 0 | 0 | 0 | 0 | 107.9 | I196 I200 | I196-V198 PolarHBondContact O-N 3.41Å; V198-I200 PolarHBondContact O-N 2.86Å | ||
| 199 | H | 35.2 | Very low | 38.1 | Very low | 132 Ų | 132 | 125.6 Ų | 125.6 | 61% | 0.611 | 69% | 0.69 | S | S | * | * | trans | -55 | 106.1 | 163.6 | -112.6 | -107.6 | 0 | 0 | 0 | 108.4 | S197 S201 | S197-H199 PolarHBondContact O-N 3.08Å; H199-S201 PolarHBondContact ND1-OG 2.99Å; H199-S201 VanDerWaalsContact ND1-OG 3.09Å; H199-S201 PolarHBondContact O-N 2.84Å | ||
| 200 | I | 42.3 | Very low | 37.7 | Very low | 72 Ų | 72 | 121.7 Ų | 121.7 | 37% | 0.369 | 68% | 0.676 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.5 | 44.3 | 174.9 | -44.9 | 175.2 | 0 | 0 | 0 | 109.5 | M132 V198 | M132-I200 HydrophobicContact CE-CB 4.02Å; M132-I200 HydrophobicContact CE-CG2 4.42Å; V198-I200 PolarHBondContact O-N 2.86Å |
| 201 | S | 35.6 | Very low | 37.5 | Very low | 79 Ų | 79 | 126.7 Ų | 126.7 | 55% | 0.552 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102 | -14.4 | -178.5 | -45.7 | 0 | 0 | 0 | 0 | 112.5 | H199 | H199-S201 PolarHBondContact ND1-OG 2.99Å; H199-S201 VanDerWaalsContact ND1-OG 3.09Å; H199-S201 PolarHBondContact O-N 2.84Å |
| 202 | N | 36.1 | Very low | 37.3 | Very low | 136 Ų | 136 | 129.7 Ų | 129.7 | 73% | 0.727 | 70% | 0.695 | S | S | * | * | trans | -146.7 | 40.7 | -173.4 | -121.2 | 71.3 | 0 | 0 | 0 | 114.4 | E204 | N202-E204 VanDerWaalsContact C-N 3.27Å; N202-E204 PolarHBondContact O-N 2.8Å | ||
| 203 | A | 37.2 | Very low | 37.1 | Very low | 93 Ų | 93 | 133.3 Ų | 133.3 | 77% | 0.769 | 71% | 0.714 | S | S | * | * | trans | -77.9 | 82.7 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 204 | E | 33.9 | Very low | 36.9 | Very low | 161 Ų | 161 | 134 Ų | 134 | 75% | 0.752 | 71% | 0.714 | S | S | * | * | trans | -66.5 | 130 | 162.4 | -79.4 | -177.5 | 117.4 | 0 | 0 | 108.7 | N202 K206 | N202-E204 VanDerWaalsContact C-N 3.27Å; N202-E204 PolarHBondContact O-N 2.8Å; E204-K206 PolarHBondContact O-N 2.82Å; E204-K206 VanDerWaalsContact O-N 3.1Å | ||
| 205 | P | 37.5 | Very low | 36.8 | Very low | 122 Ų | 122 | 135.4 Ų | 135.4 | 79% | 0.792 | 71% | 0.714 | S | S | * | * | trans | -65.6 | 115.1 | 174.1 | 24.8 | -28.9 | 0 | 0 | 0 | 108.5 | H207 | P205-H207 PolarHBondContact O-N 3.49Š| ||
| 206 | K | 36.4 | Very low | 36.5 | Very low | 201 Ų | 201 | 137 Ų | 137 | 87% | 0.874 | 71% | 0.712 | S | S | * | * | trans | -61.3 | 107.1 | 165.6 | -75.2 | -174.7 | 177.4 | 179.3 | 0 | 107.6 | E204 N208 | E204-K206 PolarHBondContact O-N 2.82Å; E204-K206 VanDerWaalsContact O-N 3.1Å; K206-N208 VanDerWaalsContact C-N 3.29Å; K206-N208 PolarHBondContact O-N 2.76Å | ||
