| 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 | 48.6 | Very low | 76.7 | Confident | 237 Ų | 237 | 80.6 Ų | 80.6 | 100% | 1.167 | 43% | 0.429 | S | S | * | . | 0 | 109.6 | 0 | -88.2 | 74.8 | 102.4 | 0 | 0 | 108.3 | |||||
| 2 | A | 53.3 | Low | 76.8 | Confident | 73 Ų | 73 | 89.9 Ų | 89.9 | 60% | 0.603 | 45% | 0.453 | S | S | * | . | trans | -69.9 | 136.2 | 166.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | Y4 | A2-Y4 PolarHBondContact O-N 2.86Š| ||
| 3 | S | 80.1 | Confident | 76.7 | Confident | 31 Ų | 31 | 92.2 Ų | 92.2 | 22% | 0.217 | 48% | 0.483 | C | S | . | . | trans | -74.8 | 125.5 | -178.7 | -37.2 | 0 | 0 | 0 | 0 | 108.7 | Y5 E6 I7 | S3-Y5 PolarHBondContact O-N 2.88Å; S3-E6 WeakPolarHBondContact CB-OE2 3.38Å; S3-E6 PolarHBondContact N-OE2 2.82Å; S3-E6 WeakPolarHBondContact O-CB 3.3Å; S3-E6 PolarHBondContact O-N 3.24Å; S3-E6 PolarHBondContact OG-OE2 3.38Å; S3-I7 PolarHBondContact O-N 3.38Å | ||
| 4 | Y | 80.9 | Confident | 76.7 | Confident | 85 Ų | 85 | 87 Ų | 87 | 33% | 0.333 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -52.6 | -29.7 | 174.8 | -61.8 | -65 | 0 | 0 | 0 | 113 | A2 E6 I7 L8 A52 V55 | A2-Y4 PolarHBondContact O-N 2.86Å; Y4-E6 PolarHBondContact O-N 3.33Å; Y4-I7 HydrophobicContact CD1-CD1 4.31Å; Y4-I7 PolarHBondContact O-N 3.13Å; Y4-L8 PolarHBondContact O-N 3.15Å; Y4-L8 VanDerWaalsContact O-N 3.13Å; Y4-A52 HydrophobicContact CD1-CB 3.75Å; Y4-A52 HydrophobicContact CG-CB 4.21Å; Y4-V55 HydrophobicContact CD2-CG1 4.4Å; Y4-V55 HydrophobicContact CE2-CG1 4.15Å |
| 5 | Y | 80.6 | Confident | 77 | Confident | 66 Ų | 66 | 84.3 Ų | 84.3 | 26% | 0.259 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -59 | -39.6 | 172.3 | -64.6 | -82.7 | 0 | 0 | 0 | 113.2 | S3 L8 D9 V10 P11 R12 L56 | S3-Y5 PolarHBondContact O-N 2.88Å; Y5-L8 PolarHBondContact O-N 3.24Å; Y5-D9 PolarHBondContact O-N 3.4Å; Y5-V10 WeakPolarHBondContact CB-O 3.07Å; Y5-V10 HydrophobicContact CD1-CG2 3.95Å; Y5-V10 PolarHBondContact O-N 2.93Å; Y5-P11 WeakPolarHBondContact CD1-O 3.5Å; Y5-R12 HydrophobicContact CD2-CG 4.27Å; Y5-R12 HydrophobicContact CG-CG 4.16Å; Y5-L56 HydrophobicContact CE1-CD2 4.12Å; Y5-L56 HydrophobicContact CE2-CD2 4.05Å |
| 6 | E | 83.1 | Confident | 77.1 | Confident | 126 Ų | 126 | 82.5 Ų | 82.5 | 59% | 0.589 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -72.5 | -35.1 | 178.1 | -63.9 | 171.5 | 100.5 | 0 | 0 | 111.3 | S3 Y4 L8 D9 | S3-E6 WeakPolarHBondContact CB-OE2 3.38Å; S3-E6 PolarHBondContact N-OE2 2.82Å; S3-E6 WeakPolarHBondContact O-CB 3.3Å; S3-E6 PolarHBondContact O-N 3.24Å; S3-E6 PolarHBondContact OG-OE2 3.38Å; Y4-E6 PolarHBondContact O-N 3.33Å; E6-L8 VanDerWaalsContact C-N 3.31Å; E6-L8 PolarHBondContact O-N 3.33Å; E6-D9 PolarHBondContact O-N 3.07Å |
| 7 | I | 85.4 | Confident | 77.4 | Confident | 25 Ų | 25 | 81.6 Ų | 81.6 | 13% | 0.128 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -65.4 | -37.6 | 177.4 | -60.7 | 173.4 | 0 | 0 | 0 | 110.9 | S3 Y4 K26 E48 V49 A52 | S3-I7 PolarHBondContact O-N 3.38Å; Y4-I7 HydrophobicContact CD1-CD1 4.31Å; Y4-I7 PolarHBondContact O-N 3.13Å; I7-K26 VanDerWaalsContact O-CE 3.27Å; I7-K26 WeakPolarHBondContact O-CE 3.32Å; I7-K26 PolarHBondContact O-NZ 3.2Å; I7-E48 HydrophobicContact CD1-CB 4.36Å; I7-E48 HydrophobicContact CG2-CB 3.7Å; I7-V49 HydrophobicContact CG2-CG2 3.85Å; I7-A52 HydrophobicContact CB-CB 4.44Å; I7-A52 HydrophobicContact CG2-CB 4.35Å |
| 8 | L | 83.6 | Confident | 77.7 | Confident | 2 Ų | 2 | 81.6 Ų | 81.6 | 1% | 0.01 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -86.7 | -7.2 | 176.6 | -76 | 159.2 | 0 | 0 | 0 | 113.1 | Y4 Y5 E6 V10 I19 K26 V49 A52 L56 | Y4-L8 PolarHBondContact O-N 3.15Å; Y4-L8 VanDerWaalsContact O-N 3.13Å; Y5-L8 PolarHBondContact O-N 3.24Å; E6-L8 VanDerWaalsContact C-N 3.31Å; E6-L8 PolarHBondContact O-N 3.33Å; L8-V10 VanDerWaalsContact C-N 3.29Å; L8-V10 HydrophobicContact CB-CG1 4.28Å; L8-V10 HydrophobicContact CB-CG2 3.73Å; L8-I19 HydrophobicContact CD1-CG2 4.14Å; L8-K26 VanDerWaalsContact C-CE 3.5Å; L8-K26 WeakPolarHBondContact O-CE 3.43Å; L8-V49 HydrophobicContact CD2-CG1 3.88Å; L8-A52 HydrophobicContact CD1-CB 3.68Å; L8-A52 HydrophobicContact CG-CB 4.01Å; L8-L56 HydrophobicContact CD1-CD1 3.5Å |
| 9 | D | 82.9 | Confident | 78.1 | Confident | 135 Ų | 135 | 77.8 Ų | 77.8 | 72% | 0.722 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.9 | 39.6 | -174.3 | -143.9 | -119.3 | 0 | 0 | 0 | 112.8 | Y5 E6 | Y5-D9 PolarHBondContact O-N 3.4Å; E6-D9 PolarHBondContact O-N 3.07Å |
| 10 | V | 82.6 | Confident | 78.4 | Confident | 17 Ų | 17 | 78.9 Ų | 78.9 | 10% | 0.103 | 42% | 0.42 | C | S | . | . | trans | -115.7 | 146.2 | -178.5 | -67.5 | 0 | 0 | 0 | 0 | 110.7 | Y5 L8 A14 I19 A22 | Y5-V10 WeakPolarHBondContact CB-O 3.07Å; Y5-V10 HydrophobicContact CD1-CG2 3.95Å; Y5-V10 PolarHBondContact O-N 2.93Å; L8-V10 VanDerWaalsContact C-N 3.29Å; L8-V10 HydrophobicContact CB-CG1 4.28Å; L8-V10 HydrophobicContact CB-CG2 3.73Å; V10-A14 HydrophobicContact CB-CB 3.94Å; V10-A14 HydrophobicContact CG2-CB 4.42Å; V10-I19 HydrophobicContact CG2-CG1 4.46Å; V10-A22 HydrophobicContact CG1-CB 3.44Å; V10-A22 VanDerWaalsContact CG1-CB 3.44Å | ||
