| 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 | 52.6 | Low | 77.9 | Confident | 236 Ų | 236 | 119.1 Ų | 119.1 | 100% | 1.163 | 61% | 0.606 | S | S | * | * | 0 | 99 | 0 | 10.5 | -77.8 | -176.7 | 0 | 0 | 108.5 | T3 | M1-T3 PolarHBondContact O-N 3.4Š| |||
| 2 | H | 54.3 | Low | 79.4 | Confident | 191 Ų | 191 | 114.4 Ų | 114.4 | 88% | 0.884 | 58% | 0.578 | S | S | * | * | trans | -77.7 | 111.5 | 168.9 | -66.6 | 105.3 | 0 | 0 | 0 | 107 | T4 | H2-T4 PolarHBondContact O-N 3.12Å; H2-T4 VanDerWaalsContact O-N 3.11Å | ||
| 3 | T | 57.7 | Low | 80.8 | Confident | 125 Ų | 125 | 105.6 Ų | 105.6 | 77% | 0.767 | 53% | 0.534 | S | S | * | . | trans | -69.4 | 105.3 | 165.3 | -169.6 | 0 | 0 | 0 | 0 | 106.4 | M1 Q5 | M1-T3 PolarHBondContact O-N 3.4Å; T3-Q5 VanDerWaalsContact C-N 3.34Å; T3-Q5 PolarHBondContact O-N 2.7Å | ||
| 4 | T | 71.9 | Confident | 81.9 | Confident | 126 Ų | 126 | 102.6 Ų | 102.6 | 77% | 0.773 | 52% | 0.515 | S | S | * | . | trans | -63.9 | 101.2 | 171 | -61.4 | 0 | 0 | 0 | 0 | 106.2 | H2 K6 | H2-T4 PolarHBondContact O-N 3.12Å; H2-T4 VanDerWaalsContact O-N 3.11Å; T4-K6 PolarHBondContact O-N 3.38Å | ||
| 5 | Q | 72.4 | Confident | 83 | Confident | 175 Ų | 175 | 95.7 Ų | 95.7 | 82% | 0.818 | 48% | 0.481 | S | S | * | . | trans | -61 | 110.4 | 171.8 | -75 | -139.7 | 57.8 | 0 | 0 | 107.7 | T3 D7 | T3-Q5 VanDerWaalsContact C-N 3.34Å; T3-Q5 PolarHBondContact O-N 2.7Å; Q5-D7 PolarHBondContact O-N 2.97Å | ||
| 6 | K | 83.4 | Confident | 83.8 | Confident | 121 Ų | 121 | 90.2 Ų | 90.2 | 53% | 0.526 | 46% | 0.455 | S | S | . | . | trans | -64 | 124.3 | 174.4 | -176.8 | -175.8 | -72.2 | 170.9 | 0 | 108.1 | T4 T8 E38 | T4-K6 PolarHBondContact O-N 3.38Å; K6-T8 HydrophobicContact CD-CG2 4.47Å; K6-T8 HydrophobicContact CG-CG2 4.41Å; K6-T8 PolarHBondContact O-N 3.4Å; K6-T8 VanDerWaalsContact O-N 3.14Å; K6-E38 VanDerWaalsContact CD-OE2 3.29Å; K6-E38 WeakPolarHBondContact CD-OE2 3.42Å; K6-E38 IonicContact NZ-OE1 2.71Å; K6-E38 PolarHBondContact NZ-OE1 2.81Å; K6-E38 IonicContact NZ-OE2 2.75Å; K6-E38 PolarHBondContact NZ-OE2 3.43Å | ||
| 7 | D | 88.6 | Confident | 84.6 | Confident | 110 Ų | 110 | 87.1 Ų | 87.1 | 59% | 0.588 | 45% | 0.452 | S | S | * | . | trans | -68.9 | 110.5 | 173.1 | -172.7 | -3.3 | 0 | 0 | 0 | 108.9 | Q5 T9 | Q5-D7 PolarHBondContact O-N 2.97Å; D7-T9 WeakPolarHBondContact OD1-CB 3.5Å; D7-T9 PolarHBondContact OD1-N 2.77Å; D7-T9 PolarHBondContact OD1-OG1 2.75Å | ||
| 8 | T | 92.2 | Very high | 85.2 | Confident | 46 Ų | 46 | 82.3 Ų | 82.3 | 28% | 0.282 | 43% | 0.427 | S | S | . | . | trans | -102.9 | 12.5 | 179.6 | 53.9 | 0 | 0 | 0 | 0 | 112.3 | K6 Y10 T11 K12 T58 | K6-T8 HydrophobicContact CD-CG2 4.47Å; K6-T8 HydrophobicContact CG-CG2 4.41Å; K6-T8 PolarHBondContact O-N 3.4Å; K6-T8 VanDerWaalsContact O-N 3.14Å; T8-Y10 VanDerWaalsContact C-N 3.26Å; T8-Y10 PolarHBondContact O-N 2.94Å; T8-T11 WeakPolarHBondContact CA-OG1 3.47Å; T8-T11 PolarHBondContact O-N 2.89Å; T8-K12 WeakPolarHBondContact O-CB 3.15Å; T8-K12 PolarHBondContact O-N 3.15Å; T8-T58 HydrophobicContact CG2-CG2 3.75Å | ||
| 9 | T | 92.7 | Very high | 85.8 | Confident | 56 Ų | 56 | 78.2 Ų | 78.2 | 34% | 0.344 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.7 | -42 | -177.3 | -58.1 | 0 | 0 | 0 | 0 | 111.6 | D7 Y87 | D7-T9 WeakPolarHBondContact OD1-CB 3.5Å; D7-T9 PolarHBondContact OD1-N 2.77Å; D7-T9 PolarHBondContact OD1-OG1 2.75Å; T9-Y87 HydrophobicContact CG2-CD1 4.13Å; T9-Y87 HydrophobicContact CG2-CG 4.06Å; T9-Y87 VanDerWaalsContact O-CD1 3.26Å; T9-Y87 WeakPolarHBondContact O-CD1 3.4Å |
| 10 | Y | 94.6 | Very high | 86.3 | Confident | 109 Ų | 109 | 82.3 Ų | 82.3 | 43% | 0.427 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.5 | -1.7 | -177.6 | -56.9 | -74.7 | 0 | 0 | 0 | 114.6 | T8 A65 Y87 | T8-Y10 VanDerWaalsContact C-N 3.26Å; T8-Y10 PolarHBondContact O-N 2.94Å; Y10-A65 WeakPolarHBondContact O-CB 3.14Å; Y10-Y87 HydrophobicContact CD1-CE1 4.26Å; Y10-Y87 HydrophobicContact CE1-CE1 4.35Å |
| 11 | T | 96.2 | Very high | 86.7 | Confident | 15 Ų | 15 | 84.9 Ų | 84.9 | 9% | 0.092 | 43% | 0.427 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.6 | -17.6 | 178.2 | 60.7 | 0 | 0 | 0 | 0 | 113 | T8 M59 R62 | T8-T11 WeakPolarHBondContact CA-OG1 3.47Å; T8-T11 PolarHBondContact O-N 2.89Å; T11-M59 VanDerWaalsContact CB-O 3.3Å; T11-M59 WeakPolarHBondContact CB-O 3.43Å; T11-M59 PolarHBondContact O-N 2.76Å; T11-R62 HydrophobicContact CG2-CB 4.4Å |
| 12 | K | 96.6 | Very high | 88.7 | Confident | 63 Ų | 63 | 73.9 Ų | 73.9 | 27% | 0.274 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87 | 126 | 178.6 | -166.5 | 169.3 | -173.1 | 155.3 | 0 | 111.4 | T8 F56 V57 A86 | T8-K12 WeakPolarHBondContact O-CB 3.15Å; T8-K12 PolarHBondContact O-N 3.15Å; K12-F56 HydrophobicContact CG-CD1 4.49Å; K12-V57 CarbonylContact C-O 3.51Å; K12-V57 WeakPolarHBondContact CA-O 3.25Å; K12-A86 HydrophobicContact CB-CB 4.08Å; K12-A86 HydrophobicContact CD-CB 4.23Å; K12-A86 HydrophobicContact CG-CB 3.74Å; K12-A86 WeakPolarHBondContact O-CB 3.48Å; K12-A86 PolarHBondContact O-N 2.72Å |
| 13 | I | 97.1 | Very high | 90.7 | Very high | 0 Ų | 0 | 68.2 Ų | 68.2 | 0% | 0 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.5 | 131.7 | -176 | -53.1 | 173.9 | 0 | 0 | 0 | 108.2 | V15 F31 F56 V57 M59 A65 A68 V83 N84 | I13-V15 HydrophobicContact CG2-CG2 4.22Å; I13-F31 HydrophobicContact CD1-CD1 4.47Å; I13-F31 HydrophobicContact CD1-CE1 4.45Å; I13-F56 VanDerWaalsContact O-CA 3.3Å; I13-F56 WeakPolarHBondContact O-CA 3.42Å; I13-V57 HydrophobicContact CB-CB 4.35Å; I13-V57 PolarHBondContact N-O 3.18Å; I13-V57 PolarHBondContact O-N 2.97Å; I13-M59 HydrophobicContact CD1-CG 3.63Å; I13-M59 HydrophobicContact CD1-SD 4.13Å; I13-M59 HydrophobicContact CG1-CG 4.44Å; I13-A65 HydrophobicContact CD1-CB 4.02Å; I13-A65 HydrophobicContact CG1-CB 4.1Å; I13-A68 HydrophobicContact CD1-CB 3.7Å; I13-V83 HydrophobicContact CG2-CG1 3.27Å; I13-N84 CarbonylContact C-O 3.58Å; I13-N84 WeakPolarHBondContact CA-O 3.44Å |
| 14 | F | 97 | Very high | 92.5 | Very high | 63 Ų | 63 | 66.9 Ų | 66.9 | 28% | 0.276 | 34% | 0.34 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.9 | 132.4 | 166.4 | 169.2 | -98.7 | 0 | 0 | 0 | 109.5 | Y54 F56 V83 N84 A86 | F14-Y54 AromaticContact CE2-CD2 3.95Å; F14-Y54 HydrophobicContact CE2-CD2 3.95Å; F14-Y54 HydrophobicContact CE2-CG 4.23Å; F14-F56 HydrophobicContact CB-CD1 4.42Å; F14-F56 HydrophobicContact CB-CE1 4.2Å; F14-F56 HydrophobicContact CD2-CD1 4.5Å; F14-F56 AromaticContact CD2-CE1 3.86Å; F14-F56 HydrophobicContact CD2-CE1 3.86Å; F14-F56 HydrophobicContact CD2-CZ 4.15Å; F14-V83 WeakPolarHBondContact O-CA 3.31Å; F14-N84 PolarHBondContact N-O 2.76Å; F14-N84 PolarHBondContact O-N 3.06Å; F14-A86 HydrophobicContact CB-CB 4.35Å |
| 15 | V | 97.1 | Very high | 93.7 | Very high | 0 Ų | 0 | 63.7 Ų | 63.7 | 0% | 0 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.3 | 108.7 | 177 | -170.1 | 0 | 0 | 0 | 0 | 108.5 | I13 L18 F31 Y54 G55 V57 I76 A81 N82 V83 | I13-V15 HydrophobicContact CG2-CG2 4.22Å; V15-L18 HydrophobicContact CG1-CD1 4.24Å; V15-L18 HydrophobicContact CG1-CD2 3.65Å; V15-L18 HydrophobicContact CG1-CG 4.03Å; V15-F31 HydrophobicContact CB-CZ 4.5Å; V15-F31 HydrophobicContact CG1-CE2 4.21Å; V15-F31 HydrophobicContact CG1-CZ 4.22Å; V15-F31 HydrophobicContact CG2-CE1 4.4Å; V15-F31 HydrophobicContact CG2-CE2 3.65Å; V15-F31 HydrophobicContact CG2-CZ 3.45Å; V15-F31 VanDerWaalsContact CG2-CZ 3.45Å; V15-Y54 CarbonylContact O-C 3.56Å; V15-Y54 WeakPolarHBondContact O-CA 3.5Å; V15-Y54 WeakPolarHBondContact O-CB 3.32Å; V15-G55 PolarHBondContact N-O 3.45Å; V15-G55 PolarHBondContact O-N 2.81Å; V15-V57 HydrophobicContact CG2-CG2 4.01Å; V15-I76 HydrophobicContact CG1-CD1 3.92Å; V15-A81 HydrophobicContact CG1-CB 4.43Å; V15-N82 CarbonylContact C-O 3.53Å; V15-N82 WeakPolarHBondContact CA-O 3.31Å; V15-V83 HydrophobicContact CG1-CG2 4.25Å |
| 16 | G | 96.9 | Very high | 94.8 | Very high | 7 Ų | 7 | 56.8 Ų | 56.8 | 7% | 0.072 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.3 | 163.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L18 A81 N82 | G16-L18 VanDerWaalsContact C-N 3.34Å; G16-A81 CarbonylContact O-C 3.45Å; G16-A81 WeakPolarHBondContact O-CA 3.26Å; G16-A81 VanDerWaalsContact O-CB 3.3Å; G16-A81 WeakPolarHBondContact O-CB 3.37Å; G16-N82 PolarHBondContact N-O 2.8Å; G16-N82 PolarHBondContact O-N 3.41Å |
| 17 | G | 96.4 | Very high | 95.3 | Very high | 38 Ų | 38 | 51 Ų | 51 | 39% | 0.392 | 27% | 0.273 | S | S | . | . | S | Bend | trans | 76.4 | 21.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114 | G53 R79 | G17-G53 PolarHBondContact N-O 3.06Å; G17-R79 WeakPolarHBondContact O-CD 3.33Å; G17-R79 WeakPolarHBondContact O-CG 3.12Å |
| 18 | L | 96.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 27% | 0.269 | C | S | . | . | trans | -69 | 146.3 | 176.6 | -63.2 | 171.7 | 0 | 0 | 0 | 111 | V15 G16 T22 L27 V42 G53 I76 R79 A81 | V15-L18 HydrophobicContact CG1-CD1 4.24Å; V15-L18 HydrophobicContact CG1-CD2 3.65Å; V15-L18 HydrophobicContact CG1-CG 4.03Å; G16-L18 VanDerWaalsContact C-N 3.34Å; L18-T22 HydrophobicContact CD1-CG2 4.48Å; L18-T22 HydrophobicContact CD2-CG2 4.31Å; L18-L27 HydrophobicContact CD1-CD1 3.57Å; L18-V42 HydrophobicContact CD1-CG2 4.49Å; L18-G53 PolarHBondContact N-O 3.26Å; L18-I76 HydrophobicContact CD2-CB 4.25Å; L18-I76 HydrophobicContact CD2-CD1 3.9Å; L18-I76 HydrophobicContact CD2-CG2 4.11Å; L18-R79 PolarHBondContact O-NH1 3.41Å; L18-A81 HydrophobicContact CD2-CB 4.49Å | ||
| 19 | P | 96 | Very high | 95.9 | Very high | 5 Ų | 5 | 58 Ų | 58 | 3% | 0.032 | 29% | 0.29 | C | S | . | . | trans | -56.7 | 147.5 | 164.2 | -28 | 38.2 | 0 | 0 | 0 | 112.3 | H21 T22 D77 R79 | P19-H21 WeakPolarHBondContact CB-CE1 3.43Å; P19-H21 PolarHBondContact O-N 2.79Å; P19-H21 VanDerWaalsContact O-N 3.16Å; P19-T22 VanDerWaalsContact CD-OG1 3.31Å; P19-T22 WeakPolarHBondContact CD-OG1 3.5Å; P19-T22 WeakPolarHBondContact O-CB 3.33Å; P19-T22 PolarHBondContact O-N 3.05Å; P19-T22 VanDerWaalsContact O-N 3.09Å; P19-T22 PolarHBondContact O-OG1 2.99Å; P19-D77 HydrophobicContact CG-CB 3.91Å; P19-R79 HydrophobicContact CG-CB 3.53Å; P19-R79 HydrophobicContact CG-CG 4.44Å | ||
| 20 | Y | 95.9 | Very high | 96 | Very high | 160 Ų | 160 | 58.9 Ų | 58.9 | 63% | 0.627 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69 | -13 | -179.2 | -59.1 | -43.5 | 0 | 0 | 0 | 113.9 | S51 | Y20-S51 WeakPolarHBondContact CD1-O 3.3Å; Y20-S51 WeakPolarHBondContact O-CB 3.49Å |
