| 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 | 47.6 | Very low | 83.9 | Confident | 231 Ų | 231 | 112.8 Ų | 112.8 | 100% | 1.138 | 64% | 0.639 | S | S | * | * | 0 | 114.1 | 0 | -89.3 | 64.7 | 117.9 | 0 | 0 | 108.7 | |||||
| 2 | G | 70.2 | Confident | 84.9 | Confident | 72 Ų | 72 | 114.3 Ų | 114.3 | 74% | 0.742 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 148.8 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 3 | F | 76 | Confident | 85.8 | Confident | 166 Ų | 166 | 116.2 Ų | 116.2 | 73% | 0.728 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 134.1 | 167.1 | -65.5 | -84.9 | 0 | 0 | 0 | 108.1 | ||
| 4 | S | 85.5 | Confident | 86.6 | Confident | 107 Ų | 107 | 113.3 Ų | 113.3 | 75% | 0.748 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 163.8 | 169.2 | 61.4 | 0 | 0 | 0 | 0 | 110.4 | ||
| 5 | E | 86.6 | Confident | 87.2 | Confident | 127 Ų | 127 | 109.2 Ų | 109.2 | 59% | 0.593 | 59% | 0.588 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 141.5 | 172 | -159.9 | 168 | 142.7 | 0 | 0 | 111.2 | ||
| 6 | G | 87.8 | Confident | 87.8 | Confident | 53 Ų | 53 | 107.7 Ų | 107.7 | 55% | 0.546 | 58% | 0.584 | S | S | . | * | trans | -106.2 | 157.7 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | I8 | G6-I8 PolarHBondContact O-N 2.81Š| ||
| 7 | D | 93.6 | Very high | 88.3 | Confident | 77 Ų | 77 | 109.2 Ų | 109.2 | 41% | 0.412 | 59% | 0.586 | S | S | . | * | trans | -76.5 | 113.1 | 173 | 178.7 | -33.9 | 0 | 0 | 0 | 110.1 | E9 K10 G11 | D7-E9 PolarHBondContact O-N 2.94Å; D7-E9 PolarHBondContact OD1-N 3.38Å; D7-E9 VanDerWaalsContact OD1-N 3.09Å; D7-K10 HydrophobicContact CB-CB 4.02Å; D7-K10 HydrophobicContact CB-CD 4.01Å; D7-K10 HydrophobicContact CB-CG 4.2Å; D7-K10 PolarHBondContact O-N 3.09Å; D7-K10 PolarHBondContact OD1-N 2.91Å; D7-K10 WeakPolarHBondContact OD2-CD 3.4Å; D7-K10 WeakPolarHBondContact OD2-CE 3.33Å; D7-K10 WeakPolarHBondContact OD2-CG 3.2Å; D7-K10 IonicContact OD2-NZ 2.81Å; D7-K10 PolarHBondContact OD2-NZ 3.1Å; D7-G11 PolarHBondContact O-N 3.44Å | ||
| 8 | I | 92.5 | Very high | 88.8 | Confident | 133 Ų | 133 | 114 Ų | 114 | 68% | 0.682 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -61.8 | -41.7 | -174.9 | -64.4 | 176.2 | 0 | 0 | 0 | 111.6 | G6 G11 K12 | G6-I8 PolarHBondContact O-N 2.81Å; I8-G11 PolarHBondContact O-N 2.84Å; I8-K12 WeakPolarHBondContact O-CB 3.13Å; I8-K12 PolarHBondContact O-N 3.45Å |
| 9 | E | 94.5 | Very high | 89.2 | Confident | 109 Ų | 109 | 110.3 Ų | 110.3 | 51% | 0.509 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -70.3 | -39.3 | -177.8 | -77.4 | -60.3 | 117 | 0 | 0 | 111.5 | D7 K12 K13 | D7-E9 PolarHBondContact O-N 2.94Å; D7-E9 PolarHBondContact OD1-N 3.38Å; D7-E9 VanDerWaalsContact OD1-N 3.09Å; E9-K12 PolarHBondContact O-N 3.37Å; E9-K13 WeakPolarHBondContact O-CG 3.43Å; E9-K13 PolarHBondContact O-N 3.25Å; E9-K13 VanDerWaalsContact O-N 3.1Å |
| 10 | K | 94.9 | Very high | 89.6 | Confident | 131 Ų | 131 | 106.5 Ų | 106.5 | 57% | 0.57 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.2 | -41.5 | 170.2 | -71 | 178.8 | -169.1 | 133.9 | 0 | 111.4 | D7 K12 K13 L14 | D7-K10 HydrophobicContact CB-CB 4.02Å; D7-K10 HydrophobicContact CB-CD 4.01Å; D7-K10 HydrophobicContact CB-CG 4.2Å; D7-K10 PolarHBondContact O-N 3.09Å; D7-K10 PolarHBondContact OD1-N 2.91Å; D7-K10 WeakPolarHBondContact OD2-CD 3.4Å; D7-K10 WeakPolarHBondContact OD2-CE 3.33Å; D7-K10 WeakPolarHBondContact OD2-CG 3.2Å; D7-K10 IonicContact OD2-NZ 2.81Å; D7-K10 PolarHBondContact OD2-NZ 3.1Å; K10-K12 VanDerWaalsContact C-N 3.33Å; K10-K12 PolarHBondContact O-N 3.25Å; K10-K13 PolarHBondContact O-N 3.4Å; K10-L14 WeakPolarHBondContact O-CB 3.47Å; K10-L14 WeakPolarHBondContact O-CG 3.3Å; K10-L14 PolarHBondContact O-N 3.43Å |
| 11 | G | 93.6 | Very high | 89.9 | Confident | 35 Ų | 35 | 108.6 Ų | 108.6 | 36% | 0.361 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -57.9 | -44.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | D7 I8 L14 F15 | D7-G11 PolarHBondContact O-N 3.44Å; I8-G11 PolarHBondContact O-N 2.84Å; G11-L14 PolarHBondContact O-N 3.48Å; G11-F15 WeakPolarHBondContact O-CB 3.47Å; G11-F15 PolarHBondContact O-N 2.87Å |
| 12 | K | 95.5 | Very high | 92.3 | Very high | 131 Ų | 131 | 99.9 Ų | 99.9 | 57% | 0.57 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.3 | -48.2 | 174.9 | -176.5 | 179 | 178.1 | -177.9 | 0 | 111.8 | I8 E9 K10 L14 F15 V16 | I8-K12 WeakPolarHBondContact O-CB 3.13Å; I8-K12 PolarHBondContact O-N 3.45Å; E9-K12 PolarHBondContact O-N 3.37Å; K10-K12 VanDerWaalsContact C-N 3.33Å; K10-K12 PolarHBondContact O-N 3.25Å; K12-L14 PolarHBondContact O-N 2.84Å; K12-F15 PolarHBondContact O-N 3.5Å; K12-V16 WeakPolarHBondContact O-CG2 3.48Å; K12-V16 PolarHBondContact O-N 2.68Å |
