| 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 | 87.3 | Confident | 94.7 | Very high | 139 Ų | 139 | 92.7 Ų | 92.7 | 69% | 0.685 | 47% | 0.47 | S | S | * | . | 0 | 146.1 | 0 | 178.8 | 177.4 | 176 | 0 | 0 | 107.7 | C21 L33 | M1-C21 HydrophobicContact CB-CB 4.17Å; M1-C21 HydrophobicContact CG-CB 4.34Å; M1-C21 PolarHBondContact O-N 3.15Å; M1-L33 HydrophobicContact CE-CD1 3.73Å; M1-L33 HydrophobicContact CE-CD2 4.43Å; M1-L33 HydrophobicContact SD-CD1 4.25Å | |||
| 2 | E | 94.2 | Very high | 94.6 | Very high | 101 Ų | 101 | 89 Ų | 89 | 47% | 0.472 | 47% | 0.472 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 148 | 177 | 75.1 | -179.3 | 121.6 | 0 | 0 | 111.7 | L4 R18 V19 | E2-L4 HydrophobicContact CG-CD1 4.34Å; E2-L4 HydrophobicContact CG-CD2 4.45Å; E2-L4 HydrophobicContact CG-CG 4.12Å; E2-L4 VanDerWaalsContact OE2-CD2 3.24Å; E2-L4 WeakPolarHBondContact OE2-CD2 3.32Å; E2-R18 IonicContact OE1-NH2 3.76Å; E2-R18 IonicContact OE2-CZ 3.54Å; E2-R18 IonicContact OE2-NE 3.4Å; E2-R18 PolarHBondContact OE2-NE 3.26Å; E2-R18 IonicContact OE2-NH2 2.84Å; E2-R18 PolarHBondContact OE2-NH2 3.36Å; E2-V19 CarbonylContact C-O 3.58Å; E2-V19 WeakPolarHBondContact CA-O 3.37Å |
| 3 | L | 97.3 | Very high | 94.6 | Very high | 41 Ų | 41 | 93.5 Ų | 93.5 | 22% | 0.215 | 49% | 0.485 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 136 | 166.7 | -69.6 | 168.2 | 0 | 0 | 0 | 109 | R18 V19 C21 L33 G36 V37 M40 | L3-R18 WeakPolarHBondContact O-CA 3.36Å; L3-V19 HydrophobicContact CB-CB 4.39Å; L3-V19 PolarHBondContact N-O 2.94Å; L3-V19 PolarHBondContact O-N 3.29Å; L3-C21 VanDerWaalsContact CD1-SG 3.55Å; L3-C21 WeakPolarHBondContact CG-SG 3.47Å; L3-L33 HydrophobicContact CD1-CD1 4.32Å; L3-L33 HydrophobicContact CD2-CD1 4.22Å; L3-L33 HydrophobicContact CG-CD1 4.44Å; L3-G36 VanDerWaalsContact CD1-C 3.46Å; L3-V37 HydrophobicContact CD1-CG2 3.85Å; L3-M40 HydrophobicContact CB-CE 3.69Å; L3-M40 HydrophobicContact CD1-CB 4.46Å; L3-M40 WeakPolarHBondContact O-CE 3.36Å |
| 4 | L | 98 | Very high | 94.8 | Very high | 110 Ų | 110 | 92.4 Ų | 92.4 | 58% | 0.576 | 49% | 0.486 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 136.9 | -178 | -65.6 | 171.9 | 0 | 0 | 0 | 109.2 | E2 L17 R18 | E2-L4 HydrophobicContact CG-CD1 4.34Å; E2-L4 HydrophobicContact CG-CD2 4.45Å; E2-L4 HydrophobicContact CG-CG 4.12Å; E2-L4 VanDerWaalsContact OE2-CD2 3.24Å; E2-L4 WeakPolarHBondContact OE2-CD2 3.32Å; L4-L17 WeakPolarHBondContact CA-O 3.23Å; L4-R18 HydrophobicContact CD2-CB 4.05Å; L4-R18 HydrophobicContact CD2-CG 3.58Å |
| 5 | G | 97.6 | Very high | 94.9 | Very high | 27 Ų | 27 | 91.2 Ų | 91.2 | 28% | 0.278 | 48% | 0.477 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.6 | 145.1 | 168.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | K16 L17 | G5-K16 CarbonylContact O-C 3.47Å; G5-K16 WeakPolarHBondContact O-CA 3.34Å; G5-L17 PolarHBondContact N-O 3.03Å; G5-L17 PolarHBondContact O-N 3.45Å |
| 6 | E | 98.1 | Very high | 95.1 | Very high | 120 Ų | 120 | 94.6 Ų | 94.6 | 56% | 0.561 | 49% | 0.487 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -134 | 127.3 | 171.6 | -173.5 | 172.5 | 82.1 | 0 | 0 | 108.9 | V8 P14 Q15 K16 | E6-V8 HydrophobicContact CG-CG2 4.24Å; E6-P14 HydrophobicContact CG-CB 4.14Å; E6-Q15 WeakPolarHBondContact CA-O 3.31Å; E6-K16 HydrophobicContact CG-CG 4.32Å; E6-K16 WeakPolarHBondContact OE2-CE 3.39Å; E6-K16 IonicContact OE2-NZ 3.91Å |
| 7 | Y | 97.3 | Very high | 95.2 | Very high | 62 Ų | 62 | 90.8 Ų | 90.8 | 24% | 0.243 | 47% | 0.467 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 130 | 172.1 | 171.1 | -112.2 | 0 | 0 | 0 | 109.2 | G9 P14 Q15 L47 F48 L51 | Y7-G9 WeakPolarHBondContact OH-CA 3.34Å; Y7-P14 CarbonylContact O-C 3.58Å; Y7-P14 WeakPolarHBondContact O-CA 3.38Å; Y7-Q15 PolarHBondContact N-O 2.74Å; Y7-Q15 PolarHBondContact O-N 3.37Å; Y7-L47 HydrophobicContact CD1-CD2 4.28Å; Y7-L47 HydrophobicContact CG-CD2 4.19Å; Y7-F48 AromaticContact CD2-CE1 3.95Å; Y7-F48 HydrophobicContact CD2-CE1 3.95Å; Y7-F48 AromaticContact CD2-CZ 3.59Å; Y7-F48 HydrophobicContact CD2-CZ 3.59Å; Y7-F48 AromaticContact CE2-CE1 3.7Å; Y7-F48 HydrophobicContact CE2-CE1 3.7Å; Y7-F48 AromaticContact CE2-CZ 3.84Å; Y7-F48 HydrophobicContact CE2-CZ 3.84Å; Y7-F48 HydrophobicContact CG-CZ 4.1Å; Y7-L51 HydrophobicContact CE1-CD1 3.92Å |
| 8 | V | 96.7 | Very high | 95.4 | Very high | 80 Ų | 80 | 94.7 Ų | 94.7 | 49% | 0.485 | 48% | 0.475 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 103.7 | 173.6 | -172.2 | 0 | 0 | 0 | 0 | 107.4 | E6 P14 | E6-V8 HydrophobicContact CG-CG2 4.24Å; V8-P14 HydrophobicContact CG2-CB 4.16Å |
| 9 | G | 92.6 | Very high | 95.5 | Very high | 12 Ų | 12 | 90.1 Ų | 90.1 | 12% | 0.124 | 45% | 0.453 | C | S | . | . | trans | -76.6 | -177.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y7 E11 G12 | Y7-G9 WeakPolarHBondContact OH-CA 3.34Å; G9-E11 PolarHBondContact O-N 2.93Å; G9-E11 VanDerWaalsContact O-N 3.12Å; G9-G12 PolarHBondContact O-N 3.03Å | ||
| 10 | Q | 90.4 | Very high | 95.5 | Very high | 211 Ų | 211 | 88.9 Ų | 88.9 | 99% | 0.986 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | -26 | 177.5 | -63.3 | -179.2 | 6.7 | 0 | 0 | 113.1 | G12 | Q10-G12 PolarHBondContact O-N 3.02Š|