| 21 | H | 94.6 | Very high | 96.1 | Very high | 136 Ų | 136 | 53.7 Ų | 53.7 | 63% | 0.63 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95 | -4.1 | 175.6 | 63 | -99.9 | 0 | 0 | 0 | 113.2 | P19 T23 | P19-H21 WeakPolarHBondContact CB-CE1 3.43Å; P19-H21 PolarHBondContact O-N 2.79Å; P19-H21 VanDerWaalsContact O-N 3.16Å; H21-T23 PolarHBondContact O-N 3.29Å |
| 22 | T | 95.4 | Very high | 96.1 | Very high | 6 Ų | 6 | 58.5 Ų | 58.5 | 4% | 0.037 | 29% | 0.289 | C | S | . | . | trans | -66.9 | 127.6 | 176.5 | -62.4 | 0 | 0 | 0 | 0 | 109.7 | L18 P19 S26 L27 V42 D77 | L18-T22 HydrophobicContact CD1-CG2 4.48Å; L18-T22 HydrophobicContact CD2-CG2 4.31Å; P19-T22 VanDerWaalsContact CD-OG1 3.31Å; P19-T22 WeakPolarHBondContact CD-OG1 3.5Å; P19-T22 WeakPolarHBondContact O-CB 3.33Å; P19-T22 PolarHBondContact O-N 3.05Å; P19-T22 VanDerWaalsContact O-N 3.09Å; P19-T22 PolarHBondContact O-OG1 2.99Å; T22-S26 WeakPolarHBondContact CG2-OG 3.36Å; T22-L27 HydrophobicContact CG2-CB 4.14Å; T22-V42 HydrophobicContact CG2-CG2 4.45Å; T22-D77 WeakPolarHBondContact CB-OD2 3.48Å; T22-D77 WeakPolarHBondContact CG2-OD2 3.28Å; T22-D77 PolarHBondContact OG1-OD2 3.22Å | ||
| 23 | T | 95.8 | Very high | 96.1 | Very high | 71 Ų | 71 | 61 Ų | 61 | 44% | 0.436 | 31% | 0.309 | S | S | . | . | trans | -98.5 | 165.5 | 175.8 | 62.7 | 0 | 0 | 0 | 0 | 111.1 | H21 A25 S26 L27 | H21-T23 PolarHBondContact O-N 3.29Å; T23-A25 PolarHBondContact O-N 3.11Å; T23-S26 PolarHBondContact N-OG 3.3Å; T23-S26 PolarHBondContact O-N 2.59Å; T23-S26 PolarHBondContact O-OG 2.93Å; T23-S26 PolarHBondContact OG1-N 3.14Å; T23-S26 PolarHBondContact OG1-OG 3.38Å; T23-L27 WeakPolarHBondContact O-CB 3.42Å; T23-L27 PolarHBondContact O-N 2.99Å | ||
| 24 | D | 96.1 | Very high | 96 | Very high | 97 Ų | 97 | 62.9 Ų | 62.9 | 52% | 0.519 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -52.9 | -41.1 | 169.8 | 50.6 | -79.9 | 0 | 0 | 0 | 111.7 | L27 R28 | D24-L27 PolarHBondContact O-N 3.02Å; D24-R28 WeakPolarHBondContact O-CB 3.22Å; D24-R28 PolarHBondContact O-N 2.93Å |
| 25 | A | 96.1 | Very high | 96 | Very high | 59 Ų | 59 | 60.8 Ų | 60.8 | 49% | 0.488 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64.2 | -45.8 | 178 | 0 | 0 | 0 | 0 | 0 | 113.4 | T23 L27 R28 K29 | T23-A25 PolarHBondContact O-N 3.11Å; A25-L27 VanDerWaalsContact C-N 3.32Å; A25-L27 PolarHBondContact O-N 2.9Å; A25-R28 PolarHBondContact O-N 2.77Å; A25-K29 WeakPolarHBondContact O-CB 3.17Å; A25-K29 PolarHBondContact O-N 2.77Å |
| 26 | S | 94.7 | Very high | 95.9 | Very high | 30 Ų | 30 | 66.2 Ų | 66.2 | 21% | 0.21 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.8 | -40.9 | 176.8 | 43.5 | 0 | 0 | 0 | 0 | 111.7 | T22 T23 K29 Y30 | T22-S26 WeakPolarHBondContact CG2-OG 3.36Å; T23-S26 PolarHBondContact N-OG 3.3Å; T23-S26 PolarHBondContact O-N 2.59Å; T23-S26 PolarHBondContact O-OG 2.93Å; T23-S26 PolarHBondContact OG1-N 3.14Å; T23-S26 PolarHBondContact OG1-OG 3.38Å; S26-K29 PolarHBondContact O-N 2.99Å; S26-Y30 PolarHBondContact O-N 3.32Å; S26-Y30 VanDerWaalsContact O-N 3.08Å |
| 27 | L | 95.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -67.3 | -43.3 | 178.7 | 176.3 | 159.1 | 0 | 0 | 0 | 110.4 | L18 T22 T23 D24 A25 K29 Y30 F31 A40 V42 V57 | L18-L27 HydrophobicContact CD1-CD1 3.57Å; T22-L27 HydrophobicContact CG2-CB 4.14Å; T23-L27 WeakPolarHBondContact O-CB 3.42Å; T23-L27 PolarHBondContact O-N 2.99Å; D24-L27 PolarHBondContact O-N 3.02Å; A25-L27 VanDerWaalsContact C-N 3.32Å; A25-L27 PolarHBondContact O-N 2.9Å; L27-K29 PolarHBondContact O-N 3.28Å; L27-Y30 PolarHBondContact O-N 3.24Å; L27-F31 HydrophobicContact CD2-CD2 4.28Å; L27-F31 HydrophobicContact CG-CD2 4.32Å; L27-F31 HydrophobicContact CG-CE2 4.34Å; L27-F31 WeakPolarHBondContact O-CD2 3.38Å; L27-F31 PolarHBondContact O-N 3.14Å; L27-A40 HydrophobicContact CD2-CB 3.74Å; L27-V42 HydrophobicContact CB-CG2 4.31Å; L27-V42 HydrophobicContact CD1-CG2 3.83Å; L27-V57 HydrophobicContact CD2-CG2 3.22Å; L27-V57 HydrophobicContact CG-CG2 4.15Å |
| 28 | R | 96.5 | Very high | 95.9 | Very high | 137 Ų | 137 | 69.4 Ų | 69.4 | 52% | 0.517 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -57.4 | -49.9 | 173.3 | -172.5 | -178.9 | -176.4 | 167.7 | 3.8 | 111.6 | D24 A25 Y30 F31 E32 I37 A40 | D24-R28 WeakPolarHBondContact O-CB 3.22Å; D24-R28 PolarHBondContact O-N 2.93Å; A25-R28 PolarHBondContact O-N 2.77Å; R28-Y30 PolarHBondContact O-N 3.34Å; R28-F31 PolarHBondContact O-N 2.83Å; R28-F31 VanDerWaalsContact O-N 3.1Å; R28-E32 WeakPolarHBondContact O-CB 3.45Å; R28-E32 PolarHBondContact O-N 3Å; R28-I37 HydrophobicContact CB-CD1 4.29Å; R28-I37 HydrophobicContact CG-CB 4.44Å; R28-I37 HydrophobicContact CG-CD1 3.57Å; R28-I37 HydrophobicContact CG-CG2 4.38Å; R28-I37 WeakPolarHBondContact O-CD1 3.42Å; R28-A40 HydrophobicContact CB-CB 3.85Å; R28-A40 HydrophobicContact CG-CB 4.26Å |
| 29 | K | 96.1 | Very high | 95.9 | Very high | 165 Ų | 165 | 74.3 Ų | 74.3 | 72% | 0.717 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -57.5 | -36.1 | 179.9 | -174.1 | 178.4 | -179.5 | -179.7 | 0 | 112.5 | A25 S26 L27 | A25-K29 WeakPolarHBondContact O-CB 3.17Å; A25-K29 PolarHBondContact O-N 2.77Å; S26-K29 PolarHBondContact O-N 2.99Å; L27-K29 PolarHBondContact O-N 3.28Å |
| 30 | Y | 95.4 | Very high | 95.9 | Very high | 75 Ų | 75 | 74.9 Ų | 74.9 | 29% | 0.294 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -67.2 | -43.8 | 176.7 | -175.4 | -95.2 | 0 | 0 | 0 | 112.3 | S26 L27 R28 V33 F34 P74 I76 | S26-Y30 PolarHBondContact O-N 3.32Å; S26-Y30 VanDerWaalsContact O-N 3.08Å; L27-Y30 PolarHBondContact O-N 3.24Å; R28-Y30 PolarHBondContact O-N 3.34Å; Y30-V33 VanDerWaalsContact O-CG1 3.27Å; Y30-V33 WeakPolarHBondContact O-CG1 3.07Å; Y30-F34 HydrophobicContact CD1-CE2 4.46Å; Y30-F34 HydrophobicContact CE1-CE2 4.03Å; Y30-P74 HydrophobicContact CE1-CB 3.99Å; Y30-P74 HydrophobicContact CE1-CG 4.35Å; Y30-P74 WeakPolarHBondContact OH-CB 3.02Å; Y30-I76 HydrophobicContact CD1-CD1 3.78Å; Y30-I76 HydrophobicContact CD1-CG1 3.88Å; Y30-I76 HydrophobicContact CD2-CG1 4.14Å; Y30-I76 HydrophobicContact CE1-CD1 3.96Å; Y30-I76 HydrophobicContact CE1-CG1 3.87Å; Y30-I76 HydrophobicContact CE2-CG1 4.14Å; Y30-I76 HydrophobicContact CG-CD1 4.27Å; Y30-I76 HydrophobicContact CG-CG1 4.03Å |
| 31 | F | 96.1 | Very high | 96 | Very high | 0 Ų | 0 | 69.5 Ų | 69.5 | 0% | 0 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -83 | -17.4 | -175.8 | -77.2 | -86 | 0 | 0 | 0 | 114.2 | I13 V15 L27 R28 V33 F34 I37 V57 M59 A68 I76 V83 | I13-F31 HydrophobicContact CD1-CD1 4.47Å; I13-F31 HydrophobicContact CD1-CE1 4.45Å; V15-F31 HydrophobicContact CB-CZ 4.5Å; V15-F31 HydrophobicContact CG1-CE2 4.21Å; V15-F31 HydrophobicContact CG1-CZ 4.22Å; V15-F31 HydrophobicContact CG2-CE1 4.4Å; V15-F31 HydrophobicContact CG2-CE2 3.65Å; V15-F31 HydrophobicContact CG2-CZ 3.45Å; V15-F31 VanDerWaalsContact CG2-CZ 3.45Å; L27-F31 HydrophobicContact CD2-CD2 4.28Å; L27-F31 HydrophobicContact CG-CD2 4.32Å; L27-F31 HydrophobicContact CG-CE2 4.34Å; L27-F31 WeakPolarHBondContact O-CD2 3.38Å; L27-F31 PolarHBondContact O-N 3.14Å; R28-F31 PolarHBondContact O-N 2.83Å; R28-F31 VanDerWaalsContact O-N 3.1Å; F31-V33 PolarHBondContact O-N 2.82Å; F31-F34 HydrophobicContact CD1-CD2 4.01Å; F31-F34 HydrophobicContact CD1-CE2 4.24Å; F31-F34 PolarHBondContact O-N 2.77Å; F31-I37 HydrophobicContact CB-CD1 3.73Å; F31-I37 HydrophobicContact CB-CG1 4.42Å; F31-V57 HydrophobicContact CB-CG1 4.09Å; F31-V57 HydrophobicContact CD2-CG2 3.71Å; F31-V57 HydrophobicContact CE2-CG2 3.95Å; F31-V57 HydrophobicContact CG-CG1 4.17Å; F31-V57 HydrophobicContact CG-CG2 4.1Å; F31-M59 HydrophobicContact CB-SD 4.41Å; F31-A68 HydrophobicContact CD1-CB 3.86Å; F31-A68 HydrophobicContact CE1-CB 3.97Å; F31-I76 HydrophobicContact CE2-CD1 4.07Å; F31-I76 HydrophobicContact CZ-CD1 4.4Å; F31-V83 HydrophobicContact CE1-CG1 4.25Å; F31-V83 HydrophobicContact CE1-CG2 4.49Å; F31-V83 HydrophobicContact CZ-CG1 4.4Å; F31-V83 HydrophobicContact CZ-CG2 4Å |
| 32 | E | 96.2 | Very high | 96.1 | Very high | 117 Ų | 117 | 64.1 Ų | 64.1 | 55% | 0.547 | 33% | 0.334 | S | S | . | . | G | 310 helix | trans | -61 | -27.9 | -178.8 | -174.4 | 176.8 | 179 | 0 | 0 | 112.3 | R28 F34 G35 I37 | R28-E32 WeakPolarHBondContact O-CB 3.45Å; R28-E32 PolarHBondContact O-N 3Å; E32-F34 PolarHBondContact O-N 3.04Å; E32-G35 PolarHBondContact O-N 3.36Å; E32-G35 VanDerWaalsContact O-N 3.14Å; E32-I37 HydrophobicContact CB-CD1 4.15Å |
| 33 | V | 95.7 | Very high | 96.1 | Very high | 115 Ų | 115 | 66 Ų | 66 | 70% | 0.697 | 34% | 0.344 | S | S | * | . | G | 310 helix | trans | -62 | -25.8 | 175.1 | 73.4 | 0 | 0 | 0 | 0 | 113.2 | Y30 F31 | Y30-V33 VanDerWaalsContact O-CG1 3.27Å; Y30-V33 WeakPolarHBondContact O-CG1 3.07Å; F31-V33 PolarHBondContact O-N 2.82Å |
| 34 | F | 95.7 | Very high | 96.2 | Very high | 40 Ų | 40 | 66.3 Ų | 66.3 | 18% | 0.175 | 35% | 0.345 | C | S | . | . | G | 310 helix | trans | -89 | -11.4 | 179.8 | -55.6 | -70.1 | 0 | 0 | 0 | 112.9 | Y30 F31 E32 M59 A64 R67 A68 | Y30-F34 HydrophobicContact CD1-CE2 4.46Å; Y30-F34 HydrophobicContact CE1-CE2 4.03Å; F31-F34 HydrophobicContact CD1-CD2 4.01Å; F31-F34 HydrophobicContact CD1-CE2 4.24Å; F31-F34 PolarHBondContact O-N 2.77Å; E32-F34 PolarHBondContact O-N 3.04Å; F34-M59 HydrophobicContact CB-CE 4.4Å; F34-A64 VanDerWaalsContact O-CB 3.28Å; F34-A64 WeakPolarHBondContact O-CB 3.35Å; F34-R67 HydrophobicContact CB-CB 4.46Å; F34-R67 HydrophobicContact CD1-CB 4.24Å; F34-R67 VanDerWaalsContact O-CZ 3.22Å; F34-R67 PolarHBondContact O-NE 2.86Å; F34-R67 VanDerWaalsContact O-NE 3.16Å; F34-R67 PolarHBondContact O-NH2 3.2Å; F34-A68 HydrophobicContact CB-CB 4.16Å; F34-A68 HydrophobicContact CD2-CB 3.77Å; F34-A68 HydrophobicContact CE2-CB 4.3Å; F34-A68 HydrophobicContact CG-CB 3.91Å |
| 35 | G | 95.9 | Very high | 96.1 | Very high | 18 Ų | 18 | 64.3 Ų | 64.3 | 19% | 0.186 | 33% | 0.334 | C | S | . | . | S | Bend | trans | 144.5 | -176.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | E32 M59 | E32-G35 PolarHBondContact O-N 3.36Å; E32-G35 VanDerWaalsContact O-N 3.14Å; G35-M59 WeakPolarHBondContact O-CE 3.35Å |
| 36 | D | 96.8 | Very high | 96.1 | Very high | 115 Ų | 115 | 73.1 Ų | 73.1 | 62% | 0.615 | 36% | 0.355 | S | S | * | . | trans | -67.5 | 139.4 | -178.2 | -66.1 | -56.3 | 0 | 0 | 0 | 112.3 | A60 | D36-A60 HydrophobicContact CB-CB 3.87Å; D36-A60 WeakPolarHBondContact O-CB 3.42Å; D36-A60 PolarHBondContact O-N 3.46Å | ||