| 13 | K | 96.7 | Very high | 93.6 | Very high | 138 Ų | 138 | 98.8 Ų | 98.8 | 60% | 0.6 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.1 | -46 | 177.1 | -73 | 175.2 | -177.8 | 176.1 | 0 | 111.7 | E9 K10 F15 V16 Q17 | E9-K13 WeakPolarHBondContact O-CG 3.43Å; E9-K13 PolarHBondContact O-N 3.25Å; E9-K13 VanDerWaalsContact O-N 3.1Å; K10-K13 PolarHBondContact O-N 3.4Å; K13-F15 VanDerWaalsContact C-N 3.35Å; K13-F15 PolarHBondContact O-N 3.44Å; K13-V16 PolarHBondContact O-N 3.35Å; K13-Q17 WeakPolarHBondContact O-CB 3.39Å; K13-Q17 VanDerWaalsContact O-CG 3.3Å; K13-Q17 WeakPolarHBondContact O-CG 3.42Å; K13-Q17 PolarHBondContact O-N 2.87Å |
| 14 | L | 96.6 | Very high | 94.6 | Very high | 76 Ų | 76 | 91.9 Ų | 91.9 | 40% | 0.398 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.9 | -41.1 | 177.4 | -72 | 171.7 | 0 | 0 | 0 | 112 | K10 G11 K12 Q17 R18 | K10-L14 WeakPolarHBondContact O-CB 3.47Å; K10-L14 WeakPolarHBondContact O-CG 3.3Å; K10-L14 PolarHBondContact O-N 3.43Å; G11-L14 PolarHBondContact O-N 3.48Å; K12-L14 PolarHBondContact O-N 2.84Å; L14-Q17 PolarHBondContact O-N 2.86Å; L14-R18 WeakPolarHBondContact O-CB 3.44Å; L14-R18 PolarHBondContact O-N 3.25Å |
| 15 | F | 96.3 | Very high | 95.1 | Very high | 52 Ų | 52 | 90.3 Ų | 90.3 | 23% | 0.228 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -61.8 | -46.5 | 177.3 | -172.7 | -86.1 | 0 | 0 | 0 | 111.3 | G11 K12 K13 Q17 R18 C19 S20 H23 V25 L37 | G11-F15 WeakPolarHBondContact O-CB 3.47Å; G11-F15 PolarHBondContact O-N 2.87Å; K12-F15 PolarHBondContact O-N 3.5Å; K13-F15 VanDerWaalsContact C-N 3.35Å; K13-F15 PolarHBondContact O-N 3.44Å; F15-Q17 VanDerWaalsContact C-N 3.33Å; F15-Q17 PolarHBondContact O-N 3.48Å; F15-R18 PolarHBondContact O-N 2.87Å; F15-C19 HydrophobicContact CD1-CB 4.3Å; F15-C19 HydrophobicContact CD2-CB 3.52Å; F15-C19 HydrophobicContact CE1-CB 4.27Å; F15-C19 HydrophobicContact CE2-CB 3.49Å; F15-C19 VanDerWaalsContact CE2-CB 3.49Å; F15-C19 HydrophobicContact CG-CB 3.93Å; F15-C19 HydrophobicContact CZ-CB 3.87Å; F15-C19 CarbonylContact O-C 3.56Å; F15-C19 WeakPolarHBondContact O-CA 3.34Å; F15-C19 WeakPolarHBondContact O-CB 3.34Å; F15-C19 PolarHBondContact O-N 3Å; F15-S20 PolarHBondContact O-N 3.32Å; F15-H23 HydrophobicContact CZ-CB 4.12Å; F15-V25 HydrophobicContact CE1-CG1 3.95Å; F15-V25 HydrophobicContact CE2-CG1 3.75Å; F15-V25 HydrophobicContact CZ-CG1 3.4Å; F15-V25 VanDerWaalsContact CZ-CG1 3.4Å; F15-L37 HydrophobicContact CE2-CD1 4.01Å; F15-L37 HydrophobicContact CZ-CD1 4.4Å |
| 16 | V | 96.2 | Very high | 95.5 | Very high | 85 Ų | 85 | 90.8 Ų | 90.8 | 52% | 0.515 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59 | -47.4 | 176.7 | 174.2 | 0 | 0 | 0 | 0 | 110.4 | K12 K13 S20 | K12-V16 WeakPolarHBondContact O-CG2 3.48Å; K12-V16 PolarHBondContact O-N 2.68Å; K13-V16 PolarHBondContact O-N 3.35Å; V16-S20 PolarHBondContact O-OG 3.01Å |
| 17 | Q | 97.3 | Very high | 95.8 | Very high | 133 Ų | 133 | 97.3 Ų | 97.3 | 62% | 0.621 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -70 | -34.9 | -176.3 | -71.9 | 175.3 | -21.6 | 0 | 0 | 114.1 | K13 L14 F15 | K13-Q17 WeakPolarHBondContact O-CB 3.39Å; K13-Q17 VanDerWaalsContact O-CG 3.3Å; K13-Q17 WeakPolarHBondContact O-CG 3.42Å; K13-Q17 PolarHBondContact O-N 2.87Å; L14-Q17 PolarHBondContact O-N 2.86Å; F15-Q17 VanDerWaalsContact C-N 3.33Å; F15-Q17 PolarHBondContact O-N 3.48Å |
| 18 | R | 96.7 | Very high | 95.7 | Very high | 196 Ų | 196 | 97.5 Ų | 97.5 | 74% | 0.74 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -117.3 | -22.6 | -166.4 | -58 | -175.3 | 178.9 | -173.3 | -0.9 | 114.9 | L14 F15 | L14-R18 WeakPolarHBondContact O-CB 3.44Å; L14-R18 PolarHBondContact O-N 3.25Å; F15-R18 PolarHBondContact O-N 2.87Å |
| 19 | C | 97 | Very high | 95.9 | Very high | 44 Ų | 44 | 92 Ų | 92 | 30% | 0.297 | 48% | 0.475 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.8 | -35 | -169.1 | -50.7 | 0 | 0 | 0 | 0 | 112.6 | F15 Q21 C22 H23 | F15-C19 HydrophobicContact CD1-CB 4.3Å; F15-C19 HydrophobicContact CD2-CB 3.52Å; F15-C19 HydrophobicContact CE1-CB 4.27Å; F15-C19 HydrophobicContact CE2-CB 3.49Å; F15-C19 VanDerWaalsContact CE2-CB 3.49Å; F15-C19 HydrophobicContact CG-CB 3.93Å; F15-C19 HydrophobicContact CZ-CB 3.87Å; F15-C19 CarbonylContact O-C 3.56Å; F15-C19 WeakPolarHBondContact O-CA 3.34Å; F15-C19 WeakPolarHBondContact O-CB 3.34Å; F15-C19 PolarHBondContact O-N 3Å; C19-Q21 PolarHBondContact O-N 3.15Å; C19-Q21 VanDerWaalsContact O-N 3.15Å; C19-C22 PolarHBondContact O-N 3.35Å; C19-H23 PolarHBondContact O-N 3.27Å |
