| 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 | 66.2 | Low | 82.5 | Confident | 246 Ų | 246 | 117.2 Ų | 117.2 | 100% | 1.212 | 59% | 0.59 | S | S | * | * | 0 | 128 | 0 | -62.8 | -141.1 | -160.8 | 0 | 0 | 108.3 | |||||
| 2 | L | 69.6 | Low | 83 | Confident | 133 Ų | 133 | 120.4 Ų | 120.4 | 70% | 0.696 | 60% | 0.597 | S | S | * | * | trans | -65.2 | 138.1 | 178.2 | -77.5 | 151.9 | 0 | 0 | 0 | 109.9 | A6 | L2-A6 HydrophobicContact CD2-CB 4.25Š| ||
| 3 | S | 81.9 | Confident | 83.4 | Confident | 78 Ų | 78 | 120.6 Ų | 120.6 | 55% | 0.545 | 60% | 0.595 | S | S | . | * | trans | -57.8 | 143.4 | 174.7 | 173.2 | 0 | 0 | 0 | 0 | 110.5 | N5 A6 M7 | S3-N5 PolarHBondContact O-N 3.25Å; S3-N5 VanDerWaalsContact O-N 3.1Å; S3-A6 WeakPolarHBondContact O-CA 3.43Å; S3-A6 WeakPolarHBondContact O-CB 3.12Å; S3-A6 PolarHBondContact O-N 3.43Å; S3-M7 PolarHBondContact O-N 2.82Å; S3-M7 VanDerWaalsContact O-N 3.16Å | ||
| 4 | H | 80.2 | Confident | 83.8 | Confident | 134 Ų | 134 | 119.5 Ų | 119.5 | 62% | 0.62 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -50.3 | -39.1 | -179.7 | -174.8 | 76.5 | 0 | 0 | 0 | 112.3 | A6 M7 V8 | H4-A6 PolarHBondContact O-N 3.1Å; H4-M7 PolarHBondContact O-N 2.85Å; H4-V8 WeakPolarHBondContact O-CG2 3.35Å; H4-V8 PolarHBondContact O-N 2.95Å |
| 5 | N | 85.1 | Confident | 84.1 | Confident | 124 Ų | 124 | 114.6 Ų | 114.6 | 66% | 0.663 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64.8 | -35.9 | 176.9 | -76.7 | -43.3 | 0 | 0 | 0 | 113.5 | S3 K9 | S3-N5 PolarHBondContact O-N 3.25Å; S3-N5 VanDerWaalsContact O-N 3.1Å; N5-K9 WeakPolarHBondContact O-CB 3.33Å; N5-K9 PolarHBondContact O-N 3Å |
| 6 | A | 86.4 | Confident | 84 | Confident | 40 Ų | 40 | 111.6 Ų | 111.6 | 33% | 0.331 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.8 | -39.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | L2 S3 H4 K9 Q10 | L2-A6 HydrophobicContact CD2-CB 4.25Å; S3-A6 WeakPolarHBondContact O-CA 3.43Å; S3-A6 WeakPolarHBondContact O-CB 3.12Å; S3-A6 PolarHBondContact O-N 3.43Å; H4-A6 PolarHBondContact O-N 3.1Å; A6-K9 PolarHBondContact O-N 3.03Å; A6-Q10 WeakPolarHBondContact O-CB 3.3Å; A6-Q10 PolarHBondContact O-N 3.5Å |
| 7 | M | 86.1 | Confident | 83.9 | Confident | 69 Ų | 69 | 108.3 Ų | 108.3 | 34% | 0.34 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64 | -43.1 | 175.5 | -169.5 | -150.1 | -67.7 | 0 | 0 | 111.7 | S3 H4 Q10 R11 | S3-M7 PolarHBondContact O-N 2.82Å; S3-M7 VanDerWaalsContact O-N 3.16Å; H4-M7 PolarHBondContact O-N 2.85Å; M7-Q10 PolarHBondContact O-N 3.39Å; M7-R11 WeakPolarHBondContact O-CG 3.3Å; M7-R11 PolarHBondContact O-N 3.22Å; M7-R11 PolarHBondContact SD-NH2 3.48Å |
| 8 | V | 87.4 | Confident | 83.8 | Confident | 69 Ų | 69 | 107.8 Ų | 107.8 | 42% | 0.418 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.6 | -42.3 | 176.8 | 172.8 | 0 | 0 | 0 | 0 | 111 | H4 R11 K12 | H4-V8 WeakPolarHBondContact O-CG2 3.35Å; H4-V8 PolarHBondContact O-N 2.95Å; V8-R11 PolarHBondContact O-N 3.28Å; V8-K12 WeakPolarHBondContact O-CB 3.15Å; V8-K12 PolarHBondContact O-N 3.35Å |
| 9 | K | 88.6 | Confident | 83.4 | Confident | 143 Ų | 143 | 108.3 Ų | 108.3 | 62% | 0.622 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.2 | -42.5 | 177.3 | -169 | 176.8 | -179.6 | -178.3 | 0 | 111.8 | N5 A6 K12 Q13 | N5-K9 WeakPolarHBondContact O-CB 3.33Å; N5-K9 PolarHBondContact O-N 3Å; A6-K9 PolarHBondContact O-N 3.03Å; K9-K12 PolarHBondContact O-N 3.24Å; K9-Q13 PolarHBondContact O-N 3.46Å |
| 10 | Q | 88.2 | Confident | 83 | Confident | 94 Ų | 94 | 111.3 Ų | 111.3 | 44% | 0.439 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.1 | -45 | 176.6 | -173.4 | 179.7 | 8.3 | 0 | 0 | 111.9 | A6 M7 K12 Q13 Q14 | A6-Q10 WeakPolarHBondContact O-CB 3.3Å; A6-Q10 PolarHBondContact O-N 3.5Å; M7-Q10 PolarHBondContact O-N 3.39Å; Q10-K12 VanDerWaalsContact C-N 3.34Å; Q10-K12 PolarHBondContact O-N 2.92Å; Q10-Q13 PolarHBondContact O-N 3.23Å; Q10-Q14 WeakPolarHBondContact O-CG 3.07Å; Q10-Q14 PolarHBondContact O-N 3.49Å |
| 11 | R | 87.9 | Confident | 82.6 | Confident | 159 Ų | 159 | 113.3 Ų | 113.3 | 60% | 0.6 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.4 | -41.2 | 175.7 | -74.6 | 177 | 176.5 | -176.7 | -0.9 | 112.2 | M7 V8 Q14 A15 | M7-R11 WeakPolarHBondContact O-CG 3.3Å; M7-R11 PolarHBondContact O-N 3.22Å; M7-R11 PolarHBondContact SD-NH2 3.48Å; V8-R11 PolarHBondContact O-N 3.28Å; R11-Q14 PolarHBondContact O-N 3.24Å; R11-A15 WeakPolarHBondContact O-CB 3.43Å; R11-A15 PolarHBondContact O-N 3.33Å |
| 12 | K | 88 | Confident | 82.7 | Confident | 156 Ų | 156 | 107.1 Ų | 107.1 | 68% | 0.678 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.9 | -42.9 | 176 | -169.8 | 175.6 | -178.9 | 179.1 | 0 | 111.3 | V8 K9 Q10 A15 T16 | V8-K12 WeakPolarHBondContact O-CB 3.15Å; V8-K12 PolarHBondContact O-N 3.35Å; K9-K12 PolarHBondContact O-N 3.24Å; Q10-K12 VanDerWaalsContact C-N 3.34Å; Q10-K12 PolarHBondContact O-N 2.92Å; K12-A15 PolarHBondContact O-N 3.47Å; K12-T16 WeakPolarHBondContact O-CG2 3.4Å; K12-T16 PolarHBondContact O-N 3.37Å; K12-T16 PolarHBondContact O-OG1 2.97Å |
| 13 | Q | 89.1 | Confident | 82.4 | Confident | 123 Ų | 123 | 107.6 Ų | 107.6 | 58% | 0.575 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.6 | -45 | 175.2 | -93.5 | 177.3 | -31.2 | 0 | 0 | 112.4 | K9 Q10 A15 T16 A17 | K9-Q13 PolarHBondContact O-N 3.46Å; Q10-Q13 PolarHBondContact O-N 3.23Å; Q13-A15 PolarHBondContact O-N 3.34Å; Q13-T16 WeakPolarHBondContact CA-OG1 3.06Å; Q13-T16 PolarHBondContact O-N 2.79Å; Q13-T16 PolarHBondContact O-OG1 3.16Å; Q13-A17 PolarHBondContact O-N 2.96Å |
| 14 | Q | 88.8 | Confident | 80.9 | Confident | 105 Ų | 105 | 105.9 Ų | 105.9 | 49% | 0.491 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.5 | -45.7 | 175.8 | -74.7 | 175.9 | -17.9 | 0 | 0 | 111.8 | Q10 R11 T16 A17 I18 | Q10-Q14 WeakPolarHBondContact O-CG 3.07Å; Q10-Q14 PolarHBondContact O-N 3.49Å; R11-Q14 PolarHBondContact O-N 3.24Å; Q14-T16 VanDerWaalsContact C-N 3.31Å; Q14-T16 PolarHBondContact O-N 3.45Å; Q14-A17 PolarHBondContact O-N 3.16Å; Q14-I18 WeakPolarHBondContact O-CG1 3.37Å; Q14-I18 PolarHBondContact O-N 3.07Å |
| 15 | A | 87.4 | Confident | 79.9 | Confident | 46 Ų | 46 | 107.3 Ų | 107.3 | 38% | 0.38 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60 | -39.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | R11 K12 Q13 M19 | R11-A15 WeakPolarHBondContact O-CB 3.43Å; R11-A15 PolarHBondContact O-N 3.33Å; K12-A15 PolarHBondContact O-N 3.47Å; Q13-A15 PolarHBondContact O-N 3.34Å; A15-M19 PolarHBondContact O-N 3.38Å |
| 16 | T | 82.9 | Confident | 78.4 | Confident | 67 Ų | 67 | 108.1 Ų | 108.1 | 41% | 0.411 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -69.7 | -33 | 176.7 | 53.7 | 0 | 0 | 0 | 0 | 113.3 | K12 Q13 Q14 K20 | K12-T16 WeakPolarHBondContact O-CG2 3.4Å; K12-T16 PolarHBondContact O-N 3.37Å; K12-T16 PolarHBondContact O-OG1 2.97Å; Q13-T16 WeakPolarHBondContact CA-OG1 3.06Å; Q13-T16 PolarHBondContact O-N 2.79Å; Q13-T16 PolarHBondContact O-OG1 3.16Å; Q14-T16 VanDerWaalsContact C-N 3.31Å; Q14-T16 PolarHBondContact O-N 3.45Å; T16-K20 WeakPolarHBondContact O-CG 3.33Å; T16-K20 PolarHBondContact O-N 3.47Å; T16-K20 VanDerWaalsContact O-N 3.1Å |
| 17 | A | 83.1 | Confident | 76.7 | Confident | 55 Ų | 55 | 112 Ų | 112 | 46% | 0.455 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -68.4 | -46.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q13 Q14 M19 K20 E21 | Q13-A17 PolarHBondContact O-N 2.96Å; Q14-A17 PolarHBondContact O-N 3.16Å; A17-M19 VanDerWaalsContact C-N 3.34Å; A17-M19 PolarHBondContact O-N 3.04Å; A17-K20 PolarHBondContact O-N 3.14Å; A17-K20 VanDerWaalsContact O-N 3.12Å; A17-E21 PolarHBondContact O-N 3.46Å |
| 18 | I | 82.1 | Confident | 75.4 | Confident | 100 Ų | 100 | 117.6 Ų | 117.6 | 51% | 0.513 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -61.1 | -43.2 | 176.1 | -65.1 | 165.2 | 0 | 0 | 0 | 110.7 | Q14 K20 E21 V22 | Q14-I18 WeakPolarHBondContact O-CG1 3.37Å; Q14-I18 PolarHBondContact O-N 3.07Å; I18-K20 VanDerWaalsContact C-N 3.33Å; I18-K20 PolarHBondContact O-N 3.48Å; I18-E21 PolarHBondContact O-N 3.14Å; I18-V22 HydrophobicContact CG2-CG2 4.23Å; I18-V22 WeakPolarHBondContact O-CB 3.27Å; I18-V22 VanDerWaalsContact O-CG2 3.29Å; I18-V22 WeakPolarHBondContact O-CG2 3.33Å; I18-V22 PolarHBondContact O-N 3.02Å |
| 19 | M | 75.6 | Confident | 74.1 | Confident | 116 Ų | 116 | 119.4 Ų | 119.4 | 57% | 0.571 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -58.1 | -46.2 | 174.1 | -95.4 | -171.2 | -107.9 | 0 | 0 | 111.2 | A15 A17 E21 V22 H23 | A15-M19 PolarHBondContact O-N 3.38Å; A17-M19 VanDerWaalsContact C-N 3.34Å; A17-M19 PolarHBondContact O-N 3.04Å; M19-E21 VanDerWaalsContact C-N 3.31Å; M19-E21 PolarHBondContact O-N 3.19Å; M19-V22 PolarHBondContact O-N 2.97Å; M19-H23 PolarHBondContact O-N 3.17Å; M19-H23 VanDerWaalsContact O-N 3.09Å; M19-H23 PolarHBondContact O-ND1 2.95Å |
| 20 | K | 75.8 | Confident | 73 | Confident | 168 Ų | 168 | 119.6 Ų | 119.6 | 73% | 0.73 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.1 | -33.5 | 179.2 | -73.6 | 178.8 | 176.2 | -170 | 0 | 113.3 | T16 A17 I18 H23 G24 | T16-K20 WeakPolarHBondContact O-CG 3.33Å; T16-K20 PolarHBondContact O-N 3.47Å; T16-K20 VanDerWaalsContact O-N 3.1Å; A17-K20 PolarHBondContact O-N 3.14Å; A17-K20 VanDerWaalsContact O-N 3.12Å; I18-K20 VanDerWaalsContact C-N 3.33Å; I18-K20 PolarHBondContact O-N 3.48Å; K20-H23 CarbonylContact O-C 3.44Å; K20-G24 PolarHBondContact O-N 3.07Å |
| 21 | E | 75.3 | Confident | 72 | Confident | 155 Ų | 155 | 122.2 Ų | 122.2 | 72% | 0.724 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -72.2 | -41.7 | 176.7 | -172.2 | 178.4 | 178.9 | 0 | 0 | 112.4 | A17 I18 M19 H23 G24 | A17-E21 PolarHBondContact O-N 3.46Å; I18-E21 PolarHBondContact O-N 3.14Å; M19-E21 VanDerWaalsContact C-N 3.31Å; M19-E21 PolarHBondContact O-N 3.19Å; E21-H23 PolarHBondContact O-N 2.64Å; E21-G24 WeakPolarHBondContact O-CA 3.45Å; E21-G24 PolarHBondContact O-N 3.03Å |
| 22 | V | 68.3 | Low | 71.4 | Confident | 115 Ų | 115 | 121.7 Ų | 121.7 | 70% | 0.697 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -62.8 | -31 | 173.8 | 170.8 | 0 | 0 | 0 | 0 | 111.7 | I18 M19 G24 | I18-V22 HydrophobicContact CG2-CG2 4.23Å; I18-V22 WeakPolarHBondContact O-CB 3.27Å; I18-V22 VanDerWaalsContact O-CG2 3.29Å; I18-V22 WeakPolarHBondContact O-CG2 3.33Å; I18-V22 PolarHBondContact O-N 3.02Å; M19-V22 PolarHBondContact O-N 2.97Å; V22-G24 VanDerWaalsContact C-N 3.28Å |
| 23 | H | 62.5 | Low | 70.6 | Confident | 143 Ų | 143 | 116.3 Ų | 116.3 | 66% | 0.662 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | 21.3 | 174.4 | -59.2 | 76.8 | 0 | 0 | 0 | 112 | M19 K20 E21 N25 | M19-H23 PolarHBondContact O-N 3.17Å; M19-H23 VanDerWaalsContact O-N 3.09Å; M19-H23 PolarHBondContact O-ND1 2.95Å; K20-H23 CarbonylContact O-C 3.44Å; E21-H23 PolarHBondContact O-N 2.64Å; H23-N25 PolarHBondContact O-N 3.44Å |
| 24 | G | 50.1 | Low | 70 | Confident | 43 Ų | 43 | 120.2 Ų | 120.2 | 44% | 0.443 | 65% | 0.652 | S | S | . | * | trans | -57.3 | 119.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | K20 E21 V22 D26 | K20-G24 PolarHBondContact O-N 3.07Å; E21-G24 WeakPolarHBondContact O-CA 3.45Å; E21-G24 PolarHBondContact O-N 3.03Å; V22-G24 VanDerWaalsContact C-N 3.28Å; G24-D26 PolarHBondContact O-N 2.66Å | ||
| 25 | N | 59.1 | Low | 69.5 | Low | 163 Ų | 163 | 124.9 Ų | 124.9 | 87% | 0.872 | 67% | 0.671 | S | S | * | * | S | Bend | trans | 24.9 | 61.7 | 154.6 | -70.3 | -17.6 | 0 | 0 | 0 | 118.1 | H23 | H23-N25 PolarHBondContact O-N 3.44Š|
| 26 | D | 52.8 | Low | 68.6 | Low | 142 Ų | 142 | 129.3 Ų | 129.3 | 76% | 0.759 | 69% | 0.693 | S | S | * | * | trans | -147.1 | 124.5 | 156.8 | -97.4 | -36.7 | 0 | 0 | 0 | 111.3 | G24 | G24-D26 PolarHBondContact O-N 2.66Š| ||
| 27 | V | 52 | Low | 68.3 | Low | 121 Ų | 121 | 130.7 Ų | 130.7 | 73% | 0.733 | 71% | 0.705 | S | S | * | * | S | Bend | trans | 33.4 | 107 | 150.9 | -165.9 | 0 | 0 | 0 | 0 | 115.7 | S29 | V27-S29 VanDerWaalsContact C-N 3.29Å; V27-S29 PolarHBondContact O-N 3.31Å |
| 28 | E | 58.3 | Low | 67.9 | Low | 186 Ų | 186 | 135 Ų | 135 | 87% | 0.869 | 72% | 0.72 | S | S | * | * | trans | 25 | 65.8 | 155.7 | -68.2 | -176.5 | 161.1 | 0 | 0 | 113.8 | M30 | E28-M30 PolarHBondContact O-N 3.13Š| ||
