| 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 | 69.5 | Low | 90.4 | Very high | 198 Ų | 198 | 102.9 Ų | 102.9 | 98% | 0.975 | 55% | 0.55 | S | S | * | * | 0 | 129.1 | 0 | -88.4 | -79.3 | -165 | 0 | 0 | 108.3 | R5 L6 | M1-R5 HydrophobicContact SD-CB 4.49Å; M1-L6 HydrophobicContact CB-CD1 4.28Å; M1-L6 HydrophobicContact CB-CD2 4.12Å; M1-L6 HydrophobicContact CB-CG 4.13Å; M1-L6 HydrophobicContact CG-CD2 4.36Å | |||
| 2 | S | 84.9 | Confident | 90.7 | Very high | 48 Ų | 48 | 104.8 Ų | 104.8 | 34% | 0.336 | 56% | 0.558 | S | S | . | * | trans | -69.7 | 138.3 | 174.8 | 50.6 | 0 | 0 | 0 | 0 | 110.6 | W4 R5 L6 | S2-W4 VanDerWaalsContact CB-NE1 3.34Å; S2-W4 PolarHBondContact O-N 3.13Å; S2-W4 VanDerWaalsContact O-N 3.16Å; S2-W4 VanDerWaalsContact OG-CE2 3.22Å; S2-W4 WeakPolarHBondContact OG-CZ2 3.42Å; S2-W4 PolarHBondContact OG-NE1 3.06Å; S2-R5 WeakPolarHBondContact O-CB 3.45Å; S2-R5 PolarHBondContact O-N 3.38Å; S2-R5 VanDerWaalsContact OG-CG 3.24Å; S2-R5 WeakPolarHBondContact OG-CG 3.01Å; S2-L6 PolarHBondContact O-N 3.15Å | ||
| 3 | L | 91.7 | Very high | 90.9 | Very high | 146 Ų | 146 | 109.2 Ų | 109.2 | 76% | 0.764 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -54 | -38.6 | -173.9 | -77.3 | 164.1 | 0 | 0 | 0 | 113.5 | R5 L6 A7 | L3-R5 VanDerWaalsContact C-N 3.29Å; L3-R5 PolarHBondContact O-N 3.49Å; L3-L6 WeakPolarHBondContact O-CB 3.45Å; L3-L6 PolarHBondContact O-N 3.15Å; L3-L6 VanDerWaalsContact O-N 3.13Å; L3-A7 PolarHBondContact O-N 3.24Å |
| 4 | W | 90.5 | Very high | 91.2 | Very high | 53 Ų | 53 | 107.8 Ų | 107.8 | 20% | 0.201 | 55% | 0.547 | C | S | . | . | H | α-helix | trans | -66.7 | -28 | 178.8 | 54.1 | -96.9 | 0 | 0 | 0 | 113.1 | S2 I9 Y11 Y14 | S2-W4 VanDerWaalsContact CB-NE1 3.34Å; S2-W4 PolarHBondContact O-N 3.13Å; S2-W4 VanDerWaalsContact O-N 3.16Å; S2-W4 VanDerWaalsContact OG-CE2 3.22Å; S2-W4 WeakPolarHBondContact OG-CZ2 3.42Å; S2-W4 PolarHBondContact OG-NE1 3.06Å; W4-I9 HydrophobicContact CB-CD1 3.81Å; W4-I9 HydrophobicContact CB-CG1 3.9Å; W4-I9 WeakPolarHBondContact O-CG1 3.24Å; W4-I9 PolarHBondContact O-N 3.27Å; W4-Y11 HydrophobicContact CH2-CD2 4.19Å; W4-Y14 HydrophobicContact CB-CD2 3.56Å; W4-Y14 HydrophobicContact CB-CE2 4.09Å; W4-Y14 HydrophobicContact CB-CG 4.18Å; W4-Y14 AromaticContact CD1-CD2 3.83Å; W4-Y14 AromaticContact CD1-CE2 3.64Å; W4-Y14 AromaticContact CD1-CZ 3.96Å; W4-Y14 HydrophobicContact CD2-CD1 4.48Å; W4-Y14 HydrophobicContact CD2-CD2 4.27Å; W4-Y14 HydrophobicContact CD2-CG 4.12Å; W4-Y14 HydrophobicContact CE3-CG 4.45Å; W4-Y14 AromaticContact CG-CD2 3.64Å; W4-Y14 HydrophobicContact CG-CD2 3.64Å; W4-Y14 AromaticContact CG-CE2 3.94Å; W4-Y14 HydrophobicContact CG-CE2 3.94Å; W4-Y14 AromaticContact CG-CG 3.99Å; W4-Y14 HydrophobicContact CG-CG 3.99Å |
| 5 | R | 92.6 | Very high | 91.4 | Very high | 150 Ų | 150 | 104.1 Ų | 104.1 | 57% | 0.566 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -70.6 | -37.3 | 171.7 | -69.4 | -70.6 | -174.1 | 111 | 0.4 | 111.6 | M1 S2 L3 A7 G8 | M1-R5 HydrophobicContact SD-CB 4.49Å; S2-R5 WeakPolarHBondContact O-CB 3.45Å; S2-R5 PolarHBondContact O-N 3.38Å; S2-R5 VanDerWaalsContact OG-CG 3.24Å; S2-R5 WeakPolarHBondContact OG-CG 3.01Å; L3-R5 VanDerWaalsContact C-N 3.29Å; L3-R5 PolarHBondContact O-N 3.49Å; R5-A7 VanDerWaalsContact C-N 3.3Å; R5-A7 PolarHBondContact O-N 2.86Å; R5-G8 PolarHBondContact O-N 3.42Å; R5-G8 VanDerWaalsContact O-N 3.15Å |
