| 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 | D | 47.8 | Very low | 77.5 | Confident | 200 Ų | 200 | 97.5 Ų | 97.5 | 100% | 1.07 | 52% | 0.515 | S | S | * | . | 0 | 113.6 | 0 | -60.5 | -87.2 | 0 | 0 | 0 | 109.4 | Q3 | D1-Q3 PolarHBondContact O-N 3.43Å; D1-Q3 VanDerWaalsContact O-N 3.16Å | |||
| 2 | M | 56.5 | Low | 78.1 | Confident | 173 Ų | 173 | 93.8 Ų | 93.8 | 85% | 0.852 | 51% | 0.508 | S | S | * | . | trans | -74.6 | 98.2 | 169.4 | -83.9 | 172.3 | 62.7 | 0 | 0 | 107.1 | D4 | M2-D4 PolarHBondContact O-N 3.37Š| ||
| 3 | Q | 61.4 | Low | 78.5 | Confident | 128 Ų | 128 | 89.5 Ų | 89.5 | 60% | 0.598 | 49% | 0.493 | S | S | * | . | trans | -71.9 | 108.4 | 168.8 | -69.3 | -168.3 | 15.7 | 0 | 0 | 107.7 | D1 Y5 | D1-Q3 PolarHBondContact O-N 3.43Å; D1-Q3 VanDerWaalsContact O-N 3.16Å; Q3-Y5 HydrophobicContact CB-CD2 4.24Å; Q3-Y5 HydrophobicContact CB-CE1 4.05Å; Q3-Y5 HydrophobicContact CB-CE2 3.6Å; Q3-Y5 WeakPolarHBondContact O-CD2 3.28Å; Q3-Y5 WeakPolarHBondContact O-CE2 3.33Å; Q3-Y5 PolarHBondContact O-N 3.07Å; Q3-Y5 VanDerWaalsContact OE1-CZ 3.28Å; Q3-Y5 PolarHBondContact OE1-OH 2.79Å | ||
| 4 | D | 79.4 | Confident | 78.9 | Confident | 115 Ų | 115 | 86.4 Ų | 86.4 | 62% | 0.615 | 48% | 0.475 | S | S | * | . | trans | -70.5 | 93 | 173.3 | -77.1 | -68.1 | 0 | 0 | 0 | 109.6 | M2 S41 | M2-D4 PolarHBondContact O-N 3.37Å; D4-S41 VanDerWaalsContact OD1-CB 3.28Å; D4-S41 WeakPolarHBondContact OD1-CB 3.31Å; D4-S41 PolarHBondContact OD1-OG 3.46Å | ||
| 5 | Y | 83.8 | Confident | 79.2 | Confident | 133 Ų | 133 | 84.9 Ų | 84.9 | 52% | 0.522 | 47% | 0.473 | S | S | . | . | P | Polyproline II helix | trans | -80.3 | 129.7 | 175.2 | -59.5 | -76.1 | 0 | 0 | 0 | 110.5 | Q3 C40 S41 | Q3-Y5 HydrophobicContact CB-CD2 4.24Å; Q3-Y5 HydrophobicContact CB-CE1 4.05Å; Q3-Y5 HydrophobicContact CB-CE2 3.6Å; Q3-Y5 WeakPolarHBondContact O-CD2 3.28Å; Q3-Y5 WeakPolarHBondContact O-CE2 3.33Å; Q3-Y5 PolarHBondContact O-N 3.07Å; Q3-Y5 VanDerWaalsContact OE1-CZ 3.28Å; Q3-Y5 PolarHBondContact OE1-OH 2.79Å; Y5-C40 CarbonylContact O-C 3.48Å; Y5-C40 VanDerWaalsContact O-CA 3.28Å; Y5-C40 WeakPolarHBondContact O-CA 3.37Å; Y5-C40 VanDerWaalsContact O-CB 3.32Å; Y5-C40 WeakPolarHBondContact O-CB 3.29Å; Y5-S41 PolarHBondContact O-N 2.88Å |
| 6 | G | 87.6 | Confident | 79.4 | Confident | 59 Ų | 59 | 88.1 Ų | 88.1 | 61% | 0.608 | 49% | 0.488 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 134.1 | 168.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | A42 | G6-A42 CarbonylContact C-O 3.53Å; G6-A42 WeakPolarHBondContact CA-O 3.49Å |
| 7 | L | 87.8 | Confident | 79.6 | Confident | 40 Ų | 40 | 85.7 Ų | 85.7 | 21% | 0.209 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 129.2 | 174.1 | -178.6 | 64.8 | 0 | 0 | 0 | 110.2 | F33 I36 C37 C40 A42 V43 L44 | L7-F33 HydrophobicContact CD2-CE2 3.76Å; L7-F33 HydrophobicContact CD2-CZ 4.22Å; L7-I36 HydrophobicContact CD2-CG2 4.24Å; L7-C37 VanDerWaalsContact CD2-SG 3.58Å; L7-C40 HydrophobicContact CB-CB 4.24Å; L7-A42 PolarHBondContact N-O 2.89Å; L7-V43 HydrophobicContact CB-CG1 4.31Å; L7-V43 HydrophobicContact CB-CG2 4.2Å; L7-V43 HydrophobicContact CD2-CG1 4.17Å; L7-V43 HydrophobicContact CD2-CG2 4.47Å; L7-V43 HydrophobicContact CG-CG1 4.41Å; L7-V43 CarbonylContact O-C 3.56Å; L7-V43 WeakPolarHBondContact O-CA 3.4Å; L7-L44 PolarHBondContact O-N 2.73Å |
