| 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 | 47 | Very low | 52.1 | Low | 154 Ų | 154 | 60.8 Ų | 60.8 | 76% | 0.759 | 31% | 0.311 | S | S | * | . | 0 | 109.6 | 0 | -163.6 | 164.5 | 69.3 | 0 | 0 | 108.3 | E5 L6 L9 | M1-E5 WeakPolarHBondContact CA-OE2 3.29Å; M1-E5 HydrophobicContact CG-CB 4.1Å; M1-L6 HydrophobicContact CE-CD1 3.81Å; M1-L6 HydrophobicContact CE-CD2 3.7Å; M1-L6 HydrophobicContact CE-CG 3.51Å; M1-L6 HydrophobicContact CG-CG 4.21Å; M1-L6 HydrophobicContact SD-CG 4.23Å; M1-L9 HydrophobicContact SD-CD1 3.83Å | |||
| 2 | T | 51.2 | Low | 52.4 | Low | 71 Ų | 71 | 67.8 Ų | 67.8 | 44% | 0.436 | 34% | 0.341 | S | S | . | . | trans | -75.8 | 156.2 | 179.6 | 61.3 | 0 | 0 | 0 | 0 | 110.6 | H4 E5 L6 | T2-H4 PolarHBondContact O-N 3.26Å; T2-E5 PolarHBondContact N-OE2 2.86Å; T2-E5 WeakPolarHBondContact O-CB 3.34Å; T2-E5 PolarHBondContact O-N 3.07Å; T2-E5 VanDerWaalsContact O-N 3.11Å; T2-E5 WeakPolarHBondContact OG1-CB 2.97Å; T2-E5 WeakPolarHBondContact OG1-CG 3.23Å; T2-E5 PolarHBondContact OG1-N 2.85Å; T2-E5 VanDerWaalsContact OG1-N 3.15Å; T2-E5 PolarHBondContact OG1-OE1 2.98Å; T2-L6 PolarHBondContact O-N 2.8Å | ||
| 3 | M | 48.4 | Very low | 52.8 | Low | 63 Ų | 63 | 71.9 Ų | 71.9 | 31% | 0.31 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -58.9 | -26.9 | 173.8 | -87.7 | -72.1 | -73.9 | 0 | 0 | 112.3 | L6 G7 F27 L30 I67 | M3-L6 HydrophobicContact SD-CD1 4.36Å; M3-G7 PolarHBondContact O-N 2.82Å; M3-F27 HydrophobicContact CE-CD1 4.28Å; M3-F27 HydrophobicContact CE-CE1 4.14Å; M3-L30 HydrophobicContact CE-CD1 4.31Å; M3-I67 HydrophobicContact CE-CD1 4.24Å; M3-I67 HydrophobicContact CE-CG1 3.9Å |
| 4 | H | 51.6 | Low | 53 | Low | 97 Ų | 97 | 67.1 Ų | 67.1 | 45% | 0.449 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -69.6 | -47.2 | 172.9 | -175.3 | 68.5 | 0 | 0 | 0 | 111.7 | T2 L6 G7 L8 Y31 | T2-H4 PolarHBondContact O-N 3.26Å; H4-L6 VanDerWaalsContact C-N 3.28Å; H4-L6 PolarHBondContact O-N 2.82Å; H4-G7 PolarHBondContact O-N 2.99Å; H4-L8 WeakPolarHBondContact NE2-CD1 3.46Å; H4-L8 WeakPolarHBondContact O-CG 3.4Å; H4-L8 PolarHBondContact O-N 2.68Å; H4-Y31 HydrophobicContact CB-CD2 4.31Å; H4-Y31 HydrophobicContact CB-CE2 4.41Å |
| 5 | E | 52.3 | Low | 53.1 | Low | 88 Ų | 88 | 70.7 Ų | 70.7 | 41% | 0.411 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -59.8 | -39.1 | 172.5 | -74.6 | 153.7 | -147.1 | 0 | 0 | 111.6 | M1 T2 L8 L9 | M1-E5 WeakPolarHBondContact CA-OE2 3.29Å; M1-E5 HydrophobicContact CG-CB 4.1Å; T2-E5 PolarHBondContact N-OE2 2.86Å; T2-E5 WeakPolarHBondContact O-CB 3.34Å; T2-E5 PolarHBondContact O-N 3.07Å; T2-E5 VanDerWaalsContact O-N 3.11Å; T2-E5 WeakPolarHBondContact OG1-CB 2.97Å; T2-E5 WeakPolarHBondContact OG1-CG 3.23Å; T2-E5 PolarHBondContact OG1-N 2.85Å; T2-E5 VanDerWaalsContact OG1-N 3.15Å; T2-E5 PolarHBondContact OG1-OE1 2.98Å; E5-L8 PolarHBondContact O-N 2.87Å; E5-L9 VanDerWaalsContact O-CB 3.24Å; E5-L9 WeakPolarHBondContact O-CB 3.49Å; E5-L9 WeakPolarHBondContact O-CD1 3.4Å; E5-L9 WeakPolarHBondContact O-CG 3.46Å; E5-L9 PolarHBondContact O-N 3.3Å |
| 6 | L | 51.1 | Low | 53.6 | Low | 23 Ų | 23 | 71.1 Ų | 71.1 | 12% | 0.12 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.3 | -48.2 | 173 | -102.1 | 160.4 | 0 | 0 | 0 | 112.1 | M1 T2 M3 H4 L8 L9 L10 E63 | M1-L6 HydrophobicContact CE-CD1 3.81Å; M1-L6 HydrophobicContact CE-CD2 3.7Å; M1-L6 HydrophobicContact CE-CG 3.51Å; M1-L6 HydrophobicContact CG-CG 4.21Å; M1-L6 HydrophobicContact SD-CG 4.23Å; T2-L6 PolarHBondContact O-N 2.8Å; M3-L6 HydrophobicContact SD-CD1 4.36Å; H4-L6 VanDerWaalsContact C-N 3.28Å; H4-L6 PolarHBondContact O-N 2.82Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L8 PolarHBondContact O-N 3.39Å; L6-L9 PolarHBondContact O-N 3.48Å; L6-L10 HydrophobicContact CD2-CD1 4.43Å; L6-L10 WeakPolarHBondContact O-CB 3.33Å; L6-L10 VanDerWaalsContact O-CD1 3.31Å; L6-L10 WeakPolarHBondContact O-CD1 3.32Å; L6-L10 WeakPolarHBondContact O-CG 3.29Å; L6-L10 PolarHBondContact O-N 2.77Å; L6-E63 HydrophobicContact CD2-CG 3.92Å; L6-E63 VanDerWaalsContact CD2-OE2 3.24Å; L6-E63 WeakPolarHBondContact CD2-OE2 3.35Å |
| 7 | G | 54.8 | Low | 53.6 | Low | 3 Ų | 3 | 78.1 Ų | 78.1 | 3% | 0.031 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -58.7 | -44.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | M3 H4 L10 V11 | M3-G7 PolarHBondContact O-N 2.82Å; H4-G7 PolarHBondContact O-N 2.99Å; G7-L10 PolarHBondContact O-N 3.15Å; G7-V11 WeakPolarHBondContact O-CB 3.44Å; G7-V11 WeakPolarHBondContact O-CG2 3.47Å; G7-V11 PolarHBondContact O-N 3.39Å |
| 8 | L | 56.2 | Low | 54.1 | Low | 71 Ų | 71 | 78.6 Ų | 78.6 | 37% | 0.372 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -65.3 | -46.2 | 176.1 | -74 | 171.4 | 0 | 0 | 0 | 112.4 | H4 E5 L6 L10 V11 E12 | H4-L8 WeakPolarHBondContact NE2-CD1 3.46Å; H4-L8 WeakPolarHBondContact O-CG 3.4Å; H4-L8 PolarHBondContact O-N 2.68Å; E5-L8 PolarHBondContact O-N 2.87Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L8 PolarHBondContact O-N 3.39Å; L8-L10 VanDerWaalsContact C-N 3.3Å; L8-L10 PolarHBondContact O-N 3.24Å; L8-V11 WeakPolarHBondContact O-CB 3.47Å; L8-V11 PolarHBondContact O-N 2.8Å; L8-E12 WeakPolarHBondContact O-CG 3.29Å; L8-E12 PolarHBondContact O-N 2.85Å |
| 9 | L | 55.5 | Low | 54.2 | Low | 77 Ų | 77 | 76.5 Ų | 76.5 | 40% | 0.403 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.4 | -40.1 | 176.8 | -89.6 | 158.3 | 0 | 0 | 0 | 112.4 | M1 E5 L6 V11 K13 | M1-L9 HydrophobicContact SD-CD1 3.83Å; E5-L9 VanDerWaalsContact O-CB 3.24Å; E5-L9 WeakPolarHBondContact O-CB 3.49Å; E5-L9 WeakPolarHBondContact O-CD1 3.4Å; E5-L9 WeakPolarHBondContact O-CG 3.46Å; E5-L9 PolarHBondContact O-N 3.3Å; L6-L9 PolarHBondContact O-N 3.48Å; L9-V11 VanDerWaalsContact C-N 3.32Å; L9-K13 PolarHBondContact O-N 2.79Å |
| 10 | L | 50.4 | Low | 54.4 | Low | 10 Ų | 10 | 77.4 Ų | 77.4 | 5% | 0.052 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -68.8 | -33.3 | 175.9 | -70.7 | 165 | 0 | 0 | 0 | 111.6 | L6 G7 L8 S14 F27 Y60 E63 | L6-L10 HydrophobicContact CD2-CD1 4.43Å; L6-L10 WeakPolarHBondContact O-CB 3.33Å; L6-L10 VanDerWaalsContact O-CD1 3.31Å; L6-L10 WeakPolarHBondContact O-CD1 3.32Å; L6-L10 WeakPolarHBondContact O-CG 3.29Å; L6-L10 PolarHBondContact O-N 2.77Å; G7-L10 PolarHBondContact O-N 3.15Å; L8-L10 VanDerWaalsContact C-N 3.3Å; L8-L10 PolarHBondContact O-N 3.24Å; L10-S14 PolarHBondContact O-OG 3.38Å; L10-F27 HydrophobicContact CB-CE2 4.31Å; L10-F27 HydrophobicContact CD1-CE1 4.08Å; L10-F27 HydrophobicContact CD1-CE2 3.54Å; L10-F27 HydrophobicContact CD1-CZ 3.23Å; L10-Y60 HydrophobicContact CB-CD1 4.45Å; L10-Y60 HydrophobicContact CB-CE1 3.99Å; L10-Y60 HydrophobicContact CD2-CD1 3.75Å; L10-Y60 HydrophobicContact CD2-CE1 3.8Å; L10-Y60 WeakPolarHBondContact O-CE1 3.49Å; L10-Y60 PolarHBondContact O-OH 3.17Å; L10-E63 HydrophobicContact CD1-CB 3.7Å; L10-E63 HydrophobicContact CD1-CG 3.77Å; L10-E63 HydrophobicContact CD2-CB 4.19Å; L10-E63 HydrophobicContact CD2-CG 3.8Å; L10-E63 HydrophobicContact CG-CG 4.24Å |
| 11 | V | 54.1 | Low | 54.6 | Low | 12 Ų | 12 | 79.2 Ų | 79.2 | 7% | 0.073 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -72.9 | -41.1 | 179.3 | 163.6 | 0 | 0 | 0 | 0 | 111.1 | G7 L8 L9 S14 R20 L24 | G7-V11 WeakPolarHBondContact O-CB 3.44Å; G7-V11 WeakPolarHBondContact O-CG2 3.47Å; G7-V11 PolarHBondContact O-N 3.39Å; L8-V11 WeakPolarHBondContact O-CB 3.47Å; L8-V11 PolarHBondContact O-N 2.8Å; L9-V11 VanDerWaalsContact C-N 3.32Å; V11-S14 PolarHBondContact O-N 3.37Å; V11-S14 PolarHBondContact O-OG 3.42Å; V11-R20 HydrophobicContact CB-CG 4.35Å; V11-R20 HydrophobicContact CG1-CG 3.53Å; V11-R20 PolarHBondContact O-NE 2.97Å; V11-R20 VanDerWaalsContact O-NE 3.09Å; V11-L24 HydrophobicContact CB-CD2 4.12Å; V11-L24 HydrophobicContact CB-CG 4.1Å; V11-L24 HydrophobicContact CG1-CD1 3.69Å; V11-L24 HydrophobicContact CG1-CD2 3.75Å; V11-L24 HydrophobicContact CG1-CG 3.58Å; V11-L24 HydrophobicContact CG2-CB 4.3Å; V11-L24 HydrophobicContact CG2-CD1 4.42Å; V11-L24 HydrophobicContact CG2-CD2 3.58Å; V11-L24 HydrophobicContact CG2-CG 3.41Å; V11-L24 VanDerWaalsContact CG2-CG 3.41Å |
| 12 | E | 56.5 | Low | 55.2 | Low | 145 Ų | 145 | 75.9 Ų | 75.9 | 68% | 0.678 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -67.1 | -35 | 178.9 | -73.1 | -179.4 | 166.9 | 0 | 0 | 112.8 | L8 S14 | L8-E12 WeakPolarHBondContact O-CG 3.29Å; L8-E12 PolarHBondContact O-N 2.85Å; E12-S14 VanDerWaalsContact C-N 3.34Å; E12-S14 PolarHBondContact O-N 2.9Å |
| 13 | K | 57.3 | Low | 55.7 | Low | 121 Ų | 121 | 73.2 Ų | 73.2 | 53% | 0.526 | 37% | 0.367 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | -3.4 | 179.5 | -76.7 | -173.7 | 165.1 | -169.4 | 0 | 115.1 | L9 E59 Y60 | L9-K13 PolarHBondContact O-N 2.79Å; K13-E59 VanDerWaalsContact CD-OE2 3.29Å; K13-E59 WeakPolarHBondContact CD-OE2 3.5Å; K13-E59 VanDerWaalsContact NZ-CD 3.34Å; K13-E59 IonicContact NZ-OE1 3.95Å; K13-E59 PolarHBondContact NZ-OE1 3.29Å; K13-E59 IonicContact NZ-OE2 2.99Å; K13-E59 PolarHBondContact NZ-OE2 2.74Å; K13-Y60 WeakPolarHBondContact CB-OH 3.3Å; K13-Y60 PolarHBondContact O-OH 3.28Å |
| 14 | S | 56.1 | Low | 56.1 | Low | 5 Ų | 5 | 73.8 Ų | 73.8 | 4% | 0.035 | 37% | 0.371 | C | S | . | . | trans | -94.3 | 125.7 | -171.4 | 57.7 | 0 | 0 | 0 | 0 | 111 | L10 V11 E12 R20 Y60 | L10-S14 PolarHBondContact O-OG 3.38Å; V11-S14 PolarHBondContact O-N 3.37Å; V11-S14 PolarHBondContact O-OG 3.42Å; E12-S14 VanDerWaalsContact C-N 3.34Å; E12-S14 PolarHBondContact O-N 2.9Å; S14-R20 PolarHBondContact O-NH2 2.92Å; S14-Y60 WeakPolarHBondContact CA-OH 3.35Å; S14-Y60 VanDerWaalsContact CB-OH 3.22Å; S14-Y60 WeakPolarHBondContact CB-OH 3.5Å; S14-Y60 PolarHBondContact N-OH 2.84Å | ||
| 15 | S | 53.8 | Low | 56.6 | Low | 120 Ų | 120 | 72.7 Ų | 72.7 | 84% | 0.839 | 37% | 0.366 | S | S | * | . | trans | -90.7 | 7.8 | -166.6 | 52.6 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 16 | T | 60.7 | Low | 57 | Low | 77 Ų | 77 | 68.9 Ų | 68.9 | 47% | 0.472 | 35% | 0.349 | S | S | . | . | S | Bend | trans | -141.7 | 131 | 174 | 51.6 | 0 | 0 | 0 | 0 | 113 | V19 R20 | T16-V19 PolarHBondContact O-N 2.95Å; T16-V19 VanDerWaalsContact O-N 3.16Å; T16-R20 PolarHBondContact O-N 3.41Å |
| 17 | Y | 54.2 | Low | 57.6 | Low | 191 Ų | 191 | 68.8 Ų | 68.8 | 75% | 0.749 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -52.6 | -36.4 | -173.3 | -171 | -103.5 | 0 | 0 | 0 | 115.8 | K21 | Y17-K21 PolarHBondContact O-N 3.48Å |
| 18 | P | 62 | Low | 57.8 | Low | 87 Ų | 87 | 73.8 Ų | 73.8 | 57% | 0.565 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -69.9 | -37.3 | 178.3 | -16.1 | 29.8 | 0 | 0 | 0 | 113.1 | N22 | P18-N22 PolarHBondContact O-N 3.32Å; P18-N22 PolarHBondContact O-ND2 3.35Å |
| 19 | V | 56.4 | Low | 58 | Low | 38 Ų | 38 | 73.4 Ų | 73.4 | 23% | 0.23 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -71.6 | -40.9 | -179.1 | -179.5 | 0 | 0 | 0 | 0 | 110 | T16 K21 N22 L23 L56 | T16-V19 PolarHBondContact O-N 2.95Å; T16-V19 VanDerWaalsContact O-N 3.16Å; V19-K21 PolarHBondContact O-N 3.24Å; V19-N22 PolarHBondContact O-N 3.33Å; V19-L23 HydrophobicContact CG1-CD1 3.84Å; V19-L23 HydrophobicContact CG1-CG 4.38Å; V19-L23 WeakPolarHBondContact O-CB 3.44Å; V19-L23 WeakPolarHBondContact O-CG 3.49Å; V19-L23 PolarHBondContact O-N 3.33Å; V19-L56 HydrophobicContact CG1-CD2 4.01Å |
| 20 | R | 57.9 | Low | 58.1 | Low | 95 Ų | 95 | 70.2 Ų | 70.2 | 36% | 0.358 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -57.7 | -47.2 | 175.9 | -171.5 | -179.5 | -68.1 | 178.3 | -0.7 | 112.3 | V11 S14 T16 L23 L24 | V11-R20 HydrophobicContact CB-CG 4.35Å; V11-R20 HydrophobicContact CG1-CG 3.53Å; V11-R20 PolarHBondContact O-NE 2.97Å; V11-R20 VanDerWaalsContact O-NE 3.09Å; S14-R20 PolarHBondContact O-NH2 2.92Å; T16-R20 PolarHBondContact O-N 3.41Å; R20-L23 PolarHBondContact O-N 3.1Å; R20-L24 HydrophobicContact CG-CD1 4.33Å; R20-L24 WeakPolarHBondContact O-CB 3.49Å; R20-L24 PolarHBondContact O-N 3.41Å |
| 21 | K | 59.6 | Low | 58.3 | Low | 116 Ų | 116 | 76.6 Ų | 76.6 | 50% | 0.504 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.8 | -45.9 | 178.2 | -177.7 | 177.3 | 173 | -179.9 | 0 | 111.7 | Y17 V19 L23 L24 E25 | Y17-K21 PolarHBondContact O-N 3.48Å; V19-K21 PolarHBondContact O-N 3.24Å; K21-L23 PolarHBondContact O-N 2.85Å; K21-L24 PolarHBondContact O-N 2.97Å; K21-E25 WeakPolarHBondContact CE-OE1 3.48Å; K21-E25 IonicContact NZ-OE1 3.98Å; K21-E25 WeakPolarHBondContact O-CB 3.44Å; K21-E25 WeakPolarHBondContact O-CG 3.34Å; K21-E25 PolarHBondContact O-N 3.25Å |
| 22 | N | 60.2 | Low | 58.3 | Low | 83 Ų | 83 | 81 Ų | 81 | 44% | 0.444 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65.5 | -37.4 | -179.4 | -75 | -26.4 | 0 | 0 | 0 | 112.9 | P18 V19 A26 | P18-N22 PolarHBondContact O-N 3.32Å; P18-N22 PolarHBondContact O-ND2 3.35Å; V19-N22 PolarHBondContact O-N 3.33Å; N22-A26 WeakPolarHBondContact O-CB 3.47Å; N22-A26 PolarHBondContact O-N 2.99Å |
| 23 | L | 60.2 | Low | 58 | Low | 15 Ų | 15 | 75.2 Ų | 75.2 | 8% | 0.079 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -69.7 | -46.3 | 174.2 | -72.6 | 170.9 | 0 | 0 | 0 | 111.1 | V19 R20 K21 E25 A26 F27 Y60 | V19-L23 HydrophobicContact CG1-CD1 3.84Å; V19-L23 HydrophobicContact CG1-CG 4.38Å; V19-L23 WeakPolarHBondContact O-CB 3.44Å; V19-L23 WeakPolarHBondContact O-CG 3.49Å; V19-L23 PolarHBondContact O-N 3.33Å; R20-L23 PolarHBondContact O-N 3.1Å; K21-L23 PolarHBondContact O-N 2.85Å; L23-E25 VanDerWaalsContact C-N 3.31Å; L23-E25 PolarHBondContact O-N 3.27Å; L23-A26 PolarHBondContact O-N 3.29Å; L23-F27 HydrophobicContact CB-CD2 4.29Å; L23-F27 HydrophobicContact CB-CE2 4.36Å; L23-F27 HydrophobicContact CD2-CE2 4.08Å; L23-F27 WeakPolarHBondContact O-CB 3.49Å; L23-F27 WeakPolarHBondContact O-CD2 3.49Å; L23-F27 PolarHBondContact O-N 2.88Å; L23-Y60 HydrophobicContact CD1-CD1 3.75Å; L23-Y60 HydrophobicContact CD1-CE1 3.77Å |
| 24 | L | 58 | Low | 57.7 | Low | 75 Ų | 75 | 75.8 Ų | 75.8 | 39% | 0.393 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -53.4 | -48.6 | 174.2 | -89 | 169.7 | 0 | 0 | 0 | 111.6 | V11 R20 K21 F27 H28 | V11-L24 HydrophobicContact CB-CD2 4.12Å; V11-L24 HydrophobicContact CB-CG 4.1Å; V11-L24 HydrophobicContact CG1-CD1 3.69Å; V11-L24 HydrophobicContact CG1-CD2 3.75Å; V11-L24 HydrophobicContact CG1-CG 3.58Å; V11-L24 HydrophobicContact CG2-CB 4.3Å; V11-L24 HydrophobicContact CG2-CD1 4.42Å; V11-L24 HydrophobicContact CG2-CD2 3.58Å; V11-L24 HydrophobicContact CG2-CG 3.41Å; V11-L24 VanDerWaalsContact CG2-CG 3.41Å; R20-L24 HydrophobicContact CG-CD1 4.33Å; R20-L24 WeakPolarHBondContact O-CB 3.49Å; R20-L24 PolarHBondContact O-N 3.41Å; K21-L24 PolarHBondContact O-N 2.97Å; L24-F27 PolarHBondContact O-N 3.43Å; L24-H28 WeakPolarHBondContact O-CB 3.4Å; L24-H28 PolarHBondContact O-N 3.3Å |
| 25 | E | 61.9 | Low | 57.4 | Low | 74 Ų | 74 | 79.9 Ų | 79.9 | 35% | 0.346 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.9 | -43 | 178.8 | -73.8 | 174.2 | -175.9 | 0 | 0 | 111.9 | K21 L23 H28 L29 K47 | K21-E25 WeakPolarHBondContact CE-OE1 3.48Å; K21-E25 IonicContact NZ-OE1 3.98Å; K21-E25 WeakPolarHBondContact O-CB 3.44Å; K21-E25 WeakPolarHBondContact O-CG 3.34Å; K21-E25 PolarHBondContact O-N 3.25Å; L23-E25 VanDerWaalsContact C-N 3.31Å; L23-E25 PolarHBondContact O-N 3.27Å; E25-H28 PolarHBondContact O-N 3.08Å; E25-L29 WeakPolarHBondContact O-CB 3.14Å; E25-L29 WeakPolarHBondContact O-CD1 3.27Å; E25-L29 VanDerWaalsContact O-CG 3.3Å; E25-L29 WeakPolarHBondContact O-CG 3.35Å; E25-L29 PolarHBondContact O-N 2.85Å; E25-K47 IonicContact OE2-NZ 2.69Å |
| 26 | A | 60.8 | Low | 57 | Low | 8 Ų | 8 | 76.1 Ų | 76.1 | 7% | 0.066 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -64.8 | -43.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | N22 L23 L30 | N22-A26 WeakPolarHBondContact O-CB 3.47Å; N22-A26 PolarHBondContact O-N 2.99Å; L23-A26 PolarHBondContact O-N 3.29Å; A26-L30 WeakPolarHBondContact O-CB 3.28Å; A26-L30 VanDerWaalsContact O-CG 3.26Å; A26-L30 WeakPolarHBondContact O-CG 3.35Å; A26-L30 PolarHBondContact O-N 3.06Å |
| 27 | F | 63 | Low | 56.6 | Low | 22 Ų | 22 | 81.2 Ų | 81.2 | 10% | 0.096 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -70.4 | -37.3 | 177 | -78.2 | -67.3 | 0 | 0 | 0 | 112.7 | M3 L10 L23 L24 L30 Y31 I67 | M3-F27 HydrophobicContact CE-CD1 4.28Å; M3-F27 HydrophobicContact CE-CE1 4.14Å; L10-F27 HydrophobicContact CB-CE2 4.31Å; L10-F27 HydrophobicContact CD1-CE1 4.08Å; L10-F27 HydrophobicContact CD1-CE2 3.54Å; L10-F27 HydrophobicContact CD1-CZ 3.23Å; L23-F27 HydrophobicContact CB-CD2 4.29Å; L23-F27 HydrophobicContact CB-CE2 4.36Å; L23-F27 HydrophobicContact CD2-CE2 4.08Å; L23-F27 WeakPolarHBondContact O-CB 3.49Å; L23-F27 WeakPolarHBondContact O-CD2 3.49Å; L23-F27 PolarHBondContact O-N 2.88Å; L24-F27 PolarHBondContact O-N 3.43Å; F27-L30 HydrophobicContact CD1-CD1 4.16Å; F27-L30 HydrophobicContact CE1-CD1 4.46Å; F27-L30 PolarHBondContact O-N 3.49Å; F27-Y31 WeakPolarHBondContact O-CB 3.31Å; F27-Y31 PolarHBondContact O-N 3.33Å; F27-I67 HydrophobicContact CD1-CD1 4.43Å; F27-I67 HydrophobicContact CE1-CD1 3.42Å; F27-I67 VanDerWaalsContact CE1-CD1 3.42Å; F27-I67 HydrophobicContact CZ-CD1 3.69Å |
| 28 | H | 59.5 | Low | 56.6 | Low | 107 Ų | 107 | 77.9 Ų | 77.9 | 50% | 0.495 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -64.6 | -43.6 | 175.4 | -169.3 | 72.5 | 0 | 0 | 0 | 111.3 | L24 E25 Y31 Q32 | L24-H28 WeakPolarHBondContact O-CB 3.4Å; L24-H28 PolarHBondContact O-N 3.3Å; E25-H28 PolarHBondContact O-N 3.08Å; H28-Y31 PolarHBondContact O-N 3.08Å; H28-Q32 PolarHBondContact NE2-NE2 3.45Å; H28-Q32 VanDerWaalsContact NE2-NE2 3.17Å; H28-Q32 PolarHBondContact O-N 2.9Å; H28-Q32 VanDerWaalsContact O-N 3.13Å |
| 29 | L | 60.4 | Low | 56.5 | Low | 64 Ų | 64 | 76.6 Ų | 76.6 | 34% | 0.335 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -62.1 | -47.5 | 173.1 | -76.3 | 161.2 | 0 | 0 | 0 | 111 | E25 Y31 Q32 L33 I44 | E25-L29 WeakPolarHBondContact O-CB 3.14Å; E25-L29 WeakPolarHBondContact O-CD1 3.27Å; E25-L29 VanDerWaalsContact O-CG 3.3Å; E25-L29 WeakPolarHBondContact O-CG 3.35Å; E25-L29 PolarHBondContact O-N 2.85Å; L29-Y31 PolarHBondContact O-N 3.09Å; L29-Q32 PolarHBondContact O-N 2.83Å; L29-Q32 VanDerWaalsContact O-N 3.16Å; L29-L33 WeakPolarHBondContact O-CD1 3.34Å; L29-L33 VanDerWaalsContact O-CG 3.3Å; L29-L33 WeakPolarHBondContact O-CG 3.32Å; L29-L33 PolarHBondContact O-N 3.23Å; L29-L33 VanDerWaalsContact O-N 3.08Å; L29-I44 HydrophobicContact CB-CD1 3.49Å; L29-I44 VanDerWaalsContact CB-CD1 3.49Å; L29-I44 HydrophobicContact CB-CG1 4.09Å; L29-I44 HydrophobicContact CD1-CG1 4.41Å |