| 6 | L | 94.1 | Very high | 91.5 | Very high | 119 Ų | 119 | 101.2 Ų | 101.2 | 62% | 0.623 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.2 | -34.1 | 176.2 | -65.5 | 171.6 | 0 | 0 | 0 | 111.8 | M1 S2 L3 G8 | M1-L6 HydrophobicContact CB-CD1 4.28Å; M1-L6 HydrophobicContact CB-CD2 4.12Å; M1-L6 HydrophobicContact CB-CG 4.13Å; M1-L6 HydrophobicContact CG-CD2 4.36Å; S2-L6 PolarHBondContact O-N 3.15Å; L3-L6 WeakPolarHBondContact O-CB 3.45Å; L3-L6 PolarHBondContact O-N 3.15Å; L3-L6 VanDerWaalsContact O-N 3.13Å; L6-G8 PolarHBondContact O-N 2.77Å; L6-G8 VanDerWaalsContact O-N 3.15Å |
| 7 | A | 93.7 | Very high | 91.7 | Very high | 74 Ų | 74 | 100.6 Ų | 100.6 | 61% | 0.612 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.6 | 1.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | L3 R5 I9 | L3-A7 PolarHBondContact O-N 3.24Å; R5-A7 VanDerWaalsContact C-N 3.3Å; R5-A7 PolarHBondContact O-N 2.86Å; A7-I9 HydrophobicContact CB-CG1 4.42Å; A7-I9 PolarHBondContact O-N 2.97Å |
| 8 | G | 94.3 | Very high | 91.8 | Very high | 69 Ų | 69 | 97.8 Ų | 97.8 | 71% | 0.711 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.9 | 14.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | R5 L6 | R5-G8 PolarHBondContact O-N 3.42Å; R5-G8 VanDerWaalsContact O-N 3.15Å; L6-G8 PolarHBondContact O-N 2.77Å; L6-G8 VanDerWaalsContact O-N 3.15Å |
| 9 | I | 94.4 | Very high | 92 | Very high | 33 Ų | 33 | 94.2 Ų | 94.2 | 17% | 0.169 | 50% | 0.502 | C | S | . | . | trans | -91.5 | 136.3 | 175.9 | 56.3 | 171.3 | 0 | 0 | 0 | 111.4 | W4 A7 R13 Y14 I17 | W4-I9 HydrophobicContact CB-CD1 3.81Å; W4-I9 HydrophobicContact CB-CG1 3.9Å; W4-I9 WeakPolarHBondContact O-CG1 3.24Å; W4-I9 PolarHBondContact O-N 3.27Å; A7-I9 HydrophobicContact CB-CG1 4.42Å; A7-I9 PolarHBondContact O-N 2.97Å; I9-R13 HydrophobicContact CB-CB 4.46Å; I9-R13 HydrophobicContact CG2-CG 4.41Å; I9-Y14 HydrophobicContact CD1-CD2 4.39Å; I9-I17 HydrophobicContact CD1-CD1 4.26Å | ||
| 10 | N | 94.7 | Very high | 92.1 | Very high | 101 Ų | 101 | 94.7 Ų | 94.7 | 54% | 0.54 | 50% | 0.5 | S | S | . | . | trans | -74 | 164.5 | 172.5 | 69.9 | 36.3 | 0 | 0 | 0 | 111.2 | I12 R13 Y14 | N10-I12 VanDerWaalsContact C-N 3.31Å; N10-I12 PolarHBondContact O-N 3.49Å; N10-I12 PolarHBondContact OD1-N 3Å; N10-R13 PolarHBondContact O-N 3.01Å; N10-R13 WeakPolarHBondContact OD1-CB 3.39Å; N10-R13 PolarHBondContact OD1-N 3.13Å; N10-Y14 PolarHBondContact O-N 3.27Å | ||
| 11 | Y | 94.1 | Very high | 92.2 | Very high | 141 Ų | 141 | 92.6 Ų | 92.6 | 55% | 0.553 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.1 | -39.6 | -177.7 | 174.2 | -107.6 | 0 | 0 | 0 | 113.1 | W4 R13 Y14 S15 | W4-Y11 HydrophobicContact CH2-CD2 4.19Å; Y11-R13 VanDerWaalsContact C-N 3.34Å; Y11-R13 PolarHBondContact O-N 3.29Å; Y11-Y14 HydrophobicContact CD2-CD1 4.43Å; Y11-Y14 PolarHBondContact O-N 3.16Å; Y11-S15 WeakPolarHBondContact O-CB 3.44Å; Y11-S15 PolarHBondContact O-N 3.32Å |
| 12 | I | 93.7 | Very high | 93.3 | Very high | 125 Ų | 125 | 87.9 Ų | 87.9 | 64% | 0.641 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -62.3 | -43.3 | 179.5 | -58.5 | -63.1 | 0 | 0 | 0 | 110.7 | N10 A16 | N10-I12 VanDerWaalsContact C-N 3.31Å; N10-I12 PolarHBondContact O-N 3.49Å; N10-I12 PolarHBondContact OD1-N 3Å; I12-A16 WeakPolarHBondContact O-CB 3.41Å; I12-A16 PolarHBondContact O-N 3.43Å |
