| 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 | 56.1 | Low | 73.6 | Confident | 247 Ų | 247 | 117.1 Ų | 117.1 | 100% | 1.217 | 63% | 0.63 | S | S | * | * | 0 | 111.8 | 0 | -73 | 174.2 | 178.8 | 0 | 0 | 106.4 | A3 | M1-A3 PolarHBondContact O-N 2.71Š| |||
| 2 | D | 54.9 | Low | 75.6 | Confident | 105 Ų | 105 | 107.3 Ų | 107.3 | 56% | 0.561 | 58% | 0.577 | S | S | * | * | trans | -83.8 | 97.6 | -170.1 | -168.9 | -0.3 | 0 | 0 | 0 | 109.6 | S4 | D2-S4 PolarHBondContact O-N 2.89Å; D2-S4 WeakPolarHBondContact OD1-CB 3.38Å; D2-S4 PolarHBondContact OD1-N 3.23Å; D2-S4 PolarHBondContact OD1-OG 3.07Å | ||
| 3 | A | 59.2 | Low | 77.3 | Confident | 87 Ų | 87 | 109.8 Ų | 109.8 | 72% | 0.719 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -70.8 | -4.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | M1 R5 | M1-A3 PolarHBondContact O-N 2.71Å; A3-R5 VanDerWaalsContact C-N 3.27Å; A3-R5 PolarHBondContact O-N 2.87Å |
| 4 | S | 61.1 | Low | 78.8 | Confident | 103 Ų | 103 | 102.1 Ų | 102.1 | 72% | 0.72 | 53% | 0.533 | S | S | * | . | G | 310 helix | trans | -77.5 | -0.9 | -171.2 | -33.8 | 0 | 0 | 0 | 0 | 115 | D2 | D2-S4 PolarHBondContact O-N 2.89Å; D2-S4 WeakPolarHBondContact OD1-CB 3.38Å; D2-S4 PolarHBondContact OD1-N 3.23Å; D2-S4 PolarHBondContact OD1-OG 3.07Å |
| 5 | R | 67.1 | Low | 80.1 | Confident | 211 Ų | 211 | 98.1 Ų | 98.1 | 80% | 0.796 | 52% | 0.515 | S | S | * | . | G | 310 helix | trans | -117.6 | 6.8 | -172.9 | -65.5 | -172.1 | -175.4 | -175.3 | -0 | 115.3 | A3 Q7 | A3-R5 VanDerWaalsContact C-N 3.27Å; A3-R5 PolarHBondContact O-N 2.87Å; R5-Q7 PolarHBondContact O-N 3.11Å |
| 6 | V | 67.9 | Low | 81.2 | Confident | 118 Ų | 118 | 99.3 Ų | 99.3 | 72% | 0.715 | 52% | 0.515 | S | S | * | . | trans | -81.9 | 103.5 | -178.8 | -172.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 7 | Q | 75.9 | Confident | 82.1 | Confident | 93 Ų | 93 | 96.6 Ų | 96.6 | 44% | 0.435 | 50% | 0.504 | S | S | . | . | P | Polyproline II helix | trans | -59.1 | 145.5 | 167.8 | -72.3 | -179.4 | 35.8 | 0 | 0 | 109.4 | R5 I9 | R5-Q7 PolarHBondContact O-N 3.11Å; Q7-I9 PolarHBondContact O-N 2.99Å |
| 8 | P | 85.6 | Confident | 82.8 | Confident | 94 Ų | 94 | 94.9 Ų | 94.9 | 61% | 0.61 | 50% | 0.495 | S | S | * | . | P | Polyproline II helix | trans | -59.9 | 126.8 | 178.3 | 23.9 | -32.3 | 0 | 0 | 0 | 110 | K10 | P8-K10 PolarHBondContact O-N 3.14Š|
| 9 | I | 91.5 | Very high | 83.4 | Confident | 102 Ų | 102 | 91.2 Ų | 91.2 | 52% | 0.523 | 48% | 0.482 | S | S | . | . | P | Polyproline II helix | trans | -67 | 129.3 | 175.1 | -61.7 | 178.8 | 0 | 0 | 0 | 108.2 | Q7 T57 L59 | Q7-I9 PolarHBondContact O-N 2.99Å; I9-T57 HydrophobicContact CG2-CG2 3.25Å; I9-L59 HydrophobicContact CD1-CD2 4.01Å; I9-L59 HydrophobicContact CG1-CD2 3.9Å |
| 10 | K | 94.1 | Very high | 83.9 | Confident | 46 Ų | 46 | 93.1 Ų | 93.1 | 20% | 0.2 | 48% | 0.482 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 140.8 | 175.9 | -66.9 | -154.9 | 173.8 | -142 | 0 | 111.6 | P8 F34 D36 L58 | P8-K10 PolarHBondContact O-N 3.14Å; K10-F34 HydrophobicContact CB-CD1 3.88Å; K10-F34 HydrophobicContact CB-CE1 3.77Å; K10-F34 HydrophobicContact CD-CD1 3.7Å; K10-F34 HydrophobicContact CD-CE1 3.63Å; K10-F34 HydrophobicContact CG-CD1 4.46Å; K10-F34 HydrophobicContact CG-CE1 4.31Å; K10-D36 IonicContact NZ-OD1 3.01Å; K10-D36 IonicContact NZ-OD2 2.81Å; K10-D36 PolarHBondContact NZ-OD2 2.92Å; K10-L58 PolarHBondContact N-O 2.81Å; K10-L58 WeakPolarHBondContact O-CB 3.47Å; K10-L58 PolarHBondContact O-N 3.37Å |
| 11 | L | 96.5 | Very high | 84.2 | Confident | 82 Ų | 82 | 90.1 Ų | 90.1 | 43% | 0.429 | 47% | 0.468 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 135.9 | 171.9 | -60.8 | 179.9 | 0 | 0 | 0 | 109.6 | M35 V55 L56 T57 | L11-M35 HydrophobicContact CB-CB 4.47Å; L11-M35 HydrophobicContact CB-CG 4.27Å; L11-M35 HydrophobicContact CB-SD 3.73Å; L11-M35 HydrophobicContact CD1-SD 4.45Å; L11-M35 PolarHBondContact O-N 3.33Å; L11-V55 HydrophobicContact CB-CG1 4.3Å; L11-V55 HydrophobicContact CD2-CG1 4.4Å; L11-L56 WeakPolarHBondContact CA-O 3.14Å; L11-T57 HydrophobicContact CD2-CG2 4.46Å |