| 37 | I | 96.8 | Very high | 96.1 | Very high | 19 Ų | 19 | 80.5 Ų | 80.5 | 10% | 0.097 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.9 | 125.6 | -178.6 | -62.4 | 169.9 | 0 | 0 | 0 | 109.4 | R28 F31 E32 A40 V57 M59 | R28-I37 HydrophobicContact CB-CD1 4.29Å; R28-I37 HydrophobicContact CG-CB 4.44Å; R28-I37 HydrophobicContact CG-CD1 3.57Å; R28-I37 HydrophobicContact CG-CG2 4.38Å; R28-I37 WeakPolarHBondContact O-CD1 3.42Å; F31-I37 HydrophobicContact CB-CD1 3.73Å; F31-I37 HydrophobicContact CB-CG1 4.42Å; E32-I37 HydrophobicContact CB-CD1 4.15Å; I37-A40 HydrophobicContact CG2-CB 4.02Å; I37-V57 HydrophobicContact CG1-CG1 4.4Å; I37-V57 HydrophobicContact CG2-CG1 4.11Å; I37-M59 HydrophobicContact CG1-CE 4.01Å; I37-M59 HydrophobicContact CG1-SD 4.02Å |
| 38 | E | 96.1 | Very high | 96.1 | Very high | 93 Ų | 93 | 84.3 Ų | 84.3 | 44% | 0.435 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.2 | -45.7 | 172.5 | 179.7 | 170.1 | -173.4 | 0 | 0 | 111.4 | K6 T58 | K6-E38 VanDerWaalsContact CD-OE2 3.29Å; K6-E38 WeakPolarHBondContact CD-OE2 3.42Å; K6-E38 IonicContact NZ-OE1 2.71Å; K6-E38 PolarHBondContact NZ-OE1 2.81Å; K6-E38 IonicContact NZ-OE2 2.75Å; K6-E38 PolarHBondContact NZ-OE2 3.43Å; E38-T58 HydrophobicContact CB-CG2 4.17Å; E38-T58 WeakPolarHBondContact CB-O 3.37Å; E38-T58 HydrophobicContact CG-CG2 4.49Å; E38-T58 PolarHBondContact N-O 3.22Å |
| 39 | E | 96 | Very high | 96 | Very high | 102 Ų | 102 | 80.4 Ų | 80.4 | 48% | 0.477 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.6 | 138.8 | -179.1 | -173.3 | 179.6 | -141 | 0 | 0 | 110.8 | V41 V57 T58 | E39-V41 HydrophobicContact CG-CG1 4Å; E39-V57 CarbonylContact O-C 3.58Å; E39-V57 WeakPolarHBondContact O-CA 3.48Å; E39-T58 PolarHBondContact N-O 2.99Å; E39-T58 PolarHBondContact O-N 3.44Å |
| 40 | A | 97 | Very high | 95.9 | Very high | 17 Ų | 17 | 79.7 Ų | 79.7 | 14% | 0.14 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.6 | 117 | 175.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | L27 R28 I37 | L27-A40 HydrophobicContact CD2-CB 3.74Å; R28-A40 HydrophobicContact CB-CB 3.85Å; R28-A40 HydrophobicContact CG-CB 4.26Å; I37-A40 HydrophobicContact CG2-CB 4.02Å |
| 41 | V | 96.9 | Very high | 95.9 | Very high | 48 Ų | 48 | 76.8 Ų | 76.8 | 29% | 0.291 | 40% | 0.399 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.3 | 128.1 | -175.3 | -68 | 0 | 0 | 0 | 0 | 111.5 | E39 I43 G55 F56 | E39-V41 HydrophobicContact CG-CG1 4Å; V41-I43 HydrophobicContact CG2-CD1 4.36Å; V41-G55 CarbonylContact O-C 3.47Å; V41-G55 WeakPolarHBondContact O-CA 3.25Å; V41-F56 HydrophobicContact CG2-CB 4.05Å; V41-F56 PolarHBondContact N-O 3.14Å; V41-F56 PolarHBondContact O-N 2.91Å |
| 42 | V | 97.1 | Very high | 95.9 | Very high | 22 Ų | 22 | 84 Ų | 84 | 13% | 0.133 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.9 | 129.3 | 168 | 177.2 | 0 | 0 | 0 | 0 | 108.1 | L18 T22 L27 T44 S51 | L18-V42 HydrophobicContact CD1-CG2 4.49Å; T22-V42 HydrophobicContact CG2-CG2 4.45Å; L27-V42 HydrophobicContact CB-CG2 4.31Å; L27-V42 HydrophobicContact CD1-CG2 3.83Å; V42-T44 PolarHBondContact O-N 2.71Å; V42-S51 WeakPolarHBondContact CG1-OG 3.3Å |
| 43 | I | 96.3 | Very high | 95.9 | Very high | 47 Ų | 47 | 78.8 Ų | 78.8 | 24% | 0.241 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.9 | 119.7 | -179.7 | -54.2 | -54.2 | 0 | 0 | 0 | 109.5 | V41 R52 Y54 F56 | V41-I43 HydrophobicContact CG2-CD1 4.36Å; I43-R52 WeakPolarHBondContact O-CB 3.44Å; I43-R52 PolarHBondContact O-N 2.76Å; I43-Y54 HydrophobicContact CB-CD2 4.13Å; I43-Y54 HydrophobicContact CB-CE1 4.34Å; I43-Y54 HydrophobicContact CB-CE2 3.65Å; I43-Y54 HydrophobicContact CG1-CD2 3.94Å; I43-Y54 HydrophobicContact CG1-CE2 3.48Å; I43-Y54 VanDerWaalsContact CG1-CE2 3.48Å; I43-Y54 HydrophobicContact CG2-CE1 4.4Å; I43-Y54 HydrophobicContact CG2-CE2 4.04Å; I43-Y54 WeakPolarHBondContact CG2-OH 3.3Å; I43-Y54 PolarHBondContact N-O 3.21Å; I43-F56 HydrophobicContact CD1-CD2 4.15Å; I43-F56 HydrophobicContact CD1-CE2 4.44Å; I43-F56 HydrophobicContact CG1-CD2 4.06Å; I43-F56 HydrophobicContact CG1-CE2 4.09Å |
| 44 | T | 96 | Very high | 95.9 | Very high | 77 Ų | 77 | 75.9 Ų | 75.9 | 47% | 0.472 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | 154.9 | 174.6 | 57.2 | 0 | 0 | 0 | 0 | 110.8 | V42 K50 | V42-T44 PolarHBondContact O-N 2.71Å; T44-K50 CarbonylContact C-O 3.57Å; T44-K50 VanDerWaalsContact CA-O 3.25Å; T44-K50 WeakPolarHBondContact CA-O 3.18Å; T44-K50 WeakPolarHBondContact CB-O 3.38Å |
| 45 | D | 95.9 | Very high | 96 | Very high | 54 Ų | 54 | 74 Ų | 74 | 29% | 0.289 | 37% | 0.373 | S | S | . | . | P | Polyproline II helix | trans | -74.4 | 128.5 | 169.9 | 172.4 | 15.7 | 0 | 0 | 0 | 109.5 | Q47 T48 G49 K50 R52 | D45-Q47 VanDerWaalsContact C-N 3.27Å; D45-Q47 PolarHBondContact O-N 2.97Å; D45-Q47 PolarHBondContact OD1-N 2.8Å; D45-T48 WeakPolarHBondContact CB-OG1 3.29Å; D45-T48 WeakPolarHBondContact OD2-CG2 3.3Å; D45-T48 PolarHBondContact OD2-OG1 2.82Å; D45-G49 VanDerWaalsContact O-CA 3.22Å; D45-G49 WeakPolarHBondContact O-CA 3.32Å; D45-G49 PolarHBondContact O-N 2.98Å; D45-K50 PolarHBondContact N-O 3.02Å; D45-R52 HydrophobicContact CB-CG 4.23Å |
| 46 | R | 95 | Very high | 96 | Very high | 245 Ų | 245 | 75.6 Ų | 75.6 | 93% | 0.925 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.7 | -27.6 | -177.4 | -172.3 | 179 | -66.4 | 172.2 | -1.1 | 112.7 | ||
| 47 | Q | 95.8 | Very high | 96.1 | Very high | 185 Ų | 185 | 70.1 Ų | 70.1 | 86% | 0.864 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82 | -44.9 | -178.9 | -67.6 | -173.1 | -20.3 | 0 | 0 | 112 | D45 | D45-Q47 VanDerWaalsContact C-N 3.27Å; D45-Q47 PolarHBondContact O-N 2.97Å; D45-Q47 PolarHBondContact OD1-N 2.8Å |
| 48 | T | 95.2 | Very high | 96.1 | Very high | 80 Ų | 80 | 69.4 Ų | 69.4 | 49% | 0.491 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.1 | -16.2 | -174.2 | 62.2 | 0 | 0 | 0 | 0 | 114.1 | D45 K50 | D45-T48 WeakPolarHBondContact CB-OG1 3.29Å; D45-T48 WeakPolarHBondContact OD2-CG2 3.3Å; D45-T48 PolarHBondContact OD2-OG1 2.82Å; T48-K50 PolarHBondContact O-N 2.74Å; T48-K50 PolarHBondContact OG1-N 2.73Å |
| 49 | G | 93.9 | Very high | 96.1 | Very high | 54 Ų | 54 | 65 Ų | 65 | 56% | 0.557 | 32% | 0.322 | S | S | * | . | trans | 70.2 | 0.2 | -172.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | D45 | D45-G49 VanDerWaalsContact O-CA 3.22Å; D45-G49 WeakPolarHBondContact O-CA 3.32Å; D45-G49 PolarHBondContact O-N 2.98Å | ||
| 50 | K | 94.3 | Very high | 96.1 | Very high | 150 Ų | 150 | 62.4 Ų | 62.4 | 65% | 0.652 | 32% | 0.318 | S | S | * | . | trans | -81 | 147.9 | -176.8 | -63.3 | -177.2 | 179.8 | -176.2 | 0 | 111.1 | T44 D45 T48 R52 | T44-K50 CarbonylContact C-O 3.57Å; T44-K50 VanDerWaalsContact CA-O 3.25Å; T44-K50 WeakPolarHBondContact CA-O 3.18Å; T44-K50 WeakPolarHBondContact CB-O 3.38Å; D45-K50 PolarHBondContact N-O 3.02Å; T48-K50 PolarHBondContact O-N 2.74Å; T48-K50 PolarHBondContact OG1-N 2.73Å; K50-R52 PolarHBondContact O-N 2.75Å | ||
| 51 | S | 95.4 | Very high | 96.1 | Very high | 15 Ų | 15 | 66 Ų | 66 | 11% | 0.105 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.8 | 134.3 | 172.5 | 176.5 | 0 | 0 | 0 | 0 | 111 | Y20 V42 G53 | Y20-S51 WeakPolarHBondContact CD1-O 3.3Å; Y20-S51 WeakPolarHBondContact O-CB 3.49Å; V42-S51 WeakPolarHBondContact CG1-OG 3.3Å; S51-G53 PolarHBondContact O-N 2.95Å; S51-G53 PolarHBondContact OG-N 2.81Å; S51-G53 VanDerWaalsContact OG-N 3.14Å |
| 52 | R | 95.8 | Very high | 96 | Very high | 150 Ų | 150 | 70.2 Ų | 70.2 | 57% | 0.566 | 35% | 0.345 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.1 | -0.6 | 173 | -61.1 | -173.4 | 68.8 | -176.6 | -0.8 | 112.6 | I43 D45 K50 Y54 | I43-R52 WeakPolarHBondContact O-CB 3.44Å; I43-R52 PolarHBondContact O-N 2.76Å; D45-R52 HydrophobicContact CB-CG 4.23Å; K50-R52 PolarHBondContact O-N 2.75Å; R52-Y54 VanDerWaalsContact C-N 3.34Å; R52-Y54 HydrophobicContact CB-CD1 3.62Å; R52-Y54 HydrophobicContact CB-CE1 3.38Å; R52-Y54 HydrophobicContact CG-CE1 4.18Å; R52-Y54 PolarHBondContact NH1-OH 2.9Å |
| 53 | G | 95.8 | Very high | 95.9 | Very high | 8 Ų | 8 | 72 Ų | 72 | 8% | 0.082 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 76.8 | 19.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | G17 L18 S51 | G17-G53 PolarHBondContact N-O 3.06Å; L18-G53 PolarHBondContact N-O 3.26Å; S51-G53 PolarHBondContact O-N 2.95Å; S51-G53 PolarHBondContact OG-N 2.81Å; S51-G53 VanDerWaalsContact OG-N 3.14Å |
| 54 | Y | 96.9 | Very high | 95.9 | Very high | 55 Ų | 55 | 69.7 Ų | 69.7 | 22% | 0.216 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.3 | 158.9 | 172.1 | 73.1 | -87.7 | 0 | 0 | 0 | 111.5 | F14 V15 I43 R52 F56 | F14-Y54 AromaticContact CE2-CD2 3.95Å; F14-Y54 HydrophobicContact CE2-CD2 3.95Å; F14-Y54 HydrophobicContact CE2-CG 4.23Å; V15-Y54 CarbonylContact O-C 3.56Å; V15-Y54 WeakPolarHBondContact O-CA 3.5Å; V15-Y54 WeakPolarHBondContact O-CB 3.32Å; I43-Y54 HydrophobicContact CB-CD2 4.13Å; I43-Y54 HydrophobicContact CB-CE1 4.34Å; I43-Y54 HydrophobicContact CB-CE2 3.65Å; I43-Y54 HydrophobicContact CG1-CD2 3.94Å; I43-Y54 HydrophobicContact CG1-CE2 3.48Å; I43-Y54 VanDerWaalsContact CG1-CE2 3.48Å; I43-Y54 HydrophobicContact CG2-CE1 4.4Å; I43-Y54 HydrophobicContact CG2-CE2 4.04Å; I43-Y54 WeakPolarHBondContact CG2-OH 3.3Å; I43-Y54 PolarHBondContact N-O 3.21Å; R52-Y54 VanDerWaalsContact C-N 3.34Å; R52-Y54 HydrophobicContact CB-CD1 3.62Å; R52-Y54 HydrophobicContact CB-CE1 3.38Å; R52-Y54 HydrophobicContact CG-CE1 4.18Å; R52-Y54 PolarHBondContact NH1-OH 2.9Å; Y54-F56 HydrophobicContact CD2-CE2 4.29Å; Y54-F56 HydrophobicContact CE2-CE2 4.02Å |
| 55 | G | 97 | Very high | 95.9 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.6 | 177.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V15 V41 | V15-G55 PolarHBondContact N-O 3.45Å; V15-G55 PolarHBondContact O-N 2.81Å; V41-G55 CarbonylContact O-C 3.47Å; V41-G55 WeakPolarHBondContact O-CA 3.25Å |