| 29 | S | 59.9 | Low | 67.3 | Low | 108 Ų | 108 | 135.4 Ų | 135.4 | 76% | 0.755 | 73% | 0.729 | S | S | * | * | trans | -64.4 | 89.9 | 168 | -178.1 | 0 | 0 | 0 | 0 | 106.1 | V27 D31 | V27-S29 VanDerWaalsContact C-N 3.29Å; V27-S29 PolarHBondContact O-N 3.31Å; S29-D31 PolarHBondContact O-N 3.24Å | ||
| 30 | M | 65.4 | Low | 66.9 | Low | 147 Ų | 147 | 140.8 Ų | 140.8 | 72% | 0.724 | 74% | 0.742 | S | S | * | * | trans | -52.1 | 115.2 | 177.9 | -162.9 | -179.5 | -69.3 | 0 | 0 | 105.8 | E28 L32 | E28-M30 PolarHBondContact O-N 3.13Å; M30-L32 HydrophobicContact CB-CD2 4.25Å; M30-L32 HydrophobicContact CG-CD2 4.13Å; M30-L32 WeakPolarHBondContact O-CG 3.07Å; M30-L32 PolarHBondContact O-N 3.08Å; M30-L32 HydrophobicContact SD-CD2 4.09Å | ||
| 31 | D | 67.9 | Low | 66.7 | Low | 149 Ų | 149 | 139.6 Ų | 139.6 | 80% | 0.797 | 74% | 0.744 | S | S | * | * | trans | -66.8 | 90.3 | 177.7 | -177.3 | 4.9 | 0 | 0 | 0 | 107.6 | S29 G33 | S29-D31 PolarHBondContact O-N 3.24Å; D31-G33 PolarHBondContact O-N 2.97Å; D31-G33 WeakPolarHBondContact OD1-CA 3.4Å; D31-G33 PolarHBondContact OD1-N 3.32Å | ||
| 32 | L | 74.6 | Confident | 66.3 | Low | 147 Ų | 147 | 137.8 Ų | 137.8 | 77% | 0.77 | 74% | 0.738 | S | S | * | * | trans | -69.6 | 8.3 | 177.7 | -59.9 | -178.5 | 0 | 0 | 0 | 112 | M30 | M30-L32 HydrophobicContact CB-CD2 4.25Å; M30-L32 HydrophobicContact CG-CD2 4.13Å; M30-L32 WeakPolarHBondContact O-CG 3.07Å; M30-L32 PolarHBondContact O-N 3.08Å; M30-L32 HydrophobicContact SD-CD2 4.09Å | ||
| 33 | G | 70.9 | Confident | 66.3 | Low | 44 Ų | 44 | 137.3 Ų | 137.3 | 45% | 0.454 | 73% | 0.729 | S | S | . | * | trans | 67.1 | 174.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | D31 K35 | D31-G33 PolarHBondContact O-N 2.97Å; D31-G33 WeakPolarHBondContact OD1-CA 3.4Å; D31-G33 PolarHBondContact OD1-N 3.32Å; G33-K35 PolarHBondContact O-N 3.38Å | ||
| 34 | K | 77.4 | Confident | 66.3 | Low | 204 Ų | 204 | 136.9 Ų | 136.9 | 89% | 0.887 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 118.5 | 172.8 | -64 | -179.8 | -175.2 | 175.8 | 0 | 108.1 | V36 | K34-V36 PolarHBondContact O-N 3.04Š|
| 35 | K | 78.9 | Confident | 67.1 | Low | 203 Ų | 203 | 140.6 Ų | 140.6 | 88% | 0.883 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 118.6 | 170.5 | -69 | -172.7 | 179.5 | -173.2 | 0 | 108.6 | G33 S37 | G33-K35 PolarHBondContact O-N 3.38Å; K35-S37 PolarHBondContact O-N 3.47Å; K35-S37 VanDerWaalsContact O-N 3.14Å |
| 36 | V | 68.3 | Low | 67.5 | Low | 140 Ų | 140 | 137 Ų | 137 | 85% | 0.848 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 118.1 | 174.4 | -176.2 | 0 | 0 | 0 | 0 | 106.4 | K34 | K34-V36 PolarHBondContact O-N 3.04Š|
| 37 | S | 76.1 | Confident | 68.1 | Low | 95 Ų | 95 | 131.2 Ų | 131.2 | 66% | 0.664 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 142.1 | 176.8 | 56.6 | 0 | 0 | 0 | 0 | 109.2 | K35 | K35-S37 PolarHBondContact O-N 3.47Å; K35-S37 VanDerWaalsContact O-N 3.14Å |
| 38 | I | 74.1 | Confident | 68.8 | Low | 147 Ų | 147 | 128.6 Ų | 128.6 | 75% | 0.754 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -46.7 | 128.5 | 172.9 | -59.2 | 164.8 | 0 | 0 | 0 | 107.9 | R40 | I38-R40 PolarHBondContact O-N 2.99Š|
| 39 | P | 69.1 | Low | 69.2 | Low | 108 Ų | 108 | 125.4 Ų | 125.4 | 70% | 0.701 | 66% | 0.656 | S | S | * | * | trans | -53.2 | 113.7 | 176.2 | -21.8 | 31.5 | 0 | 0 | 0 | 108.2 | D41 | P39-D41 PolarHBondContact O-N 2.65Š| ||
| 40 | R | 68.8 | Low | 69.4 | Low | 228 Ų | 228 | 125.4 Ų | 125.4 | 86% | 0.86 | 65% | 0.647 | S | S | * | * | trans | -81.6 | 115.7 | 170.9 | -68 | -173.9 | -174.4 | 172.4 | 1 | 106.2 | I38 I42 | I38-R40 PolarHBondContact O-N 2.99Å; R40-I42 PolarHBondContact O-N 3.16Å | ||
| 41 | D | 71.4 | Confident | 69.8 | Low | 144 Ų | 144 | 123.8 Ų | 123.8 | 77% | 0.77 | 65% | 0.65 | S | S | * | * | trans | -62.2 | 109.7 | 169.7 | -67.5 | -26.2 | 0 | 0 | 0 | 107.4 | P39 M43 | P39-D41 PolarHBondContact O-N 2.65Å; D41-M43 PolarHBondContact O-N 2.89Å | ||
| 42 | I | 66.3 | Low | 70.4 | Confident | 117 Ų | 117 | 120.4 Ų | 120.4 | 60% | 0.6 | 63% | 0.632 | S | S | * | * | trans | -66.7 | 102.6 | 173 | 21 | 169.4 | 0 | 0 | 0 | 107.1 | R40 | R40-I42 PolarHBondContact O-N 3.16Š| ||
| 43 | M | 67.8 | Low | 70.9 | Confident | 104 Ų | 104 | 122.8 Ų | 122.8 | 51% | 0.512 | 63% | 0.631 | S | S | . | * | trans | -67.5 | 145.1 | 178.2 | -47.4 | -173.1 | -69.4 | 0 | 0 | 109.5 | D41 E45 E46 L47 | D41-M43 PolarHBondContact O-N 2.89Å; M43-E45 WeakPolarHBondContact CB-OE2 3.34Å; M43-E45 PolarHBondContact O-N 2.97Å; M43-E45 VanDerWaalsContact O-N 3.13Å; M43-E46 HydrophobicContact CB-CG 4.49Å; M43-E46 HydrophobicContact CE-CG 4.41Å; M43-E46 WeakPolarHBondContact O-CB 3.34Å; M43-E46 PolarHBondContact O-N 3.27Å; M43-L47 PolarHBondContact O-N 3.38Å | ||
| 44 | L | 64 | Low | 71.5 | Confident | 135 Ų | 135 | 122.2 Ų | 122.2 | 71% | 0.707 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -57 | -30.4 | -179 | -73.6 | 171 | 0 | 0 | 0 | 111.6 | E46 L47 S48 | L44-E46 VanDerWaalsContact C-N 3.32Å; L44-E46 PolarHBondContact O-N 3.26Å; L44-L47 HydrophobicContact CD2-CD1 4.37Å; L44-L47 PolarHBondContact O-N 3.03Å; L44-S48 PolarHBondContact O-N 3.32Å |
| 45 | E | 66.6 | Low | 71.8 | Confident | 120 Ų | 120 | 112.6 Ų | 112.6 | 56% | 0.561 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -60.7 | -39 | 175.2 | -59.2 | 81.6 | -177 | 0 | 0 | 111.6 | M43 L47 S48 H49 | M43-E45 WeakPolarHBondContact CB-OE2 3.34Å; M43-E45 PolarHBondContact O-N 2.97Å; M43-E45 VanDerWaalsContact O-N 3.13Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 3.37Å; E45-S48 WeakPolarHBondContact O-CB 3.02Å; E45-S48 PolarHBondContact O-N 3.27Å; E45-S48 PolarHBondContact O-OG 3.15Å; E45-H49 PolarHBondContact O-CD2 2.9Å |
| 46 | E | 67.3 | Low | 72.3 | Confident | 88 Ų | 88 | 110 Ų | 110 | 41% | 0.411 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -71 | -28.7 | 177.8 | -61.3 | -167.2 | 170.8 | 0 | 0 | 112.6 | M43 L44 S48 | M43-E46 HydrophobicContact CB-CG 4.49Å; M43-E46 HydrophobicContact CE-CG 4.41Å; M43-E46 WeakPolarHBondContact O-CB 3.34Å; M43-E46 PolarHBondContact O-N 3.27Å; L44-E46 VanDerWaalsContact C-N 3.32Å; L44-E46 PolarHBondContact O-N 3.26Å; E46-S48 VanDerWaalsContact C-N 3.27Å; E46-S48 PolarHBondContact O-N 3.12Å |
| 47 | L | 65.3 | Low | 73.3 | Confident | 21 Ų | 21 | 107.5 Ų | 107.5 | 11% | 0.11 | 55% | 0.55 | C | S | . | . | H | α-helix | trans | -74 | -18.4 | 175.8 | -64.5 | 177.2 | 0 | 0 | 0 | 112.8 | M43 L44 E45 A55 F58 | M43-L47 PolarHBondContact O-N 3.38Å; L44-L47 HydrophobicContact CD2-CD1 4.37Å; L44-L47 PolarHBondContact O-N 3.03Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 3.37Å; L47-A55 WeakPolarHBondContact O-CB 3.22Å; L47-F58 HydrophobicContact CB-CD1 4.12Å; L47-F58 HydrophobicContact CB-CG 4.37Å; L47-F58 HydrophobicContact CD1-CD2 4.04Å; L47-F58 HydrophobicContact CD1-CE2 4.26Å; L47-F58 HydrophobicContact CD1-CG 4.17Å; L47-F58 HydrophobicContact CD2-CB 4.1Å; L47-F58 HydrophobicContact CD2-CG 4.38Å |
| 48 | S | 65.9 | Low | 73.8 | Confident | 66 Ų | 66 | 107.4 Ų | 107.4 | 46% | 0.462 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -73.6 | -33.6 | 176.3 | 81.4 | 0 | 0 | 0 | 0 | 112.2 | L44 E45 E46 L50 K59 | L44-S48 PolarHBondContact O-N 3.32Å; E45-S48 WeakPolarHBondContact O-CB 3.02Å; E45-S48 PolarHBondContact O-N 3.27Å; E45-S48 PolarHBondContact O-OG 3.15Å; E46-S48 VanDerWaalsContact C-N 3.27Å; E46-S48 PolarHBondContact O-N 3.12Å; S48-L50 PolarHBondContact O-N 3.06Å; S48-K59 PolarHBondContact O-NZ 3.06Å |
| 49 | H | 67.4 | Low | 74.4 | Confident | 118 Ų | 118 | 103 Ų | 103 | 55% | 0.546 | 51% | 0.513 | S | S | . | . | trans | -81.3 | 113.4 | -176.9 | -65.9 | -62.7 | 0 | 0 | 0 | 111.7 | E45 S51 A55 | E45-H49 PolarHBondContact O-CD2 2.9Å; H49-S51 PolarHBondContact O-N 3.23Å; H49-A55 WeakPolarHBondContact O-CB 3.49Å | ||
| 50 | L | 63.4 | Low | 75.4 | Confident | 108 Ų | 108 | 101.4 Ų | 101.4 | 57% | 0.565 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | 2.5 | -178.9 | -79.1 | 126 | 0 | 0 | 0 | 115.3 | S48 K59 | S48-L50 PolarHBondContact O-N 3.06Å; L50-K59 HydrophobicContact CD1-CD 4.47Å; L50-K59 HydrophobicContact CD2-CD 4.02Å; L50-K59 HydrophobicContact CG-CD 4.1Å |
| 51 | S | 74.2 | Confident | 76.5 | Confident | 113 Ų | 113 | 99.7 Ų | 99.7 | 79% | 0.79 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.1 | -30.8 | -178.4 | 55 | 0 | 0 | 0 | 0 | 112.9 | H49 | H49-S51 PolarHBondContact O-N 3.23Š|
| 52 | N | 81.1 | Confident | 77.2 | Confident | 79 Ų | 79 | 97.4 Ų | 97.4 | 42% | 0.422 | 48% | 0.475 | S | S | . | . | S | Bend | trans | -93 | 141.4 | -179.7 | -171.7 | -26.8 | 0 | 0 | 0 | 111.8 | G54 A55 R56 | N52-G54 PolarHBondContact O-N 3.42Å; N52-G54 PolarHBondContact OD1-N 3.09Å; N52-A55 HydrophobicContact CB-CB 4.45Å; N52-A55 PolarHBondContact O-N 3.28Å; N52-R56 PolarHBondContact O-N 3.03Å; N52-R56 VanDerWaalsContact O-N 3.14Å |
| 53 | R | 83.8 | Confident | 78.3 | Confident | 197 Ų | 197 | 100.2 Ų | 100.2 | 74% | 0.743 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -52.9 | -38.8 | 170.6 | -174.3 | -178.7 | -179.1 | -156.3 | 0.9 | 112.1 | R56 L57 | R53-R56 PolarHBondContact O-N 2.81Å; R53-L57 HydrophobicContact CG-CD1 4.21Å; R53-L57 WeakPolarHBondContact O-CG 3.18Å; R53-L57 PolarHBondContact O-N 3.21Å |
| 54 | G | 84.4 | Confident | 79.5 | Confident | 32 Ų | 32 | 103.1 Ų | 103.1 | 33% | 0.33 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.1 | -48.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | N52 R56 L57 F58 | N52-G54 PolarHBondContact O-N 3.42Å; N52-G54 PolarHBondContact OD1-N 3.09Å; G54-R56 VanDerWaalsContact C-N 3.34Å; G54-R56 PolarHBondContact O-N 3.49Å; G54-L57 PolarHBondContact O-N 3.09Å; G54-F58 PolarHBondContact O-N 3.34Å |
| 55 | A | 84.6 | Confident | 80.6 | Confident | 1 Ų | 1 | 99.7 Ų | 99.7 | 1% | 0.008 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -61.7 | -38.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L47 H49 N52 F58 K59 | L47-A55 WeakPolarHBondContact O-CB 3.22Å; H49-A55 WeakPolarHBondContact O-CB 3.49Å; N52-A55 HydrophobicContact CB-CB 4.45Å; N52-A55 PolarHBondContact O-N 3.28Å; A55-F58 PolarHBondContact O-N 3.09Å; A55-K59 PolarHBondContact O-N 3.41Å |
| 56 | R | 87.6 | Confident | 81.5 | Confident | 149 Ų | 149 | 97.7 Ų | 97.7 | 56% | 0.562 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -64.1 | -42.9 | 174.9 | -69.3 | 174.8 | 60.9 | -178.8 | 0.1 | 112.3 | N52 R53 G54 M60 | N52-R56 PolarHBondContact O-N 3.03Å; N52-R56 VanDerWaalsContact O-N 3.14Å; R53-R56 PolarHBondContact O-N 2.81Å; G54-R56 VanDerWaalsContact C-N 3.34Å; G54-R56 PolarHBondContact O-N 3.49Å; R56-M60 WeakPolarHBondContact O-CG 3.19Å; R56-M60 PolarHBondContact O-N 3.23Å |
| 57 | L | 89.8 | Confident | 82.3 | Confident | 88 Ų | 88 | 100.6 Ų | 100.6 | 46% | 0.461 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.1 | -39.1 | 177 | -73.1 | 171 | 0 | 0 | 0 | 111.8 | R53 G54 M60 R61 | R53-L57 HydrophobicContact CG-CD1 4.21Å; R53-L57 WeakPolarHBondContact O-CG 3.18Å; R53-L57 PolarHBondContact O-N 3.21Å; G54-L57 PolarHBondContact O-N 3.09Å; L57-M60 HydrophobicContact CD2-CE 3.89Å; L57-M60 PolarHBondContact O-N 2.98Å; L57-R61 WeakPolarHBondContact O-CB 3.4Å; L57-R61 PolarHBondContact O-N 2.71Å |
| 58 | F | 87.4 | Confident | 83.1 | Confident | 92 Ų | 92 | 108 Ų | 108 | 40% | 0.404 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.6 | -51.1 | 174.4 | 179.2 | -101.5 | 0 | 0 | 0 | 111.6 | L47 G54 A55 M60 R61 Q62 | L47-F58 HydrophobicContact CB-CD1 4.12Å; L47-F58 HydrophobicContact CB-CG 4.37Å; L47-F58 HydrophobicContact CD1-CD2 4.04Å; L47-F58 HydrophobicContact CD1-CE2 4.26Å; L47-F58 HydrophobicContact CD1-CG 4.17Å; L47-F58 HydrophobicContact CD2-CB 4.1Å; L47-F58 HydrophobicContact CD2-CG 4.38Å; G54-F58 PolarHBondContact O-N 3.34Å; A55-F58 PolarHBondContact O-N 3.09Å; F58-M60 VanDerWaalsContact C-N 3.33Å; F58-M60 PolarHBondContact O-N 3.21Å; F58-R61 WeakPolarHBondContact O-CB 3.49Å; F58-R61 PolarHBondContact O-N 3.26Å; F58-R61 VanDerWaalsContact O-N 3.09Å; F58-Q62 PolarHBondContact O-N 3.03Å |