| 8 | I | 89.8 | Confident | 79.4 | Confident | 123 Ų | 123 | 85.4 Ų | 85.4 | 63% | 0.631 | 47% | 0.469 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.8 | 121.6 | 175.4 | -58 | -178.4 | 0 | 0 | 0 | 107.6 | L44 C46 | I8-L44 WeakPolarHBondContact CA-O 3.27Å; I8-L44 HydrophobicContact CG1-CB 4.4Å; I8-C46 WeakPolarHBondContact CG2-SG 3.49Å |
| 9 | I | 87.5 | Confident | 79.3 | Confident | 19 Ų | 19 | 88.9 Ų | 88.9 | 10% | 0.097 | 48% | 0.479 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 140.6 | -178.7 | -173 | 163.1 | 0 | 0 | 0 | 111.4 | A13 L14 I17 F33 L44 C45 C46 | I9-A13 HydrophobicContact CD1-CB 4.14Å; I9-A13 HydrophobicContact CG1-CB 3.95Å; I9-L14 HydrophobicContact CD1-CB 4.3Å; I9-L14 HydrophobicContact CD1-CD1 4.43Å; I9-I17 HydrophobicContact CD1-CD1 3.74Å; I9-F33 HydrophobicContact CD1-CD2 4.13Å; I9-F33 HydrophobicContact CD1-CE2 3.28Å; I9-F33 HydrophobicContact CD1-CZ 3.59Å; I9-F33 HydrophobicContact CG1-CE2 4.45Å; I9-F33 HydrophobicContact CG2-CZ 4.19Å; I9-L44 PolarHBondContact N-O 3.25Å; I9-C45 CarbonylContact O-C 3.52Å; I9-C45 WeakPolarHBondContact O-CA 3.5Å; I9-C46 PolarHBondContact O-N 2.94Å |
| 10 | D | 88.8 | Confident | 78.5 | Confident | 80 Ų | 80 | 90 Ų | 90 | 43% | 0.428 | 49% | 0.491 | S | S | . | . | trans | -77.6 | 147.6 | 171 | 177.9 | 50.5 | 0 | 0 | 0 | 111.9 | A12 A13 L14 | D10-A12 VanDerWaalsContact C-N 3.28Å; D10-A12 PolarHBondContact O-N 2.93Å; D10-A12 WeakPolarHBondContact OD2-CA 3.45Å; D10-A12 WeakPolarHBondContact OD2-CB 3.34Å; D10-A12 PolarHBondContact OD2-N 2.85Å; D10-A13 HydrophobicContact CB-CB 4.49Å; D10-A13 WeakPolarHBondContact O-CB 3.28Å; D10-A13 PolarHBondContact O-N 2.83Å; D10-L14 PolarHBondContact O-N 2.65Å | ||
| 11 | G | 82.4 | Confident | 77.9 | Confident | 3 Ų | 3 | 93.4 Ų | 93.4 | 3% | 0.031 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -74.2 | -12.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | S15 R47 | G11-S15 WeakPolarHBondContact O-CB 3.16Å; G11-S15 PolarHBondContact O-N 2.81Å; G11-R47 PolarHBondContact O-NH2 3.24Å |
| 12 | A | 84.3 | Confident | 78.6 | Confident | 52 Ų | 52 | 93.2 Ų | 93.2 | 43% | 0.43 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -74.4 | -43.8 | 165.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | D10 S15 L16 | D10-A12 VanDerWaalsContact C-N 3.28Å; D10-A12 PolarHBondContact O-N 2.93Å; D10-A12 WeakPolarHBondContact OD2-CA 3.45Å; D10-A12 WeakPolarHBondContact OD2-CB 3.34Å; D10-A12 PolarHBondContact OD2-N 2.85Å; A12-S15 WeakPolarHBondContact O-CB 3.33Å; A12-S15 PolarHBondContact O-N 2.82Å; A12-L16 WeakPolarHBondContact O-CG 3.07Å; A12-L16 PolarHBondContact O-N 3.34Å |
| 13 | A | 83 | Confident | 78.7 | Confident | 38 Ų | 38 | 89.7 Ų | 89.7 | 31% | 0.314 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.3 | -45.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | I9 D10 S15 L16 I17 | I9-A13 HydrophobicContact CD1-CB 4.14Å; I9-A13 HydrophobicContact CG1-CB 3.95Å; D10-A13 HydrophobicContact CB-CB 4.49Å; D10-A13 WeakPolarHBondContact O-CB 3.28Å; D10-A13 PolarHBondContact O-N 2.83Å; A13-S15 VanDerWaalsContact C-N 3.28Å; A13-S15 PolarHBondContact O-N 3.09Å; A13-L16 PolarHBondContact O-N 2.9Å; A13-L16 VanDerWaalsContact O-N 3.16Å; A13-I17 VanDerWaalsContact O-CG1 3.29Å; A13-I17 WeakPolarHBondContact O-CG1 3.46Å; A13-I17 PolarHBondContact O-N 3.19Å |