| 11 | P | 82.3 | Confident | 78.8 | Confident | 90 Ų | 90 | 81.1 Ų | 81.1 | 58% | 0.584 | 43% | 0.426 | S | S | * | . | trans | -66.3 | 154.2 | 173.9 | 27.5 | -33.3 | 0 | 0 | 0 | 110.8 | Y5 S13 A14 | Y5-P11 WeakPolarHBondContact CD1-O 3.5Å; P11-S13 PolarHBondContact O-N 3.17Å; P11-A14 HydrophobicContact CG-CB 4.11Å; P11-A14 WeakPolarHBondContact O-CB 3.47Å; P11-A14 PolarHBondContact O-N 3.44Å | ||
| 12 | R | 78.1 | Confident | 80.7 | Confident | 192 Ų | 192 | 70.5 Ų | 70.5 | 73% | 0.725 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -16.6 | 176.4 | -63.5 | -176.8 | -171 | 177.9 | 2.1 | 114 | Y5 | Y5-R12 HydrophobicContact CD2-CG 4.27Å; Y5-R12 HydrophobicContact CG-CG 4.16Å |
| 13 | S | 76 | Confident | 82.3 | Confident | 120 Ų | 120 | 70.2 Ų | 70.2 | 84% | 0.839 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.4 | 11.8 | 176.6 | -51.4 | 0 | 0 | 0 | 0 | 113 | P11 | P11-S13 PolarHBondContact O-N 3.17Š|
| 14 | A | 76.9 | Confident | 82.6 | Confident | 19 Ų | 19 | 77.3 Ų | 77.3 | 16% | 0.157 | 38% | 0.382 | C | S | . | . | trans | -66.5 | 141.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V10 P11 D18 I19 | V10-A14 HydrophobicContact CB-CB 3.94Å; V10-A14 HydrophobicContact CG2-CB 4.42Å; P11-A14 HydrophobicContact CG-CB 4.11Å; P11-A14 WeakPolarHBondContact O-CB 3.47Å; P11-A14 PolarHBondContact O-N 3.44Å; A14-D18 HydrophobicContact CB-CB 4.07Å; A14-I19 HydrophobicContact CB-CG1 4.41Å | ||
| 15 | S | 80.7 | Confident | 82.9 | Confident | 47 Ų | 47 | 80.6 Ų | 80.6 | 33% | 0.329 | 40% | 0.398 | S | S | . | . | trans | -72.2 | 154.9 | 172 | -170.6 | 0 | 0 | 0 | 0 | 110.6 | D17 D18 I19 | S15-D17 PolarHBondContact O-N 3.39Å; S15-D17 VanDerWaalsContact O-N 3.09Å; S15-D17 PolarHBondContact OG-OD2 2.93Å; S15-D17 VanDerWaalsContact OG-OD2 3.05Å; S15-D18 WeakPolarHBondContact CB-OD2 3.5Å; S15-D18 PolarHBondContact N-OD2 3.23Å; S15-D18 WeakPolarHBondContact O-CB 3.39Å; S15-D18 PolarHBondContact O-N 3.22Å; S15-I19 PolarHBondContact O-N 2.96Å; S15-I19 VanDerWaalsContact O-N 3.12Å | ||
| 16 | P | 79.1 | Confident | 83.2 | Confident | 55 Ų | 55 | 79 Ų | 79 | 36% | 0.357 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -48 | -32.3 | 166.1 | 18.5 | -34.6 | 0 | 0 | 0 | 113.9 | I19 K20 A60 | P16-I19 PolarHBondContact O-N 2.65Å; P16-K20 PolarHBondContact O-N 3.34Å; P16-A60 HydrophobicContact CB-CB 3.88Å; P16-A60 HydrophobicContact CG-CB 4.35Å |
| 17 | D | 81.2 | Confident | 83.2 | Confident | 68 Ų | 68 | 74.2 Ų | 74.2 | 36% | 0.364 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.4 | -40.6 | 176.1 | -56.8 | -74.1 | 0 | 0 | 0 | 112.8 | S15 I19 K20 K21 | S15-D17 PolarHBondContact O-N 3.39Å; S15-D17 VanDerWaalsContact O-N 3.09Å; S15-D17 PolarHBondContact OG-OD2 2.93Å; S15-D17 VanDerWaalsContact OG-OD2 3.05Å; D17-I19 VanDerWaalsContact C-N 3.34Å; D17-K20 PolarHBondContact O-N 2.9Å; D17-K21 WeakPolarHBondContact O-CB 3.34Å; D17-K21 VanDerWaalsContact O-CG 3.25Å; D17-K21 WeakPolarHBondContact O-CG 3.27Å; D17-K21 PolarHBondContact O-N 2.94Å |
| 18 | D | 83.8 | Confident | 83.1 | Confident | 80 Ų | 80 | 78.8 Ų | 78.8 | 43% | 0.428 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -67.4 | -38.5 | 176.4 | -70.3 | -67.7 | 0 | 0 | 0 | 111.1 | A14 S15 K21 A22 | A14-D18 HydrophobicContact CB-CB 4.07Å; S15-D18 WeakPolarHBondContact CB-OD2 3.5Å; S15-D18 PolarHBondContact N-OD2 3.23Å; S15-D18 WeakPolarHBondContact O-CB 3.39Å; S15-D18 PolarHBondContact O-N 3.22Å; D18-K21 PolarHBondContact O-N 3.31Å; D18-A22 VanDerWaalsContact O-CB 3.28Å; D18-A22 WeakPolarHBondContact O-CB 3.47Å; D18-A22 PolarHBondContact O-N 3.18Å |
| 19 | I | 84.8 | Confident | 83.1 | Confident | 10 Ų | 10 | 84.7 Ų | 84.7 | 5% | 0.051 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -62.4 | -45.2 | 175.5 | -67 | 158.3 | 0 | 0 | 0 | 110.6 | L8 V10 A14 S15 P16 D17 K21 A22 Y23 Y53 L56 | L8-I19 HydrophobicContact CD1-CG2 4.14Å; V10-I19 HydrophobicContact CG2-CG1 4.46Å; A14-I19 HydrophobicContact CB-CG1 4.41Å; S15-I19 PolarHBondContact O-N 2.96Å; S15-I19 VanDerWaalsContact O-N 3.12Å; P16-I19 PolarHBondContact O-N 2.65Å; D17-I19 VanDerWaalsContact C-N 3.34Å; I19-K21 PolarHBondContact O-N 3.39Å; I19-A22 PolarHBondContact O-N 3.4Å; I19-Y23 WeakPolarHBondContact O-CB 3.46Å; I19-Y23 PolarHBondContact O-N 3.41Å; I19-Y53 HydrophobicContact CG2-CD2 3.8Å; I19-Y53 HydrophobicContact CG2-CE2 4.27Å; I19-L56 HydrophobicContact CD1-CB 4.1Å; I19-L56 HydrophobicContact CD1-CD1 4.11Å; I19-L56 HydrophobicContact CG1-CD1 4.3Å; I19-L56 HydrophobicContact CG2-CB 4.31Å; I19-L56 HydrophobicContact CG2-CD1 4.25Å |
| 20 | K | 84.2 | Confident | 83.1 | Confident | 99 Ų | 99 | 80.6 Ų | 80.6 | 43% | 0.43 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 173.7 | -80.3 | 177.3 | -179.2 | 170.5 | 0 | 112.4 | P16 D17 R24 Y53 | P16-K20 PolarHBondContact O-N 3.34Å; D17-K20 PolarHBondContact O-N 2.9Å; K20-R24 WeakPolarHBondContact O-CG 3.44Å; K20-R24 PolarHBondContact O-N 2.82Å; K20-Y53 HydrophobicContact CG-CE2 3.78Å |