| 59 | K | 86.5 | Confident | 83.7 | Confident | 56 Ų | 56 | 108 Ų | 108 | 24% | 0.243 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -62 | -37.6 | 176.6 | -70.3 | -173.1 | -176.2 | -176.2 | 0 | 113 | S48 L50 A55 Q62 R63 | S48-K59 PolarHBondContact O-NZ 3.06Å; L50-K59 HydrophobicContact CD1-CD 4.47Å; L50-K59 HydrophobicContact CD2-CD 4.02Å; L50-K59 HydrophobicContact CG-CD 4.1Å; A55-K59 PolarHBondContact O-N 3.41Å; K59-Q62 PolarHBondContact O-N 2.85Å; K59-R63 WeakPolarHBondContact O-CG 3.42Å; K59-R63 PolarHBondContact O-N 3.15Å |
| 60 | M | 90.5 | Very high | 83.4 | Confident | 74 Ų | 74 | 110 Ų | 110 | 37% | 0.365 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.1 | -39.8 | 173.6 | -79 | -170.2 | -84.4 | 0 | 0 | 112.2 | R56 L57 F58 R64 | R56-M60 WeakPolarHBondContact O-CG 3.19Å; R56-M60 PolarHBondContact O-N 3.23Å; L57-M60 HydrophobicContact CD2-CE 3.89Å; L57-M60 PolarHBondContact O-N 2.98Å; F58-M60 VanDerWaalsContact C-N 3.33Å; F58-M60 PolarHBondContact O-N 3.21Å; M60-R64 VanDerWaalsContact O-CG 3.29Å; M60-R64 WeakPolarHBondContact O-CG 3.27Å; M60-R64 PolarHBondContact O-N 3.27Å |
| 61 | R | 91.8 | Very high | 83.3 | Confident | 191 Ų | 191 | 111.4 Ų | 111.4 | 72% | 0.721 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.6 | -41.8 | 175.7 | -174.5 | 176.4 | -67.6 | -179.8 | -1.9 | 111.1 | L57 F58 R64 S65 | L57-R61 WeakPolarHBondContact O-CB 3.4Å; L57-R61 PolarHBondContact O-N 2.71Å; F58-R61 WeakPolarHBondContact O-CB 3.49Å; F58-R61 PolarHBondContact O-N 3.26Å; F58-R61 VanDerWaalsContact O-N 3.09Å; R61-R64 PolarHBondContact O-N 3.07Å; R61-S65 WeakPolarHBondContact O-CB 3.18Å; R61-S65 PolarHBondContact O-N 3.48Å |
| 62 | Q | 86.5 | Confident | 82.5 | Confident | 97 Ų | 97 | 111.9 Ų | 111.9 | 45% | 0.453 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -57.3 | -54.2 | 174.3 | -169.6 | 174.8 | 13.1 | 0 | 0 | 110.8 | F58 K59 R64 S65 D66 | F58-Q62 PolarHBondContact O-N 3.03Å; K59-Q62 PolarHBondContact O-N 2.85Å; Q62-R64 VanDerWaalsContact C-N 3.27Å; Q62-R64 PolarHBondContact O-N 3.15Å; Q62-S65 CarbonylContact O-C 3.57Å; Q62-S65 WeakPolarHBondContact O-CA 3.09Å; Q62-S65 VanDerWaalsContact O-CB 3.25Å; Q62-S65 WeakPolarHBondContact O-CB 3.43Å; Q62-S65 PolarHBondContact O-N 3.12Å; Q62-D66 PolarHBondContact O-N 2.98Å |
| 63 | R | 88.4 | Confident | 81.2 | Confident | 176 Ų | 176 | 117.1 Ų | 117.1 | 66% | 0.664 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.2 | -36.3 | 177.1 | -68.9 | -178.6 | -162.5 | 165.1 | 1.9 | 113.9 | K59 K67 | K59-R63 WeakPolarHBondContact O-CG 3.42Å; K59-R63 PolarHBondContact O-N 3.15Å; R63-K67 PolarHBondContact O-N 3.03Å; R63-K67 VanDerWaalsContact O-N 3.17Å |
| 64 | R | 92.7 | Very high | 79.6 | Confident | 165 Ų | 165 | 111.3 Ų | 111.3 | 62% | 0.623 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -68 | -39.7 | 175 | -73 | 175.2 | -164.5 | 166.6 | 3.6 | 111.1 | M60 R61 Q62 K67 Y68 | M60-R64 VanDerWaalsContact O-CG 3.29Å; M60-R64 WeakPolarHBondContact O-CG 3.27Å; M60-R64 PolarHBondContact O-N 3.27Å; R61-R64 PolarHBondContact O-N 3.07Å; Q62-R64 VanDerWaalsContact C-N 3.27Å; Q62-R64 PolarHBondContact O-N 3.15Å; R64-K67 WeakPolarHBondContact O-CB 3.36Å; R64-K67 PolarHBondContact O-N 2.69Å; R64-Y68 WeakPolarHBondContact O-CD2 3.49Å |
| 65 | S | 87.6 | Confident | 78.1 | Confident | 62 Ų | 62 | 117.5 Ų | 117.5 | 43% | 0.434 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.4 | -53.1 | 174.5 | -167.4 | 0 | 0 | 0 | 0 | 110 | R61 Q62 K67 Y68 T69 | R61-S65 WeakPolarHBondContact O-CB 3.18Å; R61-S65 PolarHBondContact O-N 3.48Å; Q62-S65 CarbonylContact O-C 3.57Å; Q62-S65 WeakPolarHBondContact O-CA 3.09Å; Q62-S65 VanDerWaalsContact O-CB 3.25Å; Q62-S65 WeakPolarHBondContact O-CB 3.43Å; Q62-S65 PolarHBondContact O-N 3.12Å; S65-K67 PolarHBondContact O-N 3.17Å; S65-K67 VanDerWaalsContact O-N 3.08Å; S65-Y68 CarbonylContact O-C 3.6Å; S65-Y68 PolarHBondContact O-N 3.27Å; S65-T69 WeakPolarHBondContact O-CG2 3.15Å; S65-T69 PolarHBondContact O-N 3.26Å; S65-T69 PolarHBondContact O-OG1 3.21Å |
| 66 | D | 85.4 | Confident | 76.4 | Confident | 78 Ų | 78 | 125.3 Ų | 125.3 | 42% | 0.417 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -57.1 | -30.7 | -178.4 | -56.9 | -18.7 | 0 | 0 | 0 | 112.5 | Q62 Y68 T69 | Q62-D66 PolarHBondContact O-N 2.98Å; D66-Y68 VanDerWaalsContact C-N 3.29Å; D66-Y68 PolarHBondContact O-N 3.27Å; D66-T69 WeakPolarHBondContact CA-OG1 3.35Å |
| 67 | K | 84.9 | Confident | 74.7 | Confident | 150 Ų | 150 | 120.8 Ų | 120.8 | 65% | 0.652 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.6 | -31 | 175.9 | -175.6 | 178.9 | 176.4 | -162.9 | 0 | 113.3 | R63 R64 S65 | R63-K67 PolarHBondContact O-N 3.03Å; R63-K67 VanDerWaalsContact O-N 3.17Å; R64-K67 WeakPolarHBondContact O-CB 3.36Å; R64-K67 PolarHBondContact O-N 2.69Å; S65-K67 PolarHBondContact O-N 3.17Å; S65-K67 VanDerWaalsContact O-N 3.08Å |
| 68 | Y | 81.4 | Confident | 72.9 | Confident | 175 Ų | 175 | 123.3 Ų | 123.3 | 69% | 0.686 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -115.6 | -8.6 | -173.2 | -55.9 | -65.7 | 0 | 0 | 0 | 113.4 | R64 S65 D66 | R64-Y68 WeakPolarHBondContact O-CD2 3.49Å; S65-Y68 CarbonylContact O-C 3.6Å; S65-Y68 PolarHBondContact O-N 3.27Å; D66-Y68 VanDerWaalsContact C-N 3.29Å; D66-Y68 PolarHBondContact O-N 3.27Å |
| 69 | T | 78.4 | Confident | 71.5 | Confident | 66 Ų | 66 | 122.1 Ų | 122.1 | 41% | 0.405 | 56% | 0.558 | S | S | . | * | trans | -90.1 | 109.4 | 170.1 | 53.1 | 0 | 0 | 0 | 0 | 109.6 | S65 D66 E71 | S65-T69 WeakPolarHBondContact O-CG2 3.15Å; S65-T69 PolarHBondContact O-N 3.26Å; S65-T69 PolarHBondContact O-OG1 3.21Å; D66-T69 WeakPolarHBondContact CA-OG1 3.35Å; T69-E71 PolarHBondContact O-N 2.71Å; T69-E71 VanDerWaalsContact O-N 3.15Å | ||
| 70 | F | 60.4 | Low | 70.1 | Confident | 162 Ų | 162 | 126.3 Ų | 126.3 | 71% | 0.711 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -69.7 | -3.9 | -178.4 | -177.3 | -104.4 | 0 | 0 | 0 | 114.3 | N72 | F70-N72 PolarHBondContact O-N 3.38Š|
| 71 | E | 62.2 | Low | 68.5 | Low | 137 Ų | 137 | 126.6 Ų | 126.6 | 64% | 0.64 | 58% | 0.58 | S | S | * | * | G | 310 helix | trans | -86.2 | 4.8 | -164.7 | -62.6 | -161.5 | 155.4 | 0 | 0 | 116.6 | T69 | T69-E71 PolarHBondContact O-N 2.71Å; T69-E71 VanDerWaalsContact O-N 3.15Å |
| 72 | N | 56.8 | Low | 66.7 | Low | 123 Ų | 123 | 122.6 Ų | 122.6 | 66% | 0.658 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -95.3 | -0.5 | -169.2 | -142.7 | 35.1 | 0 | 0 | 0 | 117 | F70 | F70-N72 PolarHBondContact O-N 3.38Š|
| 73 | F | 54.7 | Low | 65.3 | Low | 188 Ų | 188 | 124.1 Ų | 124.1 | 83% | 0.825 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.9 | -15 | 178.1 | -69.9 | -76.5 | 0 | 0 | 0 | 115 | ||
| 74 | Q | 49.8 | Very low | 63.7 | Low | 75 Ų | 75 | 118.6 Ų | 118.6 | 35% | 0.35 | 57% | 0.569 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102.3 | -20.1 | -172.8 | -71.2 | -179.7 | -9.1 | 0 | 0 | 114 | R78 | Q74-R78 WeakPolarHBondContact O-CB 3.41Å; Q74-R78 WeakPolarHBondContact O-CD 3.46Å; Q74-R78 WeakPolarHBondContact O-CG 3.44Å; Q74-R78 PolarHBondContact O-N 2.99Å |
| 75 | Y | 52.3 | Low | 62 | Low | 163 Ų | 163 | 115 Ų | 115 | 64% | 0.639 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -72.1 | -43.2 | -177 | -103 | -87 | 0 | 0 | 0 | 113.1 | A79 | Y75-A79 PolarHBondContact O-N 2.86Å |
| 76 | E | 49.2 | Very low | 60.3 | Low | 164 Ų | 164 | 115.7 Ų | 115.7 | 77% | 0.766 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -72 | -39.8 | 178.6 | -65.1 | -173.1 | 170.2 | 0 | 0 | 112.3 | A79 Q80 | E76-A79 PolarHBondContact O-N 3.03Å; E76-Q80 PolarHBondContact O-N 3.06Å |
| 77 | S | 52.7 | Low | 58.6 | Low | 54 Ų | 54 | 118.9 Ų | 118.9 | 38% | 0.378 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -66.3 | -40.6 | 176.3 | 173.3 | 0 | 0 | 0 | 0 | 112.4 | Q80 I81 | S77-Q80 PolarHBondContact O-N 2.99Å; S77-I81 WeakPolarHBondContact O-CB 3.41Å; S77-I81 VanDerWaalsContact O-CG1 3.28Å; S77-I81 WeakPolarHBondContact O-CG1 3.12Å; S77-I81 PolarHBondContact O-N 2.74Å; S77-I81 WeakPolarHBondContact OG-CD1 3.24Å |
| 78 | R | 51.9 | Low | 56.9 | Low | 142 Ų | 142 | 119.4 Ų | 119.4 | 54% | 0.536 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -67.9 | -34.7 | 177.6 | -75.8 | 172.9 | 163.7 | 175 | -3.6 | 112.6 | Q74 Q80 N82 | Q74-R78 WeakPolarHBondContact O-CB 3.41Å; Q74-R78 WeakPolarHBondContact O-CD 3.46Å; Q74-R78 WeakPolarHBondContact O-CG 3.44Å; Q74-R78 PolarHBondContact O-N 2.99Å; R78-Q80 VanDerWaalsContact C-N 3.34Å; R78-N82 VanDerWaalsContact O-CB 3.24Å; R78-N82 WeakPolarHBondContact O-CB 3.35Å; R78-N82 PolarHBondContact O-N 3.49Å; R78-N82 PolarHBondContact O-ND2 2.98Å; R78-N82 VanDerWaalsContact O-ND2 3.11Å |
| 79 | A | 57.3 | Low | 55.2 | Low | 66 Ų | 66 | 118 Ų | 118 | 55% | 0.545 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -63.1 | -40.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | Y75 E76 H83 | Y75-A79 PolarHBondContact O-N 2.86Å; E76-A79 PolarHBondContact O-N 3.03Å; A79-H83 PolarHBondContact O-N 3.03Å |
| 80 | Q | 56.1 | Low | 53.6 | Low | 145 Ų | 145 | 118 Ų | 118 | 68% | 0.678 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -71.5 | -41.7 | 177.1 | -71.8 | 171.5 | -8.1 | 0 | 0 | 112.7 | E76 S77 R78 H83 S84 | E76-Q80 PolarHBondContact O-N 3.06Å; S77-Q80 PolarHBondContact O-N 2.99Å; R78-Q80 VanDerWaalsContact C-N 3.34Å; Q80-H83 PolarHBondContact O-N 2.92Å; Q80-S84 PolarHBondContact O-N 3.02Å |
| 81 | I | 57.5 | Low | 52.4 | Low | 79 Ų | 79 | 119.3 Ų | 119.3 | 41% | 0.405 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -67.2 | -39 | 177.6 | -68.9 | 165.9 | 0 | 0 | 0 | 111.4 | S77 H83 S84 I85 | S77-I81 WeakPolarHBondContact O-CB 3.41Å; S77-I81 VanDerWaalsContact O-CG1 3.28Å; S77-I81 WeakPolarHBondContact O-CG1 3.12Å; S77-I81 PolarHBondContact O-N 2.74Å; S77-I81 WeakPolarHBondContact OG-CD1 3.24Å; I81-H83 VanDerWaalsContact C-N 3.29Å; I81-H83 PolarHBondContact O-N 3.19Å; I81-S84 PolarHBondContact O-N 3.44Å; I81-S84 PolarHBondContact O-OG 3.03Å; I81-I85 HydrophobicContact CG2-CD1 3.68Å; I81-I85 HydrophobicContact CG2-CG1 4.23Å; I81-I85 WeakPolarHBondContact O-CG1 3.25Å; I81-I85 PolarHBondContact O-N 3.42Å |
| 82 | N | 54.9 | Low | 51.2 | Low | 107 Ų | 107 | 118.7 Ų | 118.7 | 57% | 0.572 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -66.4 | -33.4 | 178 | -72.2 | -22.9 | 0 | 0 | 0 | 112 | R78 A86 | R78-N82 VanDerWaalsContact O-CB 3.24Å; R78-N82 WeakPolarHBondContact O-CB 3.35Å; R78-N82 PolarHBondContact O-N 3.49Å; R78-N82 PolarHBondContact O-ND2 2.98Å; R78-N82 VanDerWaalsContact O-ND2 3.11Å; N82-A86 WeakPolarHBondContact O-CB 3.49Å; N82-A86 PolarHBondContact O-N 2.93Å |
| 83 | H | 57 | Low | 50.1 | Low | 129 Ų | 129 | 120.2 Ų | 120.2 | 60% | 0.597 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -71.8 | -33.1 | 175.6 | -165.9 | -75.4 | 0 | 0 | 0 | 112.7 | A79 Q80 I81 | A79-H83 PolarHBondContact O-N 3.03Å; Q80-H83 PolarHBondContact O-N 2.92Å; I81-H83 VanDerWaalsContact C-N 3.29Å; I81-H83 PolarHBondContact O-N 3.19Å |
| 84 | S | 54.3 | Low | 49.2 | Very low | 61 Ų | 61 | 114.6 Ų | 114.6 | 43% | 0.427 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -77.4 | -37 | 177.2 | 63.3 | 0 | 0 | 0 | 0 | 113 | Q80 I81 M87 | Q80-S84 PolarHBondContact O-N 3.02Å; I81-S84 PolarHBondContact O-N 3.44Å; I81-S84 PolarHBondContact O-OG 3.03Å; S84-M87 PolarHBondContact O-N 3.4Å |
| 85 | I | 56.2 | Low | 48.2 | Very low | 90 Ų | 90 | 117.3 Ų | 117.3 | 46% | 0.462 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -69 | -35.2 | 177 | -66.9 | -179.6 | 0 | 0 | 0 | 111.6 | I81 M87 Q88 | I81-I85 HydrophobicContact CG2-CD1 3.68Å; I81-I85 HydrophobicContact CG2-CG1 4.23Å; I81-I85 WeakPolarHBondContact O-CG1 3.25Å; I81-I85 PolarHBondContact O-N 3.42Å; I85-M87 PolarHBondContact O-N 3.1Å; I85-Q88 PolarHBondContact O-N 3.49Å |
| 86 | A | 52 | Low | 47.5 | Very low | 76 Ų | 76 | 116.3 Ų | 116.3 | 63% | 0.628 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -63.5 | -24.7 | 176 | 0 | 0 | 0 | 0 | 0 | 113.4 | N82 | N82-A86 WeakPolarHBondContact O-CB 3.49Å; N82-A86 PolarHBondContact O-N 2.93Å |
| 87 | M | 50.4 | Low | 46.9 | Very low | 145 Ų | 145 | 116.8 Ų | 116.8 | 71% | 0.714 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -7.9 | 179.7 | -67.5 | -70.4 | 179 | 0 | 0 | 114 | S84 I85 | S84-M87 PolarHBondContact O-N 3.4Å; I85-M87 PolarHBondContact O-N 3.1Å |