| 56 | F | 97.3 | Very high | 95.9 | Very high | 52 Ų | 52 | 68 Ų | 68 | 23% | 0.228 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 141.4 | 174.2 | -64.7 | -81.5 | 0 | 0 | 0 | 110.4 | K12 I13 F14 V41 I43 Y54 A86 | K12-F56 HydrophobicContact CG-CD1 4.49Å; I13-F56 VanDerWaalsContact O-CA 3.3Å; I13-F56 WeakPolarHBondContact O-CA 3.42Å; F14-F56 HydrophobicContact CB-CD1 4.42Å; F14-F56 HydrophobicContact CB-CE1 4.2Å; F14-F56 HydrophobicContact CD2-CD1 4.5Å; F14-F56 AromaticContact CD2-CE1 3.86Å; F14-F56 HydrophobicContact CD2-CE1 3.86Å; F14-F56 HydrophobicContact CD2-CZ 4.15Å; V41-F56 HydrophobicContact CG2-CB 4.05Å; V41-F56 PolarHBondContact N-O 3.14Å; V41-F56 PolarHBondContact O-N 2.91Å; I43-F56 HydrophobicContact CD1-CD2 4.15Å; I43-F56 HydrophobicContact CD1-CE2 4.44Å; I43-F56 HydrophobicContact CG1-CD2 4.06Å; I43-F56 HydrophobicContact CG1-CE2 4.09Å; Y54-F56 HydrophobicContact CD2-CE2 4.29Å; Y54-F56 HydrophobicContact CE2-CE2 4.02Å; F56-A86 HydrophobicContact CD1-CB 4.18Å; F56-A86 HydrophobicContact CE1-CB 4.18Å |
| 57 | V | 97.5 | Very high | 96 | Very high | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.5 | 126.6 | 173.8 | -173.3 | 0 | 0 | 0 | 0 | 108.4 | K12 I13 V15 L27 F31 I37 E39 M59 | K12-V57 CarbonylContact C-O 3.51Å; K12-V57 WeakPolarHBondContact CA-O 3.25Å; I13-V57 HydrophobicContact CB-CB 4.35Å; I13-V57 PolarHBondContact N-O 3.18Å; I13-V57 PolarHBondContact O-N 2.97Å; V15-V57 HydrophobicContact CG2-CG2 4.01Å; L27-V57 HydrophobicContact CD2-CG2 3.22Å; L27-V57 HydrophobicContact CG-CG2 4.15Å; F31-V57 HydrophobicContact CB-CG1 4.09Å; F31-V57 HydrophobicContact CD2-CG2 3.71Å; F31-V57 HydrophobicContact CE2-CG2 3.95Å; F31-V57 HydrophobicContact CG-CG1 4.17Å; F31-V57 HydrophobicContact CG-CG2 4.1Å; I37-V57 HydrophobicContact CG1-CG1 4.4Å; I37-V57 HydrophobicContact CG2-CG1 4.11Å; E39-V57 CarbonylContact O-C 3.58Å; E39-V57 WeakPolarHBondContact O-CA 3.48Å; V57-M59 HydrophobicContact CG1-SD 3.57Å; V57-M59 VanDerWaalsContact CG1-SD 3.57Å |
| 58 | T | 96.8 | Very high | 96 | Very high | 4 Ų | 4 | 54.4 Ų | 54.4 | 3% | 0.025 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.3 | 112.5 | 171.9 | -51.8 | 0 | 0 | 0 | 0 | 107.3 | T8 E38 E39 | T8-T58 HydrophobicContact CG2-CG2 3.75Å; E38-T58 HydrophobicContact CB-CG2 4.17Å; E38-T58 WeakPolarHBondContact CB-O 3.37Å; E38-T58 HydrophobicContact CG-CG2 4.49Å; E38-T58 PolarHBondContact N-O 3.22Å; E39-T58 PolarHBondContact N-O 2.99Å; E39-T58 PolarHBondContact O-N 3.44Å |
| 59 | M | 97.3 | Very high | 96 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 26% | 0.264 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | 151.6 | 174.7 | -54.3 | -55.1 | -67.9 | 0 | 0 | 110.3 | T11 I13 F31 F34 G35 I37 V57 D61 A64 A65 | T11-M59 VanDerWaalsContact CB-O 3.3Å; T11-M59 WeakPolarHBondContact CB-O 3.43Å; T11-M59 PolarHBondContact O-N 2.76Å; I13-M59 HydrophobicContact CD1-CG 3.63Å; I13-M59 HydrophobicContact CD1-SD 4.13Å; I13-M59 HydrophobicContact CG1-CG 4.44Å; F31-M59 HydrophobicContact CB-SD 4.41Å; F34-M59 HydrophobicContact CB-CE 4.4Å; G35-M59 WeakPolarHBondContact O-CE 3.35Å; I37-M59 HydrophobicContact CG1-CE 4.01Å; I37-M59 HydrophobicContact CG1-SD 4.02Å; V57-M59 HydrophobicContact CG1-SD 3.57Å; V57-M59 VanDerWaalsContact CG1-SD 3.57Å; M59-D61 VanDerWaalsContact C-N 3.35Å; M59-A64 HydrophobicContact CB-CB 4.15Å; M59-A64 HydrophobicContact CE-CB 3.79Å; M59-A64 HydrophobicContact CG-CB 4.42Å; M59-A65 HydrophobicContact CB-CB 4.16Å; M59-A65 HydrophobicContact CG-CB 3.87Å |
| 60 | A | 95.8 | Very high | 96 | Very high | 48 Ų | 48 | 57.6 Ų | 57.6 | 40% | 0.397 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -67 | -39.9 | 173 | 0 | 0 | 0 | 0 | 0 | 111.4 | D36 | D36-A60 HydrophobicContact CB-CB 3.87Å; D36-A60 WeakPolarHBondContact O-CB 3.42Å; D36-A60 PolarHBondContact O-N 3.46Å |
| 61 | D | 95.4 | Very high | 96 | Very high | 92 Ų | 92 | 55.4 Ų | 55.4 | 49% | 0.492 | 27% | 0.268 | S | S | . | . | S | Bend | trans | -110.9 | 143.3 | -178.5 | -67.5 | -60.9 | 0 | 0 | 0 | 112.7 | M59 A63 A64 A65 | M59-D61 VanDerWaalsContact C-N 3.35Å; D61-A63 VanDerWaalsContact C-N 3.31Å; D61-A63 PolarHBondContact O-N 3.44Å; D61-A64 HydrophobicContact CB-CB 4.12Å; D61-A64 WeakPolarHBondContact O-CB 3.38Å; D61-A64 PolarHBondContact O-N 3.34Å; D61-A65 PolarHBondContact O-N 3.34Å |
| 62 | R | 95.2 | Very high | 95.9 | Very high | 136 Ų | 136 | 57.5 Ų | 57.5 | 51% | 0.513 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60.7 | -40.9 | 170.7 | 176.2 | 179.2 | 165.8 | 175.2 | -2.1 | 111.9 | T11 A64 A65 E66 | T11-R62 HydrophobicContact CG2-CB 4.4Å; R62-A64 VanDerWaalsContact C-N 3.27Å; R62-A64 PolarHBondContact O-N 3.37Å; R62-A65 PolarHBondContact O-N 3.44Å; R62-A65 VanDerWaalsContact O-N 3.12Å; R62-E66 HydrophobicContact CG-CG 4.48Å; R62-E66 IonicContact CZ-OE1 3.33Å; R62-E66 IonicContact NE-OE1 2.77Å; R62-E66 PolarHBondContact NE-OE1 3.01Å; R62-E66 IonicContact NH2-OE1 3Å; R62-E66 PolarHBondContact NH2-OE1 2.96Å; R62-E66 PolarHBondContact O-N 3.36Å |
| 63 | A | 96 | Very high | 95.9 | Very high | 59 Ų | 59 | 54.4 Ų | 54.4 | 49% | 0.488 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62 | -36.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | D61 E66 R67 | D61-A63 VanDerWaalsContact C-N 3.31Å; D61-A63 PolarHBondContact O-N 3.44Å; A63-E66 PolarHBondContact O-N 3.12Å; A63-R67 WeakPolarHBondContact O-CG 2.99Å; A63-R67 PolarHBondContact O-N 3.24Å |
| 64 | A | 96.5 | Very high | 95.9 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.4 | -40.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F34 M59 D61 R62 R67 A68 | F34-A64 VanDerWaalsContact O-CB 3.28Å; F34-A64 WeakPolarHBondContact O-CB 3.35Å; M59-A64 HydrophobicContact CB-CB 4.15Å; M59-A64 HydrophobicContact CE-CB 3.79Å; M59-A64 HydrophobicContact CG-CB 4.42Å; D61-A64 HydrophobicContact CB-CB 4.12Å; D61-A64 WeakPolarHBondContact O-CB 3.38Å; D61-A64 PolarHBondContact O-N 3.34Å; R62-A64 VanDerWaalsContact C-N 3.27Å; R62-A64 PolarHBondContact O-N 3.37Å; A64-R67 PolarHBondContact O-N 3.41Å; A64-A68 WeakPolarHBondContact O-CB 3.4Å; A64-A68 PolarHBondContact O-N 3.36Å |
| 65 | A | 96.5 | Very high | 95.8 | Very high | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -66 | -39.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y10 I13 M59 D61 R62 A68 C69 L85 | Y10-A65 WeakPolarHBondContact O-CB 3.14Å; I13-A65 HydrophobicContact CD1-CB 4.02Å; I13-A65 HydrophobicContact CG1-CB 4.1Å; M59-A65 HydrophobicContact CB-CB 4.16Å; M59-A65 HydrophobicContact CG-CB 3.87Å; D61-A65 PolarHBondContact O-N 3.34Å; R62-A65 PolarHBondContact O-N 3.44Å; R62-A65 VanDerWaalsContact O-N 3.12Å; A65-A68 PolarHBondContact O-N 3.12Å; A65-C69 WeakPolarHBondContact O-CB 3.46Å; A65-C69 PolarHBondContact O-N 3.16Å; A65-C69 PolarHBondContact O-SG 2.91Å; A65-L85 HydrophobicContact CB-CD2 4.4Å |
| 66 | E | 95.5 | Very high | 95.6 | Very high | 94 Ų | 94 | 57.5 Ų | 57.5 | 44% | 0.439 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.4 | -40.3 | 174.6 | -70.8 | 176.9 | -177.8 | 0 | 0 | 111.7 | R62 A63 C69 K70 | R62-E66 HydrophobicContact CG-CG 4.48Å; R62-E66 IonicContact CZ-OE1 3.33Å; R62-E66 IonicContact NE-OE1 2.77Å; R62-E66 PolarHBondContact NE-OE1 3.01Å; R62-E66 IonicContact NH2-OE1 3Å; R62-E66 PolarHBondContact NH2-OE1 2.96Å; R62-E66 PolarHBondContact O-N 3.36Å; A63-E66 PolarHBondContact O-N 3.12Å; E66-C69 PolarHBondContact O-N 3.09Å; E66-K70 PolarHBondContact O-N 3.33Å; E66-K70 VanDerWaalsContact O-N 3.12Å |
| 67 | R | 96.1 | Very high | 95.4 | Very high | 141 Ų | 141 | 58.7 Ų | 58.7 | 53% | 0.532 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -61.3 | -44.6 | 173.2 | -72.9 | -170 | -64 | -155.6 | -2 | 112.2 | F34 A63 A64 C69 K70 | F34-R67 HydrophobicContact CB-CB 4.46Å; F34-R67 HydrophobicContact CD1-CB 4.24Å; F34-R67 VanDerWaalsContact O-CZ 3.22Å; F34-R67 PolarHBondContact O-NE 2.86Å; F34-R67 VanDerWaalsContact O-NE 3.16Å; F34-R67 PolarHBondContact O-NH2 3.2Å; A63-R67 WeakPolarHBondContact O-CG 2.99Å; A63-R67 PolarHBondContact O-N 3.24Å; A64-R67 PolarHBondContact O-N 3.41Å; R67-C69 VanDerWaalsContact C-N 3.3Å; R67-C69 PolarHBondContact O-N 3.34Å; R67-K70 VanDerWaalsContact O-CB 3.25Å; R67-K70 WeakPolarHBondContact O-CB 3.4Å; R67-K70 PolarHBondContact O-N 3.22Å |
| 68 | A | 95.4 | Very high | 95.3 | Very high | 4 Ų | 4 | 62.2 Ų | 62.2 | 3% | 0.033 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -67 | -29.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | I13 F31 F34 A64 A65 | I13-A68 HydrophobicContact CD1-CB 3.7Å; F31-A68 HydrophobicContact CD1-CB 3.86Å; F31-A68 HydrophobicContact CE1-CB 3.97Å; F34-A68 HydrophobicContact CB-CB 4.16Å; F34-A68 HydrophobicContact CD2-CB 3.77Å; F34-A68 HydrophobicContact CE2-CB 4.3Å; F34-A68 HydrophobicContact CG-CB 3.91Å; A64-A68 WeakPolarHBondContact O-CB 3.4Å; A64-A68 PolarHBondContact O-N 3.36Å; A65-A68 PolarHBondContact O-N 3.12Å |
| 69 | C | 94.9 | Very high | 95.2 | Very high | 31 Ų | 31 | 67.1 Ų | 67.1 | 21% | 0.209 | 36% | 0.357 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.4 | -3.6 | 176.4 | -62.4 | 0 | 0 | 0 | 0 | 113.7 | A65 E66 R67 D71 | A65-C69 WeakPolarHBondContact O-CB 3.46Å; A65-C69 PolarHBondContact O-N 3.16Å; A65-C69 PolarHBondContact O-SG 2.91Å; E66-C69 PolarHBondContact O-N 3.09Å; R67-C69 VanDerWaalsContact C-N 3.3Å; R67-C69 PolarHBondContact O-N 3.34Å; C69-D71 VanDerWaalsContact C-N 3.29Å; C69-D71 PolarHBondContact O-N 2.84Å |
| 70 | K | 95.1 | Very high | 95.2 | Very high | 171 Ų | 171 | 74.3 Ų | 74.3 | 74% | 0.743 | 39% | 0.388 | S | S | * | . | S | Bend | trans | -62 | -39.5 | 179.5 | -172.1 | 173.1 | -178.9 | 179.5 | 0 | 111.7 | E66 R67 P72 | E66-K70 PolarHBondContact O-N 3.33Å; E66-K70 VanDerWaalsContact O-N 3.12Å; R67-K70 VanDerWaalsContact O-CB 3.25Å; R67-K70 WeakPolarHBondContact O-CB 3.4Å; R67-K70 PolarHBondContact O-N 3.22Å; K70-P72 VanDerWaalsContact O-CD 3.32Å; K70-P72 WeakPolarHBondContact O-CD 3.49Å |
| 71 | D | 93.6 | Very high | 95.2 | Very high | 103 Ų | 103 | 72.1 Ų | 72.1 | 55% | 0.551 | 37% | 0.37 | S | S | * | . | S | Bend | trans | -102.4 | 98.7 | 172.6 | -64.4 | -44 | 0 | 0 | 0 | 109 | C69 N73 P74 | C69-D71 VanDerWaalsContact C-N 3.29Å; C69-D71 PolarHBondContact O-N 2.84Å; D71-N73 PolarHBondContact O-N 2.83Å; D71-P74 WeakPolarHBondContact O-CD 3.49Å |
| 72 | P | 93.7 | Very high | 95.3 | Very high | 59 Ų | 59 | 70.8 Ų | 70.8 | 38% | 0.383 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -70.1 | -13.4 | -175 | 27.3 | -35.9 | 0 | 0 | 0 | 113.5 | K70 P74 N82 V83 | K70-P72 VanDerWaalsContact O-CD 3.32Å; K70-P72 WeakPolarHBondContact O-CD 3.49Å; P72-P74 VanDerWaalsContact C-CD 3.49Å; P72-N82 CarbonylContact O-C 3.46Å; P72-N82 VanDerWaalsContact O-CA 3.32Å; P72-N82 WeakPolarHBondContact O-CA 3.33Å; P72-V83 PolarHBondContact O-N 3.32Å |