| 11 | E | 91.8 | Very high | 95.4 | Very high | 117 Ų | 117 | 84.9 Ų | 84.9 | 55% | 0.547 | 43% | 0.433 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71 | -9.5 | 175 | 70.5 | -144.2 | 146.7 | 0 | 0 | 114 | G9 K13 | G9-E11 PolarHBondContact O-N 2.93Å; G9-E11 VanDerWaalsContact O-N 3.12Å; E11-K13 HydrophobicContact CG-CB 4.03Å; E11-K13 HydrophobicContact CG-CG 4.29Å; E11-K13 PolarHBondContact O-N 3.39Å; E11-K13 VanDerWaalsContact O-N 3.17Å |
| 12 | G | 93.4 | Very high | 95.5 | Very high | 48 Ų | 48 | 85.4 Ų | 85.4 | 50% | 0.495 | 43% | 0.434 | S | S | . | . | trans | 71.2 | 2.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | G9 Q10 | G9-G12 PolarHBondContact O-N 3.03Å; Q10-G12 PolarHBondContact O-N 3.02Å | ||
| 13 | K | 95.6 | Very high | 95 | Very high | 148 Ų | 148 | 81.7 Ų | 81.7 | 64% | 0.643 | 42% | 0.421 | S | S | * | . | trans | -84.1 | 122.8 | 177.5 | -64.9 | -178.8 | -178.8 | 173.7 | 0 | 110.3 | E11 | E11-K13 HydrophobicContact CG-CB 4.03Å; E11-K13 HydrophobicContact CG-CG 4.29Å; E11-K13 PolarHBondContact O-N 3.39Å; E11-K13 VanDerWaalsContact O-N 3.17Å | ||
| 14 | P | 96.5 | Very high | 94 | Very high | 77 Ų | 77 | 85.5 Ų | 85.5 | 50% | 0.5 | 45% | 0.447 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.9 | 133.2 | 178.6 | 29.3 | -32.9 | 0 | 0 | 0 | 111.4 | E6 Y7 V8 | E6-P14 HydrophobicContact CG-CB 4.14Å; Y7-P14 CarbonylContact O-C 3.58Å; Y7-P14 WeakPolarHBondContact O-CA 3.38Å; V8-P14 HydrophobicContact CG2-CB 4.16Å |
| 15 | Q | 96.8 | Very high | 93.2 | Very high | 75 Ų | 75 | 83.7 Ų | 83.7 | 35% | 0.35 | 46% | 0.456 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.1 | 119.3 | 172.7 | -59.7 | -172.4 | 57 | 0 | 0 | 108.8 | E6 Y7 L47 | E6-Q15 WeakPolarHBondContact CA-O 3.31Å; Y7-Q15 PolarHBondContact N-O 2.74Å; Y7-Q15 PolarHBondContact O-N 3.37Å; Q15-L47 HydrophobicContact CB-CD1 4.41Å |
| 16 | K | 97.7 | Very high | 92.3 | Very high | 146 Ų | 146 | 91.2 Ų | 91.2 | 64% | 0.635 | 49% | 0.489 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 132.1 | -173.6 | -65.8 | -178.5 | 176.5 | 179.7 | 0 | 111.2 | G5 E6 | G5-K16 CarbonylContact O-C 3.47Å; G5-K16 WeakPolarHBondContact O-CA 3.34Å; E6-K16 HydrophobicContact CG-CG 4.32Å; E6-K16 WeakPolarHBondContact OE2-CE 3.39Å; E6-K16 IonicContact OE2-NZ 3.91Å |
| 17 | L | 98.1 | Very high | 91.2 | Very high | 29 Ų | 29 | 87 Ų | 87 | 15% | 0.152 | 48% | 0.479 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 136.9 | 170.3 | -55.8 | -178.5 | 0 | 0 | 0 | 108.8 | L4 G5 M40 L43 V44 L47 | L4-L17 WeakPolarHBondContact CA-O 3.23Å; G5-L17 PolarHBondContact N-O 3.03Å; G5-L17 PolarHBondContact O-N 3.45Å; L17-M40 HydrophobicContact CB-CE 4.25Å; L17-M40 HydrophobicContact CB-SD 3.72Å; L17-M40 HydrophobicContact CD1-SD 4.11Å; L17-L43 HydrophobicContact CD1-CB 4.06Å; L17-L43 HydrophobicContact CD2-CB 4.19Å; L17-V44 HydrophobicContact CD1-CG2 3.7Å; L17-L47 HydrophobicContact CD1-CD2 4.15Å |
| 18 | R | 97.9 | Very high | 90.8 | Very high | 161 Ų | 161 | 87.7 Ų | 87.7 | 61% | 0.608 | 49% | 0.487 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -140.7 | 133.5 | 179.7 | -49.4 | -173.3 | 78.7 | 166.1 | 3.7 | 109.5 | E2 L3 L4 | E2-R18 IonicContact OE1-NH2 3.76Å; E2-R18 IonicContact OE2-CZ 3.54Å; E2-R18 IonicContact OE2-NE 3.4Å; E2-R18 PolarHBondContact OE2-NE 3.26Å; E2-R18 IonicContact OE2-NH2 2.84Å; E2-R18 PolarHBondContact OE2-NH2 3.36Å; L3-R18 WeakPolarHBondContact O-CA 3.36Å; L4-R18 HydrophobicContact CD2-CB 4.05Å; L4-R18 HydrophobicContact CD2-CG 3.58Å |
| 19 | V | 97.9 | Very high | 90.3 | Very high | 8 Ų | 8 | 88.5 Ų | 88.5 | 5% | 0.048 | 49% | 0.493 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.5 | 125.8 | 177.3 | 179.3 | 0 | 0 | 0 | 0 | 109.6 | E2 L3 Q39 M40 L43 | E2-V19 CarbonylContact C-O 3.58Å; E2-V19 WeakPolarHBondContact CA-O 3.37Å; L3-V19 HydrophobicContact CB-CB 4.39Å; L3-V19 PolarHBondContact N-O 2.94Å; L3-V19 PolarHBondContact O-N 3.29Å; V19-Q39 HydrophobicContact CG1-CB 3.96Å; V19-Q39 HydrophobicContact CG2-CB 4.32Å; V19-M40 HydrophobicContact CB-CE 4.22Å; V19-M40 HydrophobicContact CG2-CB 4.16Å; V19-M40 HydrophobicContact CG2-CE 3.8Å; V19-M40 HydrophobicContact CG2-SD 4.29Å; V19-L43 HydrophobicContact CG2-CD1 3.55Å |
| 20 | S | 94.9 | Very high | 90.2 | Very high | 66 Ų | 66 | 94.6 Ų | 94.6 | 46% | 0.462 | 52% | 0.517 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.9 | 131.8 | 169.2 | -173.7 | 0 | 0 | 0 | 0 | 109.5 | E22 | S20-E22 WeakPolarHBondContact OG-CG 3.44Å; S20-E22 PolarHBondContact OG-N 3.38Å |
| 21 | C | 93.9 | Very high | 90.3 | Very high | 5 Ų | 5 | 90.1 Ų | 90.1 | 3% | 0.034 | 50% | 0.496 | C | S | . | . | trans | -106.3 | 27.8 | 176.3 | -59.5 | 0 | 0 | 0 | 0 | 111.1 | M1 L3 A23 G32 | M1-C21 HydrophobicContact CB-CB 4.17Å; M1-C21 HydrophobicContact CG-CB 4.34Å; M1-C21 PolarHBondContact O-N 3.15Å; L3-C21 VanDerWaalsContact CD1-SG 3.55Å; L3-C21 WeakPolarHBondContact CG-SG 3.47Å; C21-A23 PolarHBondContact O-N 2.89Å; C21-G32 CarbonylContact O-C 3.59Å; C21-G32 WeakPolarHBondContact O-CA 3.29Å | ||
| 22 | E | 89.5 | Confident | 90.4 | Very high | 150 Ų | 150 | 84.8 Ų | 84.8 | 70% | 0.701 | 47% | 0.472 | S | S | * | . | P | Polyproline II helix | trans | -66.2 | 122 | 178 | -76.5 | 173.5 | 176.2 | 0 | 0 | 110.3 | S20 | S20-E22 WeakPolarHBondContact OG-CG 3.44Å; S20-E22 PolarHBondContact OG-N 3.38Å |