| 21 | K | 86.2 | Confident | 82.9 | Confident | 126 Ų | 126 | 84.2 Ų | 84.2 | 55% | 0.548 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65.5 | -41.8 | 178.2 | -73.3 | 168.9 | -174.5 | 172.7 | 0 | 111.6 | D17 D18 I19 R24 K25 | D17-K21 WeakPolarHBondContact O-CB 3.34Å; D17-K21 VanDerWaalsContact O-CG 3.25Å; D17-K21 WeakPolarHBondContact O-CG 3.27Å; D17-K21 PolarHBondContact O-N 2.94Å; D18-K21 PolarHBondContact O-N 3.31Å; I19-K21 PolarHBondContact O-N 3.39Å; K21-R24 PolarHBondContact O-N 3.25Å; K21-K25 WeakPolarHBondContact O-CG 3.48Å; K21-K25 PolarHBondContact O-N 2.98Å |
| 22 | A | 88.3 | Confident | 82.6 | Confident | 14 Ų | 14 | 83.6 Ų | 83.6 | 12% | 0.116 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -65.1 | -43.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V10 D18 I19 R24 K25 K26 | V10-A22 HydrophobicContact CG1-CB 3.44Å; V10-A22 VanDerWaalsContact CG1-CB 3.44Å; D18-A22 VanDerWaalsContact O-CB 3.28Å; D18-A22 WeakPolarHBondContact O-CB 3.47Å; D18-A22 PolarHBondContact O-N 3.18Å; I19-A22 PolarHBondContact O-N 3.4Å; A22-R24 VanDerWaalsContact C-N 3.34Å; A22-R24 PolarHBondContact O-N 3.31Å; A22-K25 PolarHBondContact O-N 2.86Å; A22-K26 VanDerWaalsContact O-CG 3.32Å; A22-K26 WeakPolarHBondContact O-CG 3.28Å; A22-K26 PolarHBondContact O-N 2.99Å |
| 23 | Y | 87.7 | Confident | 82.7 | Confident | 68 Ų | 68 | 80.8 Ų | 80.8 | 27% | 0.267 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -55 | -48.4 | 174.3 | 175.9 | -100.5 | 0 | 0 | 0 | 111.9 | I19 K25 K26 A27 V49 Y53 | I19-Y23 WeakPolarHBondContact O-CB 3.46Å; I19-Y23 PolarHBondContact O-N 3.41Å; Y23-K25 VanDerWaalsContact C-N 3.33Å; Y23-K25 PolarHBondContact O-N 3.49Å; Y23-K26 PolarHBondContact O-N 3.46Å; Y23-A27 WeakPolarHBondContact O-CB 3.27Å; Y23-A27 PolarHBondContact O-N 3.42Å; Y23-V49 HydrophobicContact CD2-CG1 3.56Å; Y23-V49 HydrophobicContact CE2-CG1 3.99Å; Y23-Y53 HydrophobicContact CD2-CG 4.2Å; Y23-Y53 HydrophobicContact CG-CD2 4.27Å; Y23-Y53 HydrophobicContact CG-CG 4.36Å |
| 24 | R | 86.6 | Confident | 82.5 | Confident | 180 Ų | 180 | 82.7 Ų | 82.7 | 68% | 0.679 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -59.3 | -42 | 178 | -69.5 | 179 | -177.4 | -165.5 | 2.3 | 112.4 | K20 K21 A22 L28 | K20-R24 WeakPolarHBondContact O-CG 3.44Å; K20-R24 PolarHBondContact O-N 2.82Å; K21-R24 PolarHBondContact O-N 3.25Å; A22-R24 VanDerWaalsContact C-N 3.34Å; A22-R24 PolarHBondContact O-N 3.31Å; R24-L28 WeakPolarHBondContact O-CG 3.49Å; R24-L28 PolarHBondContact O-N 2.96Å |
| 25 | K | 86.9 | Confident | 82.2 | Confident | 154 Ų | 154 | 83.5 Ų | 83.5 | 67% | 0.67 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -65 | -44.6 | 177.1 | -71.4 | 178.6 | 174.7 | -178.6 | 0 | 111.9 | K21 A22 Y23 L28 Q29 | K21-K25 WeakPolarHBondContact O-CG 3.48Å; K21-K25 PolarHBondContact O-N 2.98Å; A22-K25 PolarHBondContact O-N 2.86Å; Y23-K25 VanDerWaalsContact C-N 3.33Å; Y23-K25 PolarHBondContact O-N 3.49Å; K25-L28 PolarHBondContact O-N 3.38Å; K25-Q29 WeakPolarHBondContact O-CB 3.34Å; K25-Q29 PolarHBondContact O-N 2.98Å; K25-Q29 VanDerWaalsContact O-N 3.07Å |
| 26 | K | 86.4 | Confident | 81.8 | Confident | 32 Ų | 32 | 85.4 Ų | 85.4 | 14% | 0.139 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -66 | -39.8 | 179.6 | -67.3 | -106.5 | 179.5 | 169.7 | 0 | 112 | I7 L8 A22 Y23 L28 Q29 W30 V49 | I7-K26 VanDerWaalsContact O-CE 3.27Å; I7-K26 WeakPolarHBondContact O-CE 3.32Å; I7-K26 PolarHBondContact O-NZ 3.2Å; L8-K26 VanDerWaalsContact C-CE 3.5Å; L8-K26 WeakPolarHBondContact O-CE 3.43Å; A22-K26 VanDerWaalsContact O-CG 3.32Å; A22-K26 WeakPolarHBondContact O-CG 3.28Å; A22-K26 PolarHBondContact O-N 2.99Å; Y23-K26 PolarHBondContact O-N 3.46Å; K26-L28 VanDerWaalsContact C-N 3.33Å; K26-L28 PolarHBondContact O-N 3.05Å; K26-Q29 PolarHBondContact O-N 3.25Å; K26-Q29 VanDerWaalsContact O-N 3.17Å; K26-W30 PolarHBondContact O-N 2.92Å; K26-V49 HydrophobicContact CB-CG1 3.98Å; K26-V49 HydrophobicContact CB-CG2 4.15Å; K26-V49 HydrophobicContact CD-CG2 3.91Å; K26-V49 HydrophobicContact CG-CG2 4.33Å |
| 27 | A | 84 | Confident | 81.6 | Confident | 25 Ų | 25 | 89.7 Ų | 89.7 | 21% | 0.207 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -61.2 | -40.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y23 H31 F46 | Y23-A27 WeakPolarHBondContact O-CB 3.27Å; Y23-A27 PolarHBondContact O-N 3.42Å; A27-H31 PolarHBondContact O-N 3.37Å; A27-F46 HydrophobicContact CB-CE2 4.2Å |
| 28 | L | 83.4 | Confident | 81.5 | Confident | 122 Ų | 122 | 91.1 Ų | 91.1 | 64% | 0.639 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -69.2 | -34.9 | 174.8 | -69.9 | 167 | 0 | 0 | 0 | 112.3 | R24 K25 K26 | R24-L28 WeakPolarHBondContact O-CG 3.49Å; R24-L28 PolarHBondContact O-N 2.96Å; K25-L28 PolarHBondContact O-N 3.38Å; K26-L28 VanDerWaalsContact C-N 3.33Å; K26-L28 PolarHBondContact O-N 3.05Å |
| 29 | Q | 82.1 | Confident | 81.3 | Confident | 125 Ų | 125 | 93.6 Ų | 93.6 | 58% | 0.584 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -72.4 | -36.5 | -179.3 | -169.6 | 158.7 | 31.5 | 0 | 0 | 112.7 | K25 K26 N35 | K25-Q29 WeakPolarHBondContact O-CB 3.34Å; K25-Q29 PolarHBondContact O-N 2.98Å; K25-Q29 VanDerWaalsContact O-N 3.07Å; K26-Q29 PolarHBondContact O-N 3.25Å; K26-Q29 VanDerWaalsContact O-N 3.17Å; Q29-N35 PolarHBondContact O-ND2 2.99Å |