| 73 | N | 95.7 | Very high | 95.3 | Very high | 86 Ų | 86 | 64.4 Ų | 64.4 | 46% | 0.46 | 34% | 0.339 | S | S | . | . | S | Bend | trans | -129.1 | 63.7 | -176.6 | -58.7 | 120.1 | 0 | 0 | 0 | 113.9 | D71 K80 A81 | D71-N73 PolarHBondContact O-N 2.83Å; N73-K80 HydrophobicContact CB-CD 4.2Å; N73-K80 HydrophobicContact CB-CG 4.18Å; N73-A81 VanDerWaalsContact CA-O 3.3Å; N73-A81 WeakPolarHBondContact CA-O 3.41Å |
| 74 | P | 95.5 | Very high | 95.3 | Very high | 12 Ų | 12 | 64.7 Ų | 64.7 | 8% | 0.078 | 33% | 0.332 | C | S | . | . | trans | -71.4 | 158.1 | 177.6 | 27.5 | -28.9 | 0 | 0 | 0 | 112.1 | Y30 D71 P72 I76 A81 V83 | Y30-P74 HydrophobicContact CE1-CB 3.99Å; Y30-P74 HydrophobicContact CE1-CG 4.35Å; Y30-P74 WeakPolarHBondContact OH-CB 3.02Å; D71-P74 WeakPolarHBondContact O-CD 3.49Å; P72-P74 VanDerWaalsContact C-CD 3.49Å; P74-I76 HydrophobicContact CB-CG1 4.48Å; P74-I76 HydrophobicContact CG-CD1 4.39Å; P74-I76 HydrophobicContact CG-CG1 4.49Å; P74-A81 HydrophobicContact CG-CB 4.37Å; P74-A81 PolarHBondContact O-N 2.85Å; P74-V83 HydrophobicContact CG-CB 4.43Å; P74-V83 HydrophobicContact CG-CG2 3.4Å | ||
| 75 | I | 95.3 | Very high | 95.3 | Very high | 114 Ų | 114 | 66 Ų | 66 | 59% | 0.585 | 34% | 0.339 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 114.5 | 170.5 | -59.3 | 176.1 | 0 | 0 | 0 | 108.2 | R79 | I75-R79 WeakPolarHBondContact CA-O 3.37Å |
| 76 | I | 93.9 | Very high | 95.2 | Very high | 2 Ų | 2 | 66.6 Ų | 66.6 | 1% | 0.01 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 126.4 | 179.1 | -55.4 | 177.1 | 0 | 0 | 0 | 107.7 | V15 L18 Y30 F31 P74 G78 R79 A81 | V15-I76 HydrophobicContact CG1-CD1 3.92Å; L18-I76 HydrophobicContact CD2-CB 4.25Å; L18-I76 HydrophobicContact CD2-CD1 3.9Å; L18-I76 HydrophobicContact CD2-CG2 4.11Å; Y30-I76 HydrophobicContact CD1-CD1 3.78Å; Y30-I76 HydrophobicContact CD1-CG1 3.88Å; Y30-I76 HydrophobicContact CD2-CG1 4.14Å; Y30-I76 HydrophobicContact CE1-CD1 3.96Å; Y30-I76 HydrophobicContact CE1-CG1 3.87Å; Y30-I76 HydrophobicContact CE2-CG1 4.14Å; Y30-I76 HydrophobicContact CG-CD1 4.27Å; Y30-I76 HydrophobicContact CG-CG1 4.03Å; F31-I76 HydrophobicContact CE2-CD1 4.07Å; F31-I76 HydrophobicContact CZ-CD1 4.4Å; P74-I76 HydrophobicContact CB-CG1 4.48Å; P74-I76 HydrophobicContact CG-CD1 4.39Å; P74-I76 HydrophobicContact CG-CG1 4.49Å; I76-G78 PolarHBondContact O-N 2.77Å; I76-G78 VanDerWaalsContact O-N 3.09Å; I76-R79 PolarHBondContact N-O 3.01Å; I76-R79 PolarHBondContact O-N 2.91Å; I76-A81 HydrophobicContact CD1-CB 3.89Å; I76-A81 HydrophobicContact CG1-CB 4.14Å |
| 77 | D | 92.7 | Very high | 95.1 | Very high | 76 Ų | 76 | 67.1 Ų | 67.1 | 41% | 0.406 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.1 | 36.2 | -178.6 | -60.9 | -34.4 | 0 | 0 | 0 | 113.4 | P19 T22 R79 | P19-D77 HydrophobicContact CG-CB 3.91Å; T22-D77 WeakPolarHBondContact CB-OD2 3.48Å; T22-D77 WeakPolarHBondContact CG2-OD2 3.28Å; T22-D77 PolarHBondContact OG1-OD2 3.22Å; D77-R79 PolarHBondContact O-N 2.85Å |
| 78 | G | 94.3 | Very high | 94.9 | Very high | 74 Ų | 74 | 65.5 Ų | 65.5 | 76% | 0.763 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.9 | 6.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | I76 | I76-G78 PolarHBondContact O-N 2.77Å; I76-G78 VanDerWaalsContact O-N 3.09Å |
| 79 | R | 95.6 | Very high | 94.6 | Very high | 108 Ų | 108 | 68.3 Ų | 68.3 | 41% | 0.408 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 140.8 | 173.8 | -177 | 179.3 | -77.8 | -170.5 | -7.8 | 111 | G17 L18 P19 I75 I76 D77 A81 | G17-R79 WeakPolarHBondContact O-CD 3.33Å; G17-R79 WeakPolarHBondContact O-CG 3.12Å; L18-R79 PolarHBondContact O-NH1 3.41Å; P19-R79 HydrophobicContact CG-CB 3.53Å; P19-R79 HydrophobicContact CG-CG 4.44Å; I75-R79 WeakPolarHBondContact CA-O 3.37Å; I76-R79 PolarHBondContact N-O 3.01Å; I76-R79 PolarHBondContact O-N 2.91Å; D77-R79 PolarHBondContact O-N 2.85Å; R79-A81 PolarHBondContact O-N 3.35Å |
| 80 | K | 96.8 | Very high | 94 | Very high | 150 Ų | 150 | 69.9 Ų | 69.9 | 65% | 0.652 | 39% | 0.388 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -68.4 | 114.3 | 173.3 | -170.8 | 172 | 68.1 | 176 | 0 | 109.9 | N73 | N73-K80 HydrophobicContact CB-CD 4.2Å; N73-K80 HydrophobicContact CB-CG 4.18Å |
| 81 | A | 96.7 | Very high | 93.3 | Very high | 3 Ų | 3 | 70.3 Ų | 70.3 | 3% | 0.025 | 39% | 0.391 | C | S | . | . | trans | -92.4 | 170.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | V15 G16 L18 N73 P74 I76 R79 | V15-A81 HydrophobicContact CG1-CB 4.43Å; G16-A81 CarbonylContact O-C 3.45Å; G16-A81 WeakPolarHBondContact O-CA 3.26Å; G16-A81 VanDerWaalsContact O-CB 3.3Å; G16-A81 WeakPolarHBondContact O-CB 3.37Å; L18-A81 HydrophobicContact CD2-CB 4.49Å; N73-A81 VanDerWaalsContact CA-O 3.3Å; N73-A81 WeakPolarHBondContact CA-O 3.41Å; P74-A81 HydrophobicContact CG-CB 4.37Å; P74-A81 PolarHBondContact O-N 2.85Å; I76-A81 HydrophobicContact CD1-CB 3.89Å; I76-A81 HydrophobicContact CG1-CB 4.14Å; R79-A81 PolarHBondContact O-N 3.35Å | ||
| 82 | N | 96.1 | Very high | 92.3 | Very high | 64 Ų | 64 | 70.9 Ų | 70.9 | 34% | 0.342 | 40% | 0.4 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.6 | 127.8 | 171.5 | -178.6 | -38.2 | 0 | 0 | 0 | 108.5 | V15 G16 P72 N84 | V15-N82 CarbonylContact C-O 3.53Å; V15-N82 WeakPolarHBondContact CA-O 3.31Å; G16-N82 PolarHBondContact N-O 2.8Å; G16-N82 PolarHBondContact O-N 3.41Å; P72-N82 CarbonylContact O-C 3.46Å; P72-N82 VanDerWaalsContact O-CA 3.32Å; P72-N82 WeakPolarHBondContact O-CA 3.33Å; N82-N84 PolarHBondContact OD1-ND2 2.82Å |
| 83 | V | 96.7 | Very high | 90.9 | Very high | 1 Ų | 1 | 79.3 Ų | 79.3 | 1% | 0.006 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 129.6 | -177.5 | -177.5 | 0 | 0 | 0 | 0 | 109.5 | I13 F14 V15 F31 P72 P74 | I13-V83 HydrophobicContact CG2-CG1 3.27Å; F14-V83 WeakPolarHBondContact O-CA 3.31Å; V15-V83 HydrophobicContact CG1-CG2 4.25Å; F31-V83 HydrophobicContact CE1-CG1 4.25Å; F31-V83 HydrophobicContact CE1-CG2 4.49Å; F31-V83 HydrophobicContact CZ-CG1 4.4Å; F31-V83 HydrophobicContact CZ-CG2 4Å; P72-V83 PolarHBondContact O-N 3.32Å; P74-V83 HydrophobicContact CG-CB 4.43Å; P74-V83 HydrophobicContact CG-CG2 3.4Å |
| 84 | N | 96 | Very high | 89.2 | Confident | 66 Ų | 66 | 82.3 Ų | 82.3 | 35% | 0.353 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.4 | 155.9 | 177.8 | -85.9 | -64.6 | 0 | 0 | 0 | 110.6 | I13 F14 N82 A86 L88 | I13-N84 CarbonylContact C-O 3.58Å; I13-N84 WeakPolarHBondContact CA-O 3.44Å; F14-N84 PolarHBondContact N-O 2.76Å; F14-N84 PolarHBondContact O-N 3.06Å; N82-N84 PolarHBondContact OD1-ND2 2.82Å; N84-A86 PolarHBondContact O-N 2.81Å; N84-L88 HydrophobicContact CB-CD1 4.49Å |
| 85 | L | 95.5 | Very high | 87.3 | Confident | 26 Ų | 26 | 89.5 Ų | 89.5 | 14% | 0.136 | 47% | 0.473 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.2 | 130.6 | 169.6 | -67 | 172.5 | 0 | 0 | 0 | 109.6 | A65 Y87 L88 | A65-L85 HydrophobicContact CB-CD2 4.4Å; L85-Y87 HydrophobicContact CB-CD1 3.58Å; L85-Y87 HydrophobicContact CB-CE1 3.39Å; L85-Y87 HydrophobicContact CD1-CD1 4.44Å; L85-Y87 HydrophobicContact CD1-CE1 3.55Å; L85-Y87 HydrophobicContact CG-CE1 4.06Å; L85-Y87 PolarHBondContact O-N 3.47Å; L85-Y87 VanDerWaalsContact O-N 3.14Å; L85-L88 HydrophobicContact CB-CD1 4.16Å; L85-L88 HydrophobicContact CB-CG 4.39Å; L85-L88 VanDerWaalsContact O-CB 3.31Å; L85-L88 WeakPolarHBondContact O-CB 3.33Å; L85-L88 PolarHBondContact O-N 3.49Å |
| 86 | A | 94.9 | Very high | 85.1 | Confident | 13 Ų | 13 | 92.1 Ų | 92.1 | 11% | 0.107 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -63.7 | -27.2 | -167.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | K12 F14 F56 N84 L88 G89 A90 | K12-A86 HydrophobicContact CB-CB 4.08Å; K12-A86 HydrophobicContact CD-CB 4.23Å; K12-A86 HydrophobicContact CG-CB 3.74Å; K12-A86 WeakPolarHBondContact O-CB 3.48Å; K12-A86 PolarHBondContact O-N 2.72Å; F14-A86 HydrophobicContact CB-CB 4.35Å; F56-A86 HydrophobicContact CD1-CB 4.18Å; F56-A86 HydrophobicContact CE1-CB 4.18Å; N84-A86 PolarHBondContact O-N 2.81Å; A86-L88 PolarHBondContact O-N 3.26Å; A86-G89 PolarHBondContact O-N 3.22Å; A86-A90 WeakPolarHBondContact O-CB 3.04Å; A86-A90 PolarHBondContact O-N 3.08Å |
| 87 | Y | 93.2 | Very high | 83.1 | Confident | 106 Ų | 106 | 97.4 Ų | 97.4 | 42% | 0.416 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.5 | -25.6 | 176.3 | 79.2 | -94 | 0 | 0 | 0 | 112.9 | T9 Y10 L85 | T9-Y87 HydrophobicContact CG2-CD1 4.13Å; T9-Y87 HydrophobicContact CG2-CG 4.06Å; T9-Y87 VanDerWaalsContact O-CD1 3.26Å; T9-Y87 WeakPolarHBondContact O-CD1 3.4Å; Y10-Y87 HydrophobicContact CD1-CE1 4.26Å; Y10-Y87 HydrophobicContact CE1-CE1 4.35Å; L85-Y87 HydrophobicContact CB-CD1 3.58Å; L85-Y87 HydrophobicContact CB-CE1 3.39Å; L85-Y87 HydrophobicContact CD1-CD1 4.44Å; L85-Y87 HydrophobicContact CD1-CE1 3.55Å; L85-Y87 HydrophobicContact CG-CE1 4.06Å; L85-Y87 PolarHBondContact O-N 3.47Å; L85-Y87 VanDerWaalsContact O-N 3.14Å |
| 88 | L | 91.9 | Very high | 81.1 | Confident | 106 Ų | 106 | 97.3 Ų | 97.3 | 56% | 0.555 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -69.5 | -34.6 | 179.1 | -64.1 | 169.9 | 0 | 0 | 0 | 112.2 | N84 L85 A86 | N84-L88 HydrophobicContact CB-CD1 4.49Å; L85-L88 HydrophobicContact CB-CD1 4.16Å; L85-L88 HydrophobicContact CB-CG 4.39Å; L85-L88 VanDerWaalsContact O-CB 3.31Å; L85-L88 WeakPolarHBondContact O-CB 3.33Å; L85-L88 PolarHBondContact O-N 3.49Å; A86-L88 PolarHBondContact O-N 3.26Å |
| 89 | G | 87.9 | Confident | 78.7 | Confident | 63 Ų | 63 | 102.2 Ų | 102.2 | 65% | 0.649 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -101.7 | -7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | A86 K91 | A86-G89 PolarHBondContact O-N 3.22Å; G89-K91 PolarHBondContact O-N 3.42Å |
| 90 | A | 84.2 | Confident | 76.5 | Confident | 64 Ų | 64 | 102 Ų | 102 | 53% | 0.529 | 56% | 0.557 | S | S | . | * | S | Bend | trans | -65.1 | 112.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | A86 | A86-A90 WeakPolarHBondContact O-CB 3.04Å; A86-A90 PolarHBondContact O-N 3.08Å |
| 91 | K | 78.4 | Confident | 73.9 | Confident | 181 Ų | 181 | 102.5 Ų | 102.5 | 79% | 0.787 | 56% | 0.559 | S | S | * | * | trans | -47 | 131 | 167.7 | -69.9 | 177.4 | 177.2 | -179.1 | 0 | 107.3 | G89 R93 | G89-K91 PolarHBondContact O-N 3.42Å; K91-R93 PolarHBondContact O-N 2.94Å | ||
| 92 | P | 73.2 | Confident | 71.5 | Confident | 115 Ų | 115 | 106 Ų | 106 | 75% | 0.747 | 60% | 0.595 | S | S | * | * | trans | -54.2 | 110.4 | 176.6 | 21.6 | -30.9 | 0 | 0 | 0 | 106 | I94 | P92-I94 PolarHBondContact O-N 2.97Š| ||
