| 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 | D | 82.4 | Confident | 95.5 | Very high | 158 Ų | 158 | 63.9 Ų | 63.9 | 85% | 0.845 | 32% | 0.323 | S | S | * | . | 0 | -47.2 | 0 | -51.8 | -28.8 | 0 | 0 | 0 | 114 | L3 K4 N5 | D1-L3 PolarHBondContact O-N 3.41Å; D1-K4 PolarHBondContact O-N 2.91Å; D1-K4 VanDerWaalsContact O-N 3.15Å; D1-N5 WeakPolarHBondContact O-CB 3.27Å; D1-N5 VanDerWaalsContact O-CG 3.28Å; D1-N5 PolarHBondContact O-N 3.2Å; D1-N5 PolarHBondContact O-OD1 3Å | |||
| 2 | L | 95.2 | Very high | 95.5 | Very high | 71 Ų | 71 | 72.1 Ų | 72.1 | 37% | 0.372 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -50 | -56.1 | -179.8 | -175 | 143.4 | 0 | 0 | 0 | 114.4 | K4 N5 A6 L23 N26 | L2-K4 PolarHBondContact O-N 3.47Å; L2-N5 PolarHBondContact O-N 3.43Å; L2-A6 WeakPolarHBondContact O-CB 3.32Å; L2-A6 PolarHBondContact O-N 2.81Å; L2-L23 HydrophobicContact CD2-CD2 3.71Å; L2-N26 HydrophobicContact CD2-CB 4.16Å |
| 3 | L | 97 | Very high | 95.6 | Very high | 30 Ų | 30 | 80.7 Ų | 80.7 | 16% | 0.157 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -65.4 | -37.6 | 179.4 | -66.5 | 177.4 | 0 | 0 | 0 | 112.8 | D1 A6 I7 L23 N26 A27 M30 L39 | D1-L3 PolarHBondContact O-N 3.41Å; L3-A6 PolarHBondContact O-N 2.93Å; L3-I7 WeakPolarHBondContact O-CD1 3.42Å; L3-I7 WeakPolarHBondContact O-CG1 3.4Å; L3-I7 PolarHBondContact O-N 3.24Å; L3-L23 HydrophobicContact CD2-CB 4.45Å; L3-L23 HydrophobicContact CD2-CD2 4.11Å; L3-N26 HydrophobicContact CD2-CB 4.19Å; L3-N26 HydrophobicContact CG-CB 4.4Å; L3-A27 HydrophobicContact CD1-CB 4.06Å; L3-A27 HydrophobicContact CD2-CB 4.38Å; L3-M30 HydrophobicContact CD1-SD 3.75Å; L3-L39 HydrophobicContact CD1-CD1 3.68Å |
| 4 | K | 97.3 | Very high | 95.6 | Very high | 93 Ų | 93 | 80.5 Ų | 80.5 | 40% | 0.404 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.6 | -49.7 | 177.4 | 172.9 | 170.5 | -177.1 | 178.4 | 0 | 110.9 | D1 L2 A6 I7 Q8 V46 | D1-K4 PolarHBondContact O-N 2.91Å; D1-K4 VanDerWaalsContact O-N 3.15Å; L2-K4 PolarHBondContact O-N 3.47Å; K4-A6 VanDerWaalsContact C-N 3.35Å; K4-A6 PolarHBondContact O-N 3.23Å; K4-I7 PolarHBondContact O-N 3.39Å; K4-Q8 WeakPolarHBondContact O-CG 3.4Å; K4-Q8 PolarHBondContact O-N 3.43Å; K4-Q8 VanDerWaalsContact O-N 3.08Å; K4-V46 HydrophobicContact CD-CG2 4.05Å; K4-V46 HydrophobicContact CG-CG2 3.74Å |
| 5 | N | 96.6 | Very high | 95.4 | Very high | 85 Ų | 85 | 81.9 Ų | 81.9 | 46% | 0.455 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.5 | -44 | 179.5 | -66.7 | -7.6 | 0 | 0 | 0 | 110.8 | D1 L2 I7 Q8 E9 | D1-N5 WeakPolarHBondContact O-CB 3.27Å; D1-N5 VanDerWaalsContact O-CG 3.28Å; D1-N5 PolarHBondContact O-N 3.2Å; D1-N5 PolarHBondContact O-OD1 3Å; L2-N5 PolarHBondContact O-N 3.43Å; N5-I7 VanDerWaalsContact C-N 3.34Å; N5-I7 PolarHBondContact O-N 3.43Å; N5-Q8 PolarHBondContact O-N 2.66Å; N5-Q8 VanDerWaalsContact O-N 3.15Å; N5-E9 WeakPolarHBondContact O-CG 3.46Å; N5-E9 PolarHBondContact O-N 3.07Å |
| 6 | A | 97.9 | Very high | 95.3 | Very high | 6 Ų | 6 | 83.6 Ų | 83.6 | 5% | 0.05 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -60.4 | -41.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L2 L3 K4 Q8 E9 I10 L18 L23 | L2-A6 WeakPolarHBondContact O-CB 3.32Å; L2-A6 PolarHBondContact O-N 2.81Å; L3-A6 PolarHBondContact O-N 2.93Å; K4-A6 VanDerWaalsContact C-N 3.35Å; K4-A6 PolarHBondContact O-N 3.23Å; A6-Q8 VanDerWaalsContact C-N 3.33Å; A6-Q8 PolarHBondContact O-N 2.92Å; A6-E9 PolarHBondContact O-N 3.16Å; A6-I10 VanDerWaalsContact O-CG1 3.29Å; A6-I10 WeakPolarHBondContact O-CG1 3.34Å; A6-I10 PolarHBondContact O-N 2.86Å; A6-L18 HydrophobicContact CB-CD1 4.34Å; A6-L18 HydrophobicContact CB-CD2 4.07Å; A6-L23 HydrophobicContact CB-CD1 3.88Å; A6-L23 HydrophobicContact CB-CD2 3.37Å; A6-L23 HydrophobicContact CB-CG 4.29Å |