| 88 | Q | 49.5 | Very low | 46 | Very low | 161 Ų | 161 | 122.6 Ų | 122.6 | 75% | 0.752 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.3 | -8.4 | -177.2 | -74.3 | -168.3 | 6.6 | 0 | 0 | 115.2 | I85 G90 | I85-Q88 PolarHBondContact O-N 3.49Å; Q88-G90 PolarHBondContact O-N 2.91Å |
| 89 | N | 44.7 | Very low | 45 | Very low | 145 Ų | 145 | 119.8 Ų | 119.8 | 78% | 0.775 | 70% | 0.697 | S | S | * | * | trans | -81.9 | 52.7 | 176.7 | -76.5 | -38.7 | 0 | 0 | 0 | 113.2 | ||||
| 90 | G | 45 | Very low | 43.6 | Very low | 65 Ų | 65 | 119.9 Ų | 119.9 | 67% | 0.67 | 70% | 0.704 | S | S | * | * | trans | -139.9 | 36.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q88 | Q88-G90 PolarHBondContact O-N 2.91Š| ||
| 91 | K | 36.8 | Very low | 42.7 | Very low | 191 Ų | 191 | 118.9 Ų | 118.9 | 83% | 0.83 | 71% | 0.713 | S | S | * | * | trans | -168 | 101.8 | 166.1 | -125.2 | 139.7 | 157.1 | 177.2 | 0 | 114.2 | ||||
| 92 | V | 36.3 | Very low | 41.7 | Very low | 123 Ų | 123 | 124.2 Ų | 124.2 | 75% | 0.745 | 74% | 0.736 | S | S | * | * | 44.9 | 129.3 | 128.6 | -167.7 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 93 | D | 33.5 | Very low | 40.8 | Very low | 155 Ų | 155 | 128.2 Ų | 128.2 | 83% | 0.829 | 75% | 0.752 | S | S | * | * | trans | 80.2 | 114.9 | 148.6 | -69.8 | -14.9 | 0 | 0 | 0 | 124.6 | ||||
| 94 | G | 35.1 | Very low | 39.9 | Very low | 71 Ų | 71 | 126.2 Ų | 126.2 | 73% | 0.732 | 76% | 0.758 | S | S | * | * | trans | 16.2 | 126.6 | 138.1 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 95 | S | 30.8 | Very low | 39.2 | Very low | 132 Ų | 132 | 128.8 Ų | 128.8 | 92% | 0.923 | 77% | 0.773 | S | S | * | * | 177.7 | 156.3 | 122.4 | 38 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 96 | N | 36.1 | Very low | 38.8 | Very low | 141 Ų | 141 | 133.1 Ų | 133.1 | 75% | 0.754 | 80% | 0.796 | S | S | * | * | trans | -66.4 | 142.9 | -173.1 | -164.5 | -15.2 | 0 | 0 | 0 | 113.3 | ||||
| 97 | L | 36.3 | Very low | 38.4 | Very low | 174 Ų | 174 | 134.9 Ų | 134.9 | 91% | 0.911 | 80% | 0.799 | S | S | * | * | trans | -158.6 | 124.8 | 150.4 | -115.3 | 134.9 | 0 | 0 | 0 | 113 | ||||
| 98 | E | 34.3 | Very low | 38.2 | Very low | 176 Ų | 176 | 132.9 Ų | 132.9 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | -73.9 | 155.2 | 176.9 | -138.5 | 168.1 | 157.1 | 0 | 0 | 111.8 | ||||
| 99 | G | 31.1 | Very low | 38 | Very low | 84 Ų | 84 | 130.9 Ų | 130.9 | 87% | 0.866 | 80% | 0.798 | S | S | * | * | trans | 104.8 | 107.9 | 153.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 100 | G | 28.9 | Very low | 38.3 | Very low | 67 Ų | 67 | 131.4 Ų | 131.4 | 69% | 0.691 | 80% | 0.801 | S | S | * | * | trans | -180 | 72.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q102 | G100-Q102 PolarHBondContact O-N 3.42Å; G100-Q102 VanDerWaalsContact O-N 3.16Å | ||
| 101 | S | 35.6 | Very low | 38.7 | Very low | 124 Ų | 124 | 134 Ų | 134 | 87% | 0.867 | 80% | 0.803 | S | S | * | * | trans | -53.3 | 110.4 | 175.6 | -5.5 | 0 | 0 | 0 | 0 | 111.4 | Q103 | S101-Q103 PolarHBondContact O-N 3.05Š| ||
| 102 | Q | 36.7 | Very low | 39.6 | Very low | 192 Ų | 192 | 130.2 Ų | 130.2 | 90% | 0.897 | 80% | 0.799 | S | S | * | * | trans | -76.2 | 112.6 | 169.4 | -65.3 | -167.3 | 6.5 | 0 | 0 | 108.9 | G100 A104 | G100-Q102 PolarHBondContact O-N 3.42Å; G100-Q102 VanDerWaalsContact O-N 3.16Å; Q102-A104 PolarHBondContact O-N 3.37Å | ||
| 103 | Q | 36.7 | Very low | 40.5 | Very low | 191 Ų | 191 | 129 Ų | 129 | 89% | 0.893 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -57 | 119.6 | 169.6 | -82.8 | 172.4 | -17.1 | 0 | 0 | 109.9 | S101 | S101-Q103 PolarHBondContact O-N 3.05Š|
| 104 | A | 38.8 | Very low | 41.6 | Very low | 87 Ų | 87 | 127.6 Ų | 127.6 | 72% | 0.719 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -68 | 133.7 | 167.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | Q102 L106 | Q102-A104 PolarHBondContact O-N 3.37Å; A104-L106 PolarHBondContact O-N 3.24Å |
| 105 | P | 38.9 | Very low | 42.5 | Very low | 115 Ų | 115 | 134.8 Ų | 134.8 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 119.4 | 172.7 | -17.5 | 30.5 | 0 | 0 | 0 | 110.8 | T107 | P105-T107 VanDerWaalsContact C-N 3.33Å; P105-T107 PolarHBondContact O-N 3.42Å |
| 106 | L | 46.9 | Very low | 43.7 | Very low | 181 Ų | 181 | 132.3 Ų | 132.3 | 95% | 0.948 | 78% | 0.775 | S | S | * | * | trans | -69 | 88.4 | 166.6 | -73.5 | 161.2 | 0 | 0 | 0 | 109 | A104 | A104-L106 PolarHBondContact O-N 3.24Š| ||
| 107 | T | 44.4 | Very low | 44.6 | Very low | 112 Ų | 112 | 131 Ų | 131 | 69% | 0.687 | 77% | 0.774 | S | S | * | * | trans | -129 | 134.2 | 164 | 47.6 | 0 | 0 | 0 | 0 | 109.2 | P105 | P105-T107 VanDerWaalsContact C-N 3.33Å; P105-T107 PolarHBondContact O-N 3.42Å | ||
| 108 | P | 45.5 | Very low | 45.4 | Very low | 103 Ų | 103 | 128.9 Ų | 128.9 | 67% | 0.669 | 77% | 0.771 | S | S | * | * | trans | -64.4 | 145.6 | -178.2 | -8.4 | 19.7 | 0 | 0 | 0 | 110.8 | N110 | P108-N110 PolarHBondContact O-N 3.26Š| ||
| 109 | P | 46.1 | Very low | 46.4 | Very low | 119 Ų | 119 | 125 Ų | 125 | 77% | 0.773 | 76% | 0.756 | S | S | * | * | trans | -71.4 | 98.5 | 178.7 | 29.2 | -31.8 | 0 | 0 | 0 | 109.7 | T111 | P109-T111 PolarHBondContact O-N 3.38Å; P109-T111 VanDerWaalsContact O-N 3.14Å | ||
| 110 | N | 51.4 | Low | 47.8 | Very low | 157 Ų | 157 | 126.3 Ų | 126.3 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | trans | -82.5 | 42.2 | 170.1 | -90.1 | -47.2 | 0 | 0 | 0 | 111.7 | P108 | P108-N110 PolarHBondContact O-N 3.26Š| ||
| 111 | T | 53.1 | Low | 49.1 | Very low | 118 Ų | 118 | 130.3 Ų | 130.3 | 72% | 0.724 | 75% | 0.75 | S | S | * | * | trans | -112.8 | 109.6 | 178.5 | -31.6 | 0 | 0 | 0 | 0 | 108.5 | P109 D113 | P109-T111 PolarHBondContact O-N 3.38Å; P109-T111 VanDerWaalsContact O-N 3.14Å; T111-D113 PolarHBondContact O-N 2.91Å | ||
| 112 | P | 55.3 | Low | 50.3 | Low | 113 Ų | 113 | 131.1 Ų | 131.1 | 73% | 0.734 | 74% | 0.744 | S | S | * | * | trans | -59.8 | 137.6 | 171.7 | -16.2 | 28.8 | 0 | 0 | 0 | 109.2 | ||||
| 113 | D | 55.4 | Low | 51.3 | Low | 96 Ų | 96 | 125.9 Ų | 125.9 | 51% | 0.513 | 72% | 0.722 | S | S | . | * | trans | -53.5 | 122.7 | 179.8 | -173.5 | -18 | 0 | 0 | 0 | 110.8 | T111 R115 S116 | T111-D113 PolarHBondContact O-N 2.91Å; D113-R115 PolarHBondContact O-N 3.37Å; D113-R115 PolarHBondContact OD1-N 2.8Å; D113-R115 VanDerWaalsContact OD1-N 3.16Å; D113-S116 PolarHBondContact O-N 2.91Å | ||
| 114 | P | 56.2 | Low | 52 | Low | 127 Ų | 127 | 119.6 Ų | 119.6 | 83% | 0.825 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | -1.8 | -176.2 | 27.2 | -36.3 | 0 | 0 | 0 | 114.5 | ||
| 115 | R | 55.1 | Low | 52.8 | Low | 221 Ų | 221 | 122 Ų | 122 | 83% | 0.834 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | -7.9 | 174.8 | -74.5 | -167.9 | 161.3 | 88.7 | 0.3 | 115.1 | D113 | D113-R115 PolarHBondContact O-N 3.37Å; D113-R115 PolarHBondContact OD1-N 2.8Å; D113-R115 VanDerWaalsContact OD1-N 3.16Å |
| 116 | S | 55.7 | Low | 53.6 | Low | 81 Ų | 81 | 120.4 Ų | 120.4 | 57% | 0.566 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -90.5 | 129.9 | -178.1 | -52 | 0 | 0 | 0 | 0 | 110.8 | D113 | D113-S116 PolarHBondContact O-N 2.91Š|
| 117 | P | 54.5 | Low | 53.9 | Low | 112 Ų | 112 | 120.4 Ų | 120.4 | 73% | 0.727 | 70% | 0.703 | S | S | * | * | trans | -60.9 | 138.9 | 174.8 | 24.8 | -31.9 | 0 | 0 | 0 | 110 | N119 | P117-N119 PolarHBondContact O-N 3.31Š| ||
| 118 | P | 53.8 | Low | 54.6 | Low | 130 Ų | 130 | 120.7 Ų | 120.7 | 84% | 0.844 | 71% | 0.71 | S | S | * | * | trans | -65 | 107 | 179.5 | 24 | -30.1 | 0 | 0 | 0 | 109.3 | ||||
| 119 | N | 55 | Low | 55.4 | Low | 95 Ų | 95 | 117.3 Ų | 117.3 | 51% | 0.508 | 69% | 0.694 | S | S | . | * | trans | -85 | 121 | 173.1 | -175.6 | -12.2 | 0 | 0 | 0 | 108.3 | P117 E121 N122 | P117-N119 PolarHBondContact O-N 3.31Å; N119-E121 PolarHBondContact O-N 2.73Å; N119-E121 PolarHBondContact OD1-N 2.87Å; N119-E121 VanDerWaalsContact OD1-N 3.16Å; N119-N122 HydrophobicContact CB-CB 4.39Å; N119-N122 PolarHBondContact O-N 3.11Å | ||
| 120 | P | 59.3 | Low | 56.1 | Low | 111 Ų | 111 | 116.5 Ų | 116.5 | 72% | 0.721 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -12.2 | -178.5 | 26.5 | -36.3 | 0 | 0 | 0 | 114.3 | ||
| 121 | E | 56.6 | Low | 56.5 | Low | 151 Ų | 151 | 115.3 Ų | 115.3 | 71% | 0.706 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | -10.2 | 177.7 | -63.9 | -72.4 | 149.4 | 0 | 0 | 113.3 | N119 I123 | N119-E121 PolarHBondContact O-N 2.73Å; N119-E121 PolarHBondContact OD1-N 2.87Å; N119-E121 VanDerWaalsContact OD1-N 3.16Å; E121-I123 PolarHBondContact O-N 3.25Å |
| 122 | N | 61.6 | Low | 56.8 | Low | 141 Ų | 141 | 118.4 Ų | 118.4 | 75% | 0.754 | 69% | 0.685 | S | S | * | * | trans | -104.2 | 75.8 | -173.6 | -133.3 | 15.5 | 0 | 0 | 0 | 111 | N119 | N119-N122 HydrophobicContact CB-CB 4.39Å; N119-N122 PolarHBondContact O-N 3.11Å | ||
| 123 | I | 57.9 | Low | 56.9 | Low | 83 Ų | 83 | 121.7 Ų | 121.7 | 43% | 0.426 | 69% | 0.691 | S | S | . | * | P | Polyproline II helix | trans | -87.4 | 151.8 | 175.6 | -58 | 163.6 | 0 | 0 | 0 | 109.2 | E121 Y127 | E121-I123 PolarHBondContact O-N 3.25Å; I123-Y127 HydrophobicContact CG2-CG 4.39Å |
| 124 | A | 51.2 | Low | 57 | Low | 59 Ų | 59 | 122.2 Ų | 122.2 | 49% | 0.488 | 69% | 0.692 | S | S | . | * | P | Polyproline II helix | trans | -48.5 | 141.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113 | G126 Y127 | A124-G126 PolarHBondContact O-N 3.31Å; A124-G126 VanDerWaalsContact O-N 3.08Å; A124-Y127 PolarHBondContact O-N 3.18Å |
| 125 | P | 54.1 | Low | 57.4 | Low | 138 Ų | 138 | 121 Ų | 121 | 90% | 0.896 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.6 | 117.6 | 178.1 | -22.9 | 31.7 | 0 | 0 | 0 | 110.9 | ||
| 126 | G | 56.1 | Low | 57.8 | Low | 80 Ų | 80 | 115.9 Ų | 115.9 | 83% | 0.825 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 119 | -7.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | A124 | A124-G126 PolarHBondContact O-N 3.31Å; A124-G126 VanDerWaalsContact O-N 3.08Å |
| 127 | Y | 52.8 | Low | 58.1 | Low | 181 Ų | 181 | 118.9 Ų | 118.9 | 71% | 0.71 | 69% | 0.685 | S | S | * | * | trans | -110.1 | 113.2 | 170.8 | -70.8 | -92.2 | 0 | 0 | 0 | 109.6 | I123 A124 | I123-Y127 HydrophobicContact CG2-CG 4.39Å; A124-Y127 PolarHBondContact O-N 3.18Å | ||
| 128 | S | 59.6 | Low | 58.5 | Low | 118 Ų | 118 | 122.9 Ų | 122.9 | 83% | 0.825 | 69% | 0.691 | S | S | * | * | trans | -61.5 | 139.3 | 162.3 | -170.9 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 129 | G | 62.6 | Low | 58.3 | Low | 33 Ų | 33 | 124.1 Ų | 124.1 | 34% | 0.34 | 68% | 0.683 | S | S | . | * | trans | -54.5 | 176.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | L131 | G129-L131 PolarHBondContact O-N 3.11Å; G129-L131 VanDerWaalsContact O-N 3.13Å | ||
| 130 | P | 61.7 | Low | 58.2 | Low | 102 Ų | 102 | 125.3 Ų | 125.3 | 66% | 0.662 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -49.6 | 127.1 | -179.9 | -7.1 | 10.6 | 0 | 0 | 0 | 109.4 | K132 | P130-K132 PolarHBondContact O-N 3.45Š|
| 131 | L | 60 | Low | 57.8 | Low | 131 Ų | 131 | 125.7 Ų | 125.7 | 69% | 0.686 | 69% | 0.69 | S | S | * | * | trans | -60.9 | 77.1 | -175.1 | -71.8 | 155.1 | 0 | 0 | 0 | 110.7 | G129 E133 I134 | G129-L131 PolarHBondContact O-N 3.11Å; G129-L131 VanDerWaalsContact O-N 3.13Å; L131-E133 PolarHBondContact O-N 2.91Å; L131-I134 HydrophobicContact CB-CD1 4.1Å; L131-I134 HydrophobicContact CB-CG1 4.14Å; L131-I134 HydrophobicContact CD1-CD1 3.81Å; L131-I134 HydrophobicContact CD2-CD1 3.9Å; L131-I134 HydrophobicContact CD2-CG1 4.23Å; L131-I134 HydrophobicContact CG-CD1 4.14Å | ||
| 132 | K | 57.5 | Low | 57.6 | Low | 184 Ų | 184 | 124.7 Ų | 124.7 | 80% | 0.8 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -17 | 177.4 | -89.2 | 176.6 | 174.7 | 169.5 | 0 | 112.3 | P130 | P130-K132 PolarHBondContact O-N 3.45Š|
| 133 | E | 58.3 | Low | 57 | Low | 181 Ų | 181 | 121.7 Ų | 121.7 | 85% | 0.846 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.9 | -9.2 | -174.3 | -64.7 | -170.5 | 177.2 | 0 | 0 | 114.5 | L131 P135 | L131-E133 PolarHBondContact O-N 2.91Å; E133-P135 WeakPolarHBondContact O-CD 3.36Å |