| 30 | W | 84.1 | Confident | 81.3 | Confident | 50 Ų | 50 | 100.9 Ų | 100.9 | 19% | 0.189 | 49% | 0.485 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.4 | 15.4 | 177.5 | -61.8 | 115.6 | 0 | 0 | 0 | 113.5 | K26 F41 A42 K45 | K26-W30 PolarHBondContact O-N 2.92Å; W30-F41 HydrophobicContact CE3-CD1 4.48Å; W30-F41 AromaticContact CH2-CD1 3.53Å; W30-F41 HydrophobicContact CH2-CD1 3.53Å; W30-F41 AromaticContact CH2-CE1 3.42Å; W30-F41 HydrophobicContact CH2-CE1 3.42Å; W30-F41 VanDerWaalsContact CH2-CE1 3.42Å; W30-F41 HydrophobicContact CZ2-CD1 4.45Å; W30-F41 HydrophobicContact CZ2-CE1 4.11Å; W30-F41 AromaticContact CZ3-CD1 3.54Å; W30-F41 HydrophobicContact CZ3-CD1 3.54Å; W30-F41 AromaticContact CZ3-CE1 3.96Å; W30-F41 HydrophobicContact CZ3-CE1 3.96Å; W30-A42 HydrophobicContact CB-CB 4.23Å; W30-A42 HydrophobicContact CE3-CB 3.79Å; W30-K45 HydrophobicContact CD2-CB 3.7Å; W30-K45 HydrophobicContact CD2-CG 4.18Å; W30-K45 HydrophobicContact CE3-CB 4.34Å; W30-K45 HydrophobicContact CG-CB 3.93Å; W30-K45 HydrophobicContact CH2-CG 4.08Å; W30-K45 HydrophobicContact CZ2-CB 4.03Å; W30-K45 HydrophobicContact CZ2-CD 4.02Å; W30-K45 HydrophobicContact CZ2-CG 3.64Å |
| 31 | H | 79 | Confident | 81.2 | Confident | 92 Ų | 92 | 101.5 Ų | 101.5 | 43% | 0.426 | 49% | 0.488 | S | S | . | . | trans | -64.6 | 135.6 | 177.4 | -164.8 | -92.7 | 0 | 0 | 0 | 110.6 | A27 D33 K34 N35 | A27-H31 PolarHBondContact O-N 3.37Å; H31-D33 WeakPolarHBondContact ND1-CB 3.25Å; H31-D33 PolarHBondContact ND1-N 2.87Å; H31-D33 PolarHBondContact O-N 2.79Å; H31-D33 VanDerWaalsContact O-N 3.15Å; H31-K34 PolarHBondContact O-N 2.87Å; H31-K34 VanDerWaalsContact O-N 3.13Å; H31-N35 PolarHBondContact O-N 3.18Å; H31-N35 PolarHBondContact O-ND2 3.45Å | ||
| 32 | P | 75.8 | Confident | 81.1 | Confident | 77 Ų | 77 | 95.7 Ų | 95.7 | 50% | 0.5 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -19.7 | -176.6 | 24.9 | -35.4 | 0 | 0 | 0 | 113.8 | ||
| 33 | D | 78.8 | Confident | 80.9 | Confident | 134 Ų | 134 | 100.3 Ų | 100.3 | 72% | 0.717 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.8 | -35.5 | 175.4 | -168.5 | -109.9 | 0 | 0 | 0 | 112.8 | H31 | H31-D33 WeakPolarHBondContact ND1-CB 3.25Å; H31-D33 PolarHBondContact ND1-N 2.87Å; H31-D33 PolarHBondContact O-N 2.79Å; H31-D33 VanDerWaalsContact O-N 3.15Å |
| 34 | K | 72.9 | Confident | 80.9 | Confident | 159 Ų | 159 | 104.1 Ų | 104.1 | 69% | 0.691 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.8 | -14.4 | -178.5 | -83.8 | 173.5 | 158.7 | -80.8 | 0 | 113.6 | H31 P36 | H31-K34 PolarHBondContact O-N 2.87Å; H31-K34 VanDerWaalsContact O-N 3.13Å; K34-P36 WeakPolarHBondContact O-CD 3.41Å |
| 35 | N | 71.3 | Confident | 80.9 | Confident | 36 Ų | 36 | 98.3 Ų | 98.3 | 19% | 0.193 | 48% | 0.481 | C | S | . | . | trans | -123.3 | 68.1 | -179.3 | -62.7 | -77.7 | 0 | 0 | 0 | 111.2 | Q29 H31 D37 | Q29-N35 PolarHBondContact O-ND2 2.99Å; H31-N35 PolarHBondContact O-N 3.18Å; H31-N35 PolarHBondContact O-ND2 3.45Å; N35-D37 VanDerWaalsContact C-N 3.27Å; N35-D37 PolarHBondContact O-N 3.5Å | ||
| 36 | P | 70.8 | Confident | 80.9 | Confident | 87 Ų | 87 | 95 Ų | 95 | 57% | 0.565 | 47% | 0.466 | S | S | * | . | S | Bend | trans | -62.9 | -32.8 | 178.2 | 24.5 | -32.2 | 0 | 0 | 0 | 112.8 | K34 | K34-P36 WeakPolarHBondContact O-CD 3.41Š|
| 37 | D | 74.8 | Confident | 81 | Confident | 146 Ų | 146 | 99.6 Ų | 99.6 | 78% | 0.781 | 49% | 0.486 | S | S | * | . | S | Bend | trans | -86.4 | -20.7 | -177.5 | -65 | -84.3 | 0 | 0 | 0 | 114.8 | N35 | N35-D37 VanDerWaalsContact C-N 3.27Å; N35-D37 PolarHBondContact O-N 3.5Å |
| 38 | N | 79 | Confident | 81.2 | Confident | 97 Ų | 97 | 101.9 Ų | 101.9 | 52% | 0.519 | 49% | 0.493 | S | S | . | . | trans | -124.9 | 39.3 | -169.4 | -74.2 | -40.9 | 0 | 0 | 0 | 112.9 | E40 F41 A42 | N38-E40 VanDerWaalsContact C-N 3.33Å; N38-E40 PolarHBondContact O-N 3.42Å; N38-F41 HydrophobicContact CB-CB 4.34Å; N38-F41 PolarHBondContact O-N 3.13Å; N38-A42 WeakPolarHBondContact O-CB 3.41Å; N38-A42 PolarHBondContact O-N 3.44Å | ||
| 39 | K | 80.3 | Confident | 81.4 | Confident | 133 Ų | 133 | 96.1 Ų | 96.1 | 58% | 0.578 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -55.7 | -43.6 | -178.5 | -72.4 | -177.2 | 179.7 | -179.6 | 0 | 113.3 | A42 E43 | K39-A42 PolarHBondContact O-N 2.97Å; K39-E43 WeakPolarHBondContact O-CB 3.44Å; K39-E43 PolarHBondContact O-N 3.29Å |
| 40 | E | 83.8 | Confident | 81.7 | Confident | 162 Ų | 162 | 91.7 Ų | 91.7 | 76% | 0.757 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -66.2 | -39.1 | 179.8 | -67.4 | -171.5 | 142.3 | 0 | 0 | 112.7 | N38 K44 | N38-E40 VanDerWaalsContact C-N 3.33Å; N38-E40 PolarHBondContact O-N 3.42Å; E40-K44 WeakPolarHBondContact O-CG 3.34Å; E40-K44 PolarHBondContact O-N 3.43Å |