| 7 | I | 97.1 | Very high | 95.1 | Very high | 39 Ų | 39 | 82.9 Ų | 82.9 | 20% | 0.2 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -61.6 | -43.3 | 175.2 | -67.6 | 160.1 | 0 | 0 | 0 | 110.6 | L3 K4 N5 I10 Q11 L43 V46 | L3-I7 WeakPolarHBondContact O-CD1 3.42Å; L3-I7 WeakPolarHBondContact O-CG1 3.4Å; L3-I7 PolarHBondContact O-N 3.24Å; K4-I7 PolarHBondContact O-N 3.39Å; N5-I7 VanDerWaalsContact C-N 3.34Å; N5-I7 PolarHBondContact O-N 3.43Å; I7-I10 PolarHBondContact O-N 3.41Å; I7-Q11 VanDerWaalsContact O-CG 3.3Å; I7-Q11 WeakPolarHBondContact O-CG 3.3Å; I7-Q11 PolarHBondContact O-N 2.87Å; I7-L43 HydrophobicContact CD1-CD1 3.77Å; I7-V46 HydrophobicContact CB-CG1 4.19Å; I7-V46 HydrophobicContact CG2-CB 4.48Å; I7-V46 HydrophobicContact CG2-CG1 3.59Å |
| 8 | Q | 96.7 | Very high | 95.2 | Very high | 39 Ų | 39 | 81.2 Ų | 81.2 | 18% | 0.182 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -65 | -38.6 | 177.4 | -70 | 177.5 | -36.8 | 0 | 0 | 112.5 | K4 N5 A6 Q11 R12 V46 | K4-Q8 WeakPolarHBondContact O-CG 3.4Å; K4-Q8 PolarHBondContact O-N 3.43Å; K4-Q8 VanDerWaalsContact O-N 3.08Å; N5-Q8 PolarHBondContact O-N 2.66Å; N5-Q8 VanDerWaalsContact O-N 3.15Å; A6-Q8 VanDerWaalsContact C-N 3.33Å; A6-Q8 PolarHBondContact O-N 2.92Å; Q8-Q11 WeakPolarHBondContact O-CB 3.3Å; Q8-Q11 PolarHBondContact O-N 3.37Å; Q8-R12 WeakPolarHBondContact O-CG 3.48Å; Q8-R12 PolarHBondContact O-N 3.01Å; Q8-V46 HydrophobicContact CG-CG1 3.88Å |
| 9 | E | 96.9 | Very high | 95.4 | Very high | 49 Ų | 49 | 79.8 Ų | 79.8 | 23% | 0.229 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -65.5 | -39.9 | 174.5 | -70.4 | -55.1 | 112.2 | 0 | 0 | 111.9 | N5 A6 Q11 R12 K13 N14 L18 | N5-E9 WeakPolarHBondContact O-CG 3.46Å; N5-E9 PolarHBondContact O-N 3.07Å; A6-E9 PolarHBondContact O-N 3.16Å; E9-Q11 PolarHBondContact O-N 3.38Å; E9-R12 CarbonylContact O-C 3.52Å; E9-R12 PolarHBondContact O-N 3.01Å; E9-R12 IonicContact OE1-CZ 3.83Å; E9-R12 IonicContact OE1-NH1 2.76Å; E9-R12 PolarHBondContact OE1-NH1 3Å; E9-K13 PolarHBondContact O-N 2.98Å; E9-N14 WeakPolarHBondContact O-CA 3.5Å; E9-N14 PolarHBondContact O-N 2.86Å; E9-N14 WeakPolarHBondContact OE2-CB 3.22Å; E9-N14 PolarHBondContact OE2-ND2 3.36Å; E9-L18 HydrophobicContact CB-CD1 4.28Å; E9-L18 HydrophobicContact CB-CD2 4.49Å |
| 10 | I | 96.9 | Very high | 95.4 | Very high | 89 Ų | 89 | 84.1 Ų | 84.1 | 46% | 0.456 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.5 | -44.4 | 172.9 | -68.2 | 165.3 | 0 | 0 | 0 | 110.8 | A6 I7 R12 K13 N15 L18 | A6-I10 VanDerWaalsContact O-CG1 3.29Å; A6-I10 WeakPolarHBondContact O-CG1 3.34Å; A6-I10 PolarHBondContact O-N 2.86Å; I7-I10 PolarHBondContact O-N 3.41Å; I10-R12 VanDerWaalsContact C-N 3.25Å; I10-R12 PolarHBondContact O-N 3.24Å; I10-K13 WeakPolarHBondContact O-CA 3.31Å; I10-K13 PolarHBondContact O-N 3.35Å; I10-N15 HydrophobicContact CG1-CB 4.46Å; I10-L18 HydrophobicContact CD1-CD1 4.01Å; I10-L18 HydrophobicContact CG1-CD1 3.52Å |
| 11 | Q | 96.3 | Very high | 95.5 | Very high | 44 Ų | 44 | 86.3 Ų | 86.3 | 21% | 0.206 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -60.6 | -34 | 176.4 | -73.3 | 168.9 | -17.9 | 0 | 0 | 112.3 | I7 Q8 E9 K13 V46 H50 | I7-Q11 VanDerWaalsContact O-CG 3.3Å; I7-Q11 WeakPolarHBondContact O-CG 3.3Å; I7-Q11 PolarHBondContact O-N 2.87Å; Q8-Q11 WeakPolarHBondContact O-CB 3.3Å; Q8-Q11 PolarHBondContact O-N 3.37Å; E9-Q11 PolarHBondContact O-N 3.38Å; Q11-K13 PolarHBondContact O-N 2.94Å; Q11-V46 PolarHBondContact NE2-O 3.49Å; Q11-H50 VanDerWaalsContact CD-CB 3.48Å; Q11-H50 VanDerWaalsContact CD-CG 3.48Å; Q11-H50 HydrophobicContact CG-CB 4.43Å |
| 12 | R | 95.6 | Very high | 96.2 | Very high | 162 Ų | 162 | 82.5 Ų | 82.5 | 61% | 0.611 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | 3.5 | 173 | -68.4 | 171 | -177.1 | 153.3 | 0.4 | 114.1 | Q8 E9 I10 N14 | Q8-R12 WeakPolarHBondContact O-CG 3.48Å; Q8-R12 PolarHBondContact O-N 3.01Å; E9-R12 CarbonylContact O-C 3.52Å; E9-R12 PolarHBondContact O-N 3.01Å; E9-R12 IonicContact OE1-CZ 3.83Å; E9-R12 IonicContact OE1-NH1 2.76Å; E9-R12 PolarHBondContact OE1-NH1 3Å; I10-R12 VanDerWaalsContact C-N 3.25Å; I10-R12 PolarHBondContact O-N 3.24Å; R12-N14 PolarHBondContact O-N 3.44Å |