| 20 | S | 96 | Very high | 96 | Very high | 34 Ų | 34 | 91.3 Ų | 91.3 | 24% | 0.238 | 48% | 0.48 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -20.7 | -168.1 | 76.9 | 0 | 0 | 0 | 0 | 114.8 | F15 V16 C22 K32 | F15-S20 PolarHBondContact O-N 3.32Å; V16-S20 PolarHBondContact O-OG 3.01Å; S20-C22 VanDerWaalsContact C-N 3.27Å; S20-C22 PolarHBondContact O-N 2.93Å; S20-K32 PolarHBondContact O-NZ 2.87Å |
| 21 | Q | 97 | Very high | 96.1 | Very high | 151 Ų | 151 | 88.2 Ų | 88.2 | 71% | 0.706 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -36.5 | 174.3 | -63.3 | -174.7 | 23.3 | 0 | 0 | 111.1 | C19 K32 | C19-Q21 PolarHBondContact O-N 3.15Å; C19-Q21 VanDerWaalsContact O-N 3.15Å; Q21-K32 WeakPolarHBondContact O-CD 3.06Å |
| 22 | C | 97.7 | Very high | 96.2 | Very high | 48 Ų | 48 | 91.5 Ų | 91.5 | 32% | 0.324 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.2 | -20.6 | -176.6 | -60 | 0 | 0 | 0 | 0 | 113.6 | C19 S20 K32 V33 G34 | C19-C22 PolarHBondContact O-N 3.35Å; S20-C22 VanDerWaalsContact C-N 3.27Å; S20-C22 PolarHBondContact O-N 2.93Å; C22-K32 WeakPolarHBondContact O-CB 3.49Å; C22-V33 HydrophobicContact CB-CB 4.25Å; C22-G34 CarbonylContact O-C 3.58Å; C22-G34 VanDerWaalsContact O-CA 3.3Å; C22-G34 WeakPolarHBondContact O-CA 3.45Å; C22-G34 PolarHBondContact O-N 3.03Å |
| 23 | H | 97.8 | Very high | 96.2 | Very high | 49 Ų | 49 | 90.8 Ų | 90.8 | 23% | 0.227 | 48% | 0.478 | C | S | . | . | trans | -130.3 | 153.8 | -170.5 | -65.3 | -77.4 | 0 | 0 | 0 | 113.6 | F15 C19 P35 L37 | F15-H23 HydrophobicContact CZ-CB 4.12Å; C19-H23 PolarHBondContact O-N 3.27Å; H23-P35 PolarHBondContact ND1-O 2.87Å; H23-L37 HydrophobicContact CB-CD1 3.69Å; H23-L37 HydrophobicContact CB-CG 3.95Å | ||
| 24 | T | 96.9 | Very high | 96.2 | Very high | 21 Ų | 21 | 84.5 Ų | 84.5 | 13% | 0.129 | 45% | 0.452 | C | S | . | . | trans | -118.3 | 157.7 | 168.3 | 57.2 | 0 | 0 | 0 | 0 | 109.4 | P30 K32 N36 L37 | T24-P30 HydrophobicContact CG2-CG 4.32Å; T24-P30 WeakPolarHBondContact CG2-O 3.37Å; T24-P30 PolarHBondContact OG1-O 2.95Å; T24-K32 HydrophobicContact CG2-CD 4.36Å; T24-K32 HydrophobicContact CG2-CG 4.25Å; T24-N36 VanDerWaalsContact OG1-CG 3.31Å; T24-N36 PolarHBondContact OG1-ND2 3.44Å; T24-L37 PolarHBondContact O-N 3.45Å | ||
| 25 | V | 95.4 | Very high | 96.1 | Very high | 73 Ų | 73 | 81.6 Ų | 81.6 | 44% | 0.442 | 44% | 0.438 | S | S | . | . | trans | -121.6 | -11.8 | 179.6 | -65.9 | 0 | 0 | 0 | 0 | 113.6 | F15 L37 S38 | F15-V25 HydrophobicContact CE1-CG1 3.95Å; F15-V25 HydrophobicContact CE2-CG1 3.75Å; F15-V25 HydrophobicContact CZ-CG1 3.4Å; F15-V25 VanDerWaalsContact CZ-CG1 3.4Å; V25-L37 HydrophobicContact CG1-CB 4.33Å; V25-S38 WeakPolarHBondContact O-CB 3.41Å | ||
| 26 | E | 94.9 | Very high | 96.1 | Very high | 137 Ų | 137 | 79.6 Ų | 79.6 | 64% | 0.64 | 43% | 0.43 | S | S | * | . | S | Bend | trans | -69.3 | 137.1 | -179.6 | -60.7 | -52.4 | 138.8 | 0 | 0 | 111.6 | G28 G29 N36 | E26-G28 PolarHBondContact O-N 2.77Å; E26-G29 PolarHBondContact O-N 3.14Å; E26-N36 PolarHBondContact O-ND2 2.66Å |
| 27 | K | 93.8 | Very high | 96.1 | Very high | 190 Ų | 190 | 77.3 Ų | 77.3 | 83% | 0.826 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | 122.7 | 177.2 | -173.9 | -180 | 179 | -176.7 | 0 | 109.8 | G29 S38 | K27-G29 PolarHBondContact O-N 3.44Å; K27-S38 WeakPolarHBondContact CA-OG 3.36Å |
| 28 | G | 93.2 | Very high | 95.9 | Very high | 82 Ų | 82 | 72.7 Ų | 72.7 | 85% | 0.845 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.1 | 3.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | E26 | E26-G28 PolarHBondContact O-N 2.77Š|
| 29 | G | 95.5 | Very high | 95.5 | Very high | 18 Ų | 18 | 66 Ų | 66 | 19% | 0.186 | 39% | 0.389 | C | S | . | . | P | Polyproline II helix | trans | -66.4 | 163.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | E26 K27 N36 | E26-G29 PolarHBondContact O-N 3.14Å; K27-G29 PolarHBondContact O-N 3.44Å; G29-N36 VanDerWaalsContact C-ND2 3.26Å; G29-N36 WeakPolarHBondContact CA-ND2 3.47Å; G29-N36 PolarHBondContact N-ND2 3.47Å; G29-N36 PolarHBondContact O-ND2 3.33Å |
| 30 | P | 96 | Very high | 95.2 | Very high | 94 Ų | 94 | 65.6 Ų | 65.6 | 61% | 0.61 | 38% | 0.383 | S | S | * | . | P | Polyproline II helix | trans | -69.6 | 152.8 | -176.2 | 30 | -35.8 | 0 | 0 | 0 | 112 | T24 | T24-P30 HydrophobicContact CG2-CG 4.32Å; T24-P30 WeakPolarHBondContact CG2-O 3.37Å; T24-P30 PolarHBondContact OG1-O 2.95Å |