| 13 | R | 93.4 | Very high | 93.7 | Very high | 163 Ų | 163 | 89 Ų | 89 | 62% | 0.615 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -68 | -42.1 | 177.3 | -170.5 | 170.8 | -173.5 | 179.6 | 2.9 | 111.4 | I9 N10 Y11 A16 I17 | I9-R13 HydrophobicContact CB-CB 4.46Å; I9-R13 HydrophobicContact CG2-CG 4.41Å; N10-R13 PolarHBondContact O-N 3.01Å; N10-R13 WeakPolarHBondContact OD1-CB 3.39Å; N10-R13 PolarHBondContact OD1-N 3.13Å; Y11-R13 VanDerWaalsContact C-N 3.34Å; Y11-R13 PolarHBondContact O-N 3.29Å; R13-A16 PolarHBondContact O-N 2.98Å; R13-I17 HydrophobicContact CG-CD1 4.15Å; R13-I17 WeakPolarHBondContact O-CD1 3.4Å; R13-I17 VanDerWaalsContact O-CG1 3.28Å; R13-I17 WeakPolarHBondContact O-CG1 3.28Å; R13-I17 PolarHBondContact O-N 3.21Å |
| 14 | Y | 95.1 | Very high | 93.7 | Very high | 89 Ų | 89 | 86.8 Ų | 86.8 | 35% | 0.349 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -56.5 | -53.2 | 174.1 | 170.2 | -102.6 | 0 | 0 | 0 | 111.5 | W4 I9 N10 Y11 A16 I17 C18 | W4-Y14 HydrophobicContact CB-CD2 3.56Å; W4-Y14 HydrophobicContact CB-CE2 4.09Å; W4-Y14 HydrophobicContact CB-CG 4.18Å; W4-Y14 AromaticContact CD1-CD2 3.83Å; W4-Y14 AromaticContact CD1-CE2 3.64Å; W4-Y14 AromaticContact CD1-CZ 3.96Å; W4-Y14 HydrophobicContact CD2-CD1 4.48Å; W4-Y14 HydrophobicContact CD2-CD2 4.27Å; W4-Y14 HydrophobicContact CD2-CG 4.12Å; W4-Y14 HydrophobicContact CE3-CG 4.45Å; W4-Y14 AromaticContact CG-CD2 3.64Å; W4-Y14 HydrophobicContact CG-CD2 3.64Å; W4-Y14 AromaticContact CG-CE2 3.94Å; W4-Y14 HydrophobicContact CG-CE2 3.94Å; W4-Y14 AromaticContact CG-CG 3.99Å; W4-Y14 HydrophobicContact CG-CG 3.99Å; I9-Y14 HydrophobicContact CD1-CD2 4.39Å; N10-Y14 PolarHBondContact O-N 3.27Å; Y11-Y14 HydrophobicContact CD2-CD1 4.43Å; Y11-Y14 PolarHBondContact O-N 3.16Å; Y14-A16 VanDerWaalsContact C-N 3.32Å; Y14-A16 PolarHBondContact O-N 3.36Å; Y14-I17 PolarHBondContact O-N 3.33Å; Y14-I17 VanDerWaalsContact O-N 3.12Å; Y14-C18 PolarHBondContact O-N 3.06Å; Y14-C18 VanDerWaalsContact O-N 3.07Å; Y14-C18 PolarHBondContact O-SG 3.39Å |
| 15 | S | 94.5 | Very high | 93.9 | Very high | 53 Ų | 53 | 89.7 Ų | 89.7 | 37% | 0.371 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.1 | -41.8 | 179 | 178.4 | 0 | 0 | 0 | 0 | 112.2 | Y11 I17 C18 A19 | Y11-S15 WeakPolarHBondContact O-CB 3.44Å; Y11-S15 PolarHBondContact O-N 3.32Å; S15-I17 VanDerWaalsContact C-N 3.33Å; S15-I17 PolarHBondContact O-N 2.83Å; S15-C18 PolarHBondContact O-N 3.1Å; S15-A19 WeakPolarHBondContact O-CB 3.49Å; S15-A19 PolarHBondContact O-N 2.94Å |
| 16 | A | 93.6 | Very high | 94 | Very high | 57 Ų | 57 | 85.9 Ų | 85.9 | 47% | 0.471 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.7 | -38.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | I12 R13 Y14 K20 | I12-A16 WeakPolarHBondContact O-CB 3.41Å; I12-A16 PolarHBondContact O-N 3.43Å; R13-A16 PolarHBondContact O-N 2.98Å; Y14-A16 VanDerWaalsContact C-N 3.32Å; Y14-A16 PolarHBondContact O-N 3.36Å; A16-K20 PolarHBondContact O-N 3.3Å |
| 17 | I | 93.6 | Very high | 94 | Very high | 91 Ų | 91 | 87.2 Ų | 87.2 | 47% | 0.467 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66 | -48.8 | 176.8 | -67.6 | 163 | 0 | 0 | 0 | 110.4 | I9 R13 Y14 S15 A19 K20 A21 | I9-I17 HydrophobicContact CD1-CD1 4.26Å; R13-I17 HydrophobicContact CG-CD1 4.15Å; R13-I17 WeakPolarHBondContact O-CD1 3.4Å; R13-I17 VanDerWaalsContact O-CG1 3.28Å; R13-I17 WeakPolarHBondContact O-CG1 3.28Å; R13-I17 PolarHBondContact O-N 3.21Å; Y14-I17 PolarHBondContact O-N 3.33Å; Y14-I17 VanDerWaalsContact O-N 3.12Å; S15-I17 VanDerWaalsContact C-N 3.33Å; S15-I17 PolarHBondContact O-N 2.83Å; I17-A19 VanDerWaalsContact C-N 3.31Å; I17-A19 PolarHBondContact O-N 3.24Å; I17-K20 WeakPolarHBondContact O-CB 2.89Å; I17-K20 PolarHBondContact O-N 3.36Å; I17-K20 VanDerWaalsContact O-N 3.1Å; I17-A21 PolarHBondContact O-N 3.07Å |