| 12 | A | 97.5 | Very high | 85.6 | Confident | 0 Ų | 0 | 80.7 Ų | 80.7 | 0% | 0 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.3 | 140.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | V32 E33 F34 V55 L56 L58 | A12-V32 HydrophobicContact CB-CB 3.89Å; A12-V32 HydrophobicContact CB-CG2 3.76Å; A12-E33 CarbonylContact C-O 3.27Å; A12-E33 WeakPolarHBondContact CA-O 3.33Å; A12-E33 WeakPolarHBondContact CB-O 3.48Å; A12-F34 HydrophobicContact CB-CD1 4.36Å; A12-V55 WeakPolarHBondContact O-CA 3.32Å; A12-L56 PolarHBondContact N-O 3.15Å; A12-L56 PolarHBondContact O-N 3.42Å; A12-L58 HydrophobicContact CB-CD1 3.66Å; A12-L58 HydrophobicContact CB-CG 4.25Å |
| 13 | R | 97.9 | Very high | 87 | Confident | 139 Ų | 139 | 82 Ų | 82 | 53% | 0.525 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.1 | 136.8 | 177.6 | 176.4 | 175.4 | -104.1 | 163.6 | -6.2 | 110.2 | T15 V32 E33 G53 D54 | R13-T15 PolarHBondContact O-N 3.13Å; R13-V32 CarbonylContact O-C 3.41Å; R13-V32 WeakPolarHBondContact O-CA 3.41Å; R13-V32 WeakPolarHBondContact O-CB 3.44Å; R13-E33 PolarHBondContact N-O 2.8Å; R13-E33 PolarHBondContact O-N 2.91Å; R13-G53 PolarHBondContact NE-O 2.93Å; R13-D54 CarbonylContact C-O 3.58Å; R13-D54 WeakPolarHBondContact CA-O 3.25Å |
| 14 | V | 98.2 | Very high | 88.1 | Confident | 2 Ų | 2 | 85.3 Ų | 85.3 | 1% | 0.012 | 45% | 0.452 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.7 | 117.5 | 172 | 179.7 | 0 | 0 | 0 | 0 | 109.4 | V30 V32 V50 R51 G53 D54 L56 | V14-V30 HydrophobicContact CG1-CB 4.1Å; V14-V30 HydrophobicContact CG1-CG1 4.2Å; V14-V30 HydrophobicContact CG2-CG2 4.47Å; V14-V32 HydrophobicContact CB-CG1 4.44Å; V14-V32 HydrophobicContact CG2-CG1 3.89Å; V14-V50 HydrophobicContact CG2-CG2 3.96Å; V14-R51 WeakPolarHBondContact CG1-O 3.49Å; V14-G53 PolarHBondContact O-N 3.19Å; V14-D54 HydrophobicContact CB-CB 4.45Å; V14-D54 HydrophobicContact CG2-CB 4.08Å; V14-D54 PolarHBondContact N-O 3.35Å; V14-L56 HydrophobicContact CG2-CD1 4.14Å; V14-L56 HydrophobicContact CG2-CD2 4.47Å; V14-L56 HydrophobicContact CG2-CG 4.04Å |
| 15 | T | 97.8 | Very high | 89.2 | Confident | 42 Ų | 42 | 81.6 Ų | 81.6 | 26% | 0.258 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.3 | -28.2 | 178.1 | 58.5 | 0 | 0 | 0 | 0 | 113.1 | R13 R31 E33 | R13-T15 PolarHBondContact O-N 3.13Å; T15-R31 PolarHBondContact N-O 2.78Å; T15-R31 PolarHBondContact OG1-O 2.8Å; T15-E33 HydrophobicContact CG2-CB 3.85Å; T15-E33 HydrophobicContact CG2-CG 3.72Å |
| 16 | K | 97.7 | Very high | 90.2 | Very high | 118 Ų | 118 | 76.6 Ų | 76.6 | 51% | 0.513 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.4 | 136.4 | 176.5 | -167.5 | 170.6 | -177.2 | 170.7 | 0 | 112.6 | L18 V30 R31 | K16-L18 HydrophobicContact CB-CD2 4.31Å; K16-L18 HydrophobicContact CD-CD2 4.13Å; K16-L18 HydrophobicContact CG-CD2 4.09Å; K16-V30 CarbonylContact O-C 3.58Å; K16-V30 WeakPolarHBondContact O-CA 3.43Å; K16-R31 HydrophobicContact CB-CB 4.28Å; K16-R31 PolarHBondContact N-O 3.32Å; K16-R31 PolarHBondContact O-N 3.37Å |
| 17 | V | 96.7 | Very high | 91.5 | Very high | 54 Ų | 54 | 72.9 Ų | 72.9 | 33% | 0.327 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 118.2 | 166.6 | -179.3 | 0 | 0 | 0 | 0 | 109 | T28 V30 V50 E52 | V17-T28 HydrophobicContact CG1-CG2 3.51Å; V17-V30 HydrophobicContact CG2-CG1 4.37Å; V17-V50 HydrophobicContact CG2-CG1 4.45Å; V17-E52 HydrophobicContact CG2-CG 4.42Å |
| 18 | L | 95.2 | Very high | 92.4 | Very high | 65 Ų | 65 | 68.9 Ų | 68.9 | 34% | 0.34 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | -37.1 | -174.5 | -55.7 | -174.8 | 0 | 0 | 0 | 112.6 | K16 Q29 R31 I43 | K16-L18 HydrophobicContact CB-CD2 4.31Å; K16-L18 HydrophobicContact CD-CD2 4.13Å; K16-L18 HydrophobicContact CG-CD2 4.09Å; L18-Q29 HydrophobicContact CB-CB 4.41Å; L18-Q29 HydrophobicContact CB-CG 4.43Å; L18-Q29 WeakPolarHBondContact CB-O 3.41Å; L18-Q29 HydrophobicContact CD1-CG 4.11Å; L18-Q29 PolarHBondContact N-O 2.78Å; L18-R31 HydrophobicContact CD2-CB 4.35Å; L18-I43 HydrophobicContact CD1-CD1 4.08Å; L18-I43 HydrophobicContact CD1-CG1 4.21Å; L18-I43 HydrophobicContact CD1-CG2 4.05Å |