| 31 | H | 97 | Very high | 94.9 | Very high | 65 Ų | 65 | 69.3 Ų | 69.3 | 30% | 0.301 | 40% | 0.395 | S | S | . | . | P | Polyproline II helix | trans | -71.7 | 152.1 | 158.2 | -55.4 | -36.1 | 0 | 0 | 0 | 109.9 | N36 P49 Y51 | H31-N36 WeakPolarHBondContact ND1-CB 3.42Å; H31-N36 PolarHBondContact ND1-N 2.78Å; H31-P49 PolarHBondContact NE2-O 3.49Å; H31-Y51 HydrophobicContact CB-CD2 3.74Å; H31-Y51 HydrophobicContact CB-CE2 4.3Å; H31-Y51 AromaticContact CD2-CD2 3.95Å; H31-Y51 AromaticContact CG-CD2 3.71Å; H31-Y51 PolarHBondContact NE2-N 3.45Å |
| 32 | K | 96.1 | Very high | 94.3 | Very high | 104 Ų | 104 | 64.5 Ų | 64.5 | 45% | 0.452 | 39% | 0.386 | S | S | . | . | trans | -117.1 | -134.8 | 168.5 | -55.7 | -179.4 | 176.3 | -177.7 | 0 | 108.2 | S20 Q21 C22 T24 G34 | S20-K32 PolarHBondContact O-NZ 2.87Å; Q21-K32 WeakPolarHBondContact O-CD 3.06Å; C22-K32 WeakPolarHBondContact O-CB 3.49Å; T24-K32 HydrophobicContact CG2-CD 4.36Å; T24-K32 HydrophobicContact CG2-CG 4.25Å; K32-G34 PolarHBondContact N-O 2.76Å; K32-G34 PolarHBondContact O-N 3.47Å | ||
| 33 | V | 96.5 | Very high | 93.8 | Very high | 116 Ų | 116 | 64.4 Ų | 64.4 | 70% | 0.703 | 38% | 0.379 | S | S | * | . | S | Bend | trans | -59.2 | -27.9 | 168 | -177 | 0 | 0 | 0 | 0 | 111.5 | C22 Y51 | C22-V33 HydrophobicContact CB-CB 4.25Å; V33-Y51 PolarHBondContact O-OH 2.81Å |
| 34 | G | 95.3 | Very high | 93.3 | Very high | 6 Ų | 6 | 66.5 Ų | 66.5 | 6% | 0.062 | 39% | 0.387 | C | S | . | . | S | Bend | trans | -120.4 | 168.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | C22 K32 Y51 | C22-G34 CarbonylContact O-C 3.58Å; C22-G34 VanDerWaalsContact O-CA 3.3Å; C22-G34 WeakPolarHBondContact O-CA 3.45Å; C22-G34 PolarHBondContact O-N 3.03Å; K32-G34 PolarHBondContact N-O 2.76Å; K32-G34 PolarHBondContact O-N 3.47Å; G34-Y51 WeakPolarHBondContact CA-OH 3.3Å |
| 35 | P | 96 | Very high | 92.9 | Very high | 16 Ų | 16 | 66.5 Ų | 66.5 | 10% | 0.104 | 39% | 0.388 | C | S | . | . | trans | -66.6 | 159.9 | 178.7 | 28.4 | -38.4 | 0 | 0 | 0 | 112.7 | H23 L37 A48 Y51 Y53 | H23-P35 PolarHBondContact ND1-O 2.87Å; P35-L37 HydrophobicContact CG-CD2 4.45Å; P35-A48 HydrophobicContact CB-CB 3.79Å; P35-Y51 HydrophobicContact CB-CD1 3.81Å; P35-Y51 HydrophobicContact CB-CD2 4.04Å; P35-Y51 HydrophobicContact CB-CE1 4.25Å; P35-Y51 HydrophobicContact CB-CE2 4.45Å; P35-Y51 HydrophobicContact CB-CG 3.68Å; P35-Y51 HydrophobicContact CG-CD1 4.24Å; P35-Y51 HydrophobicContact CG-CE1 4.28Å; P35-Y53 HydrophobicContact CB-CE1 4.3Å; P35-Y53 WeakPolarHBondContact CB-OH 3.43Å; P35-Y53 HydrophobicContact CG-CE1 3.92Å; P35-Y53 WeakPolarHBondContact CG-OH 3.33Å | ||
| 36 | N | 96.1 | Very high | 92.5 | Very high | 10 Ų | 10 | 63.9 Ų | 63.9 | 5% | 0.053 | 38% | 0.375 | C | S | . | . | trans | -69.4 | 133.8 | 168.5 | -175.8 | -40.4 | 0 | 0 | 0 | 109.6 | T24 E26 G29 H31 S38 R43 | T24-N36 VanDerWaalsContact OG1-CG 3.31Å; T24-N36 PolarHBondContact OG1-ND2 3.44Å; E26-N36 PolarHBondContact O-ND2 2.66Å; G29-N36 VanDerWaalsContact C-ND2 3.26Å; G29-N36 WeakPolarHBondContact CA-ND2 3.47Å; G29-N36 PolarHBondContact N-ND2 3.47Å; G29-N36 PolarHBondContact O-ND2 3.33Å; H31-N36 WeakPolarHBondContact ND1-CB 3.42Å; H31-N36 PolarHBondContact ND1-N 2.78Å; N36-S38 WeakPolarHBondContact OD1-CA 3.45Å; N36-S38 WeakPolarHBondContact OD1-CB 3.44Å; N36-S38 PolarHBondContact OD1-N 3.01Å; N36-R43 PolarHBondContact O-NH1 3.19Å; N36-R43 PolarHBondContact O-NH2 3.33Å; N36-R43 VanDerWaalsContact O-NH2 3.12Å | ||
| 37 | L | 95.3 | Very high | 92.2 | Very high | 37 Ų | 37 | 62.4 Ų | 62.4 | 19% | 0.194 | 37% | 0.369 | C | S | . | . | trans | -98.1 | 3.9 | -175.7 | -55.5 | -176.2 | 0 | 0 | 0 | 113.6 | F15 H23 T24 V25 P35 G39 L40 | F15-L37 HydrophobicContact CE2-CD1 4.01Å; F15-L37 HydrophobicContact CZ-CD1 4.4Å; H23-L37 HydrophobicContact CB-CD1 3.69Å; H23-L37 HydrophobicContact CB-CG 3.95Å; T24-L37 PolarHBondContact O-N 3.45Å; V25-L37 HydrophobicContact CG1-CB 4.33Å; P35-L37 HydrophobicContact CG-CD2 4.45Å; L37-G39 PolarHBondContact O-N 3.26Å; L37-L40 HydrophobicContact CB-CB 4.24Å; L37-L40 HydrophobicContact CB-CD2 4.25Å; L37-L40 HydrophobicContact CD1-CD2 4.45Å; L37-L40 HydrophobicContact CD2-CD1 4.06Å; L37-L40 HydrophobicContact CD2-CD2 4Å; L37-L40 HydrophobicContact CD2-CG 4.49Å; L37-L40 HydrophobicContact CG-CD2 4.45Å; L37-L40 WeakPolarHBondContact O-CB 3.11Å; L37-L40 PolarHBondContact O-N 2.91Å | ||