| 13 | K | 96.2 | Very high | 96.3 | Very high | 184 Ų | 184 | 80.7 Ų | 80.7 | 80% | 0.8 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.7 | 22.8 | -173.2 | -54.4 | 179.3 | 176.9 | 178.7 | 0 | 113.8 | E9 I10 Q11 | E9-K13 PolarHBondContact O-N 2.98Å; I10-K13 WeakPolarHBondContact O-CA 3.31Å; I10-K13 PolarHBondContact O-N 3.35Å; Q11-K13 PolarHBondContact O-N 2.94Å |
| 14 | N | 95.6 | Very high | 96.4 | Very high | 78 Ų | 78 | 86.2 Ų | 86.2 | 42% | 0.417 | 44% | 0.436 | S | S | . | . | trans | -101.9 | 64.2 | 177.8 | -169.4 | 22.6 | 0 | 0 | 0 | 111.6 | E9 R12 | E9-N14 WeakPolarHBondContact O-CA 3.5Å; E9-N14 PolarHBondContact O-N 2.86Å; E9-N14 WeakPolarHBondContact OE2-CB 3.22Å; E9-N14 PolarHBondContact OE2-ND2 3.36Å; R12-N14 PolarHBondContact O-N 3.44Å | ||
| 15 | N | 93.4 | Very high | 96.4 | Very high | 102 Ų | 102 | 87.6 Ų | 87.6 | 55% | 0.545 | 44% | 0.439 | S | S | . | . | trans | -92.7 | -8.7 | -175.8 | 62.3 | 60.7 | 0 | 0 | 0 | 114.7 | I10 G17 L18 | I10-N15 HydrophobicContact CG1-CB 4.46Å; N15-G17 VanDerWaalsContact C-N 3.27Å; N15-G17 PolarHBondContact O-N 3.37Å; N15-L18 HydrophobicContact CB-CD1 4.43Å; N15-L18 WeakPolarHBondContact O-CB 3.38Å; N15-L18 PolarHBondContact O-N 3.03Å; N15-L18 VanDerWaalsContact O-N 3.14Å | ||
| 16 | S | 93.2 | Very high | 96.5 | Very high | 108 Ų | 108 | 86.2 Ų | 86.2 | 76% | 0.755 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -26.2 | -172 | 50.4 | 0 | 0 | 0 | 0 | 114.1 | ||
| 17 | G | 93.1 | Very high | 96.5 | Very high | 72 Ų | 72 | 87.3 Ų | 87.3 | 74% | 0.742 | 44% | 0.441 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | 2.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 115 | N15 | N15-G17 VanDerWaalsContact C-N 3.27Å; N15-G17 PolarHBondContact O-N 3.37Å |
| 18 | L | 97.1 | Very high | 96.5 | Very high | 53 Ų | 53 | 91.5 Ų | 91.5 | 28% | 0.277 | 46% | 0.455 | S | S | . | . | trans | -96 | 127.5 | -173 | -60.4 | -180 | 0 | 0 | 0 | 111.7 | A6 E9 I10 N15 F20 L23 | A6-L18 HydrophobicContact CB-CD1 4.34Å; A6-L18 HydrophobicContact CB-CD2 4.07Å; E9-L18 HydrophobicContact CB-CD1 4.28Å; E9-L18 HydrophobicContact CB-CD2 4.49Å; I10-L18 HydrophobicContact CD1-CD1 4.01Å; I10-L18 HydrophobicContact CG1-CD1 3.52Å; N15-L18 HydrophobicContact CB-CD1 4.43Å; N15-L18 WeakPolarHBondContact O-CB 3.38Å; N15-L18 PolarHBondContact O-N 3.03Å; N15-L18 VanDerWaalsContact O-N 3.14Å; L18-F20 PolarHBondContact O-N 3.15Å; L18-L23 HydrophobicContact CB-CD1 4.06Å; L18-L23 HydrophobicContact CD1-CD1 4.39Å | ||
| 19 | S | 97.5 | Very high | 96.6 | Very high | 54 Ų | 54 | 92.5 Ų | 92.5 | 38% | 0.378 | 46% | 0.463 | S | S | . | . | trans | -83 | 113.8 | 173.1 | 173.6 | 0 | 0 | 0 | 0 | 111 | E21 E22 L23 | S19-E21 VanDerWaalsContact C-N 3.34Å; S19-E21 PolarHBondContact O-N 3.08Å; S19-E22 PolarHBondContact O-N 3Å; S19-E22 PolarHBondContact OG-N 3.3Å; S19-L23 VanDerWaalsContact O-CG 3.27Å; S19-L23 WeakPolarHBondContact O-CG 3.35Å; S19-L23 PolarHBondContact O-N 2.95Å; S19-L23 VanDerWaalsContact O-N 3.09Å | ||
| 20 | F | 95.2 | Very high | 96.6 | Very high | 166 Ų | 166 | 92.6 Ų | 92.6 | 73% | 0.728 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -57.8 | -45.8 | 176.7 | 177.3 | -99.7 | 0 | 0 | 0 | 112.3 | L18 E22 L23 Y24 | L18-F20 PolarHBondContact O-N 3.15Å; F20-E22 VanDerWaalsContact C-N 3.35Å; F20-E22 PolarHBondContact O-N 3.48Å; F20-L23 PolarHBondContact O-N 2.76Å; F20-Y24 HydrophobicContact CZ-CD2 4.44Å; F20-Y24 VanDerWaalsContact O-CB 3.3Å; F20-Y24 WeakPolarHBondContact O-CB 3.24Å; F20-Y24 PolarHBondContact O-N 3.32Å |
| 21 | E | 98.1 | Very high | 96.6 | Very high | 131 Ų | 131 | 92.2 Ų | 92.2 | 61% | 0.612 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -61.1 | -43.6 | -178.3 | -167 | -151 | 144.6 | 0 | 0 | 111.6 | S19 R25 | S19-E21 VanDerWaalsContact C-N 3.34Å; S19-E21 PolarHBondContact O-N 3.08Å; E21-R25 VanDerWaalsContact O-CB 3.28Å; E21-R25 WeakPolarHBondContact O-CB 3.34Å; E21-R25 PolarHBondContact O-N 3.25Å; E21-R25 IonicContact OE1-NH1 3.01Å; E21-R25 PolarHBondContact OE1-NH1 3.34Å |
