| 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 | T | 62.9 | Low | 84.4 | Confident | 151 Ų | 151 | 108.4 Ų | 108.4 | 93% | 0.926 | 59% | 0.592 | S | S | * | * | 0 | -32.4 | 0 | -0.6 | 0 | 0 | 0 | 0 | 111.4 | M4 | T1-M4 PolarHBondContact O-N 3.09Š| |||
| 2 | D | 64.7 | Low | 85.3 | Confident | 132 Ų | 132 | 105.9 Ų | 105.9 | 71% | 0.706 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -71.6 | -34.2 | 178.7 | -53.2 | -55.2 | 0 | 0 | 0 | 114.5 | M4 A5 L6 | D2-M4 PolarHBondContact O-N 3.11Å; D2-A5 WeakPolarHBondContact O-CA 3.49Å; D2-A5 WeakPolarHBondContact O-CB 3.23Å; D2-A5 PolarHBondContact O-N 2.66Å; D2-L6 PolarHBondContact O-N 2.66Å |
| 3 | D | 66.1 | Low | 86.1 | Confident | 138 Ų | 138 | 107 Ų | 107 | 74% | 0.738 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -57.7 | -37.2 | 174.4 | -61.7 | -43.6 | 0 | 0 | 0 | 112.3 | A5 L6 A7 | D3-A5 VanDerWaalsContact C-N 3.29Å; D3-A5 PolarHBondContact O-N 2.94Å; D3-L6 PolarHBondContact O-N 3.06Å; D3-A7 WeakPolarHBondContact O-CB 2.88Å; D3-A7 PolarHBondContact O-N 2.94Å |
| 4 | M | 78.6 | Confident | 86.8 | Confident | 134 Ų | 134 | 104.3 Ų | 104.3 | 66% | 0.66 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -73.1 | -24.6 | 177.9 | -155.7 | 144.3 | 69.7 | 0 | 0 | 111.8 | T1 D2 K8 | T1-M4 PolarHBondContact O-N 3.09Å; D2-M4 PolarHBondContact O-N 3.11Å; M4-K8 VanDerWaalsContact O-CB 3.26Å; M4-K8 WeakPolarHBondContact O-CB 3.34Å; M4-K8 VanDerWaalsContact O-CG 3.29Å; M4-K8 WeakPolarHBondContact O-CG 3.29Å; M4-K8 PolarHBondContact O-N 3.19Å |
| 5 | A | 88.3 | Confident | 87.4 | Confident | 51 Ų | 51 | 102.5 Ų | 102.5 | 42% | 0.421 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -77.8 | -42 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | D2 D3 T9 | D2-A5 WeakPolarHBondContact O-CA 3.49Å; D2-A5 WeakPolarHBondContact O-CB 3.23Å; D2-A5 PolarHBondContact O-N 2.66Å; D3-A5 VanDerWaalsContact C-N 3.29Å; D3-A5 PolarHBondContact O-N 2.94Å; A5-T9 WeakPolarHBondContact O-CB 3.3Å; A5-T9 PolarHBondContact O-N 3.2Å; A5-T9 PolarHBondContact O-OG1 3.45Å |
| 6 | L | 93.1 | Very high | 88 | Confident | 125 Ų | 125 | 106.4 Ų | 106.4 | 65% | 0.654 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.9 | -50.5 | 175.1 | -171.5 | 102.7 | 0 | 0 | 0 | 110.9 | D2 D3 K8 T9 V10 | D2-L6 PolarHBondContact O-N 2.66Å; D3-L6 PolarHBondContact O-N 3.06Å; L6-K8 VanDerWaalsContact C-N 3.32Å; L6-K8 PolarHBondContact O-N 2.95Å; L6-T9 WeakPolarHBondContact O-CB 3.46Å; L6-T9 PolarHBondContact O-N 2.99Å; L6-V10 WeakPolarHBondContact O-CG2 3.27Å; L6-V10 PolarHBondContact O-N 2.61Å |
| 7 | A | 93.7 | Very high | 88.5 | Confident | 59 Ų | 59 | 110.9 Ų | 110.9 | 49% | 0.488 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -59.6 | -41.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | D3 T9 V10 Y11 | D3-A7 WeakPolarHBondContact O-CB 2.88Å; D3-A7 PolarHBondContact O-N 2.94Å; A7-T9 VanDerWaalsContact C-N 3.33Å; A7-T9 PolarHBondContact O-N 2.76Å; A7-V10 PolarHBondContact O-N 3.41Å; A7-Y11 WeakPolarHBondContact O-CB 3.21Å; A7-Y11 PolarHBondContact O-N 3.01Å |
| 8 | K | 94.9 | Very high | 89 | Confident | 138 Ų | 138 | 111.4 Ų | 111.4 | 60% | 0.6 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61.2 | -40.7 | 173.2 | -89.5 | -176.9 | 175 | -174.9 | 0 | 112.5 | M4 L6 N12 | M4-K8 VanDerWaalsContact O-CB 3.26Å; M4-K8 WeakPolarHBondContact O-CB 3.34Å; M4-K8 VanDerWaalsContact O-CG 3.29Å; M4-K8 WeakPolarHBondContact O-CG 3.29Å; M4-K8 PolarHBondContact O-N 3.19Å; L6-K8 VanDerWaalsContact C-N 3.32Å; L6-K8 PolarHBondContact O-N 2.95Å; K8-N12 WeakPolarHBondContact O-CB 3.21Å; K8-N12 PolarHBondContact O-N 2.96Å; K8-N12 PolarHBondContact O-ND2 3.48Å |
| 9 | T | 95.4 | Very high | 89.5 | Confident | 76 Ų | 76 | 110 Ų | 110 | 47% | 0.466 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66 | -48.7 | 179.9 | -58.8 | 0 | 0 | 0 | 0 | 110.4 | A5 L6 A7 Y11 N12 L13 | A5-T9 WeakPolarHBondContact O-CB 3.3Å; A5-T9 PolarHBondContact O-N 3.2Å; A5-T9 PolarHBondContact O-OG1 3.45Å; L6-T9 WeakPolarHBondContact O-CB 3.46Å; L6-T9 PolarHBondContact O-N 2.99Å; A7-T9 VanDerWaalsContact C-N 3.33Å; A7-T9 PolarHBondContact O-N 2.76Å; T9-Y11 PolarHBondContact O-N 2.9Å; T9-N12 PolarHBondContact O-N 3.16Å; T9-L13 HydrophobicContact CG2-CD1 3.75Å; T9-L13 HydrophobicContact CG2-CG 4.43Å; T9-L13 WeakPolarHBondContact O-CB 3.32Å; T9-L13 VanDerWaalsContact O-CG 3.29Å; T9-L13 WeakPolarHBondContact O-CG 3.27Å; T9-L13 PolarHBondContact O-N 3Å |
| 10 | V | 95.1 | Very high | 89.8 | Confident | 56 Ų | 56 | 107 Ų | 107 | 34% | 0.339 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -58.9 | -46 | 176.3 | 169.7 | 0 | 0 | 0 | 0 | 111.3 | L6 A7 N12 L13 L14 F15 | L6-V10 WeakPolarHBondContact O-CG2 3.27Å; L6-V10 PolarHBondContact O-N 2.61Å; A7-V10 PolarHBondContact O-N 3.41Å; V10-N12 PolarHBondContact O-N 2.88Å; V10-L13 PolarHBondContact O-N 3.35Å; V10-L14 HydrophobicContact CG1-CD1 4.28Å; V10-L14 WeakPolarHBondContact O-CB 3.32Å; V10-L14 PolarHBondContact O-N 2.96Å; V10-F15 HydrophobicContact CG1-CD2 3.88Å; V10-F15 HydrophobicContact CG1-CE2 3.52Å |