| 38 | S | 92.9 | Very high | 92.1 | Very high | 36 Ų | 36 | 53.6 Ų | 53.6 | 25% | 0.252 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.3 | 127.7 | 165.5 | 172.7 | 0 | 0 | 0 | 0 | 109.7 | V25 K27 N36 L40 R43 | V25-S38 WeakPolarHBondContact O-CB 3.41Å; K27-S38 WeakPolarHBondContact CA-OG 3.36Å; N36-S38 WeakPolarHBondContact OD1-CA 3.45Å; N36-S38 WeakPolarHBondContact OD1-CB 3.44Å; N36-S38 PolarHBondContact OD1-N 3.01Å; S38-L40 PolarHBondContact O-N 3.12Å; S38-R43 PolarHBondContact O-NH1 2.99Å |
| 39 | G | 89.8 | Confident | 91.9 | Very high | 55 Ų | 55 | 55.1 Ų | 55.1 | 57% | 0.567 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.6 | 21 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | L37 F41 R43 | L37-G39 PolarHBondContact O-N 3.26Å; G39-F41 PolarHBondContact O-N 3.3Å; G39-R43 WeakPolarHBondContact O-CB 3.4Å |
| 40 | L | 90.7 | Very high | 91.8 | Very high | 36 Ų | 36 | 58 Ų | 58 | 19% | 0.188 | 36% | 0.355 | C | S | . | . | trans | -59.6 | -45.4 | 179.7 | 178.9 | 68.7 | 0 | 0 | 0 | 112.2 | L37 S38 G42 R43 L64 | L37-L40 HydrophobicContact CB-CB 4.24Å; L37-L40 HydrophobicContact CB-CD2 4.25Å; L37-L40 HydrophobicContact CD1-CD2 4.45Å; L37-L40 HydrophobicContact CD2-CD1 4.06Å; L37-L40 HydrophobicContact CD2-CD2 4Å; L37-L40 HydrophobicContact CD2-CG 4.49Å; L37-L40 HydrophobicContact CG-CD2 4.45Å; L37-L40 WeakPolarHBondContact O-CB 3.11Å; L37-L40 PolarHBondContact O-N 2.91Å; S38-L40 PolarHBondContact O-N 3.12Å; L40-G42 PolarHBondContact O-N 3.47Å; L40-R43 VanDerWaalsContact O-CB 3.31Å; L40-R43 WeakPolarHBondContact O-CB 3.47Å; L40-R43 PolarHBondContact O-N 3.42Å; L40-R43 VanDerWaalsContact O-N 3.1Å; L40-L64 HydrophobicContact CD1-CD1 4.21Å; L40-L64 HydrophobicContact CD1-CD2 3.86Å; L40-L64 HydrophobicContact CD1-CG 4.49Å; L40-L64 HydrophobicContact CD2-CD2 3.8Å; L40-L64 HydrophobicContact CG-CB 4.46Å; L40-L64 HydrophobicContact CG-CD2 3.76Å | ||
| 41 | F | 88.2 | Confident | 91.7 | Very high | 112 Ų | 112 | 56.4 Ų | 56.4 | 49% | 0.491 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71 | 128.6 | -179 | -62.1 | -77.6 | 0 | 0 | 0 | 111 | G39 R43 L64 L66 | G39-F41 PolarHBondContact O-N 3.3Å; F41-R43 VanDerWaalsContact C-N 3.27Å; F41-L64 CarbonylContact C-O 3.53Å; F41-L64 WeakPolarHBondContact CA-O 3.38Å; F41-L66 HydrophobicContact CB-CB 4Å; F41-L66 HydrophobicContact CB-CD1 3.19Å; F41-L66 HydrophobicContact CB-CG 4.21Å; F41-L66 HydrophobicContact CD1-CD1 4.48Å; F41-L66 HydrophobicContact CD2-CD1 4.32Å; F41-L66 HydrophobicContact CG-CD1 3.81Å |
| 42 | G | 84.5 | Confident | 91.5 | Very high | 50 Ų | 50 | 59.4 Ų | 59.4 | 52% | 0.515 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.2 | -12.1 | -171.2 | 0 | 0 | 0 | 0 | 0 | 114 | L40 L64 | L40-G42 PolarHBondContact O-N 3.47Å; G42-L64 PolarHBondContact N-O 3.44Å |
| 43 | R | 88.2 | Confident | 91.3 | Very high | 45 Ų | 45 | 56.3 Ų | 56.3 | 17% | 0.17 | 35% | 0.347 | C | S | . | . | P | Polyproline II helix | trans | -83.4 | 145.1 | 176.3 | -167.7 | 175.8 | 70 | -167.9 | 0.2 | 110.8 | N36 S38 G39 L40 F41 Q47 L64 | N36-R43 PolarHBondContact O-NH1 3.19Å; N36-R43 PolarHBondContact O-NH2 3.33Å; N36-R43 VanDerWaalsContact O-NH2 3.12Å; S38-R43 PolarHBondContact O-NH1 2.99Å; G39-R43 WeakPolarHBondContact O-CB 3.4Å; L40-R43 VanDerWaalsContact O-CB 3.31Å; L40-R43 WeakPolarHBondContact O-CB 3.47Å; L40-R43 PolarHBondContact O-N 3.42Å; L40-R43 VanDerWaalsContact O-N 3.1Å; F41-R43 VanDerWaalsContact C-N 3.27Å; R43-Q47 HydrophobicContact CG-CB 4.2Å; R43-L64 PolarHBondContact O-N 3.33Å; R43-L64 VanDerWaalsContact O-N 3.14Å |
| 44 | K | 86.8 | Confident | 91 | Very high | 93 Ų | 93 | 55.2 Ų | 55.2 | 40% | 0.404 | 34% | 0.341 | S | S | . | . | B | Isolated β-bridge | trans | -71.1 | 147.6 | 168.9 | -72.7 | 174.9 | 176.3 | -176.8 | 0 | 110.7 | Q47 V61 L62 I63 | K44-Q47 HydrophobicContact CB-CG 4.04Å; K44-V61 HydrophobicContact CB-CG1 4.47Å; K44-V61 HydrophobicContact CD-CG1 3.77Å; K44-V61 HydrophobicContact CG-CG1 4.21Å; K44-L62 CarbonylContact C-O 3.43Å; K44-L62 VanDerWaalsContact CA-O 3.28Å; K44-L62 WeakPolarHBondContact CA-O 3.33Å; K44-I63 HydrophobicContact CG-CG1 3.96Å |
| 45 | T | 88.4 | Confident | 90.7 | Very high | 22 Ų | 22 | 58.9 Ų | 58.9 | 14% | 0.135 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | 149.8 | 173 | 54.2 | 0 | 0 | 0 | 0 | 111.2 | Q47 N57 V61 L62 L64 | T45-Q47 VanDerWaalsContact C-N 3.32Å; T45-Q47 WeakPolarHBondContact O-CG 3.28Å; T45-Q47 PolarHBondContact O-N 2.72Å; T45-N57 WeakPolarHBondContact CB-O 3.46Å; T45-N57 PolarHBondContact OG1-O 3.28Å; T45-V61 WeakPolarHBondContact OG1-CA 3.42Å; T45-V61 PolarHBondContact OG1-N 3.23Å; T45-L62 HydrophobicContact CG2-CB 3.83Å; T45-L62 PolarHBondContact N-O 3.41Å; T45-L62 PolarHBondContact OG1-N 3.16Å; T45-L64 HydrophobicContact CG2-CD1 3.66Å |