| 23 | A | 82.8 | Confident | 90.5 | Very high | 23 Ų | 23 | 84.7 Ų | 84.7 | 19% | 0.19 | 46% | 0.46 | C | S | . | . | P | Polyproline II helix | trans | -73.7 | 142.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | C21 G25 | C21-A23 PolarHBondContact O-N 2.89Å; A23-G25 PolarHBondContact O-N 3.27Å |
| 24 | P | 76.9 | Confident | 90.5 | Very high | 120 Ų | 120 | 82.9 Ų | 82.9 | 78% | 0.779 | 46% | 0.457 | S | S | * | . | S | Bend | trans | -67.1 | 122.5 | 175.8 | 25 | -31.2 | 0 | 0 | 0 | 110.7 | G27 | P24-G27 PolarHBondContact O-N 3.43Š|
| 25 | G | 81.4 | Confident | 90.4 | Very high | 73 Ų | 73 | 82.3 Ų | 82.3 | 75% | 0.753 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.1 | -142.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | A23 G27 | A23-G25 PolarHBondContact O-N 3.27Å; G25-G27 PolarHBondContact O-N 3.42Å; G25-G27 VanDerWaalsContact O-N 3.15Å |
| 26 | D | 78 | Confident | 90.4 | Very high | 184 Ų | 184 | 78.7 Ų | 78.7 | 98% | 0.984 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.3 | 27.6 | 172.6 | -74.4 | -32.5 | 0 | 0 | 0 | 112.6 | ||
| 27 | G | 76.3 | Confident | 90.4 | Very high | 33 Ų | 33 | 75.5 Ų | 75.5 | 34% | 0.34 | 43% | 0.43 | S | S | . | . | trans | -64.6 | 160.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | P24 G25 P29 | P24-G27 PolarHBondContact O-N 3.43Å; G25-G27 PolarHBondContact O-N 3.42Å; G25-G27 VanDerWaalsContact O-N 3.15Å; G27-P29 WeakPolarHBondContact O-CD 3.45Å | ||
| 28 | D | 87.4 | Confident | 90.4 | Very high | 76 Ų | 76 | 76.7 Ų | 76.7 | 41% | 0.406 | 44% | 0.444 | S | S | . | . | trans | -56 | 120.8 | 176.7 | 170.8 | 29.5 | 0 | 0 | 0 | 111.1 | F30 Q31 | D28-F30 PolarHBondContact O-N 2.94Å; D28-F30 VanDerWaalsContact O-N 3.11Å; D28-F30 WeakPolarHBondContact OD1-CD2 3.45Å; D28-F30 PolarHBondContact OD1-N 3.09Å; D28-F30 VanDerWaalsContact OD1-N 3.14Å; D28-Q31 HydrophobicContact CB-CB 4.49Å; D28-Q31 HydrophobicContact CB-CG 3.95Å; D28-Q31 WeakPolarHBondContact O-CB 3.19Å; D28-Q31 PolarHBondContact O-N 3Å | ||
| 29 | P | 86.6 | Confident | 90.4 | Very high | 96 Ų | 96 | 73.1 Ų | 73.1 | 62% | 0.623 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -55.5 | -30 | 178.9 | -26.9 | 35 | 0 | 0 | 0 | 113.7 | G27 Q31 G32 L33 | G27-P29 WeakPolarHBondContact O-CD 3.45Å; P29-Q31 VanDerWaalsContact C-N 3.35Å; P29-G32 PolarHBondContact O-N 3.29Å; P29-L33 PolarHBondContact O-N 2.96Å; P29-L33 VanDerWaalsContact O-N 3.15Å |
| 30 | F | 91.3 | Very high | 90.4 | Very high | 141 Ų | 141 | 74 Ų | 74 | 62% | 0.618 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -72.3 | -27.4 | 178.6 | -64.8 | -66.5 | 0 | 0 | 0 | 113 | D28 L33 L34 | D28-F30 PolarHBondContact O-N 2.94Å; D28-F30 VanDerWaalsContact O-N 3.11Å; D28-F30 WeakPolarHBondContact OD1-CD2 3.45Å; D28-F30 PolarHBondContact OD1-N 3.09Å; D28-F30 VanDerWaalsContact OD1-N 3.14Å; F30-L33 HydrophobicContact CD1-CD2 4.48Å; F30-L33 PolarHBondContact O-N 3.28Å; F30-L34 WeakPolarHBondContact O-CB 3.38Å; F30-L34 VanDerWaalsContact O-CG 3.29Å; F30-L34 WeakPolarHBondContact O-CG 3.5Å; F30-L34 PolarHBondContact O-N 3.31Å |
| 31 | Q | 92.5 | Very high | 90.6 | Very high | 116 Ų | 116 | 78.1 Ų | 78.1 | 54% | 0.542 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -65.6 | -43.2 | 172.5 | -68 | -60.3 | -54.5 | 0 | 0 | 111.5 | D28 P29 L33 L34 S35 | D28-Q31 HydrophobicContact CB-CB 4.49Å; D28-Q31 HydrophobicContact CB-CG 3.95Å; D28-Q31 WeakPolarHBondContact O-CB 3.19Å; D28-Q31 PolarHBondContact O-N 3Å; P29-Q31 VanDerWaalsContact C-N 3.35Å; Q31-L33 VanDerWaalsContact C-N 3.3Å; Q31-L33 PolarHBondContact O-N 3.44Å; Q31-L34 PolarHBondContact O-N 2.91Å; Q31-S35 PolarHBondContact O-N 3.48Å |
| 32 | G | 92.9 | Very high | 90.8 | Very high | 5 Ų | 5 | 83.7 Ų | 83.7 | 5% | 0.052 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -60 | -41.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | C21 P29 G36 | C21-G32 CarbonylContact O-C 3.59Å; C21-G32 WeakPolarHBondContact O-CA 3.29Å; P29-G32 PolarHBondContact O-N 3.29Å; G32-G36 PolarHBondContact O-N 3.31Å |
| 33 | L | 95.2 | Very high | 91.2 | Very high | 46 Ų | 46 | 79.2 Ų | 79.2 | 24% | 0.241 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -65.4 | -46.2 | 175.7 | -178 | 59.7 | 0 | 0 | 0 | 112.9 | M1 L3 P29 F30 Q31 S35 G36 V37 | M1-L33 HydrophobicContact CE-CD1 3.73Å; M1-L33 HydrophobicContact CE-CD2 4.43Å; M1-L33 HydrophobicContact SD-CD1 4.25Å; L3-L33 HydrophobicContact CD1-CD1 4.32Å; L3-L33 HydrophobicContact CD2-CD1 4.22Å; L3-L33 HydrophobicContact CG-CD1 4.44Å; P29-L33 PolarHBondContact O-N 2.96Å; P29-L33 VanDerWaalsContact O-N 3.15Å; F30-L33 HydrophobicContact CD1-CD2 4.48Å; F30-L33 PolarHBondContact O-N 3.28Å; Q31-L33 VanDerWaalsContact C-N 3.3Å; Q31-L33 PolarHBondContact O-N 3.44Å; L33-S35 VanDerWaalsContact C-N 3.33Å; L33-S35 PolarHBondContact O-N 3.4Å; L33-G36 PolarHBondContact O-N 3.49Å; L33-G36 VanDerWaalsContact O-N 3.16Å; L33-V37 HydrophobicContact CD1-CG2 4.18Å; L33-V37 HydrophobicContact CG-CG2 4.44Å; L33-V37 WeakPolarHBondContact O-CG2 3.42Å; L33-V37 PolarHBondContact O-N 3.29Å |