| 41 | F | 82.8 | Confident | 81.9 | Confident | 112 Ų | 112 | 94.9 Ų | 94.9 | 49% | 0.491 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -70.1 | -39.3 | 178 | -165.4 | -91.4 | 0 | 0 | 0 | 111 | W30 N38 K44 K45 | W30-F41 HydrophobicContact CE3-CD1 4.48Å; W30-F41 AromaticContact CH2-CD1 3.53Å; W30-F41 HydrophobicContact CH2-CD1 3.53Å; W30-F41 AromaticContact CH2-CE1 3.42Å; W30-F41 HydrophobicContact CH2-CE1 3.42Å; W30-F41 VanDerWaalsContact CH2-CE1 3.42Å; W30-F41 HydrophobicContact CZ2-CD1 4.45Å; W30-F41 HydrophobicContact CZ2-CE1 4.11Å; W30-F41 AromaticContact CZ3-CD1 3.54Å; W30-F41 HydrophobicContact CZ3-CD1 3.54Å; W30-F41 AromaticContact CZ3-CE1 3.96Å; W30-F41 HydrophobicContact CZ3-CE1 3.96Å; N38-F41 HydrophobicContact CB-CB 4.34Å; N38-F41 PolarHBondContact O-N 3.13Å; F41-K44 PolarHBondContact O-N 2.84Å; F41-K45 HydrophobicContact CD1-CG 3.98Å; F41-K45 HydrophobicContact CE1-CD 4.32Å; F41-K45 HydrophobicContact CE1-CG 3.73Å; F41-K45 HydrophobicContact CZ-CG 4.37Å; F41-K45 WeakPolarHBondContact O-CB 3.46Å; F41-K45 WeakPolarHBondContact O-CG 3.47Å; F41-K45 PolarHBondContact O-N 3.07Å |
| 42 | A | 84.6 | Confident | 82.4 | Confident | 4 Ų | 4 | 90.5 Ų | 90.5 | 3% | 0.033 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -62.5 | -44.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | W30 N38 K39 K45 F46 | W30-A42 HydrophobicContact CB-CB 4.23Å; W30-A42 HydrophobicContact CE3-CB 3.79Å; N38-A42 WeakPolarHBondContact O-CB 3.41Å; N38-A42 PolarHBondContact O-N 3.44Å; K39-A42 PolarHBondContact O-N 2.97Å; A42-K45 PolarHBondContact O-N 2.99Å; A42-F46 VanDerWaalsContact O-CB 3.27Å; A42-F46 WeakPolarHBondContact O-CB 3.46Å; A42-F46 PolarHBondContact O-N 3.46Å |
| 43 | E | 84.8 | Confident | 82.9 | Confident | 112 Ų | 112 | 89.7 Ų | 89.7 | 52% | 0.523 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.4 | -43.7 | 177.5 | -164.7 | -165.2 | 144.9 | 0 | 0 | 111.8 | K39 K45 F46 K47 | K39-E43 WeakPolarHBondContact O-CB 3.44Å; K39-E43 PolarHBondContact O-N 3.29Å; E43-K45 PolarHBondContact O-N 3.35Å; E43-F46 PolarHBondContact O-N 3.04Å; E43-K47 PolarHBondContact O-N 3.5Å; E43-K47 IonicContact OE1-NZ 2.79Å; E43-K47 PolarHBondContact OE1-NZ 3.12Å |
| 44 | K | 87 | Confident | 83.2 | Confident | 148 Ų | 148 | 90.3 Ų | 90.3 | 64% | 0.643 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -57.9 | -49.9 | 175 | -80.7 | -176.6 | 177.3 | 178.8 | 0 | 111.2 | E40 F41 F46 K47 E48 | E40-K44 WeakPolarHBondContact O-CG 3.34Å; E40-K44 PolarHBondContact O-N 3.43Å; F41-K44 PolarHBondContact O-N 2.84Å; K44-F46 VanDerWaalsContact C-N 3.31Å; K44-F46 PolarHBondContact O-N 3.29Å; K44-K47 PolarHBondContact O-N 3.28Å; K44-E48 WeakPolarHBondContact O-CG 3.43Å; K44-E48 PolarHBondContact O-N 3.02Å |
| 45 | K | 85.4 | Confident | 83.8 | Confident | 58 Ų | 58 | 84.9 Ų | 84.9 | 25% | 0.252 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.4 | -37.3 | 179.5 | -75.3 | -76.1 | 164.6 | -145.1 | 0 | 112.5 | W30 F41 A42 E43 E48 V49 | W30-K45 HydrophobicContact CD2-CB 3.7Å; W30-K45 HydrophobicContact CD2-CG 4.18Å; W30-K45 HydrophobicContact CE3-CB 4.34Å; W30-K45 HydrophobicContact CG-CB 3.93Å; W30-K45 HydrophobicContact CH2-CG 4.08Å; W30-K45 HydrophobicContact CZ2-CB 4.03Å; W30-K45 HydrophobicContact CZ2-CD 4.02Å; W30-K45 HydrophobicContact CZ2-CG 3.64Å; F41-K45 HydrophobicContact CD1-CG 3.98Å; F41-K45 HydrophobicContact CE1-CD 4.32Å; F41-K45 HydrophobicContact CE1-CG 3.73Å; F41-K45 HydrophobicContact CZ-CG 4.37Å; F41-K45 WeakPolarHBondContact O-CB 3.46Å; F41-K45 WeakPolarHBondContact O-CG 3.47Å; F41-K45 PolarHBondContact O-N 3.07Å; A42-K45 PolarHBondContact O-N 2.99Å; E43-K45 PolarHBondContact O-N 3.35Å; K45-E48 WeakPolarHBondContact CD-OE2 3.48Å; K45-E48 WeakPolarHBondContact CE-OE2 3.18Å; K45-E48 IonicContact NZ-OE2 2.84Å; K45-E48 PolarHBondContact NZ-OE2 2.95Å; K45-E48 PolarHBondContact O-N 3.37Å; K45-V49 WeakPolarHBondContact O-CB 3.36Å; K45-V49 WeakPolarHBondContact O-CG2 3.43Å; K45-V49 PolarHBondContact O-N 3.27Å |
| 46 | F | 87.3 | Confident | 84.3 | Confident | 84 Ų | 84 | 83.5 Ų | 83.5 | 37% | 0.368 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.6 | -44.4 | 177 | -171.6 | -96.3 | 0 | 0 | 0 | 111.9 | A27 A42 E43 K44 V49 A50 | A27-F46 HydrophobicContact CB-CE2 4.2Å; A42-F46 VanDerWaalsContact O-CB 3.27Å; A42-F46 WeakPolarHBondContact O-CB 3.46Å; A42-F46 PolarHBondContact O-N 3.46Å; E43-F46 PolarHBondContact O-N 3.04Å; K44-F46 VanDerWaalsContact C-N 3.31Å; K44-F46 PolarHBondContact O-N 3.29Å; F46-V49 PolarHBondContact O-N 3.05Å; F46-A50 WeakPolarHBondContact O-CB 3.11Å; F46-A50 PolarHBondContact O-N 3.2Å |
| 47 | K | 88.3 | Confident | 84.6 | Confident | 128 Ų | 128 | 80.9 Ų | 80.9 | 56% | 0.557 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -59.3 | -48.6 | 173.7 | -88.9 | 170.9 | 173.2 | 148.8 | 0 | 112 | E43 K44 V49 A50 E51 | E43-K47 PolarHBondContact O-N 3.5Å; E43-K47 IonicContact OE1-NZ 2.79Å; E43-K47 PolarHBondContact OE1-NZ 3.12Å; K44-K47 PolarHBondContact O-N 3.28Å; K47-V49 VanDerWaalsContact C-N 3.31Å; K47-V49 PolarHBondContact O-N 3.09Å; K47-A50 PolarHBondContact O-N 2.96Å; K47-E51 PolarHBondContact O-N 3.42Å |
| 48 | E | 88.6 | Confident | 84.7 | Confident | 73 Ų | 73 | 78.9 Ų | 78.9 | 34% | 0.341 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -57.5 | -43.9 | 177.7 | -69.2 | -177.6 | 114.7 | 0 | 0 | 111.8 | I7 K44 K45 A52 | I7-E48 HydrophobicContact CD1-CB 4.36Å; I7-E48 HydrophobicContact CG2-CB 3.7Å; K44-E48 WeakPolarHBondContact O-CG 3.43Å; K44-E48 PolarHBondContact O-N 3.02Å; K45-E48 WeakPolarHBondContact CD-OE2 3.48Å; K45-E48 WeakPolarHBondContact CE-OE2 3.18Å; K45-E48 IonicContact NZ-OE2 2.84Å; K45-E48 PolarHBondContact NZ-OE2 2.95Å; K45-E48 PolarHBondContact O-N 3.37Å; E48-A52 WeakPolarHBondContact O-CB 3.1Å; E48-A52 PolarHBondContact O-N 3.47Å |