| 93 | R | 64.8 | Low | 69.4 | Low | 235 Ų | 235 | 108.5 Ų | 108.5 | 89% | 0.887 | 61% | 0.612 | S | S | * | * | trans | -70.3 | 88.5 | 168.6 | -69.6 | -154.9 | -137.5 | 162.3 | 6.1 | 103.9 | K91 M95 | K91-R93 PolarHBondContact O-N 2.94Å; R93-M95 PolarHBondContact O-N 3.1Å | ||
| 94 | I | 60.5 | Low | 67.2 | Low | 149 Ų | 149 | 116.2 Ų | 116.2 | 76% | 0.764 | 65% | 0.648 | S | S | * | * | trans | -60.6 | 96 | 153 | -60.8 | 170.6 | 0 | 0 | 0 | 102.3 | P92 Q96 | P92-I94 PolarHBondContact O-N 2.97Å; I94-Q96 PolarHBondContact O-N 3.23Å | ||
| 95 | M | 54.7 | Low | 65.1 | Low | 164 Ų | 164 | 121.8 Ų | 121.8 | 81% | 0.808 | 67% | 0.672 | S | S | * | * | trans | -56.2 | 94 | 168.5 | -171.2 | 98.1 | 133.4 | 0 | 0 | 103.5 | R93 P97 | R93-M95 PolarHBondContact O-N 3.1Å; M95-P97 WeakPolarHBondContact O-CD 3.46Å | ||
| 96 | Q | 50 | Low | 63.2 | Low | 169 Ų | 169 | 127.2 Ų | 127.2 | 79% | 0.79 | 70% | 0.701 | S | S | * | * | trans | -54.1 | 118.4 | 165 | -105.8 | -166.7 | -6.7 | 0 | 0 | 103.7 | I94 G98 | I94-Q96 PolarHBondContact O-N 3.23Å; Q96-G98 PolarHBondContact O-N 3.4Å | ||
| 97 | P | 51 | Low | 61.1 | Low | 112 Ų | 112 | 134.4 Ų | 134.4 | 73% | 0.727 | 73% | 0.732 | S | S | * | * | trans | -62.9 | 100.1 | 167.2 | 25.4 | -27.9 | 0 | 0 | 0 | 104.3 | M95 F99 | M95-P97 WeakPolarHBondContact O-CD 3.46Å; P97-F99 PolarHBondContact O-N 3.46Å | ||
| 98 | G | 51 | Low | 59 | Low | 74 Ų | 74 | 135.6 Ų | 135.6 | 76% | 0.763 | 75% | 0.752 | S | S | * | * | trans | -68.7 | 61.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q96 A100 | Q96-G98 PolarHBondContact O-N 3.4Å; G98-A100 PolarHBondContact O-N 2.99Å; G98-A100 VanDerWaalsContact O-N 3.15Å | ||
| 99 | F | 43.8 | Very low | 57.1 | Low | 177 Ų | 177 | 135 Ų | 135 | 78% | 0.776 | 76% | 0.763 | S | S | * | * | trans | -73.5 | 84.2 | 144.5 | -96.3 | -87.4 | 0 | 0 | 0 | 105.9 | P97 F101 | P97-F99 PolarHBondContact O-N 3.46Å; F99-F101 HydrophobicContact CD1-CB 4.36Å; F99-F101 HydrophobicContact CD1-CD2 4.17Å; F99-F101 HydrophobicContact CE1-CD2 4.48Å; F99-F101 PolarHBondContact O-N 3.09Å | ||
| 100 | A | 50.2 | Low | 55.6 | Low | 105 Ų | 105 | 140 Ų | 140 | 87% | 0.868 | 77% | 0.774 | S | S | * | * | trans | -67.8 | 67.5 | 150.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | G98 | G98-A100 PolarHBondContact O-N 2.99Å; G98-A100 VanDerWaalsContact O-N 3.15Å | ||
| 101 | F | 41.9 | Very low | 54.3 | Low | 159 Ų | 159 | 144.1 Ų | 144.1 | 70% | 0.697 | 79% | 0.786 | S | S | * | * | trans | -87.8 | 112.4 | 162.3 | -143.4 | -92.3 | 0 | 0 | 0 | 105.6 | F99 V103 | F99-F101 HydrophobicContact CD1-CB 4.36Å; F99-F101 HydrophobicContact CD1-CD2 4.17Å; F99-F101 HydrophobicContact CE1-CD2 4.48Å; F99-F101 PolarHBondContact O-N 3.09Å; F101-V103 HydrophobicContact CD1-CG2 4.36Å; F101-V103 PolarHBondContact O-N 3.2Å | ||
| 102 | G | 45.3 | Very low | 53 | Low | 76 Ų | 76 | 144 Ų | 144 | 78% | 0.784 | 79% | 0.788 | S | S | * | * | trans | -57.4 | 104.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 103 | V | 51.8 | Low | 52 | Low | 117 Ų | 117 | 150.1 Ų | 150.1 | 71% | 0.709 | 80% | 0.796 | S | S | * | * | trans | -130.4 | 114.5 | 157.6 | -158.8 | 0 | 0 | 0 | 0 | 104.7 | F101 Q105 | F101-V103 HydrophobicContact CD1-CG2 4.36Å; F101-V103 PolarHBondContact O-N 3.2Å; V103-Q105 PolarHBondContact O-N 3.01Å | ||
| 104 | Q | 51.6 | Low | 51.4 | Low | 163 Ų | 163 | 144 Ų | 144 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -48 | 136.8 | 174.6 | -75 | -172.6 | -9.6 | 0 | 0 | 109.6 | L106 | Q104-L106 PolarHBondContact O-N 3.14Š| ||
| 105 | Q | 51.3 | Low | 51.1 | Low | 184 Ų | 184 | 147.2 Ų | 147.2 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | trans | -55.7 | 91.4 | 157 | -80.6 | -80.3 | 7.2 | 0 | 0 | 107.3 | V103 H107 | V103-Q105 PolarHBondContact O-N 3.01Å; Q105-H107 PolarHBondContact O-N 3.22Å | ||
| 106 | L | 56.4 | Low | 51 | Low | 139 Ų | 139 | 142.5 Ų | 142.5 | 73% | 0.728 | 79% | 0.789 | S | S | * | * | trans | -83.7 | 107 | 179.3 | -133.2 | 140.1 | 0 | 0 | 0 | 105.9 | Q104 | Q104-L106 PolarHBondContact O-N 3.14Š| ||
| 107 | H | 50.8 | Low | 51.2 | Low | 164 Ų | 164 | 142.8 Ų | 142.8 | 76% | 0.759 | 79% | 0.794 | S | S | * | * | trans | -54.3 | 129.4 | 179.4 | -71.5 | 81.1 | 0 | 0 | 0 | 110.4 | Q105 A109 | Q105-H107 PolarHBondContact O-N 3.22Å; H107-A109 VanDerWaalsContact C-N 3.26Å; H107-A109 PolarHBondContact O-N 2.67Å | ||
| 108 | P | 48.2 | Very low | 51.2 | Low | 131 Ų | 131 | 143 Ų | 143 | 85% | 0.851 | 80% | 0.795 | S | S | * | * | trans | -80.1 | 79.8 | 169.6 | 31.3 | -29.4 | 0 | 0 | 0 | 108.7 | ||||
| 109 | A | 53.3 | Low | 51.2 | Low | 95 Ų | 95 | 143.2 Ų | 143.2 | 79% | 0.785 | 79% | 0.79 | S | S | * | * | trans | -89.1 | 108 | 162.6 | 0 | 0 | 0 | 0 | 0 | 108 | H107 | H107-A109 VanDerWaalsContact C-N 3.26Å; H107-A109 PolarHBondContact O-N 2.67Å | ||
| 110 | L | 55.9 | Low | 51.8 | Low | 166 Ų | 166 | 142.8 Ų | 142.8 | 87% | 0.869 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 134.2 | -163 | -157 | 145.1 | 0 | 0 | 0 | 112.4 | Q112 | L110-Q112 PolarHBondContact O-N 3.16Š|
| 111 | I | 57.3 | Low | 51.8 | Low | 152 Ų | 152 | 147.8 Ų | 147.8 | 78% | 0.779 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 120.7 | 173.3 | -78.2 | 162 | 0 | 0 | 0 | 111.1 | ||
| 112 | Q | 51.1 | Low | 52.2 | Low | 179 Ų | 179 | 146.8 Ų | 146.8 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 135.3 | 167.9 | -68.5 | 175.7 | 27.9 | 0 | 0 | 110.9 | L110 | L110-Q112 PolarHBondContact O-N 3.16Š|
| 113 | R | 51.3 | Low | 52.5 | Low | 242 Ų | 242 | 153.5 Ų | 153.5 | 91% | 0.913 | 80% | 0.798 | S | S | * | * | trans | -164.6 | 144.8 | 131.2 | -107 | 168.1 | 146.4 | -122.1 | -11.4 | 111.7 | ||||
| 114 | P | 52.7 | Low | 52.8 | Low | 108 Ų | 108 | 153 Ų | 153 | 70% | 0.701 | 80% | 0.797 | S | S | * | * | trans | -103.8 | 151.9 | -143.7 | 38.2 | -32.4 | 0 | 0 | 0 | 113.1 | ||||
| 115 | F | 52.6 | Low | 52.7 | Low | 216 Ų | 216 | 154 Ų | 154 | 95% | 0.947 | 80% | 0.802 | S | S | * | * | trans | -178.8 | 117.3 | 138.2 | -113.3 | -84.6 | 0 | 0 | 0 | 110.2 | ||||
| 116 | G | 53.9 | Low | 52.9 | Low | 64 Ų | 64 | 149.6 Ų | 149.6 | 66% | 0.66 | 80% | 0.797 | S | S | * | * | trans | 94.6 | 105.9 | 145.9 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 117 | I | 54.5 | Low | 52.8 | Low | 175 Ų | 175 | 151.8 Ų | 151.8 | 90% | 0.897 | 80% | 0.801 | S | S | * | * | trans | 70.7 | 140.4 | 138.6 | 36.7 | 177.5 | 0 | 0 | 0 | 122.5 | ||||
| 118 | P | 50.3 | Low | 52.8 | Low | 116 Ų | 116 | 150.2 Ų | 150.2 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | trans | -129.1 | 167 | -142.6 | 39.7 | -20.6 | 0 | 0 | 0 | 119 | ||||
| 119 | A | 51.5 | Low | 52.8 | Low | 80 Ų | 80 | 151.4 Ų | 151.4 | 66% | 0.661 | 80% | 0.797 | S | S | * | * | trans | 76.1 | 154.7 | 143.2 | 0 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 120 | H | 55.3 | Low | 52.8 | Low | 168 Ų | 168 | 152.5 Ų | 152.5 | 78% | 0.778 | 80% | 0.796 | S | S | * | * | trans | 95 | 122.3 | 167.2 | -56.6 | -75 | 0 | 0 | 0 | 115.4 | ||||
| 121 | Y | 50 | Low | 52.5 | Low | 209 Ų | 209 | 147.8 Ų | 147.8 | 82% | 0.82 | 79% | 0.787 | S | S | * | * | cis | -152.8 | 137.7 | 12.3 | -112.8 | -90.3 | 0 | 0 | 0 | 108.7 | ||||
| 122 | V | 52.2 | Low | 52.3 | Low | 138 Ų | 138 | 147.6 Ų | 147.6 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | trans | -110.6 | 136.6 | 170.5 | 156.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 123 | Y | 51.5 | Low | 52.2 | Low | 217 Ų | 217 | 144.5 Ų | 144.5 | 85% | 0.851 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -100.2 | 150.5 | 172.2 | -129.1 | -103 | 0 | 0 | 0 | 110.8 | ||
| 124 | P | 58.2 | Low | 52.2 | Low | 107 Ų | 107 | 140.2 Ų | 140.2 | 70% | 0.695 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 150.7 | -157.1 | 33.4 | -25.8 | 0 | 0 | 0 | 114.3 | ||
| 125 | Q | 49.2 | Very low | 51.9 | Low | 183 Ų | 183 | 139.9 Ų | 139.9 | 86% | 0.855 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -76 | 140.9 | 168.7 | -76.2 | -94.5 | -43.9 | 0 | 0 | 111.2 | ||
| 126 | A | 54.3 | Low | 52 | Low | 93 Ų | 93 | 137.2 Ų | 137.2 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -84 | 117 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 127 | F | 53.7 | Low | 52 | Low | 184 Ų | 184 | 140.6 Ų | 140.6 | 81% | 0.807 | 78% | 0.775 | S | S | * | * | trans | -10.2 | 139.6 | 146.6 | -75.2 | -106.6 | 0 | 0 | 0 | 115.5 | ||||
| 128 | V | 52.9 | Low | 51.7 | Low | 131 Ų | 131 | 140 Ų | 140 | 79% | 0.794 | 77% | 0.769 | S | S | * | * | -172.5 | 108.3 | 67.4 | 169.9 | 0 | 0 | 0 | 0 | 105.5 | |||||
| 129 | Q | 46.7 | Very low | 51.7 | Low | 157 Ų | 157 | 140.7 Ų | 140.7 | 73% | 0.734 | 77% | 0.773 | S | S | * | * | 54.9 | 157.8 | 76.2 | -70.9 | -77.2 | 15.2 | 0 | 0 | 115.7 | |||||
| 130 | P | 53.1 | Low | 51.4 | Low | 118 Ų | 118 | 142.3 Ų | 142.3 | 77% | 0.766 | 78% | 0.775 | S | S | * | * | cis | -138.5 | 165.6 | -16.4 | 27.6 | -5.8 | 0 | 0 | 0 | 114.1 | ||||
| 131 | G | 49.4 | Very low | 51.1 | Low | 66 Ų | 66 | 138.9 Ų | 138.9 | 68% | 0.68 | 78% | 0.776 | S | S | * | * | trans | 178.4 | 108.7 | 162.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 132 | V | 53.4 | Low | 50.9 | Low | 148 Ų | 148 | 133.8 Ų | 133.8 | 90% | 0.897 | 78% | 0.777 | S | S | * | * | trans | 88.4 | 141.9 | 167.5 | -154.9 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 133 | V | 50.3 | Low | 50.6 | Low | 114 Ų | 114 | 131.7 Ų | 131.7 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | trans | -126.2 | 140.1 | -134.5 | -92.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 134 | I | 49.9 | Very low | 50.2 | Low | 152 Ų | 152 | 126.3 Ų | 126.3 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | trans | 73.5 | 142.8 | 135 | -63.9 | 171.1 | 0 | 0 | 0 | 117.4 | ||||
| 135 | P | 46.3 | Very low | 49.7 | Very low | 101 Ų | 101 | 126.8 Ų | 126.8 | 66% | 0.656 | 78% | 0.78 | S | S | * | * | cis | -141.9 | 178.1 | -24.4 | 37.6 | -18.2 | 0 | 0 | 0 | 115.5 | ||||
| 136 | H | 54.3 | Low | 49.8 | Very low | 160 Ų | 160 | 124.1 Ų | 124.1 | 74% | 0.741 | 78% | 0.777 | S | S | * | * | trans | 109.1 | 121.9 | 136.6 | 101.7 | -61.9 | 0 | 0 | 0 | 120.8 | ||||