| 46 | G | 87.7 | Confident | 90.3 | Very high | 18 Ų | 18 | 61.3 Ų | 61.3 | 19% | 0.186 | 39% | 0.391 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 74.4 | 13.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | Y53 N57 | G46-Y53 VanDerWaalsContact C-CE2 3.42Å; G46-Y53 WeakPolarHBondContact O-CD2 3.45Å; G46-N57 WeakPolarHBondContact CA-OD1 3.38Å; G46-N57 PolarHBondContact N-OD1 3.02Å |
| 47 | Q | 88.7 | Confident | 89.7 | Confident | 106 Ų | 106 | 63.7 Ų | 63.7 | 50% | 0.495 | 40% | 0.404 | S | S | . | . | trans | -119.8 | 15.7 | -171 | -56.3 | -157.2 | 7 | 0 | 0 | 116.1 | R43 K44 T45 P49 | R43-Q47 HydrophobicContact CG-CB 4.2Å; K44-Q47 HydrophobicContact CB-CG 4.04Å; T45-Q47 VanDerWaalsContact C-N 3.32Å; T45-Q47 WeakPolarHBondContact O-CG 3.28Å; T45-Q47 PolarHBondContact O-N 2.72Å; Q47-P49 VanDerWaalsContact O-CD 3.27Å; Q47-P49 WeakPolarHBondContact O-CD 3.49Å | ||
| 48 | A | 90.8 | Very high | 89 | Confident | 5 Ų | 5 | 66.3 Ų | 66.3 | 4% | 0.041 | 42% | 0.418 | C | S | . | . | trans | -66.2 | 121.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | P35 G50 Y51 Y53 | P35-A48 HydrophobicContact CB-CB 3.79Å; A48-G50 PolarHBondContact O-N 3.45Å; A48-Y51 PolarHBondContact O-N 3.28Å; A48-Y53 HydrophobicContact CB-CE2 4.15Å; A48-Y53 WeakPolarHBondContact CB-OH 3.18Å; A48-Y53 PolarHBondContact N-OH 3.05Å; A48-Y53 VanDerWaalsContact N-OH 3.16Å | ||
| 49 | P | 90.2 | Very high | 88.2 | Confident | 113 Ų | 113 | 68.9 Ų | 68.9 | 73% | 0.734 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | 134.6 | -179.2 | -22.4 | 33.6 | 0 | 0 | 0 | 110.9 | H31 Q47 Y51 | H31-P49 PolarHBondContact NE2-O 3.49Å; Q47-P49 VanDerWaalsContact O-CD 3.27Å; Q47-P49 WeakPolarHBondContact O-CD 3.49Å; P49-Y51 VanDerWaalsContact C-N 3.32Å; P49-Y51 PolarHBondContact O-N 3Å |
| 50 | G | 92 | Very high | 87.6 | Confident | 78 Ų | 78 | 73.2 Ų | 73.2 | 80% | 0.804 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.9 | -2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | A48 | A48-G50 PolarHBondContact O-N 3.45Š|
| 51 | Y | 94.8 | Very high | 86.8 | Confident | 61 Ų | 61 | 75 Ų | 75 | 24% | 0.239 | 45% | 0.451 | C | S | . | . | trans | -98.9 | 138.3 | 176.5 | -170.2 | -96.9 | 0 | 0 | 0 | 112.2 | H31 V33 G34 P35 A48 P49 Y53 | H31-Y51 HydrophobicContact CB-CD2 3.74Å; H31-Y51 HydrophobicContact CB-CE2 4.3Å; H31-Y51 AromaticContact CD2-CD2 3.95Å; H31-Y51 AromaticContact CG-CD2 3.71Å; H31-Y51 PolarHBondContact NE2-N 3.45Å; V33-Y51 PolarHBondContact O-OH 2.81Å; G34-Y51 WeakPolarHBondContact CA-OH 3.3Å; P35-Y51 HydrophobicContact CB-CD1 3.81Å; P35-Y51 HydrophobicContact CB-CD2 4.04Å; P35-Y51 HydrophobicContact CB-CE1 4.25Å; P35-Y51 HydrophobicContact CB-CE2 4.45Å; P35-Y51 HydrophobicContact CB-CG 3.68Å; P35-Y51 HydrophobicContact CG-CD1 4.24Å; P35-Y51 HydrophobicContact CG-CE1 4.28Å; A48-Y51 PolarHBondContact O-N 3.28Å; P49-Y51 VanDerWaalsContact C-N 3.32Å; P49-Y51 PolarHBondContact O-N 3Å; Y51-Y53 AromaticContact CD1-CD1 3.91Å; Y51-Y53 HydrophobicContact CD1-CD1 3.91Å; Y51-Y53 AromaticContact CD1-CD2 3.7Å; Y51-Y53 HydrophobicContact CD1-CD2 3.7Å; Y51-Y53 AromaticContact CD1-CE1 3.8Å; Y51-Y53 HydrophobicContact CD1-CE1 3.8Å; Y51-Y53 AromaticContact CD1-CE2 3.56Å; Y51-Y53 HydrophobicContact CD1-CE2 3.56Å; Y51-Y53 AromaticContact CD1-CG 3.87Å; Y51-Y53 HydrophobicContact CD1-CG 3.87Å; Y51-Y53 AromaticContact CD1-CZ 3.61Å; Y51-Y53 HydrophobicContact CE1-CD1 4.09Å; Y51-Y53 HydrophobicContact CE1-CE1 4.16Å; Y51-Y53 HydrophobicContact CE1-CG 4.31Å; Y51-Y53 HydrophobicContact CG-CE2 4.18Å; Y51-Y53 WeakPolarHBondContact O-CD2 3.31Å | ||
| 52 | T | 93.5 | Very high | 86.3 | Confident | 129 Ų | 129 | 74.4 Ų | 74.4 | 79% | 0.791 | 45% | 0.452 | S | S | * | . | trans | -89.1 | 115.1 | 176.3 | -59.