| 30 | L | 57.1 | Low | 56.9 | Low | 10 Ų | 10 | 75.8 Ų | 75.8 | 5% | 0.052 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -55.4 | -35.8 | 176.4 | -81.2 | 166 | 0 | 0 | 0 | 113.2 | M3 A26 F27 K34 Y40 I44 I67 | M3-L30 HydrophobicContact CE-CD1 4.31Å; A26-L30 WeakPolarHBondContact O-CB 3.28Å; A26-L30 VanDerWaalsContact O-CG 3.26Å; A26-L30 WeakPolarHBondContact O-CG 3.35Å; A26-L30 PolarHBondContact O-N 3.06Å; F27-L30 HydrophobicContact CD1-CD1 4.16Å; F27-L30 HydrophobicContact CE1-CD1 4.46Å; F27-L30 PolarHBondContact O-N 3.49Å; L30-K34 PolarHBondContact O-N 3.49Å; L30-Y40 HydrophobicContact CD2-CD1 3.55Å; L30-Y40 HydrophobicContact CD2-CE1 3.54Å; L30-I44 HydrophobicContact CD1-CG2 4.02Å; L30-I44 HydrophobicContact CD2-CD1 4.46Å; L30-I44 HydrophobicContact CD2-CG2 3.67Å; L30-I44 HydrophobicContact CG-CD1 4.28Å; L30-I44 HydrophobicContact CG-CG2 3.61Å; L30-I67 HydrophobicContact CD1-CD1 4.04Å; L30-I67 HydrophobicContact CD1-CG2 4.01Å; L30-I67 HydrophobicContact CD2-CG2 4.32Å |
| 31 | Y | 54.3 | Low | 57.5 | Low | 144 Ų | 144 | 73.6 Ų | 73.6 | 57% | 0.565 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -70.8 | -44.6 | 177.5 | -178.8 | -96.9 | 0 | 0 | 0 | 112.3 | H4 F27 H28 L29 L33 K34 | H4-Y31 HydrophobicContact CB-CD2 4.31Å; H4-Y31 HydrophobicContact CB-CE2 4.41Å; F27-Y31 WeakPolarHBondContact O-CB 3.31Å; F27-Y31 PolarHBondContact O-N 3.33Å; H28-Y31 PolarHBondContact O-N 3.08Å; L29-Y31 PolarHBondContact O-N 3.09Å; Y31-L33 VanDerWaalsContact C-N 3.27Å; Y31-L33 PolarHBondContact O-N 3.17Å; Y31-K34 PolarHBondContact O-N 3.4Å |
| 32 | Q | 53.9 | Low | 58.6 | Low | 105 Ų | 105 | 70.9 Ų | 70.9 | 49% | 0.491 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.8 | -36.1 | 178.3 | -72.3 | -178.7 | -17.4 | 0 | 0 | 112.1 | H28 L29 A35 | H28-Q32 PolarHBondContact NE2-NE2 3.45Å; H28-Q32 VanDerWaalsContact NE2-NE2 3.17Å; H28-Q32 PolarHBondContact O-N 2.9Å; H28-Q32 VanDerWaalsContact O-N 3.13Å; L29-Q32 PolarHBondContact O-N 2.83Å; L29-Q32 VanDerWaalsContact O-N 3.16Å; Q32-A35 PolarHBondContact O-N 2.97Å |
| 33 | L | 51.3 | Low | 59.3 | Low | 22 Ų | 22 | 70.6 Ų | 70.6 | 12% | 0.115 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -81.1 | -18.5 | -176.6 | -67.6 | 155.1 | 0 | 0 | 0 | 114.7 | L29 Y31 A35 E38 P41 I44 | L29-L33 WeakPolarHBondContact O-CD1 3.34Å; L29-L33 VanDerWaalsContact O-CG 3.3Å; L29-L33 WeakPolarHBondContact O-CG 3.32Å; L29-L33 PolarHBondContact O-N 3.23Å; L29-L33 VanDerWaalsContact O-N 3.08Å; Y31-L33 VanDerWaalsContact C-N 3.27Å; Y31-L33 PolarHBondContact O-N 3.17Å; L33-A35 PolarHBondContact O-N 3.18Å; L33-E38 HydrophobicContact CD2-CB 4.27Å; L33-P41 HydrophobicContact CD1-CG 3.51Å; L33-P41 HydrophobicContact CD2-CG 3.73Å; L33-P41 HydrophobicContact CG-CG 4.23Å; L33-I44 HydrophobicContact CD1-CD1 3.24Å |
| 34 | K | 51.5 | Low | 60.1 | Low | 133 Ų | 133 | 70 Ų | 70 | 58% | 0.578 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | -9.8 | 173 | -121 | -175.2 | 179.5 | -173.4 | 0 | 112.5 | L30 Y31 | L30-K34 PolarHBondContact O-N 3.49Å; Y31-K34 PolarHBondContact O-N 3.4Å |
| 35 | A | 48.4 | Very low | 61.4 | Low | 92 Ų | 92 | 66.4 Ų | 66.4 | 76% | 0.76 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | -13.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113 | Q32 L33 | Q32-A35 PolarHBondContact O-N 2.97Å; L33-A35 PolarHBondContact O-N 3.18Å |
| 36 | S | 46.8 | Very low | 62.6 | Low | 40 Ų | 40 | 67.7 Ų | 67.7 | 28% | 0.28 | 35% | 0.353 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113.2 | 147.6 | 170.5 | 51.4 | 0 | 0 | 0 | 0 | 108.4 | E38 | S36-E38 PolarHBondContact O-N 2.99Å; S36-E38 WeakPolarHBondContact OG-CB 3.38Å; S36-E38 PolarHBondContact OG-OE2 3.32Å |
| 37 | D | 51.8 | Low | 63.6 | Low | 185 Ų | 185 | 70.3 Ų | 70.3 | 99% | 0.989 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.2 | 39.4 | 172.8 | -85.8 | -43.5 | 0 | 0 | 0 | 112.1 | ||
| 38 | E | 53.4 | Low | 64.7 | Low | 121 Ų | 121 | 69.5 Ų | 69.5 | 57% | 0.565 | 36% | 0.36 | S | S | * | . | trans | -107 | 122 | -167 | -71.2 | 180 | 156.2 | 0 | 0 | 111.1 | L33 S36 Y40 | L33-E38 HydrophobicContact CD2-CB 4.27Å; S36-E38 PolarHBondContact O-N 2.99Å; S36-E38 WeakPolarHBondContact OG-CB 3.38Å; S36-E38 PolarHBondContact OG-OE2 3.32Å; E38-Y40 PolarHBondContact O-N 3.23Å | ||
| 39 | T | 60.2 | Low | 66.2 | Low | 59 Ų | 59 | 65 Ų | 65 | 36% | 0.362 | 34% | 0.339 | S | S | . | . | trans | -47.5 | 129.5 | 174.1 | 58.9 | 0 | 0 | 0 | 0 | 111.2 | P41 K76 | T39-P41 WeakPolarHBondContact O-CD 3.25Å; T39-P41 VanDerWaalsContact O-N 3.16Å; T39-K76 HydrophobicContact CG2-CD 3.44Å; T39-K76 VanDerWaalsContact CG2-CD 3.44Å; T39-K76 PolarHBondContact OG1-NZ 2.92Å | ||
| 40 | Y | 64.8 | Low | 67.4 | Low | 21 Ų | 21 | 64.8 Ų | 64.8 | 8% | 0.082 | 34% | 0.341 | C | S | . | . | trans | -45.4 | 120.3 | 177.5 | -62.1 | -86.8 | 0 | 0 | 0 | 111.6 | L30 E38 L42 I71 | L30-Y40 HydrophobicContact CD2-CD1 3.55Å; L30-Y40 HydrophobicContact CD2-CE1 3.54Å; E38-Y40 PolarHBondContact O-N 3.23Å; Y40-L42 PolarHBondContact O-N 3.28Å; Y40-I71 HydrophobicContact CD1-CD1 4.35Å; Y40-I71 HydrophobicContact CD1-CG1 3.91Å; Y40-I71 HydrophobicContact CD2-CB 4.26Å; Y40-I71 HydrophobicContact CD2-CG1 3.71Å; Y40-I71 HydrophobicContact CD2-CG2 4.14Å; Y40-I71 HydrophobicContact CE1-CG1 4Å; Y40-I71 HydrophobicContact CE2-CB 4.38Å; Y40-I71 HydrophobicContact CE2-CG1 3.81Å; Y40-I71 HydrophobicContact CG-CD1 4.39Å; Y40-I71 HydrophobicContact CG-CG1 3.76Å | ||
| 41 | P | 70.6 | Confident | 68.8 | Low | 50 Ų | 50 | 65.1 Ų | 65.1 | 33% | 0.325 | 34% | 0.344 | S | S | . | . | trans | -55.5 | 137.6 | 175.3 | -28.4 | 36.6 | 0 | 0 | 0 | 110.3 | L33 T39 V43 I44 I45 | L33-P41 HydrophobicContact CD1-CG 3.51Å; L33-P41 HydrophobicContact CD2-CG 3.73Å; L33-P41 HydrophobicContact CG-CG 4.23Å; T39-P41 WeakPolarHBondContact O-CD 3.25Å; T39-P41 VanDerWaalsContact O-N 3.16Å; P41-V43 PolarHBondContact O-N 3.22Å; P41-V43 VanDerWaalsContact O-N 3.07Å; P41-I44 HydrophobicContact CB-CG1 4.45Å; P41-I44 HydrophobicContact CG-CD1 4.26Å; P41-I44 WeakPolarHBondContact O-CB 3.41Å; P41-I44 PolarHBondContact O-N 2.98Å; P41-I45 PolarHBondContact O-N 3.42Å | ||
| 42 | L | 81.5 | Confident | 70.6 | Confident | 58 Ų | 58 | 58.4 Ų | 58.4 | 30% | 0.304 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -53.1 | -36.2 | -176.5 | -168.7 | 67.4 | 0 | 0 | 0 | 112.3 | Y40 I44 I45 E46 N80 L84 | Y40-L42 PolarHBondContact O-N 3.28Å; L42-I44 VanDerWaalsContact C-N 3.29Å; L42-I44 PolarHBondContact O-N 3.02Å; L42-I45 WeakPolarHBondContact O-CB 3.38Å; L42-I45 PolarHBondContact O-N 3.39Å; L42-E46 WeakPolarHBondContact O-CB 3.44Å; L42-E46 PolarHBondContact O-N 2.7Å; L42-N80 HydrophobicContact CD1-CB 3.84Å; L42-L84 HydrophobicContact CD1-CD1 3.5Å; L42-L84 HydrophobicContact CD1-CD2 4.28Å; L42-L84 HydrophobicContact CD1-CG 3.93Å; L42-L84 HydrophobicContact CG-CD1 3.99Å; L42-L84 HydrophobicContact CG-CD2 4.37Å; L42-L84 HydrophobicContact CG-CG 4.49Å |
| 43 | V | 75.6 | Confident | 72.2 | Confident | 78 Ų | 78 | 57.1 Ų | 57.1 | 47% | 0.473 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -59 | -37.3 | 178.5 | 179.8 | 0 | 0 | 0 | 0 | 112.4 | P41 K47 | P41-V43 PolarHBondContact O-N 3.22Å; P41-V43 VanDerWaalsContact O-N 3.07Å; V43-K47 HydrophobicContact CG1-CD 4.41Å; V43-K47 WeakPolarHBondContact O-CB 3.49Å; V43-K47 WeakPolarHBondContact O-CG 3.44Å; V43-K47 PolarHBondContact O-N 3.18Å |
| 44 | I | 77.1 | Confident | 73.8 | Confident | 2 Ų | 2 | 59.8 Ų | 59.8 | 1% | 0.01 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -69.9 | -44.2 | 178.5 | -61.4 | 179.4 | 0 | 0 | 0 | 110 | L29 L30 L33 P41 L42 E46 K47 T48 | L29-I44 HydrophobicContact CB-CD1 3.49Å; L29-I44 VanDerWaalsContact CB-CD1 3.49Å; L29-I44 HydrophobicContact CB-CG1 4.09Å; L29-I44 HydrophobicContact CD1-CG1 4.41Å; L30-I44 HydrophobicContact CD1-CG2 4.02Å; L30-I44 HydrophobicContact CD2-CD1 4.46Å; L30-I44 HydrophobicContact CD2-CG2 3.67Å; L30-I44 HydrophobicContact CG-CD1 4.28Å; L30-I44 HydrophobicContact CG-CG2 3.61Å; L33-I44 HydrophobicContact CD1-CD1 3.24Å; P41-I44 HydrophobicContact CB-CG1 4.45Å; P41-I44 HydrophobicContact CG-CD1 4.26Å; P41-I44 WeakPolarHBondContact O-CB 3.41Å; P41-I44 PolarHBondContact O-N 2.98Å; L42-I44 VanDerWaalsContact C-N 3.29Å; L42-I44 PolarHBondContact O-N 3.02Å; I44-E46 VanDerWaalsContact C-N 3.3Å; I44-E46 PolarHBondContact O-N 3.41Å; I44-K47 PolarHBondContact O-N 2.93Å; I44-T48 WeakPolarHBondContact O-CB 3.35Å; I44-T48 PolarHBondContact O-N 3.48Å; I44-T48 PolarHBondContact O-OG1 3.47Å |
| 45 | I | 85.5 | Confident | 75.5 | Confident | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -59.7 | -46.1 | 178.5 | -53.2 | -180 | 0 | 0 | 0 | 109.3 | P41 L42 T48 I49 L68 I71 N80 I81 L84 | P41-I45 PolarHBondContact O-N 3.42Å; L42-I45 WeakPolarHBondContact O-CB 3.38Å; L42-I45 PolarHBondContact O-N 3.39Å; I45-T48 PolarHBondContact O-N 3.29Å; I45-I49 HydrophobicContact CG2-CD1 3.93Å; I45-I49 VanDerWaalsContact O-CG1 3.32Å; I45-I49 WeakPolarHBondContact O-CG1 3.4Å; I45-I49 PolarHBondContact O-N 2.96Å; I45-L68 HydrophobicContact CG2-CD2 4.22Å; I45-I71 HydrophobicContact CD1-CG2 3.92Å; I45-I71 HydrophobicContact CG1-CD1 4.21Å; I45-I71 HydrophobicContact CG1-CG2 4.25Å; I45-N80 HydrophobicContact CD1-CB 3.47Å; I45-N80 VanDerWaalsContact CD1-CB 3.47Å; I45-I81 HydrophobicContact CG2-CG1 3.74Å; I45-L84 HydrophobicContact CB-CD1 3.89Å; I45-L84 HydrophobicContact CG2-CD1 3.8Å |
| 46 | E | 86.5 | Confident | 76.9 | Confident | 100 Ų | 100 | 57 Ų | 57 | 47% | 0.467 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.8 | -49 | 177.2 | -176.1 | 179.5 | -168.4 | 0 | 0 | 112.8 | L42 I44 T48 I49 T50 L84 | L42-E46 WeakPolarHBondContact O-CB 3.44Å; L42-E46 PolarHBondContact O-N 2.7Å; I44-E46 VanDerWaalsContact C-N 3.3Å; I44-E46 PolarHBondContact O-N 3.41Å; E46-T48 VanDerWaalsContact C-N 3.28Å; E46-T48 PolarHBondContact O-N 3.25Å; E46-I49 PolarHBondContact O-N 2.89Å; E46-T50 WeakPolarHBondContact O-CB 3.29Å; E46-T50 PolarHBondContact O-N 3.18Å; E46-T50 PolarHBondContact O-OG1 2.92Å; E46-L84 HydrophobicContact CB-CD1 3.91Å; E46-L84 HydrophobicContact CB-CD2 4.44Å |
| 47 | K | 81.5 | Confident | 78.7 | Confident | 63 Ų | 63 | 58.8 Ų | 58.8 | 27% | 0.274 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61 | -38.9 | 175.8 | -75.9 | -174.2 | 176.3 | -167.9 | 0 | 111.6 | E25 V43 I44 T50 C51 | E25-K47 IonicContact OE2-NZ 2.69Å; V43-K47 HydrophobicContact CG1-CD 4.41Å; V43-K47 WeakPolarHBondContact O-CB 3.49Å; V43-K47 WeakPolarHBondContact O-CG 3.44Å; V43-K47 PolarHBondContact O-N 3.18Å; I44-K47 PolarHBondContact O-N 2.93Å; K47-T50 WeakPolarHBondContact O-CB 3.43Å; K47-T50 PolarHBondContact O-N 3.09Å; K47-C51 PolarHBondContact O-N 3.47Å; K47-C51 VanDerWaalsContact O-N 3.13Å; K47-C51 PolarHBondContact O-SG 3.27Å |
| 48 | T | 86.9 | Confident | 80.3 | Confident | 6 Ų | 6 | 53.5 Ų | 53.5 | 4% | 0.037 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -68.2 | -41.9 | 178.8 | -50.4 | 0 | 0 | 0 | 0 | 111.5 | I44 I45 E46 T50 C51 A64 I67 L68 | I44-T48 WeakPolarHBondContact O-CB 3.35Å; I44-T48 PolarHBondContact O-N 3.48Å; I44-T48 PolarHBondContact O-OG1 3.47Å; I45-T48 PolarHBondContact O-N 3.29Å; E46-T48 VanDerWaalsContact C-N 3.28Å; E46-T48 PolarHBondContact O-N 3.25Å; T48-T50 VanDerWaalsContact C-N 3.31Å; T48-T50 PolarHBondContact O-N 3.37Å; T48-C51 WeakPolarHBondContact O-CB 3.26Å; T48-C51 PolarHBondContact O-N 3.39Å; T48-A64 HydrophobicContact CG2-CB 3.88Å; T48-A64 WeakPolarHBondContact CG2-O 3.4Å; T48-I67 HydrophobicContact CG2-CB 4.12Å; T48-I67 HydrophobicContact CG2-CG2 4.03Å; T48-L68 HydrophobicContact CG2-CD1 4.17Å; T48-L68 HydrophobicContact CG2-CD2 4Å; T48-L68 HydrophobicContact CG2-CG 3.68Å |
| 49 | I | 90.8 | Very high | 81.7 | Confident | 12 Ų | 12 | 51.3 Ų | 51.3 | 6% | 0.062 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 173.5 | -71 | 166 | 0 | 0 | 0 | 110.6 | I45 E46 C51 L52 L68 L84 A89 | I45-I49 HydrophobicContact CG2-CD1 3.93Å; I45-I49 VanDerWaalsContact O-CG1 3.32Å; I45-I49 WeakPolarHBondContact O-CG1 3.4Å; I45-I49 PolarHBondContact O-N 2.96Å; E46-I49 PolarHBondContact O-N 2.89Å; I49-C51 VanDerWaalsContact C-N 3.26Å; I49-C51 PolarHBondContact O-N 3.22Å; I49-L52 WeakPolarHBondContact O-CB 3.35Å; I49-L52 PolarHBondContact O-N 2.61Å; I49-L68 HydrophobicContact CG1-CD1 4.11Å; I49-L68 HydrophobicContact CG1-CD2 3.89Å; I49-L84 HydrophobicContact CD1-CB 3.6Å; I49-L84 HydrophobicContact CD1-CD1 4.32Å; I49-A89 HydrophobicContact CG2-CB 3.84Å |
| 50 | T | 87 | Confident | 82.6 | Confident | 59 Ų | 59 | 49.3 Ų | 49.3 | 36% | 0.362 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -60.8 | -35 | 178.2 | -56.9 | 0 | 0 | 0 | 0 | 111.8 | E46 K47 T48 L52 T53 L54 | E46-T50 WeakPolarHBondContact O-CB 3.29Å; E46-T50 PolarHBondContact O-N 3.18Å; E46-T50 PolarHBondContact O-OG1 2.92Å; K47-T50 WeakPolarHBondContact O-CB 3.43Å; K47-T50 PolarHBondContact O-N 3.09Å; T48-T50 VanDerWaalsContact C-N 3.31Å; T48-T50 PolarHBondContact O-N 3.37Å; T50-L52 PolarHBondContact O-N 3.44Å; T50-L52 VanDerWaalsContact O-N 3.16Å; T50-T53 PolarHBondContact O-N 3.46Å; T50-T53 PolarHBondContact O-OG1 3.44Å; T50-L54 HydrophobicContact CG2-CD1 4.08Å; T50-L54 HydrophobicContact CG2-CG 4.14Å; T50-L54 WeakPolarHBondContact O-CG 3.44Å; T50-L54 PolarHBondContact O-N 3.1Å; T50-L54 VanDerWaalsContact O-N 3.12Å |
| 51 | C | 86.5 | Confident | 83.7 | Confident | 17 Ų | 17 | 49.7 Ų | 49.7 | 12% | 0.115 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -59.1 | -28 | 174.7 | -65.2 | 0 | 0 | 0 | 0 | 113.1 | K47 T48 I49 L56 A64 | K47-C51 PolarHBondContact O-N 3.47Å; K47-C51 VanDerWaalsContact O-N 3.13Å; K47-C51 PolarHBondContact O-SG 3.27Å; T48-C51 WeakPolarHBondContact O-CB 3.26Å; T48-C51 PolarHBondContact O-N 3.39Å; I49-C51 VanDerWaalsContact C-N 3.26Å; I49-C51 PolarHBondContact O-N 3.22Å; C51-L56 HydrophobicContact CB-CD1 3.96Å; C51-A64 HydrophobicContact CB-CB 3.95Å |
| 52 | L | 90.6 | Very high | 84.6 | Confident | 3 Ų | 3 | 48.6 Ų | 48.6 | 2% | 0.016 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -71.8 | -32.1 | 177.2 | -52.9 | -173.2 | 0 | 0 | 0 | 112.3 | I49 T50 K61 A64 L65 L68 A89 L93 | I49-L52 WeakPolarHBondContact O-CB 3.35Å; I49-L52 PolarHBondContact O-N 2.61Å; T50-L52 PolarHBondContact O-N 3.44Å; T50-L52 VanDerWaalsContact O-N 3.16Å; L52-K61 PolarHBondContact O-NZ 3.03Å; L52-A64 HydrophobicContact CD2-CB 3.69Å; L52-L65 HydrophobicContact CD1-CD2 3.99Å; L52-L65 HydrophobicContact CD2-CD2 4.07Å; L52-L65 HydrophobicContact CD2-CG 3.86Å; L52-L68 HydrophobicContact CD1-CD1 3.7Å; L52-L68 HydrophobicContact CG-CD1 4.27Å; L52-A89 HydrophobicContact CB-CB 4.32Å; L52-A89 HydrophobicContact CD1-CB 4.33Å; L52-L93 HydrophobicContact CB-CD2 4.32Å; L52-L93 HydrophobicContact CD2-CD2 4.07Å |
| 53 | T | 88.1 | Confident | 84.7 | Confident | 79 Ų | 79 | 46.8 Ų | 46.8 | 49% | 0.485 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -87.4 | -24.1 | -176.3 | 65.8 | 0 | 0 | 0 | 0 | 112.9 | T50 A89 | T50-T53 PolarHBondContact O-N 3.46Å; T50-T53 PolarHBondContact O-OG1 3.44Å; T53-A89 HydrophobicContact CG2-CB 3.85Å |
| 54 | L | 85.5 | Confident | 85.3 | Confident | 78 Ų | 78 | 43.3 Ų | 43.3 | 41% | 0.408 | 24% | 0.237 | S | C | . | . | S | Bend | trans | -71 | 156.4 | 176.5 | -67.6 | 174.9 | 0 | 0 | 0 | 112.8 | T50 L56 K61 | T50-L54 HydrophobicContact CG2-CD1 4.08Å; T50-L54 HydrophobicContact CG2-CG 4.14Å; T50-L54 WeakPolarHBondContact O-CG 3.44Å; T50-L54 PolarHBondContact O-N 3.1Å; T50-L54 VanDerWaalsContact O-N 3.12Å; L54-L56 HydrophobicContact CB-CD1 4.27Å; L54-L56 HydrophobicContact CB-CD2 4.45Å; L54-L56 HydrophobicContact CB-CG 3.89Å; L54-L56 PolarHBondContact O-N 3.23Å; L54-K61 WeakPolarHBondContact O-CE 3.49Å; L54-K61 PolarHBondContact O-NZ 3.25Å |
| 55 | S | 86.1 | Confident | 86 | Confident | 131 Ų | 131 | 43.3 Ų | 43.3 | 92% | 0.916 | 24% | 0.237 | S | C | * | . | S | Bend | trans | -77.3 | 64.9 | 174 | -59.2 | 0 | 0 | 0 | 0 | 111.5 | ||
| 56 | L | 78.4 | Confident | 86.2 | Confident | 36 Ų | 36 | 46.7 Ų | 46.7 | 19% | 0.188 | 25% | 0.251 | C | S | . | . | trans | -98.8 | 159.3 | 176.1 | -56.3 | 177.9 | 0 | 0 | 0 | 111.3 | V19 C51 L54 Y60 K61 | V19-L56 HydrophobicContact CG1-CD2 4.01Å; C51-L56 HydrophobicContact CB-CD1 3.96Å; L54-L56 HydrophobicContact CB-CD1 4.27Å; L54-L56 HydrophobicContact CB-CD2 4.45Å; L54-L56 HydrophobicContact CB-CG 3.89Å; L54-L56 PolarHBondContact O-N 3.23Å; L56-Y60 HydrophobicContact CB-CD2 4.24Å; L56-Y60 HydrophobicContact CB-CG 4.36Å; L56-Y60 HydrophobicContact CD1-CG 4.47Å; L56-K61 HydrophobicContact CB-CG 4.45Å | ||
| 57 | T | 84.2 | Confident | 86.2 | Confident | 77 Ų | 77 | 42.3 Ų | 42.3 | 47% | 0.472 | 23% | 0.231 | S | C | . | . | trans | -61.3 | 157 | 171.4 | 71.1 | 0 | 0 | 0 | 0 | 110.8 | E59 Y60 K61 | T57-E59 PolarHBondContact O-N 3.23Å; T57-Y60 PolarHBondContact O-N 2.88Å; T57-Y60 VanDerWaalsContact O-N 3.17Å; T57-Y60 WeakPolarHBondContact OG1-CD2 3.39Å; T57-Y60 WeakPolarHBondContact OG1-CE2 3.34Å; T57-K61 PolarHBondContact O-N 2.84Å | ||
| 58 | H | 85.9 | Confident | 86.7 | Confident | 74 Ų | 74 | 39.3 Ų | 39.3 | 34% | 0.343 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -59.4 | -29.2 | 179.3 | 62.9 | -111.6 | 0 | 0 | 0 | 112.2 | Y60 K61 L62 E98 L101 | H58-Y60 PolarHBondContact O-N 3.15Å; H58-K61 PolarHBondContact O-N 3.15Å; H58-L62 VanDerWaalsContact O-CB 3.26Å; H58-L62 WeakPolarHBondContact O-CB 3.48Å; H58-L62 PolarHBondContact O-N 3.3Å; H58-E98 IonicContact CE1-OE2 2.92Å; H58-E98 IonicContact CG-OE2 3.81Å; H58-E98 IonicContact ND1-OE1 3.52Å; H58-E98 IonicContact ND1-OE2 3.68Å; H58-E98 PolarHBondContact ND1-OE2 3.35Å; H58-L101 HydrophobicContact CB-CD1 4Å; H58-L101 HydrophobicContact CB-CD2 4.25Å; H58-L101 HydrophobicContact CB-CG 4.16Å; H58-L101 WeakPolarHBondContact O-CD2 3.37Å |
| 59 | E | 83.5 | Confident | 87 | Confident | 74 Ų | 74 | 40.9 Ų | 40.9 | 35% | 0.346 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -58.3 | -44.3 | 176.7 | -62.7 | -172.2 | 159.6 | 0 | 0 | 111.9 | K13 T57 L62 E63 | K13-E59 VanDerWaalsContact CD-OE2 3.29Å; K13-E59 WeakPolarHBondContact CD-OE2 3.5Å; K13-E59 VanDerWaalsContact NZ-CD 3.34Å; K13-E59 IonicContact NZ-OE1 3.95Å; K13-E59 PolarHBondContact NZ-OE1 3.29Å; K13-E59 IonicContact NZ-OE2 2.99Å; K13-E59 PolarHBondContact NZ-OE2 2.74Å; T57-E59 PolarHBondContact O-N 3.23Å; E59-L62 WeakPolarHBondContact O-CB 3.41Å; E59-L62 PolarHBondContact O-N 3.37Å; E59-E63 PolarHBondContact O-N 3.09Å |