| 137 | V | 55.4 | Low | 49.7 | Very low | 136 Ų | 136 | 126.1 Ų | 126.1 | 82% | 0.824 | 78% | 0.78 | S | S | * | * | trans | 75.1 | 118.7 | 152.7 | -56 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 138 | Q | 47.8 | Very low | 49.2 | Very low | 162 Ų | 162 | 122.8 Ų | 122.8 | 76% | 0.757 | 78% | 0.776 | S | S | * | * | trans | -116.3 | 152 | 177.8 | 152.3 | 175.9 | -24.7 | 0 | 0 | 108.2 | T140 | Q138-T140 HydrophobicContact CG-CG2 4.34Š| ||
| 139 | P | 49.7 | Very low | 48.7 | Very low | 131 Ų | 131 | 126.8 Ų | 126.8 | 85% | 0.851 | 78% | 0.779 | S | S | * | * | -151.4 | 177.9 | 101.3 | 33.2 | -9.2 | 0 | 0 | 0 | 116.4 | |||||
| 140 | T | 45.9 | Very low | 49.1 | Very low | 113 Ų | 113 | 124.3 Ų | 124.3 | 69% | 0.693 | 77% | 0.769 | S | S | * | * | trans | -117.7 | 157 | -147.5 | 41.4 | 0 | 0 | 0 | 0 | 116.3 | Q138 | Q138-T140 HydrophobicContact CG-CG2 4.34Š| ||
| 141 | A | 49.4 | Very low | 48.6 | Very low | 97 Ų | 97 | 124.7 Ų | 124.7 | 80% | 0.802 | 77% | 0.765 | S | S | * | * | trans | 91.9 | 133.4 | 134.7 | 0 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 142 | A | 45.4 | Very low | 48.6 | Very low | 102 Ų | 102 | 131.5 Ų | 131.5 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | trans | 71.8 | 147.3 | 140.9 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 143 | A | 46.4 | Very low | 48.6 | Very low | 94 Ų | 94 | 130.1 Ų | 130.1 | 78% | 0.777 | 76% | 0.764 | S | S | * | * | cis | -165.7 | 160 | -2.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 144 | A | 42.3 | Very low | 48.7 | Very low | 104 Ų | 104 | 128.2 Ų | 128.2 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | trans | 40.3 | 124.5 | 147.6 | 0 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 145 | S | 47.9 | Very low | 48.5 | Very low | 116 Ų | 116 | 125.7 Ų | 125.7 | 81% | 0.811 | 77% | 0.769 | S | S | * | * | trans | -157.1 | 120 | 137.5 | 58.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 146 | T | 51.6 | Low | 48.4 | Very low | 127 Ų | 127 | 125.2 Ų | 125.2 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | trans | -22.5 | 139.3 | 157.5 | 44.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 147 | T | 51.3 | Low | 47.9 | Very low | 136 Ų | 136 | 129.3 Ų | 129.3 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | 169.3 | 156.1 | 110.3 | 36.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 148 | P | 44.6 | Very low | 47.5 | Very low | 113 Ų | 113 | 127.2 Ų | 127.2 | 73% | 0.734 | 78% | 0.781 | S | S | * | * | trans | -105.1 | 156.9 | -146.8 | 38.5 | -31.6 | 0 | 0 | 0 | 114.2 | ||||
| 149 | Y | 40.7 | Very low | 47.1 | Very low | 215 Ų | 215 | 126.8 Ų | 126.8 | 84% | 0.843 | 78% | 0.779 | S | S | * | * | trans | -156.1 | 115.2 | 157.4 | -139.8 | -114.4 | 0 | 0 | 0 | 113.9 | ||||
| 150 | I | 55.1 | Low | 46.9 | Very low | 105 Ų | 105 | 130.8 Ų | 130.8 | 54% | 0.538 | 78% | 0.779 | S | S | . | * | trans | 67.8 | 106 | 147.6 | -59.7 | -167 | 0 | 0 | 0 | 119.6 | Y152 | I150-Y152 HydrophobicContact CG2-CD2 3.7Å; I150-Y152 HydrophobicContact CG2-CE2 4.47Å | ||
| 151 | D | 42.6 | Very low | 46.8 | Very low | 126 Ų | 126 | 131.2 Ų | 131.2 | 67% | 0.674 | 79% | 0.786 | S | S | * | * | trans | -73.8 | 131 | 152.2 | -158.3 | -68.1 | 0 | 0 | 0 | 109.3 | T153 | D151-T153 WeakPolarHBondContact OD1-CB 3.27Å; D151-T153 WeakPolarHBondContact OD1-CG2 3.39Å; D151-T153 PolarHBondContact OD1-N 3.3Å; D151-T153 VanDerWaalsContact OD1-N 3.12Å; D151-T153 PolarHBondContact OD1-OG1 3.18Å | ||
| 152 | Y | 51.1 | Low | 46.5 | Very low | 210 Ų | 210 | 131.5 Ų | 131.5 | 82% | 0.824 | 79% | 0.788 | S | S | * | * | trans | -132.1 | 67.9 | 167.7 | -125.4 | -83.6 | 0 | 0 | 0 | 107.8 | I150 | I150-Y152 HydrophobicContact CG2-CD2 3.7Å; I150-Y152 HydrophobicContact CG2-CE2 4.47Å | ||
| 153 | T | 52.8 | Low | 46.4 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 73% | 0.73 | 79% | 0.787 | S | S | * | * | trans | -98.8 | 119.7 | 165.6 | 55.4 | 0 | 0 | 0 | 0 | 109.3 | D151 | D151-T153 WeakPolarHBondContact OD1-CB 3.27Å; D151-T153 WeakPolarHBondContact OD1-CG2 3.39Å; D151-T153 PolarHBondContact OD1-N 3.3Å; D151-T153 VanDerWaalsContact OD1-N 3.12Å; D151-T153 PolarHBondContact OD1-OG1 3.18Å | ||
| 154 | G | 51.4 | Low | 46.2 | Very low | 73 Ų | 73 | 131.5 Ų | 131.5 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | S | Bend | trans | 98.2 | 93.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 155 | A | 47.2 | Very low | 46.1 | Very low | 99 Ų | 99 | 131.4 Ų | 131.4 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | 165.5 | 68.6 | 141.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 156 | A | 44.3 | Very low | 45.8 | Very low | 91 Ų | 91 | 130.6 Ų | 130.6 | 75% | 0.752 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -165.5 | 38.6 | 164.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 157 | Y | 43.5 | Very low | 45.3 | Very low | 247 Ų | 247 | 129.3 Ų | 129.3 | 97% | 0.969 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -140.8 | 60.3 | 170 | -88.5 | -87.2 | 0 | 0 | 0 | 109.1 | ||
| 158 | A | 46.2 | Very low | 44.8 | Very low | 92 Ų | 92 | 127.9 Ų | 127.9 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -162 | 56.8 | 174 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 159 | Q | 40.6 | Very low | 44.6 | Very low | 152 Ų | 152 | 127 Ų | 127 | 71% | 0.71 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -164 | 149.4 | 161.4 | -124.5 | 157.2 | -106.2 | 0 | 0 | 106 | ||
| 160 | Y | 45.1 | Very low | 44.5 | Very low | 216 Ų | 216 | 121.7 Ų | 121.7 | 85% | 0.847 | 80% | 0.795 | S | S | * | * | S | Bend | trans | 76.1 | 36.6 | -178 | -17.5 | -71.5 | 0 | 0 | 0 | 118 | ||
| 161 | S | 43 | Very low | 43.9 | Very low | 121 Ų | 121 | 121.4 Ų | 121.4 | 85% | 0.846 | 81% | 0.808 | S | S | * | * | trans | -142.7 | 44.9 | 150.9 | 72.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 162 | A | 42.8 | Very low | 44 | Very low | 103 Ų | 103 | 119.7 Ų | 119.7 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -115.5 | 16.5 | 166.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 163 | A | 43.4 | Very low | 43.7 | Very low | 100 Ų | 100 | 119.9 Ų | 119.9 | 83% | 0.826 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -131.1 | 48.4 | 179 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 164 | A | 41.9 | Very low | 43.2 | Very low | 96 Ų | 96 | 120.3 Ų | 120.3 | 79% | 0.793 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -141.5 | 8.5 | 166.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 165 | A | 42 | Very low | 42.7 | Very low | 103 Ų | 103 | 123.5 Ų | 123.5 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -98.6 | 16.6 | 177 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 166 | A | 41.3 | Very low | 42.4 | Very low | 99 Ų | 99 | 128.4 Ų | 128.4 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -135.2 | 17.9 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 167 | A | 40.5 | Very low | 42.9 | Very low | 99 Ų | 99 | 129.6 Ų | 129.6 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -125.8 | 29 | 178 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 168 | A | 40.4 | Very low | 42.8 | Very low | 107 Ų | 107 | 128.5 Ų | 128.5 | 88% | 0.884 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -96 | 14.9 | 174 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 169 | A | 39.9 | Very low | 42.9 | Very low | 95 Ų | 95 | 128.8 Ų | 128.8 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -150 | 82.6 | -176.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 170 | A | 40.2 | Very low | 43.2 | Very low | 103 Ų | 103 | 125.6 Ų | 125.6 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | trans | 171.7 | 112.7 | 152.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 171 | A | 42.7 | Very low | 43.6 | Very low | 98 Ų | 98 | 121.1 Ų | 121.1 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | trans | 137.2 | 72 | 162.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 172 | A | 43 | Very low | 44.1 | Very low | 90 Ų | 90 | 121.4 Ų | 121.4 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | 60.4 | 124.7 | 74.3 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 173 | Y | 45.6 | Very low | 44.2 | Very low | 215 Ų | 215 | 121 Ų | 121 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | 83.4 | 96.3 | 171 | -84.5 | -94.3 | 0 | 0 | 0 | 119 | ||||
| 174 | D | 42 | Very low | 44.4 | Very low | 128 Ų | 128 | 121.1 Ų | 121.1 | 68% | 0.684 | 80% | 0.799 | S | S | * | * | 164.1 | 90 | 101.5 | -137.1 | -91.5 | 0 | 0 | 0 | 107.8 | |||||
| 175 | Q | 40.5 | Very low | 44.6 | Very low | 139 Ų | 139 | 121.2 Ų | 121.2 | 65% | 0.65 | 80% | 0.8 | S | S | * | * | 61.4 | 104.6 | 96.5 | -165.7 | 152.2 | -64.2 | 0 | 0 | 113.9 | |||||
| 176 | Y | 40.9 | Very low | 44.6 | Very low | 202 Ų | 202 | 119.5 Ų | 119.5 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | -176.2 | 145 | 118.6 | -90.7 | -71.9 | 0 | 0 | 0 | 110.6 | |||||
| 177 | P | 54.5 | Low | 44.6 | Very low | 116 Ų | 116 | 124.6 Ų | 124.6 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | trans | -104.2 | 155.5 | -144.2 | 38.7 | -35.5 | 0 | 0 | 0 | 116.1 | ||||
| 178 | Y | 42.1 | Very low | 44.7 | Very low | 224 Ų | 224 | 126.5 Ų | 126.5 | 88% | 0.878 | 79% | 0.793 | S | S | * | * | trans | -69.1 | 139.2 | 171.6 | -124.6 | -97.6 | 0 | 0 | 0 | 112.2 | ||||
| 179 | A | 48 | Very low | 44.7 | Very low | 99 Ų | 99 | 128.1 Ų | 128.1 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -96.6 | 123.3 | 157.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 180 | A | 47.4 | Very low | 44.8 | Very low | 85 Ų | 85 | 130 Ų | 130 | 70% | 0.702 | 79% | 0.793 | S | S | * | * | trans | -108 | 139.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 181 | S | 53.4 | Low | 44.9 | Very low | 121 Ų | 121 | 128.7 Ų | 128.7 | 85% | 0.846 | 79% | 0.791 | S | S | * | * | -178.2 | 148.2 | 120.9 | -80.2 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 182 | P | 54.6 | Low | 44.8 | Very low | 127 Ų | 127 | 127.8 Ų | 127.8 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -109.8 | 153.4 | -164.3 | 38.8 | -27.5 | 0 | 0 | 0 | 114.2 | ||||