| 14 | L | 85.1 | Confident | 78.4 | Confident | 46 Ų | 46 | 87.5 Ų | 87.5 | 24% | 0.241 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -59.4 | -40.6 | 174.7 | -172.4 | 69.7 | 0 | 0 | 0 | 111.6 | I9 D10 L16 I17 M18 F33 | I9-L14 HydrophobicContact CD1-CB 4.3Å; I9-L14 HydrophobicContact CD1-CD1 4.43Å; D10-L14 PolarHBondContact O-N 2.65Å; L14-L16 VanDerWaalsContact C-N 3.34Å; L14-L16 PolarHBondContact O-N 3.24Å; L14-I17 PolarHBondContact O-N 3.22Å; L14-M18 HydrophobicContact CD1-CE 4.34Å; L14-M18 HydrophobicContact CD1-CG 4.41Å; L14-M18 HydrophobicContact CG-CG 4.4Å; L14-M18 VanDerWaalsContact O-CB 3.31Å; L14-M18 WeakPolarHBondContact O-CB 3.46Å; L14-M18 VanDerWaalsContact O-CG 3.27Å; L14-M18 WeakPolarHBondContact O-CG 3.32Å; L14-M18 PolarHBondContact O-N 3.44Å; L14-F33 HydrophobicContact CD1-CD1 4.4Å; L14-F33 HydrophobicContact CD1-CE1 3.47Å; L14-F33 VanDerWaalsContact CD1-CE1 3.47Å; L14-F33 HydrophobicContact CD1-CZ 3.73Å |
| 15 | S | 83.3 | Confident | 77.3 | Confident | 64 Ų | 64 | 86.5 Ų | 86.5 | 45% | 0.448 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.8 | -34.9 | 177.8 | -169.4 | 0 | 0 | 0 | 0 | 112.5 | G11 A12 A13 K19 | G11-S15 WeakPolarHBondContact O-CB 3.16Å; G11-S15 PolarHBondContact O-N 2.81Å; A12-S15 WeakPolarHBondContact O-CB 3.33Å; A12-S15 PolarHBondContact O-N 2.82Å; A13-S15 VanDerWaalsContact C-N 3.28Å; A13-S15 PolarHBondContact O-N 3.09Å; S15-K19 VanDerWaalsContact O-CB 3.32Å; S15-K19 WeakPolarHBondContact O-CB 3.33Å; S15-K19 PolarHBondContact O-N 2.88Å; S15-K19 VanDerWaalsContact O-N 3.09Å |
| 16 | L | 82.6 | Confident | 75.8 | Confident | 136 Ų | 136 | 84.9 Ų | 84.9 | 71% | 0.712 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -69.9 | -40.4 | 175.8 | -71.1 | 169.8 | 0 | 0 | 0 | 111.7 | A12 A13 L14 K19 | A12-L16 WeakPolarHBondContact O-CG 3.07Å; A12-L16 PolarHBondContact O-N 3.34Å; A13-L16 PolarHBondContact O-N 2.9Å; A13-L16 VanDerWaalsContact O-N 3.16Å; L14-L16 VanDerWaalsContact C-N 3.34Å; L14-L16 PolarHBondContact O-N 3.24Å; L16-K19 PolarHBondContact O-N 3.17Å |
| 17 | I | 81.9 | Confident | 74.5 | Confident | 48 Ų | 48 | 83.6 Ų | 83.6 | 25% | 0.246 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -69 | -37.4 | 178.2 | -65.1 | 165.3 | 0 | 0 | 0 | 111.3 | I9 A13 L14 R30 F33 | I9-I17 HydrophobicContact CD1-CD1 3.74Å; A13-I17 VanDerWaalsContact O-CG1 3.29Å; A13-I17 WeakPolarHBondContact O-CG1 3.46Å; A13-I17 PolarHBondContact O-N 3.19Å; L14-I17 PolarHBondContact O-N 3.22Å; I17-R30 HydrophobicContact CG2-CB 4.49Å; I17-F33 HydrophobicContact CD1-CD2 3.91Å; I17-F33 HydrophobicContact CD1-CE2 4.34Å; I17-F33 HydrophobicContact CD1-CG 4.18Å; I17-F33 HydrophobicContact CG2-CB 3.82Å; I17-F33 HydrophobicContact CG2-CD1 4.21Å; I17-F33 HydrophobicContact CG2-CG 4.02Å |
| 18 | M | 76.3 | Confident | 73.7 | Confident | 80 Ų | 80 | 86.2 Ų | 86.2 | 39% | 0.394 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -81.7 | -14.4 | 179.5 | -70.9 | -68.1 | -167.6 | 0 | 0 | 113.6 | L14 P20 R30 | L14-M18 HydrophobicContact CD1-CE 4.34Å; L14-M18 HydrophobicContact CD1-CG 4.41Å; L14-M18 HydrophobicContact CG-CG 4.4Å; L14-M18 VanDerWaalsContact O-CB 3.31Å; L14-M18 WeakPolarHBondContact O-CB 3.46Å; L14-M18 VanDerWaalsContact O-CG 3.27Å; L14-M18 WeakPolarHBondContact O-CG 3.32Å; L14-M18 PolarHBondContact O-N 3.44Å; M18-P20 WeakPolarHBondContact O-CD 3.28Å; M18-R30 HydrophobicContact SD-CG 4.25Å |