| 18 | C | 94.8 | Very high | 94 | Very high | 50 Ų | 50 | 88.6 Ų | 88.6 | 34% | 0.338 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -58.8 | -44.6 | 177.2 | -64.2 | 0 | 0 | 0 | 0 | 111.4 | Y14 S15 K20 A21 V22 | Y14-C18 PolarHBondContact O-N 3.06Å; Y14-C18 VanDerWaalsContact O-N 3.07Å; Y14-C18 PolarHBondContact O-SG 3.39Å; S15-C18 PolarHBondContact O-N 3.1Å; C18-K20 VanDerWaalsContact C-N 3.28Å; C18-K20 PolarHBondContact O-N 3.12Å; C18-A21 PolarHBondContact O-N 3Å; C18-V22 WeakPolarHBondContact O-CG2 3.38Å; C18-V22 PolarHBondContact O-N 2.92Å |
| 19 | A | 94.5 | Very high | 93.9 | Very high | 29 Ų | 29 | 91 Ų | 91 | 24% | 0.24 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -64 | -32.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S15 I17 R23 | S15-A19 WeakPolarHBondContact O-CB 3.49Å; S15-A19 PolarHBondContact O-N 2.94Å; I17-A19 VanDerWaalsContact C-N 3.31Å; I17-A19 PolarHBondContact O-N 3.24Å; A19-R23 VanDerWaalsContact CB-NH1 3.35Å; A19-R23 VanDerWaalsContact O-CG 3.26Å; A19-R23 WeakPolarHBondContact O-CG 3.36Å; A19-R23 PolarHBondContact O-N 3.4Å; A19-R23 VanDerWaalsContact O-N 3.17Å; A19-R23 PolarHBondContact O-NH1 3.37Å; A19-R23 VanDerWaalsContact O-NH1 3.17Å |
| 20 | K | 93.5 | Very high | 93.9 | Very high | 105 Ų | 105 | 95.9 Ų | 95.9 | 46% | 0.457 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.7 | -49.4 | 172.8 | -179.4 | -178 | 168.7 | -177.1 | 0 | 110.8 | A16 I17 C18 V22 R23 E24 | A16-K20 PolarHBondContact O-N 3.3Å; I17-K20 WeakPolarHBondContact O-CB 2.89Å; I17-K20 PolarHBondContact O-N 3.36Å; I17-K20 VanDerWaalsContact O-N 3.1Å; C18-K20 VanDerWaalsContact C-N 3.28Å; C18-K20 PolarHBondContact O-N 3.12Å; K20-V22 VanDerWaalsContact C-N 3.31Å; K20-V22 PolarHBondContact O-N 3.35Å; K20-R23 PolarHBondContact O-N 3.06Å; K20-R23 VanDerWaalsContact O-N 3.12Å; K20-E24 WeakPolarHBondContact CE-OE1 3.44Å; K20-E24 IonicContact NZ-OE1 3.75Å; K20-E24 PolarHBondContact O-N 3.01Å |
| 21 | A | 94.2 | Very high | 93.7 | Very high | 50 Ų | 50 | 95 Ų | 95 | 41% | 0.413 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -56.5 | -45.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | I17 C18 R23 E24 C25 | I17-A21 PolarHBondContact O-N 3.07Å; C18-A21 PolarHBondContact O-N 3Å; A21-R23 VanDerWaalsContact C-N 3.34Å; A21-R23 PolarHBondContact O-N 3.48Å; A21-E24 PolarHBondContact O-N 2.88Å; A21-C25 PolarHBondContact O-N 3.15Å; A21-C25 PolarHBondContact O-SG 3.05Å; A21-C25 VanDerWaalsContact O-SG 3.35Å |
| 22 | V | 94 | Very high | 93.5 | Very high | 99 Ų | 99 | 94.6 Ų | 94.6 | 60% | 0.6 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.6 | -41.7 | 177.2 | 173.8 | 0 | 0 | 0 | 0 | 112.1 | C18 K20 E24 C25 | C18-V22 WeakPolarHBondContact O-CG2 3.38Å; C18-V22 PolarHBondContact O-N 2.92Å; K20-V22 VanDerWaalsContact C-N 3.31Å; K20-V22 PolarHBondContact O-N 3.35Å; V22-E24 VanDerWaalsContact C-N 3.31Å; V22-E24 PolarHBondContact O-N 3.44Å; V22-C25 PolarHBondContact O-N 3.35Å |