| 183 | A | 44.9 | Very low | 44.7 | Very low | 95 Ų | 95 | 134.8 Ų | 134.8 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -178.8 | 109.8 | 151.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 184 | A | 46.4 | Very low | 44.7 | Very low | 102 Ų | 102 | 130.1 Ų | 130.1 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | 89.4 | 134.4 | 81.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 185 | A | 46 | Very low | 44.6 | Very low | 99 Ų | 99 | 134.4 Ų | 134.4 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | 89.3 | 126.3 | 165.7 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 186 | G | 42.8 | Very low | 45.1 | Very low | 66 Ų | 66 | 132.8 Ų | 132.8 | 68% | 0.68 | 82% | 0.817 | S | S | * | * | trans | 132.8 | 105.1 | 145.5 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 187 | Y | 41.1 | Very low | 45.2 | Very low | 206 Ų | 206 | 129 Ų | 129 | 81% | 0.808 | 82% | 0.815 | S | S | * | * | trans | -88.3 | 144.4 | -170.4 | -22.5 | -87.6 | 0 | 0 | 0 | 112.8 | ||||
| 188 | V | 42.2 | Very low | 44.7 | Very low | 140 Ų | 140 | 132.1 Ų | 132.1 | 85% | 0.848 | 82% | 0.819 | S | S | * | * | trans | 40.8 | 123.6 | 136.7 | -173 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 189 | T | 40.2 | Very low | 44.9 | Very low | 140 Ų | 140 | 129.6 Ų | 129.6 | 86% | 0.859 | 82% | 0.815 | S | S | * | * | -179.5 | 157.2 | 124.2 | 176.7 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 190 | T | 42.2 | Very low | 45 | Very low | 134 Ų | 134 | 129.4 Ų | 129.4 | 82% | 0.822 | 81% | 0.806 | S | S | * | * | trans | -99.1 | 161 | -156.8 | -166.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 191 | G | 41.8 | Very low | 45.1 | Very low | 77 Ų | 77 | 132.6 Ų | 132.6 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | 105.9 | 125.4 | 142 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 192 | G | 42.2 | Very low | 44.9 | Very low | 79 Ų | 79 | 133.6 Ų | 133.6 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | trans | 153.1 | 95.6 | 155.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 193 | Y | 39.9 | Very low | 44.4 | Very low | 236 Ų | 236 | 131.9 Ų | 131.9 | 93% | 0.925 | 81% | 0.807 | S | S | * | * | trans | -83.4 | 142 | 165.3 | -64.5 | -89.4 | 0 | 0 | 0 | 110.6 | ||||
| 194 | S | 44.8 | Very low | 44.6 | Very low | 117 Ų | 117 | 132.2 Ų | 132.2 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -152.2 | 139.6 | 154.1 | 59.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 195 | Y | 40 | Very low | 44.9 | Very low | 218 Ų | 218 | 132.2 Ų | 132.2 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | trans | -108.7 | 146.2 | -177.3 | 40 | -92 | 0 | 0 | 0 | 109.1 | ||||
| 196 | A | 50.9 | Low | 45.2 | Very low | 105 Ų | 105 | 133.8 Ų | 133.8 | 87% | 0.868 | 81% | 0.812 | S | S | * | * | trans | -148 | 131 | 157.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 197 | V | 44.6 | Very low | 45.3 | Very low | 123 Ų | 123 | 133.7 Ų | 133.7 | 75% | 0.745 | 81% | 0.811 | S | S | * | * | trans | -103.2 | 135.8 | -178.7 | 159.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 198 | Q | 42.3 | Very low | 45.6 | Very low | 182 Ų | 182 | 130.7 Ų | 130.7 | 85% | 0.85 | 81% | 0.814 | S | S | * | * | trans | -169.6 | 105.1 | 150.6 | -141.2 | 137.1 | -41.6 | 0 | 0 | 109.4 | ||||
| 199 | Q | 47.7 | Very low | 45.6 | Very low | 171 Ų | 171 | 128.7 Ų | 128.7 | 80% | 0.799 | 81% | 0.812 | S | S | * | * | 100.8 | 151.3 | 73.4 | -83.1 | -140.4 | 31.2 | 0 | 0 | 114.2 | |||||
| 200 | P | 50.3 | Low | 45.7 | Very low | 94 Ų | 94 | 126.7 Ų | 126.7 | 61% | 0.61 | 81% | 0.81 | S | S | * | * | trans | -133.3 | 179.6 | -141.5 | 42.6 | -24 | 0 | 0 | 0 | 117.8 | ||||
| 201 | I | 49.3 | Very low | 45.8 | Very low | 153 Ų | 153 | 124.9 Ų | 124.9 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | 62.6 | 138.7 | 154 | 69.7 | 172.2 | 0 | 0 | 0 | 124.2 | ||||
| 202 | T | 48 | Very low | 45.7 | Very low | 141 Ų | 141 | 126 Ų | 126 | 87% | 0.865 | 81% | 0.81 | S | S | * | * | trans | 156.1 | 146.3 | 139 | 46.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 203 | A | 45.7 | Very low | 45.7 | Very low | 91 Ų | 91 | 127 Ų | 127 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | cis | -161.6 | 130.5 | -3.6 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 204 | A | 47.4 | Very low | 45.8 | Very low | 103 Ų | 103 | 120.8 Ų | 120.8 | 85% | 0.851 | 81% | 0.808 | S | S | * | * | 44.8 | 116.1 | 107.5 | 0 | 0 | 0 | 0 | 0 | 118.9 | |||||
| 205 | A | 54.3 | Low | 45.4 | Very low | 101 Ų | 101 | 119.9 Ų | 119.9 | 84% | 0.835 | 81% | 0.808 | S | S | * | * | 174.2 | 151 | 113.3 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 206 | P | 50.9 | Low | 45.4 | Very low | 133 Ų | 133 | 114.2 Ų | 114.2 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | trans | -112.3 | 174.4 | -172.1 | 41 | -29.7 | 0 | 0 | 0 | 114.5 | ||||
| 207 | G | 46.3 | Very low | 44.9 | Very low | 64 Ų | 64 | 114.1 Ų | 114.1 | 66% | 0.66 | 81% | 0.805 | S | S | * | * | trans | 144.6 | 115.5 | 150.5 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 208 | T | 47.4 | Very low | 44.8 | Very low | 143 Ų | 143 | 112.4 Ų | 112.4 | 88% | 0.877 | 80% | 0.804 | S | S | * | * | trans | 71 | 110.4 | 136.6 | 46.9 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 209 | A | 42.1 | Very low | 44.6 | Very low | 98 Ų | 98 | 108.3 Ų | 108.3 | 81% | 0.81 | 80% | 0.801 | S | S | * | * | 61.2 | 123.4 | 119.9 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 210 | A | 42 | Very low | 44.4 | Very low | 97 Ų | 97 | 105.2 Ų | 105.2 | 80% | 0.802 | 81% | 0.805 | S | S | * | * | 171.2 | 142.6 | 113.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 211 | A | 43.3 | Very low | 44.3 | Very low | 97 Ų | 97 | 105.3 Ų | 105.3 | 80% | 0.802 | 81% | 0.814 | S | S | * | * | trans | 63.8 | 110 | 149.4 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 212 | A | 40.8 | Very low | 44 | Very low | 99 Ų | 99 | 108 Ų | 108 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | 76.8 | 130.3 | 58.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 213 | A | 41.6 | Very low | 43.9 | Very low | 100 Ų | 100 | 104.5 Ų | 104.5 | 83% | 0.826 | 81% | 0.812 | S | S | * | * | trans | 78.9 | 111.9 | 158.6 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 214 | A | 42.3 | Very low | 44.2 | Very low | 106 Ų | 106 | 107 Ų | 107 | 88% | 0.876 | 81% | 0.808 | S | S | * | * | 171 | 125.5 | 97.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 215 | A | 36.6 | Very low | 44.1 | Very low | 99 Ų | 99 | 111.3 Ų | 111.3 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -90.5 | 163.8 | 168.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 216 | A | 39.5 | Very low | 44 | Very low | 99 Ų | 99 | 114 Ų | 114 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | 91.3 | 147.1 | 154.5 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 217 | A | 40.7 | Very low | 44 | Very low | 103 Ų | 103 | 113.4 Ų | 113.4 | 85% | 0.851 | 80% | 0.796 | S | S | * | * | trans | 74.5 | 146.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 218 | A | 41.8 | Very low | 44.2 | Very low | 87 Ų | 87 | 120 Ų | 120 | 72% | 0.719 | 81% | 0.809 | S | S | * | * | cis | -170.1 | 132.7 | -11.9 | 0 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 219 | A | 39.6 | Very low | 44.4 | Very low | 95 Ų | 95 | 122.4 Ų | 122.4 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | 69.8 | 126.8 | 113.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | |||||
| 220 | A | 42.8 | Very low | 44.9 | Very low | 106 Ų | 106 | 124.6 Ų | 124.6 | 88% | 0.876 | 81% | 0.808 | S | S | * | * | trans | 76.8 | 109.8 | 151.2 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 221 | A | 47.8 | Very low | 45.6 | Very low | 97 Ų | 97 | 127.4 Ų | 127.4 | 80% | 0.802 | 80% | 0.804 | S | S | * | * | trans | 177.9 | 96.5 | 133.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 222 | F | 42.9 | Very low | 46.2 | Very low | 209 Ų | 209 | 128.6 Ų | 128.6 | 92% | 0.917 | 80% | 0.802 | S | S | * | * | 61.9 | 113.8 | 89.2 | -125.9 | -86 | 0 | 0 | 0 | 115 | |||||
| 223 | G | 45.9 | Very low | 46.8 | Very low | 68 Ų | 68 | 129.7 Ų | 129.7 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | trans | 155.2 | 78.8 | 169.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 224 | Q | 51.7 | Low | 47.6 | Very low | 143 Ų | 143 | 134.5 Ų | 134.5 | 67% | 0.668 | 79% | 0.791 | S | S | * | * | 84.5 | 126.3 | 83.3 | -84.7 | -75.2 | -4.1 | 0 | 0 | 114.4 | |||||
| 225 | Y | 46.7 | Very low | 48.4 | Very low | 194 Ų | 194 | 137.4 Ų | 137.4 | 76% | 0.761 | 79% | 0.788 | S | S | * | * | trans | 74.4 | 139 | 165.2 | -82.3 | -95.8 | 0 | 0 | 0 | 121.2 | ||||
| 226 | Q | 52 | Low | 49.4 | Very low | 156 Ų | 156 | 145.7 Ų | 145.7 | 73% | 0.729 | 81% | 0.81 | S | S | * | * | cis | -179.9 | 132 | -31 | -161.9 | 177 | 17.2 | 0 | 0 | 105 | ||||
| 227 | P | 50.9 | Low | 49.9 | Very low | 122 Ų | 122 | 148 Ų | 148 | 79% | 0.792 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -95.5 | 124.8 | 171.1 | 31.7 | -28.4 | 0 | 0 | 0 | 112 | ||
| 228 | Q | 49.3 | Very low | 50.4 | Low | 201 Ų | 201 | 150.4 Ų | 150.4 | 94% | 0.939 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -72 | 125.9 | 170.7 | -93.6 | 174.5 | -51.3 | 0 | 0 | 110.8 | ||
| 229 | Q | 51.8 | Low | 50.9 | Low | 195 Ų | 195 | 153.9 Ų | 153.9 | 91% | 0.911 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 140.1 | 171.4 | -68.6 | -147.4 | 9.3 | 0 | 0 | 111.8 | ||
| 230 | L | 52.6 | Low | 51.6 | Low | 143 Ų | 143 | 157.4 Ų | 157.4 | 75% | 0.749 | 81% | 0.814 | S | S | * | * | trans | -104.4 | 165.2 | 171.8 | -148.5 | 93.5 | 0 | 0 | 0 | 108.6 | ||||
| 231 | Q | 56.6 | Low | 52.1 | Low | 156 Ų | 156 | 160.6 Ų | 160.6 | 73% | 0.729 | 81% | 0.81 | S | S | * | * | trans | 86 | 103.2 | -178.1 | -84.2 | 82.5 | 12.6 | 0 | 0 | 115.5 | ||||
| 232 | T | 56.3 | Low | 52.4 | Low | 123 Ų | 123 | 164.8 Ų | 164.8 | 76% | 0.755 | 81% | 0.81 | S | S | * | * | 82.7 | 131.7 | 60.4 | -52.5 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 233 | D | 54.2 | Low | 53.1 | Low | 122 Ų | 122 | 161.6 Ų | 161.6 | 65% | 0.652 | 80% | 0.803 | S | S | * | * | trans | 87 | 106.1 | 158.3 | -123.4 | -118.1 | 0 | 0 | 0 | 118.3 | ||||
| 234 | R | 58.6 | Low | 53.6 | Low | 201 Ų | 201 | 168.8 Ų | 168.8 | 76% | 0.758 | 81% | 0.811 | S | S | * | * | 141 | 125.7 | 116.2 | -74.9 | -147.2 | 170.8 | 164.1 | -3.4 | 116.6 | |||||
| 235 | M | 58.7 | Low | 53.8 | Low | 166 Ų | 166 | 171 Ų | 171 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | 70.1 | 102 | 144.8 | -65.7 | -159.4 | -83 | 0 | 0 | 118.5 | ||||
| 236 | Q | 58.2 | Low | 54.5 | Low | 273 Ų | 273 | 168.9 Ų | 168.9 | 100% | 1.276 | 83% | 0.828 | S | S | * | * | -157.6 | 0 | 101.9 | -74.4 | -149.2 | 25 | 0 | 0 | 110 |
Retrieved 236 of 236 residues in 72.4 ms
(Link to these results)