| 19 | K | 76.9 | Confident | 73.2 | Confident | 152 Ų | 152 | 87.6 Ų | 87.6 | 66% | 0.661 | 50% | 0.495 | S | S | * | . | S | Bend | trans | -73 | 120.5 | -179.2 | -164.2 | 172 | -177.8 | -178.6 | 0 | 109.3 | S15 L16 R21 | S15-K19 VanDerWaalsContact O-CB 3.32Å; S15-K19 WeakPolarHBondContact O-CB 3.33Å; S15-K19 PolarHBondContact O-N 2.88Å; S15-K19 VanDerWaalsContact O-N 3.09Å; L16-K19 PolarHBondContact O-N 3.17Å; K19-R21 PolarHBondContact O-N 3.26Å |
| 20 | P | 63.5 | Low | 72.8 | Confident | 110 Ų | 110 | 93.6 Ų | 93.6 | 71% | 0.714 | 52% | 0.517 | S | S | * | . | P | Polyproline II helix | trans | -63 | 128.8 | 173.8 | 26.1 | -31.6 | 0 | 0 | 0 | 108.7 | M18 | M18-P20 WeakPolarHBondContact O-CD 3.28Š|
| 21 | R | 66.9 | Low | 72.6 | Confident | 163 Ų | 163 | 95.9 Ų | 95.9 | 62% | 0.615 | 53% | 0.525 | S | S | * | . | P | Polyproline II helix | trans | -78.9 | 131.4 | 169.8 | -63 | -179.8 | 105.6 | 128.1 | 2.2 | 107.8 | K19 D23 | K19-R21 PolarHBondContact O-N 3.26Å; R21-D23 VanDerWaalsContact C-N 3.3Å; R21-D23 IonicContact NE-OD2 3.64Å |
| 22 | E | 61.8 | Low | 72.7 | Confident | 195 Ų | 195 | 100.1 Ų | 100.1 | 91% | 0.911 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -79.2 | -22.5 | -178.7 | -60.6 | -172.8 | 103.8 | 0 | 0 | 111.5 | G24 | E22-G24 PolarHBondContact O-N 3.16Š|
| 23 | D | 58.9 | Low | 72.8 | Confident | 100 Ų | 100 | 98.8 Ų | 98.8 | 54% | 0.535 | 53% | 0.531 | S | S | . | . | S | Bend | trans | -71.2 | 98.5 | 165.1 | 24.9 | -55.3 | 0 | 0 | 0 | 108.2 | R21 S25 | R21-D23 VanDerWaalsContact C-N 3.3Å; R21-D23 IonicContact NE-OD2 3.64Å; D23-S25 PolarHBondContact O-N 3.02Å |
| 24 | G | 55.4 | Low | 72.9 | Confident | 81 Ų | 81 | 100.5 Ų | 100.5 | 84% | 0.835 | 53% | 0.534 | S | S | * | . | S | Bend | trans | -55.5 | 19.8 | -175.5 | 0 | 0 | 0 | 0 | 0 | 118 | E22 S26 | E22-G24 PolarHBondContact O-N 3.16Å; G24-S26 VanDerWaalsContact C-N 3.35Å; G24-S26 PolarHBondContact O-N 2.8Å; G24-S26 VanDerWaalsContact O-N 3.16Å |
| 25 | S | 55.3 | Low | 73.1 | Confident | 95 Ų | 95 | 104.1 Ų | 104.1 | 66% | 0.664 | 55% | 0.55 | S | S | * | * | trans | -69.9 | 95.6 | 153.6 | -167.4 | 0 | 0 | 0 | 0 | 107.7 | D23 G27 | D23-S25 PolarHBondContact O-N 3.02Å; S25-G27 PolarHBondContact O-N 3.09Å | ||
| 26 | S | 53.3 | Low | 73.3 | Confident | 98 Ų | 98 | 104.7 Ų | 104.7 | 69% | 0.685 | 55% | 0.547 | S | S | * | . | trans | -57.9 | 78.2 | 169.2 | 54.6 | 0 | 0 | 0 | 0 | 109.7 | G24 N28 | G24-S26 VanDerWaalsContact C-N 3.35Å; G24-S26 PolarHBondContact O-N 2.8Å; G24-S26 VanDerWaalsContact O-N 3.16Å; S26-N28 VanDerWaalsContact C-N 3.29Å; S26-N28 PolarHBondContact O-N 3.36Å; S26-N28 PolarHBondContact O-OD1 2.93Å | ||
| 27 | G | 59.7 | Low | 73.4 | Confident | 33 Ų | 33 | 99.4 Ų | 99.4 | 34% | 0.34 | 52% | 0.521 | S | S | . | . | trans | -68.6 | 95.5 | 167.5 | 0 | 0 | 0 | 0 | 0 | 106.4 | S25 Y29 | S25-G27 PolarHBondContact O-N 3.09Å; G27-Y29 PolarHBondContact O-N 3.19Å | ||
| 28 | N | 71.5 | Confident | 73.5 | Confident | 94 Ų | 94 | 107.6 Ų | 107.6 | 50% | 0.503 | 55% | 0.549 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | 20.8 | 176.9 | -72.5 | 9 | 0 | 0 | 0 | 113.2 | S26 R30 E31 L32 | S26-N28 VanDerWaalsContact C-N 3.29Å; S26-N28 PolarHBondContact O-N 3.36Å; S26-N28 PolarHBondContact O-OD1 2.93Å; N28-R30 PolarHBondContact O-N 3.4Å; N28-E31 HydrophobicContact CB-CB 4.27Å; N28-E31 PolarHBondContact ND2-OE2 3.14Å; N28-E31 WeakPolarHBondContact O-CA 3.4Å; N28-E31 WeakPolarHBondContact O-CB 3.09Å; N28-E31 PolarHBondContact O-N 3.29Å; N28-L32 PolarHBondContact O-N 3.28Å |