| 60 | Y | 78 | Confident | 86.8 | Confident | 17 Ų | 17 | 43.5 Ų | 43.5 | 7% | 0.067 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.6 | -43 | 177.3 | -68.6 | -73.3 | 0 | 0 | 0 | 112.7 | L10 K13 S14 L23 L56 T57 H58 L62 E63 A64 | L10-Y60 HydrophobicContact CB-CD1 4.45Å; L10-Y60 HydrophobicContact CB-CE1 3.99Å; L10-Y60 HydrophobicContact CD2-CD1 3.75Å; L10-Y60 HydrophobicContact CD2-CE1 3.8Å; L10-Y60 WeakPolarHBondContact O-CE1 3.49Å; L10-Y60 PolarHBondContact O-OH 3.17Å; K13-Y60 WeakPolarHBondContact CB-OH 3.3Å; K13-Y60 PolarHBondContact O-OH 3.28Å; S14-Y60 WeakPolarHBondContact CA-OH 3.35Å; S14-Y60 VanDerWaalsContact CB-OH 3.22Å; S14-Y60 WeakPolarHBondContact CB-OH 3.5Å; S14-Y60 PolarHBondContact N-OH 2.84Å; L23-Y60 HydrophobicContact CD1-CD1 3.75Å; L23-Y60 HydrophobicContact CD1-CE1 3.77Å; L56-Y60 HydrophobicContact CB-CD2 4.24Å; L56-Y60 HydrophobicContact CB-CG 4.36Å; L56-Y60 HydrophobicContact CD1-CG 4.47Å; T57-Y60 PolarHBondContact O-N 2.88Å; T57-Y60 VanDerWaalsContact O-N 3.17Å; T57-Y60 WeakPolarHBondContact OG1-CD2 3.39Å; T57-Y60 WeakPolarHBondContact OG1-CE2 3.34Å; H58-Y60 PolarHBondContact O-N 3.15Å; Y60-L62 VanDerWaalsContact C-N 3.25Å; Y60-L62 PolarHBondContact O-N 2.91Å; Y60-E63 PolarHBondContact O-N 3.48Å; Y60-A64 WeakPolarHBondContact O-CB 3.44Å; Y60-A64 PolarHBondContact O-N 2.85Å |
| 61 | K | 89 | Confident | 86.9 | Confident | 30 Ų | 30 | 40.7 Ų | 40.7 | 13% | 0.13 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.7 | -36.4 | 179.9 | -62.7 | -165.7 | -179.2 | -156.6 | 0 | 111 | L52 L54 L56 T57 H58 A64 L65 L93 L101 | L52-K61 PolarHBondContact O-NZ 3.03Å; L54-K61 WeakPolarHBondContact O-CE 3.49Å; L54-K61 PolarHBondContact O-NZ 3.25Å; L56-K61 HydrophobicContact CB-CG 4.45Å; T57-K61 PolarHBondContact O-N 2.84Å; H58-K61 PolarHBondContact O-N 3.15Å; K61-A64 PolarHBondContact O-N 3.33Å; K61-L65 WeakPolarHBondContact O-CB 3.49Å; K61-L65 VanDerWaalsContact O-CG 3.26Å; K61-L65 WeakPolarHBondContact O-CG 3.45Å; K61-L65 PolarHBondContact O-N 3.11Å; K61-L93 HydrophobicContact CB-CD2 4.31Å; K61-L93 HydrophobicContact CD-CD1 3.64Å; K61-L93 HydrophobicContact CD-CD2 4.23Å; K61-L101 HydrophobicContact CB-CD1 3.94Å; K61-L101 HydrophobicContact CB-CD2 4.26Å; K61-L101 HydrophobicContact CD-CD1 4.3Å |
| 62 | L | 88.8 | Confident | 87.1 | Confident | 27 Ų | 27 | 39.9 Ų | 39.9 | 14% | 0.141 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.7 | -48.9 | 174.9 | 178.9 | 64.1 | 0 | 0 | 0 | 111.4 | H58 E59 Y60 L65 K66 L101 Y104 | H58-L62 VanDerWaalsContact O-CB 3.26Å; H58-L62 WeakPolarHBondContact O-CB 3.48Å; H58-L62 PolarHBondContact O-N 3.3Å; E59-L62 WeakPolarHBondContact O-CB 3.41Å; E59-L62 PolarHBondContact O-N 3.37Å; Y60-L62 VanDerWaalsContact C-N 3.25Å; Y60-L62 PolarHBondContact O-N 2.91Å; L62-L65 PolarHBondContact O-N 3.36Å; L62-K66 WeakPolarHBondContact O-CG 3.2Å; L62-K66 PolarHBondContact O-N 2.92Å; L62-L101 HydrophobicContact CB-CD2 3.79Å; L62-L101 HydrophobicContact CD1-CD2 4.35Å; L62-Y104 HydrophobicContact CD1-CD1 3.94Å; L62-Y104 HydrophobicContact CD1-CD2 3.31Å; L62-Y104 HydrophobicContact CD1-CE1 3.88Å; L62-Y104 HydrophobicContact CD1-CE2 3.27Å; L62-Y104 HydrophobicContact CD1-CG 3.67Å |
| 63 | E | 83.5 | Confident | 87.1 | Confident | 19 Ų | 19 | 45.2 Ų | 45.2 | 9% | 0.089 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -68.3 | -39.1 | 179.7 | -66.1 | -56.2 | 141.7 | 0 | 0 | 112.2 | L6 L10 E59 Y60 L65 K66 I67 | L6-E63 HydrophobicContact CD2-CG 3.92Å; L6-E63 VanDerWaalsContact CD2-OE2 3.24Å; L6-E63 WeakPolarHBondContact CD2-OE2 3.35Å; L10-E63 HydrophobicContact CD1-CB 3.7Å; L10-E63 HydrophobicContact CD1-CG 3.77Å; L10-E63 HydrophobicContact CD2-CB 4.19Å; L10-E63 HydrophobicContact CD2-CG 3.8Å; L10-E63 HydrophobicContact CG-CG 4.24Å; E59-E63 PolarHBondContact O-N 3.09Å; Y60-E63 PolarHBondContact O-N 3.48Å; E63-L65 VanDerWaalsContact C-N 3.33Å; E63-L65 PolarHBondContact O-N 3.4Å; E63-K66 PolarHBondContact O-N 3.28Å; E63-K66 IonicContact OE1-NZ 3.69Å; E63-K66 PolarHBondContact OE1-NZ 3.36Å; E63-K66 WeakPolarHBondContact OE2-CD 3.25Å; E63-K66 IonicContact OE2-NZ 2.85Å; E63-I67 VanDerWaalsContact O-CG1 3.3Å; E63-I67 WeakPolarHBondContact O-CG1 3.41Å; E63-I67 PolarHBondContact O-N 2.88Å |
| 64 | A | 88 | Confident | 87.1 | Confident | 6 Ų | 6 | 45.4 Ų | 45.4 | 5% | 0.05 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58.5 | -43.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T48 C51 L52 Y60 K61 K66 I67 L68 | T48-A64 HydrophobicContact CG2-CB 3.88Å; T48-A64 WeakPolarHBondContact CG2-O 3.4Å; C51-A64 HydrophobicContact CB-CB 3.95Å; L52-A64 HydrophobicContact CD2-CB 3.69Å; Y60-A64 WeakPolarHBondContact O-CB 3.44Å; Y60-A64 PolarHBondContact O-N 2.85Å; K61-A64 PolarHBondContact O-N 3.33Å; A64-K66 PolarHBondContact O-N 2.96Å; A64-I67 PolarHBondContact O-N 3.46Å; A64-L68 WeakPolarHBondContact O-CG 3.05Å; A64-L68 PolarHBondContact O-N 2.89Å |
| 65 | L | 92.8 | Very high | 87.3 | Confident | 1 Ų | 1 | 46.8 Ų | 46.8 | 1% | 0.005 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63 | -40.5 | 175.9 | -74.2 | 166.5 | 0 | 0 | 0 | 112.4 | L52 K61 L62 E63 L68 L69 T90 L93 L101 L108 | L52-L65 HydrophobicContact CD1-CD2 3.99Å; L52-L65 HydrophobicContact CD2-CD2 4.07Å; L52-L65 HydrophobicContact CD2-CG 3.86Å; K61-L65 WeakPolarHBondContact O-CB 3.49Å; K61-L65 VanDerWaalsContact O-CG 3.26Å; K61-L65 WeakPolarHBondContact O-CG 3.45Å; K61-L65 PolarHBondContact O-N 3.11Å; L62-L65 PolarHBondContact O-N 3.36Å; E63-L65 VanDerWaalsContact C-N 3.33Å; E63-L65 PolarHBondContact O-N 3.4Å; L65-L68 PolarHBondContact O-N 3.25Å; L65-L69 WeakPolarHBondContact O-CB 3.45Å; L65-L69 PolarHBondContact O-N 2.91Å; L65-T90 HydrophobicContact CD2-CG2 4.28Å; L65-L93 HydrophobicContact CD1-CD2 3.95Å; L65-L93 HydrophobicContact CD2-CD2 4.48Å; L65-L93 HydrophobicContact CG-CD2 4.39Å; L65-L101 HydrophobicContact CD1-CD2 4.37Å; L65-L108 HydrophobicContact CD2-CD2 4.13Å |
| 66 | K | 88.8 | Confident | 87.4 | Confident | 71 Ų | 71 | 45 Ų | 45 | 31% | 0.309 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -62.6 | -42.6 | 176.4 | -72.3 | 172.8 | -177.1 | 172.1 | 0 | 111.9 | L62 E63 A64 L69 L70 Y104 | L62-K66 WeakPolarHBondContact O-CG 3.2Å; L62-K66 PolarHBondContact O-N 2.92Å; E63-K66 PolarHBondContact O-N 3.28Å; E63-K66 IonicContact OE1-NZ 3.69Å; E63-K66 PolarHBondContact OE1-NZ 3.36Å; E63-K66 WeakPolarHBondContact OE2-CD 3.25Å; E63-K66 IonicContact OE2-NZ 2.85Å; A64-K66 PolarHBondContact O-N 2.96Å; K66-L69 PolarHBondContact O-N 3.41Å; K66-L70 PolarHBondContact O-N 3.45Å; K66-Y104 HydrophobicContact CD-CE1 4.41Å; K66-Y104 HydrophobicContact CG-CD1 4.01Å; K66-Y104 HydrophobicContact CG-CE1 3.85Å |
| 67 | I | 86.1 | Confident | 88 | Confident | 8 Ų | 8 | 43.4 Ų | 43.4 | 4% | 0.041 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.5 | -47.3 | 176.7 | -66 | 164.1 | 0 | 0 | 0 | 110.4 | M3 F27 L30 T48 E63 A64 L69 L70 I71 | M3-I67 HydrophobicContact CE-CD1 4.24Å; M3-I67 HydrophobicContact CE-CG1 3.9Å; F27-I67 HydrophobicContact CD1-CD1 4.43Å; F27-I67 HydrophobicContact CE1-CD1 3.42Å; F27-I67 VanDerWaalsContact CE1-CD1 3.42Å; F27-I67 HydrophobicContact CZ-CD1 3.69Å; L30-I67 HydrophobicContact CD1-CD1 4.04Å; L30-I67 HydrophobicContact CD1-CG2 4.01Å; L30-I67 HydrophobicContact CD2-CG2 4.32Å; T48-I67 HydrophobicContact CG2-CB 4.12Å; T48-I67 HydrophobicContact CG2-CG2 4.03Å; E63-I67 VanDerWaalsContact O-CG1 3.3Å; E63-I67 WeakPolarHBondContact O-CG1 3.41Å; E63-I67 PolarHBondContact O-N 2.88Å; A64-I67 PolarHBondContact O-N 3.46Å; I67-L69 VanDerWaalsContact C-N 3.3Å; I67-L69 PolarHBondContact O-N 2.8Å; I67-L70 WeakPolarHBondContact O-CB 3.48Å; I67-L70 PolarHBondContact O-N 3.45Å; I67-I71 HydrophobicContact CG2-CD1 3.64Å; I67-I71 HydrophobicContact CG2-CG1 4.42Å; I67-I71 WeakPolarHBondContact O-CD1 3.28Å; I67-I71 VanDerWaalsContact O-CG1 3.29Å; I67-I71 WeakPolarHBondContact O-CG1 3.42Å; I67-I71 PolarHBondContact O-N 2.93Å |
| 68 | L | 92.3 | Very high | 88.4 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.6 | -38.1 | 177.5 | -70.1 | 170.8 | 0 | 0 | 0 | 112.2 | I45 T48 I49 L52 A64 L65 L70 I71 A72 I81 L108 | I45-L68 HydrophobicContact CG2-CD2 4.22Å; T48-L68 HydrophobicContact CG2-CD1 4.17Å; T48-L68 HydrophobicContact CG2-CD2 4Å; T48-L68 HydrophobicContact CG2-CG 3.68Å; I49-L68 HydrophobicContact CG1-CD1 4.11Å; I49-L68 HydrophobicContact CG1-CD2 3.89Å; L52-L68 HydrophobicContact CD1-CD1 3.7Å; L52-L68 HydrophobicContact CG-CD1 4.27Å; A64-L68 WeakPolarHBondContact O-CG 3.05Å; A64-L68 PolarHBondContact O-N 2.89Å; L65-L68 PolarHBondContact O-N 3.25Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-I71 HydrophobicContact CD2-CD1 4.41Å; L68-I71 PolarHBondContact O-N 3.17Å; L68-A72 VanDerWaalsContact O-CB 3.24Å; L68-A72 WeakPolarHBondContact O-CB 3.38Å; L68-A72 PolarHBondContact O-N 2.87Å; L68-I81 HydrophobicContact CB-CD1 4.43Å; L68-I81 HydrophobicContact CD2-CD1 4.2Å; L68-I81 HydrophobicContact CD2-CG1 4.13Å; L68-I81 WeakPolarHBondContact O-CD1 3.23Å; L68-L108 HydrophobicContact CB-CD1 4.43Å; L68-L108 HydrophobicContact CB-CD2 3.83Å; L68-L108 HydrophobicContact CD1-CD2 4.28Å |
| 69 | L | 92.4 | Very high | 88.7 | Confident | 39 Ų | 39 | 43.1 Ų | 43.1 | 20% | 0.204 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.5 | -36.9 | 175.6 | -175.7 | 62.3 | 0 | 0 | 0 | 112.2 | L65 K66 I67 A72 Q73 N107 R111 | L65-L69 WeakPolarHBondContact O-CB 3.45Å; L65-L69 PolarHBondContact O-N 2.91Å; K66-L69 PolarHBondContact O-N 3.41Å; I67-L69 VanDerWaalsContact C-N 3.3Å; I67-L69 PolarHBondContact O-N 2.8Å; L69-A72 PolarHBondContact O-N 3.07Å; L69-Q73 WeakPolarHBondContact O-CG 3.26Å; L69-Q73 PolarHBondContact O-N 3.47Å; L69-Q73 PolarHBondContact O-NE2 3.08Å; L69-Q73 VanDerWaalsContact O-NE2 3.1Å; L69-N107 HydrophobicContact CD1-CB 4.5Å; L69-N107 HydrophobicContact CD2-CB 4.2Å; L69-R111 HydrophobicContact CD1-CB 4.43Å |
| 70 | L | 87.7 | Confident | 89.2 | Confident | 68 Ų | 68 | 40.9 Ų | 40.9 | 36% | 0.356 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -65.3 | -47.4 | 173.4 | -179 | 67.6 | 0 | 0 | 0 | 111.1 | K66 I67 L68 A72 Q73 | K66-L70 PolarHBondContact O-N 3.45Å; I67-L70 WeakPolarHBondContact O-CB 3.48Å; I67-L70 PolarHBondContact O-N 3.45Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L70-A72 VanDerWaalsContact C-N 3.27Å; L70-A72 PolarHBondContact O-N 3.34Å; L70-Q73 WeakPolarHBondContact O-CB 3.4Å; L70-Q73 WeakPolarHBondContact O-CG 3.47Å; L70-Q73 PolarHBondContact O-N 3.33Å; L70-Q73 VanDerWaalsContact O-N 3.15Å |
| 71 | I | 87.9 | Confident | 90 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60 | -39.7 | 176.2 | -66.5 | 159.6 | 0 | 0 | 0 | 110.7 | Y40 I45 I67 L68 Q73 E74 G77 I81 | Y40-I71 HydrophobicContact CD1-CD1 4.35Å; Y40-I71 HydrophobicContact CD1-CG1 3.91Å; Y40-I71 HydrophobicContact CD2-CB 4.26Å; Y40-I71 HydrophobicContact CD2-CG1 3.71Å; Y40-I71 HydrophobicContact CD2-CG2 4.14Å; Y40-I71 HydrophobicContact CE1-CG1 4Å; Y40-I71 HydrophobicContact CE2-CB 4.38Å; Y40-I71 HydrophobicContact CE2-CG1 3.81Å; Y40-I71 HydrophobicContact CG-CD1 4.39Å; Y40-I71 HydrophobicContact CG-CG1 3.76Å; I45-I71 HydrophobicContact CD1-CG2 3.92Å; I45-I71 HydrophobicContact CG1-CD1 4.21Å; I45-I71 HydrophobicContact CG1-CG2 4.25Å; I67-I71 HydrophobicContact CG2-CD1 3.64Å; I67-I71 HydrophobicContact CG2-CG1 4.42Å; I67-I71 WeakPolarHBondContact O-CD1 3.28Å; I67-I71 VanDerWaalsContact O-CG1 3.29Å; I67-I71 WeakPolarHBondContact O-CG1 3.42Å; I67-I71 PolarHBondContact O-N 2.93Å; L68-I71 HydrophobicContact CD2-CD1 4.41Å; L68-I71 PolarHBondContact O-N 3.17Å; I71-Q73 PolarHBondContact O-N 3.33Å; I71-E74 PolarHBondContact O-N 3.4Å; I71-E74 VanDerWaalsContact O-N 3.16Å; I71-G77 WeakPolarHBondContact O-CA 3.41Å; I71-I81 HydrophobicContact CB-CD1 4.2Å; I71-I81 HydrophobicContact CG2-CD1 3.92Å; I71-I81 HydrophobicContact CG2-CG1 4.3Å |
| 72 | A | 92.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -12.3 | -180 | 0 | 0 | 0 | 0 | 0 | 113.8 | L68 L69 L70 E74 L78 I81 L108 R111 | L68-A72 VanDerWaalsContact O-CB 3.24Å; L68-A72 WeakPolarHBondContact O-CB 3.38Å; L68-A72 PolarHBondContact O-N 2.87Å; L69-A72 PolarHBondContact O-N 3.07Å; L70-A72 VanDerWaalsContact C-N 3.27Å; L70-A72 PolarHBondContact O-N 3.34Å; A72-E74 PolarHBondContact O-N 3.33Å; A72-L78 HydrophobicContact CB-CD1 4.25Å; A72-I81 HydrophobicContact CB-CD1 3.82Å; A72-L108 HydrophobicContact CB-CD1 3.86Å; A72-R111 HydrophobicContact CB-CG 3.9Å; A72-R111 PolarHBondContact O-NE 2.99Å; A72-R111 PolarHBondContact O-NH2 3.06Å |
| 73 | Q | 89.7 | Confident | 90.5 | Very high | 115 Ų | 115 | 46.3 Ų | 46.3 | 54% | 0.537 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -32.1 | 171.6 | -59.7 | -52.7 | -49.8 | 0 | 0 | 111.2 | L69 L70 I71 | L69-Q73 WeakPolarHBondContact O-CG 3.26Å; L69-Q73 PolarHBondContact O-N 3.47Å; L69-Q73 PolarHBondContact O-NE2 3.08Å; L69-Q73 VanDerWaalsContact O-NE2 3.1Å; L70-Q73 WeakPolarHBondContact O-CB 3.4Å; L70-Q73 WeakPolarHBondContact O-CG 3.47Å; L70-Q73 PolarHBondContact O-N 3.33Å; L70-Q73 VanDerWaalsContact O-N 3.15Å; I71-Q73 PolarHBondContact O-N 3.33Å |
| 74 | E | 88.3 | Confident | 91 | Very high | 82 Ų | 82 | 47.2 Ų | 47.2 | 38% | 0.383 | 21% | 0.212 | S | C | . | . | S | Bend | trans | -87.2 | 132.7 | 176 | -65.8 | 172 | -155.4 | 0 | 0 | 111.4 | I71 A72 K76 G77 L78 | I71-E74 PolarHBondContact O-N 3.4Å; I71-E74 VanDerWaalsContact O-N 3.16Å; A72-E74 PolarHBondContact O-N 3.33Å; E74-K76 VanDerWaalsContact C-N 3.26Å; E74-K76 PolarHBondContact O-N 3.25Å; E74-G77 CarbonylContact O-C 3.59Å; E74-G77 WeakPolarHBondContact O-CA 3.4Å; E74-G77 PolarHBondContact O-N 3.16Å; E74-L78 PolarHBondContact O-N 2.85Å |
| 75 | E | 88.9 | Confident | 91.2 | Very high | 107 Ų | 107 | 53.1 Ų | 53.1 | 50% | 0.5 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58 | -35.6 | 179.2 | -74.1 | -59.1 | 137.9 | 0 | 0 | 113.4 | R79 R111 | E75-R79 WeakPolarHBondContact O-CB 3.2Å; E75-R79 VanDerWaalsContact O-CG 3.29Å; E75-R79 WeakPolarHBondContact O-CG 3.26Å; E75-R79 PolarHBondContact O-N 3.24Å; E75-R79 PolarHBondContact O-NE 2.69Å; E75-R111 IonicContact OE1-CZ 2.7Å; E75-R111 IonicContact OE1-NH1 3.05Å; E75-R111 IonicContact OE1-NH2 2.7Å; E75-R111 PolarHBondContact OE1-NH2 2.82Å |
| 76 | K | 89.3 | Confident | 91.3 | Very high | 93 Ų | 93 | 53 Ų | 53 | 40% | 0.404 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -69.6 | -41 | 174.6 | -166.6 | -174.7 | 177.6 | -175.5 | 0 | 111.4 | T39 E74 R79 N80 | T39-K76 HydrophobicContact CG2-CD 3.44Å; T39-K76 VanDerWaalsContact CG2-CD 3.44Å; T39-K76 PolarHBondContact OG1-NZ 2.92Å; E74-K76 VanDerWaalsContact C-N 3.26Å; E74-K76 PolarHBondContact O-N 3.25Å; K76-R79 PolarHBondContact O-N 3.45Å; K76-N80 PolarHBondContact O-N 3.29Å; K76-N80 PolarHBondContact O-ND2 3.2Å |
| 77 | G | 90 | Very high | 91.6 | Very high | 3 Ų | 3 | 49.9 Ų | 49.9 | 3% | 0.031 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.3 | -47.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | I71 E74 R79 N80 I81 | I71-G77 WeakPolarHBondContact O-CA 3.41Å; E74-G77 CarbonylContact O-C 3.59Å; E74-G77 WeakPolarHBondContact O-CA 3.4Å; E74-G77 PolarHBondContact O-N 3.16Å; G77-R79 PolarHBondContact O-N 3.22Å; G77-N80 WeakPolarHBondContact O-CB 3.27Å; G77-N80 PolarHBondContact O-N 2.79Å; G77-N80 VanDerWaalsContact O-N 3.13Å; G77-I81 WeakPolarHBondContact O-CG1 3.4Å; G77-I81 PolarHBondContact O-N 2.95Å |
| 78 | L | 93.1 | Very high | 92 | Very high | 2 Ų | 2 | 51.7 Ų | 51.7 | 1% | 0.01 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -58.2 | -45.9 | 175.5 | 179.6 | 65.5 | 0 | 0 | 0 | 112.2 | A72 E74 N80 I81 L82 I112 | A72-L78 HydrophobicContact CB-CD1 4.25Å; E74-L78 PolarHBondContact O-N 2.85Å; L78-N80 VanDerWaalsContact C-N 3.29Å; L78-N80 PolarHBondContact O-N 3.4Å; L78-I81 PolarHBondContact O-N 3.45Å; L78-L82 PolarHBondContact O-N 3.35Å; L78-I112 HydrophobicContact CD1-CB 4.3Å; L78-I112 HydrophobicContact CD1-CG1 3.71Å |
| 79 | R | 93 | Very high | 92.2 | Very high | 144 Ų | 144 | 52 Ų | 52 | 54% | 0.543 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.8 | -39.3 | 175.6 | -76.9 | -175.7 | -65.1 | -178.2 | 1.5 | 112.4 | E75 K76 G77 L82 R83 | E75-R79 WeakPolarHBondContact O-CB 3.2Å; E75-R79 VanDerWaalsContact O-CG 3.29Å; E75-R79 WeakPolarHBondContact O-CG 3.26Å; E75-R79 PolarHBondContact O-N 3.24Å; E75-R79 PolarHBondContact O-NE 2.69Å; K76-R79 PolarHBondContact O-N 3.45Å; G77-R79 PolarHBondContact O-N 3.22Å; R79-L82 PolarHBondContact O-N 3.1Å; R79-R83 WeakPolarHBondContact O-CB 3.33Å; R79-R83 PolarHBondContact O-N 3.44Å |
| 80 | N | 92.2 | Very high | 92.4 | Very high | 26 Ų | 26 | 50.2 Ų | 50.2 | 14% | 0.139 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -69.3 | -40.7 | 177.5 | -74 | -18.6 | 0 | 0 | 0 | 112.1 | L42 I45 K76 G77 L78 L82 R83 L84 | L42-N80 HydrophobicContact CD1-CB 3.84Å; I45-N80 HydrophobicContact CD1-CB 3.47Å; I45-N80 VanDerWaalsContact CD1-CB 3.47Å; K76-N80 PolarHBondContact O-N 3.29Å; K76-N80 PolarHBondContact O-ND2 3.2Å; G77-N80 WeakPolarHBondContact O-CB 3.27Å; G77-N80 PolarHBondContact O-N 2.79Å; G77-N80 VanDerWaalsContact O-N 3.13Å; L78-N80 VanDerWaalsContact C-N 3.29Å; L78-N80 PolarHBondContact O-N 3.4Å; N80-L82 VanDerWaalsContact C-N 3.32Å; N80-L82 PolarHBondContact O-N 3.35Å; N80-R83 PolarHBondContact O-N 3.02Å; N80-L84 WeakPolarHBondContact O-CB 3.43Å; N80-L84 WeakPolarHBondContact O-CG 3.03Å; N80-L84 PolarHBondContact O-N 3.17Å |
| 81 | I | 94.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58.5 | -46.4 | 173.9 | -68.4 | 168.4 | 0 | 0 | 0 | 110.3 | I45 L68 I71 A72 G77 L78 L84 Q85 G86 I112 | I45-I81 HydrophobicContact CG2-CG1 3.74Å; L68-I81 HydrophobicContact CB-CD1 4.43Å; L68-I81 HydrophobicContact CD2-CD1 4.2Å; L68-I81 HydrophobicContact CD2-CG1 4.13Å; L68-I81 WeakPolarHBondContact O-CD1 3.23Å; I71-I81 HydrophobicContact CB-CD1 4.2Å; I71-I81 HydrophobicContact CG2-CD1 3.92Å; I71-I81 HydrophobicContact CG2-CG1 4.3Å; A72-I81 HydrophobicContact CB-CD1 3.82Å; G77-I81 WeakPolarHBondContact O-CG1 3.4Å; G77-I81 PolarHBondContact O-N 2.95Å; L78-I81 PolarHBondContact O-N 3.45Å; I81-L84 CarbonylContact O-C 3.57Å; I81-L84 PolarHBondContact O-N 3.35Å; I81-Q85 PolarHBondContact O-N 2.92Å; I81-G86 PolarHBondContact O-N 3.09Å; I81-I112 HydrophobicContact CG2-CD1 4.28Å |
| 82 | L | 94.6 | Very high | 93.2 | Very high | 16 Ų | 16 | 49.2 Ų | 49.2 | 8% | 0.084 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.8 | -42.9 | 176.1 | -78.7 | 171.9 | 0 | 0 | 0 | 112.6 | L78 R79 N80 L84 Q85 I112 R117 A121 | L78-L82 PolarHBondContact O-N 3.35Å; R79-L82 PolarHBondContact O-N 3.1Å; N80-L82 VanDerWaalsContact C-N 3.32Å; N80-L82 PolarHBondContact O-N 3.35Å; L82-L84 PolarHBondContact O-N 2.67Å; L82-Q85 PolarHBondContact O-N 3.03Å; L82-I112 HydrophobicContact CD2-CG2 3.7Å; L82-I112 HydrophobicContact CG-CG2 4.41Å; L82-R117 HydrophobicContact CD1-CB 4.33Å; L82-R117 HydrophobicContact CD1-CG 4.23Å; L82-A121 HydrophobicContact CD2-CB 4.17Å |