| 22 | E | 97.6 | Very high | 96.7 | Very high | 78 Ų | 78 | 94.7 Ų | 94.7 | 36% | 0.364 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.8 | -46.8 | 179.5 | -177.3 | 177.1 | -162.8 | 0 | 0 | 111.8 | S19 F20 Y24 R25 N26 | S19-E22 PolarHBondContact O-N 3Å; S19-E22 PolarHBondContact OG-N 3.3Å; F20-E22 VanDerWaalsContact C-N 3.35Å; F20-E22 PolarHBondContact O-N 3.48Å; E22-Y24 VanDerWaalsContact C-N 3.33Å; E22-Y24 PolarHBondContact O-N 3.36Å; E22-R25 PolarHBondContact O-N 3.3Å; E22-N26 WeakPolarHBondContact O-CB 3.47Å; E22-N26 PolarHBondContact O-N 3.19Å; E22-N26 PolarHBondContact O-ND2 3.49Å |
| 23 | L | 98.1 | Very high | 96.9 | Very high | 33 Ų | 33 | 92.4 Ų | 92.4 | 17% | 0.173 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 178.7 | -65.5 | 179.6 | 0 | 0 | 0 | 111 | L2 L3 A6 L18 S19 F20 N26 A27 | L2-L23 HydrophobicContact CD2-CD2 3.71Å; L3-L23 HydrophobicContact CD2-CB 4.45Å; L3-L23 HydrophobicContact CD2-CD2 4.11Å; A6-L23 HydrophobicContact CB-CD1 3.88Å; A6-L23 HydrophobicContact CB-CD2 3.37Å; A6-L23 HydrophobicContact CB-CG 4.29Å; L18-L23 HydrophobicContact CB-CD1 4.06Å; L18-L23 HydrophobicContact CD1-CD1 4.39Å; S19-L23 VanDerWaalsContact O-CG 3.27Å; S19-L23 WeakPolarHBondContact O-CG 3.35Å; S19-L23 PolarHBondContact O-N 2.95Å; S19-L23 VanDerWaalsContact O-N 3.09Å; F20-L23 PolarHBondContact O-N 2.76Å; L23-N26 PolarHBondContact O-N 3.48Å; L23-A27 WeakPolarHBondContact O-CB 3.3Å; L23-A27 PolarHBondContact O-N 3.42Å |
| 24 | Y | 97.9 | Very high | 96.9 | Very high | 145 Ų | 145 | 92.5 Ų | 92.5 | 57% | 0.569 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63 | -48.4 | 177.9 | -175.9 | -92.7 | 0 | 0 | 0 | 111.8 | F20 E22 N26 A27 Y28 | F20-Y24 HydrophobicContact CZ-CD2 4.44Å; F20-Y24 VanDerWaalsContact O-CB 3.3Å; F20-Y24 WeakPolarHBondContact O-CB 3.24Å; F20-Y24 PolarHBondContact O-N 3.32Å; E22-Y24 VanDerWaalsContact C-N 3.33Å; E22-Y24 PolarHBondContact O-N 3.36Å; Y24-N26 VanDerWaalsContact C-N 3.32Å; Y24-N26 PolarHBondContact O-N 2.94Å; Y24-A27 PolarHBondContact O-N 3.26Å; Y24-Y28 VanDerWaalsContact O-CB 3.29Å; Y24-Y28 WeakPolarHBondContact O-CB 3.48Å; Y24-Y28 PolarHBondContact O-N 3.45Å |
| 25 | R | 98.3 | Very high | 97 | Very high | 122 Ų | 122 | 93.9 Ų | 93.9 | 46% | 0.46 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.1 | -42.3 | 178.9 | -177.7 | 175.8 | 63 | -126.9 | -0.4 | 111.9 | E21 E22 T29 | E21-R25 VanDerWaalsContact O-CB 3.28Å; E21-R25 WeakPolarHBondContact O-CB 3.34Å; E21-R25 PolarHBondContact O-N 3.25Å; E21-R25 IonicContact OE1-NH1 3.01Å; E21-R25 PolarHBondContact OE1-NH1 3.34Å; E22-R25 PolarHBondContact O-N 3.3Å; R25-T29 WeakPolarHBondContact O-CB 3.44Å; R25-T29 PolarHBondContact O-N 3.02Å; R25-T29 PolarHBondContact O-OG1 3.46Å |
| 26 | N | 97.8 | Very high | 97.2 | Very high | 57 Ų | 57 | 90.4 Ų | 90.4 | 31% | 0.305 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.4 | -47.5 | 177.8 | -83.3 | -80.8 | 0 | 0 | 0 | 112 | L2 L3 E22 L23 Y24 Y28 T29 M30 | L2-N26 HydrophobicContact CD2-CB 4.16Å; L3-N26 HydrophobicContact CD2-CB 4.19Å; L3-N26 HydrophobicContact CG-CB 4.4Å; E22-N26 WeakPolarHBondContact O-CB 3.47Å; E22-N26 PolarHBondContact O-N 3.19Å; E22-N26 PolarHBondContact O-ND2 3.49Å; L23-N26 PolarHBondContact O-N 3.48Å; Y24-N26 VanDerWaalsContact C-N 3.32Å; Y24-N26 PolarHBondContact O-N 2.94Å; N26-Y28 PolarHBondContact O-N 3.47Å; N26-T29 PolarHBondContact O-N 3.3Å; N26-M30 WeakPolarHBondContact O-CG 3.36Å; N26-M30 PolarHBondContact O-N 3.4Å; N26-M30 VanDerWaalsContact O-N 3.09Å |
| 27 | A | 97.9 | Very high | 97.4 | Very high | 29 Ų | 29 | 92.8 Ų | 92.8 | 24% | 0.24 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -62.1 | -44 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | L3 L23 Y24 T29 M30 V31 L39 | L3-A27 HydrophobicContact CD1-CB 4.06Å; L3-A27 HydrophobicContact CD2-CB 4.38Å; L23-A27 WeakPolarHBondContact O-CB 3.3Å; L23-A27 PolarHBondContact O-N 3.42Å; Y24-A27 PolarHBondContact O-N 3.26Å; A27-T29 PolarHBondContact O-N 3.14Å; A27-M30 PolarHBondContact O-N 3.29Å; A27-V31 PolarHBondContact O-N 2.9Å; A27-V31 VanDerWaalsContact O-N 3.17Å; A27-L39 HydrophobicContact CB-CD2 4.31Å |