| 34 | L | 95.6 | Very high | 91.9 | Very high | 111 Ų | 111 | 80.8 Ų | 80.8 | 58% | 0.581 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -59.7 | -44.9 | 178.7 | -74.9 | 169.2 | 0 | 0 | 0 | 111.5 | F30 Q31 G36 V37 A38 | F30-L34 WeakPolarHBondContact O-CB 3.38Å; F30-L34 VanDerWaalsContact O-CG 3.29Å; F30-L34 WeakPolarHBondContact O-CG 3.5Å; F30-L34 PolarHBondContact O-N 3.31Å; Q31-L34 PolarHBondContact O-N 2.91Å; L34-G36 VanDerWaalsContact C-N 3.34Å; L34-V37 PolarHBondContact O-N 2.9Å; L34-A38 PolarHBondContact O-N 3.02Å |
| 35 | S | 94.8 | Very high | 92.9 | Very high | 64 Ų | 64 | 79.2 Ų | 79.2 | 45% | 0.448 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 174.3 | -179.1 | 0 | 0 | 0 | 0 | 111.7 | Q31 L33 V37 A38 Q39 | Q31-S35 PolarHBondContact O-N 3.48Å; L33-S35 VanDerWaalsContact C-N 3.33Å; L33-S35 PolarHBondContact O-N 3.4Å; S35-V37 PolarHBondContact O-N 3.49Å; S35-A38 PolarHBondContact O-N 3.11Å; S35-Q39 WeakPolarHBondContact O-CG 3.44Å; S35-Q39 PolarHBondContact O-N 3.34Å; S35-Q39 PolarHBondContact O-NE2 3.15Å; S35-Q39 PolarHBondContact OG-NE2 2.96Å |
| 36 | G | 96.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 82.4 Ų | 82.4 | 0% | 0 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -63.8 | -39.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | L3 G32 L33 L34 Q39 M40 | L3-G36 VanDerWaalsContact CD1-C 3.46Å; G32-G36 PolarHBondContact O-N 3.31Å; L33-G36 PolarHBondContact O-N 3.49Å; L33-G36 VanDerWaalsContact O-N 3.16Å; L34-G36 VanDerWaalsContact C-N 3.34Å; G36-Q39 PolarHBondContact O-N 2.99Å; G36-M40 WeakPolarHBondContact O-CB 3.48Å; G36-M40 PolarHBondContact O-N 3.19Å |
| 37 | V | 97.8 | Very high | 94.5 | Very high | 79 Ų | 79 | 75 Ų | 75 | 48% | 0.479 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66.2 | -41.3 | 176.5 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | L3 L33 L34 S35 M40 K41 | L3-V37 HydrophobicContact CD1-CG2 3.85Å; L33-V37 HydrophobicContact CD1-CG2 4.18Å; L33-V37 HydrophobicContact CG-CG2 4.44Å; L33-V37 WeakPolarHBondContact O-CG2 3.42Å; L33-V37 PolarHBondContact O-N 3.29Å; L34-V37 PolarHBondContact O-N 2.9Å; S35-V37 PolarHBondContact O-N 3.49Å; V37-M40 PolarHBondContact O-N 3.48Å; V37-K41 PolarHBondContact O-N 3.43Å |
| 38 | A | 97.9 | Very high | 95.4 | Very high | 53 Ų | 53 | 77 Ų | 77 | 44% | 0.438 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -59.9 | -47.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L34 S35 K41 E42 | L34-A38 PolarHBondContact O-N 3.02Å; S35-A38 PolarHBondContact O-N 3.11Å; A38-K41 WeakPolarHBondContact O-CB 3.48Å; A38-K41 PolarHBondContact O-N 3.45Å; A38-E42 PolarHBondContact O-N 2.99Å |
| 39 | Q | 98 | Very high | 95.7 | Very high | 87 Ų | 87 | 74.7 Ų | 74.7 | 41% | 0.407 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.3 | -41.8 | 176.3 | -72.9 | 173.1 | 74.7 | 0 | 0 | 112.6 | V19 S35 G36 K41 E42 L43 | V19-Q39 HydrophobicContact CG1-CB 3.96Å; V19-Q39 HydrophobicContact CG2-CB 4.32Å; S35-Q39 WeakPolarHBondContact O-CG 3.44Å; S35-Q39 PolarHBondContact O-N 3.34Å; S35-Q39 PolarHBondContact O-NE2 3.15Å; S35-Q39 PolarHBondContact OG-NE2 2.96Å; G36-Q39 PolarHBondContact O-N 2.99Å; Q39-K41 VanDerWaalsContact C-N 3.28Å; Q39-K41 PolarHBondContact O-N 3.16Å; Q39-E42 WeakPolarHBondContact O-CB 3.27Å; Q39-E42 PolarHBondContact O-N 3.06Å; Q39-E42 VanDerWaalsContact O-N 3.17Å; Q39-L43 PolarHBondContact O-N 2.94Å |
| 40 | M | 98.3 | Very high | 96 | Very high | 26 Ų | 26 | 74.2 Ų | 74.2 | 13% | 0.128 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -62 | -38.3 | 177.8 | -175.3 | 62.3 | 78.9 | 0 | 0 | 111.4 | L3 L17 V19 G36 V37 E42 L43 V44 | L3-M40 HydrophobicContact CB-CE 3.69Å; L3-M40 HydrophobicContact CD1-CB 4.46Å; L3-M40 WeakPolarHBondContact O-CE 3.36Å; L17-M40 HydrophobicContact CB-CE 4.25Å; L17-M40 HydrophobicContact CB-SD 3.72Å; L17-M40 HydrophobicContact CD1-SD 4.11Å; V19-M40 HydrophobicContact CB-CE 4.22Å; V19-M40 HydrophobicContact CG2-CB 4.16Å; V19-M40 HydrophobicContact CG2-CE 3.8Å; V19-M40 HydrophobicContact CG2-SD 4.29Å; G36-M40 WeakPolarHBondContact O-CB 3.48Å; G36-M40 PolarHBondContact O-N 3.19Å; V37-M40 PolarHBondContact O-N 3.48Å; M40-E42 VanDerWaalsContact C-N 3.31Å; M40-E42 PolarHBondContact O-N 2.75Å; M40-L43 PolarHBondContact O-N 3.33Å; M40-V44 HydrophobicContact CG-CG2 4.45Å; M40-V44 WeakPolarHBondContact O-CB 3.39Å; M40-V44 VanDerWaalsContact O-CG2 3.27Å; M40-V44 WeakPolarHBondContact O-CG2 3.31Å; M40-V44 PolarHBondContact O-N 3.43Å; M40-V44 HydrophobicContact SD-CG2 4.49Å |
| 41 | K | 98.4 | Very high | 95.9 | Very high | 152 Ų | 152 | 70.8 Ų | 70.8 | 66% | 0.661 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -61.1 | -40.5 | 175.3 | -176.7 | -173.4 | 132 | -174.5 | 0 | 111.9 | V37 A38 Q39 T45 | V37-K41 PolarHBondContact O-N 3.43Å; A38-K41 WeakPolarHBondContact O-CB 3.48Å; A38-K41 PolarHBondContact O-N 3.45Å; Q39-K41 VanDerWaalsContact C-N 3.28Å; Q39-K41 PolarHBondContact O-N 3.16Å; K41-T45 WeakPolarHBondContact O-CB 3.45Å; K41-T45 PolarHBondContact O-N 2.89Å; K41-T45 PolarHBondContact O-OG1 3.5Å |