| 19 | G | 93.8 | Very high | 92.9 | Very high | 24 Ų | 24 | 64.6 Ų | 64.6 | 25% | 0.247 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 157.9 | 178.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | T28 Q29 | G19-T28 CarbonylContact O-C 3.57Å; G19-T28 WeakPolarHBondContact O-CA 3.35Å; G19-Q29 PolarHBondContact N-O 2.8Å; G19-Q29 PolarHBondContact O-N 2.78Å |
| 20 | R | 93.4 | Very high | 93.2 | Very high | 129 Ų | 129 | 59.7 Ų | 59.7 | 49% | 0.487 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 143.1 | 175.5 | -62.3 | -71.4 | -85.7 | -176.2 | -8.9 | 110.3 | G25 C27 T28 | R20-G25 PolarHBondContact NE-O 2.81Å; R20-G25 PolarHBondContact NH2-O 2.84Å; R20-C27 CarbonylContact C-O 3.57Å; R20-C27 WeakPolarHBondContact CA-O 3.37Å; R20-T28 PolarHBondContact NH1-OG1 2.85Å |
| 21 | T | 89.9 | Confident | 93.3 | Very high | 31 Ų | 31 | 61.6 Ų | 61.6 | 19% | 0.19 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.2 | 169.6 | -178.7 | -166.1 | 0 | 0 | 0 | 0 | 111.4 | C27 Q29 L68 | T21-C27 HydrophobicContact CG2-CB 3.72Å; T21-C27 PolarHBondContact N-O 2.97Å; T21-C27 WeakPolarHBondContact O-CB 3.43Å; T21-C27 PolarHBondContact O-N 3.35Å; T21-C27 VanDerWaalsContact O-O 3.12Å; T21-Q29 HydrophobicContact CG2-CB 4.15Å; T21-L68 WeakPolarHBondContact OG1-CD2 3.48Å |
| 22 | G | 85.1 | Confident | 93.4 | Very high | 49 Ų | 49 | 57.7 Ų | 57.7 | 51% | 0.505 | 31% | 0.309 | S | S | . | . | S | Bend | trans | 84.3 | 152 | -172.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q24 G25 | G22-Q24 PolarHBondContact O-N 2.84Å; G22-Q24 VanDerWaalsContact O-N 3.14Å; G22-G25 PolarHBondContact O-N 2.83Å |
| 23 | S | 84.3 | Confident | 93.4 | Very high | 132 Ų | 132 | 61.2 Ų | 61.2 | 92% | 0.923 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -30.1 | -174.7 | 51.3 | 0 | 0 | 0 | 0 | 114.2 | ||
| 24 | Q | 83.8 | Confident | 93.3 | Very high | 157 Ų | 157 | 54.8 Ų | 54.8 | 73% | 0.734 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.9 | 6.2 | 179.8 | -64 | 179.5 | -24 | 0 | 0 | 113.2 | G22 Q26 | G22-Q24 PolarHBondContact O-N 2.84Å; G22-Q24 VanDerWaalsContact O-N 3.14Å; Q24-Q26 HydrophobicContact CB-CG 4.01Å; Q24-Q26 PolarHBondContact O-N 3.42Å; Q24-Q26 VanDerWaalsContact O-N 3.11Å; Q24-Q26 PolarHBondContact O-NE2 2.83Å |
| 25 | G | 82.4 | Confident | 93.2 | Very high | 25 Ų | 25 | 60.2 Ų | 60.2 | 26% | 0.258 | 33% | 0.327 | S | S | . | . | S | Bend | trans | 59.5 | 23.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | R20 G22 | R20-G25 PolarHBondContact NE-O 2.81Å; R20-G25 PolarHBondContact NH2-O 2.84Å; G22-G25 PolarHBondContact O-N 2.83Å |
| 26 | Q | 89.4 | Confident | 92.9 | Very high | 107 Ų | 107 | 63.2 Ų | 63.2 | 50% | 0.5 | 34% | 0.342 | S | S | . | . | trans | -86.4 | -13 | -178.2 | -63.7 | -56.5 | -46.8 | 0 | 0 | 113.5 | Q24 G48 | Q24-Q26 HydrophobicContact CB-CG 4.01Å; Q24-Q26 PolarHBondContact O-N 3.42Å; Q24-Q26 VanDerWaalsContact O-N 3.11Å; Q24-Q26 PolarHBondContact O-NE2 2.83Å; Q26-G48 PolarHBondContact O-N 3.22Å | ||
| 27 | C | 93.9 | Very high | 92.5 | Very high | 39 Ų | 39 | 60.7 Ų | 60.7 | 26% | 0.264 | 33% | 0.334 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104 | 143.9 | 179.8 | -62.5 | 0 | 0 | 0 | 0 | 110 | R20 T21 V46 | R20-C27 CarbonylContact C-O 3.57Å; R20-C27 WeakPolarHBondContact CA-O 3.37Å; T21-C27 HydrophobicContact CG2-CB 3.72Å; T21-C27 PolarHBondContact N-O 2.97Å; T21-C27 WeakPolarHBondContact O-CB 3.43Å; T21-C27 PolarHBondContact O-N 3.35Å; T21-C27 VanDerWaalsContact O-O 3.12Å; C27-V46 CarbonylContact C-O 3.54Å; C27-V46 WeakPolarHBondContact CA-O 3.43Å |
| 28 | T | 95.5 | Very high | 91.9 | Very high | 9 Ų | 9 | 62.2 Ų | 62.2 | 6% | 0.055 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 126.7 | 171.8 | -50.5 | 0 | 0 | 0 | 0 | 107.6 | V17 G19 R20 V30 V46 G48 V50 | V17-T28 HydrophobicContact CG1-CG2 3.51Å; G19-T28 CarbonylContact O-C 3.57Å; G19-T28 WeakPolarHBondContact O-CA 3.35Å; R20-T28 PolarHBondContact NH1-OG1 2.85Å; T28-V30 HydrophobicContact CG2-CG1 4.26Å; T28-V46 PolarHBondContact N-O 3.28Å; T28-V46 PolarHBondContact O-N 3.18Å; T28-G48 PolarHBondContact OG1-O 3.36Å; T28-G48 VanDerWaalsContact OG1-O 3.13Å; T28-V50 HydrophobicContact CG2-CG1 3.74Å |