| 11 | Y | 95.7 | Very high | 90.2 | Very high | 132 Ų | 132 | 105.9 Ų | 105.9 | 52% | 0.518 | 55% | 0.552 | S | S | . | * | I | π-helix | trans | -59.5 | -49.2 | 176.3 | 177.4 | -97.3 | 0 | 0 | 0 | 111.9 | A7 T9 L13 F15 R16 | A7-Y11 WeakPolarHBondContact O-CB 3.21Å; A7-Y11 PolarHBondContact O-N 3.01Å; T9-Y11 PolarHBondContact O-N 2.9Å; Y11-L13 VanDerWaalsContact C-N 3.3Å; Y11-L13 PolarHBondContact O-N 3.33Å; Y11-F15 HydrophobicContact CD2-CB 3.89Å; Y11-F15 HydrophobicContact CE2-CB 4.33Å; Y11-F15 CarbonylContact O-C 3.45Å; Y11-F15 PolarHBondContact O-N 3.41Å; Y11-R16 HydrophobicContact CD1-CB 4.3Å; Y11-R16 HydrophobicContact CE1-CB 3.97Å; Y11-R16 HydrophobicContact CE1-CG 4.23Å; Y11-R16 WeakPolarHBondContact O-CB 3.44Å; Y11-R16 PolarHBondContact O-N 2.83Å |
| 12 | N | 95.5 | Very high | 91.9 | Very high | 79 Ų | 79 | 101 Ų | 101 | 42% | 0.422 | 53% | 0.527 | S | S | . | . | I | π-helix | trans | -64.6 | -33.4 | -178.4 | -78.4 | -48 | 0 | 0 | 0 | 113.3 | K8 T9 V10 R16 | K8-N12 WeakPolarHBondContact O-CB 3.21Å; K8-N12 PolarHBondContact O-N 2.96Å; K8-N12 PolarHBondContact O-ND2 3.48Å; T9-N12 PolarHBondContact O-N 3.16Å; V10-N12 PolarHBondContact O-N 2.88Å; N12-R16 WeakPolarHBondContact OD1-CD 3.35Å; N12-R16 PolarHBondContact OD1-NH1 3.27Å |
| 13 | L | 95.3 | Very high | 93.5 | Very high | 120 Ų | 120 | 99 Ų | 99 | 63% | 0.628 | 52% | 0.519 | S | S | * | . | I | π-helix | trans | -81.9 | -45.3 | -178.6 | -70.4 | 173.8 | 0 | 0 | 0 | 113 | T9 V10 Y11 | T9-L13 HydrophobicContact CG2-CD1 3.75Å; T9-L13 HydrophobicContact CG2-CG 4.43Å; T9-L13 WeakPolarHBondContact O-CB 3.32Å; T9-L13 VanDerWaalsContact O-CG 3.29Å; T9-L13 WeakPolarHBondContact O-CG 3.27Å; T9-L13 PolarHBondContact O-N 3Å; V10-L13 PolarHBondContact O-N 3.35Å; Y11-L13 VanDerWaalsContact C-N 3.3Å; Y11-L13 PolarHBondContact O-N 3.33Å |
| 14 | L | 95.6 | Very high | 95 | Very high | 69 Ų | 69 | 94.1 Ų | 94.1 | 36% | 0.361 | 49% | 0.494 | S | S | . | . | I | π-helix | trans | -106.1 | -44.2 | -168 | -57.3 | -177.2 | 0 | 0 | 0 | 112.1 | V10 T20 F21 T24 | V10-L14 HydrophobicContact CG1-CD1 4.28Å; V10-L14 WeakPolarHBondContact O-CB 3.32Å; V10-L14 PolarHBondContact O-N 2.96Å; L14-T20 CarbonylContact O-C 3.24Å; L14-T20 VanDerWaalsContact O-C 3.24Å; L14-T20 PolarHBondContact O-OG1 2.75Å; L14-F21 WeakPolarHBondContact O-CA 2.9Å; L14-F21 PolarHBondContact O-N 3.34Å; L14-F21 VanDerWaalsContact O-N 3.08Å; L14-T24 HydrophobicContact CB-CG2 4.09Å; L14-T24 HydrophobicContact CD1-CG2 4.12Å |
| 15 | F | 96.4 | Very high | 95.9 | Very high | 78 Ų | 78 | 91.9 Ų | 91.9 | 34% | 0.342 | 48% | 0.484 | S | S | . | . | I | π-helix | trans | -105.7 | -9.6 | -163.9 | -56.8 | -76.4 | 0 | 0 | 0 | 115.1 | V10 Y11 F21 T24 | V10-F15 HydrophobicContact CG1-CD2 3.88Å; V10-F15 HydrophobicContact CG1-CE2 3.52Å; Y11-F15 HydrophobicContact CD2-CB 3.89Å; Y11-F15 HydrophobicContact CE2-CB 4.33Å; Y11-F15 CarbonylContact O-C 3.45Å; Y11-F15 PolarHBondContact O-N 3.41Å; F15-F21 HydrophobicContact CB-CD2 4.23Å; F15-F21 AromaticContact CD1-CD2 3.57Å; F15-F21 HydrophobicContact CD1-CD2 3.57Å; F15-F21 AromaticContact CD1-CE2 3.81Å; F15-F21 HydrophobicContact CD1-CE2 3.81Å; F15-F21 HydrophobicContact CE1-CD2 4.46Å; F15-F21 HydrophobicContact CE1-CE2 4.49Å; F15-F21 HydrophobicContact CG-CD2 4.39Å; F15-T24 HydrophobicContact CE1-CG2 4.04Å; F15-T24 HydrophobicContact CZ-CG2 4.06Å |
| 16 | R | 96.6 | Very high | 96.4 | Very high | 165 Ų | 165 | 96 Ų | 96 | 62% | 0.623 | 50% | 0.496 | S | S | * | . | S | Bend | trans | -73 | -34.7 | -176.1 | 178.5 | 173.7 | 175.5 | 174.3 | -2.1 | 114.2 | Y11 N12 | Y11-R16 HydrophobicContact CD1-CB 4.3Å; Y11-R16 HydrophobicContact CE1-CB 3.97Å; Y11-R16 HydrophobicContact CE1-CG 4.23Å; Y11-R16 WeakPolarHBondContact O-CB 3.44Å; Y11-R16 PolarHBondContact O-N 2.83Å; N12-R16 WeakPolarHBondContact OD1-CD 3.35Å; N12-R16 PolarHBondContact OD1-NH1 3.27Å |
| 17 | R | 97.1 | Very high | 96.6 | Very high | 182 Ų | 182 | 93.9 Ų | 93.9 | 69% | 0.687 | 49% | 0.488 | S | S | * | . | S | Bend | trans | -107.6 | 134.9 | 179.4 | -62.5 | -175.3 | -178.9 | -154.1 | 0.8 | 109.6 | S19 T20 F21 | R17-S19 PolarHBondContact O-N 3.39Å; R17-T20 HydrophobicContact CB-CG2 4.45Å; R17-T20 PolarHBondContact O-N 2.96Å; R17-T20 PolarHBondContact O-OG1 3.02Å; R17-F21 VanDerWaalsContact O-CB 3.24Å; R17-F21 WeakPolarHBondContact O-CB 3.48Å; R17-F21 PolarHBondContact O-N 3.19Å |