| 83 | R | 93.7 | Very high | 93.3 | Very high | 172 Ų | 172 | 49.7 Ų | 49.7 | 65% | 0.649 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -61.3 | -35.2 | 177.6 | 178.2 | 179.3 | 171.1 | 170.6 | -1.3 | 112.1 | R79 N80 Q85 | R79-R83 WeakPolarHBondContact O-CB 3.33Å; R79-R83 PolarHBondContact O-N 3.44Å; N80-R83 PolarHBondContact O-N 3.02Å; R83-Q85 VanDerWaalsContact C-N 3.32Å |
| 84 | L | 93.8 | Very high | 93.5 | Very high | 39 Ų | 39 | 44.4 Ų | 44.4 | 20% | 0.204 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.3 | 18.9 | -178.4 | -65.3 | 172.4 | 0 | 0 | 0 | 113.1 | L42 I45 E46 I49 N80 I81 L82 G86 | L42-L84 HydrophobicContact CD1-CD1 3.5Å; L42-L84 HydrophobicContact CD1-CD2 4.28Å; L42-L84 HydrophobicContact CD1-CG 3.93Å; L42-L84 HydrophobicContact CG-CD1 3.99Å; L42-L84 HydrophobicContact CG-CD2 4.37Å; L42-L84 HydrophobicContact CG-CG 4.49Å; I45-L84 HydrophobicContact CB-CD1 3.89Å; I45-L84 HydrophobicContact CG2-CD1 3.8Å; E46-L84 HydrophobicContact CB-CD1 3.91Å; E46-L84 HydrophobicContact CB-CD2 4.44Å; I49-L84 HydrophobicContact CD1-CB 3.6Å; I49-L84 HydrophobicContact CD1-CD1 4.32Å; N80-L84 WeakPolarHBondContact O-CB 3.43Å; N80-L84 WeakPolarHBondContact O-CG 3.03Å; N80-L84 PolarHBondContact O-N 3.17Å; I81-L84 CarbonylContact O-C 3.57Å; I81-L84 PolarHBondContact O-N 3.35Å; L82-L84 PolarHBondContact O-N 2.67Å; L84-G86 PolarHBondContact O-N 2.81Å; L84-G86 VanDerWaalsContact O-N 3.11Å |
| 85 | Q | 94.1 | Very high | 93.7 | Very high | 129 Ų | 129 | 42.1 Ų | 42.1 | 60% | 0.603 | 19% | 0.19 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 55.6 | 30.4 | 178.5 | -60.6 | 176.7 | -24.5 | 0 | 0 | 113.8 | I81 L82 R83 C87 D88 A89 | I81-Q85 PolarHBondContact O-N 2.92Å; L82-Q85 PolarHBondContact O-N 3.03Å; R83-Q85 VanDerWaalsContact C-N 3.32Å; Q85-C87 PolarHBondContact O-N 3.32Å; Q85-D88 HydrophobicContact CB-CB 4.39Å; Q85-D88 PolarHBondContact O-N 3.11Å; Q85-D88 VanDerWaalsContact O-N 3.08Å; Q85-A89 PolarHBondContact O-N 3.45Å |
| 86 | G | 94.2 | Very high | 93.8 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.7 | -26 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | I81 L84 T90 | I81-G86 PolarHBondContact O-N 3.09Å; L84-G86 PolarHBondContact O-N 2.81Å; L84-G86 VanDerWaalsContact O-N 3.11Å; G86-T90 WeakPolarHBondContact O-CB 3.29Å; G86-T90 PolarHBondContact O-N 3.04Å; G86-T90 PolarHBondContact O-OG1 3.48Å |
| 87 | C | 95 | Very high | 93.7 | Very high | 4 Ų | 4 | 41.1 Ų | 41.1 | 3% | 0.027 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.8 | -45.9 | 171.4 | 52.2 | 0 | 0 | 0 | 0 | 112 | Q85 T90 L91 I112 | Q85-C87 PolarHBondContact O-N 3.32Å; C87-T90 PolarHBondContact O-N 3.36Å; C87-T90 VanDerWaalsContact O-N 3.15Å; C87-L91 WeakPolarHBondContact O-CG 3.47Å; C87-L91 PolarHBondContact O-N 2.82Å; C87-I112 HydrophobicContact CB-CD1 4.34Å |
| 88 | D | 95.2 | Very high | 93.5 | Very high | 46 Ų | 46 | 46.3 Ų | 46.3 | 25% | 0.246 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.3 | -43.9 | -176.3 | -61.8 | 1.7 | 0 | 0 | 0 | 110.6 | Q85 T90 L91 N92 Y125 | Q85-D88 HydrophobicContact CB-CB 4.39Å; Q85-D88 PolarHBondContact O-N 3.11Å; Q85-D88 VanDerWaalsContact O-N 3.08Å; D88-T90 VanDerWaalsContact C-N 3.29Å; D88-T90 PolarHBondContact O-N 2.9Å; D88-L91 PolarHBondContact O-N 3.35Å; D88-N92 VanDerWaalsContact O-CB 3.26Å; D88-N92 WeakPolarHBondContact O-CB 3.33Å; D88-N92 PolarHBondContact O-N 3.21Å; D88-Y125 HydrophobicContact CB-CD2 3.82Å; D88-Y125 HydrophobicContact CB-CE2 3.78Å |
| 89 | A | 95.3 | Very high | 93.4 | Very high | 8 Ų | 8 | 49.9 Ų | 49.9 | 7% | 0.066 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.1 | -41.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | I49 L52 T53 Q85 L93 | I49-A89 HydrophobicContact CG2-CB 3.84Å; L52-A89 HydrophobicContact CB-CB 4.32Å; L52-A89 HydrophobicContact CD1-CB 4.33Å; T53-A89 HydrophobicContact CG2-CB 3.85Å; Q85-A89 PolarHBondContact O-N 3.45Å; A89-L93 WeakPolarHBondContact O-CB 3.27Å; A89-L93 PolarHBondContact O-N 2.84Å |
| 90 | T | 96.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -71 | -40.6 | 179.9 | -54.5 | 0 | 0 | 0 | 0 | 112.2 | L65 G86 C87 D88 L93 L94 C105 L108 L109 | L65-T90 HydrophobicContact CD2-CG2 4.28Å; G86-T90 WeakPolarHBondContact O-CB 3.29Å; G86-T90 PolarHBondContact O-N 3.04Å; G86-T90 PolarHBondContact O-OG1 3.48Å; C87-T90 PolarHBondContact O-N 3.36Å; C87-T90 VanDerWaalsContact O-N 3.15Å; D88-T90 VanDerWaalsContact C-N 3.29Å; D88-T90 PolarHBondContact O-N 2.9Å; T90-L93 PolarHBondContact O-N 3.21Å; T90-L94 WeakPolarHBondContact O-CB 3.43Å; T90-L94 PolarHBondContact O-N 3.49Å; T90-C105 HydrophobicContact CG2-CB 3.88Å; T90-L108 HydrophobicContact CG2-CB 4.42Å; T90-L108 HydrophobicContact CG2-CD2 4.12Å; T90-L108 HydrophobicContact CG2-CG 4.47Å; T90-L108 WeakPolarHBondContact OG1-CD2 3.26Å; T90-L109 HydrophobicContact CG2-CD1 4.11Å; T90-L109 HydrophobicContact CG2-CD2 4.12Å; T90-L109 HydrophobicContact CG2-CG 3.77Å |
| 91 | L | 96.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.8 | -48.5 | 175.6 | -75.9 | 167.5 | 0 | 0 | 0 | 111.2 | C87 D88 L93 L94 F95 L109 I122 Y125 | C87-L91 WeakPolarHBondContact O-CG 3.47Å; C87-L91 PolarHBondContact O-N 2.82Å; D88-L91 PolarHBondContact O-N 3.35Å; L91-L93 PolarHBondContact O-N 3.07Å; L91-L94 WeakPolarHBondContact O-CB 3.43Å; L91-L94 PolarHBondContact O-N 3.48Å; L91-L94 VanDerWaalsContact O-N 3.15Å; L91-F95 HydrophobicContact CB-CE2 3.99Å; L91-F95 HydrophobicContact CB-CZ 4.33Å; L91-F95 HydrophobicContact CD2-CE1 4.48Å; L91-F95 HydrophobicContact CD2-CE2 4.27Å; L91-F95 HydrophobicContact CD2-CZ 3.77Å; L91-F95 WeakPolarHBondContact O-CD2 3.29Å; L91-F95 VanDerWaalsContact O-CG 3.23Å; L91-F95 WeakPolarHBondContact O-CG 3.49Å; L91-F95 PolarHBondContact O-N 2.93Å; L91-L109 HydrophobicContact CD2-CD1 3.67Å; L91-L109 HydrophobicContact CD2-CD2 3.97Å; L91-L109 HydrophobicContact CD2-CG 4.49Å; L91-L109 HydrophobicContact CG-CD1 4.24Å; L91-L109 HydrophobicContact CG-CD2 3.84Å; L91-I122 HydrophobicContact CD1-CG1 4.45Å; L91-I122 HydrophobicContact CD1-CG2 4.33Å; L91-I122 HydrophobicContact CD2-CG2 4.39Å; L91-Y125 HydrophobicContact CB-CD1 4.01Å; L91-Y125 HydrophobicContact CB-CE1 4Å; L91-Y125 HydrophobicContact CB-CG 4.29Å; L91-Y125 HydrophobicContact CD1-CD1 3.83Å; L91-Y125 HydrophobicContact CD1-CD2 4.17Å; L91-Y125 HydrophobicContact CD1-CG 3.55Å; L91-Y125 HydrophobicContact CG-CD1 4.5Å |
| 92 | N | 94.7 | Very high | 93.3 | Very high | 48 Ų | 48 | 46.6 Ų | 46.6 | 26% | 0.257 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -56.8 | -41.3 | 175.6 | -177.3 | 46.9 | 0 | 0 | 0 | 111.5 | D88 K96 Y125 | D88-N92 VanDerWaalsContact O-CB 3.26Å; D88-N92 WeakPolarHBondContact O-CB 3.33Å; D88-N92 PolarHBondContact O-N 3.21Å; N92-K96 PolarHBondContact O-N 3.46Å; N92-K96 WeakPolarHBondContact OD1-CD 3.45Å; N92-K96 VanDerWaalsContact OD1-CE 3.26Å; N92-K96 WeakPolarHBondContact OD1-CE 3.47Å; N92-K96 PolarHBondContact OD1-NZ 3.39Å; N92-Y125 WeakPolarHBondContact CB-OH 3.46Å |
| 93 | L | 95.1 | Very high | 93.3 | Very high | 10 Ų | 10 | 47.2 Ų | 47.2 | 5% | 0.052 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -66.5 | -49.1 | 175 | -174.1 | 61.4 | 0 | 0 | 0 | 111.3 | L52 K61 L65 A89 T90 L91 F95 K96 A97 L101 | L52-L93 HydrophobicContact CB-CD2 4.32Å; L52-L93 HydrophobicContact CD2-CD2 4.07Å; K61-L93 HydrophobicContact CB-CD2 4.31Å; K61-L93 HydrophobicContact CD-CD1 3.64Å; K61-L93 HydrophobicContact CD-CD2 4.23Å; L65-L93 HydrophobicContact CD1-CD2 3.95Å; L65-L93 HydrophobicContact CD2-CD2 4.48Å; L65-L93 HydrophobicContact CG-CD2 4.39Å; A89-L93 WeakPolarHBondContact O-CB 3.27Å; A89-L93 PolarHBondContact O-N 2.84Å; T90-L93 PolarHBondContact O-N 3.21Å; L91-L93 PolarHBondContact O-N 3.07Å; L93-F95 PolarHBondContact O-N 3.28Å; L93-K96 PolarHBondContact O-N 3.05Å; L93-K96 VanDerWaalsContact O-N 3.12Å; L93-A97 HydrophobicContact CD1-CB 3.9Å; L93-A97 HydrophobicContact CG-CB 4.11Å; L93-A97 WeakPolarHBondContact O-CA 3.4Å; L93-A97 WeakPolarHBondContact O-CB 3.43Å; L93-A97 PolarHBondContact O-N 3.29Å; L93-L101 HydrophobicContact CD1-CD1 4.16Å; L93-L101 HydrophobicContact CD2-CD1 4.45Å |
| 94 | L | 95.3 | Very high | 93.4 | Very high | 3 Ų | 3 | 42.7 Ų | 42.7 | 2% | 0.016 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -51.7 | -42.4 | 178 | 175.9 | 63.6 | 0 | 0 | 0 | 112.3 | T90 L91 K102 C105 L106 L109 L132 | T90-L94 WeakPolarHBondContact O-CB 3.43Å; T90-L94 PolarHBondContact O-N 3.49Å; L91-L94 WeakPolarHBondContact O-CB 3.43Å; L91-L94 PolarHBondContact O-N 3.48Å; L91-L94 VanDerWaalsContact O-N 3.15Å; L94-K102 HydrophobicContact CD1-CB 4.04Å; L94-K102 HydrophobicContact CD1-CG 4.07Å; L94-C105 HydrophobicContact CB-CB 3.91Å; L94-C105 HydrophobicContact CD1-CB 4.04Å; L94-L106 HydrophobicContact CD1-CD1 4.47Å; L94-L106 HydrophobicContact CD1-CD2 4.1Å; L94-L106 HydrophobicContact CD1-CG 3.9Å; L94-L106 HydrophobicContact CD2-CD2 3.84Å; L94-L106 HydrophobicContact CD2-CG 4.47Å; L94-L109 HydrophobicContact CD2-CD1 3.74Å; L94-L132 HydrophobicContact CD2-CD2 4.16Å |
| 95 | F | 92.8 | Very high | 93.6 | Very high | 35 Ų | 35 | 40.9 Ų | 40.9 | 15% | 0.154 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -75.7 | -23.1 | -175.7 | -56.9 | -31.6 | 0 | 0 | 0 | 113.8 | L91 L93 Y125 Q131 L132 Q135 | L91-F95 HydrophobicContact CB-CE2 3.99Å; L91-F95 HydrophobicContact CB-CZ 4.33Å; L91-F95 HydrophobicContact CD2-CE1 4.48Å; L91-F95 HydrophobicContact CD2-CE2 4.27Å; L91-F95 HydrophobicContact CD2-CZ 3.77Å; L91-F95 WeakPolarHBondContact O-CD2 3.29Å; L91-F95 VanDerWaalsContact O-CG 3.23Å; L91-F95 WeakPolarHBondContact O-CG 3.49Å; L91-F95 PolarHBondContact O-N 2.93Å; L93-F95 PolarHBondContact O-N 3.28Å; F95-Y125 HydrophobicContact CD2-CE1 4.25Å; F95-Y125 HydrophobicContact CE2-CD1 4.14Å; F95-Y125 AromaticContact CE2-CE1 3.8Å; F95-Y125 HydrophobicContact CE2-CE1 3.8Å; F95-Q131 HydrophobicContact CD1-CB 3.84Å; F95-Q131 HydrophobicContact CD2-CB 4.03Å; F95-Q131 HydrophobicContact CD2-CG 4.13Å; F95-Q131 HydrophobicContact CE1-CB 3.51Å; F95-Q131 HydrophobicContact CE2-CB 3.71Å; F95-Q131 HydrophobicContact CE2-CG 4.05Å; F95-Q131 HydrophobicContact CG-CB 4.1Å; F95-Q131 HydrophobicContact CG-CG 4.44Å; F95-Q131 HydrophobicContact CZ-CB 3.44Å; F95-Q131 VanDerWaalsContact CZ-CB 3.44Å; F95-Q131 HydrophobicContact CZ-CG 4.29Å; F95-L132 HydrophobicContact CE1-CD2 4.29Å; F95-Q135 HydrophobicContact CD1-CG 4.15Å |
| 96 | K | 90.9 | Very high | 93.7 | Very high | 162 Ų | 162 | 34.7 Ų | 34.7 | 70% | 0.704 | 17% | 0.172 | S | C | * | . | H | α-helix | trans | -111.7 | -16.8 | -175.6 | -66.2 | 174.2 | 178.5 | 166.7 | 0 | 114.5 | N92 L93 | N92-K96 PolarHBondContact O-N 3.46Å; N92-K96 WeakPolarHBondContact OD1-CD 3.45Å; N92-K96 VanDerWaalsContact OD1-CE 3.26Å; N92-K96 WeakPolarHBondContact OD1-CE 3.47Å; N92-K96 PolarHBondContact OD1-NZ 3.39Å; L93-K96 PolarHBondContact O-N 3.05Å; L93-K96 VanDerWaalsContact O-N 3.12Å |
| 97 | A | 86.2 | Confident | 93.8 | Very high | 17 Ų | 17 | 37.8 Ų | 37.8 | 14% | 0.14 | 19% | 0.189 | C | C | . | . | S | Bend | trans | -76.6 | 159.3 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114 | L93 L101 K102 | L93-A97 HydrophobicContact CD1-CB 3.9Å; L93-A97 HydrophobicContact CG-CB 4.11Å; L93-A97 WeakPolarHBondContact O-CA 3.4Å; L93-A97 WeakPolarHBondContact O-CB 3.43Å; L93-A97 PolarHBondContact O-N 3.29Å; A97-L101 HydrophobicContact CB-CB 3.9Å; A97-L101 HydrophobicContact CB-CD1 3.94Å; A97-L101 HydrophobicContact CB-CG 4.46Å; A97-K102 WeakPolarHBondContact O-CE 3.24Å |
| 98 | E | 85.7 | Confident | 93.9 | Very high | 111 Ų | 111 | 37.6 Ų | 37.6 | 52% | 0.519 | 19% | 0.187 | S | C | . | . | trans | -58.5 | 152.4 | 163.5 | -64.4 | 172.9 | -166 | 0 | 0 | 111.4 | H58 V100 L101 | H58-E98 IonicContact CE1-OE2 2.92Å; H58-E98 IonicContact CG-OE2 3.81Å; H58-E98 IonicContact ND1-OE1 3.52Å; H58-E98 IonicContact ND1-OE2 3.68Å; H58-E98 PolarHBondContact ND1-OE2 3.35Å; E98-V100 PolarHBondContact O-N 2.89Å; E98-L101 PolarHBondContact O-N 3.27Å; E98-L101 VanDerWaalsContact O-N 3.08Å | ||
| 99 | E | 90.5 | Very high | 94.1 | Very high | 78 Ų | 78 | 35.4 Ų | 35.4 | 36% | 0.364 | 18% | 0.176 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.7 | -24.6 | -179.6 | -68.9 | -76.7 | 118.8 | 0 | 0 | 113.4 | L101 K102 P103 S139 F142 | E99-L101 PolarHBondContact O-N 2.97Å; E99-K102 WeakPolarHBondContact OE1-CE 3.25Å; E99-K102 IonicContact OE1-NZ 3.59Å; E99-K102 PolarHBondContact OE1-NZ 3.31Å; E99-P103 WeakPolarHBondContact O-CD 3.49Å; E99-S139 PolarHBondContact OE2-OG 3.35Å; E99-F142 HydrophobicContact CB-CE2 4.5Å; E99-F142 WeakPolarHBondContact O-CZ 3.46Å; E99-F142 WeakPolarHBondContact OE2-CE2 3.26Å |
| 100 | V | 91.4 | Very high | 94.2 | Very high | 80 Ų | 80 | 36 Ų | 36 | 49% | 0.485 | 18% | 0.178 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -34.2 | 179.9 | -179.3 | 0 | 0 | 0 | 0 | 112.5 | E98 | E98-V100 PolarHBondContact O-N 2.89Š|
| 101 | L | 93.5 | Very high | 94.2 | Very high | 5 Ų | 5 | 37.5 Ų | 37.5 | 3% | 0.026 | 18% | 0.183 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -25.7 | -177.5 | -63.7 | 178.5 | 0 | 0 | 0 | 112.9 | H58 K61 L62 L65 L93 A97 E98 E99 P103 Y104 C105 | H58-L101 HydrophobicContact CB-CD1 4Å; H58-L101 HydrophobicContact CB-CD2 4.25Å; H58-L101 HydrophobicContact CB-CG 4.16Å; H58-L101 WeakPolarHBondContact O-CD2 3.37Å; K61-L101 HydrophobicContact CB-CD1 3.94Å; K61-L101 HydrophobicContact CB-CD2 4.26Å; K61-L101 HydrophobicContact CD-CD1 4.3Å; L62-L101 HydrophobicContact CB-CD2 3.79Å; L62-L101 HydrophobicContact CD1-CD2 4.35Å; L65-L101 HydrophobicContact CD1-CD2 4.37Å; L93-L101 HydrophobicContact CD1-CD1 4.16Å; L93-L101 HydrophobicContact CD2-CD1 4.45Å; A97-L101 HydrophobicContact CB-CB 3.9Å; A97-L101 HydrophobicContact CB-CD1 3.94Å; A97-L101 HydrophobicContact CB-CG 4.46Å; E98-L101 PolarHBondContact O-N 3.27Å; E98-L101 VanDerWaalsContact O-N 3.08Å; E99-L101 PolarHBondContact O-N 2.97Å; L101-P103 VanDerWaalsContact C-CD 3.46Å; L101-Y104 PolarHBondContact O-N 3.37Å; L101-C105 PolarHBondContact O-N 3.47Å; L101-C105 VanDerWaalsContact O-N 3.09Å |
| 102 | K | 94.5 | Very high | 94.3 | Very high | 15 Ų | 15 | 37.5 Ų | 37.5 | 7% | 0.065 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -53.6 | -43 | -174 | -64.3 | -170.4 | 178.9 | 177.8 | 0 | 114.3 | L94 A97 E99 Y104 C105 L106 F142 | L94-K102 HydrophobicContact CD1-CB 4.04Å; L94-K102 HydrophobicContact CD1-CG 4.07Å; A97-K102 WeakPolarHBondContact O-CE 3.24Å; E99-K102 WeakPolarHBondContact OE1-CE 3.25Å; E99-K102 IonicContact OE1-NZ 3.59Å; E99-K102 PolarHBondContact OE1-NZ 3.31Å; K102-Y104 VanDerWaalsContact C-N 3.27Å; K102-Y104 PolarHBondContact O-N 3.49Å; K102-C105 PolarHBondContact O-N 3.05Å; K102-L106 WeakPolarHBondContact O-CB 3.44Å; K102-L106 VanDerWaalsContact O-CG 3.27Å; K102-L106 WeakPolarHBondContact O-CG 3.49Å; K102-L106 PolarHBondContact O-N 3.18Å; K102-F142 HydrophobicContact CB-CD2 4.03Å; K102-F142 HydrophobicContact CB-CE2 3.66Å; K102-F142 HydrophobicContact CB-CZ 4.11Å; K102-F142 HydrophobicContact CD-CD2 4Å; K102-F142 HydrophobicContact CD-CE2 3.75Å; K102-F142 HydrophobicContact CG-CE2 4.25Å |
| 103 | P | 94.7 | Very high | 94.4 | Very high | 30 Ų | 30 | 35.2 Ų | 35.2 | 20% | 0.195 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.6 | -39 | 177.2 | -24 | 31.9 | 0 | 0 | 0 | 113.3 | E99 L101 N107 F142 Q145 | E99-P103 WeakPolarHBondContact O-CD 3.49Å; L101-P103 VanDerWaalsContact C-CD 3.46Å; P103-N107 WeakPolarHBondContact O-CB 3.34Å; P103-N107 PolarHBondContact O-N 3.5Å; P103-N107 PolarHBondContact O-ND2 3.21Å; P103-F142 HydrophobicContact CG-CD1 4.4Å; P103-F142 HydrophobicContact CG-CE1 3.59Å; P103-F142 HydrophobicContact CG-CZ 3.97Å; P103-Q145 PolarHBondContact O-NE2 3.46Å |
| 104 | Y | 94.8 | Very high | 94.4 | Very high | 77 Ų | 77 | 39.2 Ų | 39.2 | 30% | 0.302 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -76.7 | -39.2 | -177 | -66.1 | -92.9 | 0 | 0 | 0 | 111.4 | L62 K66 L101 K102 L106 N107 L108 | L62-Y104 HydrophobicContact CD1-CD1 3.94Å; L62-Y104 HydrophobicContact CD1-CD2 3.31Å; L62-Y104 HydrophobicContact CD1-CE1 3.88Å; L62-Y104 HydrophobicContact CD1-CE2 3.27Å; L62-Y104 HydrophobicContact CD1-CG 3.67Å; K66-Y104 HydrophobicContact CD-CE1 4.41Å; K66-Y104 HydrophobicContact CG-CD1 4.01Å; K66-Y104 HydrophobicContact CG-CE1 3.85Å; L101-Y104 PolarHBondContact O-N 3.37Å; K102-Y104 VanDerWaalsContact C-N 3.27Å; K102-Y104 PolarHBondContact O-N 3.49Å; Y104-L106 VanDerWaalsContact C-N 3.35Å; Y104-N107 PolarHBondContact O-N 3.4Å; Y104-L108 PolarHBondContact O-N 3.07Å; Y104-L108 VanDerWaalsContact O-N 3.07Å |
| 105 | C | 97.1 | Very high | 94.4 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.4 | -47.2 | 169.8 | -63.4 | 0 | 0 | 0 | 0 | 111.1 | T90 L94 L101 K102 L108 L109 | T90-C105 HydrophobicContact CG2-CB 3.88Å; L94-C105 HydrophobicContact CB-CB 3.91Å; L94-C105 HydrophobicContact CD1-CB 4.04Å; L101-C105 PolarHBondContact O-N 3.47Å; L101-C105 VanDerWaalsContact O-N 3.09Å; K102-C105 PolarHBondContact O-N 3.05Å; C105-L108 PolarHBondContact O-N 3.36Å; C105-L109 WeakPolarHBondContact O-CB 3.24Å; C105-L109 VanDerWaalsContact O-CG 3.26Å; C105-L109 WeakPolarHBondContact O-CG 3.01Å; C105-L109 PolarHBondContact O-N 3.46Å |
| 106 | L | 97 | Very high | 94.5 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.3 | -43.7 | 179.9 | -72.3 | 167.5 | 0 | 0 | 0 | 111.8 | L94 K102 Y104 L108 L109 I110 F142 Q145 I146 L149 | L94-L106 HydrophobicContact CD1-CD1 4.47Å; L94-L106 HydrophobicContact CD1-CD2 4.1Å; L94-L106 HydrophobicContact CD1-CG 3.9Å; L94-L106 HydrophobicContact CD2-CD2 3.84Å; L94-L106 HydrophobicContact CD2-CG 4.47Å; K102-L106 WeakPolarHBondContact O-CB 3.44Å; K102-L106 VanDerWaalsContact O-CG 3.27Å; K102-L106 WeakPolarHBondContact O-CG 3.49Å; K102-L106 PolarHBondContact O-N 3.18Å; Y104-L106 VanDerWaalsContact C-N 3.35Å; L106-L108 PolarHBondContact O-N 3.16Å; L106-L109 PolarHBondContact O-N 3.07Å; L106-I110 WeakPolarHBondContact O-CB 3.1Å; L106-I110 WeakPolarHBondContact O-CD1 3.21Å; L106-I110 WeakPolarHBondContact O-CG1 3.04Å; L106-I110 PolarHBondContact O-N 2.83Å; L106-F142 HydrophobicContact CD1-CB 3.78Å; L106-F142 HydrophobicContact CD1-CG 4.13Å; L106-Q145 HydrophobicContact CB-CB 4.14Å; L106-Q145 HydrophobicContact CD1-CB 3.85Å; L106-Q145 HydrophobicContact CG-CB 4.48Å; L106-I146 HydrophobicContact CD1-CG1 4.08Å; L106-I146 HydrophobicContact CD2-CG1 3.85Å; L106-L149 HydrophobicContact CD2-CD2 4.41Å |