| 49 | V | 88.3 | Confident | 84.2 | Confident | 1 Ų | 1 | 80 Ų | 80 | 1% | 0.006 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -67.8 | -38.2 | -179.8 | 165.6 | 0 | 0 | 0 | 0 | 112.2 | I7 L8 Y23 K26 K45 F46 K47 Y53 | I7-V49 HydrophobicContact CG2-CG2 3.85Å; L8-V49 HydrophobicContact CD2-CG1 3.88Å; Y23-V49 HydrophobicContact CD2-CG1 3.56Å; Y23-V49 HydrophobicContact CE2-CG1 3.99Å; K26-V49 HydrophobicContact CB-CG1 3.98Å; K26-V49 HydrophobicContact CB-CG2 4.15Å; K26-V49 HydrophobicContact CD-CG2 3.91Å; K26-V49 HydrophobicContact CG-CG2 4.33Å; K45-V49 WeakPolarHBondContact O-CB 3.36Å; K45-V49 WeakPolarHBondContact O-CG2 3.43Å; K45-V49 PolarHBondContact O-N 3.27Å; F46-V49 PolarHBondContact O-N 3.05Å; K47-V49 VanDerWaalsContact C-N 3.31Å; K47-V49 PolarHBondContact O-N 3.09Å; V49-Y53 WeakPolarHBondContact O-CB 3.4Å; V49-Y53 PolarHBondContact O-N 2.71Å |
| 50 | A | 88.3 | Confident | 83.5 | Confident | 33 Ų | 33 | 74.9 Ų | 74.9 | 27% | 0.273 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -66.5 | -46.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | F46 K47 A52 Y53 E54 | F46-A50 WeakPolarHBondContact O-CB 3.11Å; F46-A50 PolarHBondContact O-N 3.2Å; K47-A50 PolarHBondContact O-N 2.96Å; A50-A52 PolarHBondContact O-N 2.84Å; A50-Y53 PolarHBondContact O-N 3.43Å; A50-E54 PolarHBondContact O-N 3.06Å |
| 51 | E | 88.8 | Confident | 82.4 | Confident | 117 Ų | 117 | 73.3 Ų | 73.3 | 55% | 0.547 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 177.1 | -170 | -179.3 | 98 | 0 | 0 | 111.3 | K47 Y53 E54 V55 | K47-E51 PolarHBondContact O-N 3.42Å; E51-Y53 VanDerWaalsContact C-N 3.32Å; E51-Y53 PolarHBondContact O-N 3.05Å; E51-E54 PolarHBondContact O-N 3.49Å; E51-V55 WeakPolarHBondContact O-CG2 3.4Å; E51-V55 PolarHBondContact O-N 3.06Å |
| 52 | A | 88.1 | Confident | 81.1 | Confident | 0 Ų | 0 | 72.5 Ų | 72.5 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.5 | -42.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y4 I7 L8 E48 A50 L56 | Y4-A52 HydrophobicContact CD1-CB 3.75Å; Y4-A52 HydrophobicContact CG-CB 4.21Å; I7-A52 HydrophobicContact CB-CB 4.44Å; I7-A52 HydrophobicContact CG2-CB 4.35Å; L8-A52 HydrophobicContact CD1-CB 3.68Å; L8-A52 HydrophobicContact CG-CB 4.01Å; E48-A52 WeakPolarHBondContact O-CB 3.1Å; E48-A52 PolarHBondContact O-N 3.47Å; A50-A52 PolarHBondContact O-N 2.84Å; A52-L56 WeakPolarHBondContact O-CB 3.45Å; A52-L56 WeakPolarHBondContact O-CD1 3.25Å; A52-L56 VanDerWaalsContact O-CG 3.25Å; A52-L56 WeakPolarHBondContact O-CG 3.47Å; A52-L56 PolarHBondContact O-N 3.04Å; A52-L56 VanDerWaalsContact O-N 3.17Å |
| 53 | Y | 87 | Confident | 79.5 | Confident | 59 Ų | 59 | 75.5 Ų | 75.5 | 23% | 0.231 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -66.8 | -43.3 | 179.3 | 175.2 | -96.8 | 0 | 0 | 0 | 112.1 | I19 K20 Y23 V49 A50 E51 V55 L56 S57 | I19-Y53 HydrophobicContact CG2-CD2 3.8Å; I19-Y53 HydrophobicContact CG2-CE2 4.27Å; K20-Y53 HydrophobicContact CG-CE2 3.78Å; Y23-Y53 HydrophobicContact CD2-CG 4.2Å; Y23-Y53 HydrophobicContact CG-CD2 4.27Å; Y23-Y53 HydrophobicContact CG-CG 4.36Å; V49-Y53 WeakPolarHBondContact O-CB 3.4Å; V49-Y53 PolarHBondContact O-N 2.71Å; A50-Y53 PolarHBondContact O-N 3.43Å; E51-Y53 VanDerWaalsContact C-N 3.32Å; E51-Y53 PolarHBondContact O-N 3.05Å; Y53-V55 PolarHBondContact O-N 3.09Å; Y53-L56 PolarHBondContact O-N 3.33Å; Y53-S57 WeakPolarHBondContact O-CB 3.33Å; Y53-S57 PolarHBondContact O-N 3.17Å |
| 54 | E | 85.9 | Confident | 77.8 | Confident | 148 Ų | 148 | 74.3 Ų | 74.3 | 69% | 0.692 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -60.2 | -47.6 | -179.5 | -167.3 | 173.1 | 107.6 | 0 | 0 | 111.2 | A50 E51 L56 S57 D58 | A50-E54 PolarHBondContact O-N 3.06Å; E51-E54 PolarHBondContact O-N 3.49Å; E54-L56 PolarHBondContact O-N 3.02Å; E54-S57 PolarHBondContact O-N 3.49Å; E54-D58 WeakPolarHBondContact O-CB 3.4Å; E54-D58 PolarHBondContact O-N 2.82Å |
| 55 | V | 85 | Confident | 75.9 | Confident | 44 Ų | 44 | 77.4 Ų | 77.4 | 27% | 0.267 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.4 | -44.1 | 178.8 | 176 | 0 | 0 | 0 | 0 | 111.9 | Y4 E51 Y53 M59 | Y4-V55 HydrophobicContact CD2-CG1 4.4Å; Y4-V55 HydrophobicContact CE2-CG1 4.15Å; E51-V55 WeakPolarHBondContact O-CG2 3.4Å; E51-V55 PolarHBondContact O-N 3.06Å; Y53-V55 PolarHBondContact O-N 3.09Å; V55-M59 HydrophobicContact CG1-CE 3.65Å; V55-M59 WeakPolarHBondContact O-CG 3.48Å; V55-M59 PolarHBondContact O-N 3.38Å |
| 56 | L | 81.1 | Confident | 74.1 | Confident | 8 Ų | 8 | 83 Ų | 83 | 4% | 0.042 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -73.9 | -34.6 | -178.9 | -68.1 | 170.6 | 0 | 0 | 0 | 112.6 | Y5 L8 I19 A52 Y53 E54 A60 | Y5-L56 HydrophobicContact CE1-CD2 4.12Å; Y5-L56 HydrophobicContact CE2-CD2 4.05Å; L8-L56 HydrophobicContact CD1-CD1 3.5Å; I19-L56 HydrophobicContact CD1-CB 4.1Å; I19-L56 HydrophobicContact CD1-CD1 4.11Å; I19-L56 HydrophobicContact CG1-CD1 4.3Å; I19-L56 HydrophobicContact CG2-CB 4.31Å; I19-L56 HydrophobicContact CG2-CD1 4.25Å; A52-L56 WeakPolarHBondContact O-CB 3.45Å; A52-L56 WeakPolarHBondContact O-CD1 3.25Å; A52-L56 VanDerWaalsContact O-CG 3.25Å; A52-L56 WeakPolarHBondContact O-CG 3.47Å; A52-L56 PolarHBondContact O-N 3.04Å; A52-L56 VanDerWaalsContact O-N 3.17Å; Y53-L56 PolarHBondContact O-N 3.33Å; E54-L56 PolarHBondContact O-N 3.02Å; L56-A60 WeakPolarHBondContact O-CB 3.24Å; L56-A60 PolarHBondContact O-N 3.27Å |