| 18 | T | 97.3 | Very high | 96.8 | Very high | 120 Ų | 120 | 92.8 Ų | 92.8 | 74% | 0.736 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -57.7 | -35.3 | -178.3 | -48.9 | 0 | 0 | 0 | 0 | 113 | F21 A22 | T18-F21 WeakPolarHBondContact O-CB 3.4Å; T18-A22 WeakPolarHBondContact O-CB 3.47Å; T18-A22 PolarHBondContact O-N 3.08Å |
| 19 | S | 97.4 | Very high | 97 | Very high | 85 Ų | 85 | 88.7 Ų | 88.7 | 59% | 0.594 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -66.6 | -47.7 | 177.2 | 53.3 | 0 | 0 | 0 | 0 | 112.8 | R17 F21 A22 V23 | R17-S19 PolarHBondContact O-N 3.39Å; S19-F21 VanDerWaalsContact C-N 3.31Å; S19-A22 PolarHBondContact O-N 3.36Å; S19-V23 WeakPolarHBondContact O-CG2 3.42Å; S19-V23 PolarHBondContact O-N 3.49Å |
| 20 | T | 97 | Very high | 97.1 | Very high | 49 Ų | 49 | 89.7 Ų | 89.7 | 30% | 0.301 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -68.9 | -34 | 177.2 | 59.5 | 0 | 0 | 0 | 0 | 111.3 | L14 R17 V23 T24 | L14-T20 CarbonylContact O-C 3.24Å; L14-T20 VanDerWaalsContact O-C 3.24Å; L14-T20 PolarHBondContact O-OG1 2.75Å; R17-T20 HydrophobicContact CB-CG2 4.45Å; R17-T20 PolarHBondContact O-N 2.96Å; R17-T20 PolarHBondContact O-OG1 3.02Å; T20-V23 PolarHBondContact O-N 2.96Å; T20-T24 WeakPolarHBondContact O-CB 3.45Å; T20-T24 PolarHBondContact O-N 2.99Å; T20-T24 PolarHBondContact O-OG1 3.39Å |
| 21 | F | 97.7 | Very high | 97.3 | Very high | 85 Ų | 85 | 92.5 Ų | 92.5 | 37% | 0.373 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.9 | -51.7 | 174.4 | 175.2 | -94.3 | 0 | 0 | 0 | 111.3 | L14 F15 R17 T18 S19 V23 T24 I25 | L14-F21 WeakPolarHBondContact O-CA 2.9Å; L14-F21 PolarHBondContact O-N 3.34Å; L14-F21 VanDerWaalsContact O-N 3.08Å; F15-F21 HydrophobicContact CB-CD2 4.23Å; F15-F21 AromaticContact CD1-CD2 3.57Å; F15-F21 HydrophobicContact CD1-CD2 3.57Å; F15-F21 AromaticContact CD1-CE2 3.81Å; F15-F21 HydrophobicContact CD1-CE2 3.81Å; F15-F21 HydrophobicContact CE1-CD2 4.46Å; F15-F21 HydrophobicContact CE1-CE2 4.49Å; F15-F21 HydrophobicContact CG-CD2 4.39Å; R17-F21 VanDerWaalsContact O-CB 3.24Å; R17-F21 WeakPolarHBondContact O-CB 3.48Å; R17-F21 PolarHBondContact O-N 3.19Å; T18-F21 WeakPolarHBondContact O-CB 3.4Å; S19-F21 VanDerWaalsContact C-N 3.31Å; F21-V23 PolarHBondContact O-N 3.47Å; F21-T24 WeakPolarHBondContact O-CB 3.48Å; F21-T24 PolarHBondContact O-N 3.11Å; F21-I25 HydrophobicContact CD1-CD1 3.97Å; F21-I25 HydrophobicContact CE1-CD1 3.31Å; F21-I25 HydrophobicContact CE1-CG1 4.45Å; F21-I25 HydrophobicContact CE2-CD1 3.97Å; F21-I25 HydrophobicContact CZ-CD1 3.3Å; F21-I25 HydrophobicContact CZ-CG1 4.4Å; F21-I25 PolarHBondContact O-N 3.22Å |
| 22 | A | 98.2 | Very high | 97.4 | Very high | 49 Ų | 49 | 92.4 Ų | 92.4 | 41% | 0.405 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.8 | -45.4 | -180 | 0 | 0 | 0 | 0 | 0 | 112 | T18 S19 T24 I25 M26 | T18-A22 WeakPolarHBondContact O-CB 3.47Å; T18-A22 PolarHBondContact O-N 3.08Å; S19-A22 PolarHBondContact O-N 3.36Å; A22-T24 VanDerWaalsContact C-N 3.34Å; A22-T24 PolarHBondContact O-N 3.5Å; A22-I25 PolarHBondContact O-N 3.41Å; A22-M26 WeakPolarHBondContact O-CG 3.42Å; A22-M26 PolarHBondContact O-N 3.37Å |
| 23 | V | 98.3 | Very high | 97.5 | Very high | 90 Ų | 90 | 94 Ų | 94 | 55% | 0.545 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62 | -43.2 | 176.4 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | S19 T20 F21 I25 M26 V27 | S19-V23 WeakPolarHBondContact O-CG2 3.42Å; S19-V23 PolarHBondContact O-N 3.49Å; T20-V23 PolarHBondContact O-N 2.96Å; F21-V23 PolarHBondContact O-N 3.47Å; V23-I25 VanDerWaalsContact C-N 3.31Å; V23-I25 PolarHBondContact O-N 3.41Å; V23-M26 PolarHBondContact O-N 2.84Å; V23-V27 HydrophobicContact CG1-CG2 4.26Å; V23-V27 WeakPolarHBondContact O-CG2 3.37Å; V23-V27 PolarHBondContact O-N 2.83Å |
| 24 | T | 98.1 | Very high | 97.6 | Very high | 34 Ų | 34 | 96.8 Ų | 96.8 | 21% | 0.209 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -58.9 | -43.7 | 177.6 | -58.9 | 0 | 0 | 0 | 0 | 111.1 | L14 F15 T20 F21 A22 G28 | L14-T24 HydrophobicContact CB-CG2 4.09Å; L14-T24 HydrophobicContact CD1-CG2 4.12Å; F15-T24 HydrophobicContact CE1-CG2 4.04Å; F15-T24 HydrophobicContact CZ-CG2 4.06Å; T20-T24 WeakPolarHBondContact O-CB 3.45Å; T20-T24 PolarHBondContact O-N 2.99Å; T20-T24 PolarHBondContact O-OG1 3.39Å; F21-T24 WeakPolarHBondContact O-CB 3.48Å; F21-T24 PolarHBondContact O-N 3.11Å; A22-T24 VanDerWaalsContact C-N 3.34Å; A22-T24 PolarHBondContact O-N 3.5Å; T24-G28 WeakPolarHBondContact O-CA 3.35Å; T24-G28 PolarHBondContact O-N 3.43Å |