| 29 | Y | 77.9 | Confident | 74 | Confident | 152 Ų | 152 | 108 Ų | 108 | 60% | 0.596 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -53.7 | -35.3 | 175 | -67.8 | -74.7 | 0 | 0 | 0 | 112.3 | G27 F33 | G27-Y29 PolarHBondContact O-N 3.19Å; Y29-F33 WeakPolarHBondContact O-CB 3.32Å; Y29-F33 PolarHBondContact O-N 2.93Å |
| 30 | R | 80.7 | Confident | 74.5 | Confident | 145 Ų | 145 | 102 Ų | 102 | 55% | 0.547 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.1 | -44.7 | 173.1 | 178.8 | 179.1 | 172.4 | -176.9 | -2.3 | 112 | I17 M18 N28 F33 L34 | I17-R30 HydrophobicContact CG2-CB 4.49Å; M18-R30 HydrophobicContact SD-CG 4.25Å; N28-R30 PolarHBondContact O-N 3.4Å; R30-F33 PolarHBondContact O-N 3.5Å; R30-L34 HydrophobicContact CG-CD1 4.21Å; R30-L34 VanDerWaalsContact O-CG 3.27Å; R30-L34 WeakPolarHBondContact O-CG 3.41Å; R30-L34 PolarHBondContact O-N 2.94Å |
| 31 | E | 83.9 | Confident | 75.6 | Confident | 129 Ų | 129 | 100.8 Ų | 100.8 | 60% | 0.603 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -70.4 | -44.1 | -177.4 | -163.9 | 160.5 | -127.6 | 0 | 0 | 110.8 | N28 F33 L34 E35 | N28-E31 HydrophobicContact CB-CB 4.27Å; N28-E31 PolarHBondContact ND2-OE2 3.14Å; N28-E31 WeakPolarHBondContact O-CA 3.4Å; N28-E31 WeakPolarHBondContact O-CB 3.09Å; N28-E31 PolarHBondContact O-N 3.29Å; E31-F33 PolarHBondContact O-N 3.32Å; E31-L34 PolarHBondContact O-N 3.41Å; E31-E35 PolarHBondContact O-N 2.91Å |
| 32 | L | 85.3 | Confident | 76.6 | Confident | 92 Ų | 92 | 95.9 Ų | 95.9 | 48% | 0.482 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.9 | -43.8 | 172.6 | -177 | 66.2 | 0 | 0 | 0 | 112.1 | N28 L34 E35 I36 | N28-L32 PolarHBondContact O-N 3.28Å; L32-L34 VanDerWaalsContact C-N 3.31Å; L32-L34 PolarHBondContact O-N 3.02Å; L32-E35 WeakPolarHBondContact O-CB 3.47Å; L32-E35 PolarHBondContact O-N 3.12Å; L32-I36 HydrophobicContact CG-CD1 4.23Å; L32-I36 VanDerWaalsContact O-CG1 3.31Å; L32-I36 WeakPolarHBondContact O-CG1 3.24Å; L32-I36 PolarHBondContact O-N 3.02Å |
| 33 | F | 86 | Confident | 77.7 | Confident | 23 Ų | 23 | 89.9 Ų | 89.9 | 10% | 0.101 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -61.7 | -40.9 | 176.5 | 175.4 | -102.7 | 0 | 0 | 0 | 111.8 | L7 I9 L14 I17 Y29 R30 E31 I36 C37 | L7-F33 HydrophobicContact CD2-CE2 3.76Å; L7-F33 HydrophobicContact CD2-CZ 4.22Å; I9-F33 HydrophobicContact CD1-CD2 4.13Å; I9-F33 HydrophobicContact CD1-CE2 3.28Å; I9-F33 HydrophobicContact CD1-CZ 3.59Å; I9-F33 HydrophobicContact CG1-CE2 4.45Å; I9-F33 HydrophobicContact CG2-CZ 4.19Å; L14-F33 HydrophobicContact CD1-CD1 4.4Å; L14-F33 HydrophobicContact CD1-CE1 3.47Å; L14-F33 VanDerWaalsContact CD1-CE1 3.47Å; L14-F33 HydrophobicContact CD1-CZ 3.73Å; I17-F33 HydrophobicContact CD1-CD2 3.91Å; I17-F33 HydrophobicContact CD1-CE2 4.34Å; I17-F33 HydrophobicContact CD1-CG 4.18Å; I17-F33 HydrophobicContact CG2-CB 3.82Å; I17-F33 HydrophobicContact CG2-CD1 4.21Å; I17-F33 HydrophobicContact CG2-CG 4.02Å; Y29-F33 WeakPolarHBondContact O-CB 3.32Å; Y29-F33 PolarHBondContact O-N 2.93Å; R30-F33 PolarHBondContact O-N 3.5Å; E31-F33 PolarHBondContact O-N 3.32Å; F33-I36 PolarHBondContact O-N 2.95Å; F33-C37 WeakPolarHBondContact CE1-SG 3.48Å; F33-C37 WeakPolarHBondContact CZ-SG 3.27Å; F33-C37 PolarHBondContact O-N 3.16Å; F33-C37 PolarHBondContact O-SG 3.47Å |