| 28 | Y | 97.9 | Very high | 97.5 | Very high | 127 Ų | 127 | 96.7 Ų | 96.7 | 50% | 0.498 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -58.3 | -46.9 | 175.1 | 176.2 | -96.7 | 0 | 0 | 0 | 111.7 | Y24 N26 M30 V31 L32 | Y24-Y28 VanDerWaalsContact O-CB 3.29Å; Y24-Y28 WeakPolarHBondContact O-CB 3.48Å; Y24-Y28 PolarHBondContact O-N 3.45Å; N26-Y28 PolarHBondContact O-N 3.47Å; Y28-M30 VanDerWaalsContact C-N 3.29Å; Y28-M30 PolarHBondContact O-N 3.48Å; Y28-V31 PolarHBondContact O-N 3.44Å; Y28-V31 VanDerWaalsContact O-N 3.14Å; Y28-L32 HydrophobicContact CE1-CB 4.4Å; Y28-L32 HydrophobicContact CE1-CD2 4Å; Y28-L32 WeakPolarHBondContact O-CB 3.21Å; Y28-L32 PolarHBondContact O-N 3.33Å |
| 29 | T | 98 | Very high | 97.6 | Very high | 59 Ų | 59 | 96.2 Ų | 96.2 | 36% | 0.362 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -59.9 | -38.8 | 179.2 | -60.6 | 0 | 0 | 0 | 0 | 111.8 | R25 N26 A27 H33 | R25-T29 WeakPolarHBondContact O-CB 3.44Å; R25-T29 PolarHBondContact O-N 3.02Å; R25-T29 PolarHBondContact O-OG1 3.46Å; N26-T29 PolarHBondContact O-N 3.3Å; A27-T29 PolarHBondContact O-N 3.14Å; T29-H33 PolarHBondContact O-N 2.96Å; T29-H33 VanDerWaalsContact O-N 3.12Å; T29-H33 PolarHBondContact O-ND1 3.41Å |
| 30 | M | 97.4 | Very high | 97.6 | Very high | 51 Ų | 51 | 101.3 Ų | 101.3 | 25% | 0.251 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63 | -45.7 | 175.2 | -71.8 | -170.4 | 68.5 | 0 | 0 | 112.1 | L3 N26 A27 Y28 H33 K34 H35 K38 L39 | L3-M30 HydrophobicContact CD1-SD 3.75Å; N26-M30 WeakPolarHBondContact O-CG 3.36Å; N26-M30 PolarHBondContact O-N 3.4Å; N26-M30 VanDerWaalsContact O-N 3.09Å; A27-M30 PolarHBondContact O-N 3.29Å; Y28-M30 VanDerWaalsContact C-N 3.29Å; Y28-M30 PolarHBondContact O-N 3.48Å; M30-H33 PolarHBondContact O-N 3.04Å; M30-K34 PolarHBondContact O-N 3.2Å; M30-H35 HydrophobicContact CB-CB 4.38Å; M30-H35 HydrophobicContact CE-CB 4.23Å; M30-H35 WeakPolarHBondContact O-CA 3.46Å; M30-H35 WeakPolarHBondContact O-CB 3.43Å; M30-H35 PolarHBondContact O-N 3.02Å; M30-K38 HydrophobicContact CE-CB 4.44Å; M30-K38 HydrophobicContact CE-CD 4.47Å; M30-K38 HydrophobicContact CE-CG 4.37Å; M30-L39 HydrophobicContact CE-CB 3.99Å; M30-L39 HydrophobicContact SD-CB 4.43Å; M30-L39 HydrophobicContact SD-CD1 4.2Å |
| 31 | V | 97.6 | Very high | 97.7 | Very high | 82 Ų | 82 | 95.4 Ų | 95.4 | 50% | 0.497 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -67.4 | -41.5 | 179.6 | 176.8 | 0 | 0 | 0 | 0 | 111.1 | A27 Y28 H33 K34 L39 | A27-V31 PolarHBondContact O-N 2.9Å; A27-V31 VanDerWaalsContact O-N 3.17Å; Y28-V31 PolarHBondContact O-N 3.44Å; Y28-V31 VanDerWaalsContact O-N 3.14Å; V31-H33 VanDerWaalsContact C-N 3.31Å; V31-H33 PolarHBondContact O-N 2.71Å; V31-K34 PolarHBondContact O-N 2.89Å; V31-L39 HydrophobicContact CG2-CD2 4.04Å |
| 32 | L | 98.3 | Very high | 97.6 | Very high | 96 Ų | 96 | 90.4 Ų | 90.4 | 50% | 0.503 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -56.1 | -45.6 | 177.2 | -177.9 | 66 | 0 | 0 | 0 | 111.4 | Y28 K34 | Y28-L32 HydrophobicContact CE1-CB 4.4Å; Y28-L32 HydrophobicContact CE1-CD2 4Å; Y28-L32 WeakPolarHBondContact O-CB 3.21Å; Y28-L32 PolarHBondContact O-N 3.33Å; L32-K34 PolarHBondContact O-N 3.37Å |
| 33 | H | 98.1 | Very high | 97.6 | Very high | 113 Ų | 113 | 90.3 Ų | 90.3 | 52% | 0.523 | 44% | 0.437 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.7 | 21.1 | 177.9 | -62.8 | 100 | 0 | 0 | 0 | 113.8 | T29 M30 V31 H35 | T29-H33 PolarHBondContact O-N 2.96Å; T29-H33 VanDerWaalsContact O-N 3.12Å; T29-H33 PolarHBondContact O-ND1 3.41Å; M30-H33 PolarHBondContact O-N 3.04Å; V31-H33 VanDerWaalsContact C-N 3.31Å; V31-H33 PolarHBondContact O-N 2.71Å; H33-H35 PolarHBondContact O-N 2.82Å |