| 29 | Q | 95.9 | Very high | 91.8 | Very high | 4 Ų | 4 | 66.4 Ų | 66.4 | 2% | 0.019 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.5 | 130.4 | 172.9 | -170.6 | 166.9 | 86.4 | 0 | 0 | 109.3 | L18 G19 T21 I43 R44 N45 R66 L68 | L18-Q29 HydrophobicContact CB-CB 4.41Å; L18-Q29 HydrophobicContact CB-CG 4.43Å; L18-Q29 WeakPolarHBondContact CB-O 3.41Å; L18-Q29 HydrophobicContact CD1-CG 4.11Å; L18-Q29 PolarHBondContact N-O 2.78Å; G19-Q29 PolarHBondContact N-O 2.8Å; G19-Q29 PolarHBondContact O-N 2.78Å; T21-Q29 HydrophobicContact CG2-CB 4.15Å; Q29-I43 HydrophobicContact CG-CG2 3.29Å; Q29-R44 CarbonylContact C-O 3.56Å; Q29-R44 WeakPolarHBondContact CA-O 3.37Å; Q29-N45 PolarHBondContact NE2-OD1 3.43Å; Q29-R66 PolarHBondContact NE2-O 2.81Å; Q29-L68 HydrophobicContact CB-CD1 4.31Å |
| 30 | V | 97.6 | Very high | 91.8 | Very high | 0 Ų | 0 | 68.3 Ų | 68.3 | 0% | 0 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.6 | 149.1 | -177.1 | -61.1 | 0 | 0 | 0 | 0 | 110.6 | V14 K16 V17 T28 V32 I43 R44 V46 V50 L56 | V14-V30 HydrophobicContact CG1-CB 4.1Å; V14-V30 HydrophobicContact CG1-CG1 4.2Å; V14-V30 HydrophobicContact CG2-CG2 4.47Å; K16-V30 CarbonylContact O-C 3.58Å; K16-V30 WeakPolarHBondContact O-CA 3.43Å; V17-V30 HydrophobicContact CG2-CG1 4.37Å; T28-V30 HydrophobicContact CG2-CG1 4.26Å; V30-V32 HydrophobicContact CG2-CG1 3.86Å; V30-I43 WeakPolarHBondContact O-CA 3.19Å; V30-R44 HydrophobicContact CG2-CB 4.15Å; V30-R44 PolarHBondContact N-O 3.47Å; V30-R44 PolarHBondContact O-N 2.79Å; V30-V46 HydrophobicContact CG2-CG2 3.75Å; V30-V50 HydrophobicContact CG1-CG1 3.55Å; V30-V50 HydrophobicContact CG1-CG2 4.35Å; V30-L56 HydrophobicContact CG2-CD1 4.23Å |
| 31 | R | 97.3 | Very high | 91.9 | Very high | 86 Ų | 86 | 64.1 Ų | 64.1 | 33% | 0.325 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.3 | 132.5 | 162.7 | -177.7 | 175.7 | -67 | -115.4 | 2 | 108.3 | T15 K16 L18 S41 | T15-R31 PolarHBondContact N-O 2.78Å; T15-R31 PolarHBondContact OG1-O 2.8Å; K16-R31 HydrophobicContact CB-CB 4.28Å; K16-R31 PolarHBondContact N-O 3.32Å; K16-R31 PolarHBondContact O-N 3.37Å; L18-R31 HydrophobicContact CD2-CB 4.35Å; R31-S41 PolarHBondContact NH1-OG 2.88Å |
| 32 | V | 97.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 148 | 175.5 | -57.4 | 0 | 0 | 0 | 0 | 110.8 | A12 R13 V14 V30 S41 I42 R44 L56 L58 | A12-V32 HydrophobicContact CB-CB 3.89Å; A12-V32 HydrophobicContact CB-CG2 3.76Å; R13-V32 CarbonylContact O-C 3.41Å; R13-V32 WeakPolarHBondContact O-CA 3.41Å; R13-V32 WeakPolarHBondContact O-CB 3.44Å; V14-V32 HydrophobicContact CB-CG1 4.44Å; V14-V32 HydrophobicContact CG2-CG1 3.89Å; V30-V32 HydrophobicContact CG2-CG1 3.86Å; V32-S41 CarbonylContact O-C 3.52Å; V32-S41 WeakPolarHBondContact O-CA 3.14Å; V32-S41 WeakPolarHBondContact O-CB 3.38Å; V32-I42 HydrophobicContact CG2-CD1 4.31Å; V32-I42 HydrophobicContact CG2-CG1 3.54Å; V32-I42 PolarHBondContact N-O 3.22Å; V32-I42 PolarHBondContact O-N 2.89Å; V32-R44 HydrophobicContact CG2-CG 4.28Å; V32-L56 HydrophobicContact CG1-CD1 3.67Å; V32-L56 HydrophobicContact CG1-CG 4.42Å; V32-L58 HydrophobicContact CG2-CD1 4.47Å |
| 33 | E | 97.7 | Very high | 92.8 | Very high | 74 Ų | 74 | 60.7 Ų | 60.7 | 35% | 0.346 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.3 | 139.3 | 172.2 | -78.8 | 166.5 | -156.8 | 0 | 0 | 109.5 | A12 R13 T15 | A12-E33 CarbonylContact C-O 3.27Å; A12-E33 WeakPolarHBondContact CA-O 3.33Å; A12-E33 WeakPolarHBondContact CB-O 3.48Å; R13-E33 PolarHBondContact N-O 2.8Å; R13-E33 PolarHBondContact O-N 2.91Å; T15-E33 HydrophobicContact CG2-CB 3.85Å; T15-E33 HydrophobicContact CG2-CG 3.72Å |
| 34 | F | 96.4 | Very high | 93.4 | Very high | 4 Ų | 4 | 56.1 Ų | 56.1 | 2% | 0.018 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.9 | 137.6 | 178.9 | -73.5 | -82.5 | 0 | 0 | 0 | 110.8 | K10 A12 D36 D37 R40 I42 L58 | K10-F34 HydrophobicContact CB-CD1 3.88Å; K10-F34 HydrophobicContact CB-CE1 3.77Å; K10-F34 HydrophobicContact CD-CD1 3.7Å; K10-F34 HydrophobicContact CD-CE1 3.63Å; K10-F34 HydrophobicContact CG-CD1 4.46Å; K10-F34 HydrophobicContact CG-CE1 4.31Å; A12-F34 HydrophobicContact CB-CD1 4.36Å; F34-D36 VanDerWaalsContact C-N 3.29Å; F34-D36 WeakPolarHBondContact CB-OD1 3.45Å; F34-D36 PolarHBondContact O-N 3.35Å; F34-D37 HydrophobicContact CB-CB 4.43Å; F34-D37 WeakPolarHBondContact CB-O 3.41Å; F34-D37 CarbonylContact O-C 3.51Å; F34-D37 