| 23 | R | 93.2 | Very high | 93.4 | Very high | 72 Ų | 72 | 92.8 Ų | 92.8 | 27% | 0.272 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.7 | -32.3 | 178.4 | -69.5 | 175.9 | -164.8 | 107.2 | -0.2 | 112.6 | A19 K20 A21 C25 L26 A34 | A19-R23 VanDerWaalsContact CB-NH1 3.35Å; A19-R23 VanDerWaalsContact O-CG 3.26Å; A19-R23 WeakPolarHBondContact O-CG 3.36Å; A19-R23 PolarHBondContact O-N 3.4Å; A19-R23 VanDerWaalsContact O-N 3.17Å; A19-R23 PolarHBondContact O-NH1 3.37Å; A19-R23 VanDerWaalsContact O-NH1 3.17Å; K20-R23 PolarHBondContact O-N 3.06Å; K20-R23 VanDerWaalsContact O-N 3.12Å; A21-R23 VanDerWaalsContact C-N 3.34Å; A21-R23 PolarHBondContact O-N 3.48Å; R23-C25 PolarHBondContact O-N 3.36Å; R23-L26 HydrophobicContact CB-CD1 4.42Å; R23-L26 HydrophobicContact CG-CD1 4.45Å; R23-L26 WeakPolarHBondContact O-CB 3.44Å; R23-L26 PolarHBondContact O-N 3.38Å; R23-A34 HydrophobicContact CB-CB 4.18Å; R23-A34 HydrophobicContact CG-CB 3.96Å |
| 24 | E | 92.2 | Very high | 93.3 | Very high | 100 Ų | 100 | 85.5 Ų | 85.5 | 47% | 0.467 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -68.2 | -26.9 | 177.7 | -74.7 | 176.5 | 171.1 | 0 | 0 | 112.6 | K20 A21 V22 K31 | K20-E24 WeakPolarHBondContact CE-OE1 3.44Å; K20-E24 IonicContact NZ-OE1 3.75Å; K20-E24 PolarHBondContact O-N 3.01Å; A21-E24 PolarHBondContact O-N 2.88Å; V22-E24 VanDerWaalsContact C-N 3.31Å; V22-E24 PolarHBondContact O-N 3.44Å; E24-K31 PolarHBondContact O-NZ 2.84Å |
| 25 | C | 94.6 | Very high | 93 | Very high | 114 Ų | 114 | 84.1 Ų | 84.1 | 77% | 0.77 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | -4 | 175.3 | -60.3 | 0 | 0 | 0 | 0 | 114.4 | A21 V22 R23 | A21-C25 PolarHBondContact O-N 3.15Å; A21-C25 PolarHBondContact O-SG 3.05Å; A21-C25 VanDerWaalsContact O-SG 3.35Å; V22-C25 PolarHBondContact O-N 3.35Å; R23-C25 PolarHBondContact O-N 3.36Å |
| 26 | L | 94.6 | Very high | 92.6 | Very high | 69 Ų | 69 | 89.1 Ų | 89.1 | 36% | 0.361 | 48% | 0.477 | S | S | . | . | S | Bend | trans | -70.6 | 152.5 | 176.9 | -71.1 | 170.1 | 0 | 0 | 0 | 111.8 | R23 K31 A34 | R23-L26 HydrophobicContact CB-CD1 4.42Å; R23-L26 HydrophobicContact CG-CD1 4.45Å; R23-L26 WeakPolarHBondContact O-CB 3.44Å; R23-L26 PolarHBondContact O-N 3.38Å; L26-K31 HydrophobicContact CB-CB 4.47Å; L26-A34 HydrophobicContact CD1-CB 3.77Å |
| 27 | K | 94.3 | Very high | 92.3 | Very high | 147 Ų | 147 | 95.1 Ų | 95.1 | 64% | 0.639 | 49% | 0.488 | S | S | * | . | trans | -57.5 | 151 | 168.7 | -66.8 | 178.6 | 173.6 | 178.1 | 0 | 110.8 | E29 Y30 K31 | K27-E29 HydrophobicContact CB-CG 4.15Å; K27-E29 WeakPolarHBondContact CD-OE1 3.26Å; K27-E29 PolarHBondContact O-N 3.17Å; K27-Y30 HydrophobicContact CB-CD2 4.11Å; K27-Y30 PolarHBondContact O-N 3.22Å; K27-K31 WeakPolarHBondContact O-CB 3.43Å; K27-K31 PolarHBondContact O-N 3.36Å | ||
| 28 | S | 91.9 | Very high | 91.6 | Very high | 103 Ų | 103 | 94.5 Ų | 94.5 | 72% | 0.72 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -51.8 | -41.4 | -175.3 | 49.1 | 0 | 0 | 0 | 0 | 113.3 | Y30 K31 | S28-Y30 VanDerWaalsContact C-N 3.3Å; S28-Y30 PolarHBondContact O-N 3.12Å; S28-K31 PolarHBondContact O-N 3.17Å |
| 29 | E | 93.3 | Very high | 90.5 | Very high | 119 Ų | 119 | 94.7 Ų | 94.7 | 56% | 0.556 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -57.6 | -37.4 | 178.4 | 66.3 | -162.9 | 157.3 | 0 | 0 | 113.4 | K27 | K27-E29 HydrophobicContact CB-CG 4.15Å; K27-E29 WeakPolarHBondContact CD-OE1 3.26Å; K27-E29 PolarHBondContact O-N 3.17Å |
| 30 | Y | 93.6 | Very high | 89.6 | Confident | 137 Ų | 137 | 102.5 Ų | 102.5 | 54% | 0.537 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -94.2 | -24.5 | 179.3 | -53.8 | -60.5 | 0 | 0 | 0 | 112.9 | K27 S28 L32 D33 A34 | K27-Y30 HydrophobicContact CB-CD2 4.11Å; K27-Y30 PolarHBondContact O-N 3.22Å; S28-Y30 VanDerWaalsContact C-N 3.3Å; S28-Y30 PolarHBondContact O-N 3.12Å; Y30-L32 VanDerWaalsContact C-N 3.29Å; Y30-L32 PolarHBondContact O-N 3.26Å; Y30-D33 PolarHBondContact O-N 3.43Å; Y30-A34 WeakPolarHBondContact O-CB 3.42Å; Y30-A34 PolarHBondContact O-N 3.3Å |