| 34 | K | 97.3 | Very high | 97.6 | Very high | 187 Ų | 187 | 95.7 Ų | 95.7 | 81% | 0.813 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.6 | 21.8 | 175.2 | -50.1 | -61.5 | -177.1 | 179.6 | 0 | 114.8 | M30 V31 L32 G36 | M30-K34 PolarHBondContact O-N 3.2Å; V31-K34 PolarHBondContact O-N 2.89Å; L32-K34 PolarHBondContact O-N 3.37Å; K34-G36 VanDerWaalsContact C-N 3.26Å; K34-G36 PolarHBondContact O-N 3.15Å |
| 35 | H | 97.4 | Very high | 97.6 | Very high | 107 Ų | 107 | 94.3 Ų | 94.3 | 50% | 0.495 | 45% | 0.453 | S | S | . | . | trans | -91.9 | 25.1 | 172.5 | -59.3 | -49.6 | 0 | 0 | 0 | 113.1 | M30 H33 E37 K38 L39 | M30-H35 HydrophobicContact CB-CB 4.38Å; M30-H35 HydrophobicContact CE-CB 4.23Å; M30-H35 WeakPolarHBondContact O-CA 3.46Å; M30-H35 WeakPolarHBondContact O-CB 3.43Å; M30-H35 PolarHBondContact O-N 3.02Å; H33-H35 PolarHBondContact O-N 2.82Å; H35-E37 VanDerWaalsContact C-N 3.33Å; H35-E37 PolarHBondContact O-N 3.38Å; H35-K38 PolarHBondContact O-N 3.14Å; H35-L39 PolarHBondContact O-N 3.24Å; H35-L39 VanDerWaalsContact O-N 3.14Å | ||
| 36 | G | 97 | Very high | 97.6 | Very high | 28 Ų | 28 | 88.8 Ų | 88.8 | 29% | 0.289 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.1 | -37.5 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | K34 K38 L39 Y40 | K34-G36 VanDerWaalsContact C-N 3.26Å; K34-G36 PolarHBondContact O-N 3.15Å; G36-K38 PolarHBondContact O-N 3.17Å; G36-L39 PolarHBondContact O-N 3.42Å; G36-Y40 WeakPolarHBondContact O-CB 3.29Å; G36-Y40 PolarHBondContact O-N 3.48Å |
| 37 | E | 97.6 | Very high | 97.5 | Very high | 158 Ų | 158 | 88.7 Ų | 88.7 | 74% | 0.738 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -63.2 | -41.4 | 177.3 | -173.1 | -178.4 | -175.7 | 0 | 0 | 112 | H35 Y40 T41 | H35-E37 VanDerWaalsContact C-N 3.33Å; H35-E37 PolarHBondContact O-N 3.38Å; E37-Y40 PolarHBondContact O-N 2.82Å; E37-T41 VanDerWaalsContact O-CB 3.31Å; E37-T41 WeakPolarHBondContact O-CB 3.43Å; E37-T41 PolarHBondContact O-N 2.85Å; E37-T41 PolarHBondContact O-OG1 3.46Å |
| 38 | K | 96.6 | Very high | 97.5 | Very high | 155 Ų | 155 | 90.4 Ų | 90.4 | 67% | 0.674 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -63.5 | -42.9 | 175.3 | -176.8 | 175.5 | -178.4 | 175.4 | 0 | 111.3 | M30 H35 G36 G42 | M30-K38 HydrophobicContact CE-CB 4.44Å; M30-K38 HydrophobicContact CE-CD 4.47Å; M30-K38 HydrophobicContact CE-CG 4.37Å; H35-K38 PolarHBondContact O-N 3.14Å; G36-K38 PolarHBondContact O-N 3.17Å; K38-G42 PolarHBondContact O-N 3.3Å |
| 39 | L | 97.3 | Very high | 97.5 | Very high | 43 Ų | 43 | 88.5 Ų | 88.5 | 23% | 0.225 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -62.2 | -47.2 | 176.2 | 179.3 | 60.2 | 0 | 0 | 0 | 111.2 | L3 A27 M30 V31 H35 G36 L43 | L3-L39 HydrophobicContact CD1-CD1 3.68Å; A27-L39 HydrophobicContact CB-CD2 4.31Å; M30-L39 HydrophobicContact CE-CB 3.99Å; M30-L39 HydrophobicContact SD-CB 4.43Å; M30-L39 HydrophobicContact SD-CD1 4.2Å; V31-L39 HydrophobicContact CG2-CD2 4.04Å; H35-L39 PolarHBondContact O-N 3.24Å; H35-L39 VanDerWaalsContact O-N 3.14Å; G36-L39 PolarHBondContact O-N 3.42Å; L39-L43 WeakPolarHBondContact O-CB 3.4Å; L39-L43 PolarHBondContact O-N 3.03Å |
| 40 | Y | 97.8 | Very high | 97.4 | Very high | 161 Ų | 161 | 88.3 Ų | 88.3 | 63% | 0.631 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -64.7 | -46.7 | -179 | -173 | -93.3 | 0 | 0 | 0 | 112.2 | G36 E37 L43 R44 | G36-Y40 WeakPolarHBondContact O-CB 3.29Å; G36-Y40 PolarHBondContact O-N 3.48Å; E37-Y40 PolarHBondContact O-N 2.82Å; Y40-L43 PolarHBondContact O-N 3.31Å; Y40-R44 PolarHBondContact O-N 3.49Å |
| 41 | T | 97.9 | Very high | 97.3 | Very high | 41 Ų | 41 | 91.1 Ų | 91.1 | 25% | 0.252 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.4 | -47.3 | 178.8 | -57.8 | 0 | 0 | 0 | 0 | 110.9 | E37 L43 R44 E45 | E37-T41 VanDerWaalsContact O-CB 3.31Å; E37-T41 WeakPolarHBondContact O-CB 3.43Å; E37-T41 PolarHBondContact O-N 2.85Å; E37-T41 PolarHBondContact O-OG1 3.46Å; T41-L43 PolarHBondContact O-N 3.34Å; T41-R44 WeakPolarHBondContact O-CB 3.49Å; T41-R44 PolarHBondContact O-N 3.27Å; T41-E45 WeakPolarHBondContact O-CG 3.5Å; T41-E45 PolarHBondContact O-N 3.09Å |