| 25 | I | 97.8 | Very high | 97.7 | Very high | 87 Ų | 87 | 98.6 Ų | 98.6 | 45% | 0.446 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.4 | -46.4 | 177.4 | -70.5 | 179 | 0 | 0 | 0 | 111.2 | F21 A22 V23 V27 G28 A29 | F21-I25 HydrophobicContact CD1-CD1 3.97Å; F21-I25 HydrophobicContact CE1-CD1 3.31Å; F21-I25 HydrophobicContact CE1-CG1 4.45Å; F21-I25 HydrophobicContact CE2-CD1 3.97Å; F21-I25 HydrophobicContact CZ-CD1 3.3Å; F21-I25 HydrophobicContact CZ-CG1 4.4Å; F21-I25 PolarHBondContact O-N 3.22Å; A22-I25 PolarHBondContact O-N 3.41Å; V23-I25 VanDerWaalsContact C-N 3.31Å; V23-I25 PolarHBondContact O-N 3.41Å; I25-V27 PolarHBondContact O-N 3.26Å; I25-G28 PolarHBondContact O-N 3.28Å; I25-A29 VanDerWaalsContact O-CB 3.29Å; I25-A29 WeakPolarHBondContact O-CB 3.14Å; I25-A29 PolarHBondContact O-N 2.77Å |
| 26 | M | 98.3 | Very high | 97.8 | Very high | 137 Ų | 137 | 100.8 Ų | 100.8 | 68% | 0.675 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.2 | -47.1 | -178.5 | -66.6 | -137.9 | -59.4 | 0 | 0 | 111.9 | A22 V23 A29 V30 | A22-M26 WeakPolarHBondContact O-CG 3.42Å; A22-M26 PolarHBondContact O-N 3.37Å; V23-M26 PolarHBondContact O-N 2.84Å; M26-A29 PolarHBondContact O-N 3.27Å; M26-V30 WeakPolarHBondContact O-CG2 3.31Å; M26-V30 PolarHBondContact O-N 2.91Å |
| 27 | V | 98.2 | Very high | 97.8 | Very high | 81 Ų | 81 | 96.9 Ų | 96.9 | 49% | 0.491 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.9 | -44.1 | 176.9 | 174.4 | 0 | 0 | 0 | 0 | 110.6 | V23 I25 A29 V30 L31 | V23-V27 HydrophobicContact CG1-CG2 4.26Å; V23-V27 WeakPolarHBondContact O-CG2 3.37Å; V23-V27 PolarHBondContact O-N 2.83Å; I25-V27 PolarHBondContact O-N 3.26Å; V27-A29 VanDerWaalsContact C-N 3.31Å; V27-A29 PolarHBondContact O-N 2.87Å; V27-V30 PolarHBondContact O-N 3.33Å; V27-L31 HydrophobicContact CG1-CD1 4.03Å; V27-L31 WeakPolarHBondContact O-CG 3.34Å; V27-L31 PolarHBondContact O-N 3.23Å; V27-L31 VanDerWaalsContact O-N 3.11Å |
| 28 | G | 98.1 | Very high | 97.9 | Very high | 36 Ų | 36 | 93.9 Ų | 93.9 | 37% | 0.371 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.7 | -42.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | T24 I25 L31 F32 | T24-G28 WeakPolarHBondContact O-CA 3.35Å; T24-G28 PolarHBondContact O-N 3.43Å; I25-G28 PolarHBondContact O-N 3.28Å; G28-L31 PolarHBondContact O-N 2.78Å; G28-F32 WeakPolarHBondContact O-CB 3.29Å; G28-F32 PolarHBondContact O-N 3.38Å |
| 29 | A | 98.3 | Very high | 97.9 | Very high | 53 Ų | 53 | 89.7 Ų | 89.7 | 44% | 0.438 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64 | -47.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | I25 M26 V27 L31 F32 E33 | I25-A29 VanDerWaalsContact O-CB 3.29Å; I25-A29 WeakPolarHBondContact O-CB 3.14Å; I25-A29 PolarHBondContact O-N 2.77Å; M26-A29 PolarHBondContact O-N 3.27Å; V27-A29 VanDerWaalsContact C-N 3.31Å; V27-A29 PolarHBondContact O-N 2.87Å; A29-L31 VanDerWaalsContact C-N 3.34Å; A29-L31 PolarHBondContact O-N 2.98Å; A29-F32 PolarHBondContact O-N 3.3Å; A29-E33 WeakPolarHBondContact O-CB 3.48Å; A29-E33 PolarHBondContact O-N 3.43Å |
| 30 | V | 98 | Very high | 98 | Very high | 97 Ų | 97 | 87.2 Ų | 87.2 | 59% | 0.588 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63.2 | -40.3 | 179.5 | 173.5 | 0 | 0 | 0 | 0 | 111.7 | M26 V27 | M26-V30 WeakPolarHBondContact O-CG2 3.31Å; M26-V30 PolarHBondContact O-N 2.91Å; V27-V30 PolarHBondContact O-N 3.33Å |
| 31 | L | 98.3 | Very high | 98 | Very high | 115 Ų | 115 | 89.4 Ų | 89.4 | 60% | 0.602 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -70.1 | -41.7 | 176.3 | -67.5 | 177.4 | 0 | 0 | 0 | 111.7 | V27 G28 A29 V35 | V27-L31 HydrophobicContact CG1-CD1 4.03Å; V27-L31 WeakPolarHBondContact O-CG 3.34Å; V27-L31 PolarHBondContact O-N 3.23Å; V27-L31 VanDerWaalsContact O-N 3.11Å; G28-L31 PolarHBondContact O-N 2.78Å; A29-L31 VanDerWaalsContact C-N 3.34Å; A29-L31 PolarHBondContact O-N 2.98Å; L31-V35 WeakPolarHBondContact O-CG2 3.49Å; L31-V35 PolarHBondContact O-N 3.46Å |
| 32 | F | 97.9 | Very high | 98 | Very high | 129 Ų | 129 | 88 Ų | 88 | 57% | 0.566 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.1 | -47.5 | 178.5 | 178.4 | -93.7 | 0 | 0 | 0 | 111.3 | G28 A29 R34 V35 F36 | G28-F32 WeakPolarHBondContact O-CB 3.29Å; G28-F32 PolarHBondContact O-N 3.38Å; A29-F32 PolarHBondContact O-N 3.3Å; F32-R34 PolarHBondContact O-N 3.49Å; F32-V35 PolarHBondContact O-N 2.92Å; F32-F36 HydrophobicContact CD1-CB 4.16Å; F32-F36 HydrophobicContact CE1-CB 3.81Å; F32-F36 HydrophobicContact CE1-CD1 4.49Å; F32-F36 AromaticContact CE1-CD2 3.96Å; F32-F36 HydrophobicContact CE1-CD2 3.96Å; F32-F36 AromaticContact CE1-CG 3.83Å; F32-F36 HydrophobicContact CE1-CG 3.83Å; F32-F36 HydrophobicContact CE2-CB 4.43Å; F32-F36 HydrophobicContact CE2-CD2 4.11Å; F32-F36 HydrophobicContact CZ-CB 3.97Å; F32-F36 AromaticContact CZ-CD2 3.43Å; F32-F36 HydrophobicContact CZ-CD2 3.43Å; F32-F36 VanDerWaalsContact CZ-CD2 3.43Å; F32-F36 HydrophobicContact CZ-CE2 4.11Å; F32-F36 AromaticContact CZ-CG 3.8Å; F32-F36 HydrophobicContact CZ-CG 3.8Å; F32-F36 WeakPolarHBondContact O-CB 3.33Å; F32-F36 PolarHBondContact O-N 3.5Å |