| 134 | I | 57.7 | Low | 56.9 | Low | 107 Ų | 107 | 122.8 Ų | 122.8 | 55% | 0.549 | 70% | 0.699 | S | S | . | * | S | Bend | trans | -84.4 | 106.5 | 171.2 | -57.2 | -177.5 | 0 | 0 | 0 | 106.4 | L131 | L131-I134 HydrophobicContact CB-CD1 4.1Å; L131-I134 HydrophobicContact CB-CG1 4.14Å; L131-I134 HydrophobicContact CD1-CD1 3.81Å; L131-I134 HydrophobicContact CD2-CD1 3.9Å; L131-I134 HydrophobicContact CD2-CG1 4.23Å; L131-I134 HydrophobicContact CG-CD1 4.14Å |
| 135 | P | 64.4 | Low | 57.1 | Low | 101 Ų | 101 | 125 Ų | 125 | 66% | 0.656 | 71% | 0.709 | S | S | * | * | trans | -55.2 | 137 | 171.3 | 23.1 | -30.9 | 0 | 0 | 0 | 107.3 | E133 E137 | E133-P135 WeakPolarHBondContact O-CD 3.36Å; P135-E137 PolarHBondContact O-N 3.21Å | ||
| 136 | P | 63.2 | Low | 57.5 | Low | 114 Ų | 114 | 128 Ų | 128 | 74% | 0.74 | 71% | 0.708 | S | S | * | * | trans | -51.3 | 116.9 | 179 | 21.5 | -32.1 | 0 | 0 | 0 | 107.1 | K138 | P136-K138 PolarHBondContact O-N 2.99Š| ||
| 137 | E | 61.5 | Low | 58.1 | Low | 145 Ų | 145 | 132.7 Ų | 132.7 | 68% | 0.678 | 70% | 0.702 | S | S | * | * | trans | -51.3 | 109.5 | 177.8 | -176 | 176.8 | 178.8 | 0 | 0 | 105.8 | P135 F139 | P135-E137 PolarHBondContact O-N 3.21Å; E137-F139 HydrophobicContact CB-CD2 4.21Å; E137-F139 HydrophobicContact CB-CE2 4.32Å; E137-F139 VanDerWaalsContact CD-CE2 3.46Å; E137-F139 HydrophobicContact CG-CD2 3.96Å; E137-F139 HydrophobicContact CG-CE2 3.97Å; E137-F139 PolarHBondContact O-N 3.39Å; E137-F139 WeakPolarHBondContact OE2-CE2 3.49Å | ||
| 138 | K | 62.5 | Low | 59.1 | Low | 196 Ų | 196 | 133.2 Ų | 133.2 | 85% | 0.852 | 70% | 0.704 | S | S | * | * | trans | -70.3 | 76.3 | 175.7 | -68.3 | -172.9 | -178.7 | -178.6 | 0 | 106 | P136 N140 | P136-K138 PolarHBondContact O-N 2.99Å; K138-N140 PolarHBondContact O-N 3.41Å | ||
| 139 | F | 51.6 | Low | 59.6 | Low | 156 Ų | 156 | 132.1 Ų | 132.1 | 68% | 0.684 | 69% | 0.686 | S | S | * | * | trans | -48.3 | 118.1 | 163.8 | -94 | -89.3 | 0 | 0 | 0 | 106 | E137 T141 | E137-F139 HydrophobicContact CB-CD2 4.21Å; E137-F139 HydrophobicContact CB-CE2 4.32Å; E137-F139 VanDerWaalsContact CD-CE2 3.46Å; E137-F139 HydrophobicContact CG-CD2 3.96Å; E137-F139 HydrophobicContact CG-CE2 3.97Å; E137-F139 PolarHBondContact O-N 3.39Å; E137-F139 WeakPolarHBondContact OE2-CE2 3.49Å; F139-T141 PolarHBondContact O-N 3.31Å | ||
| 140 | N | 51.3 | Low | 60.3 | Low | 119 Ų | 119 | 132.1 Ų | 132.1 | 64% | 0.636 | 68% | 0.68 | S | S | * | * | trans | -40.5 | 106.1 | -170.6 | -60.6 | -63.1 | 0 | 0 | 0 | 111.7 | K138 T142 A143 | K138-N140 PolarHBondContact O-N 3.41Å; N140-T142 PolarHBondContact O-N 3.28Å; N140-A143 WeakPolarHBondContact O-CB 3.07Å; N140-A143 PolarHBondContact O-N 2.96Å | ||
| 141 | T | 50.7 | Low | 61.2 | Low | 120 Ų | 120 | 131 Ų | 131 | 74% | 0.736 | 67% | 0.673 | S | S | * | * | G | 310 helix | trans | -62.3 | -8.9 | 171.9 | -50 | 0 | 0 | 0 | 0 | 111.9 | F139 A143 | F139-T141 PolarHBondContact O-N 3.31Å; T141-A143 VanDerWaalsContact C-N 3.29Å |
| 142 | T | 52.9 | Low | 62 | Low | 130 Ų | 130 | 132.8 Ų | 132.8 | 80% | 0.798 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -80.5 | -3.7 | 171.6 | 46 | 0 | 0 | 0 | 0 | 114.2 | N140 | N140-T142 PolarHBondContact O-N 3.28Š|
| 143 | A | 48.4 | Very low | 63 | Low | 77 Ų | 77 | 126.9 Ų | 126.9 | 64% | 0.636 | 65% | 0.646 | S | S | * | * | G | 310 helix | trans | -96.9 | 12.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | N140 T141 P145 | N140-A143 WeakPolarHBondContact O-CB 3.07Å; N140-A143 PolarHBondContact O-N 2.96Å; T141-A143 VanDerWaalsContact C-N 3.29Å; A143-P145 WeakPolarHBondContact O-CD 3.49Å |
| 144 | V | 57.3 | Low | 64 | Low | 106 Ų | 106 | 124.3 Ų | 124.3 | 64% | 0.642 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -69.7 | 108.9 | 161.1 | -177.5 | 0 | 0 | 0 | 0 | 105.1 | K146 | V144-K146 PolarHBondContact O-N 3.25Š|
| 145 | P | 54.5 | Low | 65 | Low | 105 Ų | 105 | 122.4 Ų | 122.4 | 68% | 0.682 | 63% | 0.634 | S | S | * | * | trans | -54.4 | 138.2 | 172.4 | -13.5 | 28.6 | 0 | 0 | 0 | 106.1 | A143 Y147 | A143-P145 WeakPolarHBondContact O-CD 3.49Å; P145-Y147 WeakPolarHBondContact O-CA 3.28Å; P145-Y147 PolarHBondContact O-N 3.01Å | ||
| 146 | K | 62.9 | Low | 65.9 | Low | 202 Ų | 202 | 118.9 Ų | 118.9 | 88% | 0.878 | 61% | 0.61 | S | S | * | * | trans | -40.4 | 113.1 | 163.7 | -71.9 | 178.9 | 178.5 | -180 | 0 | 105.7 | V144 Y148 | V144-K146 PolarHBondContact O-N 3.25Å; K146-Y148 PolarHBondContact O-N 3.35Å | ||
| 147 | Y | 69.1 | Low | 66.5 | Low | 179 Ų | 179 | 116.3 Ų | 116.3 | 70% | 0.702 | 59% | 0.594 | S | S | * | * | trans | -50.9 | 138.5 | -169.5 | 42.8 | -88.5 | 0 | 0 | 0 | 107.5 | P145 Q149 | P145-Y147 WeakPolarHBondContact O-CA 3.28Å; P145-Y147 PolarHBondContact O-N 3.01Å; Y147-Q149 PolarHBondContact O-N 3.15Å | ||
| 148 | Y | 72.9 | Confident | 67.4 | Low | 191 Ų | 191 | 115.8 Ų | 115.8 | 75% | 0.749 | 60% | 0.596 | S | S | * | * | trans | -53.2 | 113.1 | 171.5 | 168 | -98.4 | 0 | 0 | 0 | 107.3 | K146 P151 | K146-Y148 PolarHBondContact O-N 3.35Å; Y148-P151 WeakPolarHBondContact OH-CD 3.49Å | ||
| 149 | Q | 71.1 | Confident | 68.5 | Low | 96 Ų | 96 | 110.4 Ų | 110.4 | 45% | 0.449 | 58% | 0.577 | S | S | . | * | trans | -89.9 | 119.9 | 173.6 | -163.8 | 174.8 | 5.3 | 0 | 0 | 106.9 | Y147 P151 E153 | Y147-Q149 PolarHBondContact O-N 3.15Å; Q149-P151 WeakPolarHBondContact O-CD 3.06Å; Q149-E153 WeakPolarHBondContact CG-OE2 3.43Å; Q149-E153 PolarHBondContact NE2-OE2 3.42Å | ||
| 150 | S | 76.6 | Confident | 69.9 | Low | 32 Ų | 32 | 107.8 Ų | 107.8 | 22% | 0.224 | 58% | 0.576 | C | S | . | * | trans | -64.4 | 128.4 | 178.6 | -179.7 | 0 | 0 | 0 | 0 | 109 | W152 E153 | S150-W152 PolarHBondContact O-N 2.97Å; S150-W152 WeakPolarHBondContact OG-CB 3.39Å; S150-W152 PolarHBondContact OG-N 2.94Å; S150-E153 WeakPolarHBondContact O-CB 3.5Å; S150-E153 PolarHBondContact O-N 3.48Å | ||
| 151 | P | 80.3 | Confident | 71.3 | Confident | 79 Ų | 79 | 110.1 Ų | 110.1 | 51% | 0.513 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -56.1 | -24.5 | 172.6 | -25.5 | 34.6 | 0 | 0 | 0 | 112.8 | Y148 Q149 E153 Q154 A155 | Y148-P151 WeakPolarHBondContact OH-CD 3.49Å; Q149-P151 WeakPolarHBondContact O-CD 3.06Å; P151-E153 VanDerWaalsContact C-N 3.32Å; P151-E153 PolarHBondContact O-N 2.89Å; P151-Q154 PolarHBondContact O-N 2.99Å; P151-A155 PolarHBondContact O-N 3.08Å; P151-A155 VanDerWaalsContact O-N 3.1Å |
| 152 | W | 78.3 | Confident | 72.6 | Confident | 169 Ų | 169 | 108.8 Ų | 108.8 | 64% | 0.64 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.7 | -29.9 | 174.7 | -62.4 | 96.2 | 0 | 0 | 0 | 113 | S150 Q154 A155 I156 | S150-W152 PolarHBondContact O-N 2.97Å; S150-W152 WeakPolarHBondContact OG-CB 3.39Å; S150-W152 PolarHBondContact OG-N 2.94Å; W152-Q154 VanDerWaalsContact C-N 3.28Å; W152-Q154 PolarHBondContact O-N 2.86Å; W152-A155 PolarHBondContact O-N 3.17Å; W152-I156 HydrophobicContact CB-CD1 4.13Å; W152-I156 HydrophobicContact CE3-CD1 4.15Å; W152-I156 WeakPolarHBondContact O-CB 3.46Å; W152-I156 VanDerWaalsContact O-CG1 3.27Å; W152-I156 WeakPolarHBondContact O-CG1 3.44Å; W152-I156 PolarHBondContact O-N 2.83Å |
| 153 | E | 77.8 | Confident | 73.8 | Confident | 59 Ų | 59 | 105 Ų | 105 | 28% | 0.276 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 173 | -77.2 | -177.1 | 162.2 | 0 | 0 | 111 | Q149 S150 P151 S157 Y167 | Q149-E153 WeakPolarHBondContact CG-OE2 3.43Å; Q149-E153 PolarHBondContact NE2-OE2 3.42Å; S150-E153 WeakPolarHBondContact O-CB 3.5Å; S150-E153 PolarHBondContact O-N 3.48Å; P151-E153 VanDerWaalsContact C-N 3.32Å; P151-E153 PolarHBondContact O-N 2.89Å; E153-S157 WeakPolarHBondContact O-CA 3.29Å; E153-S157 WeakPolarHBondContact O-CB 3.44Å; E153-S157 PolarHBondContact O-N 3.04Å; E153-Y167 PolarHBondContact OE1-OH 2.76Å |
| 154 | Q | 78.4 | Confident | 75.1 | Confident | 128 Ų | 128 | 106.3 Ų | 106.3 | 60% | 0.598 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -72.5 | -43.3 | 177.2 | -67.2 | -178.7 | -11.7 | 0 | 0 | 111.9 | P151 W152 I156 S157 | P151-Q154 PolarHBondContact O-N 2.99Å; W152-Q154 VanDerWaalsContact C-N 3.28Å; W152-Q154 PolarHBondContact O-N 2.86Å; Q154-I156 VanDerWaalsContact C-N 3.3Å; Q154-I156 PolarHBondContact O-N 2.89Å; Q154-S157 PolarHBondContact O-N 3.03Å; Q154-S157 PolarHBondContact O-OG 3.11Å |
| 155 | A | 79.4 | Confident | 76 | Confident | 67 Ų | 67 | 104.8 Ų | 104.8 | 55% | 0.554 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.9 | -34.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | P151 W152 | P151-A155 PolarHBondContact O-N 3.08Å; P151-A155 VanDerWaalsContact O-N 3.1Å; W152-A155 PolarHBondContact O-N 3.17Å |
| 156 | I | 82.4 | Confident | 76.8 | Confident | 27 Ų | 27 | 103.5 Ų | 103.5 | 14% | 0.138 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -95.2 | -11.4 | -175.7 | -63.3 | 167.3 | 0 | 0 | 0 | 111.6 | W152 Q154 N158 D159 L162 L163 L166 | W152-I156 HydrophobicContact CB-CD1 4.13Å; W152-I156 HydrophobicContact CE3-CD1 4.15Å; W152-I156 WeakPolarHBondContact O-CB 3.46Å; W152-I156 VanDerWaalsContact O-CG1 3.27Å; W152-I156 WeakPolarHBondContact O-CG1 3.44Å; W152-I156 PolarHBondContact O-N 2.83Å; Q154-I156 VanDerWaalsContact C-N 3.3Å; Q154-I156 PolarHBondContact O-N 2.89Å; I156-N158 PolarHBondContact O-N 3.04Å; I156-D159 PolarHBondContact O-N 2.77Å; I156-L162 HydrophobicContact CG2-CB 3.31Å; I156-L162 HydrophobicContact CG2-CD1 4.42Å; I156-L163 HydrophobicContact CG2-CD2 4.33Å; I156-L163 HydrophobicContact CG2-CG 4.26Å; I156-L166 HydrophobicContact CB-CD1 4.1Å; I156-L166 HydrophobicContact CD1-CD1 3.8Å; I156-L166 HydrophobicContact CD1-CD2 4.47Å; I156-L166 HydrophobicContact CD1-CG 4.35Å; I156-L166 HydrophobicContact CG2-CD1 3.88Å |
| 157 | S | 75.6 | Confident | 77.1 | Confident | 59 Ų | 59 | 100.5 Ų | 100.5 | 41% | 0.413 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | -26.1 | -176.5 | 62.8 | 0 | 0 | 0 | 0 | 115.5 | E153 Q154 L163 | E153-S157 WeakPolarHBondContact O-CA 3.29Å; E153-S157 WeakPolarHBondContact O-CB 3.44Å; E153-S157 PolarHBondContact O-N 3.04Å; Q154-S157 PolarHBondContact O-N 3.03Å; Q154-S157 PolarHBondContact O-OG 3.11Å; S157-L163 WeakPolarHBondContact O-CD1 3.42Å |
| 158 | N | 82 | Confident | 77.1 | Confident | 135 Ų | 135 | 96 Ų | 96 | 72% | 0.722 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | -17.3 | -178.9 | -61.4 | -38.6 | 0 | 0 | 0 | 113 | I156 | I156-N158 PolarHBondContact O-N 3.04Š|
| 159 | D | 85.1 | Confident | 76.8 | Confident | 83 Ų | 83 | 94.7 Ų | 94.7 | 44% | 0.444 | 50% | 0.498 | S | S | . | . | trans | -109.6 | 104.5 | -175.4 | -69.5 | -22.2 | 0 | 0 | 0 | 110.4 | I156 E161 L162 L163 | I156-D159 PolarHBondContact O-N 2.77Å; D159-E161 VanDerWaalsContact C-N 3.34Å; D159-E161 PolarHBondContact O-N 3.45Å; D159-L162 HydrophobicContact CB-CB 4.13Å; D159-L162 HydrophobicContact CB-CD1 3.96Å; D159-L162 HydrophobicContact CB-CG 4.18Å; D159-L162 PolarHBondContact O-N 3.32Å; D159-L163 PolarHBondContact O-N 3.2Å; D159-L163 VanDerWaalsContact O-N 3.09Å | ||
| 160 | P | 80.7 | Confident | 76.6 | Confident | 101 Ų | 101 | 96.9 Ų | 96.9 | 66% | 0.656 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.2 | -32.6 | -172.3 | 25.4 | -33.8 | 0 | 0 | 0 | 113.3 | L163 E164 | P160-L163 PolarHBondContact O-N 3.44Å; P160-E164 PolarHBondContact O-N 2.89Å; P160-E164 VanDerWaalsContact O-N 3.09Å |
| 161 | E | 80.6 | Confident | 76.2 | Confident | 168 Ų | 168 | 105 Ų | 105 | 79% | 0.785 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.4 | -39.5 | 177.4 | -68.9 | -174.1 | 166.7 | 0 | 0 | 112.3 | D159 E164 A165 | D159-E161 VanDerWaalsContact C-N 3.34Å; D159-E161 PolarHBondContact O-N 3.45Å; E161-E164 PolarHBondContact O-N 3.2Å; E161-A165 PolarHBondContact O-N 3.34Å |
| 162 | L | 77.8 | Confident | 75.5 | Confident | 92 Ų | 92 | 110.3 Ų | 110.3 | 48% | 0.482 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -75.1 | -34.1 | 179.2 | -68.4 | 180 | 0 | 0 | 0 | 111.7 | I156 D159 E164 A165 L166 | I156-L162 HydrophobicContact CG2-CB 3.31Å; I156-L162 HydrophobicContact CG2-CD1 4.42Å; D159-L162 HydrophobicContact CB-CB 4.13Å; D159-L162 HydrophobicContact CB-CD1 3.96Å; D159-L162 HydrophobicContact CB-CG 4.18Å; D159-L162 PolarHBondContact O-N 3.32Å; L162-E164 VanDerWaalsContact C-N 3.32Å; L162-A165 PolarHBondContact O-N 3.27Å; L162-L166 PolarHBondContact O-N 3Å; L162-L166 VanDerWaalsContact O-N 3.09Å |