| 34 | L | 84.8 | Confident | 79 | Confident | 74 Ų | 74 | 90.1 Ų | 90.1 | 39% | 0.387 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.9 | -38 | 176.3 | -73.4 | 168.6 | 0 | 0 | 0 | 112 | R30 E31 L32 I36 C37 R38 | R30-L34 HydrophobicContact CG-CD1 4.21Å; R30-L34 VanDerWaalsContact O-CG 3.27Å; R30-L34 WeakPolarHBondContact O-CG 3.41Å; R30-L34 PolarHBondContact O-N 2.94Å; E31-L34 PolarHBondContact O-N 3.41Å; L32-L34 VanDerWaalsContact C-N 3.31Å; L32-L34 PolarHBondContact O-N 3.02Å; L34-I36 VanDerWaalsContact C-N 3.34Å; L34-C37 PolarHBondContact O-N 2.98Å; L34-R38 VanDerWaalsContact O-CG 3.24Å; L34-R38 WeakPolarHBondContact O-CG 3.31Å; L34-R38 PolarHBondContact O-N 2.94Å |
| 35 | E | 88.3 | Confident | 80.5 | Confident | 123 Ų | 123 | 89 Ų | 89 | 58% | 0.575 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -61.4 | -42.9 | 174.7 | -172.7 | 177.6 | -167.3 | 0 | 0 | 111.8 | E31 L32 R38 S39 | E31-E35 PolarHBondContact O-N 2.91Å; L32-E35 WeakPolarHBondContact O-CB 3.47Å; L32-E35 PolarHBondContact O-N 3.12Å; E35-R38 PolarHBondContact O-N 3.49Å; E35-S39 PolarHBondContact O-N 3.2Å; E35-S39 VanDerWaalsContact O-N 3.12Å; E35-S39 PolarHBondContact O-OG 3.26Å |
| 36 | I | 87.5 | Confident | 81.3 | Confident | 76 Ų | 76 | 87 Ų | 87 | 39% | 0.39 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.2 | -45.3 | 174.4 | -63.7 | 164.3 | 0 | 0 | 0 | 110.1 | L7 L32 F33 L34 R38 S39 C40 | L7-I36 HydrophobicContact CD2-CG2 4.24Å; L32-I36 HydrophobicContact CG-CD1 4.23Å; L32-I36 VanDerWaalsContact O-CG1 3.31Å; L32-I36 WeakPolarHBondContact O-CG1 3.24Å; L32-I36 PolarHBondContact O-N 3.02Å; F33-I36 PolarHBondContact O-N 2.95Å; L34-I36 VanDerWaalsContact C-N 3.34Å; I36-R38 VanDerWaalsContact C-N 3.26Å; I36-R38 PolarHBondContact O-N 3.04Å; I36-S39 WeakPolarHBondContact O-CB 3.13Å; I36-S39 PolarHBondContact O-N 2.92Å; I36-C40 PolarHBondContact O-N 3.19Å; I36-C40 VanDerWaalsContact O-N 3.09Å; I36-C40 PolarHBondContact O-SG 3.43Å |
| 37 | C | 85.5 | Confident | 81.9 | Confident | 24 Ų | 24 | 90.9 Ų | 90.9 | 16% | 0.162 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -59.4 | -35.8 | 177.2 | -69.8 | 0 | 0 | 0 | 0 | 112.9 | L7 F33 L34 S39 C40 V43 | L7-C37 VanDerWaalsContact CD2-SG 3.58Å; F33-C37 WeakPolarHBondContact CE1-SG 3.48Å; F33-C37 WeakPolarHBondContact CZ-SG 3.27Å; F33-C37 PolarHBondContact O-N 3.16Å; F33-C37 PolarHBondContact O-SG 3.47Å; L34-C37 PolarHBondContact O-N 2.98Å; C37-S39 VanDerWaalsContact C-N 3.3Å; C37-C40 PolarHBondContact O-N 3.32Å; C37-V43 HydrophobicContact CB-CG2 4.04Å |
| 38 | R | 84.8 | Confident | 81.5 | Confident | 220 Ų | 220 | 96.6 Ų | 96.6 | 83% | 0.83 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -73.4 | -23.6 | 176.7 | -69.8 | 171.5 | 84.9 | 104.6 | 4.5 | 112.9 | L34 E35 I36 | L34-R38 VanDerWaalsContact O-CG 3.24Å; L34-R38 WeakPolarHBondContact O-CG 3.31Å; L34-R38 PolarHBondContact O-N 2.94Å; E35-R38 PolarHBondContact O-N 3.49Å; I36-R38 VanDerWaalsContact C-N 3.26Å; I36-R38 PolarHBondContact O-N 3.04Å |
| 39 | S | 86.6 | Confident | 80.4 | Confident | 89 Ų | 89 | 97 Ų | 97 | 62% | 0.622 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -85.7 | -14.9 | 176.6 | -54.9 | 0 | 0 | 0 | 0 | 112.4 | E35 I36 C37 | E35-S39 PolarHBondContact O-N 3.2Å; E35-S39 VanDerWaalsContact O-N 3.12Å; E35-S39 PolarHBondContact O-OG 3.26Å; I36-S39 WeakPolarHBondContact O-CB 3.13Å; I36-S39 PolarHBondContact O-N 2.92Å; C37-S39 VanDerWaalsContact C-N 3.3Å |