| 33 | E | 97.7 | Very high | 98 | Very high | 114 Ų | 114 | 90.6 Ų | 90.6 | 53% | 0.533 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -49.1 | -55.5 | 177.5 | 179.3 | -179.2 | -169.6 | 0 | 0 | 111 | A29 V35 F36 D37 | A29-E33 WeakPolarHBondContact O-CB 3.48Å; A29-E33 PolarHBondContact O-N 3.43Å; E33-V35 PolarHBondContact O-N 2.97Å; E33-F36 PolarHBondContact O-N 3.45Å; E33-D37 WeakPolarHBondContact O-CB 3.31Å; E33-D37 VanDerWaalsContact O-CG 3.23Å; E33-D37 PolarHBondContact O-N 3.46Å |
| 34 | R | 97.8 | Very high | 98 | Very high | 178 Ų | 178 | 91.3 Ų | 91.3 | 67% | 0.672 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.7 | -39 | -176.7 | -168.6 | 169.7 | -175.3 | 94.5 | -1.1 | 113.5 | F32 Q38 | F32-R34 PolarHBondContact O-N 3.49Å; R34-Q38 VanDerWaalsContact O-CG 3.32Å; R34-Q38 WeakPolarHBondContact O-CG 3.38Å; R34-Q38 PolarHBondContact O-N 3.4Å |
| 35 | V | 98.1 | Very high | 98 | Very high | 107 Ų | 107 | 93.1 Ų | 93.1 | 65% | 0.648 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -72.7 | -42.4 | 179 | 173.2 | 0 | 0 | 0 | 0 | 110.6 | L31 F32 E33 G39 | L31-V35 WeakPolarHBondContact O-CG2 3.49Å; L31-V35 PolarHBondContact O-N 3.46Å; F32-V35 PolarHBondContact O-N 2.92Å; E33-V35 PolarHBondContact O-N 2.97Å; V35-G39 PolarHBondContact O-N 3.24Å |
| 36 | F | 97.6 | Very high | 98 | Very high | 124 Ų | 124 | 96.2 Ų | 96.2 | 54% | 0.544 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.7 | -43.5 | -177.9 | -170.8 | -94.1 | 0 | 0 | 0 | 111.3 | F32 E33 G39 G40 | F32-F36 HydrophobicContact CD1-CB 4.16Å; F32-F36 HydrophobicContact CE1-CB 3.81Å; F32-F36 HydrophobicContact CE1-CD1 4.49Å; F32-F36 AromaticContact CE1-CD2 3.96Å; F32-F36 HydrophobicContact CE1-CD2 3.96Å; F32-F36 AromaticContact CE1-CG 3.83Å; F32-F36 HydrophobicContact CE1-CG 3.83Å; F32-F36 HydrophobicContact CE2-CB 4.43Å; F32-F36 HydrophobicContact CE2-CD2 4.11Å; F32-F36 HydrophobicContact CZ-CB 3.97Å; F32-F36 AromaticContact CZ-CD2 3.43Å; F32-F36 HydrophobicContact CZ-CD2 3.43Å; F32-F36 VanDerWaalsContact CZ-CD2 3.43Å; F32-F36 HydrophobicContact CZ-CE2 4.11Å; F32-F36 AromaticContact CZ-CG 3.8Å; F32-F36 HydrophobicContact CZ-CG 3.8Å; F32-F36 WeakPolarHBondContact O-CB 3.33Å; F32-F36 PolarHBondContact O-N 3.5Å; E33-F36 PolarHBondContact O-N 3.45Å; F36-G39 PolarHBondContact O-N 3.4Å; F36-G40 WeakPolarHBondContact O-CA 3.47Å; F36-G40 PolarHBondContact O-N 2.99Å |
| 37 | D | 97.9 | Very high | 98 | Very high | 83 Ų | 83 | 96.6 Ų | 96.6 | 44% | 0.444 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.9 | -51.3 | 177 | -71 | -16 | 0 | 0 | 0 | 111 | E33 G39 G40 D41 | E33-D37 WeakPolarHBondContact O-CB 3.31Å; E33-D37 VanDerWaalsContact O-CG 3.23Å; E33-D37 PolarHBondContact O-N 3.46Å; D37-G39 PolarHBondContact O-N 2.97Å; D37-G40 PolarHBondContact O-N 3.49Å; D37-D41 WeakPolarHBondContact O-CB 3.48Å; D37-D41 PolarHBondContact O-N 3.27Å |
| 38 | Q | 97.8 | Very high | 97.9 | Very high | 118 Ų | 118 | 94.8 Ų | 94.8 | 55% | 0.551 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.6 | -40.7 | 179.4 | -70.6 | -178.3 | 22.8 | 0 | 0 | 112.5 | R34 A42 | R34-Q38 VanDerWaalsContact O-CG 3.32Å; R34-Q38 WeakPolarHBondContact O-CG 3.38Å; R34-Q38 PolarHBondContact O-N 3.4Å; Q38-A42 VanDerWaalsContact O-CB 3.27Å; Q38-A42 WeakPolarHBondContact O-CB 3.45Å; Q38-A42 PolarHBondContact O-N 2.99Å |
| 39 | G | 98.1 | Very high | 97.9 | Very high | 32 Ų | 32 | 103 Ų | 103 | 33% | 0.33 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67 | -43.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | V35 F36 D37 A42 I43 | V35-G39 PolarHBondContact O-N 3.24Å; F36-G39 PolarHBondContact O-N 3.4Å; D37-G39 PolarHBondContact O-N 2.97Å; G39-A42 PolarHBondContact O-N 3.47Å; G39-I43 VanDerWaalsContact O-CG1 3.29Å; G39-I43 WeakPolarHBondContact O-CG1 3.11Å; G39-I43 PolarHBondContact O-N 3.29Å |
| 40 | G | 98.2 | Very high | 97.7 | Very high | 34 Ų | 34 | 102.8 Ų | 102.8 | 35% | 0.351 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.7 | -47.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | F36 D37 I43 F44 | F36-G40 WeakPolarHBondContact O-CA 3.47Å; F36-G40 PolarHBondContact O-N 2.99Å; D37-G40 PolarHBondContact O-N 3.49Å; G40-I43 PolarHBondContact O-N 2.9Å; G40-F44 WeakPolarHBondContact O-CB 3.47Å; G40-F44 PolarHBondContact O-N 3.32Å |
| 41 | D | 97.9 | Very high | 97.6 | Very high | 95 Ų | 95 | 105.9 Ų | 105.9 | 51% | 0.508 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -56.3 | -53.4 | 173.4 | -80.4 | -19.1 | 0 | 0 | 0 | 110 | D37 I43 F44 E45 | D37-D41 WeakPolarHBondContact O-CB 3.48Å; D37-D41 PolarHBondContact O-N 3.27Å; D41-I43 VanDerWaalsContact C-N 3.34Å; D41-I43 PolarHBondContact O-N 2.8Å; D41-F44 CarbonylContact O-C 3.53Å; D41-F44 WeakPolarHBondContact O-CA 3.29Å; D41-F44 WeakPolarHBondContact O-CB 3.33Å; D41-F44 PolarHBondContact O-N 2.84Å; D41-E45 WeakPolarHBondContact O-CG 3.47Å; D41-E45 PolarHBondContact O-N 3.08Å |