| 42 | E | 98.4 | Very high | 95.7 | Very high | 123 Ų | 123 | 69.1 Ų | 69.1 | 58% | 0.575 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63.4 | -49.6 | 175.8 | -68.6 | 174.6 | -178.8 | 0 | 0 | 110.9 | A38 Q39 M40 V44 T45 E46 | A38-E42 PolarHBondContact O-N 2.99Å; Q39-E42 WeakPolarHBondContact O-CB 3.27Å; Q39-E42 PolarHBondContact O-N 3.06Å; Q39-E42 VanDerWaalsContact O-N 3.17Å; M40-E42 VanDerWaalsContact C-N 3.31Å; M40-E42 PolarHBondContact O-N 2.75Å; E42-V44 VanDerWaalsContact C-N 3.3Å; E42-V44 PolarHBondContact O-N 2.96Å; E42-T45 CarbonylContact O-C 3.58Å; E42-T45 WeakPolarHBondContact O-CA 3.44Å; E42-T45 WeakPolarHBondContact O-CB 3.29Å; E42-T45 PolarHBondContact O-N 3.47Å; E42-E46 WeakPolarHBondContact O-CG 3.49Å; E42-E46 PolarHBondContact O-N 2.85Å |
| 43 | L | 98.1 | Very high | 95.4 | Very high | 55 Ų | 55 | 74.9 Ų | 74.9 | 29% | 0.288 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -58.4 | -40.4 | 177.4 | -68.5 | 177 | 0 | 0 | 0 | 112.9 | L17 V19 Q39 M40 T45 E46 L47 | L17-L43 HydrophobicContact CD1-CB 4.06Å; L17-L43 HydrophobicContact CD2-CB 4.19Å; V19-L43 HydrophobicContact CG2-CD1 3.55Å; Q39-L43 PolarHBondContact O-N 2.94Å; M40-L43 PolarHBondContact O-N 3.33Å; L43-T45 VanDerWaalsContact C-N 3.35Å; L43-E46 PolarHBondContact O-N 2.99Å; L43-L47 VanDerWaalsContact O-CB 3.31Å; L43-L47 WeakPolarHBondContact O-CB 3.4Å; L43-L47 PolarHBondContact O-N 2.9Å |
| 44 | V | 97.6 | Very high | 95 | Very high | 57 Ų | 57 | 75.4 Ų | 75.4 | 35% | 0.345 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -64.4 | -42.5 | 174.5 | 169.9 | 0 | 0 | 0 | 0 | 110.4 | L17 M40 E42 E46 L47 F48 | L17-V44 HydrophobicContact CD1-CG2 3.7Å; M40-V44 HydrophobicContact CG-CG2 4.45Å; M40-V44 WeakPolarHBondContact O-CB 3.39Å; M40-V44 VanDerWaalsContact O-CG2 3.27Å; M40-V44 WeakPolarHBondContact O-CG2 3.31Å; M40-V44 PolarHBondContact O-N 3.43Å; M40-V44 HydrophobicContact SD-CG2 4.49Å; E42-V44 VanDerWaalsContact C-N 3.3Å; E42-V44 PolarHBondContact O-N 2.96Å; V44-E46 PolarHBondContact O-N 3.04Å; V44-L47 PolarHBondContact O-N 3.12Å; V44-F48 HydrophobicContact CG1-CD2 3.82Å; V44-F48 HydrophobicContact CG1-CE2 4.07Å; V44-F48 VanDerWaalsContact O-CD2 3.29Å; V44-F48 WeakPolarHBondContact O-CD2 3.37Å; V44-F48 PolarHBondContact O-N 3.31Å |
| 45 | T | 97.4 | Very high | 94.5 | Very high | 87 Ų | 87 | 77.1 Ų | 77.1 | 53% | 0.534 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 178.3 | -55.5 | 0 | 0 | 0 | 0 | 111.3 | K41 E42 L43 G49 | K41-T45 WeakPolarHBondContact O-CB 3.45Å; K41-T45 PolarHBondContact O-N 2.89Å; K41-T45 PolarHBondContact O-OG1 3.5Å; E42-T45 CarbonylContact O-C 3.58Å; E42-T45 WeakPolarHBondContact O-CA 3.44Å; E42-T45 WeakPolarHBondContact O-CB 3.29Å; E42-T45 PolarHBondContact O-N 3.47Å; L43-T45 VanDerWaalsContact C-N 3.35Å; T45-G49 WeakPolarHBondContact O-CA 3.38Å; T45-G49 PolarHBondContact O-N 2.85Å |
| 46 | E | 96.9 | Very high | 93.9 | Very high | 140 Ų | 140 | 78.1 Ų | 78.1 | 65% | 0.654 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -64.5 | -41.1 | 175.6 | -71.1 | -177.9 | 165.2 | 0 | 0 | 112.1 | E42 L43 V44 P50 | E42-E46 WeakPolarHBondContact O-CG 3.49Å; E42-E46 PolarHBondContact O-N 2.85Å; L43-E46 PolarHBondContact O-N 2.99Å; V44-E46 PolarHBondContact O-N 3.04Å; E46-P50 WeakPolarHBondContact O-CD 3.46Å |
| 47 | L | 95.8 | Very high | 93 | Very high | 29 Ų | 29 | 84.2 Ų | 84.2 | 15% | 0.152 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -62 | -45.3 | 178 | 177.5 | 64.6 | 0 | 0 | 0 | 111.9 | Y7 Q15 L17 L43 V44 | Y7-L47 HydrophobicContact CD1-CD2 4.28Å; Y7-L47 HydrophobicContact CG-CD2 4.19Å; Q15-L47 HydrophobicContact CB-CD1 4.41Å; L17-L47 HydrophobicContact CD1-CD2 4.15Å; L43-L47 VanDerWaalsContact O-CB 3.31Å; L43-L47 WeakPolarHBondContact O-CB 3.4Å; L43-L47 PolarHBondContact O-N 2.9Å; V44-L47 PolarHBondContact O-N 3.12Å |
| 48 | F | 95.6 | Very high | 92.1 | Very high | 75 Ų | 75 | 87.1 Ų | 87.1 | 33% | 0.329 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -89.2 | -17.4 | -176.1 | -73.9 | -74.9 | 0 | 0 | 0 | 114.1 | Y7 V44 L51 V52 | Y7-F48 AromaticContact CD2-CE1 3.95Å; Y7-F48 HydrophobicContact CD2-CE1 3.95Å; Y7-F48 AromaticContact CD2-CZ 3.59Å; Y7-F48 HydrophobicContact CD2-CZ 3.59Å; Y7-F48 AromaticContact CE2-CE1 3.7Å; Y7-F48 HydrophobicContact CE2-CE1 3.7Å; Y7-F48 AromaticContact CE2-CZ 3.84Å; Y7-F48 HydrophobicContact CE2-CZ 3.84Å; Y7-F48 HydrophobicContact CG-CZ 4.1Å; V44-F48 HydrophobicContact CG1-CD2 3.82Å; V44-F48 HydrophobicContact CG1-CE2 4.07Å; V44-F48 VanDerWaalsContact O-CD2 3.29Å; V44-F48 WeakPolarHBondContact O-CD2 3.37Å; V44-F48 PolarHBondContact O-N 3.31Å; F48-L51 HydrophobicContact CD1-CD1 3.8Å; F48-L51 HydrophobicContact CE1-CD1 4.13Å; F48-L51 PolarHBondContact O-N 3.17Å; F48-V52 HydrophobicContact CB-CG2 4.43Å; F48-V52 WeakPolarHBondContact O-CG2 3.45Å; F48-V52 PolarHBondContact O-N 3.07Å |
| 49 | G | 94.5 | Very high | 90.9 | Very high | 26 Ų | 26 | 94.4 Ų | 94.4 | 27% | 0.268 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -49.8 | -53.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | T45 Q53 | T45-G49 WeakPolarHBondContact O-CA 3.38Å; T45-G49 PolarHBondContact O-N 2.85Å; G49-Q53 WeakPolarHBondContact O-CG 3.41Å; G49-Q53 PolarHBondContact O-N 3.03Å |
| 50 | P | 92.3 | Very high | 89.7 | Confident | 87 Ų | 87 | 95.2 Ų | 95.2 | 57% | 0.565 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.8 | -37.3 | 176.3 | -23.1 | 34.4 | 0 | 0 | 0 | 113.7 | E46 Q53 A54 | E46-P50 WeakPolarHBondContact O-CD 3.46Å; P50-Q53 PolarHBondContact O-N 3.34Å; P50-A54 WeakPolarHBondContact O-CB 2.93Å; P50-A54 PolarHBondContact O-N 3.17Å |