| 107 | N | 97.1 | Very high | 94.7 | Very high | 64 Ų | 64 | 43.5 Ų | 43.5 | 34% | 0.342 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -61.8 | -42.9 | 177.6 | -73.9 | -15 | 0 | 0 | 0 | 112.2 | L69 P103 Y104 I110 R111 Q145 | L69-N107 HydrophobicContact CD1-CB 4.5Å; L69-N107 HydrophobicContact CD2-CB 4.2Å; P103-N107 WeakPolarHBondContact O-CB 3.34Å; P103-N107 PolarHBondContact O-N 3.5Å; P103-N107 PolarHBondContact O-ND2 3.21Å; Y104-N107 PolarHBondContact O-N 3.4Å; N107-I110 PolarHBondContact O-N 3Å; N107-R111 PolarHBondContact O-N 2.99Å; N107-Q145 PolarHBondContact OD1-NE2 3.39Å |
| 108 | L | 97.5 | Very high | 95.1 | Very high | 0 Ų | 0 | 42.7 Ų | 42.7 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.5 | -43.3 | 175.9 | -179.5 | 57.6 | 0 | 0 | 0 | 111.5 | L65 L68 A72 T90 Y104 C105 L106 R111 I112 | L65-L108 HydrophobicContact CD2-CD2 4.13Å; L68-L108 HydrophobicContact CB-CD1 4.43Å; L68-L108 HydrophobicContact CB-CD2 3.83Å; L68-L108 HydrophobicContact CD1-CD2 4.28Å; A72-L108 HydrophobicContact CB-CD1 3.86Å; T90-L108 HydrophobicContact CG2-CB 4.42Å; T90-L108 HydrophobicContact CG2-CD2 4.12Å; T90-L108 HydrophobicContact CG2-CG 4.47Å; T90-L108 WeakPolarHBondContact OG1-CD2 3.26Å; Y104-L108 PolarHBondContact O-N 3.07Å; Y104-L108 VanDerWaalsContact O-N 3.07Å; C105-L108 PolarHBondContact O-N 3.36Å; L106-L108 PolarHBondContact O-N 3.16Å; L108-R111 PolarHBondContact O-N 3.01Å; L108-I112 HydrophobicContact CD1-CD1 4.16Å; L108-I112 HydrophobicContact CD1-CG1 4.4Å; L108-I112 HydrophobicContact CG-CD1 3.93Å; L108-I112 WeakPolarHBondContact O-CB 3.47Å; L108-I112 VanDerWaalsContact O-CG1 3.25Å; L108-I112 WeakPolarHBondContact O-CG1 3.49Å; L108-I112 PolarHBondContact O-N 3.3Å |
| 109 | L | 98 | Very high | 95.7 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -66.3 | -38.2 | 177.5 | -70 | 167.3 | 0 | 0 | 0 | 112.6 | T90 L91 L94 C105 L106 I112 S113 I122 L149 | T90-L109 HydrophobicContact CG2-CD1 4.11Å; T90-L109 HydrophobicContact CG2-CD2 4.12Å; T90-L109 HydrophobicContact CG2-CG 3.77Å; L91-L109 HydrophobicContact CD2-CD1 3.67Å; L91-L109 HydrophobicContact CD2-CD2 3.97Å; L91-L109 HydrophobicContact CD2-CG 4.49Å; L91-L109 HydrophobicContact CG-CD1 4.24Å; L91-L109 HydrophobicContact CG-CD2 3.84Å; L94-L109 HydrophobicContact CD2-CD1 3.74Å; C105-L109 WeakPolarHBondContact O-CB 3.24Å; C105-L109 VanDerWaalsContact O-CG 3.26Å; C105-L109 WeakPolarHBondContact O-CG 3.01Å; C105-L109 PolarHBondContact O-N 3.46Å; L106-L109 PolarHBondContact O-N 3.07Å; L109-I112 PolarHBondContact O-N 3.22Å; L109-S113 VanDerWaalsContact O-CB 3.28Å; L109-S113 WeakPolarHBondContact O-CB 3.46Å; L109-S113 PolarHBondContact O-N 3.15Å; L109-S113 PolarHBondContact O-OG 3.41Å; L109-I122 HydrophobicContact CB-CD1 4.47Å; L109-I122 HydrophobicContact CD2-CD1 4.1Å; L109-I122 HydrophobicContact CD2-CG1 4.18Å; L109-L149 HydrophobicContact CB-CD1 4.21Å; L109-L149 HydrophobicContact CB-CD2 4.02Å; L109-L149 HydrophobicContact CD1-CD2 4.39Å |
| 110 | I | 97.9 | Very high | 95.9 | Very high | 22 Ų | 22 | 39.5 Ų | 39.5 | 11% | 0.113 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59.5 | -51.3 | 173.5 | -72.2 | 163.7 | 0 | 0 | 0 | 109 | L106 N107 I112 S113 E114 Q145 Q148 L149 | L106-I110 WeakPolarHBondContact O-CB 3.1Å; L106-I110 WeakPolarHBondContact O-CD1 3.21Å; L106-I110 WeakPolarHBondContact O-CG1 3.04Å; L106-I110 PolarHBondContact O-N 2.83Å; N107-I110 PolarHBondContact O-N 3Å; I110-I112 VanDerWaalsContact C-N 3.32Å; I110-I112 PolarHBondContact O-N 2.96Å; I110-S113 WeakPolarHBondContact CA-OG 3.43Å; I110-S113 PolarHBondContact O-N 3.22Å; I110-S113 VanDerWaalsContact O-N 3.11Å; I110-S113 PolarHBondContact O-OG 3.4Å; I110-E114 PolarHBondContact O-N 3.38Å; I110-Q145 HydrophobicContact CD1-CB 4.21Å; I110-Q148 HydrophobicContact CD1-CB 4.21Å; I110-Q148 HydrophobicContact CD1-CG 4.05Å; I110-Q148 HydrophobicContact CG1-CG 4.27Å; I110-Q148 HydrophobicContact CG2-CG 4.12Å; I110-L149 HydrophobicContact CG1-CB 4.03Å |
| 111 | R | 97.4 | Very high | 96.1 | Very high | 30 Ų | 30 | 36.7 Ų | 36.7 | 11% | 0.113 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.1 | -43.3 | 176.7 | 177.5 | 55.6 | -174.7 | 134.1 | 3.3 | 112 | L69 A72 E75 N107 L108 S113 E114 | L69-R111 HydrophobicContact CD1-CB 4.43Å; A72-R111 HydrophobicContact CB-CG 3.9Å; A72-R111 PolarHBondContact O-NE 2.99Å; A72-R111 PolarHBondContact O-NH2 3.06Å; E75-R111 IonicContact OE1-CZ 2.7Å; E75-R111 IonicContact OE1-NH1 3.05Å; E75-R111 IonicContact OE1-NH2 2.7Å; E75-R111 PolarHBondContact OE1-NH2 2.82Å; N107-R111 PolarHBondContact O-N 2.99Å; L108-R111 PolarHBondContact O-N 3.01Å; R111-S113 VanDerWaalsContact C-N 3.34Å; R111-S113 PolarHBondContact O-N 3.39Å; R111-E114 VanDerWaalsContact CD-OE2 3.25Å; R111-E114 WeakPolarHBondContact CD-OE2 3.47Å; R111-E114 IonicContact CZ-OE2 2.85Å; R111-E114 IonicContact NE-OE2 3.75Å; R111-E114 IonicContact NH1-OE2 3.83Å; R111-E114 PolarHBondContact NH1-OE2 2.89Å; R111-E114 WeakPolarHBondContact O-CB 3.47Å; R111-E114 PolarHBondContact O-N 3.47Å |
| 112 | I | 97.3 | Very high | 96.2 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.5 | -45.9 | 176 | -72.1 | 165.1 | 0 | 0 | 0 | 111.5 | L78 I81 L82 C87 L108 L109 I110 E114 S115 G118 I122 | L78-I112 HydrophobicContact CD1-CB 4.3Å; L78-I112 HydrophobicContact CD1-CG1 3.71Å; I81-I112 HydrophobicContact CG2-CD1 4.28Å; L82-I112 HydrophobicContact CD2-CG2 3.7Å; L82-I112 HydrophobicContact CG-CG2 4.41Å; C87-I112 HydrophobicContact CB-CD1 4.34Å; L108-I112 HydrophobicContact CD1-CD1 4.16Å; L108-I112 HydrophobicContact CD1-CG1 4.4Å; L108-I112 HydrophobicContact CG-CD1 3.93Å; L108-I112 WeakPolarHBondContact O-CB 3.47Å; L108-I112 VanDerWaalsContact O-CG1 3.25Å; L108-I112 WeakPolarHBondContact O-CG1 3.49Å; L108-I112 PolarHBondContact O-N 3.3Å; L109-I112 PolarHBondContact O-N 3.22Å; I110-I112 VanDerWaalsContact C-N 3.32Å; I110-I112 PolarHBondContact O-N 2.96Å; I112-E114 PolarHBondContact O-N 2.83Å; I112-S115 PolarHBondContact O-N 2.91Å; I112-S115 PolarHBondContact O-OG 3.04Å; I112-G118 WeakPolarHBondContact O-CA 3.24Å; I112-I122 HydrophobicContact CB-CD1 4.47Å; I112-I122 HydrophobicContact CG2-CD1 4.02Å; I112-I122 HydrophobicContact CG2-CG1 4.49Å |
| 113 | S | 97.5 | Very high | 96.3 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -70.2 | -6.7 | -177.6 | 72 | 0 | 0 | 0 | 0 | 114.4 | L109 I110 R111 S115 R119 N152 | L109-S113 VanDerWaalsContact O-CB 3.28Å; L109-S113 WeakPolarHBondContact O-CB 3.46Å; L109-S113 PolarHBondContact O-N 3.15Å; L109-S113 PolarHBondContact O-OG 3.41Å; I110-S113 WeakPolarHBondContact CA-OG 3.43Å; I110-S113 PolarHBondContact O-N 3.22Å; I110-S113 VanDerWaalsContact O-N 3.11Å; I110-S113 PolarHBondContact O-OG 3.4Å; R111-S113 VanDerWaalsContact C-N 3.34Å; R111-S113 PolarHBondContact O-N 3.39Å; S113-S115 PolarHBondContact O-N 3.37Å; S113-R119 WeakPolarHBondContact O-CD 3.42Å; S113-R119 WeakPolarHBondContact O-CG 3.38Å; S113-R119 PolarHBondContact O-NE 3.36Å; S113-N152 VanDerWaalsContact OG-CB 3.26Å; S113-N152 WeakPolarHBondContact OG-CB 3.29Å; S113-N152 PolarHBondContact OG-ND2 3.47Å |
| 114 | E | 96 | Very high | 96.2 | Very high | 95 Ų | 95 | 42.4 Ų | 42.4 | 44% | 0.444 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -33.1 | 171.3 | -71.2 | 168.6 | -171.6 | 0 | 0 | 110.9 | I110 R111 I112 R119 | I110-E114 PolarHBondContact O-N 3.38Å; R111-E114 VanDerWaalsContact CD-OE2 3.25Å; R111-E114 WeakPolarHBondContact CD-OE2 3.47Å; R111-E114 IonicContact CZ-OE2 2.85Å; R111-E114 IonicContact NE-OE2 3.75Å; R111-E114 IonicContact NH1-OE2 3.83Å; R111-E114 PolarHBondContact NH1-OE2 2.89Å; R111-E114 WeakPolarHBondContact O-CB 3.47Å; R111-E114 PolarHBondContact O-N 3.47Å; I112-E114 PolarHBondContact O-N 2.83Å; E114-R119 PolarHBondContact O-NH2 3.5Å |
| 115 | S | 94.7 | Very high | 96.1 | Very high | 30 Ų | 30 | 41.3 Ų | 41.3 | 21% | 0.21 | 20% | 0.195 | C | C | . | . | S | Bend | trans | -84.1 | 144.5 | 174.2 | 75.3 | 0 | 0 | 0 | 0 | 112.5 | I112 S113 R117 G118 R119 | I112-S115 PolarHBondContact O-N 2.91Å; I112-S115 PolarHBondContact O-OG 3.04Å; S113-S115 PolarHBondContact O-N 3.37Å; S115-R117 VanDerWaalsContact C-N 3.3Å; S115-R117 PolarHBondContact O-N 3.41Å; S115-G118 PolarHBondContact O-N 3.17Å; S115-G118 VanDerWaalsContact O-N 3.17Å; S115-G118 PolarHBondContact OG-N 2.89Å; S115-R119 WeakPolarHBondContact O-CG 3.49Å; S115-R119 PolarHBondContact O-N 2.99Å |
| 116 | L | 94.2 | Very high | 95.6 | Very high | 106 Ų | 106 | 46.4 Ų | 46.4 | 56% | 0.555 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -58 | -42.9 | 175.2 | 178.4 | 60.9 | 0 | 0 | 0 | 111.9 | G118 R119 I120 V156 | L116-G118 VanDerWaalsContact C-N 3.3Å; L116-G118 PolarHBondContact O-N 2.88Å; L116-R119 PolarHBondContact O-N 3.36Å; L116-I120 HydrophobicContact CD1-CD1 4.17Å; L116-I120 HydrophobicContact CD1-CG1 4.38Å; L116-I120 HydrophobicContact CG-CD1 4.06Å; L116-I120 WeakPolarHBondContact O-CG1 3.35Å; L116-I120 PolarHBondContact O-N 3.21Å; L116-V156 HydrophobicContact CD1-CG2 3.98Å |
| 117 | R | 94.7 | Very high | 95.1 | Very high | 153 Ų | 153 | 50.8 Ų | 50.8 | 58% | 0.577 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -59.9 | -40.9 | 177.9 | -174.3 | 176.9 | 179.7 | 169.4 | 1.2 | 111.7 | L82 S115 A121 | L82-R117 HydrophobicContact CD1-CB 4.33Å; L82-R117 HydrophobicContact CD1-CG 4.23Å; S115-R117 VanDerWaalsContact C-N 3.3Å; S115-R117 PolarHBondContact O-N 3.41Å; R117-A121 WeakPolarHBondContact O-CB 3.48Å; R117-A121 PolarHBondContact O-N 3.38Å |
| 118 | G | 96.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -68.7 | -37.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | I112 S115 L116 A121 I122 | I112-G118 WeakPolarHBondContact O-CA 3.24Å; S115-G118 PolarHBondContact O-N 3.17Å; S115-G118 VanDerWaalsContact O-N 3.17Å; S115-G118 PolarHBondContact OG-N 2.89Å; L116-G118 VanDerWaalsContact C-N 3.3Å; L116-G118 PolarHBondContact O-N 2.88Å; G118-A121 PolarHBondContact O-N 3.05Å; G118-I122 VanDerWaalsContact O-CG1 3.27Å; G118-I122 WeakPolarHBondContact O-CG1 3.42Å; G118-I122 PolarHBondContact O-N 2.76Å |
| 119 | R | 96.7 | Very high | 94.5 | Very high | 60 Ų | 60 | 48 Ų | 48 | 23% | 0.226 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.1 | -48.3 | 173.3 | -62.8 | 166.8 | -162.7 | -179.2 | 5.9 | 111.1 | S113 E114 S115 L116 I122 L123 N152 L153 V156 | S113-R119 WeakPolarHBondContact O-CD 3.42Å; S113-R119 WeakPolarHBondContact O-CG 3.38Å; S113-R119 PolarHBondContact O-NE 3.36Å; E114-R119 PolarHBondContact O-NH2 3.5Å; S115-R119 WeakPolarHBondContact O-CG 3.49Å; S115-R119 PolarHBondContact O-N 2.99Å; L116-R119 PolarHBondContact O-N 3.36Å; R119-I122 PolarHBondContact O-N 2.88Å; R119-L123 WeakPolarHBondContact O-CD1 3.28Å; R119-L123 VanDerWaalsContact O-CG 3.24Å; R119-L123 WeakPolarHBondContact O-CG 3.47Å; R119-L123 PolarHBondContact O-N 3.39Å; R119-N152 WeakPolarHBondContact CD-O 3.45Å; R119-N152 PolarHBondContact NE-O 3.01Å; R119-L153 HydrophobicContact CB-CD2 4.18Å; R119-L153 HydrophobicContact CG-CD2 4.4Å; R119-V156 HydrophobicContact CB-CG2 3.7Å |
| 120 | I | 95.2 | Very high | 94.3 | Very high | 63 Ų | 63 | 52.8 Ų | 52.8 | 32% | 0.323 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.8 | -49.2 | 178.6 | -66.6 | 169.8 | 0 | 0 | 0 | 110.2 | L116 I122 L123 E124 | L116-I120 HydrophobicContact CD1-CD1 4.17Å; L116-I120 HydrophobicContact CD1-CG1 4.38Å; L116-I120 HydrophobicContact CG-CD1 4.06Å; L116-I120 WeakPolarHBondContact O-CG1 3.35Å; L116-I120 PolarHBondContact O-N 3.21Å; I120-I122 VanDerWaalsContact C-N 3.3Å; I120-I122 PolarHBondContact O-N 3.03Å; I120-L123 PolarHBondContact O-N 3.41Å; I120-E124 VanDerWaalsContact CG2-CD 3.5Å; I120-E124 HydrophobicContact CG2-CG 4.12Å; I120-E124 WeakPolarHBondContact CG2-OE1 3.45Å; I120-E124 WeakPolarHBondContact O-CB 3.43Å; I120-E124 WeakPolarHBondContact O-CG 3.23Å; I120-E124 PolarHBondContact O-N 2.95Å |
| 121 | A | 95.2 | Very high | 94.1 | Very high | 21 Ų | 21 | 54.5 Ų | 54.5 | 17% | 0.174 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -57.9 | -41 | 179 | 0 | 0 | 0 | 0 | 0 | 112.8 | L82 R117 G118 E124 Y125 | L82-A121 HydrophobicContact CD2-CB 4.17Å; R117-A121 WeakPolarHBondContact O-CB 3.48Å; R117-A121 PolarHBondContact O-N 3.38Å; G118-A121 PolarHBondContact O-N 3.05Å; A121-E124 PolarHBondContact O-N 3.39Å; A121-Y125 PolarHBondContact O-N 2.97Å |
| 122 | I | 97 | Very high | 93.9 | Very high | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -67.6 | -36.3 | 177.1 | -67.9 | 165.9 | 0 | 0 | 0 | 111.7 | L91 L109 I112 G118 R119 I120 S128 L149 L153 | L91-I122 HydrophobicContact CD1-CG1 4.45Å; L91-I122 HydrophobicContact CD1-CG2 4.33Å; L91-I122 HydrophobicContact CD2-CG2 4.39Å; L109-I122 HydrophobicContact CB-CD1 4.47Å; L109-I122 HydrophobicContact CD2-CD1 4.1Å; L109-I122 HydrophobicContact CD2-CG1 4.18Å; I112-I122 HydrophobicContact CB-CD1 4.47Å; I112-I122 HydrophobicContact CG2-CD1 4.02Å; I112-I122 HydrophobicContact CG2-CG1 4.49Å; G118-I122 VanDerWaalsContact O-CG1 3.27Å; G118-I122 WeakPolarHBondContact O-CG1 3.42Å; G118-I122 PolarHBondContact O-N 2.76Å; R119-I122 PolarHBondContact O-N 2.88Å; I120-I122 VanDerWaalsContact C-N 3.3Å; I120-I122 PolarHBondContact O-N 3.03Å; I122-S128 WeakPolarHBondContact O-CB 3.26Å; I122-S128 PolarHBondContact O-OG 3.3Å; I122-L149 HydrophobicContact CD1-CD1 4.15Å; I122-L153 HydrophobicContact CB-CD2 3.91Å; I122-L153 HydrophobicContact CD1-CD2 4.32Å; I122-L153 HydrophobicContact CG2-CD1 3.84Å; I122-L153 HydrophobicContact CG2-CD2 3.78Å; I122-L153 HydrophobicContact CG2-CG 4.44Å |
| 123 | L | 95.4 | Very high | 93.8 | Very high | 20 Ų | 20 | 54.1 Ų | 54.1 | 11% | 0.105 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -74.5 | -32.2 | 179.2 | -70.8 | 164.9 | 0 | 0 | 0 | 112.7 | R119 I120 P129 L153 V156 A159 M162 F163 | R119-L123 WeakPolarHBondContact O-CD1 3.28Å; R119-L123 VanDerWaalsContact O-CG 3.24Å; R119-L123 WeakPolarHBondContact O-CG 3.47Å; R119-L123 PolarHBondContact O-N 3.39Å; I120-L123 PolarHBondContact O-N 3.41Å; L123-P129 HydrophobicContact CD2-CG 4.25Å; L123-L153 HydrophobicContact CD2-CB 4.26Å; L123-L153 HydrophobicContact CD2-CD1 4.24Å; L123-L153 HydrophobicContact CG-CD2 4.31Å; L123-V156 HydrophobicContact CD1-CB 3.91Å; L123-V156 HydrophobicContact CD1-CG1 4.15Å; L123-V156 HydrophobicContact CD1-CG2 3.97Å; L123-A159 HydrophobicContact CD1-CB 3.59Å; L123-A159 HydrophobicContact CD2-CB 3.75Å; L123-A159 HydrophobicContact CG-CB 4.33Å; L123-M162 HydrophobicContact CD2-SD 3.92Å; L123-F163 HydrophobicContact CD2-CE2 4.18Å |
| 124 | E | 93.1 | Very high | 93.5 | Very high | 150 Ų | 150 | 57.4 Ų | 57.4 | 70% | 0.701 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -78.6 | -20.2 | 178.9 | -72.7 | 178 | 168.1 | 0 | 0 | 113 | I120 A121 T126 | I120-E124 VanDerWaalsContact CG2-CD 3.5Å; I120-E124 HydrophobicContact CG2-CG 4.12Å; I120-E124 WeakPolarHBondContact CG2-OE1 3.45Å; I120-E124 WeakPolarHBondContact O-CB 3.43Å; I120-E124 WeakPolarHBondContact O-CG 3.23Å; I120-E124 PolarHBondContact O-N 2.95Å; A121-E124 PolarHBondContact O-N 3.39Å; E124-T126 PolarHBondContact O-N 3.06Å |
| 125 | Y | 91.9 | Very high | 93.3 | Very high | 54 Ų | 54 | 53.3 Ų | 53.3 | 21% | 0.212 | 26% | 0.263 | C | S | . | . | S | Bend | trans | -62 | 125.9 | 172.3 | -174.3 | -91.4 | 0 | 0 | 0 | 110.6 | D88 L91 N92 F95 A121 D127 S128 | D88-Y125 HydrophobicContact CB-CD2 3.82Å; D88-Y125 HydrophobicContact CB-CE2 3.78Å; L91-Y125 HydrophobicContact CB-CD1 4.01Å; L91-Y125 HydrophobicContact CB-CE1 4Å; L91-Y125 HydrophobicContact CB-CG 4.29Å; L91-Y125 HydrophobicContact CD1-CD1 3.83Å; L91-Y125 HydrophobicContact CD1-CD2 4.17Å; L91-Y125 HydrophobicContact CD1-CG 3.55Å; L91-Y125 HydrophobicContact CG-CD1 4.5Å; N92-Y125 WeakPolarHBondContact CB-OH 3.46Å; F95-Y125 HydrophobicContact CD2-CE1 4.25Å; F95-Y125 HydrophobicContact CE2-CD1 4.14Å; F95-Y125 AromaticContact CE2-CE1 3.8Å; F95-Y125 HydrophobicContact CE2-CE1 3.8Å; A121-Y125 PolarHBondContact O-N 2.97Å; Y125-D127 PolarHBondContact O-N 2.85Å; Y125-S128 WeakPolarHBondContact O-CB 3.49Å; Y125-S128 PolarHBondContact O-N 3.03Å |
| 126 | T | 86.8 | Confident | 93.2 | Very high | 107 Ų | 107 | 52.1 Ų | 52.1 | 66% | 0.656 | 25% | 0.254 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.5 | 124.6 | -173 | -50.9 | 0 | 0 | 0 | 0 | 112.5 | E124 S128 | E124-T126 PolarHBondContact O-N 3.06Å; T126-S128 PolarHBondContact O-N 3.15Å |
| 127 | D | 87.5 | Confident | 92.8 | Very high | 91 Ų | 91 | 52.5 Ų | 52.5 | 49% | 0.487 | 25% | 0.253 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.2 | 15.2 | 179.1 | -56.8 | -40.1 | 0 | 0 | 0 | 115.8 | Y125 Q130 Q131 | Y125-D127 PolarHBondContact O-N 2.85Å; D127-Q130 PolarHBondContact O-N 3.09Å; D127-Q130 VanDerWaalsContact O-N 3.14Å; D127-Q130 PolarHBondContact O-OE1 3.19Å; D127-Q131 HydrophobicContact CB-CG 4.22Å; D127-Q131 WeakPolarHBondContact O-CB 3.38Å; D127-Q131 VanDerWaalsContact O-CG 3.28Å; D127-Q131 WeakPolarHBondContact O-CG 3.47Å; D127-Q131 PolarHBondContact O-N 2.88Å |
| 128 | S | 90.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -53.1 | -48.7 | -177.7 | 171.3 | 0 | 0 | 0 | 0 | 113.2 | I122 Y125 T126 Q130 Q131 L132 | I122-S128 WeakPolarHBondContact O-CB 3.26Å; I122-S128 PolarHBondContact O-OG 3.3Å; Y125-S128 WeakPolarHBondContact O-CB 3.49Å; Y125-S128 PolarHBondContact O-N 3.03Å; T126-S128 PolarHBondContact O-N 3.15Å; S128-Q130 PolarHBondContact O-N 2.9Å; S128-Q131 PolarHBondContact O-N 3.11Å; S128-L132 WeakPolarHBondContact O-CB 3.35Å; S128-L132 VanDerWaalsContact O-CG 3.26Å; S128-L132 WeakPolarHBondContact O-CG 3.29Å; S128-L132 PolarHBondContact O-N 2.7Å |
| 129 | P | 91.7 | Very high | 91.7 | Very high | 6 Ų | 6 | 52.9 Ų | 52.9 | 4% | 0.039 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -56.9 | -47.4 | 176.1 | -24.9 | 34.7 | 0 | 0 | 0 | 112.9 | L123 L132 L133 M162 F163 | L123-P129 HydrophobicContact CD2-CG 4.25Å; P129-L132 PolarHBondContact O-N 3.31Å; P129-L133 WeakPolarHBondContact O-CG 3.3Å; P129-L133 PolarHBondContact O-N 2.99Å; P129-M162 HydrophobicContact CB-CB 4.15Å; P129-M162 HydrophobicContact CG-CB 4.18Å; P129-M162 HydrophobicContact CG-SD 3.9Å; P129-F163 HydrophobicContact CB-CE1 4Å; P129-F163 HydrophobicContact CB-CE2 4.48Å; P129-F163 HydrophobicContact CB-CZ 3.91Å; P129-F163 HydrophobicContact CG-CZ 4.47Å |
| 130 | Q | 92.5 | Very high | 91.1 | Very high | 100 Ų | 100 | 59.3 Ų | 59.3 | 47% | 0.467 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -64.6 | -42.9 | -179.6 | -64.8 | 84 | -14.8 | 0 | 0 | 111.1 | D127 S128 L133 L134 | D127-Q130 PolarHBondContact O-N 3.09Å; D127-Q130 VanDerWaalsContact O-N 3.14Å; D127-Q130 PolarHBondContact O-OE1 3.19Å; S128-Q130 PolarHBondContact O-N 2.9Å; Q130-L133 PolarHBondContact O-N 2.7Å; Q130-L134 WeakPolarHBondContact O-CG 3.49Å; Q130-L134 PolarHBondContact O-N 3.02Å |