| 207 | H | 38.8 | Very low | 36.2 | Very low | 166 Ų | 166 | 133.9 Ų | 133.9 | 77% | 0.769 | 71% | 0.713 | S | S | * | * | trans | -62.9 | 92.6 | 167.2 | -166.8 | -77.8 | 0 | 0 | 0 | 107.8 | P205 S209 | P205-H207 PolarHBondContact O-N 3.49Å; H207-S209 VanDerWaalsContact C-N 3.3Å; H207-S209 PolarHBondContact CE1-OG 2.88Å; H207-S209 PolarHBondContact ND1-OG 3.16Å; H207-S209 PolarHBondContact O-N 3.45Å | ||
| 208 | N | 33.3 | Very low | 36.3 | Very low | 139 Ų | 139 | 140.3 Ų | 140.3 | 74% | 0.743 | 72% | 0.724 | S | S | * | * | trans | -77.6 | 88.1 | 173.5 | -165.7 | 13 | 0 | 0 | 0 | 108.3 | K206 N210 | K206-N208 VanDerWaalsContact C-N 3.29Å; K206-N208 PolarHBondContact O-N 2.76Å; N208-N210 PolarHBondContact O-N 3.04Å | ||
| 209 | S | 42.6 | Very low | 36.1 | Very low | 95 Ų | 95 | 145.1 Ų | 145.1 | 66% | 0.664 | 74% | 0.738 | S | S | * | * | trans | -69 | 75.4 | 164.4 | -54.6 | 0 | 0 | 0 | 0 | 108.8 | H207 | H207-S209 VanDerWaalsContact C-N 3.3Å; H207-S209 PolarHBondContact CE1-OG 2.88Å; H207-S209 PolarHBondContact ND1-OG 3.16Å; H207-S209 PolarHBondContact O-N 3.45Å | ||
| 210 | N | 35.1 | Very low | 35.9 | Very low | 127 Ų | 127 | 142.7 Ų | 142.7 | 68% | 0.679 | 75% | 0.748 | S | S | * | * | trans | -146.3 | 78.8 | 164.2 | -143.4 | 10.1 | 0 | 0 | 0 | 110.4 | N208 Q212 | N208-N210 PolarHBondContact O-N 3.04Å; N210-Q212 PolarHBondContact O-N 2.8Å | ||
| 211 | R | 38.4 | Very low | 35.4 | Very low | 253 Ų | 253 | 143.1 Ų | 143.1 | 96% | 0.955 | 77% | 0.77 | S | S | * | * | trans | -83.3 | 102.2 | 162.8 | -120.6 | -171.5 | -81.5 | 178.4 | -5.2 | 107 | ||||
| 212 | Q | 38.9 | Very low | 35.5 | Very low | 157 Ų | 157 | 146.6 Ų | 146.6 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | trans | -87.8 | 141.2 | 166.5 | -163 | -174.2 | 1.5 | 0 | 0 | 109.2 | N210 | N210-Q212 PolarHBondContact O-N 2.8Š| ||
| 213 | L | 38.3 | Very low | 36 | Very low | 136 Ų | 136 | 145.5 Ų | 145.5 | 71% | 0.712 | 78% | 0.783 | S | S | * | * | trans | 79.5 | 135.1 | 152.5 | -118.3 | 73.9 | 0 | 0 | 0 | 115.7 | ||||
| 214 | E | 32.2 | Very low | 35.8 | Very low | 145 Ų | 145 | 144.6 Ų | 144.6 | 68% | 0.678 | 78% | 0.783 | S | S | * | * | cis | -157.1 | 148.6 | 35.7 | -93.5 | -173.6 | 104.7 | 0 | 0 | 114.6 | ||||
| 215 | R | 34.9 | Very low | 35.8 | Very low | 226 Ų | 226 | 140.7 Ų | 140.7 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | trans | 35.8 | 117.4 | 135.6 | -70.7 | 174.6 | 155.7 | -177.2 | -5.4 | 121.5 | ||||
| 216 | S | 34.4 | Very low | 35.8 | Very low | 119 Ų | 119 | 145 Ų | 145 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | -170 | 113.5 | 116.8 | 54.6 | 0 | 0 | 0 | 0 | 106.8 | |||||