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 53 | Y | 91.8 | Very high | 85.9 | Confident | 38 Ų | 38 | 77.1 Ų | 77.1 | 15% | 0.149 | 45% | 0.454 | C | S | . | . | trans | -98.8 | 158.3 | -179 | -72.9 | -88.3 | 0 | 0 | 0 | 112.7 | P35 G46 A48 Y51 N57 | P35-Y53 HydrophobicContact CB-CE1 4.3Å; P35-Y53 WeakPolarHBondContact CB-OH 3.43Å; P35-Y53 HydrophobicContact CG-CE1 3.92Å; P35-Y53 WeakPolarHBondContact CG-OH 3.33Å; G46-Y53 VanDerWaalsContact C-CE2 3.42Å; G46-Y53 WeakPolarHBondContact O-CD2 3.45Å; A48-Y53 HydrophobicContact CB-CE2 4.15Å; A48-Y53 WeakPolarHBondContact CB-OH 3.18Å; A48-Y53 PolarHBondContact N-OH 3.05Å; A48-Y53 VanDerWaalsContact N-OH 3.16Å; Y51-Y53 AromaticContact CD1-CD1 3.91Å; Y51-Y53 HydrophobicContact CD1-CD1 3.91Å; Y51-Y53 AromaticContact CD1-CD2 3.7Å; Y51-Y53 HydrophobicContact CD1-CD2 3.7Å; Y51-Y53 AromaticContact CD1-CE1 3.8Å; Y51-Y53 HydrophobicContact CD1-CE1 3.8Å; Y51-Y53 AromaticContact CD1-CE2 3.56Å; Y51-Y53 HydrophobicContact CD1-CE2 3.56Å; Y51-Y53 AromaticContact CD1-CG 3.87Å; Y51-Y53 HydrophobicContact CD1-CG 3.87Å; Y51-Y53 AromaticContact CD1-CZ 3.61Å; Y51-Y53 HydrophobicContact CE1-CD1 4.09Å; Y51-Y53 HydrophobicContact CE1-CE1 4.16Å; Y51-Y53 HydrophobicContact CE1-CG 4.31Å; Y51-Y53 HydrophobicContact CG-CE2 4.18Å; Y51-Y53 WeakPolarHBondContact O-CD2 3.31Å; Y53-N57 HydrophobicContact CD1-CB 4.16Å; Y53-N57 WeakPolarHBondContact CD1-OD1 3.33Å | ||
| 54 | T | 89.4 | Confident | 85 | Confident | 94 Ų | 94 | 77.9 Ų | 77.9 | 58% | 0.577 | 46% | 0.461 | S | S | * | . | trans | -72.7 | 150.7 | 166.7 | 65.2 | 0 | 0 | 0 | 0 | 110.7 | A56 N57 I58 | T54-A56 PolarHBondContact O-N 3.29Å; T54-N57 PolarHBondContact O-N 3.1Å; T54-N57 PolarHBondContact OG1-N 3Å; T54-I58 PolarHBondContact O-N 2.74Å | ||
| 55 | A | 88.1 | Confident | 84 | Confident | 82 Ų | 82 | 76.6 Ų | 76.6 | 68% | 0.678 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -54.8 | -36.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | N57 I58 S59 | A55-N57 PolarHBondContact O-N 3.46Å; A55-I58 PolarHBondContact O-N 3.02Å; A55-S59 WeakPolarHBondContact O-CB 3.44Å; A55-S59 PolarHBondContact O-N 2.8Å; A55-S59 PolarHBondContact O-OG 2.83Å |
| 56 | A | 88.2 | Confident | 82.3 | Confident | 67 Ų | 67 | 78.8 Ų | 78.8 | 55% | 0.554 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -64.5 | -35.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | T54 S59 K60 | T54-A56 PolarHBondContact O-N 3.29Å; A56-S59 PolarHBondContact O-OG 3.18Å; A56-K60 WeakPolarHBondContact O-CG 2.97Å; A56-K60 PolarHBondContact O-N 3.29Å |
| 57 | N | 83.3 | Confident | 80.6 | Confident | 61 Ų | 61 | 83.7 Ų | 83.7 | 33% | 0.326 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -73.5 | -37.4 | 178.8 | -164.5 | -80.9 | 0 | 0 | 0 | 111.6 | T45 G46 Y53 T54 A55 | T45-N57 WeakPolarHBondContact CB-O 3.46Å; T45-N57 PolarHBondContact OG1-O 3.28Å; G46-N57 WeakPolarHBondContact CA-OD1 3.38Å; G46-N57 PolarHBondContact N-OD1 3.02Å; Y53-N57 HydrophobicContact CD1-CB 4.16Å; Y53-N57 WeakPolarHBondContact CD1-OD1 3.33Å; T54-N57 PolarHBondContact O-N 3.1Å; T54-N57 PolarHBondContact OG1-N 3Å; A55-N57 PolarHBondContact O-N 3.46Å |
| 58 | I | 80.8 | Confident | 78.8 | Confident | 92 Ų | 92 | 83 Ų | 83 | 47% | 0.472 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.7 | -45.2 | 177.5 | -62 | 170.6 | 0 | 0 | 0 | 110.5 | T54 A55 K60 V61 | T54-I58 PolarHBondContact O-N 2.74Å; A55-I58 PolarHBondContact O-N 3.02Å; I58-K60 VanDerWaalsContact C-N 3.3Å; I58-K60 PolarHBondContact O-N 3.42Å; I58-V61 WeakPolarHBondContact O-CG2 3.27Å; I58-V61 PolarHBondContact O-N 2.97Å |
| 59 | S | 77.1 | Confident | 76.5 | Confident | 89 Ų | 89 | 91.5 Ų | 91.5 | 62% | 0.622 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -70 | -24 | -174.3 | 66.2 | 0 | 0 | 0 | 0 | 114.2 | A55 A56 V61 | A55-S59 WeakPolarHBondContact O-CB 3.44Å; A55-S59 PolarHBondContact O-N 2.8Å; A55-S59 PolarHBondContact O-OG 2.83Å; A56-S59 PolarHBondContact O-OG 3.18Å; S59-V61 VanDerWaalsContact C-N 3.33Å; S59-V61 PolarHBondContact O-N 3.38Å |
| 60 | K | 76.4 | Confident | 74.1 | Confident | 146 Ų | 146 | 96.5 Ų | 96.5 | 64% | 0.635 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -24.5 | 179.9 | -87.3 | -82 | -176.7 | 176.7 | 0 | 114.2 | A56 I58 L62 | A56-K60 WeakPolarHBondContact O-CG 2.97Å; A56-K60 PolarHBondContact O-N 3.29Å; I58-K60 VanDerWaalsContact C-N 3.3Å; I58-K60 PolarHBondContact O-N 3.42Å; K60-L62 HydrophobicContact CB-CG 4.23Å; K60-L62 HydrophobicContact CD-CD1 4.46Å; K60-L62 WeakPolarHBondContact O-CG 3.48Å; K60-L62 PolarHBondContact O-N 2.95Å |
| 61 | V | 73.1 | Confident | 71.4 | Confident | 75 Ų | 75 | 99.9 Ų | 99.9 | 46% | 0.455 | 53% | 0.526 | S | S | . | . | trans | 35.9 | 47.9 | 179.5 | -160 | 0 | 0 | 0 | 0 | 113.8 | K44 T45 I58 S59 | K44-V61 HydrophobicContact CB-CG1 4.47Å; K44-V61 HydrophobicContact CD-CG1 3.77Å; K44-V61 HydrophobicContact CG-CG1 4.21Å; T45-V61 WeakPolarHBondContact OG1-CA 3.42Å; T45-V61 PolarHBondContact OG1-N 3.23Å; I58-V61 WeakPolarHBondContact O-CG2 3.27Å; I58-V61 PolarHBondContact O-N 2.97Å; S59-V61 VanDerWaalsContact C-N 3.33Å; S59-V61 PolarHBondContact O-N 3.38Å | ||