| 163 | L | 77.7 | Confident | 74.8 | Confident | 49 Ų | 49 | 108.1 Ų | 108.1 | 26% | 0.257 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.9 | -41.4 | 170.1 | -81 | 175.4 | 0 | 0 | 0 | 112 | I156 S157 D159 P160 A165 L166 Y167 | I156-L163 HydrophobicContact CG2-CD2 4.33Å; I156-L163 HydrophobicContact CG2-CG 4.26Å; S157-L163 WeakPolarHBondContact O-CD1 3.42Å; D159-L163 PolarHBondContact O-N 3.2Å; D159-L163 VanDerWaalsContact O-N 3.09Å; P160-L163 PolarHBondContact O-N 3.44Å; L163-A165 VanDerWaalsContact C-N 3.27Å; L163-A165 PolarHBondContact O-N 3.04Å; L163-L166 PolarHBondContact O-N 2.71Å; L163-Y167 WeakPolarHBondContact O-CD2 3.44Å; L163-Y167 PolarHBondContact O-N 2.85Å |
| 164 | E | 76.3 | Confident | 74.4 | Confident | 106 Ų | 106 | 114.1 Ų | 114.1 | 50% | 0.495 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.2 | -31.8 | 176.8 | -171.7 | 168.7 | -174.1 | 0 | 0 | 112 | P160 E161 L162 Y167 K169 | P160-E164 PolarHBondContact O-N 2.89Å; P160-E164 VanDerWaalsContact O-N 3.09Å; E161-E164 PolarHBondContact O-N 3.2Å; L162-E164 VanDerWaalsContact C-N 3.32Å; E164-Y167 CarbonylContact O-C 3.4Å; E164-K169 WeakPolarHBondContact OE1-CE 3.4Å; E164-K169 IonicContact OE1-NZ 2.64Å; E164-K169 PolarHBondContact OE1-NZ 3.03Å |
| 165 | A | 75.6 | Confident | 74 | Confident | 73 Ų | 73 | 111.6 Ų | 111.6 | 60% | 0.603 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -71.2 | -33.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | E161 L162 L163 | E161-A165 PolarHBondContact O-N 3.34Å; L162-A165 PolarHBondContact O-N 3.27Å; L163-A165 VanDerWaalsContact C-N 3.27Å; L163-A165 PolarHBondContact O-N 3.04Å |
| 166 | L | 71.5 | Confident | 73.2 | Confident | 79 Ų | 79 | 118 Ų | 118 | 41% | 0.414 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -70.8 | -29.9 | 177.5 | -78.3 | 179.7 | 0 | 0 | 0 | 113.4 | I156 L162 L163 P168 | I156-L166 HydrophobicContact CB-CD1 4.1Å; I156-L166 HydrophobicContact CD1-CD1 3.8Å; I156-L166 HydrophobicContact CD1-CD2 4.47Å; I156-L166 HydrophobicContact CD1-CG 4.35Å; I156-L166 HydrophobicContact CG2-CD1 3.88Å; L162-L166 PolarHBondContact O-N 3Å; L162-L166 VanDerWaalsContact O-N 3.09Å; L163-L166 PolarHBondContact O-N 2.71Å; L166-P168 WeakPolarHBondContact O-CD 3.47Å |
| 167 | Y | 69.6 | Low | 72.6 | Confident | 139 Ų | 139 | 120.6 Ų | 120.6 | 55% | 0.545 | 64% | 0.643 | S | S | . | * | S | Bend | trans | -107.5 | 81 | 171.7 | -60.3 | -74.3 | 0 | 0 | 0 | 108.7 | E153 L163 E164 K169 | E153-Y167 PolarHBondContact OE1-OH 2.76Å; L163-Y167 WeakPolarHBondContact O-CD2 3.44Å; L163-Y167 PolarHBondContact O-N 2.85Å; E164-Y167 CarbonylContact O-C 3.4Å; Y167-K169 PolarHBondContact O-N 3.04Å |
| 168 | P | 70.1 | Confident | 72.3 | Confident | 85 Ų | 85 | 127 Ų | 127 | 55% | 0.552 | 67% | 0.667 | S | S | * | * | trans | -49.3 | 123.6 | 171.5 | -15.2 | 18.8 | 0 | 0 | 0 | 107.3 | L166 L170 | L166-P168 WeakPolarHBondContact O-CD 3.47Å; P168-L170 HydrophobicContact CB-CD2 4.22Å; P168-L170 HydrophobicContact CB-CG 4.38Å; P168-L170 PolarHBondContact O-N 2.99Å | ||
| 169 | K | 65.9 | Low | 71.8 | Confident | 163 Ų | 163 | 127.6 Ų | 127.6 | 71% | 0.709 | 67% | 0.669 | S | S | * | * | trans | -62.1 | 76.3 | 164.2 | -76.5 | 171.6 | 176.6 | 160.9 | 0 | 106.5 | E164 Y167 F171 | E164-K169 WeakPolarHBondContact OE1-CE 3.4Å; E164-K169 IonicContact OE1-NZ 2.64Å; E164-K169 PolarHBondContact OE1-NZ 3.03Å; Y167-K169 PolarHBondContact O-N 3.04Å; K169-F171 PolarHBondContact O-N 3.06Å; K169-F171 VanDerWaalsContact O-N 3.07Å | ||
| 170 | L | 67.3 | Low | 71.4 | Confident | 142 Ų | 142 | 127.6 Ų | 127.6 | 74% | 0.743 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 119.4 | 173.3 | -68 | 175.9 | 0 | 0 | 0 | 104.6 | P168 K172 | P168-L170 HydrophobicContact CB-CD2 4.22Å; P168-L170 HydrophobicContact CB-CG 4.38Å; P168-L170 PolarHBondContact O-N 2.99Å; L170-K172 PolarHBondContact O-N 3.23Å |
| 171 | F | 67 | Low | 70.9 | Confident | 202 Ų | 202 | 130.5 Ų | 130.5 | 89% | 0.886 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 117.6 | 171.6 | -67.6 | -79 | 0 | 0 | 0 | 106.8 | K169 P173 | K169-F171 PolarHBondContact O-N 3.06Å; K169-F171 VanDerWaalsContact O-N 3.07Å; F171-P173 WeakPolarHBondContact O-CD 3.46Å; F171-P173 VanDerWaalsContact O-N 3.13Å |
| 172 | K | 66.1 | Low | 70.3 | Confident | 191 Ų | 191 | 131.3 Ų | 131.3 | 83% | 0.83 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 124.1 | 173.4 | -72.8 | -179.2 | 179.5 | 176.3 | 0 | 105.2 | L170 E174 | L170-K172 PolarHBondContact O-N 3.23Å; K172-E174 PolarHBondContact O-N 3.04Å |
| 173 | P | 64.1 | Low | 69.8 | Low | 122 Ų | 122 | 136.8 Ų | 136.8 | 79% | 0.792 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 119.1 | 174.2 | 20.2 | -28.8 | 0 | 0 | 0 | 106.5 | F171 G175 | F171-P173 WeakPolarHBondContact O-CD 3.46Å; F171-P173 VanDerWaalsContact O-N 3.13Å; P173-G175 PolarHBondContact O-N 3.09Å |
| 174 | E | 69.1 | Low | 69.2 | Low | 186 Ų | 186 | 138.6 Ų | 138.6 | 87% | 0.869 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 142.9 | 178.4 | -72 | -165.8 | 152.7 | 0 | 0 | 108.7 | K172 K176 | K172-E174 PolarHBondContact O-N 3.04Å; E174-K176 PolarHBondContact O-N 3.36Å |
| 175 | G | 69.6 | Low | 68.6 | Low | 74 Ų | 74 | 142.3 Ų | 142.3 | 76% | 0.763 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 128.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 109 | P173 A177 | P173-G175 PolarHBondContact O-N 3.09Å; G175-A177 PolarHBondContact O-N 2.93Å |
| 176 | K | 63.6 | Low | 67.9 | Low | 203 Ų | 203 | 144.5 Ų | 144.5 | 88% | 0.883 | 73% | 0.728 | S | S | * | * | trans | -43 | 111.9 | -176.6 | -64.4 | -179.7 | 179.2 | -179.6 | 0 | 108.9 | E174 E178 | E174-K176 PolarHBondContact O-N 3.36Å; K176-E178 PolarHBondContact O-N 3.41Å | ||
| 177 | A | 70.3 | Confident | 67.5 | Low | 80 Ų | 80 | 151.9 Ų | 151.9 | 66% | 0.661 | 75% | 0.75 | S | S | * | * | trans | -54.8 | 130.4 | 170 | 0 | 0 | 0 | 0 | 0 | 107.2 | G175 L179 | G175-A177 PolarHBondContact O-N 2.93Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 3.4Å | ||
| 178 | E | 68.8 | Low | 67 | Low | 195 Ų | 195 | 149.9 Ų | 149.9 | 91% | 0.911 | 75% | 0.752 | S | S | * | * | trans | -60.8 | 99.7 | 172 | -75.1 | -173.5 | 160.8 | 0 | 0 | 107.3 | K176 | K176-E178 PolarHBondContact O-N 3.41Š| ||
| 179 | L | 70.8 | Confident | 66.5 | Low | 147 Ų | 147 | 149.8 Ų | 149.8 | 77% | 0.77 | 76% | 0.759 | S | S | * | * | trans | -64.9 | 136.1 | 176.2 | -67.1 | 174 | 0 | 0 | 0 | 107.6 | A177 D181 | A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 3.4Å; L179-D181 PolarHBondContact O-N 3.21Å | ||
| 180 | P | 76.7 | Confident | 66.4 | Low | 83 Ų | 83 | 145.8 Ų | 145.8 | 54% | 0.539 | 75% | 0.748 | S | S | . | * | trans | -52.5 | 139.3 | 171.8 | -24.3 | 32.6 | 0 | 0 | 0 | 110.5 | Y182 | P180-Y182 VanDerWaalsContact C-N 3.33Å; P180-Y182 HydrophobicContact CB-CD2 4.45Å; P180-Y182 HydrophobicContact CB-CE2 4.03Å; P180-Y182 HydrophobicContact CG-CE2 4.26Å; P180-Y182 WeakPolarHBondContact O-CD2 3.38Å; P180-Y182 PolarHBondContact O-N 3.03Å | ||
| 181 | D | 70.6 | Confident | 66.1 | Low | 161 Ų | 161 | 141.5 Ų | 141.5 | 86% | 0.861 | 73% | 0.729 | S | S | * | * | trans | -67.9 | 91.7 | 175.8 | -171.9 | 26.2 | 0 | 0 | 0 | 109.4 | L179 R183 | L179-D181 PolarHBondContact O-N 3.21Å; D181-R183 PolarHBondContact O-N 3.36Å; D181-R183 VanDerWaalsContact O-N 3.1Å | ||
| 182 | Y | 67.1 | Low | 65.6 | Low | 185 Ų | 185 | 142.7 Ų | 142.7 | 73% | 0.725 | 73% | 0.734 | S | S | * | * | trans | -75.3 | 100.6 | 176 | -72.7 | -79.9 | 0 | 0 | 0 | 109 | P180 S184 | P180-Y182 VanDerWaalsContact C-N 3.33Å; P180-Y182 HydrophobicContact CB-CD2 4.45Å; P180-Y182 HydrophobicContact CB-CE2 4.03Å; P180-Y182 HydrophobicContact CG-CE2 4.26Å; P180-Y182 WeakPolarHBondContact O-CD2 3.38Å; P180-Y182 PolarHBondContact O-N 3.03Å; Y182-S184 PolarHBondContact O-N 2.85Å | ||
| 183 | R | 68.6 | Low | 65.6 | Low | 208 Ų | 208 | 136.1 Ų | 136.1 | 79% | 0.785 | 72% | 0.721 | S | S | * | * | trans | -61.9 | 103.2 | 173.2 | -148.1 | 175.7 | -169.9 | -150.3 | 3.2 | 109.4 | D181 F185 | D181-R183 PolarHBondContact O-N 3.36Å; D181-R183 VanDerWaalsContact O-N 3.1Å; R183-F185 WeakPolarHBondContact O-CE2 2.96Å; R183-F185 PolarHBondContact O-N 3Å | ||
| 184 | S | 64.9 | Low | 65.8 | Low | 86 Ų | 86 | 131.6 Ų | 131.6 | 60% | 0.601 | 70% | 0.696 | S | S | * | * | trans | -74.4 | 114.4 | 177.1 | 62.1 | 0 | 0 | 0 | 0 | 109.9 | Y182 N186 | Y182-S184 PolarHBondContact O-N 2.85Å; S184-N186 PolarHBondContact O-N 3.14Å | ||
| 185 | F | 64 | Low | 65.4 | Low | 184 Ų | 184 | 129 Ų | 129 | 81% | 0.807 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -72.3 | -5.6 | 174.2 | -43.6 | -79.9 | 0 | 0 | 0 | 112.4 | R183 R187 | R183-F185 WeakPolarHBondContact O-CE2 2.96Å; R183-F185 PolarHBondContact O-N 3Å; F185-R187 PolarHBondContact O-N 3.45Å |
| 186 | N | 61.5 | Low | 65.1 | Low | 120 Ų | 120 | 134 Ų | 134 | 64% | 0.642 | 69% | 0.685 | S | S | * | * | trans | -101.5 | 58.4 | -179.4 | -65.6 | -30.3 | 0 | 0 | 0 | 111.5 | S184 V188 | S184-N186 PolarHBondContact O-N 3.14Å; N186-V188 PolarHBondContact O-N 2.95Å | ||
| 187 | R | 62.7 | Low | 64.8 | Low | 234 Ų | 234 | 131 Ų | 131 | 88% | 0.883 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -67.6 | -18.7 | 164.5 | -64.7 | -174.8 | 87.8 | 160.2 | 5.7 | 111.6 | F185 | F185-R187 PolarHBondContact O-N 3.45Š|
| 188 | V | 59.3 | Low | 64.1 | Low | 97 Ų | 97 | 129.2 Ų | 129.2 | 59% | 0.588 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -143.1 | 131 | 167.1 | -163.7 | 0 | 0 | 0 | 0 | 106.1 | N186 T190 | N186-V188 PolarHBondContact O-N 2.95Å; V188-T190 VanDerWaalsContact C-N 3.29Å; V188-T190 PolarHBondContact O-N 3.03Å; V188-T190 PolarHBondContact O-OG1 3.02Å |
| 189 | A | 59.8 | Low | 63.5 | Low | 83 Ų | 83 | 124.6 Ų | 124.6 | 69% | 0.686 | 65% | 0.647 | S | S | * | * | trans | -63 | 92.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109 | P191 | A189-P191 WeakPolarHBondContact O-CD 3.08Š| ||
| 190 | T | 62.7 | Low | 62.9 | Low | 79 Ų | 79 | 125.9 Ų | 125.9 | 49% | 0.485 | 65% | 0.646 | S | S | . | * | trans | -88.4 | 112 | 175.6 | -54.8 | 0 | 0 | 0 | 0 | 106.5 | V188 F195 | V188-T190 VanDerWaalsContact C-N 3.29Å; V188-T190 PolarHBondContact O-N 3.03Å; V188-T190 PolarHBondContact O-OG1 3.02Å; T190-F195 HydrophobicContact CG2-CE2 4.26Å | ||
| 191 | P | 61.5 | Low | 62.1 | Low | 52 Ų | 52 | 128 Ų | 128 | 34% | 0.338 | 65% | 0.651 | S | S | . | * | trans | -60.6 | 143.7 | 176.7 | 25 | -31.8 | 0 | 0 | 0 | 109.2 | A189 G193 G194 A198 | A189-P191 WeakPolarHBondContact O-CD 3.08Å; P191-G193 PolarHBondContact O-N 3.46Å; P191-G194 PolarHBondContact O-N 3.47Å; P191-A198 HydrophobicContact CB-CB 4.39Å; P191-A198 HydrophobicContact CG-CB 3.7Å | ||
| 192 | F | 56.6 | Low | 61.5 | Low | 226 Ų | 226 | 126.7 Ų | 126.7 | 99% | 0.991 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.7 | 117 | 174.7 | -90.7 | -87.2 | 0 | 0 | 0 | 109.5 | ||
| 193 | G | 66.5 | Low | 61.3 | Low | 54 Ų | 54 | 126.9 Ų | 126.9 | 56% | 0.557 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 99.1 | 5.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | P191 | P191-G193 PolarHBondContact O-N 3.46Š|
| 194 | G | 68.2 | Low | 60.9 | Low | 26 Ų | 26 | 124.4 Ų | 124.4 | 27% | 0.268 | 65% | 0.649 | S | S | . | * | trans | 81.6 | 163.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 115 | P191 E196 K197 A198 | P191-G194 PolarHBondContact O-N 3.47Å; G194-E196 VanDerWaalsContact C-N 3.25Å; G194-E196 PolarHBondContact O-N 3.22Å; G194-K197 PolarHBondContact O-N 2.94Å; G194-A198 PolarHBondContact O-N 3.13Å | ||
| 195 | F | 59.3 | Low | 60.9 | Low | 132 Ų | 132 | 129.3 Ų | 129.3 | 58% | 0.579 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -63.1 | -26.5 | -173.4 | -67.4 | -81.3 | 0 | 0 | 0 | 114.2 | T190 K197 A198 | T190-F195 HydrophobicContact CG2-CE2 4.26Å; F195-K197 VanDerWaalsContact C-N 3.27Å; F195-K197 PolarHBondContact O-N 3.35Å; F195-A198 PolarHBondContact O-N 2.85Å |