| 31 | K | 92.1 | Very high | 89 | Confident | 81 Ų | 81 | 106.9 Ų | 106.9 | 35% | 0.352 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.8 | -35.7 | -175.9 | -170.1 | 166.1 | -179.1 | 165.8 | 0 | 111.9 | E24 L26 K27 S28 A34 S35 | E24-K31 PolarHBondContact O-NZ 2.84Å; L26-K31 HydrophobicContact CB-CB 4.47Å; K27-K31 WeakPolarHBondContact O-CB 3.43Å; K27-K31 PolarHBondContact O-N 3.36Å; S28-K31 PolarHBondContact O-N 3.17Å; K31-A34 PolarHBondContact O-N 3.31Å; K31-S35 VanDerWaalsContact O-CB 3.28Å; K31-S35 WeakPolarHBondContact O-CB 3.28Å; K31-S35 PolarHBondContact O-N 3.19Å; K31-S35 PolarHBondContact O-OG 3.39Å |
| 32 | L | 89.6 | Confident | 88.7 | Confident | 134 Ų | 134 | 109.7 Ų | 109.7 | 70% | 0.702 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -60.3 | -49.4 | 177.4 | -111.3 | 164.6 | 0 | 0 | 0 | 111.9 | Y30 S35 | Y30-L32 VanDerWaalsContact C-N 3.29Å; Y30-L32 PolarHBondContact O-N 3.26Å; L32-S35 PolarHBondContact O-N 3.04Å |
| 33 | D | 91.2 | Very high | 88.2 | Confident | 86 Ų | 86 | 113.8 Ų | 113.8 | 46% | 0.46 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -71.1 | -38.2 | -179.8 | -162.6 | 54.3 | 0 | 0 | 0 | 112.1 | Y30 S35 K36 | Y30-D33 PolarHBondContact O-N 3.43Å; D33-S35 VanDerWaalsContact C-N 3.29Å; D33-S35 PolarHBondContact O-N 2.66Å; D33-K36 PolarHBondContact O-N 2.9Å; D33-K36 IonicContact OD1-NZ 2.82Å; D33-K36 PolarHBondContact OD1-NZ 3.37Å |
| 34 | A | 92.1 | Very high | 87.9 | Confident | 11 Ų | 11 | 117.3 Ų | 117.3 | 9% | 0.091 | 59% | 0.593 | C | S | . | * | H | α-helix | trans | -62.5 | -35 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | R23 L26 Y30 K31 K36 R37 | R23-A34 HydrophobicContact CB-CB 4.18Å; R23-A34 HydrophobicContact CG-CB 3.96Å; L26-A34 HydrophobicContact CD1-CB 3.77Å; Y30-A34 WeakPolarHBondContact O-CB 3.42Å; Y30-A34 PolarHBondContact O-N 3.3Å; K31-A34 PolarHBondContact O-N 3.31Å; A34-K36 VanDerWaalsContact C-N 3.31Å; A34-K36 PolarHBondContact O-N 3.46Å; A34-R37 PolarHBondContact O-N 2.92Å |
| 35 | S | 87.1 | Confident | 87.8 | Confident | 60 Ų | 60 | 115.8 Ų | 115.8 | 42% | 0.42 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -68.4 | -28.1 | -178 | -63.9 | 0 | 0 | 0 | 0 | 113 | K31 L32 D33 R37 V38 | K31-S35 VanDerWaalsContact O-CB 3.28Å; K31-S35 WeakPolarHBondContact O-CB 3.28Å; K31-S35 PolarHBondContact O-N 3.19Å; K31-S35 PolarHBondContact O-OG 3.39Å; L32-S35 PolarHBondContact O-N 3.04Å; D33-S35 VanDerWaalsContact C-N 3.29Å; D33-S35 PolarHBondContact O-N 2.66Å; S35-R37 PolarHBondContact O-N 3.5Å; S35-R37 VanDerWaalsContact O-N 3.08Å; S35-V38 WeakPolarHBondContact O-CB 3.37Å; S35-V38 PolarHBondContact O-N 3.08Å |
| 36 | K | 87.4 | Confident | 87.5 | Confident | 158 Ų | 158 | 114.3 Ų | 114.3 | 69% | 0.687 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.7 | -24.3 | 176 | -62.6 | 174.4 | -170.3 | 160.1 | 0 | 113.1 | D33 A34 V38 | D33-K36 PolarHBondContact O-N 2.9Å; D33-K36 IonicContact OD1-NZ 2.82Å; D33-K36 PolarHBondContact OD1-NZ 3.37Å; A34-K36 VanDerWaalsContact C-N 3.31Å; A34-K36 PolarHBondContact O-N 3.46Å; K36-V38 VanDerWaalsContact C-N 3.26Å; K36-V38 PolarHBondContact O-N 3.31Å |
| 37 | R | 85.8 | Confident | 87.4 | Confident | 183 Ų | 183 | 119 Ų | 119 | 69% | 0.691 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.9 | -12.1 | 178.2 | -53.4 | -175.3 | -169.8 | -151.4 | 3.5 | 112.8 | A34 S35 | A34-R37 PolarHBondContact O-N 2.92Å; S35-R37 PolarHBondContact O-N 3.5Å; S35-R37 VanDerWaalsContact O-N 3.08Å |