| 62 | L | 79.1 | Confident | 68.4 | Low | 99 Ų | 99 | 105 Ų | 105 | 52% | 0.518 | 55% | 0.554 | S | S | . | * | trans | -84.5 | 136 | 179.4 | -60.8 | 176.2 | 0 | 0 | 0 | 109.4 | K44 T45 K60 | K44-L62 CarbonylContact C-O 3.43Å; K44-L62 VanDerWaalsContact CA-O 3.28Å; K44-L62 WeakPolarHBondContact CA-O 3.33Å; T45-L62 HydrophobicContact CG2-CB 3.83Å; T45-L62 PolarHBondContact N-O 3.41Å; T45-L62 PolarHBondContact OG1-N 3.16Å; K60-L62 HydrophobicContact CB-CG 4.23Å; K60-L62 HydrophobicContact CD-CD1 4.46Å; K60-L62 WeakPolarHBondContact O-CG 3.48Å; K60-L62 PolarHBondContact O-N 2.95Å | ||
| 63 | I | 75.5 | Confident | 65.8 | Low | 106 Ų | 106 | 111.5 Ų | 111.5 | 54% | 0.544 | 58% | 0.576 | S | S | . | * | B | Isolated β-bridge | trans | -82.9 | 120.7 | 167.1 | -61.7 | 174.7 | 0 | 0 | 0 | 106.7 | K44 S65 | K44-I63 HydrophobicContact CG-CG1 3.96Å; I63-S65 VanDerWaalsContact C-N 3.34Å; I63-S65 PolarHBondContact O-N 3.24Å |
| 64 | L | 69.1 | Low | 64.5 | Low | 61 Ų | 61 | 115.2 Ų | 115.2 | 32% | 0.319 | 60% | 0.597 | S | S | . | * | trans | -73.5 | 94.6 | 172.3 | -81 | 93.2 | 0 | 0 | 0 | 108.4 | L40 F41 G42 R43 T45 L66 | L40-L64 HydrophobicContact CD1-CD1 4.21Å; L40-L64 HydrophobicContact CD1-CD2 3.86Å; L40-L64 HydrophobicContact CD1-CG 4.49Å; L40-L64 HydrophobicContact CD2-CD2 3.8Å; L40-L64 HydrophobicContact CG-CB 4.46Å; L40-L64 HydrophobicContact CG-CD2 3.76Å; F41-L64 CarbonylContact C-O 3.53Å; F41-L64 WeakPolarHBondContact CA-O 3.38Å; G42-L64 PolarHBondContact N-O 3.44Å; R43-L64 PolarHBondContact O-N 3.33Å; R43-L64 VanDerWaalsContact O-N 3.14Å; T45-L64 HydrophobicContact CG2-CD1 3.66Å; L64-L66 PolarHBondContact O-N 3.47Å | ||
| 65 | S | 65.1 | Low | 63.2 | Low | 67 Ų | 67 | 116.3 Ų | 116.3 | 47% | 0.469 | 60% | 0.598 | S | S | . | * | trans | -61.2 | 131.4 | -169.6 | 61.5 | 0 | 0 | 0 | 0 | 112.9 | I63 L67 | I63-S65 VanDerWaalsContact C-N 3.34Å; I63-S65 PolarHBondContact O-N 3.24Å; S65-L67 PolarHBondContact O-N 2.91Å | ||
| 66 | L | 54.3 | Low | 61.8 | Low | 68 Ų | 68 | 118.2 Ų | 118.2 | 36% | 0.356 | 59% | 0.594 | S | S | . | * | trans | -90 | 61.3 | 173.6 | -172.6 | 86.3 | 0 | 0 | 0 | 110.4 | F41 L64 L68 R69 | F41-L66 HydrophobicContact CB-CB 4Å; F41-L66 HydrophobicContact CB-CD1 3.19Å; F41-L66 HydrophobicContact CB-CG 4.21Å; F41-L66 HydrophobicContact CD1-CD1 4.48Å; F41-L66 HydrophobicContact CD2-CD1 4.32Å; F41-L66 HydrophobicContact CG-CD1 3.81Å; L64-L66 PolarHBondContact O-N 3.47Å; L66-L68 PolarHBondContact O-N 3.41Å; L66-R69 HydrophobicContact CD1-CG 3.85Å; L66-R69 HydrophobicContact CD2-CB 3.89Å; L66-R69 HydrophobicContact CD2-CG 3.82Å; L66-R69 HydrophobicContact CG-CB 4.06Å; L66-R69 HydrophobicContact CG-CG 3.87Å | ||
| 67 | L | 51.3 | Low | 60.2 | Low | 121 Ų | 121 | 121.2 Ų | 121.2 | 63% | 0.634 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.7 | 4 | 172.7 | -90 | 162.4 | 0 | 0 | 0 | 113.1 | S65 | S65-L67 PolarHBondContact O-N 2.91Š|
| 68 | L | 50.2 | Low | 58.8 | Low | 92 Ų | 92 | 124.9 Ų | 124.9 | 48% | 0.482 | 61% | 0.613 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102.1 | 1.3 | -174.2 | -75.2 | 159.2 | 0 | 0 | 0 | 114.8 | L66 | L66-L68 PolarHBondContact O-N 3.41Š|
| 69 | R | 43.7 | Very low | 57.3 | Low | 183 Ų | 183 | 127.1 Ų | 127.1 | 69% | 0.691 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -94.8 | 3.6 | 178.4 | -82.8 | -160.8 | -141.4 | -117.5 | -1.5 | 115.4 | L66 | L66-R69 HydrophobicContact CD1-CG 3.85Å; L66-R69 HydrophobicContact CD2-CB 3.89Å; L66-R69 HydrophobicContact CD2-CG 3.82Å; L66-R69 HydrophobicContact CG-CB 4.06Å; L66-R69 HydrophobicContact CG-CG 3.87Å |
| 70 | Y | 38.5 | Very low | 55.9 | Low | 218 Ų | 218 | 129.9 Ų | 129.9 | 86% | 0.855 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -98.8 | 3.6 | -172.9 | -116.3 | -84.9 | 0 | 0 | 0 | 116.1 | ||
| 71 | H | 36.6 | Very low | 54.4 | Low | 148 Ų | 148 | 128.6 Ų | 128.6 | 69% | 0.685 | 62% | 0.621 | S | S | * | * | trans | -126 | 35.8 | 179.2 | -76.6 | -4.1 | 0 | 0 | 0 | 113.8 | ||||
| 72 | M | 31.7 | Very low | 52.8 | Low | 169 Ų | 169 | 133.1 Ų | 133.1 | 83% | 0.833 | 64% | 0.635 | S | S | * | * | trans | -102 | 64.9 | 164.4 | -69.7 | -85.8 | -63.2 | 0 | 0 | 108.8 | ||||
| 73 | E | 38.5 | Very low | 50.4 | Low | 265 Ų | 265 | 136.2 Ų | 136.2 | 100% | 1.238 | 65% | 0.646 | S | S | * | * | trans | -131.4 | 0 | 149.9 | -76.2 | -169.6 | 152.9 | 0 | 0 | 107.4 |
Retrieved 73 of 73 residues in 45.5 ms
(Link to these results)