| 196 | E | 63.1 | Low | 60.7 | Low | 178 Ų | 178 | 124.9 Ų | 124.9 | 83% | 0.832 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -66.4 | -27.4 | 179.2 | -63.5 | -167.2 | 174.1 | 0 | 0 | 113.4 | G194 S199 | G194-E196 VanDerWaalsContact C-N 3.25Å; G194-E196 PolarHBondContact O-N 3.22Å; E196-S199 PolarHBondContact O-OG 3.27Å |
| 197 | K | 59 | Low | 61.1 | Low | 141 Ų | 141 | 122.8 Ų | 122.8 | 61% | 0.613 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -91.9 | -23.7 | 177.3 | -65.1 | -173 | -179.2 | 179.6 | 0 | 112.9 | G194 F195 K200 | G194-K197 PolarHBondContact O-N 2.94Å; F195-K197 VanDerWaalsContact C-N 3.27Å; F195-K197 PolarHBondContact O-N 3.35Å; K197-K200 PolarHBondContact O-N 3.45Å |
| 198 | A | 54.5 | Low | 60.9 | Low | 42 Ų | 42 | 119.6 Ų | 119.6 | 35% | 0.347 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -71.5 | -30.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | P191 G194 F195 K200 I201 | P191-A198 HydrophobicContact CB-CB 4.39Å; P191-A198 HydrophobicContact CG-CB 3.7Å; G194-A198 PolarHBondContact O-N 3.13Å; F195-A198 PolarHBondContact O-N 2.85Å; A198-K200 PolarHBondContact O-N 3.21Å; A198-K200 VanDerWaalsContact O-N 3.14Å; A198-I201 PolarHBondContact O-N 3.47Å |
| 199 | S | 56.7 | Low | 60.9 | Low | 98 Ų | 98 | 122 Ų | 122 | 69% | 0.685 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | -13.1 | 178.3 | 62.9 | 0 | 0 | 0 | 0 | 114 | E196 | E196-S199 PolarHBondContact O-OG 3.27Š|
| 200 | K | 58.7 | Low | 60.9 | Low | 175 Ų | 175 | 125.5 Ų | 125.5 | 76% | 0.761 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.7 | -1 | -176 | -68.9 | -174.3 | -179.8 | 178.9 | 0 | 115 | K197 A198 | K197-K200 PolarHBondContact O-N 3.45Å; A198-K200 PolarHBondContact O-N 3.21Å; A198-K200 VanDerWaalsContact O-N 3.14Å |
| 201 | I | 59.8 | Low | 60.7 | Low | 126 Ų | 126 | 126.9 Ų | 126.9 | 65% | 0.646 | 65% | 0.649 | S | S | * | * | trans | -134.7 | 74.5 | -169.2 | -48.2 | 174.6 | 0 | 0 | 0 | 110.9 | A198 | A198-I201 PolarHBondContact O-N 3.47Š| ||
| 202 | V | 57.5 | Low | 60.5 | Low | 134 Ų | 134 | 130.6 Ų | 130.6 | 81% | 0.812 | 67% | 0.666 | S | S | * | * | trans | -119.9 | 75 | 147.6 | -172.6 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 203 | K | 61.7 | Low | 60.5 | Low | 190 Ų | 190 | 124.8 Ų | 124.8 | 83% | 0.826 | 65% | 0.645 | S | S | * | * | trans | -104.6 | 51.8 | 159.5 | -65.2 | -173 | -177 | -178.5 | 0 | 108.3 | K205 | K203-K205 PolarHBondContact O-N 3.14Š| ||
| 204 | F | 61.4 | Low | 60 | Low | 155 Ų | 155 | 127.4 Ų | 127.4 | 68% | 0.68 | 65% | 0.645 | S | S | * | * | trans | -74.7 | 96.8 | 171.5 | -172 | -106.6 | 0 | 0 | 0 | 107.7 | V206 | F204-V206 HydrophobicContact CD1-CG2 3.85Å; F204-V206 HydrophobicContact CE1-CB 4.19Å; F204-V206 HydrophobicContact CE1-CG2 3.65Å; F204-V206 PolarHBondContact O-N 3.33Å | ||
| 205 | K | 64 | Low | 59.4 | Low | 189 Ų | 189 | 131.3 Ų | 131.3 | 82% | 0.822 | 66% | 0.664 | S | S | * | * | trans | -77.7 | 110.1 | 160.4 | -75.1 | -79.3 | -175 | 172.4 | 0 | 105.6 | K203 P207 | K203-K205 PolarHBondContact O-N 3.14Å; K205-P207 VanDerWaalsContact O-CD 3.3Å; K205-P207 WeakPolarHBondContact O-CD 3.49Å | ||
| 206 | V | 60.8 | Low | 59.3 | Low | 92 Ų | 92 | 126.8 Ų | 126.8 | 56% | 0.558 | 65% | 0.646 | S | S | * | * | trans | -56 | 120.9 | 168.6 | -177.1 | 0 | 0 | 0 | 0 | 106.5 | F204 D208 F209 | F204-V206 HydrophobicContact CD1-CG2 3.85Å; F204-V206 HydrophobicContact CE1-CB 4.19Å; F204-V206 HydrophobicContact CE1-CG2 3.65Å; F204-V206 PolarHBondContact O-N 3.33Å; V206-D208 PolarHBondContact O-N 2.99Å; V206-F209 HydrophobicContact CG1-CD2 4.47Å; V206-F209 HydrophobicContact CG1-CE2 3.94Å | ||
| 207 | P | 68.9 | Low | 59.1 | Low | 75 Ų | 75 | 123.5 Ų | 123.5 | 49% | 0.487 | 64% | 0.64 | S | S | . | * | trans | -62 | 134.7 | 171.1 | -20.3 | 33.2 | 0 | 0 | 0 | 109 | K205 F209 | K205-P207 VanDerWaalsContact O-CD 3.3Å; K205-P207 WeakPolarHBondContact O-CD 3.49Å; P207-F209 WeakPolarHBondContact O-CD2 3.42Å; P207-F209 VanDerWaalsContact O-CE2 3.3Å; P207-F209 WeakPolarHBondContact O-CE2 3.38Å; P207-F209 PolarHBondContact O-N 3.22Å | ||
| 208 | D | 59.4 | Low | 59.1 | Low | 168 Ų | 168 | 125 Ų | 125 | 90% | 0.898 | 64% | 0.642 | S | S | * | * | trans | -63.6 | 111.1 | 173.1 | -71.2 | -32.5 | 0 | 0 | 0 | 108.3 | V206 | V206-D208 PolarHBondContact O-N 2.99Š| ||
| 209 | F | 58 | Low | 59.1 | Low | 146 Ų | 146 | 127.2 Ų | 127.2 | 64% | 0.64 | 64% | 0.644 | S | S | * | * | trans | -82.5 | 121.1 | 173.8 | -59 | -81.2 | 0 | 0 | 0 | 107.9 | V206 P207 L211 | V206-F209 HydrophobicContact CG1-CD2 4.47Å; V206-F209 HydrophobicContact CG1-CE2 3.94Å; P207-F209 WeakPolarHBondContact O-CD2 3.42Å; P207-F209 VanDerWaalsContact O-CE2 3.3Å; P207-F209 WeakPolarHBondContact O-CE2 3.38Å; P207-F209 PolarHBondContact O-N 3.22Å; F209-L211 PolarHBondContact O-N 2.97Å | ||
| 210 | E | 60.3 | Low | 59.1 | Low | 157 Ų | 157 | 126.7 Ų | 126.7 | 73% | 0.734 | 63% | 0.631 | S | S | * | * | trans | -66.2 | 86.2 | 168.4 | -80.9 | -168.7 | 157.3 | 0 | 0 | 109.7 | L212 | E210-L212 PolarHBondContact O-N 3.26Å; E210-L212 VanDerWaalsContact O-N 3.12Å | ||
| 211 | L | 59.2 | Low | 58.9 | Low | 108 Ų | 108 | 122.7 Ų | 122.7 | 57% | 0.565 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | 2.7 | 174.7 | -72 | 163.9 | 0 | 0 | 0 | 113.2 | F209 L213 L214 T215 | F209-L211 PolarHBondContact O-N 2.97Å; L211-L213 VanDerWaalsContact C-N 3.3Å; L211-L213 PolarHBondContact O-N 3.33Å; L211-L214 HydrophobicContact CD2-CB 4.46Å; L211-L214 HydrophobicContact CD2-CD2 4.02Å; L211-L214 PolarHBondContact O-N 3.09Å; L211-T215 PolarHBondContact O-N 3.42Å; L211-T215 PolarHBondContact O-OG1 3.22Å |
| 212 | L | 57.3 | Low | 58.6 | Low | 130 Ų | 130 | 125 Ų | 125 | 68% | 0.681 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -61.7 | -37.4 | -179.5 | -68.5 | 174.8 | 0 | 0 | 0 | 112 | E210 L214 T215 D216 | E210-L212 PolarHBondContact O-N 3.26Å; E210-L212 VanDerWaalsContact O-N 3.12Å; L212-L214 VanDerWaalsContact C-N 3.27Å; L212-L214 PolarHBondContact O-N 2.66Å; L212-T215 PolarHBondContact O-N 3.4Å; L212-D216 PolarHBondContact O-N 3.26Å |
| 213 | L | 56.2 | Low | 58.5 | Low | 105 Ų | 105 | 123.1 Ų | 123.1 | 55% | 0.55 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -68.1 | -24.9 | 174.4 | -83.3 | 130.8 | 0 | 0 | 0 | 113.4 | L211 T215 F219 | L211-L213 VanDerWaalsContact C-N 3.3Å; L211-L213 PolarHBondContact O-N 3.33Å; L213-T215 VanDerWaalsContact C-N 3.32Å; L213-F219 HydrophobicContact CD2-CD2 4.48Å; L213-F219 HydrophobicContact CD2-CG 4.5Å |
| 214 | L | 55.4 | Low | 58.1 | Low | 108 Ų | 108 | 117.9 Ų | 117.9 | 57% | 0.565 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -84.9 | -10.9 | 178.8 | -152 | 70.2 | 0 | 0 | 0 | 112.6 | L211 L212 M220 | L211-L214 HydrophobicContact CD2-CB 4.46Å; L211-L214 HydrophobicContact CD2-CD2 4.02Å; L211-L214 PolarHBondContact O-N 3.09Å; L212-L214 VanDerWaalsContact C-N 3.27Å; L212-L214 PolarHBondContact O-N 2.66Å; L214-M220 HydrophobicContact CD1-CE 3.8Å; L214-M220 HydrophobicContact CG-CE 4Å; L214-M220 WeakPolarHBondContact O-CE 3.49Å |
| 215 | T | 56.4 | Low | 57.9 | Low | 109 Ų | 109 | 116 Ų | 116 | 67% | 0.669 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -106.6 | -14 | -178.3 | -33.6 | 0 | 0 | 0 | 0 | 111.9 | L211 L212 L213 P217 | L211-T215 PolarHBondContact O-N 3.42Å; L211-T215 PolarHBondContact O-OG1 3.22Å; L212-T215 PolarHBondContact O-N 3.4Å; L213-T215 VanDerWaalsContact C-N 3.32Å; T215-P217 WeakPolarHBondContact O-CD 3.37Å |
| 216 | D | 57.6 | Low | 57.3 | Low | 36 Ų | 36 | 111.8 Ų | 111.8 | 19% | 0.193 | 59% | 0.59 | C | S | . | * | trans | -75.6 | 118.1 | 178.1 | -172.1 | -20.5 | 0 | 0 | 0 | 110.9 | L212 R218 F219 | L212-D216 PolarHBondContact O-N 3.26Å; D216-R218 PolarHBondContact O-N 2.67Å; D216-R218 WeakPolarHBondContact OD1-CB 3.29Å; D216-R218 WeakPolarHBondContact OD1-CG 3.37Å; D216-R218 PolarHBondContact OD1-N 3.1Å; D216-R218 IonicContact OD1-NE 3.15Å; D216-R218 PolarHBondContact OD1-NE 3.12Å; D216-R218 VanDerWaalsContact OD1-NE 3.15Å; D216-R218 IonicContact OD2-CZ 3.29Å; D216-R218 VanDerWaalsContact OD2-CZ 3.29Å; D216-R218 IonicContact OD2-NE 3.07Å; D216-R218 PolarHBondContact OD2-NE 2.93Å; D216-R218 VanDerWaalsContact OD2-NE 3.07Å; D216-R218 IonicContact OD2-NH2 2.69Å; D216-R218 PolarHBondContact OD2-NH2 2.95Å; D216-F219 HydrophobicContact CB-CD2 3.9Å; D216-F219 PolarHBondContact O-N 3.48Å; D216-F219 VanDerWaalsContact O-N 3.12Å | ||
| 217 | P | 57.8 | Low | 57.1 | Low | 109 Ų | 109 | 110.3 Ų | 110.3 | 71% | 0.708 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.2 | -24.9 | 179.6 | -24 | 33.1 | 0 | 0 | 0 | 114 | T215 F219 | T215-P217 WeakPolarHBondContact O-CD 3.37Å; P217-F219 VanDerWaalsContact C-N 3.32Å; P217-F219 PolarHBondContact O-N 2.73Å |
| 218 | R | 59.9 | Low | 56.5 | Low | 172 Ų | 172 | 110.3 Ų | 110.3 | 65% | 0.649 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73 | -23.7 | -177.5 | -60.2 | 178.5 | -62.4 | 157.7 | 1.9 | 113.4 | D216 | D216-R218 PolarHBondContact O-N 2.67Å; D216-R218 WeakPolarHBondContact OD1-CB 3.29Å; D216-R218 WeakPolarHBondContact OD1-CG 3.37Å; D216-R218 PolarHBondContact OD1-N 3.1Å; D216-R218 IonicContact OD1-NE 3.15Å; D216-R218 PolarHBondContact OD1-NE 3.12Å; D216-R218 VanDerWaalsContact OD1-NE 3.15Å; D216-R218 IonicContact OD2-CZ 3.29Å; D216-R218 VanDerWaalsContact OD2-CZ 3.29Å; D216-R218 IonicContact OD2-NE 3.07Å; D216-R218 PolarHBondContact OD2-NE 2.93Å; D216-R218 VanDerWaalsContact OD2-NE 3.07Å; D216-R218 IonicContact OD2-NH2 2.69Å; D216-R218 PolarHBondContact OD2-NH2 2.95Å |
| 219 | F | 54.6 | Low | 56.5 | Low | 90 Ų | 90 | 110.6 Ų | 110.6 | 40% | 0.395 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102 | -17.9 | -177.9 | -66 | -81.2 | 0 | 0 | 0 | 112.8 | L213 D216 P217 S221 F222 V223 | L213-F219 HydrophobicContact CD2-CD2 4.48Å; L213-F219 HydrophobicContact CD2-CG 4.5Å; D216-F219 HydrophobicContact CB-CD2 3.9Å; D216-F219 PolarHBondContact O-N 3.48Å; D216-F219 VanDerWaalsContact O-N 3.12Å; P217-F219 VanDerWaalsContact C-N 3.32Å; P217-F219 PolarHBondContact O-N 2.73Å; F219-S221 PolarHBondContact O-N 3.23Å; F219-S221 VanDerWaalsContact O-N 3.17Å; F219-F222 PolarHBondContact O-N 2.9Å; F219-F222 VanDerWaalsContact O-N 3.15Å; F219-V223 WeakPolarHBondContact O-CG2 3.42Å |
| 220 | M | 55.8 | Low | 56.6 | Low | 86 Ų | 86 | 116 Ų | 116 | 42% | 0.424 | 60% | 0.602 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -60 | -24.1 | 177.3 | -74.6 | -72.1 | 100 | 0 | 0 | 114.7 | L214 F222 V223 | L214-M220 HydrophobicContact CD1-CE 3.8Å; L214-M220 HydrophobicContact CG-CE 4Å; L214-M220 WeakPolarHBondContact O-CE 3.49Å; M220-F222 VanDerWaalsContact C-N 3.34Å; M220-V223 HydrophobicContact CE-CG2 4.07Å |
| 221 | S | 55.3 | Low | 56.7 | Low | 91 Ų | 91 | 111.2 Ų | 111.2 | 64% | 0.636 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | -26.1 | 178 | 54.6 | 0 | 0 | 0 | 0 | 113.4 | F219 | F219-S221 PolarHBondContact O-N 3.23Å; F219-S221 VanDerWaalsContact O-N 3.17Å |
| 222 | F | 53.8 | Low | 57 | Low | 176 Ų | 176 | 115.9 Ų | 115.9 | 77% | 0.772 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | -23.1 | -173.4 | -65.7 | -73.7 | 0 | 0 | 0 | 114.1 | F219 M220 | F219-F222 PolarHBondContact O-N 2.9Å; F219-F222 VanDerWaalsContact O-N 3.15Å; M220-F222 VanDerWaalsContact C-N 3.34Å |
| 223 | V | 53.7 | Low | 57.5 | Low | 93 Ų | 93 | 117.1 Ų | 117.1 | 56% | 0.564 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -94.6 | -6.9 | -169.8 | -104.5 | 0 | 0 | 0 | 0 | 115.8 | F219 M220 P225 | F219-V223 WeakPolarHBondContact O-CG2 3.42Å; M220-V223 HydrophobicContact CE-CG2 4.07Å; V223-P225 WeakPolarHBondContact O-CD 3.35Å |
| 224 | N | 54 | Low | 58.2 | Low | 81 Ų | 81 | 118 Ų | 118 | 43% | 0.433 | 61% | 0.605 | S | S | . | * | trans | -125.3 | 77.9 | -173.7 | -158.2 | -0.1 | 0 | 0 | 0 | 114.9 | L226 S227 | N224-L226 PolarHBondContact O-N 3.44Å; N224-L226 WeakPolarHBondContact OD1-CA 3.42Å; N224-L226 VanDerWaalsContact OD1-CB 3.27Å; N224-L226 WeakPolarHBondContact OD1-CB 3.39Å; N224-L226 PolarHBondContact OD1-N 3.01Å; N224-S227 WeakPolarHBondContact O-CB 3.42Å; N224-S227 PolarHBondContact O-N 2.95Å; N224-S227 PolarHBondContact O-OG 3.26Å; N224-S227 PolarHBondContact OD1-N 3.42Å | ||
| 225 | P | 57 | Low | 59.1 | Low | 115 Ų | 115 | 118.8 Ų | 118.8 | 75% | 0.747 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.5 | -6.9 | 168.1 | 27.7 | -34 | 0 | 0 | 0 | 113 | V223 | V223-P225 WeakPolarHBondContact O-CD 3.35Š|