| 57 | S | 77.4 | Confident | 72.4 | Confident | 31 Ų | 31 | 87.5 Ų | 87.5 | 22% | 0.217 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -65 | -41.7 | 175.8 | -174.6 | 0 | 0 | 0 | 0 | 110.9 | Y53 E54 A60 Q61 | Y53-S57 WeakPolarHBondContact O-CB 3.33Å; Y53-S57 PolarHBondContact O-N 3.17Å; E54-S57 PolarHBondContact O-N 3.49Å; S57-A60 PolarHBondContact O-N 3.19Å; S57-Q61 VanDerWaalsContact O-CB 3.24Å; S57-Q61 WeakPolarHBondContact O-CB 3.15Å; S57-Q61 PolarHBondContact O-N 3.5Å |
| 58 | D | 76.8 | Confident | 70.5 | Confident | 105 Ų | 105 | 87.3 Ų | 87.3 | 56% | 0.561 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62.5 | -44.1 | 177.3 | -173.9 | -99.9 | 0 | 0 | 0 | 112.1 | E54 A60 Q61 S62 | E54-D58 WeakPolarHBondContact O-CB 3.4Å; E54-D58 PolarHBondContact O-N 2.82Å; D58-A60 VanDerWaalsContact C-N 3.34Å; D58-A60 PolarHBondContact O-N 3.49Å; D58-Q61 PolarHBondContact O-N 2.87Å; D58-S62 PolarHBondContact O-N 3.26Å; D58-S62 PolarHBondContact O-OG 3.29Å |
| 59 | M | 68.8 | Low | 68.3 | Low | 119 Ų | 119 | 90 Ų | 90 | 59% | 0.586 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.5 | -41.1 | 174.4 | -68.7 | -179.8 | -172 | 0 | 0 | 112.6 | V55 | V55-M59 HydrophobicContact CG1-CE 3.65Å; V55-M59 WeakPolarHBondContact O-CG 3.48Å; V55-M59 PolarHBondContact O-N 3.38Å |
| 60 | A | 64.9 | Low | 66.4 | Low | 26 Ų | 26 | 98 Ų | 98 | 22% | 0.215 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -70.9 | -36.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | P16 L56 S57 D58 S62 G63 C64 | P16-A60 HydrophobicContact CB-CB 3.88Å; P16-A60 HydrophobicContact CG-CB 4.35Å; L56-A60 WeakPolarHBondContact O-CB 3.24Å; L56-A60 PolarHBondContact O-N 3.27Å; S57-A60 PolarHBondContact O-N 3.19Å; D58-A60 VanDerWaalsContact C-N 3.34Å; D58-A60 PolarHBondContact O-N 3.49Å; A60-S62 VanDerWaalsContact C-N 3.32Å; A60-S62 PolarHBondContact O-N 3.39Å; A60-G63 PolarHBondContact O-N 3.49Å; A60-C64 PolarHBondContact O-N 3.4Å |
| 61 | Q | 61.3 | Low | 64.3 | Low | 130 Ų | 130 | 106.4 Ų | 106.4 | 61% | 0.607 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -71.6 | -29.5 | -178.9 | -160.1 | 164.5 | -1.1 | 0 | 0 | 111.9 | S57 D58 G63 | S57-Q61 VanDerWaalsContact O-CB 3.24Å; S57-Q61 WeakPolarHBondContact O-CB 3.15Å; S57-Q61 PolarHBondContact O-N 3.5Å; D58-Q61 PolarHBondContact O-N 2.87Å; Q61-G63 VanDerWaalsContact C-N 3.28Å; Q61-G63 PolarHBondContact O-N 3.07Å |
| 62 | S | 55.6 | Low | 62.3 | Low | 94 Ų | 94 | 107 Ų | 107 | 66% | 0.657 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | -25 | 175.4 | -59.5 | 0 | 0 | 0 | 0 | 114.1 | D58 A60 | D58-S62 PolarHBondContact O-N 3.26Å; D58-S62 PolarHBondContact O-OG 3.29Å; A60-S62 VanDerWaalsContact C-N 3.32Å; A60-S62 PolarHBondContact O-N 3.39Å |
| 63 | G | 50.2 | Low | 60.4 | Low | 67 Ų | 67 | 114.4 Ų | 114.4 | 69% | 0.691 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.3 | -11.8 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | A60 Q61 | A60-G63 PolarHBondContact O-N 3.49Å; Q61-G63 VanDerWaalsContact C-N 3.28Å; Q61-G63 PolarHBondContact O-N 3.07Å |
| 64 | C | 50.6 | Low | 58.4 | Low | 88 Ų | 88 | 117.4 Ų | 117.4 | 60% | 0.595 | 62% | 0.62 | S | S | * | * | trans | -125.7 | 39 | -165.2 | -67.4 | 0 | 0 | 0 | 0 | 114.1 | A60 | A60-C64 PolarHBondContact O-N 3.4Š| ||
| 65 | Y | 45.6 | Very low | 56.3 | Low | 213 Ų | 213 | 114.4 Ų | 114.4 | 84% | 0.835 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -88.3 | -6 | 177.7 | -158.1 | -102.2 | 0 | 0 | 0 | 115.2 | ||
| 66 | E | 48.7 | Very low | 54.5 | Low | 174 Ų | 174 | 116.5 Ų | 116.5 | 81% | 0.813 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -97.3 | -23.1 | -173.4 | -61.3 | -146.5 | 100.2 | 0 | 0 | 116.8 | ||
| 67 | H | 51.3 | Low | 52.9 | Low | 179 Ų | 179 | 125 Ų | 125 | 83% | 0.829 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -147.3 | 0.3 | -169.3 | -79.9 | -61.8 | 0 | 0 | 0 | 121.6 | ||
| 68 | V | 49.1 | Very low | 51.4 | Low | 124 Ų | 124 | 130.4 Ų | 130.4 | 75% | 0.752 | 71% | 0.714 | S | S | * | * | trans | -126.3 | 70.5 | -171.9 | -160.3 | 0 | 0 | 0 | 0 | 113.2 | H70 | V68-H70 VanDerWaalsContact C-N 3.32Š| ||
| 69 | C | 41.6 | Very low | 50 | Low | 131 Ų | 131 | 133.1 Ų | 133.1 | 89% | 0.885 | 73% | 0.725 | S | S | * | * | trans | -93.8 | 69.6 | 154.5 | -148.9 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 70 | H | 48.7 | Very low | 49.6 | Very low | 169 Ų | 169 | 130.5 Ų | 130.5 | 78% | 0.782 | 72% | 0.717 | S | S | * | * | trans | -97.5 | 95.8 | 154.4 | -143.2 | 48.2 | 0 | 0 | 0 | 106.6 | V68 D72 | V68-H70 VanDerWaalsContact C-N 3.32Å; H70-D72 PolarHBondContact O-N 3.4Å; H70-D72 VanDerWaalsContact O-N 3.09Å | ||
| 71 | R | 44.1 | Very low | 49 | Very low | 208 Ų | 208 | 136 Ų | 136 | 79% | 0.785 | 75% | 0.751 | S | S | * | * | trans | -52.9 | 108.7 | 168.9 | -174.6 | 173.8 | 85.1 | -156.2 | 8.5 | 107.5 | E73 | R71-E73 PolarHBondContact O-N 3.28Š| ||