| 40 | C | 87.3 | Confident | 78.6 | Confident | 25 Ų | 25 | 93.8 Ų | 93.8 | 17% | 0.169 | 50% | 0.5 | C | S | . | . | S | Bend | trans | -90.2 | 141.2 | 176.8 | -65.7 | 0 | 0 | 0 | 0 | 111.7 | Y5 L7 I36 C37 A42 V43 | Y5-C40 CarbonylContact O-C 3.48Å; Y5-C40 VanDerWaalsContact O-CA 3.28Å; Y5-C40 WeakPolarHBondContact O-CA 3.37Å; Y5-C40 VanDerWaalsContact O-CB 3.32Å; Y5-C40 WeakPolarHBondContact O-CB 3.29Å; L7-C40 HydrophobicContact CB-CB 4.24Å; I36-C40 PolarHBondContact O-N 3.19Å; I36-C40 VanDerWaalsContact O-N 3.09Å; I36-C40 PolarHBondContact O-SG 3.43Å; C37-C40 PolarHBondContact O-N 3.32Å; C40-A42 VanDerWaalsContact C-N 3.34Å; C40-V43 HydrophobicContact CB-CG2 4.28Å |
| 41 | S | 86.7 | Confident | 77 | Confident | 85 Ų | 85 | 95 Ų | 95 | 59% | 0.594 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -71.4 | -31.7 | 175.9 | -166.2 | 0 | 0 | 0 | 0 | 111.3 | D4 Y5 | D4-S41 VanDerWaalsContact OD1-CB 3.28Å; D4-S41 WeakPolarHBondContact OD1-CB 3.31Å; D4-S41 PolarHBondContact OD1-OG 3.46Å; Y5-S41 PolarHBondContact O-N 2.88Å |
| 42 | A | 86.9 | Confident | 74.8 | Confident | 61 Ų | 61 | 98 Ų | 98 | 50% | 0.504 | 53% | 0.53 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.6 | 144.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | G6 L7 C40 | G6-A42 CarbonylContact C-O 3.53Å; G6-A42 WeakPolarHBondContact CA-O 3.49Å; L7-A42 PolarHBondContact N-O 2.89Å; C40-A42 VanDerWaalsContact C-N 3.34Å |
| 43 | V | 85.3 | Confident | 72.7 | Confident | 69 Ų | 69 | 102.4 Ų | 102.4 | 42% | 0.418 | 55% | 0.546 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 122.9 | 173.7 | -175.8 | 0 | 0 | 0 | 0 | 109.2 | L7 C37 C40 | L7-V43 HydrophobicContact CB-CG1 4.31Å; L7-V43 HydrophobicContact CB-CG2 4.2Å; L7-V43 HydrophobicContact CD2-CG1 4.17Å; L7-V43 HydrophobicContact CD2-CG2 4.47Å; L7-V43 HydrophobicContact CG-CG1 4.41Å; L7-V43 CarbonylContact O-C 3.56Å; L7-V43 WeakPolarHBondContact O-CA 3.4Å; C37-V43 HydrophobicContact CB-CG2 4.04Å; C40-V43 HydrophobicContact CB-CG2 4.28Å |
| 44 | L | 87.4 | Confident | 71 | Confident | 105 Ų | 105 | 105.9 Ų | 105.9 | 55% | 0.55 | 58% | 0.579 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -112.4 | 117.8 | 178.8 | -176.5 | 66.1 | 0 | 0 | 0 | 110.3 | L7 I8 I9 | L7-L44 PolarHBondContact O-N 2.73Å; I8-L44 WeakPolarHBondContact CA-O 3.27Å; I8-L44 HydrophobicContact CG1-CB 4.4Å; I9-L44 PolarHBondContact N-O 3.25Å |
| 45 | C | 84.9 | Confident | 69.4 | Low | 58 Ų | 58 | 111.4 Ų | 111.4 | 39% | 0.392 | 60% | 0.602 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.7 | 116.6 | 171.8 | -176.5 | 0 | 0 | 0 | 0 | 110.1 | I9 R47 | I9-C45 CarbonylContact O-C 3.52Å; I9-C45 WeakPolarHBondContact O-CA 3.5Å; C45-R47 PolarHBondContact O-N 3.31Å |
| 46 | C | 73.5 | Confident | 67.6 | Low | 52 Ų | 52 | 111.4 Ų | 111.4 | 35% | 0.351 | 61% | 0.611 | S | S | . | * | trans | -83.4 | 30 | -170.6 | -55.1 | 0 | 0 | 0 | 0 | 114 | I8 I9 M48 | I8-C46 WeakPolarHBondContact CG2-SG 3.49Å; I9-C46 PolarHBondContact O-N 2.94Å; C46-M48 PolarHBondContact O-N 2.65Å | ||
| 47 | R | 65 | Low | 65.6 | Low | 180 Ų | 180 | 114.8 Ų | 114.8 | 68% | 0.679 | 63% | 0.629 | S | S | * | * | trans | -64.5 | 76.8 | 175.8 | -89.5 | -101 | -174.5 | 179.6 | -1.3 | 111.2 | G11 C45 | G11-R47 PolarHBondContact O-NH2 3.24Å; C45-R47 PolarHBondContact O-N 3.31Å | ||
| 48 | M | 51.1 | Low | 63.7 | Low | 153 Ų | 153 | 119.5 Ų | 119.5 | 75% | 0.754 | 66% | 0.659 | S | S | * | * | trans | -80.3 | 125.9 | 148.6 | -67.9 | -138.2 | -105.9 | 0 | 0 | 106.6 | C46 P50 | C46-M48 PolarHBondContact O-N 2.65Å; M48-P50 HydrophobicContact CB-CB 4.05Å; M48-P50 HydrophobicContact CB-CG 3.78Å; M48-P50 VanDerWaalsContact O-CD 3.28Å; M48-P50 WeakPolarHBondContact O-CD 3.47Å; M48-P50 HydrophobicContact SD-CB 4.26Å | ||