| 42 | A | 97.7 | Very high | 97.6 | Very high | 54 Ų | 54 | 102.2 Ų | 102.2 | 45% | 0.446 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -54.7 | -46.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q38 G39 F44 E45 Q46 | Q38-A42 VanDerWaalsContact O-CB 3.27Å; Q38-A42 WeakPolarHBondContact O-CB 3.45Å; Q38-A42 PolarHBondContact O-N 2.99Å; G39-A42 PolarHBondContact O-N 3.47Å; A42-F44 VanDerWaalsContact C-N 3.35Å; A42-E45 PolarHBondContact O-N 3.23Å; A42-Q46 VanDerWaalsContact O-CB 3.31Å; A42-Q46 WeakPolarHBondContact O-CB 3.45Å; A42-Q46 PolarHBondContact O-N 3.19Å |
| 43 | I | 98.4 | Very high | 97.5 | Very high | 105 Ų | 105 | 102.4 Ų | 102.4 | 54% | 0.538 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.7 | -47.3 | 176.1 | -69.8 | 166.7 | 0 | 0 | 0 | 110 | G39 G40 D41 Q46 M47 | G39-I43 VanDerWaalsContact O-CG1 3.29Å; G39-I43 WeakPolarHBondContact O-CG1 3.11Å; G39-I43 PolarHBondContact O-N 3.29Å; G40-I43 PolarHBondContact O-N 2.9Å; D41-I43 VanDerWaalsContact C-N 3.34Å; D41-I43 PolarHBondContact O-N 2.8Å; I43-Q46 PolarHBondContact O-N 3.36Å; I43-M47 HydrophobicContact CG2-SD 3.99Å; I43-M47 WeakPolarHBondContact O-CB 3.45Å; I43-M47 VanDerWaalsContact O-CG 3.31Å; I43-M47 WeakPolarHBondContact O-CG 3.44Å; I43-M47 PolarHBondContact O-N 2.9Å |
| 44 | F | 97.9 | Very high | 97.3 | Very high | 104 Ų | 104 | 101.2 Ų | 101.2 | 46% | 0.456 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.3 | -41.4 | -179.9 | 178.5 | -104 | 0 | 0 | 0 | 112.6 | G40 D41 A42 M47 N48 L52 | G40-F44 WeakPolarHBondContact O-CB 3.47Å; G40-F44 PolarHBondContact O-N 3.32Å; D41-F44 CarbonylContact O-C 3.53Å; D41-F44 WeakPolarHBondContact O-CA 3.29Å; D41-F44 WeakPolarHBondContact O-CB 3.33Å; D41-F44 PolarHBondContact O-N 2.84Å; A42-F44 VanDerWaalsContact C-N 3.35Å; F44-M47 PolarHBondContact O-N 2.97Å; F44-N48 WeakPolarHBondContact CD2-ND2 3.24Å; F44-N48 VanDerWaalsContact CE2-ND2 3.33Å; F44-N48 WeakPolarHBondContact CE2-ND2 3.34Å; F44-N48 WeakPolarHBondContact O-CB 3.41Å; F44-N48 PolarHBondContact O-N 3.48Å; F44-N48 VanDerWaalsContact O-N 3.08Å; F44-N48 PolarHBondContact O-ND2 2.97Å; F44-L52 HydrophobicContact CD1-CD1 4.45Å; F44-L52 HydrophobicContact CD1-CD2 4.45Å; F44-L52 HydrophobicContact CE1-CD1 4.27Å; F44-L52 HydrophobicContact CE1-CD2 3.59Å; F44-L52 HydrophobicContact CZ-CD2 4.23Å |
| 45 | E | 97.8 | Very high | 97.2 | Very high | 72 Ų | 72 | 95.1 Ų | 95.1 | 34% | 0.336 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.2 | -45.2 | 176.4 | -33.5 | -151.4 | 143.5 | 0 | 0 | 110.9 | D41 A42 M47 N48 R49 L52 K54 | D41-E45 WeakPolarHBondContact O-CG 3.47Å; D41-E45 PolarHBondContact O-N 3.08Å; A42-E45 PolarHBondContact O-N 3.23Å; E45-M47 PolarHBondContact O-N 2.71Å; E45-N48 CarbonylContact O-C 3.27Å; E45-N48 VanDerWaalsContact O-C 3.27Å; E45-N48 PolarHBondContact O-N 3.26Å; E45-R49 WeakPolarHBondContact O-CA 3.46Å; E45-R49 PolarHBondContact O-N 3.19Å; E45-L52 HydrophobicContact CB-CD1 4.41Å; E45-K54 WeakPolarHBondContact OE1-CE 3.29Å; E45-K54 IonicContact OE1-NZ 2.61Å; E45-K54 PolarHBondContact OE1-NZ 2.99Å; E45-K54 WeakPolarHBondContact OE2-CE 3.43Å; E45-K54 IonicContact OE2-NZ 3.45Å; E45-K54 PolarHBondContact OE2-NZ 2.87Å |
| 46 | Q | 97.4 | Very high | 97.1 | Very high | 153 Ų | 153 | 92.5 Ų | 92.5 | 72% | 0.715 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -62.9 | -43.2 | -179.7 | -177.4 | 175.3 | -8.1 | 0 | 0 | 111.2 | A42 I43 N48 R49 | A42-Q46 VanDerWaalsContact O-CB 3.31Å; A42-Q46 WeakPolarHBondContact O-CB 3.45Å; A42-Q46 PolarHBondContact O-N 3.19Å; I43-Q46 PolarHBondContact O-N 3.36Å; Q46-N48 VanDerWaalsContact C-N 3.27Å; Q46-N48 PolarHBondContact O-N 3.38Å; Q46-R49 PolarHBondContact O-N 2.98Å |
| 47 | M | 98.1 | Very high | 96.9 | Very high | 144 Ų | 144 | 90.1 Ų | 90.1 | 71% | 0.709 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -65.5 | -30.6 | 176.7 | -73.2 | -179.7 | 64.6 | 0 | 0 | 112.9 | I43 F44 E45 | I43-M47 HydrophobicContact CG2-SD 3.99Å; I43-M47 WeakPolarHBondContact O-CB 3.45Å; I43-M47 VanDerWaalsContact O-CG 3.31Å; I43-M47 WeakPolarHBondContact O-CG 3.44Å; I43-M47 PolarHBondContact O-N 2.9Å; F44-M47 PolarHBondContact O-N 2.97Å; E45-M47 PolarHBondContact O-N 2.71Å |
| 48 | N | 98 | Very high | 96.6 | Very high | 43 Ų | 43 | 92.6 Ų | 92.6 | 23% | 0.23 | 46% | 0.462 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110.2 | 29.3 | -177.7 | -65.8 | -77.9 | 0 | 0 | 0 | 112.8 | F44 E45 Q46 G50 K51 L52 H55 | F44-N48 WeakPolarHBondContact CD2-ND2 3.24Å; F44-N48 VanDerWaalsContact CE2-ND2 3.33Å; F44-N48 WeakPolarHBondContact CE2-ND2 3.34Å; F44-N48 WeakPolarHBondContact O-CB 3.41Å; F44-N48 PolarHBondContact O-N 3.48Å; F44-N48 VanDerWaalsContact O-N 3.08Å; F44-N48 PolarHBondContact O-ND2 2.97Å; E45-N48 CarbonylContact O-C 3.27Å; E45-N48 VanDerWaalsContact O-C 3.27Å; E45-N48 PolarHBondContact O-N 3.26Å; Q46-N48 VanDerWaalsContact C-N 3.27Å; Q46-N48 PolarHBondContact O-N 3.38Å; N48-G50 PolarHBondContact O-N 3.44Å; N48-K51 PolarHBondContact O-N 2.8Å; N48-L52 HydrophobicContact CB-CD1 3.46Å; N48-L52 VanDerWaalsContact CB-CD1 3.46Å; N48-L52 HydrophobicContact CB-CG 3.91Å; N48-L52 PolarHBondContact O-N 2.91Å; N48-H55 PolarHBondContact O-ND1 2.94Å |