| 131 | Q | 93.9 | Very high | 90.9 | Very high | 59 Ų | 59 | 64 Ų | 64 | 28% | 0.276 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -65.8 | -38.8 | 177.8 | -68.8 | -66.7 | -22.4 | 0 | 0 | 111.9 | F95 D127 S128 L134 Q135 | F95-Q131 HydrophobicContact CD1-CB 3.84Å; F95-Q131 HydrophobicContact CD2-CB 4.03Å; F95-Q131 HydrophobicContact CD2-CG 4.13Å; F95-Q131 HydrophobicContact CE1-CB 3.51Å; F95-Q131 HydrophobicContact CE2-CB 3.71Å; F95-Q131 HydrophobicContact CE2-CG 4.05Å; F95-Q131 HydrophobicContact CG-CB 4.1Å; F95-Q131 HydrophobicContact CG-CG 4.44Å; F95-Q131 HydrophobicContact CZ-CB 3.44Å; F95-Q131 VanDerWaalsContact CZ-CB 3.44Å; F95-Q131 HydrophobicContact CZ-CG 4.29Å; D127-Q131 HydrophobicContact CB-CG 4.22Å; D127-Q131 WeakPolarHBondContact O-CB 3.38Å; D127-Q131 VanDerWaalsContact O-CG 3.28Å; D127-Q131 WeakPolarHBondContact O-CG 3.47Å; D127-Q131 PolarHBondContact O-N 2.88Å; S128-Q131 PolarHBondContact O-N 3.11Å; Q131-L134 WeakPolarHBondContact O-CB 3.36Å; Q131-L134 PolarHBondContact O-N 3.25Å; Q131-Q135 WeakPolarHBondContact O-CG 3.35Å; Q131-Q135 PolarHBondContact O-N 2.83Å |
| 132 | L | 94.6 | Very high | 90.8 | Very high | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.5 | -42.7 | 173.9 | -72.5 | 172.5 | 0 | 0 | 0 | 111.6 | L94 F95 S128 P129 L134 Q135 L136 L149 L153 | L94-L132 HydrophobicContact CD2-CD2 4.16Å; F95-L132 HydrophobicContact CE1-CD2 4.29Å; S128-L132 WeakPolarHBondContact O-CB 3.35Å; S128-L132 VanDerWaalsContact O-CG 3.26Å; S128-L132 WeakPolarHBondContact O-CG 3.29Å; S128-L132 PolarHBondContact O-N 2.7Å; P129-L132 PolarHBondContact O-N 3.31Å; L132-L134 VanDerWaalsContact C-N 3.33Å; L132-L134 PolarHBondContact O-N 2.96Å; L132-Q135 PolarHBondContact O-N 3.14Å; L132-L136 PolarHBondContact O-N 3.08Å; L132-L149 HydrophobicContact CD1-CD2 4.17Å; L132-L149 HydrophobicContact CD2-CD2 3.8Å; L132-L153 HydrophobicContact CD1-CD1 3.81Å |
| 133 | L | 93.7 | Very high | 90.6 | Very high | 21 Ų | 21 | 63.4 Ų | 63.4 | 11% | 0.11 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.7 | -39.2 | 174.3 | -67 | -179.1 | 0 | 0 | 0 | 112.1 | P129 Q130 L136 Q137 I150 F163 F168 | P129-L133 WeakPolarHBondContact O-CG 3.3Å; P129-L133 PolarHBondContact O-N 2.99Å; Q130-L133 PolarHBondContact O-N 2.7Å; L133-L136 PolarHBondContact O-N 3.05Å; L133-Q137 WeakPolarHBondContact O-CG 3.36Å; L133-Q137 PolarHBondContact O-N 3.36Å; L133-Q137 VanDerWaalsContact O-N 3.16Å; L133-I150 HydrophobicContact CD2-CD1 4.31Å; L133-F163 HydrophobicContact CD1-CD1 4.46Å; L133-F163 HydrophobicContact CD2-CD1 4.07Å; L133-F163 HydrophobicContact CD2-CE1 4.44Å; L133-F163 HydrophobicContact CG-CD1 4.29Å; L133-F163 HydrophobicContact CG-CE1 4.47Å; L133-F168 HydrophobicContact CD1-CB 4.3Å; L133-F168 HydrophobicContact CD2-CB 3.96Å; L133-F168 HydrophobicContact CD2-CD1 3.74Å; L133-F168 HydrophobicContact CD2-CD2 3.41Å; L133-F168 VanDerWaalsContact CD2-CD2 3.41Å; L133-F168 HydrophobicContact CD2-CE1 3.99Å; L133-F168 HydrophobicContact CD2-CE2 3.71Å; L133-F168 HydrophobicContact CD2-CG 3.42Å; L133-F168 VanDerWaalsContact CD2-CG 3.42Å; L133-F168 HydrophobicContact CD2-CZ 3.96Å |
| 134 | L | 92.1 | Very high | 90.5 | Very high | 70 Ų | 70 | 64.5 Ų | 64.5 | 37% | 0.366 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.9 | -41.5 | 174.2 | -71.1 | 171.6 | 0 | 0 | 0 | 112.1 | Q130 Q131 L132 L136 Q137 K138 | Q130-L134 WeakPolarHBondContact O-CG 3.49Å; Q130-L134 PolarHBondContact O-N 3.02Å; Q131-L134 WeakPolarHBondContact O-CB 3.36Å; Q131-L134 PolarHBondContact O-N 3.25Å; L132-L134 VanDerWaalsContact C-N 3.33Å; L132-L134 PolarHBondContact O-N 2.96Å; L134-L136 VanDerWaalsContact C-N 3.33Å; L134-L136 PolarHBondContact O-N 2.7Å; L134-Q137 PolarHBondContact O-N 3.5Å; L134-K138 VanDerWaalsContact O-CG 3.29Å; L134-K138 WeakPolarHBondContact O-CG 3.42Å; L134-K138 PolarHBondContact O-N 3.4Å; L134-K138 VanDerWaalsContact O-N 3.07Å |
| 135 | Q | 91.7 | Very high | 90.6 | Very high | 8 Ų | 8 | 59.4 Ų | 59.4 | 4% | 0.037 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.7 | -40 | 176.2 | -70 | -61.7 | -33.6 | 0 | 0 | 111.6 | F95 Q131 L132 Q137 K138 S139 I146 | F95-Q135 HydrophobicContact CD1-CG 4.15Å; Q131-Q135 WeakPolarHBondContact O-CG 3.35Å; Q131-Q135 PolarHBondContact O-N 2.83Å; L132-Q135 PolarHBondContact O-N 3.14Å; Q135-Q137 VanDerWaalsContact C-N 3.29Å; Q135-Q137 PolarHBondContact O-N 3.02Å; Q135-K138 PolarHBondContact O-N 3.42Å; Q135-S139 PolarHBondContact O-N 3.49Å; Q135-S139 VanDerWaalsContact O-N 3.08Å; Q135-I146 HydrophobicContact CB-CD1 3.86Å |
| 136 | L | 92.2 | Very high | 90.8 | Very high | 5 Ų | 5 | 57 Ų | 57 | 3% | 0.026 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.9 | -38.9 | 176.9 | -173.9 | 62.9 | 0 | 0 | 0 | 112.2 | L132 L133 L134 I146 L147 F168 Y171 | L132-L136 PolarHBondContact O-N 3.08Å; L133-L136 PolarHBondContact O-N 3.05Å; L134-L136 VanDerWaalsContact C-N 3.33Å; L134-L136 PolarHBondContact O-N 2.7Å; L136-I146 HydrophobicContact CB-CD1 4.49Å; L136-I146 HydrophobicContact CB-CG2 4.03Å; L136-I146 HydrophobicContact CD1-CB 4.16Å; L136-I146 HydrophobicContact CD1-CG2 4.14Å; L136-L147 HydrophobicContact CD1-CD2 4.45Å; L136-L147 HydrophobicContact CD1-CG 4.14Å; L136-L147 HydrophobicContact CD2-CD2 3.89Å; L136-L147 HydrophobicContact CD2-CG 4.46Å; L136-F168 HydrophobicContact CD2-CD2 4.06Å; L136-F168 HydrophobicContact CD2-CE2 3.44Å; L136-F168 VanDerWaalsContact CD2-CE2 3.44Å; L136-F168 HydrophobicContact CD2-CZ 4.4Å; L136-Y171 HydrophobicContact CD1-CE1 4.21Å; L136-Y171 HydrophobicContact CD2-CD1 3.89Å; L136-Y171 HydrophobicContact CD2-CE1 3.53Å; L136-Y171 HydrophobicContact CG-CE1 3.94Å; L136-Y171 HydrophobicContact CG-CE2 4.49Å |
| 137 | Q | 86.7 | Confident | 91.2 | Very high | 115 Ų | 115 | 52 Ų | 52 | 54% | 0.537 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -71.4 | -33 | 176.3 | -71 | 175.7 | -10.7 | 0 | 0 | 112.7 | L133 L134 Q135 | L133-Q137 WeakPolarHBondContact O-CG 3.36Å; L133-Q137 PolarHBondContact O-N 3.36Å; L133-Q137 VanDerWaalsContact O-N 3.16Å; L134-Q137 PolarHBondContact O-N 3.5Å; Q135-Q137 VanDerWaalsContact C-N 3.29Å; Q135-Q137 PolarHBondContact O-N 3.02Å |
| 138 | K | 86.6 | Confident | 91.6 | Very high | 149 Ų | 149 | 50.6 Ų | 50.6 | 65% | 0.648 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -76.6 | -36.9 | -177.3 | -75.5 | 175.1 | -179.2 | -178.3 | 0 | 113.6 | L134 Q135 | L134-K138 VanDerWaalsContact O-CG 3.29Å; L134-K138 WeakPolarHBondContact O-CG 3.42Å; L134-K138 PolarHBondContact O-N 3.4Å; L134-K138 VanDerWaalsContact O-N 3.07Å; Q135-K138 PolarHBondContact O-N 3.42Å |
| 139 | S | 81.7 | Confident | 92 | Very high | 11 Ų | 11 | 50.6 Ų | 50.6 | 8% | 0.077 | 24% | 0.235 | C | C | . | . | trans | -131.8 | 107.6 | -172 | -171.4 | 0 | 0 | 0 | 0 | 112.6 | E99 Q135 K141 F142 S143 | E99-S139 PolarHBondContact OE2-OG 3.35Å; Q135-S139 PolarHBondContact O-N 3.49Å; Q135-S139 VanDerWaalsContact O-N 3.08Å; S139-K141 PolarHBondContact O-N 3.13Å; S139-F142 PolarHBondContact O-N 3.39Å; S139-F142 WeakPolarHBondContact OG-CD2 3.35Å; S139-S143 PolarHBondContact O-OG 3.43Å | ||
| 140 | K | 84 | Confident | 92.2 | Very high | 195 Ų | 195 | 50.3 Ų | 50.3 | 85% | 0.848 | 23% | 0.233 | S | C | * | . | G | 310 helix | trans | -60.2 | -31.8 | 169.2 | -68.6 | -173.4 | 179.2 | -177.9 | 0 | 111.6 | F142 S143 | K140-F142 VanDerWaalsContact C-N 3.26Å; K140-F142 PolarHBondContact O-N 3.43Å; K140-S143 WeakPolarHBondContact CA-OG 3.31Å; K140-S143 WeakPolarHBondContact O-CB 3.32Å; K140-S143 PolarHBondContact O-N 2.92Å; K140-S143 PolarHBondContact O-OG 3.28Å |
| 141 | K | 90 | Very high | 92.4 | Very high | 161 Ų | 161 | 46.6 Ų | 46.6 | 70% | 0.7 | 22% | 0.217 | S | C | * | . | G | 310 helix | trans | -58.2 | -35 | -176.9 | -173.1 | -179.9 | 176.5 | -178.7 | 0 | 113.3 | S139 | S139-K141 PolarHBondContact O-N 3.13Š|
| 142 | F | 92.7 | Very high | 92.6 | Very high | 7 Ų | 7 | 44.9 Ų | 44.9 | 3% | 0.031 | 21% | 0.21 | C | C | . | . | G | 310 helix | trans | -107.3 | 10 | -176.4 | -53.2 | -48.5 | 0 | 0 | 0 | 113.6 | E99 K102 P103 L106 S139 K140 N144 Q145 I146 | E99-F142 HydrophobicContact CB-CE2 4.5Å; E99-F142 WeakPolarHBondContact O-CZ 3.46Å; E99-F142 WeakPolarHBondContact OE2-CE2 3.26Å; K102-F142 HydrophobicContact CB-CD2 4.03Å; K102-F142 HydrophobicContact CB-CE2 3.66Å; K102-F142 HydrophobicContact CB-CZ 4.11Å; K102-F142 HydrophobicContact CD-CD2 4Å; K102-F142 HydrophobicContact CD-CE2 3.75Å; K102-F142 HydrophobicContact CG-CE2 4.25Å; P103-F142 HydrophobicContact CG-CD1 4.4Å; P103-F142 HydrophobicContact CG-CE1 3.59Å; P103-F142 HydrophobicContact CG-CZ 3.97Å; L106-F142 HydrophobicContact CD1-CB 3.78Å; L106-F142 HydrophobicContact CD1-CG 4.13Å; S139-F142 PolarHBondContact O-N 3.39Å; S139-F142 WeakPolarHBondContact OG-CD2 3.35Å; K140-F142 VanDerWaalsContact C-N 3.26Å; K140-F142 PolarHBondContact O-N 3.43Å; F142-N144 VanDerWaalsContact C-N 3.27Å; F142-N144 PolarHBondContact O-N 3.49Å; F142-Q145 PolarHBondContact O-N 3Å; F142-I146 HydrophobicContact CB-CD1 4.04Å; F142-I146 HydrophobicContact CB-CG1 4.35Å; F142-I146 WeakPolarHBondContact O-CG1 3.42Å; F142-I146 PolarHBondContact O-N 2.92Å |
| 143 | S | 93.2 | Very high | 92.7 | Very high | 2 Ų | 2 | 44.9 Ų | 44.9 | 1% | 0.014 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -56.5 | -41.7 | -175.8 | -69.5 | 0 | 0 | 0 | 0 | 112.3 | S139 K140 I146 L147 Y171 | S139-S143 PolarHBondContact O-OG 3.43Å; K140-S143 WeakPolarHBondContact CA-OG 3.31Å; K140-S143 WeakPolarHBondContact O-CB 3.32Å; K140-S143 PolarHBondContact O-N 2.92Å; K140-S143 PolarHBondContact O-OG 3.28Å; S143-I146 PolarHBondContact O-N 3.21Å; S143-L147 VanDerWaalsContact O-CB 3.32Å; S143-L147 WeakPolarHBondContact O-CB 3.42Å; S143-L147 VanDerWaalsContact O-CG 3.25Å; S143-L147 WeakPolarHBondContact O-CG 3.24Å; S143-L147 PolarHBondContact O-N 3.35Å; S143-Y171 PolarHBondContact OG-OH 3.08Å |
| 144 | N | 93.4 | Very high | 92.7 | Very high | 43 Ų | 43 | 43.9 Ų | 43.9 | 23% | 0.23 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.5 | -46.5 | 178 | -78.5 | -32.6 | 0 | 0 | 0 | 112.8 | F142 L147 Q148 L181 R184 | F142-N144 VanDerWaalsContact C-N 3.27Å; F142-N144 PolarHBondContact O-N 3.49Å; N144-L147 PolarHBondContact O-N 3.21Å; N144-Q148 WeakPolarHBondContact O-CB 3.47Å; N144-Q148 PolarHBondContact O-N 3.5Å; N144-L181 WeakPolarHBondContact OD1-CA 3.48Å; N144-L181 WeakPolarHBondContact OD1-CD1 3.46Å; N144-R184 WeakPolarHBondContact O-CD 3.22Å |
| 145 | Q | 95.2 | Very high | 92.7 | Very high | 44 Ų | 44 | 42.4 Ų | 42.4 | 21% | 0.206 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -67.3 | -40.6 | 178.7 | -70.8 | 177.6 | -66.4 | 0 | 0 | 112.1 | P103 L106 N107 I110 F142 Q148 L149 | P103-Q145 PolarHBondContact O-NE2 3.46Å; L106-Q145 HydrophobicContact CB-CB 4.14Å; L106-Q145 HydrophobicContact CD1-CB 3.85Å; L106-Q145 HydrophobicContact CG-CB 4.48Å; N107-Q145 PolarHBondContact OD1-NE2 3.39Å; I110-Q145 HydrophobicContact CD1-CB 4.21Å; F142-Q145 PolarHBondContact O-N 3Å; Q145-Q148 PolarHBondContact O-N 3.3Å; Q145-L149 PolarHBondContact O-N 2.97Å |
| 146 | I | 96 | Very high | 92.7 | Very high | 4 Ų | 4 | 42.7 Ų | 42.7 | 2% | 0.021 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -65.8 | -43 | 177.6 | -64.5 | 166.9 | 0 | 0 | 0 | 110.4 | L106 Q135 L136 F142 S143 L149 I150 | L106-I146 HydrophobicContact CD1-CG1 4.08Å; L106-I146 HydrophobicContact CD2-CG1 3.85Å; Q135-I146 HydrophobicContact CB-CD1 3.86Å; L136-I146 HydrophobicContact CB-CD1 4.49Å; L136-I146 HydrophobicContact CB-CG2 4.03Å; L136-I146 HydrophobicContact CD1-CB 4.16Å; L136-I146 HydrophobicContact CD1-CG2 4.14Å; F142-I146 HydrophobicContact CB-CD1 4.04Å; F142-I146 HydrophobicContact CB-CG1 4.35Å; F142-I146 WeakPolarHBondContact O-CG1 3.42Å; F142-I146 PolarHBondContact O-N 2.92Å; S143-I146 PolarHBondContact O-N 3.21Å; I146-L149 WeakPolarHBondContact O-CB 3.12Å; I146-L149 PolarHBondContact O-N 2.68Å; I146-I150 HydrophobicContact CG2-CD1 3.96Å; I146-I150 HydrophobicContact CG2-CG1 4.5Å; I146-I150 WeakPolarHBondContact O-CG1 3.46Å; I146-I150 PolarHBondContact O-N 2.87Å |
| 147 | L | 96.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -67.5 | -34.8 | 176 | -70.6 | 174.3 | 0 | 0 | 0 | 112.4 | L136 S143 N144 I150 T151 F168 Y171 L172 L181 R184 K185 V188 | L136-L147 HydrophobicContact CD1-CD2 4.45Å; L136-L147 HydrophobicContact CD1-CG 4.14Å; L136-L147 HydrophobicContact CD2-CD2 3.89Å; L136-L147 HydrophobicContact CD2-CG 4.46Å; S143-L147 VanDerWaalsContact O-CB 3.32Å; S143-L147 WeakPolarHBondContact O-CB 3.42Å; S143-L147 VanDerWaalsContact O-CG 3.25Å; S143-L147 WeakPolarHBondContact O-CG 3.24Å; S143-L147 PolarHBondContact O-N 3.35Å; N144-L147 PolarHBondContact O-N 3.21Å; L147-I150 PolarHBondContact O-N 3.43Å; L147-T151 WeakPolarHBondContact O-CB 2.98Å; L147-T151 PolarHBondContact O-N 3.42Å; L147-T151 PolarHBondContact O-OG1 3.25Å; L147-F168 HydrophobicContact CD2-CE2 4.08Å; L147-F168 HydrophobicContact CD2-CZ 4.05Å; L147-Y171 HydrophobicContact CD1-CE1 4.41Å; L147-Y171 HydrophobicContact CD2-CE1 4.41Å; L147-L172 HydrophobicContact CD2-CD2 3.91Å; L147-L181 HydrophobicContact CD1-CD1 3.52Å; L147-R184 HydrophobicContact CB-CG 3.81Å; L147-R184 HydrophobicContact CD1-CB 4.49Å; L147-R184 HydrophobicContact CD1-CG 4.34Å; L147-K185 HydrophobicContact CD1-CG 3.97Å; L147-V188 HydrophobicContact CB-CG2 4.39Å; L147-V188 HydrophobicContact CD2-CG1 4.45Å; L147-V188 HydrophobicContact CD2-CG2 4.23Å |
| 148 | Q | 96.1 | Very high | 92.8 | Very high | 63 Ų | 63 | 44.2 Ų | 44.2 | 29% | 0.294 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -60.4 | -46.1 | 171 | 178.8 | 70.5 | 46.2 | 0 | 0 | 110.9 | I110 N144 Q145 T151 N152 | I110-Q148 HydrophobicContact CD1-CB 4.21Å; I110-Q148 HydrophobicContact CD1-CG 4.05Å; I110-Q148 HydrophobicContact CG1-CG 4.27Å; I110-Q148 HydrophobicContact CG2-CG 4.12Å; N144-Q148 WeakPolarHBondContact O-CB 3.47Å; N144-Q148 PolarHBondContact O-N 3.5Å; Q145-Q148 PolarHBondContact O-N 3.3Å; Q148-T151 WeakPolarHBondContact O-CB 3.26Å; Q148-T151 PolarHBondContact O-N 3.2Å; Q148-N152 PolarHBondContact O-N 2.87Å; Q148-N152 VanDerWaalsContact O-N 3.15Å |
| 149 | L | 97.2 | Very high | 93 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.2 | -49.6 | 175.7 | 177.9 | 57.9 | 0 | 0 | 0 | 111 | L106 L109 I110 I122 L132 Q145 I146 T151 N152 L153 | L106-L149 HydrophobicContact CD2-CD2 4.41Å; L109-L149 HydrophobicContact CB-CD1 4.21Å; L109-L149 HydrophobicContact CB-CD2 4.02Å; L109-L149 HydrophobicContact CD1-CD2 4.39Å; I110-L149 HydrophobicContact CG1-CB 4.03Å; I122-L149 HydrophobicContact CD1-CD1 4.15Å; L132-L149 HydrophobicContact CD1-CD2 4.17Å; L132-L149 HydrophobicContact CD2-CD2 3.8Å; Q145-L149 PolarHBondContact O-N 2.97Å; I146-L149 WeakPolarHBondContact O-CB 3.12Å; I146-L149 PolarHBondContact O-N 2.68Å; L149-T151 VanDerWaalsContact C-N 3.28Å; L149-T151 PolarHBondContact O-N 2.82Å; L149-N152 WeakPolarHBondContact O-CB 3.46Å; L149-N152 PolarHBondContact O-N 2.87Å; L149-N152 VanDerWaalsContact O-N 3.09Å; L149-L153 HydrophobicContact CD1-CG 4.44Å; L149-L153 HydrophobicContact CG-CD1 4.43Å; L149-L153 WeakPolarHBondContact O-CG 3.34Å; L149-L153 PolarHBondContact O-N 3.05Å |
| 150 | I | 96.9 | Very high | 93.5 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.4 | -40.8 | 177.7 | -68.4 | 170.3 | 0 | 0 | 0 | 111.1 | L133 I146 L147 N152 L153 L154 F163 F168 V188 | L133-I150 HydrophobicContact CD2-CD1 4.31Å; I146-I150 HydrophobicContact CG2-CD1 3.96Å; I146-I150 HydrophobicContact CG2-CG1 4.5Å; I146-I150 WeakPolarHBondContact O-CG1 3.46Å; I146-I150 PolarHBondContact O-N 2.87Å; L147-I150 PolarHBondContact O-N 3.43Å; I150-N152 VanDerWaalsContact C-N 3.3Å; I150-N152 PolarHBondContact O-N 3.21Å; I150-L153 PolarHBondContact O-N 3.15Å; I150-L153 VanDerWaalsContact O-N 3.11Å; I150-L154 HydrophobicContact CG2-CD1 3.86Å; I150-L154 HydrophobicContact CG2-CG 4.13Å; I150-L154 VanDerWaalsContact O-CG 3.29Å; I150-L154 WeakPolarHBondContact O-CG 3.15Å; I150-L154 PolarHBondContact O-N 2.91Å; I150-F163 HydrophobicContact CD1-CD1 4.45Å; I150-F163 HydrophobicContact CD1-CE1 4.07Å; I150-F163 HydrophobicContact CG1-CE1 3.87Å; I150-F163 HydrophobicContact CG1-CZ 4.17Å; I150-F163 HydrophobicContact CG2-CD1 4.09Å; I150-F163 HydrophobicContact CG2-CD2 4.45Å; I150-F163 HydrophobicContact CG2-CE1 4.12Å; I150-F163 HydrophobicContact CG2-CE2 4.46Å; I150-F163 HydrophobicContact CG2-CG 4.27Å; I150-F163 HydrophobicContact CG2-CZ 4.31Å; I150-F168 HydrophobicContact CD1-CE2 4.46Å; I150-F168 HydrophobicContact CD1-CZ 3.93Å; I150-F168 HydrophobicContact CG2-CE1 4.35Å; I150-F168 HydrophobicContact CG2-CZ 4.26Å; I150-V188 HydrophobicContact CG2-CG1 4.03Å |
| 151 | T | 96.8 | Very high | 93.8 | Very high | 22 Ų | 22 | 35.9 Ų | 35.9 | 14% | 0.135 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -54.6 | -47.3 | 175.4 | -58.7 | 0 | 0 | 0 | 0 | 111 | L147 Q148 L149 L153 L154 L187 V188 L191 | L147-T151 WeakPolarHBondContact O-CB 2.98Å; L147-T151 PolarHBondContact O-N 3.42Å; L147-T151 PolarHBondContact O-OG1 3.25Å; Q148-T151 WeakPolarHBondContact O-CB 3.26Å; Q148-T151 PolarHBondContact O-N 3.2Å; L149-T151 VanDerWaalsContact C-N 3.28Å; L149-T151 PolarHBondContact O-N 2.82Å; T151-L153 PolarHBondContact O-N 2.93Å; T151-L154 PolarHBondContact O-N 3.37Å; T151-L187 HydrophobicContact CG2-CD2 3.95Å; T151-L187 HydrophobicContact CG2-CG 4.49Å; T151-V188 VanDerWaalsContact OG1-CG2 3.27Å; T151-V188 WeakPolarHBondContact OG1-CG2 3.44Å; T151-L191 HydrophobicContact CG2-CD1 3.73Å |
| 152 | N | 96.8 | Very high | 94 | Very high | 23 Ų | 23 | 32.2 Ų | 32.2 | 12% | 0.123 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.8 | -42.8 | 177.3 | -68.6 | -4.3 | 0 | 0 | 0 | 111.6 | S113 R119 Q148 L149 I150 L154 G155 | S113-N152 VanDerWaalsContact OG-CB 3.26Å; S113-N152 WeakPolarHBondContact OG-CB 3.29Å; S113-N152 PolarHBondContact OG-ND2 3.47Å; R119-N152 WeakPolarHBondContact CD-O 3.45Å; R119-N152 PolarHBondContact NE-O 3.01Å; Q148-N152 PolarHBondContact O-N 2.87Å; Q148-N152 VanDerWaalsContact O-N 3.15Å; L149-N152 WeakPolarHBondContact O-CB 3.46Å; L149-N152 PolarHBondContact O-N 2.87Å; L149-N152 VanDerWaalsContact O-N 3.09Å; I150-N152 VanDerWaalsContact C-N 3.3Å; I150-N152 PolarHBondContact O-N 3.21Å; N152-L154 PolarHBondContact O-N 3.4Å; N152-G155 PolarHBondContact O-N 2.85Å |