| 217 | G | 29.7 | Very low | 35.7 | Very low | 71 Ų | 71 | 139.1 Ų | 139.1 | 73% | 0.732 | 79% | 0.789 | S | S | * | * | 88.5 | 112.1 | 81 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 218 | R | 33.8 | Very low | 35.5 | Very low | 226 Ų | 226 | 137.5 Ų | 137.5 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | trans | 91.7 | 116.9 | 148.2 | -63.8 | -168.5 | -171 | -127.9 | 2.8 | 120.6 | ||||
| 219 | F | 33.3 | Very low | 35.9 | Very low | 192 Ų | 192 | 138.9 Ų | 138.9 | 84% | 0.842 | 79% | 0.788 | S | S | * | * | trans | 76.7 | 109.1 | 135.7 | -81.8 | -105 | 0 | 0 | 0 | 120.3 | ||||
| 220 | G | 31.2 | Very low | 35.4 | Very low | 81 Ų | 81 | 138.2 Ų | 138.2 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | 101.7 | 117.7 | 112.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 221 | G | 32.7 | Very low | 35.3 | Very low | 80 Ų | 80 | 135 Ų | 135 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | trans | 94.2 | 96 | 136.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 222 | N | 36.4 | Very low | 35.3 | Very low | 152 Ų | 152 | 133.6 Ų | 133.6 | 81% | 0.813 | 80% | 0.795 | S | S | * | * | trans | -63.7 | 146.6 | 139.5 | -164.7 | 58.1 | 0 | 0 | 0 | 107.2 | ||||
| 223 | P | 46.1 | Very low | 35.2 | Very low | 113 Ų | 113 | 130.1 Ų | 130.1 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | -158 | 153.5 | 64 | 38.5 | -15.3 | 0 | 0 | 0 | 119.6 | |||||
| 224 | G | 33.5 | Very low | 35.2 | Very low | 75 Ų | 75 | 130.7 Ų | 130.7 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | 82 | 152 | 132.8 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 225 | G | 34 | Very low | 35.5 | Very low | 78 Ų | 78 | 127.7 Ų | 127.7 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | 145.5 | 102 | 158.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 226 | F | 37.4 | Very low | 35.7 | Very low | 212 Ų | 212 | 128.7 Ų | 128.7 | 93% | 0.93 | 80% | 0.803 | S | S | * | * | trans | -75.7 | 154.8 | 174.7 | -78.4 | -109.8 | 0 | 0 | 0 | 113.6 | ||||
| 227 | G | 35 | Very low | 35.9 | Very low | 79 Ų | 79 | 126.6 Ų | 126.6 | 81% | 0.814 | 80% | 0.801 | S | S | * | * | trans | 67.9 | 163.6 | 145.3 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 228 | N | 34.5 | Very low | 36.3 | Very low | 132 Ų | 132 | 127.2 Ų | 127.2 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | cis | -174.5 | 159 | -1.6 | 177.2 | 29.8 | 0 | 0 | 0 | 106.1 | ||||
| 229 | Q | 40.5 | Very low | 36.6 | Very low | 167 Ų | 167 | 120.1 Ų | 120.1 | 78% | 0.78 | 80% | 0.804 | S | S | * | * | trans | 68.5 | 105.5 | 158.6 | -85.4 | 161.9 | 18.9 | 0 | 0 | 120.4 | ||||