| 72 | D | 45.7 | Very low | 48.5 | Very low | 129 Ų | 129 | 139.2 Ų | 139.2 | 69% | 0.69 | 76% | 0.758 | S | S | * | * | trans | -51.6 | 104.4 | 166.8 | -86.2 | -86.6 | 0 | 0 | 0 | 108.3 | H70 P74 | H70-D72 PolarHBondContact O-N 3.4Å; H70-D72 VanDerWaalsContact O-N 3.09Å; D72-P74 WeakPolarHBondContact O-CD 3.45Å | ||
| 73 | E | 49.2 | Very low | 48.6 | Very low | 156 Ų | 156 | 139.9 Ų | 139.9 | 73% | 0.729 | 75% | 0.752 | S | S | * | * | trans | -81.8 | 111.7 | 157.9 | -172 | 179.2 | 108.3 | 0 | 0 | 106 | R71 A75 | R71-E73 PolarHBondContact O-N 3.28Å; E73-A75 PolarHBondContact O-N 3.05Å | ||
| 74 | P | 45.1 | Very low | 48.3 | Very low | 122 Ų | 122 | 141.7 Ų | 141.7 | 79% | 0.792 | 75% | 0.752 | S | S | * | * | trans | -71 | 100.6 | 172.8 | 28.3 | -31.6 | 0 | 0 | 0 | 108.4 | D72 A76 | D72-P74 WeakPolarHBondContact O-CD 3.45Å; P74-A76 PolarHBondContact O-N 3.45Å | ||
| 75 | A | 41.5 | Very low | 48.4 | Very low | 86 Ų | 86 | 143.7 Ų | 143.7 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | trans | -56.9 | 125.4 | 165.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | E73 | E73-A75 PolarHBondContact O-N 3.05Š| ||
| 76 | A | 47.2 | Very low | 48.4 | Very low | 87 Ų | 87 | 144.8 Ų | 144.8 | 72% | 0.719 | 77% | 0.768 | S | S | * | * | trans | 35.5 | 121.5 | 149.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | P74 | P74-A76 PolarHBondContact O-N 3.45Š| ||
| 77 | E | 46.9 | Very low | 48.5 | Very low | 187 Ų | 187 | 143 Ų | 143 | 87% | 0.874 | 76% | 0.763 | S | S | * | * | trans | 167.1 | 92 | 132.7 | -91.7 | 166.7 | 169.2 | 0 | 0 | 110.2 | ||||
| 78 | T | 47 | Very low | 48.3 | Very low | 145 Ų | 145 | 140.1 Ų | 140.1 | 89% | 0.89 | 76% | 0.761 | S | S | * | * | trans | 174.1 | 62.8 | 146.6 | 31.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 79 | M | 46.8 | Very low | 48.4 | Very low | 161 Ų | 161 | 138.7 Ų | 138.7 | 79% | 0.793 | 76% | 0.756 | S | S | * | * | trans | -88.2 | 120.7 | 158.2 | -66.1 | -169.3 | 91.4 | 0 | 0 | 107.5 | I83 | M79-I83 HydrophobicContact CE-CD1 3.68Š| ||
| 80 | P | 59.4 | Low | 48.7 | Very low | 65 Ų | 65 | 141.2 Ų | 141.2 | 42% | 0.422 | 75% | 0.753 | S | S | . | * | trans | -71.3 | 151.6 | -176 | 29.1 | -34.8 | 0 | 0 | 0 | 111.6 | W82 | P80-W82 PolarHBondContact O-N 3.35Š| ||
| 81 | P | 52.5 | Low | 49 | Very low | 141 Ų | 141 | 141.6 Ų | 141.6 | 92% | 0.916 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | 22.7 | -165.1 | 30 | -37.7 | 0 | 0 | 0 | 116.2 | ||
| 82 | W | 51.2 | Low | 49.2 | Very low | 198 Ų | 198 | 143.5 Ų | 143.5 | 75% | 0.75 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.1 | 11.6 | -171.4 | 63.1 | -90.4 | 0 | 0 | 0 | 115.8 | P80 P84 | P80-W82 PolarHBondContact O-N 3.35Å; W82-P84 VanDerWaalsContact O-CD 3.3Å; W82-P84 WeakPolarHBondContact O-CD 3.35Å |
| 83 | I | 57.9 | Low | 49.4 | Very low | 107 Ų | 107 | 144.3 Ų | 144.3 | 55% | 0.549 | 78% | 0.777 | S | S | . | * | trans | -78.4 | 116.2 | 176 | -57.3 | 167.6 | 0 | 0 | 0 | 109.2 | M79 | M79-I83 HydrophobicContact CE-CD1 3.68Š| ||
| 84 | P | 45.1 | Very low | 49.4 | Very low | 105 Ų | 105 | 143.6 Ų | 143.6 | 68% | 0.682 | 78% | 0.78 | S | S | * | * | trans | -73 | 135.5 | -178.1 | 29.6 | -32.1 | 0 | 0 | 0 | 110.3 | W82 R86 | W82-P84 VanDerWaalsContact O-CD 3.3Å; W82-P84 WeakPolarHBondContact O-CD 3.35Å; P84-R86 PolarHBondContact O-N 2.79Å | ||
| 85 | C | 51.2 | Low | 49.7 | Very low | 130 Ų | 130 | 144.8 Ų | 144.8 | 88% | 0.878 | 78% | 0.779 | S | S | * | * | trans | -45.8 | 101.4 | 172.6 | -74.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 86 | R | 45.8 | Very low | 50.1 | Low | 237 Ų | 237 | 148.3 Ų | 148.3 | 89% | 0.894 | 78% | 0.783 | S | S | * | * | trans | -101.8 | 91.1 | 166.4 | -164.5 | 166.2 | -174.1 | -164.9 | -0.2 | 108.2 | P84 | P84-R86 PolarHBondContact O-N 2.79Š| ||
| 87 | L | 51.3 | Low | 50.3 | Low | 136 Ų | 136 | 152.1 Ų | 152.1 | 71% | 0.712 | 79% | 0.787 | S | S | * | * | trans | -46.7 | 147.5 | 158.5 | -82.2 | 93.2 | 0 | 0 | 0 | 109.4 | ||||
| 88 | P | 46.1 | Very low | 50.5 | Low | 119 Ų | 119 | 149.8 Ų | 149.8 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | -119.1 | 119.4 | 119.7 | 27.4 | -16.8 | 0 | 0 | 0 | 108.7 | F90 | P88-F90 PolarHBondContact O-N 3.02Š| |||
| 89 | S | 52.6 | Low | 50.8 | Low | 94 Ų | 94 | 150.1 Ų | 150.1 | 66% | 0.657 | 77% | 0.773 | S | S | * | * | trans | -39.2 | 123.2 | 145.2 | -62.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 90 | F | 47.8 | Very low | 51.1 | Low | 184 Ų | 184 | 149.3 Ų | 149.3 | 81% | 0.807 | 77% | 0.772 | S | S | * | * | trans | -177.9 | 85.3 | 131.8 | -117.7 | -103.5 | 0 | 0 | 0 | 108.4 | P88 | P88-F90 PolarHBondContact O-N 3.02Š| ||
| 91 | I | 54.3 | Low | 50.4 | Low | 177 Ų | 177 | 156.3 Ų | 156.3 | 91% | 0.908 | 80% | 0.801 | S | S | * | * | trans | -81.6 | 98.8 | 142.9 | -67.1 | 167.7 | 0 | 0 | 0 | 104.3 | ||||
| 92 | F | 49.1 | Very low | 50.2 | Low | 248 Ų | 248 | 157.7 Ų | 157.7 | 100% | 1.088 | 79% | 0.791 | S | S | * | * | trans | -174.2 | 0 | 132.7 | -161.7 | -100.2 | 0 | 0 | 0 | 108.9 |
Retrieved 92 of 92 residues in 19.4 ms
(Link to these results)