| 42 | G | 96.9 | Very high | 97.2 | Very high | 26 Ų | 26 | 93.2 Ų | 93.2 | 27% | 0.268 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.4 | -38.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | K38 E45 V46 | K38-G42 PolarHBondContact O-N 3.3Å; G42-E45 PolarHBondContact O-N 2.85Å; G42-V46 VanDerWaalsContact O-CG2 3.24Å; G42-V46 WeakPolarHBondContact O-CG2 3.49Å; G42-V46 PolarHBondContact O-N 3.4Å |
| 43 | L | 97.5 | Very high | 97 | Very high | 77 Ų | 77 | 93.8 Ų | 93.8 | 40% | 0.403 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -60.8 | -48.5 | 173.6 | 174.7 | 65.3 | 0 | 0 | 0 | 111.2 | I7 L39 Y40 T41 E45 V46 V47 | I7-L43 HydrophobicContact CD1-CD1 3.77Å; L39-L43 WeakPolarHBondContact O-CB 3.4Å; L39-L43 PolarHBondContact O-N 3.03Å; Y40-L43 PolarHBondContact O-N 3.31Å; T41-L43 PolarHBondContact O-N 3.34Å; L43-E45 VanDerWaalsContact C-N 3.31Å; L43-E45 PolarHBondContact O-N 3.37Å; L43-V46 PolarHBondContact O-N 3.43Å; L43-V47 HydrophobicContact CD1-CG2 3.92Å; L43-V47 HydrophobicContact CG-CG2 4.47Å; L43-V47 WeakPolarHBondContact O-CG2 3.29Å; L43-V47 PolarHBondContact O-N 3.14Å |
| 44 | R | 98.1 | Very high | 95.5 | Very high | 145 Ų | 145 | 95 Ų | 95 | 55% | 0.547 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -56.9 | -46.6 | 178.3 | -176.9 | -179.1 | 66.5 | -173.5 | -0.8 | 110.9 | Y40 T41 T48 | Y40-R44 PolarHBondContact O-N 3.49Å; T41-R44 WeakPolarHBondContact O-CB 3.49Å; T41-R44 PolarHBondContact O-N 3.27Å; R44-T48 WeakPolarHBondContact O-CB 3.3Å; R44-T48 PolarHBondContact O-N 2.84Å; R44-T48 PolarHBondContact O-OG1 2.81Å |
| 45 | E | 97.3 | Very high | 93.3 | Very high | 117 Ų | 117 | 98.6 Ų | 98.6 | 55% | 0.547 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.1 | -51.8 | 178.6 | -73.1 | 170.3 | -178 | 0 | 0 | 112 | T41 G42 L43 V47 T48 E49 | T41-E45 WeakPolarHBondContact O-CG 3.5Å; T41-E45 PolarHBondContact O-N 3.09Å; G42-E45 PolarHBondContact O-N 2.85Å; L43-E45 VanDerWaalsContact C-N 3.31Å; L43-E45 PolarHBondContact O-N 3.37Å; E45-V47 VanDerWaalsContact C-N 3.34Å; E45-V47 PolarHBondContact O-N 2.92Å; E45-T48 PolarHBondContact O-N 3.47Å; E45-E49 VanDerWaalsContact O-CB 3.3Å; E45-E49 WeakPolarHBondContact O-CB 3.39Å; E45-E49 PolarHBondContact O-N 3.46Å |
| 46 | V | 97.2 | Very high | 93.1 | Very high | 6 Ų | 6 | 98.2 Ų | 98.2 | 4% | 0.036 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -63.7 | -39 | -177.2 | 174.2 | 0 | 0 | 0 | 0 | 112.1 | K4 I7 Q8 Q11 G42 L43 H50 | K4-V46 HydrophobicContact CD-CG2 4.05Å; K4-V46 HydrophobicContact CG-CG2 3.74Å; I7-V46 HydrophobicContact CB-CG1 4.19Å; I7-V46 HydrophobicContact CG2-CB 4.48Å; I7-V46 HydrophobicContact CG2-CG1 3.59Å; Q8-V46 HydrophobicContact CG-CG1 3.88Å; Q11-V46 PolarHBondContact NE2-O 3.49Å; G42-V46 VanDerWaalsContact O-CG2 3.24Å; G42-V46 WeakPolarHBondContact O-CG2 3.49Å; G42-V46 PolarHBondContact O-N 3.4Å; L43-V46 PolarHBondContact O-N 3.43Å; V46-H50 WeakPolarHBondContact O-CB 3.27Å; V46-H50 PolarHBondContact O-N 3.01Å; V46-H50 VanDerWaalsContact O-N 3.16Å |
| 47 | V | 97.1 | Very high | 92.9 | Very high | 55 Ų | 55 | 101.9 Ų | 101.9 | 33% | 0.333 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -69.4 | -43.7 | 176.2 | 174.9 | 0 | 0 | 0 | 0 | 110.8 | L43 E45 H50 L51 | L43-V47 HydrophobicContact CD1-CG2 3.92Å; L43-V47 HydrophobicContact CG-CG2 4.47Å; L43-V47 WeakPolarHBondContact O-CG2 3.29Å; L43-V47 PolarHBondContact O-N 3.14Å; E45-V47 VanDerWaalsContact C-N 3.34Å; E45-V47 PolarHBondContact O-N 2.92Å; V47-H50 PolarHBondContact O-N 3.25Å; V47-L51 HydrophobicContact CG1-CD1 3.91Å; V47-L51 HydrophobicContact CG1-CG 4.42Å; V47-L51 VanDerWaalsContact O-CG 3.3Å; V47-L51 WeakPolarHBondContact O-CG 3.48Å; V47-L51 PolarHBondContact O-N 3.41Å |