| 153 | L | 96.9 | Very high | 94 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.6 | -36 | 179.2 | -60.5 | -178.4 | 0 | 0 | 0 | 112.9 | R119 I122 L123 L132 L149 I150 T151 G155 V156 F163 | R119-L153 HydrophobicContact CB-CD2 4.18Å; R119-L153 HydrophobicContact CG-CD2 4.4Å; I122-L153 HydrophobicContact CB-CD2 3.91Å; I122-L153 HydrophobicContact CD1-CD2 4.32Å; I122-L153 HydrophobicContact CG2-CD1 3.84Å; I122-L153 HydrophobicContact CG2-CD2 3.78Å; I122-L153 HydrophobicContact CG2-CG 4.44Å; L123-L153 HydrophobicContact CD2-CB 4.26Å; L123-L153 HydrophobicContact CD2-CD1 4.24Å; L123-L153 HydrophobicContact CG-CD2 4.31Å; L132-L153 HydrophobicContact CD1-CD1 3.81Å; L149-L153 HydrophobicContact CD1-CG 4.44Å; L149-L153 HydrophobicContact CG-CD1 4.43Å; L149-L153 WeakPolarHBondContact O-CG 3.34Å; L149-L153 PolarHBondContact O-N 3.05Å; I150-L153 PolarHBondContact O-N 3.15Å; I150-L153 VanDerWaalsContact O-N 3.11Å; T151-L153 PolarHBondContact O-N 2.93Å; L153-G155 PolarHBondContact O-N 3.41Å; L153-G155 VanDerWaalsContact O-N 3.15Å; L153-V156 WeakPolarHBondContact O-CB 3.3Å; L153-V156 PolarHBondContact O-N 2.93Å; L153-F163 HydrophobicContact CB-CE2 4.24Å; L153-F163 HydrophobicContact CD1-CE2 4.38Å; L153-F163 HydrophobicContact CD1-CZ 4.02Å |
| 154 | L | 95.2 | Very high | 93.9 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 20% | 0.196 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67 | -10.2 | 176.8 | -68.5 | 170.9 | 0 | 0 | 0 | 113.7 | I150 T151 N152 V156 R160 F163 V188 L191 V192 | I150-L154 HydrophobicContact CG2-CD1 3.86Å; I150-L154 HydrophobicContact CG2-CG 4.13Å; I150-L154 VanDerWaalsContact O-CG 3.29Å; I150-L154 WeakPolarHBondContact O-CG 3.15Å; I150-L154 PolarHBondContact O-N 2.91Å; T151-L154 PolarHBondContact O-N 3.37Å; N152-L154 PolarHBondContact O-N 3.4Å; L154-V156 PolarHBondContact O-N 3.47Å; L154-R160 HydrophobicContact CD2-CB 4.32Å; L154-R160 HydrophobicContact CD2-CG 3.95Å; L154-F163 HydrophobicContact CD2-CB 4.15Å; L154-F163 HydrophobicContact CD2-CD2 3.69Å; L154-F163 HydrophobicContact CD2-CG 4.24Å; L154-F163 HydrophobicContact CG-CD2 4.37Å; L154-V188 HydrophobicContact CD1-CG1 3.9Å; L154-L191 HydrophobicContact CB-CB 4.21Å; L154-L191 HydrophobicContact CB-CD1 4.48Å; L154-L191 HydrophobicContact CD1-CB 3.81Å; L154-L191 HydrophobicContact CD1-CD1 4.47Å; L154-V192 HydrophobicContact CD1-CG2 3.66Å; L154-V192 HydrophobicContact CD2-CG2 3.9Å; L154-V192 HydrophobicContact CG-CG2 4.47Å |
| 155 | G | 90.5 | Very high | 93.8 | Very high | 39 Ų | 39 | 36.8 Ų | 36.8 | 40% | 0.402 | 20% | 0.201 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -13.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | N152 L153 P157 | N152-G155 PolarHBondContact O-N 2.85Å; L153-G155 PolarHBondContact O-N 3.41Å; L153-G155 VanDerWaalsContact O-N 3.15Å; G155-P157 WeakPolarHBondContact O-CD 3.18Å |
| 156 | V | 92.4 | Very high | 93.7 | Very high | 14 Ų | 14 | 39.8 Ų | 39.8 | 9% | 0.085 | 23% | 0.225 | C | C | . | . | S | Bend | trans | -93.3 | 110.6 | 167.6 | -178 | 0 | 0 | 0 | 0 | 108.3 | L116 R119 L123 L153 L154 T158 A159 | L116-V156 HydrophobicContact CD1-CG2 3.98Å; R119-V156 HydrophobicContact CB-CG2 3.7Å; L123-V156 HydrophobicContact CD1-CB 3.91Å; L123-V156 HydrophobicContact CD1-CG1 4.15Å; L123-V156 HydrophobicContact CD1-CG2 3.97Å; L153-V156 WeakPolarHBondContact O-CB 3.3Å; L153-V156 PolarHBondContact O-N 2.93Å; L154-V156 PolarHBondContact O-N 3.47Å; V156-T158 WeakPolarHBondContact CG1-OG1 3.35Å; V156-T158 PolarHBondContact O-N 2.95Å; V156-T158 VanDerWaalsContact O-N 3.09Å; V156-A159 HydrophobicContact CB-CB 4.09Å; V156-A159 HydrophobicContact CG1-CB 4.48Å; V156-A159 VanDerWaalsContact O-CB 3.23Å; V156-A159 WeakPolarHBondContact O-CB 3.48Å; V156-A159 PolarHBondContact O-N 3.3Å |
| 157 | P | 90.6 | Very high | 93.5 | Very high | 56 Ų | 56 | 47.2 Ų | 47.2 | 36% | 0.364 | 26% | 0.257 | S | S | . | . | G | 310 helix | trans | -58.3 | -30.4 | -171.4 | -27.9 | 35.6 | 0 | 0 | 0 | 115.2 | G155 A159 S196 | G155-P157 WeakPolarHBondContact O-CD 3.18Å; P157-A159 VanDerWaalsContact C-N 3.33Å; P157-S196 WeakPolarHBondContact O-CB 3.35Å; P157-S196 PolarHBondContact O-OG 2.93Å |
| 158 | T | 89.8 | Confident | 93.4 | Very high | 95 Ų | 95 | 47.5 Ų | 47.5 | 58% | 0.583 | 26% | 0.258 | S | S | * | . | G | 310 helix | trans | -72.1 | -26.2 | 176.9 | 52.2 | 0 | 0 | 0 | 0 | 112.7 | V156 R160 | V156-T158 WeakPolarHBondContact CG1-OG1 3.35Å; V156-T158 PolarHBondContact O-N 2.95Å; V156-T158 VanDerWaalsContact O-N 3.09Å; T158-R160 VanDerWaalsContact C-N 3.26Å; T158-R160 PolarHBondContact O-N 3.47Å |
| 159 | A | 92.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 25% | 0.254 | C | S | . | . | G | 310 helix | trans | -67.7 | -24.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | L123 V156 P157 K161 M162 F163 | L123-A159 HydrophobicContact CD1-CB 3.59Å; L123-A159 HydrophobicContact CD2-CB 3.75Å; L123-A159 HydrophobicContact CG-CB 4.33Å; V156-A159 HydrophobicContact CB-CB 4.09Å; V156-A159 HydrophobicContact CG1-CB 4.48Å; V156-A159 VanDerWaalsContact O-CB 3.23Å; V156-A159 WeakPolarHBondContact O-CB 3.48Å; V156-A159 PolarHBondContact O-N 3.3Å; P157-A159 VanDerWaalsContact C-N 3.33Å; A159-K161 PolarHBondContact O-N 3.22Å; A159-M162 WeakPolarHBondContact O-CA 3.42Å; A159-M162 VanDerWaalsContact O-CB 3.26Å; A159-M162 WeakPolarHBondContact O-CB 3.49Å; A159-M162 PolarHBondContact O-N 3.42Å; A159-F163 WeakPolarHBondContact O-CD2 3.4Å; A159-F163 PolarHBondContact O-N 3.46Å |
| 160 | R | 91.7 | Very high | 93.2 | Very high | 19 Ų | 19 | 50.2 Ų | 50.2 | 7% | 0.072 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -56.5 | -37.7 | -179 | -60.1 | 179.6 | -171.3 | 162.1 | 1 | 112.3 | L154 T158 M162 F163 N164 L191 L194 P195 | L154-R160 HydrophobicContact CD2-CB 4.32Å; L154-R160 HydrophobicContact CD2-CG 3.95Å; T158-R160 VanDerWaalsContact C-N 3.26Å; T158-R160 PolarHBondContact O-N 3.47Å; R160-M162 VanDerWaalsContact C-N 3.29Å; R160-M162 PolarHBondContact O-N 2.86Å; R160-F163 PolarHBondContact O-N 2.83Å; R160-N164 WeakPolarHBondContact O-CB 3.36Å; R160-N164 PolarHBondContact O-N 3.39Å; R160-L191 WeakPolarHBondContact CD-O 3.26Å; R160-L194 WeakPolarHBondContact CD-O 3.3Å; R160-L194 VanDerWaalsContact NH1-C 3.33Å; R160-L194 PolarHBondContact NH1-O 3.33Å; R160-P195 PolarHBondContact NH1-O 3.17Å |
| 161 | K | 90.6 | Very high | 93.1 | Very high | 161 Ų | 161 | 52.5 Ų | 52.5 | 70% | 0.7 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -64.3 | -32.2 | 175.3 | -65.8 | -176 | -179.9 | -178.6 | 0 | 112.8 | A159 F163 N164 | A159-K161 PolarHBondContact O-N 3.22Å; K161-F163 VanDerWaalsContact C-N 3.3Å; K161-F163 PolarHBondContact O-N 3.02Å; K161-N164 PolarHBondContact O-N 3.15Å |
| 162 | M | 92.6 | Very high | 93 | Very high | 84 Ų | 84 | 51.7 Ų | 51.7 | 41% | 0.414 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -69.3 | -30.5 | 178.4 | -55 | 174.8 | 175.1 | 0 | 0 | 111.9 | L123 P129 A159 R160 | L123-M162 HydrophobicContact CD2-SD 3.92Å; P129-M162 HydrophobicContact CB-CB 4.15Å; P129-M162 HydrophobicContact CG-CB 4.18Å; P129-M162 HydrophobicContact CG-SD 3.9Å; A159-M162 WeakPolarHBondContact O-CA 3.42Å; A159-M162 VanDerWaalsContact O-CB 3.26Å; A159-M162 WeakPolarHBondContact O-CB 3.49Å; A159-M162 PolarHBondContact O-N 3.42Å; R160-M162 VanDerWaalsContact C-N 3.29Å; R160-M162 PolarHBondContact O-N 2.86Å |
| 163 | F | 93 | Very high | 92.8 | Very high | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -97.1 | -10.7 | 177.8 | -65.9 | -73.5 | 0 | 0 | 0 | 113.5 | L123 P129 L133 I150 L153 L154 A159 R160 K161 V165 F168 V192 | L123-F163 HydrophobicContact CD2-CE2 4.18Å; P129-F163 HydrophobicContact CB-CE1 4Å; P129-F163 HydrophobicContact CB-CE2 4.48Å; P129-F163 HydrophobicContact CB-CZ 3.91Å; P129-F163 HydrophobicContact CG-CZ 4.47Å; L133-F163 HydrophobicContact CD1-CD1 4.46Å; L133-F163 HydrophobicContact CD2-CD1 4.07Å; L133-F163 HydrophobicContact CD2-CE1 4.44Å; L133-F163 HydrophobicContact CG-CD1 4.29Å; L133-F163 HydrophobicContact CG-CE1 4.47Å; I150-F163 HydrophobicContact CD1-CD1 4.45Å; I150-F163 HydrophobicContact CD1-CE1 4.07Å; I150-F163 HydrophobicContact CG1-CE1 3.87Å; I150-F163 HydrophobicContact CG1-CZ 4.17Å; I150-F163 HydrophobicContact CG2-CD1 4.09Å; I150-F163 HydrophobicContact CG2-CD2 4.45Å; I150-F163 HydrophobicContact CG2-CE1 4.12Å; I150-F163 HydrophobicContact CG2-CE2 4.46Å; I150-F163 HydrophobicContact CG2-CG 4.27Å; I150-F163 HydrophobicContact CG2-CZ 4.31Å; L153-F163 HydrophobicContact CB-CE2 4.24Å; L153-F163 HydrophobicContact CD1-CE2 4.38Å; L153-F163 HydrophobicContact CD1-CZ 4.02Å; L154-F163 HydrophobicContact CD2-CB 4.15Å; L154-F163 HydrophobicContact CD2-CD2 3.69Å; L154-F163 HydrophobicContact CD2-CG 4.24Å; L154-F163 HydrophobicContact CG-CD2 4.37Å; A159-F163 WeakPolarHBondContact O-CD2 3.4Å; A159-F163 PolarHBondContact O-N 3.46Å; R160-F163 PolarHBondContact O-N 2.83Å; K161-F163 VanDerWaalsContact C-N 3.3Å; K161-F163 PolarHBondContact O-N 3.02Å; F163-V165 PolarHBondContact O-N 3.29Å; F163-F168 HydrophobicContact CB-CD1 4.17Å; F163-F168 HydrophobicContact CB-CE1 4.09Å; F163-F168 HydrophobicContact CD1-CE1 4.2Å; F163-F168 VanDerWaalsContact O-CD1 3.3Å; F163-F168 WeakPolarHBondContact O-CD1 3.45Å; F163-V192 HydrophobicContact CB-CG2 4.12Å |
| 164 | N | 91.1 | Very high | 92.7 | Very high | 91 Ų | 91 | 56.9 Ų | 56.9 | 49% | 0.487 | 32% | 0.322 | S | S | . | . | trans | -76.5 | 68.5 | 175.2 | -168.4 | 4.5 | 0 | 0 | 0 | 111.5 | R160 K161 V192 | R160-N164 WeakPolarHBondContact O-CB 3.36Å; R160-N164 PolarHBondContact O-N 3.39Å; K161-N164 PolarHBondContact O-N 3.15Å; N164-V192 HydrophobicContact CB-CG1 3.86Å | ||
| 165 | V | 92.1 | Very high | 92.4 | Very high | 57 Ų | 57 | 66.2 Ų | 66.2 | 35% | 0.345 | 36% | 0.363 | S | S | . | . | trans | -116.3 | 130.6 | -179 | -176.8 | 0 | 0 | 0 | 0 | 108.8 | F163 K167 F168 I169 | F163-V165 PolarHBondContact O-N 3.29Å; V165-K167 VanDerWaalsContact C-N 3.27Å; V165-K167 PolarHBondContact O-N 3.29Å; V165-K167 VanDerWaalsContact O-N 3.07Å; V165-F168 WeakPolarHBondContact O-CA 3.39Å; V165-F168 PolarHBondContact O-N 3.39Å; V165-I169 PolarHBondContact O-N 3.18Å | ||
| 166 | P | 92.9 | Very high | 92.3 | Very high | 107 Ų | 107 | 66 Ų | 66 | 70% | 0.695 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -51.6 | -39.9 | -173.3 | -30.8 | 35.1 | 0 | 0 | 0 | 115 | F168 I169 S170 | P166-F168 VanDerWaalsContact C-N 3.34Å; P166-F168 PolarHBondContact O-N 3.38Å; P166-I169 PolarHBondContact O-N 2.76Å; P166-S170 WeakPolarHBondContact O-CB 3.32Å; P166-S170 PolarHBondContact O-N 3.12Å |
| 167 | K | 92.3 | Very high | 92.2 | Very high | 161 Ų | 161 | 73.9 Ų | 73.9 | 70% | 0.7 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -63.4 | -38.4 | 177.1 | -69.4 | -173.9 | 179.1 | -179.6 | 0 | 112.6 | V165 Y171 | V165-K167 VanDerWaalsContact C-N 3.27Å; V165-K167 PolarHBondContact O-N 3.29Å; V165-K167 VanDerWaalsContact O-N 3.07Å; K167-Y171 PolarHBondContact O-N 2.92Å; K167-Y171 VanDerWaalsContact O-N 3.1Å |
| 168 | F | 94.4 | Very high | 92.2 | Very high | 6 Ų | 6 | 74.4 Ų | 74.4 | 3% | 0.026 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -73.6 | -42.8 | 178.2 | -175.7 | -135.1 | 0 | 0 | 0 | 111.2 | L133 L136 L147 I150 F163 V165 P166 S170 Y171 L172 V188 V192 | L133-F168 HydrophobicContact CD1-CB 4.3Å; L133-F168 HydrophobicContact CD2-CB 3.96Å; L133-F168 HydrophobicContact CD2-CD1 3.74Å; L133-F168 HydrophobicContact CD2-CD2 3.41Å; L133-F168 VanDerWaalsContact CD2-CD2 3.41Å; L133-F168 HydrophobicContact CD2-CE1 3.99Å; L133-F168 HydrophobicContact CD2-CE2 3.71Å; L133-F168 HydrophobicContact CD2-CG 3.42Å; L133-F168 VanDerWaalsContact CD2-CG 3.42Å; L133-F168 HydrophobicContact CD2-CZ 3.96Å; L136-F168 HydrophobicContact CD2-CD2 4.06Å; L136-F168 HydrophobicContact CD2-CE2 3.44Å; L136-F168 VanDerWaalsContact CD2-CE2 3.44Å; L136-F168 HydrophobicContact CD2-CZ 4.4Å; L147-F168 HydrophobicContact CD2-CE2 4.08Å; L147-F168 HydrophobicContact CD2-CZ 4.05Å; I150-F168 HydrophobicContact CD1-CE2 4.46Å; I150-F168 HydrophobicContact CD1-CZ 3.93Å; I150-F168 HydrophobicContact CG2-CE1 4.35Å; I150-F168 HydrophobicContact CG2-CZ 4.26Å; F163-F168 HydrophobicContact CB-CD1 4.17Å; F163-F168 HydrophobicContact CB-CE1 4.09Å; F163-F168 HydrophobicContact CD1-CE1 4.2Å; F163-F168 VanDerWaalsContact O-CD1 3.3Å; F163-F168 WeakPolarHBondContact O-CD1 3.45Å; V165-F168 WeakPolarHBondContact O-CA 3.39Å; V165-F168 PolarHBondContact O-N 3.39Å; P166-F168 VanDerWaalsContact C-N 3.34Å; P166-F168 PolarHBondContact O-N 3.38Å; F168-S170 VanDerWaalsContact C-N 3.29Å; F168-S170 PolarHBondContact O-N 3.41Å; F168-Y171 HydrophobicContact CD2-CD1 4.14Å; F168-Y171 HydrophobicContact CE2-CD1 4.09Å; F168-Y171 WeakPolarHBondContact O-CB 3.32Å; F168-Y171 PolarHBondContact O-N 3.17Å; F168-Y171 VanDerWaalsContact O-N 3.09Å; F168-L172 HydrophobicContact CD1-CD1 3.96Å; F168-L172 HydrophobicContact CD2-CD1 4.4Å; F168-L172 HydrophobicContact CD2-CD2 4.45Å; F168-L172 HydrophobicContact CD2-CG 4.11Å; F168-L172 HydrophobicContact CE1-CD1 3.73Å; F168-L172 HydrophobicContact CE1-CG 4.35Å; F168-L172 HydrophobicContact CE2-CD1 4.14Å; F168-L172 HydrophobicContact CE2-CD2 3.73Å; F168-L172 HydrophobicContact CE2-CG 3.85Å; F168-L172 HydrophobicContact CG-CD1 4.33Å; F168-L172 HydrophobicContact CG-CG 4.47Å; F168-L172 HydrophobicContact CZ-CD1 3.84Å; F168-L172 HydrophobicContact CZ-CD2 3.82Å; F168-L172 HydrophobicContact CZ-CG 4.01Å; F168-L172 WeakPolarHBondContact O-CG 3.37Å; F168-L172 PolarHBondContact O-N 3.38Å; F168-V188 HydrophobicContact CE1-CG1 3.97Å; F168-V188 HydrophobicContact CZ-CG1 3.77Å; F168-V192 HydrophobicContact CE1-CG2 4.42Å |
| 169 | I | 94.7 | Very high | 92.3 | Very high | 38 Ų | 38 | 74.1 Ų | 74.1 | 20% | 0.195 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -56.5 | -45.3 | 173.5 | -59.7 | -57.4 | 0 | 0 | 0 | 110.9 | V165 P166 Y171 L172 S173 L189 V192 | V165-I169 PolarHBondContact O-N 3.18Å; P166-I169 PolarHBondContact O-N 2.76Å; I169-Y171 PolarHBondContact O-N 2.99Å; I169-L172 PolarHBondContact O-N 3.44Å; I169-S173 PolarHBondContact O-N 3.07Å; I169-S173 PolarHBondContact O-OG 2.97Å; I169-L189 HydrophobicContact CD1-CD1 4Å; I169-L189 HydrophobicContact CG2-CD1 4.06Å; I169-V192 HydrophobicContact CD1-CB 4.47Å; I169-V192 HydrophobicContact CD1-CG1 3.76Å |
| 170 | S | 94.2 | Very high | 92.3 | Very high | 82 Ų | 82 | 78.9 Ų | 78.9 | 57% | 0.573 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -59.9 | -42.8 | 175 | 178.7 | 0 | 0 | 0 | 0 | 112.6 | P166 F168 S173 S174 | P166-S170 WeakPolarHBondContact O-CB 3.32Å; P166-S170 PolarHBondContact O-N 3.12Å; F168-S170 VanDerWaalsContact C-N 3.29Å; F168-S170 PolarHBondContact O-N 3.41Å; S170-S173 PolarHBondContact O-N 2.94Å; S170-S174 PolarHBondContact O-N 3.24Å |
| 171 | Y | 94.1 | Very high | 92.3 | Very high | 48 Ų | 48 | 78.9 Ų | 78.9 | 19% | 0.188 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 174.3 | 168.6 | -89.9 | 0 | 0 | 0 | 112.4 | L136 S143 L147 K167 F168 I169 S173 S174 K185 | L136-Y171 HydrophobicContact CD1-CE1 4.21Å; L136-Y171 HydrophobicContact CD2-CD1 3.89Å; L136-Y171 HydrophobicContact CD2-CE1 3.53Å; L136-Y171 HydrophobicContact CG-CE1 3.94Å; L136-Y171 HydrophobicContact CG-CE2 4.49Å; S143-Y171 PolarHBondContact OG-OH 3.08Å; L147-Y171 HydrophobicContact CD1-CE1 4.41Å; L147-Y171 HydrophobicContact CD2-CE1 4.41Å; K167-Y171 PolarHBondContact O-N 2.92Å; K167-Y171 VanDerWaalsContact O-N 3.1Å; F168-Y171 HydrophobicContact CD2-CD1 4.14Å; F168-Y171 HydrophobicContact CE2-CD1 4.09Å; F168-Y171 WeakPolarHBondContact O-CB 3.32Å; F168-Y171 PolarHBondContact O-N 3.17Å; F168-Y171 VanDerWaalsContact O-N 3.09Å; I169-Y171 PolarHBondContact O-N 2.99Å; Y171-S173 VanDerWaalsContact C-N 3.33Å; Y171-S173 PolarHBondContact O-N 3.48Å; Y171-S174 PolarHBondContact O-N 3.36Å; Y171-S174 PolarHBondContact O-OG 2.83Å; Y171-K185 HydrophobicContact CE1-CD 4.4Å; Y171-K185 HydrophobicContact CE1-CG 4.31Å; Y171-K185 PolarHBondContact O-NZ 2.88Å |
| 172 | L | 94.4 | Very high | 92.5 | Very high | 5 Ų | 5 | 73 Ų | 73 | 3% | 0.026 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -66.1 | -35.8 | 179.7 | -65.8 | 173.3 | 0 | 0 | 0 | 112.1 | L147 F168 I169 S174 K185 V188 L189 | L147-L172 HydrophobicContact CD2-CD2 3.91Å; F168-L172 HydrophobicContact CD1-CD1 3.96Å; F168-L172 HydrophobicContact CD2-CD1 4.4Å; F168-L172 HydrophobicContact CD2-CD2 4.45Å; F168-L172 HydrophobicContact CD2-CG 4.11Å; F168-L172 HydrophobicContact CE1-CD1 3.73Å; F168-L172 HydrophobicContact CE1-CG 4.35Å; F168-L172 HydrophobicContact CE2-CD1 4.14Å; F168-L172 HydrophobicContact CE2-CD2 3.73Å; F168-L172 HydrophobicContact CE2-CG 3.85Å; F168-L172 HydrophobicContact CG-CD1 4.33Å; F168-L172 HydrophobicContact CG-CG 4.47Å; F168-L172 HydrophobicContact CZ-CD1 3.84Å; F168-L172 HydrophobicContact CZ-CD2 3.82Å; F168-L172 HydrophobicContact CZ-CG 4.01Å; F168-L172 WeakPolarHBondContact O-CG 3.37Å; F168-L172 PolarHBondContact O-N 3.38Å; I169-L172 PolarHBondContact O-N 3.44Å; L172-S174 VanDerWaalsContact C-N 3.28Å; L172-S174 PolarHBondContact O-N 3.32Å; L172-K185 HydrophobicContact CD2-CB 4.14Å; L172-K185 HydrophobicContact CD2-CG 4.13Å; L172-K185 WeakPolarHBondContact O-CB 3.08Å; L172-V188 HydrophobicContact CD1-CB 4.39Å; L172-V188 HydrophobicContact CD1-CG1 3.79Å; L172-V188 HydrophobicContact CD2-CB 3.98Å; L172-V188 HydrophobicContact CD2-CG1 3.86Å; L172-L189 HydrophobicContact CB-CB 4.12Å; L172-L189 HydrophobicContact CB-CD1 4.29Å; L172-L189 HydrophobicContact CD1-CB 4.19Å; L172-L189 HydrophobicContact CD1-CD1 4.31Å |
| 173 | S | 93.5 | Very high | 92.5 | Very high | 77 Ų | 77 | 74.5 Ų | 74.5 | 54% | 0.538 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -75.2 | -15.4 | 176.3 | -60.9 | 0 | 0 | 0 | 0 | 113.8 | I169 S170 Y171 | I169-S173 PolarHBondContact O-N 3.07Å; I169-S173 PolarHBondContact O-OG 2.97Å; S170-S173 PolarHBondContact O-N 2.94Å; Y171-S173 VanDerWaalsContact C-N 3.33Å; Y171-S173 PolarHBondContact O-N 3.48Å |
| 174 | S | 93.5 | Very high | 92.6 | Very high | 54 Ų | 54 | 76.7 Ų | 76.7 | 38% | 0.378 | 42% | 0.416 | S | S | . | . | S | Bend | trans | -75.1 | 135.9 | 178.3 | 71 | 0 | 0 | 0 | 0 | 112.2 | S170 Y171 L172 K185 | S170-S174 PolarHBondContact O-N 3.24Å; Y171-S174 PolarHBondContact O-N 3.36Å; Y171-S174 PolarHBondContact O-OG 2.83Å; L172-S174 VanDerWaalsContact C-N 3.28Å; L172-S174 PolarHBondContact O-N 3.32Å; S174-K185 WeakPolarHBondContact O-CD 3.33Å; S174-K185 PolarHBondContact O-NZ 3.27Å; S174-K185 PolarHBondContact OG-NZ 2.94Å |