| 38 | V | 79.6 | Confident | 87.3 | Confident | 78 Ų | 78 | 118.5 Ų | 118.5 | 47% | 0.473 | 59% | 0.586 | S | S | . | * | S | Bend | trans | -98.2 | 96.5 | -176.1 | -175.5 | 0 | 0 | 0 | 0 | 108.8 | S35 K36 | S35-V38 WeakPolarHBondContact O-CB 3.37Å; S35-V38 PolarHBondContact O-N 3.08Å; K36-V38 VanDerWaalsContact C-N 3.26Å; K36-V38 PolarHBondContact O-N 3.31Å |
| 39 | G | 72.3 | Confident | 87.3 | Confident | 53 Ų | 53 | 120.4 Ų | 120.4 | 55% | 0.546 | 59% | 0.588 | S | S | . | * | trans | 164.3 | 130.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 40 | K | 75.5 | Confident | 87.2 | Confident | 194 Ų | 194 | 117.9 Ų | 117.9 | 84% | 0.843 | 59% | 0.594 | S | S | * | * | trans | -116.4 | 106.7 | 169 | -66.8 | -171.6 | -178.8 | -173 | 0 | 107.5 | V42 | K40-V42 PolarHBondContact O-N 3.43Å; K40-V42 VanDerWaalsContact O-N 3.15Å | ||
| 41 | H | 81.1 | Confident | 87 | Confident | 196 Ų | 196 | 118.8 Ų | 118.8 | 91% | 0.907 | 60% | 0.601 | S | S | * | * | trans | -84.1 | 33.2 | 174.6 | -60.1 | -75.4 | 0 | 0 | 0 | 111.9 | ||||
| 42 | V | 86.5 | Confident | 87 | Confident | 110 Ų | 110 | 118.4 Ų | 118.4 | 67% | 0.667 | 61% | 0.606 | S | S | * | * | trans | -102.3 | 119.5 | -175.2 | -178.4 | 0 | 0 | 0 | 0 | 108.8 | K40 | K40-V42 PolarHBondContact O-N 3.43Å; K40-V42 VanDerWaalsContact O-N 3.15Å | ||
| 43 | K | 85.3 | Confident | 86.9 | Confident | 185 Ų | 185 | 115.2 Ų | 115.2 | 80% | 0.804 | 59% | 0.589 | S | S | * | * | trans | -85.3 | 111.3 | 169.4 | -175.8 | 176.3 | 179.2 | -179.4 | 0 | 108.9 | ||||
| 44 | L | 86.3 | Confident | 86.3 | Confident | 146 Ų | 146 | 122 Ų | 122 | 76% | 0.764 | 61% | 0.609 | S | S | * | * | trans | -76 | 129.8 | 167.6 | -90 | 111.5 | 0 | 0 | 0 | 109.6 | ||||
| 45 | T | 89.2 | Confident | 84.9 | Confident | 68 Ų | 68 | 126.5 Ų | 126.5 | 42% | 0.417 | 63% | 0.631 | S | S | . | * | trans | -118.6 | 119.5 | 171.1 | -52.4 | 0 | 0 | 0 | 0 | 107.2 | W47 P52 | T45-W47 VanDerWaalsContact O-CD1 3.27Å; T45-P52 HydrophobicContact CG2-CB 3.67Å | ||
| 46 | N | 89.5 | Confident | 83.5 | Confident | 82 Ų | 82 | 129.7 Ų | 129.7 | 44% | 0.439 | 65% | 0.648 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -81.5 | 139.4 | 174.7 | -72.1 | 45.7 | 0 | 0 | 0 | 108.7 | P52 I53 N55 | N46-P52 CarbonylContact O-C 3.57Å; N46-I53 PolarHBondContact O-N 3.17Å; N46-N55 PolarHBondContact ND2-ND2 3.37Å |
| 47 | W | 91.4 | Very high | 81.6 | Confident | 169 Ų | 169 | 130 Ų | 130 | 64% | 0.64 | 68% | 0.68 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -121.4 | 140.5 | 178.9 | -71.4 | 72.2 | 0 | 0 | 0 | 109.4 | T45 G50 K51 P52 | T45-W47 VanDerWaalsContact O-CD1 3.27Å; W47-G50 WeakPolarHBondContact CZ3-O 3.42Å; W47-K51 WeakPolarHBondContact CA-O 3.36Å; W47-P52 HydrophobicContact CD2-CB 4.18Å; W47-P52 HydrophobicContact CH2-CB 4.43Å; W47-P52 HydrophobicContact CH2-CG 4.3Å; W47-P52 HydrophobicContact CZ2-CB 4.08Å; W47-P52 HydrophobicContact CZ2-CG 4.38Å |
| 48 | K | 92.5 | Very high | 81.4 | Confident | 135 Ų | 135 | 127.4 Ų | 127.4 | 59% | 0.587 | 68% | 0.679 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -146.4 | 138.5 | 172 | -170.8 | -174.4 | 176.5 | -174.8 | 0 | 108.7 | G50 K51 I53 | K48-G50 PolarHBondContact O-N 3.3Å; K48-G50 VanDerWaalsContact O-N 3.13Å; K48-K51 PolarHBondContact N-O 3.01Å; K48-K51 PolarHBondContact O-N 2.91Å; K48-K51 VanDerWaalsContact O-O 3.09Å; K48-I53 HydrophobicContact CB-CD1 3.25Å; K48-I53 HydrophobicContact CB-CG1 3.74Å; K48-I53 HydrophobicContact CD-CD1 4.22Å; K48-I53 HydrophobicContact CG-CD1 4.33Å |