| 51 | L | 89.5 | Confident | 88.4 | Confident | 68 Ų | 68 | 98.1 Ų | 98.1 | 36% | 0.356 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.6 | -44.3 | -178 | -61.9 | 176.5 | 0 | 0 | 0 | 111.3 | Y7 F48 A54 E55 | Y7-L51 HydrophobicContact CE1-CD1 3.92Å; F48-L51 HydrophobicContact CD1-CD1 3.8Å; F48-L51 HydrophobicContact CE1-CD1 4.13Å; F48-L51 PolarHBondContact O-N 3.17Å; L51-A54 PolarHBondContact O-N 3.44Å; L51-E55 PolarHBondContact O-N 3.37Å |
| 52 | V | 89.2 | Confident | 86.9 | Confident | 82 Ų | 82 | 94 Ų | 94 | 50% | 0.497 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.4 | -41.4 | 177.3 | 173.8 | 0 | 0 | 0 | 0 | 110.8 | F48 A54 E55 V56 | F48-V52 HydrophobicContact CB-CG2 4.43Å; F48-V52 WeakPolarHBondContact O-CG2 3.45Å; F48-V52 PolarHBondContact O-N 3.07Å; V52-A54 PolarHBondContact O-N 3.45Å; V52-E55 PolarHBondContact O-N 3.29Å; V52-V56 HydrophobicContact CG1-CG2 4.46Å; V52-V56 VanDerWaalsContact O-CG2 3.31Å; V52-V56 WeakPolarHBondContact O-CG2 3.4Å; V52-V56 PolarHBondContact O-N 3.26Å |
| 53 | Q | 86.7 | Confident | 85 | Confident | 126 Ų | 126 | 91.2 Ų | 91.2 | 59% | 0.589 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.7 | -42.1 | 175.9 | -73 | -179.2 | 22.4 | 0 | 0 | 112.2 | G49 P50 E55 V56 Q57 | G49-Q53 WeakPolarHBondContact O-CG 3.41Å; G49-Q53 PolarHBondContact O-N 3.03Å; P50-Q53 PolarHBondContact O-N 3.34Å; Q53-E55 VanDerWaalsContact C-N 3.34Å; Q53-V56 PolarHBondContact O-N 3.07Å; Q53-Q57 WeakPolarHBondContact O-CG 3.38Å; Q53-Q57 PolarHBondContact O-N 3.03Å |
| 54 | A | 85.9 | Confident | 83 | Confident | 57 Ų | 57 | 93.4 Ų | 93.4 | 47% | 0.471 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.6 | -41.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P50 L51 V52 Q57 H58 | P50-A54 WeakPolarHBondContact O-CB 2.93Å; P50-A54 PolarHBondContact O-N 3.17Å; L51-A54 PolarHBondContact O-N 3.44Å; V52-A54 PolarHBondContact O-N 3.45Å; A54-Q57 PolarHBondContact O-N 3.36Å; A54-H58 WeakPolarHBondContact O-CB 3.42Å; A54-H58 PolarHBondContact O-N 2.89Å |
| 55 | E | 84.3 | Confident | 81 | Confident | 146 Ų | 146 | 98.2 Ų | 98.2 | 68% | 0.682 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.3 | -43 | 177.9 | -171.1 | 171.7 | 157.3 | 0 | 0 | 112.4 | L51 V52 Q53 Q57 H58 R59 | L51-E55 PolarHBondContact O-N 3.37Å; V52-E55 PolarHBondContact O-N 3.29Å; Q53-E55 VanDerWaalsContact C-N 3.34Å; E55-Q57 PolarHBondContact O-N 3.31Å; E55-H58 PolarHBondContact O-N 2.87Å; E55-R59 PolarHBondContact O-N 3.19Å |
| 56 | V | 82.8 | Confident | 78.9 | Confident | 86 Ų | 86 | 101.1 Ų | 101.1 | 52% | 0.521 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60.6 | -46 | 175.2 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | V52 Q53 H58 R59 V60 | V52-V56 HydrophobicContact CG1-CG2 4.46Å; V52-V56 VanDerWaalsContact O-CG2 3.31Å; V52-V56 WeakPolarHBondContact O-CG2 3.4Å; V52-V56 PolarHBondContact O-N 3.26Å; Q53-V56 PolarHBondContact O-N 3.07Å; V56-H58 PolarHBondContact O-N 2.8Å; V56-R59 PolarHBondContact O-N 3.28Å; V56-V60 WeakPolarHBondContact O-CG2 3.24Å; V56-V60 PolarHBondContact O-N 2.88Å |
| 57 | Q | 77.4 | Confident | 76.9 | Confident | 128 Ų | 128 | 98.5 Ų | 98.5 | 60% | 0.598 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.2 | -41.5 | 177.2 | -72.8 | 176.1 | 30.6 | 0 | 0 | 112.1 | Q53 A54 E55 R59 V60 A61 | Q53-Q57 WeakPolarHBondContact O-CG 3.38Å; Q53-Q57 PolarHBondContact O-N 3.03Å; A54-Q57 PolarHBondContact O-N 3.36Å; E55-Q57 PolarHBondContact O-N 3.31Å; Q57-R59 VanDerWaalsContact C-N 3.31Å; Q57-R59 PolarHBondContact O-N 3.49Å; Q57-V60 PolarHBondContact O-N 3.44Å; Q57-A61 WeakPolarHBondContact O-CB 3.49Å; Q57-A61 PolarHBondContact O-N 2.94Å |
| 58 | H | 79.2 | Confident | 74.7 | Confident | 139 Ų | 139 | 103.8 Ų | 103.8 | 64% | 0.644 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -60.5 | -42.5 | 176.3 | -175.5 | 65.6 | 0 | 0 | 0 | 111.5 | A54 E55 V56 A61 A62 | A54-H58 WeakPolarHBondContact O-CB 3.42Å; A54-H58 PolarHBondContact O-N 2.89Å; E55-H58 PolarHBondContact O-N 2.87Å; V56-H58 PolarHBondContact O-N 2.8Å; H58-A61 PolarHBondContact O-N 3.36Å; H58-A62 VanDerWaalsContact O-CB 3.23Å; H58-A62 WeakPolarHBondContact O-CB 3.37Å; H58-A62 PolarHBondContact O-N 2.86Å |
| 59 | R | 73.4 | Confident | 72.7 | Confident | 206 Ų | 206 | 108.3 Ų | 108.3 | 78% | 0.777 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -65.4 | -40 | 177.1 | -166.6 | 178.6 | -171.8 | -175.3 | 1.8 | 112.7 | E55 V56 Q57 A62 A63 | E55-R59 PolarHBondContact O-N 3.19Å; V56-R59 PolarHBondContact O-N 3.28Å; Q57-R59 VanDerWaalsContact C-N 3.31Å; Q57-R59 PolarHBondContact O-N 3.49Å; R59-A62 PolarHBondContact O-N 3.36Å; R59-A63 PolarHBondContact O-N 3.34Å |
| 60 | V | 72.1 | Confident | 70.3 | Confident | 105 Ų | 105 | 110.3 Ų | 110.3 | 64% | 0.636 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -65.9 | -42.9 | 175.7 | 173.2 | 0 | 0 | 0 | 0 | 111 | V56 Q57 A62 A63 | V56-V60 WeakPolarHBondContact O-CG2 3.24Å; V56-V60 PolarHBondContact O-N 2.88Å; Q57-V60 PolarHBondContact O-N 3.44Å; V60-A62 VanDerWaalsContact C-N 3.29Å; V60-A62 PolarHBondContact O-N 3.05Å; V60-A63 PolarHBondContact O-N 3.37Å |