| 49 | R | 96.3 | Very high | 96.3 | Very high | 210 Ų | 210 | 91.7 Ų | 91.7 | 79% | 0.792 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.2 | 132.8 | -179.8 | -163.2 | 177.4 | -175.4 | -150.2 | 0.4 | 110.8 | E45 Q46 K51 | E45-R49 WeakPolarHBondContact O-CA 3.46Å; E45-R49 PolarHBondContact O-N 3.19Å; Q46-R49 PolarHBondContact O-N 2.98Å; R49-K51 PolarHBondContact O-N 3Å |
| 50 | G | 94.9 | Very high | 96 | Very high | 48 Ų | 48 | 97.7 Ų | 97.7 | 50% | 0.495 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 76.3 | -9.3 | -176.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | N48 H55 | N48-G50 PolarHBondContact O-N 3.44Å; G50-H55 PolarHBondContact N-ND1 3.32Å |
| 51 | K | 96.4 | Very high | 95.6 | Very high | 162 Ų | 162 | 101 Ų | 101 | 70% | 0.704 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.8 | -33 | 179.2 | -58.7 | -179.1 | -176.8 | 175.8 | 0 | 113.6 | N48 R49 | N48-K51 PolarHBondContact O-N 2.8Å; R49-K51 PolarHBondContact O-N 3Å |
| 52 | L | 97.3 | Very high | 94.5 | Very high | 37 Ų | 37 | 104 Ų | 104 | 19% | 0.194 | 50% | 0.497 | C | S | . | . | S | Bend | trans | -71.5 | 143.2 | -178 | -69.9 | 145.5 | 0 | 0 | 0 | 111.4 | F44 E45 N48 K54 H55 | F44-L52 HydrophobicContact CD1-CD1 4.45Å; F44-L52 HydrophobicContact CD1-CD2 4.45Å; F44-L52 HydrophobicContact CE1-CD1 4.27Å; F44-L52 HydrophobicContact CE1-CD2 3.59Å; F44-L52 HydrophobicContact CZ-CD2 4.23Å; E45-L52 HydrophobicContact CB-CD1 4.41Å; N48-L52 HydrophobicContact CB-CD1 3.46Å; N48-L52 VanDerWaalsContact CB-CD1 3.46Å; N48-L52 HydrophobicContact CB-CG 3.91Å; N48-L52 PolarHBondContact O-N 2.91Å; L52-K54 HydrophobicContact CB-CD 4.44Å; L52-K54 HydrophobicContact CB-CG 3.96Å; L52-K54 PolarHBondContact O-N 2.92Å; L52-H55 WeakPolarHBondContact O-CB 3.38Å; L52-H55 PolarHBondContact O-N 3.24Å |
| 53 | W | 95.8 | Very high | 93.1 | Very high | 134 Ų | 134 | 111 Ų | 111 | 51% | 0.508 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -49.9 | -45.7 | 177.5 | 176.2 | -117.2 | 0 | 0 | 0 | 112 | H55 I56 K57 Y60 | W53-H55 PolarHBondContact O-N 3.5Å; W53-I56 HydrophobicContact CE3-CD1 3.99Å; W53-I56 HydrophobicContact CE3-CG1 3.84Å; W53-I56 HydrophobicContact CZ3-CD1 4.36Å; W53-I56 HydrophobicContact CZ3-CG1 4.32Å; W53-I56 CarbonylContact O-C 3.56Å; W53-I56 WeakPolarHBondContact O-CG1 3.42Å; W53-I56 PolarHBondContact O-N 2.89Å; W53-K57 HydrophobicContact CD2-CB 4.19Å; W53-K57 HydrophobicContact CG-CB 4.49Å; W53-K57 HydrophobicContact CZ2-CB 4.12Å; W53-K57 HydrophobicContact CZ2-CG 3.77Å; W53-K57 VanDerWaalsContact O-CB 3.29Å; W53-K57 WeakPolarHBondContact O-CB 3.42Å; W53-K57 PolarHBondContact O-N 2.78Å; W53-Y60 AromaticContact CH2-CD2 3.73Å; W53-Y60 HydrophobicContact CH2-CD2 3.73Å; W53-Y60 HydrophobicContact CH2-CG 4.02Å; W53-Y60 AromaticContact CZ3-CD2 3.57Å; W53-Y60 HydrophobicContact CZ3-CD2 3.57Å; W53-Y60 HydrophobicContact CZ3-CE2 4.13Å; W53-Y60 HydrophobicContact CZ3-CG 4.24Å |
| 54 | K | 94.5 | Very high | 91.2 | Very high | 89 Ų | 89 | 118.6 Ų | 118.6 | 39% | 0.387 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -52.5 | -27.1 | 176.8 | 71.9 | -170.5 | 174.3 | -147.8 | 0 | 114.8 | E45 L52 | E45-K54 WeakPolarHBondContact OE1-CE 3.29Å; E45-K54 IonicContact OE1-NZ 2.61Å; E45-K54 PolarHBondContact OE1-NZ 2.99Å; E45-K54 WeakPolarHBondContact OE2-CE 3.43Å; E45-K54 IonicContact OE2-NZ 3.45Å; E45-K54 PolarHBondContact OE2-NZ 2.87Å; L52-K54 HydrophobicContact CB-CD 4.44Å; L52-K54 HydrophobicContact CB-CG 3.96Å; L52-K54 PolarHBondContact O-N 2.92Å |
| 55 | H | 95.4 | Very high | 90.8 | Very high | 49 Ų | 49 | 119.4 Ų | 119.4 | 23% | 0.227 | 56% | 0.558 | C | S | . | * | H | α-helix | trans | -82.2 | -30.2 | 177.5 | -57.3 | 147 | 0 | 0 | 0 | 112.6 | N48 G50 L52 W53 H58 | N48-H55 PolarHBondContact O-ND1 2.94Å; G50-H55 PolarHBondContact N-ND1 3.32Å; L52-H55 WeakPolarHBondContact O-CB 3.38Å; L52-H55 PolarHBondContact O-N 3.24Å; W53-H55 PolarHBondContact O-N 3.5Å; H55-H58 PolarHBondContact O-CE1 2.97Å; H55-H58 PolarHBondContact O-ND1 2.99Å |