| 230 | G | 33.9 | Very low | 37.1 | Very low | 82 Ų | 82 | 116.3 Ų | 116.3 | 85% | 0.845 | 81% | 0.809 | S | S | * | * | 73.1 | 123.9 | 96.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 231 | G | 32.6 | Very low | 37.6 | Very low | 60 Ų | 60 | 115.5 Ų | 115.5 | 62% | 0.619 | 80% | 0.8 | S | S | * | * | trans | 118.9 | 113.4 | 130.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 232 | F | 36.9 | Very low | 38 | Very low | 222 Ų | 222 | 120.9 Ų | 120.9 | 97% | 0.974 | 81% | 0.809 | S | S | * | * | trans | 56.4 | 114.5 | 143.2 | -50.8 | -80.2 | 0 | 0 | 0 | 119.4 | ||||
| 233 | G | 38.5 | Very low | 38 | Very low | 84 Ų | 84 | 121 Ų | 121 | 87% | 0.866 | 85% | 0.846 | S | S | * | * | trans | -166.7 | 96.1 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 234 | N | 37.1 | Very low | 37.6 | Very low | 149 Ų | 149 | 121.4 Ų | 121.4 | 80% | 0.797 | 85% | 0.852 | S | S | * | * | trans | -76.8 | 145.3 | -177.8 | -165.8 | 26.5 | 0 | 0 | 0 | 111.7 | ||||
| 235 | S | 38.3 | Very low | 37.8 | Very low | 81 Ų | 81 | 123.8 Ų | 123.8 | 57% | 0.566 | 86% | 0.856 | S | S | * | * | trans | 66.4 | 139.7 | 139.6 | -79.6 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 236 | R | 40.6 | Very low | 38 | Very low | 247 Ų | 247 | 126.4 Ų | 126.4 | 93% | 0.932 | 86% | 0.859 | S | S | * | * | trans | 76.4 | 130.5 | 154.5 | -64 | 162.1 | -177.9 | -163.5 | -0.1 | 115.1 | ||||
| 237 | G | 37.4 | Very low | 38 | Very low | 76 Ų | 76 | 121.4 Ų | 121.4 | 78% | 0.784 | 86% | 0.855 | S | S | * | * | cis | 120.3 | 112.5 | 23.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 238 | G | 39.1 | Very low | 38.2 | Very low | 84 Ų | 84 | 124 Ų | 124 | 87% | 0.866 | 86% | 0.857 | S | S | * | * | trans | 63.9 | 113.2 | 146.9 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 239 | G | 39.9 | Very low | 38.4 | Very low | 76 Ų | 76 | 123.5 Ų | 123.5 | 78% | 0.784 | 87% | 0.867 | S | S | * | * | 98.1 | 129.9 | 109.9 | 0 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 240 | A | 44.2 | Very low | 38.3 | Very low | 113 Ų | 113 | 120.4 Ų | 120.4 | 93% | 0.934 | 87% | 0.873 | S | S | * | * | trans | 63.6 | 143.5 | 157 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 241 | G | 41.1 | Very low | 38.6 | Very low | 64 Ų | 64 | 123.3 Ų | 123.3 | 66% | 0.66 | 88% | 0.876 | S | S | * | * | cis | 138.7 | 142.1 | 17.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 242 | L | 40.7 | Very low | 39.1 | Very low | 192 Ų | 192 | 128.6 Ų | 128.6 | 100% | 1.005 | 90% | 0.897 | S | S | * | * | trans | 77.1 | 134.8 | 162.8 | -52.2 | 172.2 | 0 | 0 | 0 | 118.5 | ||||
| 243 | G | 35.8 | Very low | 39.3 | Very low | 155 Ų | 155 | 120.1 Ų | 120.1 | 100% | 1.598 | 89% | 0.89 | S | S | * | * | trans | 149.4 | 0 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.7 |
Retrieved 243 of 243 residues in 273.9 ms
(Link to these results)