VanDerWaalsContact O-C 3.27Å; F34-D37 PolarHBondContact O-N 2.94Å; F34-R40 HydrophobicContact CD2-CB 3.82Å; F34-R40 HydrophobicContact CD2-CG 3.61Å; F34-R40 WeakPolarHBondContact CD2-O 3.36Å; F34-R40 HydrophobicContact CE2-CB 4.43Å; F34-R40 HydrophobicContact CE2-CG 3.72Å; F34-R40 PolarHBondContact N-O 3.31Å; F34-I42 HydrophobicContact CE2-CD1 4.12Å; F34-I42 HydrophobicContact CE2-CG1 4.18Å; F34-I42 HydrophobicContact CE2-CG2 3.75Å; F34-I42 HydrophobicContact CZ-CD1 3.78Å; F34-I42 HydrophobicContact CZ-CG1 4.31Å; F34-I42 HydrophobicContact CZ-CG2 4.34Å; F34-L58 HydrophobicContact CD1-CD1 4.31Å; F34-L58 HydrophobicContact CE1-CD1 3.54Å; F34-L58 HydrophobicContact CZ-CD1 3.94Å |
| 35 | M | 94.8 | Very high | 94 | Very high | 115 Ų | 115 | 52.7 Ų | 52.7 | 57% | 0.567 | 28% | 0.278 | S | S | * | . | S | Bend | trans | -72.9 | -24.2 | -179.6 | -66.7 | -175.6 | 69.7 | 0 | 0 | 112.6 | L11 V55 | L11-M35 HydrophobicContact CB-CB 4.47Å; L11-M35 HydrophobicContact CB-CG 4.27Å; L11-M35 HydrophobicContact CB-SD 3.73Å; L11-M35 HydrophobicContact CD1-SD 4.45Å; L11-M35 PolarHBondContact O-N 3.33Å; M35-V55 HydrophobicContact SD-CG1 3.94Å; M35-V55 HydrophobicContact SD-CG2 4.38Å |
| 36 | D | 92.9 | Very high | 94.6 | Very high | 105 Ų | 105 | 52.7 Ų | 52.7 | 56% | 0.561 | 27% | 0.273 | S | S | * | . | S | Bend | trans | -88.7 | -15.2 | 175.4 | 61.1 | -38.7 | 0 | 0 | 0 | 113.3 | K10 F34 | K10-D36 IonicContact NZ-OD1 3.01Å; K10-D36 IonicContact NZ-OD2 2.81Å; K10-D36 PolarHBondContact NZ-OD2 2.92Å; F34-D36 VanDerWaalsContact C-N 3.29Å; F34-D36 WeakPolarHBondContact CB-OD1 3.45Å; F34-D36 PolarHBondContact O-N 3.35Å |
| 37 | D | 89.3 | Confident | 94.9 | Very high | 65 Ų | 65 | 56.2 Ų | 56.2 | 35% | 0.348 | 29% | 0.287 | S | S | . | . | trans | -151.3 | 95 | -180 | -179.2 | 1.8 | 0 | 0 | 0 | 110.8 | F34 N39 R40 | F34-D37 HydrophobicContact CB-CB 4.43Å; F34-D37 WeakPolarHBondContact CB-O 3.41Å; F34-D37 CarbonylContact O-C 3.51Å; F34-D37 VanDerWaalsContact O-C 3.27Å; F34-D37 PolarHBondContact O-N 2.94Å; D37-N39 PolarHBondContact O-N 3.21Å; D37-N39 WeakPolarHBondContact OD1-CB 3.44Å; D37-N39 PolarHBondContact OD1-N 3.43Å; D37-R40 HydrophobicContact CB-CB 4.35Å; D37-R40 PolarHBondContact O-N 3.37Å | ||
| 38 | S | 83.8 | Confident | 94.8 | Very high | 87 Ų | 87 | 55.2 Ų | 55.2 | 61% | 0.608 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.8 | -15.2 | -178.7 | 57.8 | 0 | 0 | 0 | 0 | 114.1 | R40 | S38-R40 VanDerWaalsContact C-N 3.25Š|
| 39 | N | 92 | Very high | 94.7 | Very high | 152 Ų | 152 | 61 Ų | 61 | 81% | 0.813 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.5 | -15.7 | 177.3 | -67.3 | -29.6 | 0 | 0 | 0 | 111.8 | D37 | D37-N39 PolarHBondContact O-N 3.21Å; D37-N39 WeakPolarHBondContact OD1-CB 3.44Å; D37-N39 PolarHBondContact OD1-N 3.43Å |
| 40 | R | 94.5 | Very high | 94.7 | Very high | 65 Ų | 65 | 61.8 Ų | 61.8 | 25% | 0.245 | 33% | 0.326 | C | S | . | . | trans | -100.3 | 117.9 | -178.7 | -168.3 | -179 | 174.9 | -178.3 | -0.1 | 110.2 | F34 D37 S38 E62 | F34-R40 HydrophobicContact CD2-CB 3.82Å; F34-R40 HydrophobicContact CD2-CG 3.61Å; F34-R40 WeakPolarHBondContact CD2-O 3.36Å; F34-R40 HydrophobicContact CE2-CB 4.43Å; F34-R40 HydrophobicContact CE2-CG 3.72Å; F34-R40 PolarHBondContact N-O 3.31Å; D37-R40 HydrophobicContact CB-CB 4.35Å; D37-R40 PolarHBondContact O-N 3.37Å; S38-R40 VanDerWaalsContact C-N 3.25Å; R40-E62 IonicContact CZ-OE1 3.6Å; R40-E62 IonicContact CZ-OE2 3.21Å; R40-E62 IonicContact NH1-OE1 3.68Å; R40-E62 PolarHBondContact NH1-OE1 3.19Å; R40-E62 IonicContact NH1-OE2 3.94Å; R40-E62 IonicContact NH2-OE1 2.72Å; R40-E62 PolarHBondContact NH2-OE1 3.06Å; R40-E62 IonicContact NH2-OE2 3.22Å; R40-E62 PolarHBondContact NH2-OE2 3.28Å | ||
| 41 | S | 95.8 | Very high | 94.7 | Very high | 40 Ų | 40 | 71.2 Ų | 71.2 | 28% | 0.28 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 145.2 | 171.4 | 70.1 | 0 | 0 | 0 | 0 | 111.3 | R31 V32 | R31-S41 PolarHBondContact NH1-OG 2.88Å; V32-S41 CarbonylContact O-C 3.52Å; V32-S41 WeakPolarHBondContact O-CA 3.14Å; V32-S41 WeakPolarHBondContact O-CB 3.38Å |