| 226 | L | 50.8 | Low | 59.4 | Low | 100 Ų | 100 | 119.5 Ų | 119.5 | 52% | 0.524 | 62% | 0.621 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.3 | -3.2 | 175.7 | -48.5 | 175.1 | 0 | 0 | 0 | 112.7 | N224 G228 R229 | N224-L226 PolarHBondContact O-N 3.44Å; N224-L226 WeakPolarHBondContact OD1-CA 3.42Å; N224-L226 VanDerWaalsContact OD1-CB 3.27Å; N224-L226 WeakPolarHBondContact OD1-CB 3.39Å; N224-L226 PolarHBondContact OD1-N 3.01Å; L226-G228 PolarHBondContact O-N 2.95Å; L226-R229 HydrophobicContact CD2-CG 4.41Å; L226-R229 PolarHBondContact O-N 3.38Å |
| 227 | S | 57.3 | Low | 59.6 | Low | 62 Ų | 62 | 125.8 Ų | 125.8 | 43% | 0.434 | 65% | 0.647 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65.4 | -18.7 | 177.4 | 68.7 | 0 | 0 | 0 | 0 | 113.2 | N224 R234 | N224-S227 WeakPolarHBondContact O-CB 3.42Å; N224-S227 PolarHBondContact O-N 2.95Å; N224-S227 PolarHBondContact O-OG 3.26Å; N224-S227 PolarHBondContact OD1-N 3.42Å; S227-R234 PolarHBondContact O-NH1 3Å; S227-R234 PolarHBondContact O-NH2 3.19Å |
| 228 | G | 57.3 | Low | 59.7 | Low | 74 Ų | 74 | 123.1 Ų | 123.1 | 76% | 0.763 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.4 | -8.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | L226 | L226-G228 PolarHBondContact O-N 2.95Š|
| 229 | R | 58.5 | Low | 59.5 | Low | 174 Ų | 174 | 128 Ų | 128 | 66% | 0.657 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -76.2 | 134.7 | 177.3 | -68.2 | -167.5 | -169.9 | -103.4 | 1.3 | 110.2 | L226 S231 | L226-R229 HydrophobicContact CD2-CG 4.41Å; L226-R229 PolarHBondContact O-N 3.38Å; R229-S231 PolarHBondContact O-N 3.23Å |
| 230 | R | 61.3 | Low | 59.2 | Low | 259 Ų | 259 | 129.5 Ų | 129.5 | 98% | 0.977 | 67% | 0.669 | S | S | * | * | trans | -62 | 108.2 | 166.5 | -100.6 | -176.4 | -90.7 | -102.6 | 0.7 | 108.3 | ||||
| 231 | S | 62.4 | Low | 58.9 | Low | 57 Ų | 57 | 130 Ų | 130 | 40% | 0.399 | 68% | 0.681 | S | S | . | * | trans | -115.6 | 130 | 172.6 | 72.8 | 0 | 0 | 0 | 0 | 109.4 | R229 N233 R234 | R229-S231 PolarHBondContact O-N 3.23Å; S231-N233 PolarHBondContact O-N 2.99Å; S231-R234 PolarHBondContact O-N 3.5Å; S231-R234 WeakPolarHBondContact OG-CD 3.35Å; S231-R234 WeakPolarHBondContact OG-CG 3.42Å | ||
| 232 | F | 64.1 | Low | 58.8 | Low | 206 Ų | 206 | 132.6 Ų | 132.6 | 90% | 0.904 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | -19.4 | 176.8 | -169.3 | -98 | 0 | 0 | 0 | 113.1 | R234 | F232-R234 VanDerWaalsContact C-N 3.3Å; F232-R234 PolarHBondContact O-N 3.43Å |
| 233 | N | 68.3 | Low | 58.6 | Low | 157 Ų | 157 | 130.9 Ų | 130.9 | 84% | 0.84 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | 12.5 | -178.8 | -61.4 | -30.9 | 0 | 0 | 0 | 114.2 | S231 | S231-N233 PolarHBondContact O-N 2.99Š|
| 234 | R | 71.3 | Confident | 58.7 | Low | 123 Ų | 123 | 132.4 Ų | 132.4 | 46% | 0.464 | 69% | 0.686 | S | S | . | * | S | Bend | trans | -97.1 | 136.8 | 175.6 | -84 | 167.9 | 101.8 | 178.1 | 7.4 | 110.4 | S227 S231 F232 | S227-R234 PolarHBondContact O-NH1 3Å; S227-R234 PolarHBondContact O-NH2 3.19Å; S231-R234 PolarHBondContact O-N 3.5Å; S231-R234 WeakPolarHBondContact OG-CD 3.35Å; S231-R234 WeakPolarHBondContact OG-CG 3.42Å; F232-R234 VanDerWaalsContact C-N 3.3Å; F232-R234 PolarHBondContact O-N 3.43Å |
| 235 | T | 73.3 | Confident | 58.2 | Low | 124 Ų | 124 | 133.6 Ų | 133.6 | 76% | 0.761 | 70% | 0.698 | S | S | * | * | trans | -53.7 | 133.4 | 170 | -28.8 | 0 | 0 | 0 | 0 | 109 | K237 | T235-K237 PolarHBondContact O-N 2.94Š| ||
| 236 | P | 63.7 | Low | 58 | Low | 124 Ų | 124 | 135.3 Ų | 135.3 | 81% | 0.805 | 70% | 0.699 | S | S | * | * | trans | -59.5 | 105.2 | 179.2 | 22.4 | -32.4 | 0 | 0 | 0 | 109.4 | G238 | P236-G238 PolarHBondContact O-N 3.42Š| ||
| 237 | K | 61.5 | Low | 57.8 | Low | 168 Ų | 168 | 136.1 Ų | 136.1 | 73% | 0.73 | 71% | 0.708 | S | S | * | * | trans | -76.3 | 117.5 | 164.9 | -73.6 | -172.9 | 172.2 | -166.5 | 0 | 105.4 | T235 | T235-K237 PolarHBondContact O-N 2.94Š| ||
| 238 | G | 59.6 | Low | 57.3 | Low | 54 Ų | 54 | 139.5 Ų | 139.5 | 56% | 0.557 | 72% | 0.72 | S | S | * | * | trans | -54.6 | 173.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | P236 I240 | P236-G238 PolarHBondContact O-N 3.42Å; G238-I240 PolarHBondContact O-N 2.9Å | ||
| 239 | W | 55.5 | Low | 56.6 | Low | 274 Ų | 274 | 141 Ų | 141 | 100% | 1.038 | 71% | 0.714 | S | S | * | * | trans | -73.4 | 75.6 | 178.3 | -66.1 | 44.4 | 0 | 0 | 0 | 109.1 | ||||
| 240 | I | 49.7 | Very low | 55.9 | Low | 121 Ų | 121 | 138.3 Ų | 138.3 | 62% | 0.621 | 72% | 0.718 | S | S | * | * | trans | -94.3 | 106.9 | 167.3 | 57.9 | 172.5 | 0 | 0 | 0 | 106.8 | G238 E242 | G238-I240 PolarHBondContact O-N 2.9Å; I240-E242 VanDerWaalsContact C-N 3.32Å; I240-E242 PolarHBondContact O-N 2.96Å; I240-E242 VanDerWaalsContact O-N 3.11Å | ||
| 241 | S | 49.3 | Very low | 54.9 | Low | 97 Ų | 97 | 133.7 Ų | 133.7 | 68% | 0.678 | 71% | 0.707 | S | S | * | * | trans | -73.3 | 96 | 163 | 58.9 | 0 | 0 | 0 | 0 | 106.3 | N243 | S241-N243 VanDerWaalsContact C-N 3.28Å; S241-N243 WeakPolarHBondContact CB-OD1 3.46Å; S241-N243 PolarHBondContact O-N 3.25Å; S241-N243 PolarHBondContact O-OD1 3.38Å; S241-N243 PolarHBondContact OG-OD1 2.94Å | ||
| 242 | E | 53.2 | Low | 53.9 | Low | 146 Ų | 146 | 136.1 Ų | 136.1 | 68% | 0.682 | 72% | 0.721 | S | S | * | * | trans | -68.5 | 101.8 | 157.5 | -71.5 | -174.4 | -167.9 | 0 | 0 | 105.2 | I240 I244 | I240-E242 VanDerWaalsContact C-N 3.32Å; I240-E242 PolarHBondContact O-N 2.96Å; I240-E242 VanDerWaalsContact O-N 3.11Å; E242-I244 HydrophobicContact CB-CG1 4.48Å; E242-I244 PolarHBondContact O-N 3.45Å | ||
| 243 | N | 49.6 | Very low | 52.9 | Low | 139 Ų | 139 | 132.7 Ų | 132.7 | 74% | 0.743 | 72% | 0.718 | S | S | * | * | trans | -66.9 | 72.2 | -178.8 | -57.9 | -16.4 | 0 | 0 | 0 | 109.1 | S241 P245 | S241-N243 VanDerWaalsContact C-N 3.28Å; S241-N243 WeakPolarHBondContact CB-OD1 3.46Å; S241-N243 PolarHBondContact O-N 3.25Å; S241-N243 PolarHBondContact O-OD1 3.38Å; S241-N243 PolarHBondContact OG-OD1 2.94Å; N243-P245 WeakPolarHBondContact O-CD 3.36Å | ||
| 244 | I | 55.2 | Low | 51.6 | Low | 126 Ų | 126 | 132.6 Ų | 132.6 | 65% | 0.646 | 72% | 0.717 | S | S | * | * | trans | -87.8 | 112.2 | 168.7 | -57.2 | 170.5 | 0 | 0 | 0 | 105.1 | E242 I246 | E242-I244 HydrophobicContact CB-CG1 4.48Å; E242-I244 PolarHBondContact O-N 3.45Å; I244-I246 PolarHBondContact O-N 3.4Å; I244-I246 VanDerWaalsContact O-N 3.11Å | ||
| 245 | P | 44.5 | Very low | 50.2 | Low | 106 Ų | 106 | 133.9 Ų | 133.9 | 69% | 0.688 | 73% | 0.733 | S | S | * | * | trans | -63.8 | 117.9 | 175.9 | 25.7 | -30.7 | 0 | 0 | 0 | 108.2 | N243 V247 | N243-P245 WeakPolarHBondContact O-CD 3.36Å; P245-V247 PolarHBondContact O-N 3.02Å | ||
| 246 | I | 51.4 | Low | 48.7 | Very low | 150 Ų | 150 | 134.3 Ų | 134.3 | 77% | 0.769 | 74% | 0.735 | S | S | * | * | trans | -72 | 97.2 | 170.1 | -57.2 | 174 | 0 | 0 | 0 | 105.9 | I244 I248 | I244-I246 PolarHBondContact O-N 3.4Å; I244-I246 VanDerWaalsContact O-N 3.11Å; I246-I248 HydrophobicContact CG2-CG1 3.77Å; I246-I248 PolarHBondContact O-N 3.36Å | ||
| 247 | V | 46.1 | Very low | 47.7 | Very low | 118 Ų | 118 | 134.5 Ų | 134.5 | 72% | 0.715 | 74% | 0.735 | S | S | * | * | trans | -75.9 | 100.9 | 166.7 | -179.5 | 0 | 0 | 0 | 0 | 106.5 | P245 T249 | P245-V247 PolarHBondContact O-N 3.02Å; V247-T249 PolarHBondContact O-N 2.95Å | ||
| 248 | I | 47.5 | Very low | 47 | Very low | 133 Ų | 133 | 133.4 Ų | 133.4 | 68% | 0.682 | 74% | 0.735 | S | S | * | * | trans | -79.9 | 98.4 | 168.8 | -55.7 | 176.5 | 0 | 0 | 0 | 106 | I246 T250 | I246-I248 HydrophobicContact CG2-CG1 3.77Å; I246-I248 PolarHBondContact O-N 3.36Å; I248-T250 HydrophobicContact CG2-CG2 4.22Å; I248-T250 PolarHBondContact O-N 2.95Å; I248-T250 VanDerWaalsContact O-N 3.15Å | ||
| 249 | T | 41.9 | Very low | 46.6 | Very low | 105 Ų | 105 | 136.4 Ų | 136.4 | 64% | 0.644 | 75% | 0.745 | S | S | * | * | trans | -71.9 | 102.5 | 167.6 | -53 | 0 | 0 | 0 | 0 | 107.8 | V247 E251 | V247-T249 PolarHBondContact O-N 2.95Å; T249-E251 HydrophobicContact CG2-CG 4.27Å; T249-E251 PolarHBondContact O-N 3.38Å | ||
| 250 | T | 45.3 | Very low | 46 | Very low | 118 Ų | 118 | 132.7 Ų | 132.7 | 72% | 0.724 | 74% | 0.739 | S | S | * | * | trans | -79.8 | 92.9 | 165 | 52.5 | 0 | 0 | 0 | 0 | 107.6 | I248 P252 | I248-T250 HydrophobicContact CG2-CG2 4.22Å; I248-T250 PolarHBondContact O-N 2.95Å; I248-T250 VanDerWaalsContact O-N 3.15Å; T250-P252 WeakPolarHBondContact O-CD 3.35Å | ||
| 251 | E | 40 | Very low | 46.2 | Very low | 162 Ų | 162 | 132.3 Ų | 132.3 | 76% | 0.757 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 120.6 | 161.8 | -76.8 | -89.5 | 141.2 | 0 | 0 | 107.5 | T249 | T249-E251 HydrophobicContact CG2-CG 4.27Å; T249-E251 PolarHBondContact O-N 3.38Å |
| 252 | P | 41.3 | Very low | 46.2 | Very low | 107 Ų | 107 | 137.2 Ų | 137.2 | 70% | 0.695 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 132 | 167.1 | 28.9 | -30.4 | 0 | 0 | 0 | 108.7 | T250 D254 | T250-P252 WeakPolarHBondContact O-CD 3.35Å; P252-D254 PolarHBondContact O-N 3.02Å |
| 253 | T | 41.9 | Very low | 46.2 | Very low | 135 Ų | 135 | 137.9 Ų | 137.9 | 83% | 0.828 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 118.1 | 173.9 | 10.5 | 0 | 0 | 0 | 0 | 108 | D255 | T253-D255 PolarHBondContact O-N 3.29Š|
| 254 | D | 42.7 | Very low | 45.6 | Very low | 154 Ų | 154 | 143 Ų | 143 | 82% | 0.824 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 121.9 | 172.7 | -77.3 | -35.5 | 0 | 0 | 0 | 109.9 | P252 T256 | P252-D254 PolarHBondContact O-N 3.02Å; D254-T256 PolarHBondContact O-N 3.16Å; D254-T256 VanDerWaalsContact O-N 3.17Å |
| 255 | D | 40.3 | Very low | 45.1 | Very low | 151 Ų | 151 | 143.9 Ų | 143.9 | 81% | 0.807 | 80% | 0.801 | S | S | * | * | trans | -62 | 112.7 | 174.1 | -75.5 | -39.4 | 0 | 0 | 0 | 110.1 | T253 T257 | T253-D255 PolarHBondContact O-N 3.29Å; D255-T257 PolarHBondContact O-N 3.44Å | ||
| 256 | T | 41.7 | Very low | 45.1 | Very low | 132 Ų | 132 | 145.8 Ų | 145.8 | 81% | 0.81 | 81% | 0.807 | S | S | * | * | trans | -72.4 | 94.4 | 168.9 | -57.7 | 0 | 0 | 0 | 0 | 108.3 | D254 I258 | D254-T256 PolarHBondContact O-N 3.16Å; D254-T256 VanDerWaalsContact O-N 3.17Å; T256-I258 PolarHBondContact O-N 2.86Å | ||
| 257 | T | 44.2 | Very low | 44.8 | Very low | 128 Ų | 128 | 145.6 Ų | 145.6 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | -76.7 | 113.7 | 170.2 | 45 | 0 | 0 | 0 | 0 | 109.5 | D255 | D255-T257 PolarHBondContact O-N 3.44Š| ||
| 258 | I | 46.1 | Very low | 44.7 | Very low | 145 Ų | 145 | 147.2 Ų | 147.2 | 74% | 0.744 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 130.1 | 174.7 | -60.1 | 163.8 | 0 | 0 | 0 | 107.8 | T256 E260 | T256-I258 PolarHBondContact O-N 2.86Å; I258-E260 PolarHBondContact O-N 3.1Å |
| 259 | P | 51.6 | Low | 44.5 | Very low | 117 Ų | 117 | 148.1 Ų | 148.1 | 76% | 0.76 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 117.5 | 173.8 | 28.8 | -30.3 | 0 | 0 | 0 | 109.8 | S261 | P259-S261 PolarHBondContact O-N 3.47Š|
| 260 | E | 42.8 | Very low | 44.7 | Very low | 197 Ų | 197 | 151 Ų | 151 | 92% | 0.921 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 125 | 167.5 | -73.6 | -177.2 | 156.7 | 0 | 0 | 109.6 | I258 | I258-E260 PolarHBondContact O-N 3.1Š|
| 261 | S | 53.8 | Low | 44.6 | Very low | 112 Ų | 112 | 153.4 Ų | 153.4 | 78% | 0.783 | 84% | 0.843 | S | S | * | * | trans | -116.2 | 109.4 | 165.9 | 55.3 | 0 | 0 | 0 | 0 | 108.8 | P259 | P259-S261 PolarHBondContact O-N 3.47Š| ||
| 262 | E | 49.3 | Very low | 45 | Very low | 201 Ų | 201 | 152.7 Ų | 152.7 | 94% | 0.939 | 85% | 0.849 | S | S | * | * | trans | -143.6 | 136.3 | 155 | -85.3 | -158.8 | 154.6 | 0 | 0 | 111.6 | ||||
| 263 | D | 52.6 | Low | 45.3 | Very low | 159 Ų | 159 | 156.5 Ų | 156.5 | 85% | 0.85 | 86% | 0.862 | S | S | * | * | trans | -55.1 | 140.2 | 178.8 | -80 | -45.9 | 0 | 0 | 0 | 114.9 | ||||
| 264 | L | 37 | Very low | 45.6 | Very low | 247 Ų | 247 | 158.5 Ų | 158.5 | 100% | 1.293 | 87% | 0.865 | S | S | * | * | -174.2 | 0 | 120 | -104.4 | 153 | 0 | 0 | 0 | 112 |
Retrieved 264 of 264 residues in 63.4 ms
(Link to these results)