| 49 | D | 92.9 | Very high | 81.5 | Confident | 143 Ų | 143 | 129.9 Ų | 129.9 | 77% | 0.765 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 51 | 39.7 | 178.8 | -50.4 | -38.6 | 0 | 0 | 0 | 112.9 | K51 | D49-K51 VanDerWaalsContact C-N 3.27Å; D49-K51 PolarHBondContact O-N 3.33Å |
| 50 | G | 90.3 | Very high | 82 | Confident | 66 Ų | 66 | 134.2 Ų | 134.2 | 68% | 0.68 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 75.8 | 3.5 | 178 | 0 | 0 | 0 | 0 | 0 | 115.8 | W47 K48 | W47-G50 WeakPolarHBondContact CZ3-O 3.42Å; K48-G50 PolarHBondContact O-N 3.3Å; K48-G50 VanDerWaalsContact O-N 3.13Å |
| 51 | K | 90.3 | Very high | 82.4 | Confident | 157 Ų | 157 | 130.7 Ų | 130.7 | 68% | 0.683 | 69% | 0.689 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -119.5 | 143.6 | 178.7 | -67.3 | 178.9 | -177.4 | 175.2 | 0 | 111.6 | W47 K48 D49 I53 | W47-K51 WeakPolarHBondContact CA-O 3.36Å; K48-K51 PolarHBondContact N-O 3.01Å; K48-K51 PolarHBondContact O-N 2.91Å; K48-K51 VanDerWaalsContact O-O 3.09Å; D49-K51 VanDerWaalsContact C-N 3.27Å; D49-K51 PolarHBondContact O-N 3.33Å; K51-I53 PolarHBondContact O-N 3.48Å |
| 52 | P | 90.9 | Very high | 82.5 | Confident | 72 Ų | 72 | 126.6 Ų | 126.6 | 47% | 0.468 | 68% | 0.676 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -68.2 | 121.4 | 172.9 | 27.8 | -31.4 | 0 | 0 | 0 | 108.8 | T45 N46 W47 R54 | T45-P52 HydrophobicContact CG2-CB 3.67Å; N46-P52 CarbonylContact O-C 3.57Å; W47-P52 HydrophobicContact CD2-CB 4.18Å; W47-P52 HydrophobicContact CH2-CB 4.43Å; W47-P52 HydrophobicContact CH2-CG 4.3Å; W47-P52 HydrophobicContact CZ2-CB 4.08Å; W47-P52 HydrophobicContact CZ2-CG 4.38Å; P52-R54 PolarHBondContact O-N 3.02Å |
| 53 | I | 88.6 | Confident | 82.2 | Confident | 67 Ų | 67 | 127.7 Ų | 127.7 | 34% | 0.344 | 68% | 0.676 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -78.6 | 117.6 | 171 | -49.8 | 163.7 | 0 | 0 | 0 | 106.5 | N46 K48 K51 N55 | N46-I53 PolarHBondContact O-N 3.17Å; K48-I53 HydrophobicContact CB-CD1 3.25Å; K48-I53 HydrophobicContact CB-CG1 3.74Å; K48-I53 HydrophobicContact CD-CD1 4.22Å; K48-I53 HydrophobicContact CG-CD1 4.33Å; K51-I53 PolarHBondContact O-N 3.48Å; I53-N55 VanDerWaalsContact C-N 3.28Å; I53-N55 PolarHBondContact O-N 3.36Å |
| 54 | R | 77.3 | Confident | 82 | Confident | 229 Ų | 229 | 123.6 Ų | 123.6 | 86% | 0.864 | 67% | 0.667 | S | S | * | * | trans | -73.1 | 92.8 | 165 | -137.1 | 179.4 | -177.1 | 166.5 | -0.8 | 106.1 | P52 V56 | P52-R54 PolarHBondContact O-N 3.02Å; R54-V56 PolarHBondContact O-N 3.38Å | ||
| 55 | N | 63.9 | Low | 81.6 | Confident | 105 Ų | 105 | 121.9 Ų | 121.9 | 56% | 0.561 | 66% | 0.66 | S | S | * | * | trans | -67.1 | 91.9 | 166.1 | -80.9 | -24 | 0 | 0 | 0 | 106.6 | N46 I53 A57 | N46-N55 PolarHBondContact ND2-ND2 3.37Å; I53-N55 VanDerWaalsContact C-N 3.28Å; I53-N55 PolarHBondContact O-N 3.36Å; N55-A57 PolarHBondContact O-N 2.82Å | ||
| 56 | V | 56.1 | Low | 81 | Confident | 128 Ų | 128 | 126.4 Ų | 126.4 | 78% | 0.776 | 68% | 0.68 | S | S | * | * | trans | -72.6 | 101.8 | 160.8 | -176.3 | 0 | 0 | 0 | 0 | 104.1 | R54 | R54-V56 PolarHBondContact O-N 3.38Š| ||
| 57 | A | 48.4 | Very low | 80.2 | Confident | 164 Ų | 164 | 130.5 Ų | 130.5 | 100% | 1.355 | 70% | 0.702 | S | S | * | * | trans | -77.1 | 0 | 162.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | N55 | N55-A57 PolarHBondContact O-N 2.82Š|
Retrieved 57 of 57 residues in 29.6 ms
(Link to these results)