| 61 | A | 70.3 | Confident | 68.5 | Low | 86 Ų | 86 | 113.2 Ų | 113.2 | 71% | 0.711 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -70.3 | -24.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q57 H58 | Q57-A61 WeakPolarHBondContact O-CB 3.49Å; Q57-A61 PolarHBondContact O-N 2.94Å; H58-A61 PolarHBondContact O-N 3.36Å |
| 62 | A | 67.5 | Low | 66.7 | Low | 65 Ų | 65 | 116.7 Ų | 116.7 | 54% | 0.537 | 67% | 0.666 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.8 | -8.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | H58 R59 V60 P64 | H58-A62 VanDerWaalsContact O-CB 3.23Å; H58-A62 WeakPolarHBondContact O-CB 3.37Å; H58-A62 PolarHBondContact O-N 2.86Å; R59-A62 PolarHBondContact O-N 3.36Å; V60-A62 VanDerWaalsContact C-N 3.29Å; V60-A62 PolarHBondContact O-N 3.05Å; A62-P64 WeakPolarHBondContact O-CD 3.41Å |
| 63 | A | 58.3 | Low | 65.1 | Low | 65 Ų | 65 | 121 Ų | 121 | 54% | 0.537 | 68% | 0.68 | S | S | . | * | S | Bend | trans | -75 | 114.6 | 169.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | R59 V60 | R59-A63 PolarHBondContact O-N 3.34Å; V60-A63 PolarHBondContact O-N 3.37Å |
| 64 | P | 55.7 | Low | 63.8 | Low | 101 Ų | 101 | 122 Ų | 122 | 66% | 0.656 | 69% | 0.69 | S | S | * | * | trans | -62.7 | 143 | 165.1 | -0.2 | 16.4 | 0 | 0 | 0 | 107.4 | A62 E66 | A62-P64 WeakPolarHBondContact O-CD 3.41Å; P64-E66 PolarHBondContact O-N 3.16Å | ||
| 65 | D | 57 | Low | 62.5 | Low | 159 Ų | 159 | 126.1 Ų | 126.1 | 85% | 0.85 | 70% | 0.704 | S | S | * | * | trans | -61.7 | 77.1 | 169.4 | -163.5 | -2.1 | 0 | 0 | 0 | 109.1 | A67 | D65-A67 PolarHBondContact O-N 3.44Š| ||
| 66 | E | 52.7 | Low | 61.3 | Low | 148 Ų | 148 | 123.4 Ų | 123.4 | 69% | 0.692 | 71% | 0.706 | S | S | * | * | trans | -78.7 | 77.8 | 169.2 | -67.3 | -115.3 | 137.3 | 0 | 0 | 107.3 | P64 L68 | P64-E66 PolarHBondContact O-N 3.16Å; E66-L68 PolarHBondContact O-N 2.96Å | ||
| 67 | A | 54.1 | Low | 60.2 | Low | 84 Ų | 84 | 127.1 Ų | 127.1 | 69% | 0.694 | 72% | 0.718 | S | S | * | * | trans | -58.9 | 89.1 | 151.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | D65 | D65-A67 PolarHBondContact O-N 3.44Š| ||
| 68 | L | 49.9 | Very low | 59.5 | Low | 140 Ų | 140 | 128.5 Ų | 128.5 | 73% | 0.733 | 73% | 0.729 | S | S | * | * | trans | -128 | 90.4 | 163.1 | -63.8 | 178.5 | 0 | 0 | 0 | 109.3 | E66 | E66-L68 PolarHBondContact O-N 2.96Š| ||
| 69 | D | 53.2 | Low | 58.5 | Low | 171 Ų | 171 | 128.6 Ų | 128.6 | 91% | 0.914 | 73% | 0.73 | S | S | * | * | trans | -37.8 | 125.7 | 144.2 | -176.1 | 29.8 | 0 | 0 | 0 | 110.5 | ||||
| 70 | G | 45.4 | Very low | 57.8 | Low | 67 Ų | 67 | 125 Ų | 125 | 69% | 0.691 | 73% | 0.726 | S | S | * | * | trans | 167.1 | 66.4 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113 | D72 | G70-D72 PolarHBondContact O-N 2.8Š| ||
| 71 | D | 53 | Low | 57.1 | Low | 148 Ų | 148 | 126.2 Ų | 126.2 | 79% | 0.791 | 73% | 0.729 | S | S | * | * | trans | -37.3 | 119.6 | 153.2 | -175 | 38.5 | 0 | 0 | 0 | 111.5 | ||||
| 72 | D | 53.2 | Low | 56.5 | Low | 142 Ų | 142 | 129.4 Ų | 129.4 | 76% | 0.759 | 73% | 0.733 | S | S | * | * | trans | -156.5 | 96.8 | 147.9 | -145.7 | 12.1 | 0 | 0 | 0 | 108.2 | G70 D74 | G70-D72 PolarHBondContact O-N 2.8Å; D72-D74 PolarHBondContact O-N 2.89Å | ||
| 73 | E | 55.5 | Low | 56.1 | Low | 172 Ų | 172 | 132.2 Ų | 132.2 | 80% | 0.804 | 74% | 0.739 | S | S | * | * | trans | -60.5 | 111.2 | 157.4 | -63.3 | -165.3 | 166.4 | 0 | 0 | 108 | ||||
| 74 | D | 57.9 | Low | 56.3 | Low | 148 Ų | 148 | 135.9 Ų | 135.9 | 79% | 0.791 | 75% | 0.75 | S | S | * | * | trans | -133.6 | 93.9 | 153.9 | -117.5 | -8.9 | 0 | 0 | 0 | 109.9 | D72 A76 | D72-D74 PolarHBondContact O-N 2.89Å; D74-A76 PolarHBondContact O-N 2.99Å | ||
| 75 | D | 59 | Low | 56.1 | Low | 143 Ų | 143 | 142 Ų | 142 | 77% | 0.765 | 76% | 0.759 | S | S | * | * | trans | -53.9 | 109.8 | 157 | 177.4 | 25.5 | 0 | 0 | 0 | 110.1 | ||||
| 76 | A | 59.3 | Low | 56.2 | Low | 88 Ų | 88 | 139.7 Ų | 139.7 | 73% | 0.727 | 75% | 0.751 | S | S | * | * | trans | -149.4 | 89.4 | 158.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | D74 D78 | D74-A76 PolarHBondContact O-N 2.99Å; A76-D78 PolarHBondContact O-N 3.11Å | ||
| 77 | E | 60.6 | Low | 56.5 | Low | 165 Ų | 165 | 138.9 Ų | 138.9 | 77% | 0.771 | 75% | 0.752 | S | S | * | * | trans | -50.8 | 100.2 | 153.1 | -62.8 | -105.4 | 157.3 | 0 | 0 | 109.3 | ||||
| 78 | D | 61.3 | Low | 56.5 | Low | 156 Ų | 156 | 145.2 Ų | 145.2 | 83% | 0.834 | 76% | 0.764 | S | S | * | * | trans | -99.1 | 87.4 | 164.1 | -165.9 | 25 | 0 | 0 | 0 | 109.2 | A76 | A76-D78 PolarHBondContact O-N 3.11Š| ||
| 79 | E | 59.5 | Low | 56.8 | Low | 142 Ų | 142 | 146.2 Ų | 146.2 | 66% | 0.664 | 77% | 0.77 | S | S | * | * | trans | -64.5 | 131 | 169.4 | -67.6 | -169.3 | 139.9 | 0 | 0 | 111.3 | ||||
| 80 | N | 59.4 | Low | 57.1 | Low | 130 Ų | 130 | 140.3 Ų | 140.3 | 70% | 0.695 | 75% | 0.749 | S | S | * | * | trans | 66.5 | 103.4 | 153.4 | -67.9 | -63 | 0 | 0 | 0 | 118.5 | ||||
| 81 | N | 56.5 | Low | 57.8 | Low | 131 Ų | 131 | 143.3 Ų | 143.3 | 70% | 0.701 | 76% | 0.757 | S | S | * | * | -145.7 | 91.1 | 123.3 | -160.1 | 2.9 | 0 | 0 | 0 | 114.1 | D83 | N81-D83 PolarHBondContact ND2-OD2 2.85Å; N81-D83 PolarHBondContact O-N 3.15Å; N81-D83 PolarHBondContact OD1-N 3.41Å; N81-D83 PolarHBondContact OD1-OD2 3.31Å | |||