| 42 | I | 96.6 | Very high | 94.7 | Very high | 2 Ų | 2 | 73.2 Ų | 73.2 | 1% | 0.01 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.1 | 162.4 | -179.9 | 66.7 | 169.3 | 0 | 0 | 0 | 110.7 | V32 F34 R44 L58 E64 | V32-I42 HydrophobicContact CG2-CD1 4.31Å; V32-I42 HydrophobicContact CG2-CG1 3.54Å; V32-I42 PolarHBondContact N-O 3.22Å; V32-I42 PolarHBondContact O-N 2.89Å; F34-I42 HydrophobicContact CE2-CD1 4.12Å; F34-I42 HydrophobicContact CE2-CG1 4.18Å; F34-I42 HydrophobicContact CE2-CG2 3.75Å; F34-I42 HydrophobicContact CZ-CD1 3.78Å; F34-I42 HydrophobicContact CZ-CG1 4.31Å; F34-I42 HydrophobicContact CZ-CG2 4.34Å; I42-R44 HydrophobicContact CD1-CG 4.19Å; I42-R44 HydrophobicContact CG1-CG 4.39Å; I42-L58 HydrophobicContact CD1-CD1 3.81Å; I42-E64 HydrophobicContact CB-CG 3.95Å; I42-E64 HydrophobicContact CG2-CG 4.13Å; I42-E64 VanDerWaalsContact CG2-OE1 3.25Å; I42-E64 WeakPolarHBondContact CG2-OE1 3.15Å |
| 43 | I | 96.9 | Very high | 94.7 | Very high | 6 Ų | 6 | 74.8 Ų | 74.8 | 3% | 0.031 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.2 | 133.4 | 176 | -58.1 | 177.7 | 0 | 0 | 0 | 110.2 | L18 Q29 V30 A65 R67 | L18-I43 HydrophobicContact CD1-CD1 4.08Å; L18-I43 HydrophobicContact CD1-CG1 4.21Å; L18-I43 HydrophobicContact CD1-CG2 4.05Å; Q29-I43 HydrophobicContact CG-CG2 3.29Å; V30-I43 WeakPolarHBondContact O-CA 3.19Å; I43-A65 HydrophobicContact CG2-CB 4.16Å; I43-A65 PolarHBondContact O-N 3.41Å; I43-R67 HydrophobicContact CD1-CG 3.62Å |
| 44 | R | 97.2 | Very high | 94.7 | Very high | 37 Ų | 37 | 74.5 Ų | 74.5 | 14% | 0.14 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 152.7 | 177.1 | -70.1 | -65.3 | 175.2 | 159.4 | 4.5 | 112.7 | Q29 V30 V32 I42 L58 E60 R63 | Q29-R44 CarbonylContact C-O 3.56Å; Q29-R44 WeakPolarHBondContact CA-O 3.37Å; V30-R44 HydrophobicContact CG2-CB 4.15Å; V30-R44 PolarHBondContact N-O 3.47Å; V30-R44 PolarHBondContact O-N 2.79Å; V32-R44 HydrophobicContact CG2-CG 4.28Å; I42-R44 HydrophobicContact CD1-CG 4.19Å; I42-R44 HydrophobicContact CG1-CG 4.39Å; R44-L58 HydrophobicContact CG-CD2 4.11Å; R44-E60 PolarHBondContact NH1-O 3.23Å; R44-E60 PolarHBondContact NH2-O 2.61Å; R44-R63 PolarHBondContact NE-O 2.98Å; R44-R63 PolarHBondContact NH1-O 3.01Å; R44-R63 PolarHBondContact NH2-O 3.01Å |
| 45 | N | 95.9 | Very high | 94.8 | Very high | 84 Ų | 84 | 78 Ų | 78 | 45% | 0.449 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 123.7 | 167.7 | -64.1 | -24.2 | 0 | 0 | 0 | 107.9 | Q29 A65 | Q29-N45 PolarHBondContact NE2-OD1 3.43Å; N45-A65 WeakPolarHBondContact OD1-CB 3.46Å |
| 46 | V | 96.3 | Very high | 94.9 | Very high | 26 Ų | 26 | 74 Ų | 74 | 16% | 0.158 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | 133.6 | 174.3 | 178.6 | 0 | 0 | 0 | 0 | 107.9 | C27 T28 V30 V50 L56 | C27-V46 CarbonylContact C-O 3.54Å; C27-V46 WeakPolarHBondContact CA-O 3.43Å; T28-V46 PolarHBondContact N-O 3.28Å; T28-V46 PolarHBondContact O-N 3.18Å; V30-V46 HydrophobicContact CG2-CG2 3.75Å; V46-V50 HydrophobicContact CB-CG1 4.47Å; V46-V50 HydrophobicContact CG1-CB 4.15Å; V46-V50 HydrophobicContact CG1-CG2 4.4Å; V46-L56 HydrophobicContact CG2-CD1 3.67Å; V46-L56 HydrophobicContact CG2-CD2 4.19Å |
| 47 | K | 94.4 | Very high | 95 | Very high | 181 Ų | 181 | 73.2 Ų | 73.2 | 79% | 0.787 | 39% | 0.393 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 129.6 | 173.3 | -174.7 | 178.4 | 178.8 | -178.8 | 0 | 109 | ||
| 48 | G | 91.6 | Very high | 95.3 | Very high | 18 Ų | 18 | 70.6 Ų | 70.6 | 19% | 0.186 | 38% | 0.379 | C | S | . | . | S | Bend | trans | 89 | -167.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | Q26 T28 | Q26-G48 PolarHBondContact O-N 3.22Å; T28-G48 PolarHBondContact OG1-O 3.36Å; T28-G48 VanDerWaalsContact OG1-O 3.13Å |
| 49 | P | 93.4 | Very high | 95.8 | Very high | 131 Ų | 131 | 72 Ų | 72 | 85% | 0.851 | 38% | 0.379 | S | S | * | . | trans | -72.7 | 140.6 | 179.2 | 30.2 | -33.2 | 0 | 0 | 0 | 111 | ||||
| 50 | V | 96.4 | Very high | 95.8 | Very high | 20 Ų | 20 | 68.7 Ų | 68.7 | 12% | 0.121 | 36% | 0.359 | C | S | . | . | trans | -147.8 | 149.1 | 179 | 63.2 | 0 | 0 | 0 | 0 | 108.5 | V14 V17 T28 V30 V46 D54 | V14-V50 HydrophobicContact CG2-CG2 3.96Å; V17-V50 HydrophobicContact CG2-CG1 4.45Å; T28-V50 HydrophobicContact CG2-CG1 3.74Å; V30-V50 HydrophobicContact CG1-CG1 3.55Å; V30-V50 HydrophobicContact CG1-CG2 4.35Å; V46-V50 HydrophobicContact CB-CG1 4.47Å; V46-V50 HydrophobicContact CG1-CB 4.15Å; V46-V50 HydrophobicContact CG1-CG2 4.4Å; V50-D54 HydrophobicContact CG2-CB 4.26Å | ||