| 49 | A | 48 | Very low | 61.9 | Low | 101 Ų | 101 | 113.8 Ų | 113.8 | 84% | 0.835 | 66% | 0.659 | S | S | * | * | trans | -93.9 | 90.7 | 142.8 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 50 | P | 42 | Very low | 59.6 | Low | 85 Ų | 85 | 121 Ų | 121 | 55% | 0.552 | 67% | 0.673 | S | S | * | * | trans | -100.4 | 36.5 | -176.9 | 38.7 | -27 | 0 | 0 | 0 | 111.1 | M48 | M48-P50 HydrophobicContact CB-CB 4.05Å; M48-P50 HydrophobicContact CB-CG 3.78Å; M48-P50 VanDerWaalsContact O-CD 3.28Å; M48-P50 WeakPolarHBondContact O-CD 3.47Å; M48-P50 HydrophobicContact SD-CB 4.26Å | ||
| 51 | L | 45.7 | Very low | 57.9 | Low | 170 Ų | 170 | 126.1 Ų | 126.1 | 89% | 0.89 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -84.2 | -10.9 | 177.4 | -93.5 | 160.7 | 0 | 0 | 0 | 113.9 | ||
| 52 | Q | 38.2 | Very low | 55.8 | Low | 193 Ų | 193 | 137.6 Ų | 137.6 | 90% | 0.902 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -140.1 | 26 | -176.6 | -68.4 | -170.8 | -40.2 | 0 | 0 | 115.6 | ||
| 53 | K | 42 | Very low | 54.2 | Low | 185 Ų | 185 | 141.4 Ų | 141.4 | 80% | 0.804 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -128.1 | 12.8 | 175.9 | -130.3 | -170.9 | -83.5 | -176 | 0 | 115.8 | ||
| 54 | A | 50.1 | Low | 52.6 | Low | 96 Ų | 96 | 145.2 Ų | 145.2 | 79% | 0.793 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -97.7 | 17.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 55 | Q | 49.6 | Very low | 50.6 | Low | 189 Ų | 189 | 147.4 Ų | 147.4 | 88% | 0.883 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -110.3 | -10.8 | 177.7 | -75.1 | -168.4 | -49.1 | 0 | 0 | 115.9 | ||
| 56 | V | 51.4 | Low | 48.6 | Very low | 123 Ų | 123 | 152.7 Ų | 152.7 | 75% | 0.745 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -143.4 | -28.4 | -176.6 | -160.1 | 0 | 0 | 0 | 0 | 119.4 | ||
| 57 | L | 46.3 | Very low | 47.1 | Very low | 148 Ų | 148 | 159 Ų | 159 | 78% | 0.775 | 83% | 0.827 | S | S | * | * | trans | -144.2 | 131.9 | -168.3 | -71.6 | 166.8 | 0 | 0 | 0 | 116.1 | A59 | L57-A59 PolarHBondContact O-N 3.16Š| ||
| 58 | P | 44.5 | Very low | 45.9 | Very low | 123 Ų | 123 | 157.6 Ų | 157.6 | 80% | 0.799 | 84% | 0.837 | S | S | * | * | trans | -76.6 | 115.8 | 175 | 30.6 | -29.8 | 0 | 0 | 0 | 110.2 | R60 | P58-R60 PolarHBondContact O-N 2.69Š| ||
| 59 | A | 46.6 | Very low | 45.5 | Very low | 100 Ų | 100 | 157.9 Ų | 157.9 | 83% | 0.826 | 84% | 0.843 | S | S | * | * | trans | -79.2 | 112.7 | 178 | 0 | 0 | 0 | 0 | 0 | 110.5 | L57 | L57-A59 PolarHBondContact O-N 3.16Š| ||
| 60 | R | 38.8 | Very low | 45.3 | Very low | 241 Ų | 241 | 162.3 Ų | 162.3 | 91% | 0.909 | 84% | 0.843 | S | S | * | * | trans | -73.4 | 139.4 | 163.9 | -74.9 | -172.9 | 177.5 | -152.3 | 1.1 | 109.9 | P58 | P58-R60 PolarHBondContact O-N 2.69Š| ||
| 61 | P | 52.8 | Low | 45.6 | Very low | 131 Ų | 131 | 168.8 Ų | 168.8 | 85% | 0.851 | 87% | 0.867 | S | S | * | * | trans | -80.2 | 134.6 | 170.4 | 32.7 | -29.9 | 0 | 0 | 0 | 109.9 | ||||
| 62 | R | 40.8 | Very low | 45.6 | Very low | 326 Ų | 326 | 168.6 Ų | 168.6 | 100% | 1.23 | 87% | 0.865 | S | S | * | * | trans | -109.7 | 0 | 158 | -83.8 | -164.2 | -173.7 | -176.5 | 3.1 | 107.8 |
Retrieved 62 of 62 residues in 59.8 ms
(Link to these results)