| 82 | I | 57.5 | Low | 58.2 | Low | 153 Ų | 153 | 142 Ų | 142 | 79% | 0.785 | 76% | 0.76 | S | S | * | * | trans | -79.3 | 87 | 158.4 | 39.4 | 157.3 | 0 | 0 | 0 | 109.8 | ||||
| 83 | D | 58.1 | Low | 58.7 | Low | 124 Ų | 124 | 140 Ų | 140 | 66% | 0.663 | 76% | 0.763 | S | S | * | * | trans | -117.2 | 76.6 | 164.8 | -89.4 | -40.5 | 0 | 0 | 0 | 110.6 | N81 R85 | N81-D83 PolarHBondContact ND2-OD2 2.85Å; N81-D83 PolarHBondContact O-N 3.15Å; N81-D83 PolarHBondContact OD1-N 3.41Å; N81-D83 PolarHBondContact OD1-OD2 3.31Å; D83-R85 PolarHBondContact O-N 3.47Å | ||
| 84 | N | 62.6 | Low | 59.2 | Low | 142 Ų | 142 | 141.6 Ų | 141.6 | 76% | 0.759 | 77% | 0.767 | S | S | * | * | trans | 14.3 | 72.2 | 136.3 | -136.2 | 38 | 0 | 0 | 0 | 117 | T86 | N84-T86 VanDerWaalsContact C-N 3.33Å; N84-T86 PolarHBondContact O-N 2.85Å; N84-T86 VanDerWaalsContact O-N 3.15Å | ||
| 85 | R | 51.8 | Low | 59.8 | Low | 229 Ų | 229 | 145.8 Ų | 145.8 | 86% | 0.864 | 77% | 0.772 | S | S | * | * | trans | -83.7 | 77.8 | 163 | -101.9 | -179 | 178.3 | 162.8 | 1.5 | 110.4 | D83 N87 | D83-R85 PolarHBondContact O-N 3.47Å; R85-N87 PolarHBondContact O-N 2.91Å | ||
| 86 | T | 58.7 | Low | 60.1 | Low | 111 Ų | 111 | 144.5 Ų | 144.5 | 68% | 0.681 | 77% | 0.771 | S | S | * | * | trans | -66.6 | 76.3 | 159 | 33.1 | 0 | 0 | 0 | 0 | 110.4 | N84 | N84-T86 VanDerWaalsContact C-N 3.33Å; N84-T86 PolarHBondContact O-N 2.85Å; N84-T86 VanDerWaalsContact O-N 3.15Å | ||
| 87 | N | 60.6 | Low | 60.6 | Low | 130 Ų | 130 | 149.9 Ų | 149.9 | 70% | 0.695 | 78% | 0.778 | S | S | * | * | trans | -129.1 | 63.5 | 167.4 | -67.9 | -6.9 | 0 | 0 | 0 | 109.4 | R85 D89 | R85-N87 PolarHBondContact O-N 2.91Å; N87-D89 VanDerWaalsContact C-N 3.25Å; N87-D89 PolarHBondContact O-N 2.84Å | ||
| 88 | F | 52.7 | Low | 60.7 | Low | 217 Ų | 217 | 147.1 Ų | 147.1 | 95% | 0.952 | 77% | 0.774 | S | S | * | * | trans | -86.3 | 75.2 | 159.2 | -98.7 | -86.5 | 0 | 0 | 0 | 108.1 | G90 | F88-G90 PolarHBondContact O-N 3.14Å; F88-G90 VanDerWaalsContact O-N 3.09Å | ||
| 89 | D | 57.8 | Low | 61.1 | Low | 161 Ų | 161 | 145.7 Ų | 145.7 | 86% | 0.861 | 77% | 0.774 | S | S | * | * | trans | -79 | 79.6 | 162.6 | -169.8 | 30.2 | 0 | 0 | 0 | 107.9 | N87 | N87-D89 VanDerWaalsContact C-N 3.25Å; N87-D89 PolarHBondContact O-N 2.84Å | ||
| 90 | G | 58.6 | Low | 61.1 | Low | 47 Ų | 47 | 148.3 Ų | 148.3 | 49% | 0.485 | 81% | 0.808 | S | S | . | * | trans | -84.6 | 147.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | F88 S92 | F88-G90 PolarHBondContact O-N 3.14Å; F88-G90 VanDerWaalsContact O-N 3.09Å; G90-S92 PolarHBondContact O-N 3.32Å | ||
| 91 | P | 60.1 | Low | 61.2 | Low | 131 Ų | 131 | 149.2 Ų | 149.2 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | trans | -65.3 | 134.6 | -158.3 | 26.2 | -33.4 | 0 | 0 | 0 | 112.9 | A93 | P91-A93 PolarHBondContact O-N 3.4Å; P91-A93 VanDerWaalsContact O-N 3.11Å | ||
| 92 | S | 61.2 | Low | 61.5 | Low | 121 Ų | 121 | 150.2 Ų | 150.2 | 85% | 0.846 | 82% | 0.819 | S | S | * | * | trans | -49.5 | 113.7 | 174.6 | -88.4 | 0 | 0 | 0 | 0 | 112.3 | G90 K94 | G90-S92 PolarHBondContact O-N 3.32Å; S92-K94 PolarHBondContact O-N 3.3Å; S92-K94 VanDerWaalsContact O-N 3.16Å | ||
| 93 | A | 63.4 | Low | 61.7 | Low | 100 Ų | 100 | 150 Ų | 150 | 83% | 0.826 | 82% | 0.821 | S | S | * | * | trans | -67.8 | 109.2 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | P91 R95 | P91-A93 PolarHBondContact O-N 3.4Å; P91-A93 VanDerWaalsContact O-N 3.11Å; A93-R95 PolarHBondContact O-N 3.15Å; A93-R95 VanDerWaalsContact O-N 3.15Å | ||
| 94 | K | 66.1 | Low | 61.9 | Low | 204 Ų | 204 | 151.5 Ų | 151.5 | 89% | 0.887 | 83% | 0.83 | S | S | * | * | trans | -64.4 | 113.6 | 170.6 | -68.6 | -170.7 | 179.9 | -178.3 | 0 | 109.2 | S92 | S92-K94 PolarHBondContact O-N 3.3Å; S92-K94 VanDerWaalsContact O-N 3.16Å | ||
| 95 | R | 70.6 | Confident | 61.8 | Low | 236 Ų | 236 | 152.1 Ų | 152.1 | 89% | 0.891 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 125.2 | 173 | -169.8 | -179.6 | -170.2 | -157.3 | 3.1 | 110.4 | A93 | A93-R95 PolarHBondContact O-N 3.15Å; A93-R95 VanDerWaalsContact O-N 3.15Å |
| 96 | P | 66.9 | Low | 62.5 | Low | 116 Ų | 116 | 147 Ų | 147 | 75% | 0.753 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 139.7 | 168.4 | -13.7 | 28.4 | 0 | 0 | 0 | 110.7 | ||
| 97 | K | 68 | Low | 62.8 | Low | 201 Ų | 201 | 149.6 Ų | 149.6 | 87% | 0.874 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 135.5 | 174.4 | -121.5 | 171.4 | -174 | 173.3 | 0 | 109.5 | ||
| 98 | P | 63.5 | Low | 63 | Low | 107 Ų | 107 | 151.1 Ų | 151.1 | 70% | 0.695 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 143.3 | 171.4 | 28.1 | -31.7 | 0 | 0 | 0 | 110.5 | ||
| 99 | P | 70.1 | Confident | 63.8 | Low | 127 Ų | 127 | 145.6 Ų | 145.6 | 83% | 0.825 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 145.8 | 174.7 | 29 | -32.7 | 0 | 0 | 0 | 111.1 | ||
| 100 | S | 59.5 | Low | 64.4 | Low | 196 Ų | 196 | 144.2 Ų | 144.2 | 100% | 1.371 | 85% | 0.846 | S | S | * | * | trans | -77.3 | 0 | 173.2 | -67.8 | 0 | 0 | 0 | 0 | 112.7 |
Retrieved 100 of 100 residues in 105.1 ms
(Link to these results)