| 51 | R | 97.3 | Very high | 95.7 | Very high | 197 Ų | 197 | 65.8 Ų | 65.8 | 74% | 0.743 | 35% | 0.349 | S | S | * | . | trans | -127.3 | 160.5 | -180 | -63.8 | -179.3 | -177.8 | 178.2 | 0.9 | 110.9 | V14 D54 | V14-R51 WeakPolarHBondContact CG1-O 3.49Å; R51-D54 PolarHBondContact N-OD2 2.55Å; R51-D54 WeakPolarHBondContact O-CB 3.42Å; R51-D54 PolarHBondContact O-N 3.24Å | ||
| 52 | E | 97.8 | Very high | 95.5 | Very high | 128 Ų | 128 | 69.5 Ų | 69.5 | 60% | 0.598 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | 139.8 | 170.4 | -66 | -179.9 | 178.3 | 0 | 0 | 110 | V17 | V17-E52 HydrophobicContact CG2-CG 4.42Š|
| 53 | G | 97.4 | Very high | 95.3 | Very high | 34 Ų | 34 | 76.7 Ų | 76.7 | 35% | 0.351 | 39% | 0.388 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91.6 | -17 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | R13 V14 | R13-G53 PolarHBondContact NE-O 2.93Å; V14-G53 PolarHBondContact O-N 3.19Å |
| 54 | D | 98.3 | Very high | 95.2 | Very high | 68 Ų | 68 | 81.8 Ų | 81.8 | 36% | 0.364 | 41% | 0.412 | S | S | . | . | trans | -58.9 | 148.9 | 175.1 | -71.8 | -14.2 | 0 | 0 | 0 | 111.1 | R13 V14 V50 R51 | R13-D54 CarbonylContact C-O 3.58Å; R13-D54 WeakPolarHBondContact CA-O 3.25Å; V14-D54 HydrophobicContact CB-CB 4.45Å; V14-D54 HydrophobicContact CG2-CB 4.08Å; V14-D54 PolarHBondContact N-O 3.35Å; V50-D54 HydrophobicContact CG2-CB 4.26Å; R51-D54 PolarHBondContact N-OD2 2.55Å; R51-D54 WeakPolarHBondContact O-CB 3.42Å; R51-D54 PolarHBondContact O-N 3.24Å | ||
| 55 | V | 97.6 | Very high | 95 | Very high | 76 Ų | 76 | 80.9 Ų | 80.9 | 46% | 0.461 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 127.9 | 179.8 | -179.2 | 0 | 0 | 0 | 0 | 109.9 | L11 A12 M35 | L11-V55 HydrophobicContact CB-CG1 4.3Å; L11-V55 HydrophobicContact CD2-CG1 4.4Å; A12-V55 WeakPolarHBondContact O-CA 3.32Å; M35-V55 HydrophobicContact SD-CG1 3.94Å; M35-V55 HydrophobicContact SD-CG2 4.38Å |
| 56 | L | 96.9 | Very high | 94.8 | Very high | 32 Ų | 32 | 86.1 Ų | 86.1 | 17% | 0.168 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.5 | 140.1 | 176.7 | -56 | -174.9 | 0 | 0 | 0 | 110.4 | L11 A12 V14 V30 V32 V46 L58 | L11-L56 WeakPolarHBondContact CA-O 3.14Å; A12-L56 PolarHBondContact N-O 3.15Å; A12-L56 PolarHBondContact O-N 3.42Å; V14-L56 HydrophobicContact CG2-CD1 4.14Å; V14-L56 HydrophobicContact CG2-CD2 4.47Å; V14-L56 HydrophobicContact CG2-CG 4.04Å; V30-L56 HydrophobicContact CG2-CD1 4.23Å; V32-L56 HydrophobicContact CG1-CD1 3.67Å; V32-L56 HydrophobicContact CG1-CG 4.42Å; V46-L56 HydrophobicContact CG2-CD1 3.67Å; V46-L56 HydrophobicContact CG2-CD2 4.19Å; L56-L58 HydrophobicContact CB-CD2 4.38Å |
| 57 | T | 96.6 | Very high | 94.2 | Very high | 88 Ų | 88 | 93.2 Ų | 93.2 | 54% | 0.54 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.6 | 118.6 | 167.3 | -57.6 | 0 | 0 | 0 | 0 | 108.8 | I9 L11 | I9-T57 HydrophobicContact CG2-CG2 3.25Å; L11-T57 HydrophobicContact CD2-CG2 4.46Å |
| 58 | L | 94.8 | Very high | 93.6 | Very high | 11 Ų | 11 | 88.2 Ų | 88.2 | 6% | 0.058 | 43% | 0.431 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 115.7 | -179.2 | -57.8 | 178.8 | 0 | 0 | 0 | 109.7 | K10 A12 V32 F34 I42 R44 L56 | K10-L58 PolarHBondContact N-O 2.81Å; K10-L58 WeakPolarHBondContact O-CB 3.47Å; K10-L58 PolarHBondContact O-N 3.37Å; A12-L58 HydrophobicContact CB-CD1 3.66Å; A12-L58 HydrophobicContact CB-CG 4.25Å; V32-L58 HydrophobicContact CG2-CD1 4.47Å; F34-L58 HydrophobicContact CD1-CD1 4.31Å; F34-L58 HydrophobicContact CE1-CD1 3.54Å; F34-L58 HydrophobicContact CZ-CD1 3.94Å; I42-L58 HydrophobicContact CD1-CD1 3.81Å; R44-L58 HydrophobicContact CG-CD2 4.11Å; L56-L58 HydrophobicContact CB-CD2 4.38Å |
| 59 | L | 93.2 | Very high | 92.9 | Very high | 117 Ų | 117 | 100.8 Ų | 100.8 | 61% | 0.613 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -81.9 | -24 | 174.9 | -57.3 | -178.5 | 0 | 0 | 0 | 112.8 | I9 | I9-L59 HydrophobicContact CD1-CD2 4.01Å; I9-L59 HydrophobicContact CG1-CD2 3.9Å |