| 56 | I | 94.9 | Very high | 90.5 | Very high | 52 Ų | 52 | 121.8 Ų | 121.8 | 27% | 0.267 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -108 | -9.9 | -173.5 | 62.6 | 169.4 | 0 | 0 | 0 | 113.5 | W53 H58 N59 Y60 | W53-I56 HydrophobicContact CE3-CD1 3.99Å; W53-I56 HydrophobicContact CE3-CG1 3.84Å; W53-I56 HydrophobicContact CZ3-CD1 4.36Å; W53-I56 HydrophobicContact CZ3-CG1 4.32Å; W53-I56 CarbonylContact O-C 3.56Å; W53-I56 WeakPolarHBondContact O-CG1 3.42Å; W53-I56 PolarHBondContact O-N 2.89Å; I56-H58 PolarHBondContact O-N 3.05Å; I56-N59 VanDerWaalsContact O-CB 3.3Å; I56-N59 WeakPolarHBondContact O-CB 3.32Å; I56-N59 PolarHBondContact O-N 3.37Å; I56-N59 PolarHBondContact O-ND2 2.99Å; I56-N59 VanDerWaalsContact O-ND2 3.16Å; I56-Y60 HydrophobicContact CB-CE2 4.33Å; I56-Y60 HydrophobicContact CD1-CE2 4.21Å; I56-Y60 HydrophobicContact CG1-CE2 4.39Å; I56-Y60 VanDerWaalsContact O-CD2 3.27Å; I56-Y60 WeakPolarHBondContact O-CD2 3.33Å |
| 57 | K | 94.1 | Very high | 90.1 | Very high | 74 Ų | 74 | 120.1 Ų | 120.1 | 32% | 0.322 | 56% | 0.562 | S | S | . | * | G | 310 helix | trans | -52.7 | -38.9 | -176.9 | -175.4 | 176.6 | -158.7 | -105 | 0 | 112.7 | W53 N59 Y60 E61 | W53-K57 HydrophobicContact CD2-CB 4.19Å; W53-K57 HydrophobicContact CG-CB 4.49Å; W53-K57 HydrophobicContact CZ2-CB 4.12Å; W53-K57 HydrophobicContact CZ2-CG 3.77Å; W53-K57 VanDerWaalsContact O-CB 3.29Å; W53-K57 WeakPolarHBondContact O-CB 3.42Å; W53-K57 PolarHBondContact O-N 2.78Å; K57-N59 PolarHBondContact O-N 3.2Å; K57-Y60 PolarHBondContact O-N 3.49Å; K57-E61 WeakPolarHBondContact CD-OE2 3.29Å; K57-E61 WeakPolarHBondContact CE-OE1 3.36Å; K57-E61 VanDerWaalsContact CE-OE2 3.23Å; K57-E61 WeakPolarHBondContact CE-OE2 3.26Å; K57-E61 HydrophobicContact CG-CG 4Å; K57-E61 WeakPolarHBondContact CG-OE2 3.33Å; K57-E61 IonicContact NZ-OE1 2.66Å; K57-E61 PolarHBondContact NZ-OE1 2.93Å; K57-E61 IonicContact NZ-OE2 2.66Å; K57-E61 PolarHBondContact NZ-OE2 3.46Å; K57-E61 PolarHBondContact O-N 3.47Å; K57-E61 VanDerWaalsContact O-N 3.11Å |
| 58 | H | 91.9 | Very high | 89.6 | Confident | 135 Ų | 135 | 118.7 Ų | 118.7 | 63% | 0.625 | 55% | 0.553 | S | S | * | * | G | 310 helix | trans | -59.6 | -17.5 | 177.2 | 70.6 | -86.6 | 0 | 0 | 0 | 114.4 | H55 I56 Y60 | H55-H58 PolarHBondContact O-CE1 2.97Å; H55-H58 PolarHBondContact O-ND1 2.99Å; I56-H58 PolarHBondContact O-N 3.05Å; H58-Y60 VanDerWaalsContact C-N 3.32Å |
| 59 | N | 91.8 | Very high | 89.1 | Confident | 100 Ų | 100 | 123.4 Ų | 123.4 | 54% | 0.535 | 57% | 0.574 | S | S | . | * | G | 310 helix | trans | -82.1 | -11.3 | 175.3 | -60.1 | -52.8 | 0 | 0 | 0 | 113.2 | I56 K57 | I56-N59 VanDerWaalsContact O-CB 3.3Å; I56-N59 WeakPolarHBondContact O-CB 3.32Å; I56-N59 PolarHBondContact O-N 3.37Å; I56-N59 PolarHBondContact O-ND2 2.99Å; I56-N59 VanDerWaalsContact O-ND2 3.16Å; K57-N59 PolarHBondContact O-N 3.2Å |
| 60 | Y | 90.9 | Very high | 88.6 | Confident | 157 Ų | 157 | 117.7 Ų | 117.7 | 62% | 0.616 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.5 | -12.8 | -166.9 | -57.8 | -72 | 0 | 0 | 0 | 114.1 | W53 I56 K57 H58 | W53-Y60 AromaticContact CH2-CD2 3.73Å; W53-Y60 HydrophobicContact CH2-CD2 3.73Å; W53-Y60 HydrophobicContact CH2-CG 4.02Å; W53-Y60 AromaticContact CZ3-CD2 3.57Å; W53-Y60 HydrophobicContact CZ3-CD2 3.57Å; W53-Y60 HydrophobicContact CZ3-CE2 4.13Å; W53-Y60 HydrophobicContact CZ3-CG 4.24Å; I56-Y60 HydrophobicContact CB-CE2 4.33Å; I56-Y60 HydrophobicContact CD1-CE2 4.21Å; I56-Y60 HydrophobicContact CG1-CE2 4.39Å; I56-Y60 VanDerWaalsContact O-CD2 3.27Å; I56-Y60 WeakPolarHBondContact O-CD2 3.33Å; K57-Y60 PolarHBondContact O-N 3.49Å; H58-Y60 VanDerWaalsContact C-N 3.32Å |
| 61 | E | 90.4 | Very high | 88.1 | Confident | 105 Ų | 105 | 122.6 Ų | 122.6 | 49% | 0.491 | 56% | 0.564 | S | S | . | * | trans | -95.2 | 123 | 171.1 | -70 | -173.3 | 155.9 | 0 | 0 | 109.3 | K57 | K57-E61 WeakPolarHBondContact CD-OE2 3.29Å; K57-E61 WeakPolarHBondContact CE-OE1 3.36Å; K57-E61 VanDerWaalsContact CE-OE2 3.23Å; K57-E61 WeakPolarHBondContact CE-OE2 3.26Å; K57-E61 HydrophobicContact CG-CG 4Å; K57-E61 WeakPolarHBondContact CG-OE2 3.33Å; K57-E61 IonicContact NZ-OE1 2.66Å; K57-E61 PolarHBondContact NZ-OE1 2.93Å; K57-E61 IonicContact NZ-OE2 2.66Å; K57-E61 PolarHBondContact NZ-OE2 3.46Å; K57-E61 PolarHBondContact O-N 3.47Å; K57-E61 VanDerWaalsContact O-N 3.11Å | ||
| 62 | N | 75.4 | Confident | 87.5 | Confident | 156 Ų | 156 | 119.6 Ų | 119.6 | 83% | 0.834 | 55% | 0.553 | S | S | * | * | trans | -75.4 | 137.5 | 167.8 | -68.2 | -41.2 | 0 | 0 | 0 | 108.2 | E64 | N62-E64 PolarHBondContact O-N 3.48Å; N62-E64 VanDerWaalsContact O-N 3.09Å | ||
| 63 | E | 66.4 | Low | 86.7 | Confident | 203 Ų | 203 | 126.5 Ų | 126.5 | 95% | 0.949 | 58% | 0.583 | S | S | * | * | trans | -65.6 | 104.5 | 165.2 | -67.1 | 178.7 | 170.9 | 0 | 0 | 107.4 | ||||
| 64 | E | 58.8 | Low | 85.9 | Confident | 264 Ų | 264 | 125.8 Ų | 125.8 | 100% | 1.234 | 59% | 0.59 | S | S | * | * | trans | -75.1 | 0 | 157.9 | -80.8 | -168.3 | 163.2 | 0 | 0 | 110.2 | N62 | N62-E64 PolarHBondContact O-N 3.48Å; N62-E64 VanDerWaalsContact O-N 3.09Å |
Retrieved 64 of 64 residues in 179.5 ms
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