| 48 | T | 97.8 | Very high | 92.6 | Very high | 64 Ų | 64 | 98.8 Ų | 98.8 | 39% | 0.393 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.2 | -46.8 | 178.2 | -58.2 | 0 | 0 | 0 | 0 | 111.1 | R44 E45 H50 L51 I52 | R44-T48 WeakPolarHBondContact O-CB 3.3Å; R44-T48 PolarHBondContact O-N 2.84Å; R44-T48 PolarHBondContact O-OG1 2.81Å; E45-T48 PolarHBondContact O-N 3.47Å; T48-H50 VanDerWaalsContact C-N 3.34Å; T48-H50 PolarHBondContact O-N 3.12Å; T48-L51 PolarHBondContact O-N 2.71Å; T48-I52 HydrophobicContact CG2-CD1 3.47Å; T48-I52 VanDerWaalsContact CG2-CD1 3.47Å; T48-I52 HydrophobicContact CG2-CG1 4.18Å; T48-I52 WeakPolarHBondContact O-CB 3.36Å; T48-I52 VanDerWaalsContact O-CG1 3.32Å; T48-I52 WeakPolarHBondContact O-CG1 3.32Å; T48-I52 PolarHBondContact O-N 2.92Å |
| 49 | E | 96.9 | Very high | 92.4 | Very high | 88 Ų | 88 | 95.5 Ų | 95.5 | 41% | 0.411 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -55.8 | -47.5 | 176.6 | -174.2 | -175.7 | 177.9 | 0 | 0 | 111.4 | E45 L51 I52 N53 | E45-E49 VanDerWaalsContact O-CB 3.3Å; E45-E49 WeakPolarHBondContact O-CB 3.39Å; E45-E49 PolarHBondContact O-N 3.46Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 2.91Å; E49-I52 PolarHBondContact O-N 3.09Å; E49-N53 WeakPolarHBondContact CG-ND2 3.28Å; E49-N53 VanDerWaalsContact O-CB 3.27Å; E49-N53 WeakPolarHBondContact O-CB 3.46Å; E49-N53 PolarHBondContact O-N 3.38Å; E49-N53 PolarHBondContact O-ND2 3.42Å |
| 50 | H | 95.8 | Very high | 92.1 | Very high | 55 Ų | 55 | 98.8 Ų | 98.8 | 26% | 0.255 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.4 | -36.6 | 178.8 | 178 | 69.8 | 0 | 0 | 0 | 113.5 | Q11 V46 V47 T48 K54 | Q11-H50 VanDerWaalsContact CD-CB 3.48Å; Q11-H50 VanDerWaalsContact CD-CG 3.48Å; Q11-H50 HydrophobicContact CG-CB 4.43Å; V46-H50 WeakPolarHBondContact O-CB 3.27Å; V46-H50 PolarHBondContact O-N 3.01Å; V46-H50 VanDerWaalsContact O-N 3.16Å; V47-H50 PolarHBondContact O-N 3.25Å; T48-H50 VanDerWaalsContact C-N 3.34Å; T48-H50 PolarHBondContact O-N 3.12Å; H50-K54 WeakPolarHBondContact O-CB 3.49Å |
| 51 | L | 95.9 | Very high | 91.7 | Very high | 109 Ų | 109 | 94.6 Ų | 94.6 | 57% | 0.571 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -78.1 | -32.9 | -179.3 | -67.4 | 176 | 0 | 0 | 0 | 112.7 | V47 T48 E49 | V47-L51 HydrophobicContact CG1-CD1 3.91Å; V47-L51 HydrophobicContact CG1-CG 4.42Å; V47-L51 VanDerWaalsContact O-CG 3.3Å; V47-L51 WeakPolarHBondContact O-CG 3.48Å; V47-L51 PolarHBondContact O-N 3.41Å; T48-L51 PolarHBondContact O-N 2.71Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 2.91Å |
| 52 | I | 96.8 | Very high | 91.3 | Very high | 127 Ų | 127 | 98.4 Ų | 98.4 | 65% | 0.651 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -76.7 | -46.3 | 177.5 | -68 | 175.5 | 0 | 0 | 0 | 110.8 | T48 E49 K54 | T48-I52 HydrophobicContact CG2-CD1 3.47Å; T48-I52 VanDerWaalsContact CG2-CD1 3.47Å; T48-I52 HydrophobicContact CG2-CG1 4.18Å; T48-I52 WeakPolarHBondContact O-CB 3.36Å; T48-I52 VanDerWaalsContact O-CG1 3.32Å; T48-I52 WeakPolarHBondContact O-CG1 3.32Å; T48-I52 PolarHBondContact O-N 2.92Å; E49-I52 PolarHBondContact O-N 3.09Å; I52-K54 PolarHBondContact O-N 3.35Å |
| 53 | N | 92.2 | Very high | 90.8 | Very high | 108 Ų | 108 | 104 Ų | 104 | 58% | 0.578 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -87.9 | 19.9 | -174.5 | -59.8 | -25.7 | 0 | 0 | 0 | 112.8 | E49 E55 | E49-N53 WeakPolarHBondContact CG-ND2 3.28Å; E49-N53 VanDerWaalsContact O-CB 3.27Å; E49-N53 WeakPolarHBondContact O-CB 3.46Å; E49-N53 PolarHBondContact O-N 3.38Å; E49-N53 PolarHBondContact O-ND2 3.42Å; N53-E55 PolarHBondContact O-N 3.01Å |
| 54 | K | 68 | Low | 90.3 | Very high | 137 Ų | 137 | 106.3 Ų | 106.3 | 60% | 0.596 | 51% | 0.513 | S | S | * | . | trans | -75.6 | 92.3 | -179.3 | -134.9 | -174.6 | -174.3 | -174.6 | 0 | 109.2 | H50 I52 | H50-K54 WeakPolarHBondContact O-CB 3.49Å; I52-K54 PolarHBondContact O-N 3.35Å | ||
| 55 | E | 50.4 | Low | 89.6 | Confident | 264 Ų | 264 | 102.7 Ų | 102.7 | 100% | 1.234 | 51% | 0.509 | S | S | * | . | trans | -78.4 | 0 | 154.1 | -68 | -168.2 | 153.1 | 0 | 0 | 110.2 | N53 | N53-E55 PolarHBondContact O-N 3.01Š|
Retrieved 55 of 55 residues in 40.1 ms
(Link to these results)