| 60 | E | 92.8 | Very high | 92.9 | Very high | 81 Ų | 81 | 99.3 Ų | 99.3 | 38% | 0.379 | 45% | 0.454 | S | S | . | . | S | Bend | trans | -128.9 | 79.7 | -179.8 | -65.5 | -177.1 | 121.6 | 0 | 0 | 109.4 | R44 E62 R63 | R44-E60 PolarHBondContact NH1-O 3.23Å; R44-E60 PolarHBondContact NH2-O 2.61Å; E60-E62 PolarHBondContact O-N 2.77Å; E60-E62 VanDerWaalsContact O-N 3.15Å; E60-R63 HydrophobicContact CB-CG 4.35Å; E60-R63 VanDerWaalsContact CD-CD 3.46Å; E60-R63 PolarHBondContact O-N 3.24Å; E60-R63 WeakPolarHBondContact OE1-CD 3.21Å; E60-R63 IonicContact OE1-NH1 3.37Å; E60-R63 PolarHBondContact OE1-NH1 2.78Å; E60-R63 WeakPolarHBondContact OE2-CD 3.47Å; E60-R63 IonicContact OE2-NH1 2.77Å; E60-R63 PolarHBondContact OE2-NH1 3.38Å |
| 61 | S | 91.9 | Very high | 92.7 | Very high | 5 Ų | 5 | 103.4 Ų | 103.4 | 4% | 0.035 | 47% | 0.472 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.4 | -25.3 | -170.4 | 56.5 | 0 | 0 | 0 | 0 | 115.2 | ||
| 62 | E | 92 | Very high | 92.5 | Very high | 118 Ų | 118 | 98.2 Ų | 98.2 | 55% | 0.551 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.4 | -15.6 | -173.4 | -58.6 | -53 | 125.6 | 0 | 0 | 114.6 | R40 E60 | R40-E62 IonicContact CZ-OE1 3.6Å; R40-E62 IonicContact CZ-OE2 3.21Å; R40-E62 IonicContact NH1-OE1 3.68Å; R40-E62 PolarHBondContact NH1-OE1 3.19Å; R40-E62 IonicContact NH1-OE2 3.94Å; R40-E62 IonicContact NH2-OE1 2.72Å; R40-E62 PolarHBondContact NH2-OE1 3.06Å; R40-E62 IonicContact NH2-OE2 3.22Å; R40-E62 PolarHBondContact NH2-OE2 3.28Å; E60-E62 PolarHBondContact O-N 2.77Å; E60-E62 VanDerWaalsContact O-N 3.15Å |
| 63 | R | 92.6 | Very high | 92.2 | Very high | 152 Ų | 152 | 96.5 Ų | 96.5 | 57% | 0.574 | 45% | 0.448 | S | S | * | . | trans | -87.1 | 145.4 | -176.8 | -62.3 | -176 | 83.4 | 178 | 4.7 | 112.1 | R44 E60 | R44-R63 PolarHBondContact NE-O 2.98Å; R44-R63 PolarHBondContact NH1-O 3.01Å; R44-R63 PolarHBondContact NH2-O 3.01Å; E60-R63 HydrophobicContact CB-CG 4.35Å; E60-R63 VanDerWaalsContact CD-CD 3.46Å; E60-R63 PolarHBondContact O-N 3.24Å; E60-R63 WeakPolarHBondContact OE1-CD 3.21Å; E60-R63 IonicContact OE1-NH1 3.37Å; E60-R63 PolarHBondContact OE1-NH1 2.78Å; E60-R63 WeakPolarHBondContact OE2-CD 3.47Å; E60-R63 IonicContact OE2-NH1 2.77Å; E60-R63 PolarHBondContact OE2-NH1 3.38Å | ||
| 64 | E | 94.3 | Very high | 91.8 | Very high | 113 Ų | 113 | 100.4 Ų | 100.4 | 53% | 0.528 | 45% | 0.454 | S | S | . | . | trans | -125.3 | 146.3 | 174.6 | -58.3 | -161.5 | -177.3 | 0 | 0 | 112.2 | I42 | I42-E64 HydrophobicContact CB-CG 3.95Å; I42-E64 HydrophobicContact CG2-CG 4.13Å; I42-E64 VanDerWaalsContact CG2-OE1 3.25Å; I42-E64 WeakPolarHBondContact CG2-OE1 3.15Å | ||
| 65 | A | 93.3 | Very high | 91.4 | Very high | 18 Ų | 18 | 102.5 Ų | 102.5 | 15% | 0.149 | 46% | 0.461 | C | S | . | . | P | Polyproline II helix | trans | -72.3 | 140.7 | 168.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | I43 N45 R67 | I43-A65 HydrophobicContact CG2-CB 4.16Å; I43-A65 PolarHBondContact O-N 3.41Å; N45-A65 WeakPolarHBondContact OD1-CB 3.46Å; A65-R67 PolarHBondContact O-N 2.72Å |
| 66 | R | 91.3 | Very high | 91 | Very high | 194 Ų | 194 | 104.4 Ų | 104.4 | 73% | 0.732 | 46% | 0.461 | S | S | * | . | P | Polyproline II helix | trans | -60.1 | 133.9 | 174.3 | -170.5 | -178.6 | -174.4 | 170.1 | 7.6 | 109.9 | Q29 | Q29-R66 PolarHBondContact NE2-O 2.81Š|
| 67 | R | 85.1 | Confident | 90.5 | Very high | 176 Ų | 176 | 110 Ų | 110 | 66% | 0.664 | 48% | 0.483 | S | S | * | . | P | Polyproline II helix | trans | -56.9 | 140 | 174.6 | -68.4 | -178.3 | -174.3 | -172.4 | 3.4 | 110.9 | I43 A65 | I43-R67 HydrophobicContact CD1-CG 3.62Å; A65-R67 PolarHBondContact O-N 2.72Å |
| 68 | L | 81.3 | Confident | 90 | Very high | 76 Ų | 76 | 111.8 Ų | 111.8 | 40% | 0.398 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -54.6 | 140.6 | 163.8 | -70.7 | 170.6 | 0 | 0 | 0 | 109.4 | T21 Q29 | T21-L68 WeakPolarHBondContact OG1-CD2 3.48Å; Q29-L68 HydrophobicContact CB-CD1 4.31Å |
| 69 | R | 77.6 | Confident | 89.6 | Confident | 281 Ų | 281 | 121 Ų | 121 | 100% | 1.06 | 52% | 0.517 | S | S | * | . | trans | -83.8 | 0 | 171.5 | -73.9 | -177.1 | 178.3 | -179.5 | -1.8 | 109.8 |
Retrieved 69 of 69 residues in 568.3 ms
(Link to these results)