| 175 | K | 89.8 | Confident | 92.8 | Very high | 197 Ų | 197 | 72.7 Ų | 72.7 | 86% | 0.857 | 39% | 0.394 | S | S | * | . | trans | -79.9 | 144 | 174.7 | -65.6 | -171 | 177 | -176 | 0 | 111.3 | ||||
| 176 | S | 89.1 | Confident | 92.9 | Very high | 34 Ų | 34 | 76 Ų | 76 | 24% | 0.238 | 41% | 0.406 | C | S | . | . | trans | -119.5 | 166 | 166.2 | 51 | 0 | 0 | 0 | 0 | 110.9 | D178 N182 | S176-D178 PolarHBondContact O-N 3.16Å; S176-D178 PolarHBondContact OG-O 3.13Å; S176-N182 PolarHBondContact N-OD1 3.32Å; S176-N182 PolarHBondContact O-ND2 3.27Å; S176-N182 PolarHBondContact OG-OD1 3.08Å; S176-N182 VanDerWaalsContact OG-OD1 3.09Å | ||
| 177 | D | 90.3 | Very high | 93 | Very high | 180 Ų | 180 | 74.6 Ų | 74.6 | 96% | 0.963 | 39% | 0.392 | S | S | * | . | S | Bend | trans | -70.1 | -20.5 | 174.3 | -55 | -37.9 | 0 | 0 | 0 | 112.5 | S179 | D177-S179 PolarHBondContact O-N 3.32Š|
| 178 | D | 90.8 | Very high | 93.2 | Very high | 66 Ų | 66 | 66.9 Ų | 66.9 | 35% | 0.353 | 36% | 0.359 | S | S | . | . | trans | -80.8 | 113.3 | 176 | 179.8 | -12.4 | 0 | 0 | 0 | 111 | S176 E180 L181 N182 | S176-D178 PolarHBondContact O-N 3.16Å; S176-D178 PolarHBondContact OG-O 3.13Å; D178-E180 WeakPolarHBondContact OD1-CA 3Å; D178-E180 WeakPolarHBondContact OD1-CB 3.35Å; D178-E180 PolarHBondContact OD1-N 3.37Å; D178-L181 HydrophobicContact CB-CB 3.81Å; D178-L181 PolarHBondContact O-N 3.44Å; D178-L181 PolarHBondContact OD1-N 2.89Å; D178-N182 VanDerWaalsContact O-CG 3.3Å; D178-N182 PolarHBondContact O-N 3.22Å; D178-N182 VanDerWaalsContact O-N 3.08Å; D178-N182 PolarHBondContact O-ND2 3.11Å; D178-N182 VanDerWaalsContact O-ND2 3.15Å | ||
| 179 | S | 91.7 | Very high | 93.2 | Very high | 90 Ų | 90 | 68.3 Ų | 68.3 | 63% | 0.629 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -66.2 | -36.8 | 178.8 | 56.1 | 0 | 0 | 0 | 0 | 113.3 | D177 N182 L183 | D177-S179 PolarHBondContact O-N 3.32Å; S179-N182 PolarHBondContact O-N 2.98Å; S179-L183 WeakPolarHBondContact O-CG 3.44Å; S179-L183 PolarHBondContact O-N 3.47Å; S179-L183 VanDerWaalsContact O-N 3.08Å |
| 180 | E | 91 | Very high | 93.2 | Very high | 99 Ų | 99 | 72 Ų | 72 | 46% | 0.463 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -67.6 | -43.3 | 178.4 | -167.3 | -165.4 | 148.4 | 0 | 0 | 110 | D178 N182 L183 R184 | D178-E180 WeakPolarHBondContact OD1-CA 3Å; D178-E180 WeakPolarHBondContact OD1-CB 3.35Å; D178-E180 PolarHBondContact OD1-N 3.37Å; E180-N182 VanDerWaalsContact C-N 3.31Å; E180-N182 PolarHBondContact O-N 2.95Å; E180-L183 PolarHBondContact O-N 3.37Å; E180-R184 WeakPolarHBondContact O-CB 3.26Å; E180-R184 PolarHBondContact O-N 2.68Å; E180-R184 IonicContact OE1-CZ 3.89Å; E180-R184 IonicContact OE1-NH2 3.78Å; E180-R184 PolarHBondContact OE1-NH2 2.88Å |
| 181 | L | 93 | Very high | 93.2 | Very high | 19 Ų | 19 | 69.3 Ų | 69.3 | 10% | 0.099 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60.8 | -41.4 | 175.7 | -179.9 | 58.6 | 0 | 0 | 0 | 111.5 | N144 L147 D178 R184 K185 | N144-L181 WeakPolarHBondContact OD1-CA 3.48Å; N144-L181 WeakPolarHBondContact OD1-CD1 3.46Å; L147-L181 HydrophobicContact CD1-CD1 3.52Å; D178-L181 HydrophobicContact CB-CB 3.81Å; D178-L181 PolarHBondContact O-N 3.44Å; D178-L181 PolarHBondContact OD1-N 2.89Å; L181-R184 PolarHBondContact O-N 2.82Å; L181-K185 HydrophobicContact CD1-CG 4.45Å; L181-K185 WeakPolarHBondContact O-CG 3.49Å; L181-K185 PolarHBondContact O-N 3.48Å |
| 182 | N | 93.5 | Very high | 93.1 | Very high | 38 Ų | 38 | 67.2 Ų | 67.2 | 20% | 0.203 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.1 | -45.5 | 175.8 | -72.8 | -35.8 | 0 | 0 | 0 | 112.2 | S176 D178 S179 E180 R184 K185 Q186 | S176-N182 PolarHBondContact N-OD1 3.32Å; S176-N182 PolarHBondContact O-ND2 3.27Å; S176-N182 PolarHBondContact OG-OD1 3.08Å; S176-N182 VanDerWaalsContact OG-OD1 3.09Å; D178-N182 VanDerWaalsContact O-CG 3.3Å; D178-N182 PolarHBondContact O-N 3.22Å; D178-N182 VanDerWaalsContact O-N 3.08Å; D178-N182 PolarHBondContact O-ND2 3.11Å; D178-N182 VanDerWaalsContact O-ND2 3.15Å; S179-N182 PolarHBondContact O-N 2.98Å; E180-N182 VanDerWaalsContact C-N 3.31Å; E180-N182 PolarHBondContact O-N 2.95Å; N182-R184 VanDerWaalsContact C-N 3.3Å; N182-R184 PolarHBondContact O-N 2.86Å; N182-K185 PolarHBondContact O-N 3.38Å; N182-Q186 WeakPolarHBondContact O-CG 3.19Å; N182-Q186 PolarHBondContact O-N 3.35Å |
| 183 | L | 93.5 | Very high | 92.9 | Very high | 115 Ų | 115 | 71.5 Ų | 71.5 | 60% | 0.602 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -59.6 | -43.4 | 175.9 | -72.7 | 172.6 | 0 | 0 | 0 | 111.3 | S179 E180 Q186 L187 | S179-L183 WeakPolarHBondContact O-CG 3.44Å; S179-L183 PolarHBondContact O-N 3.47Å; S179-L183 VanDerWaalsContact O-N 3.08Å; E180-L183 PolarHBondContact O-N 3.37Å; L183-Q186 PolarHBondContact O-N 2.99Å; L183-L187 PolarHBondContact O-N 3.32Å |
| 184 | R | 93.9 | Very high | 92.7 | Very high | 46 Ų | 46 | 68.4 Ų | 68.4 | 17% | 0.174 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.2 | -40.5 | 178.9 | -160.3 | 174.4 | -66.8 | -78.9 | 4.1 | 112 | N144 L147 E180 L181 N182 L187 V188 | N144-R184 WeakPolarHBondContact O-CD 3.22Å; L147-R184 HydrophobicContact CB-CG 3.81Å; L147-R184 HydrophobicContact CD1-CB 4.49Å; L147-R184 HydrophobicContact CD1-CG 4.34Å; E180-R184 WeakPolarHBondContact O-CB 3.26Å; E180-R184 PolarHBondContact O-N 2.68Å; E180-R184 IonicContact OE1-CZ 3.89Å; E180-R184 IonicContact OE1-NH2 3.78Å; E180-R184 PolarHBondContact OE1-NH2 2.88Å; L181-R184 PolarHBondContact O-N 2.82Å; N182-R184 VanDerWaalsContact C-N 3.3Å; N182-R184 PolarHBondContact O-N 2.86Å; R184-L187 PolarHBondContact O-N 3.24Å; R184-V188 VanDerWaalsContact O-CG2 3.31Å; R184-V188 WeakPolarHBondContact O-CG2 3.08Å; R184-V188 PolarHBondContact O-N 3.49Å |
| 185 | K | 95.7 | Very high | 92.4 | Very high | 7 Ų | 7 | 67.8 Ų | 67.8 | 3% | 0.03 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.3 | -43.6 | 173.3 | -74.8 | -179 | -179.8 | -168.2 | 0 | 112 | L147 Y171 L172 S174 L181 N182 V188 L189 | L147-K185 HydrophobicContact CD1-CG 3.97Å; Y171-K185 HydrophobicContact CE1-CD 4.4Å; Y171-K185 HydrophobicContact CE1-CG 4.31Å; Y171-K185 PolarHBondContact O-NZ 2.88Å; L172-K185 HydrophobicContact CD2-CB 4.14Å; L172-K185 HydrophobicContact CD2-CG 4.13Å; L172-K185 WeakPolarHBondContact O-CB 3.08Å; S174-K185 WeakPolarHBondContact O-CD 3.33Å; S174-K185 PolarHBondContact O-NZ 3.27Å; S174-K185 PolarHBondContact OG-NZ 2.94Å; L181-K185 HydrophobicContact CD1-CG 4.45Å; L181-K185 WeakPolarHBondContact O-CG 3.49Å; L181-K185 PolarHBondContact O-N 3.48Å; N182-K185 PolarHBondContact O-N 3.38Å; K185-V188 PolarHBondContact O-N 3.16Å; K185-L189 VanDerWaalsContact O-CB 3.29Å; K185-L189 WeakPolarHBondContact O-CB 3.07Å; K185-L189 PolarHBondContact O-N 3.46Å |
| 186 | Q | 94.9 | Very high | 92.1 | Very high | 127 Ų | 127 | 60.2 Ų | 60.2 | 59% | 0.593 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.1 | -44.6 | 177.2 | -73.4 | 176.5 | -9.1 | 0 | 0 | 111.9 | N182 L183 L189 W190 | N182-Q186 WeakPolarHBondContact O-CG 3.19Å; N182-Q186 PolarHBondContact O-N 3.35Å; L183-Q186 PolarHBondContact O-N 2.99Å; Q186-L189 PolarHBondContact O-N 3.31Å; Q186-W190 WeakPolarHBondContact O-CB 3.47Å; Q186-W190 PolarHBondContact O-N 3.06Å |
| 187 | L | 94.9 | Very high | 91.7 | Very high | 77 Ų | 77 | 65.9 Ų | 65.9 | 40% | 0.403 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -58.7 | -49.4 | 175.6 | 175.8 | 62.7 | 0 | 0 | 0 | 111.5 | T151 L183 R184 L189 W190 L191 | T151-L187 HydrophobicContact CG2-CD2 3.95Å; T151-L187 HydrophobicContact CG2-CG 4.49Å; L183-L187 PolarHBondContact O-N 3.32Å; R184-L187 PolarHBondContact O-N 3.24Å; L187-L189 VanDerWaalsContact C-N 3.34Å; L187-L189 PolarHBondContact O-N 3.03Å; L187-W190 HydrophobicContact CD1-CE3 4.42Å; L187-W190 PolarHBondContact O-N 2.97Å; L187-L191 HydrophobicContact CD1-CD1 4.18Å; L187-L191 HydrophobicContact CD1-CG 4.32Å; L187-L191 HydrophobicContact CG-CD1 4.11Å; L187-L191 WeakPolarHBondContact O-CG 3.5Å; L187-L191 PolarHBondContact O-N 3.06Å |
| 188 | V | 95.8 | Very high | 91.5 | Very high | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.9 | -40.9 | 179.6 | 175.2 | 0 | 0 | 0 | 0 | 110.9 | L147 I150 T151 L154 F168 L172 R184 K185 W190 L191 V192 | L147-V188 HydrophobicContact CB-CG2 4.39Å; L147-V188 HydrophobicContact CD2-CG1 4.45Å; L147-V188 HydrophobicContact CD2-CG2 4.23Å; I150-V188 HydrophobicContact CG2-CG1 4.03Å; T151-V188 VanDerWaalsContact OG1-CG2 3.27Å; T151-V188 WeakPolarHBondContact OG1-CG2 3.44Å; L154-V188 HydrophobicContact CD1-CG1 3.9Å; F168-V188 HydrophobicContact CE1-CG1 3.97Å; F168-V188 HydrophobicContact CZ-CG1 3.77Å; L172-V188 HydrophobicContact CD1-CB 4.39Å; L172-V188 HydrophobicContact CD1-CG1 3.79Å; L172-V188 HydrophobicContact CD2-CB 3.98Å; L172-V188 HydrophobicContact CD2-CG1 3.86Å; R184-V188 VanDerWaalsContact O-CG2 3.31Å; R184-V188 WeakPolarHBondContact O-CG2 3.08Å; R184-V188 PolarHBondContact O-N 3.49Å; K185-V188 PolarHBondContact O-N 3.16Å; V188-W190 PolarHBondContact O-N 2.76Å; V188-L191 PolarHBondContact O-N 3.36Å; V188-V192 HydrophobicContact CG1-CG2 4.27Å; V188-V192 VanDerWaalsContact O-CG2 3.28Å; V188-V192 WeakPolarHBondContact O-CG2 3.39Å; V188-V192 PolarHBondContact O-N 2.9Å |
| 189 | L | 95.5 | Very high | 91.1 | Very high | 36 Ų | 36 | 62.6 Ų | 62.6 | 19% | 0.188 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.6 | -45 | 176.5 | -177.6 | 60.2 | 0 | 0 | 0 | 111.6 | I169 L172 K185 Q186 L187 V192 N193 | I169-L189 HydrophobicContact CD1-CD1 4Å; I169-L189 HydrophobicContact CG2-CD1 4.06Å; L172-L189 HydrophobicContact CB-CB 4.12Å; L172-L189 HydrophobicContact CB-CD1 4.29Å; L172-L189 HydrophobicContact CD1-CB 4.19Å; L172-L189 HydrophobicContact CD1-CD1 4.31Å; K185-L189 VanDerWaalsContact O-CB 3.29Å; K185-L189 WeakPolarHBondContact O-CB 3.07Å; K185-L189 PolarHBondContact O-N 3.46Å; Q186-L189 PolarHBondContact O-N 3.31Å; L187-L189 VanDerWaalsContact C-N 3.34Å; L187-L189 PolarHBondContact O-N 3.03Å; L189-V192 PolarHBondContact O-N 2.87Å; L189-N193 PolarHBondContact O-N 3.47Å; L189-N193 PolarHBondContact O-ND2 2.92Å; L189-N193 VanDerWaalsContact O-ND2 3.1Å |
| 190 | W | 93.6 | Very high | 90.5 | Very high | 114 Ų | 114 | 63.7 Ų | 63.7 | 43% | 0.432 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -60 | -48.8 | 175.4 | 179.6 | 76.4 | 0 | 0 | 0 | 111.2 | Q186 L187 V188 V192 N193 L194 | Q186-W190 WeakPolarHBondContact O-CB 3.47Å; Q186-W190 PolarHBondContact O-N 3.06Å; L187-W190 HydrophobicContact CD1-CE3 4.42Å; L187-W190 PolarHBondContact O-N 2.97Å; V188-W190 PolarHBondContact O-N 2.76Å; W190-V192 PolarHBondContact O-N 3Å; W190-N193 PolarHBondContact O-N 2.93Å; W190-L194 HydrophobicContact CE3-CD1 4.27Å; W190-L194 HydrophobicContact CH2-CD1 3.9Å; W190-L194 HydrophobicContact CH2-CD2 4.49Å; W190-L194 HydrophobicContact CZ2-CD1 4.19Å; W190-L194 HydrophobicContact CZ2-CD2 3.96Å; W190-L194 HydrophobicContact CZ2-CG 4.48Å; W190-L194 HydrophobicContact CZ3-CD1 3.94Å; W190-L194 PolarHBondContact O-N 2.88Å |
| 191 | L | 94.2 | Very high | 90.2 | Very high | 26 Ų | 26 | 63.8 Ų | 63.8 | 14% | 0.136 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62.1 | -38.8 | 179.9 | -73 | 172.6 | 0 | 0 | 0 | 113.7 | T151 L154 R160 L187 V188 N193 L194 | T151-L191 HydrophobicContact CG2-CD1 3.73Å; L154-L191 HydrophobicContact CB-CB 4.21Å; L154-L191 HydrophobicContact CB-CD1 4.48Å; L154-L191 HydrophobicContact CD1-CB 3.81Å; L154-L191 HydrophobicContact CD1-CD1 4.47Å; R160-L191 WeakPolarHBondContact CD-O 3.26Å; L187-L191 HydrophobicContact CD1-CD1 4.18Å; L187-L191 HydrophobicContact CD1-CG 4.32Å; L187-L191 HydrophobicContact CG-CD1 4.11Å; L187-L191 WeakPolarHBondContact O-CG 3.5Å; L187-L191 PolarHBondContact O-N 3.06Å; V188-L191 PolarHBondContact O-N 3.36Å; L191-N193 VanDerWaalsContact C-N 3.28Å; L191-N193 PolarHBondContact O-N 3.25Å; L191-L194 HydrophobicContact CD2-CD1 4.05Å; L191-L194 PolarHBondContact O-N 3.45Å |
| 192 | V | 93.4 | Very high | 89.7 | Confident | 5 Ų | 5 | 65.1 Ų | 65.1 | 3% | 0.03 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65 | -34.9 | 177.6 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | L154 F163 N164 F168 I169 V188 L189 W190 | L154-V192 HydrophobicContact CD1-CG2 3.66Å; L154-V192 HydrophobicContact CD2-CG2 3.9Å; L154-V192 HydrophobicContact CG-CG2 4.47Å; F163-V192 HydrophobicContact CB-CG2 4.12Å; N164-V192 HydrophobicContact CB-CG1 3.86Å; F168-V192 HydrophobicContact CE1-CG2 4.42Å; I169-V192 HydrophobicContact CD1-CB 4.47Å; I169-V192 HydrophobicContact CD1-CG1 3.76Å; V188-V192 HydrophobicContact CG1-CG2 4.27Å; V188-V192 VanDerWaalsContact O-CG2 3.28Å; V188-V192 WeakPolarHBondContact O-CG2 3.39Å; V188-V192 PolarHBondContact O-N 2.9Å; L189-V192 PolarHBondContact O-N 2.87Å; W190-V192 PolarHBondContact O-N 3Å |
| 193 | N | 89.9 | Confident | 89.2 | Confident | 95 Ų | 95 | 66.1 Ų | 66.1 | 51% | 0.508 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -81.1 | -12 | -178 | -70.2 | -30.3 | 0 | 0 | 0 | 114 | L189 W190 L191 | L189-N193 PolarHBondContact O-N 3.47Å; L189-N193 PolarHBondContact O-ND2 2.92Å; L189-N193 VanDerWaalsContact O-ND2 3.1Å; W190-N193 PolarHBondContact O-N 2.93Å; L191-N193 VanDerWaalsContact C-N 3.28Å; L191-N193 PolarHBondContact O-N 3.25Å |
| 194 | L | 89.8 | Confident | 88.5 | Confident | 11 Ų | 11 | 63.3 Ų | 63.3 | 6% | 0.058 | 33% | 0.331 | C | S | . | . | S | Bend | trans | -66.5 | 135 | 175.5 | -69.4 | 178.5 | 0 | 0 | 0 | 110.9 | R160 W190 L191 L199 | R160-L194 WeakPolarHBondContact CD-O 3.3Å; R160-L194 VanDerWaalsContact NH1-C 3.33Å; R160-L194 PolarHBondContact NH1-O 3.33Å; W190-L194 HydrophobicContact CE3-CD1 4.27Å; W190-L194 HydrophobicContact CH2-CD1 3.9Å; W190-L194 HydrophobicContact CH2-CD2 4.49Å; W190-L194 HydrophobicContact CZ2-CD1 4.19Å; W190-L194 HydrophobicContact CZ2-CD2 3.96Å; W190-L194 HydrophobicContact CZ2-CG 4.48Å; W190-L194 HydrophobicContact CZ3-CD1 3.94Å; W190-L194 PolarHBondContact O-N 2.88Å; L191-L194 HydrophobicContact CD2-CD1 4.05Å; L191-L194 PolarHBondContact O-N 3.45Å; L194-L199 HydrophobicContact CB-CD1 4.09Å; L194-L199 HydrophobicContact CD1-CD1 4.21Å; L194-L199 HydrophobicContact CD2-CD1 3.95Å; L194-L199 HydrophobicContact CG-CD1 4.32Å |
| 195 | P | 85.4 | Confident | 87.8 | Confident | 41 Ų | 41 | 65.4 Ų | 65.4 | 27% | 0.266 | 35% | 0.353 | S | S | . | . | trans | -68 | 142.1 | -177.7 | 29.2 | -35 | 0 | 0 | 0 | 111.5 | R160 Q197 H202 | R160-P195 PolarHBondContact NH1-O 3.17Å; P195-Q197 WeakPolarHBondContact CB-O 3.4Å; P195-Q197 PolarHBondContact O-N 3.17Å; P195-H202 WeakPolarHBondContact CD-CD2 3.47Å; P195-H202 VanDerWaalsContact CD-CG 3.46Å; P195-H202 HydrophobicContact CG-CB 3.45Å; P195-H202 VanDerWaalsContact CG-CB 3.45Å; P195-H202 VanDerWaalsContact CG-CG 3.43Å | ||
| 196 | S | 83.5 | Confident | 86.8 | Confident | 38 Ų | 38 | 70 Ų | 70 | 27% | 0.266 | 38% | 0.375 | S | S | . | . | S | Bend | trans | -68 | -18.3 | 179.5 | -58.5 | 0 | 0 | 0 | 0 | 113.6 | P157 | P157-S196 WeakPolarHBondContact O-CB 3.35Å; P157-S196 PolarHBondContact O-OG 2.93Å |
| 197 | Q | 82.3 | Confident | 85.3 | Confident | 153 Ų | 153 | 69.7 Ų | 69.7 | 72% | 0.715 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -133.2 | 159.9 | 178.9 | -68.5 | 177.4 | -12.6 | 0 | 0 | 109 | P195 L199 | P195-Q197 WeakPolarHBondContact CB-O 3.4Å; P195-Q197 PolarHBondContact O-N 3.17Å; Q197-L199 PolarHBondContact O-N 2.96Å |
| 198 | N | 84.5 | Confident | 83.4 | Confident | 114 Ų | 114 | 68.8 Ų | 68.8 | 61% | 0.61 | 38% | 0.378 | S | S | * | . | trans | 54.3 | 38.8 | 176.4 | -55.3 | -12.4 | 0 | 0 | 0 | 113.2 | V200 D201 H202 | N198-V200 PolarHBondContact O-N 2.93Å; N198-D201 HydrophobicContact CB-CB 4.23Å; N198-D201 WeakPolarHBondContact CB-OD2 3.12Å; N198-D201 PolarHBondContact O-N 3.04Å; N198-H202 WeakPolarHBondContact O-CB 3.36Å; N198-H202 PolarHBondContact O-N 2.93Å | ||
| 199 | L | 83.5 | Confident | 81 | Confident | 63 Ų | 63 | 76.5 Ų | 76.5 | 33% | 0.33 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -59.1 | -38.3 | -179.2 | -178 | 65.1 | 0 | 0 | 0 | 111.7 | L194 Q197 H202 L203 | L194-L199 HydrophobicContact CB-CD1 4.09Å; L194-L199 HydrophobicContact CD1-CD1 4.21Å; L194-L199 HydrophobicContact CD2-CD1 3.95Å; L194-L199 HydrophobicContact CG-CD1 4.32Å; Q197-L199 PolarHBondContact O-N 2.96Å; L199-H202 WeakPolarHBondContact O-CB 3.33Å; L199-H202 PolarHBondContact O-N 3.13Å; L199-L203 HydrophobicContact CD1-CD1 4.44Å; L199-L203 HydrophobicContact CD1-CG 4.38Å; L199-L203 HydrophobicContact CG-CD1 4.13Å; L199-L203 HydrophobicContact CG-CG 4.45Å; L199-L203 VanDerWaalsContact O-CG 3.29Å; L199-L203 WeakPolarHBondContact O-CG 3.12Å; L199-L203 PolarHBondContact O-N 2.91Å |
| 200 | V | 79.7 | Confident | 78.7 | Confident | 114 Ų | 114 | 81.1 Ų | 81.1 | 69% | 0.691 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -63.3 | -48 | 177.6 | 178.8 | 0 | 0 | 0 | 0 | 110.5 | N198 H202 L203 A204 | N198-V200 PolarHBondContact O-N 2.93Å; V200-H202 VanDerWaalsContact C-N 3.28Å; V200-H202 PolarHBondContact O-N 3.37Å; V200-L203 PolarHBondContact O-N 3.19Å; V200-A204 VanDerWaalsContact O-CB 3.29Å; V200-A204 WeakPolarHBondContact O-CB 3.46Å; V200-A204 PolarHBondContact O-N 3.49Å |
| 201 | D | 83.1 | Confident | 76.4 | Confident | 100 Ų | 100 | 83.6 Ų | 83.6 | 54% | 0.535 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.7 | -35.7 | 177.5 | -54.7 | -31.5 | 0 | 0 | 0 | 111.8 | N198 S205 | N198-D201 HydrophobicContact CB-CB 4.23Å; N198-D201 WeakPolarHBondContact CB-OD2 3.12Å; N198-D201 PolarHBondContact O-N 3.04Å; D201-S205 WeakPolarHBondContact O-CB 3.44Å; D201-S205 PolarHBondContact O-N 2.95Å; D201-S205 PolarHBondContact O-OG 3.23Å |
| 202 | H | 83.4 | Confident | 73.9 | Confident | 47 Ų | 47 | 89.6 Ų | 89.6 | 22% | 0.218 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -65.1 | -46.1 | 174.7 | -179 | 74.9 | 0 | 0 | 0 | 112.3 | P195 N198 L199 V200 S205 Q206 | P195-H202 WeakPolarHBondContact CD-CD2 3.47Å; P195-H202 VanDerWaalsContact CD-CG 3.46Å; P195-H202 HydrophobicContact CG-CB 3.45Å; P195-H202 VanDerWaalsContact CG-CB 3.45Å; P195-H202 VanDerWaalsContact CG-CG 3.43Å; N198-H202 WeakPolarHBondContact O-CB 3.36Å; N198-H202 PolarHBondContact O-N 2.93Å; L199-H202 WeakPolarHBondContact O-CB 3.33Å; L199-H202 PolarHBondContact O-N 3.13Å; V200-H202 VanDerWaalsContact C-N 3.28Å; V200-H202 PolarHBondContact O-N 3.37Å; H202-S205 WeakPolarHBondContact CA-OG 3.48Å; H202-S205 PolarHBondContact O-N 3.45Å; H202-S205 PolarHBondContact O-OG 2.82Å; H202-Q206 PolarHBondContact CE1-NE2 3.12Å; H202-Q206 VanDerWaalsContact CE1-NE2 3.33Å; H202-Q206 PolarHBondContact NE2-NE2 2.93Å; H202-Q206 WeakPolarHBondContact O-CB 3.39Å; H202-Q206 WeakPolarHBondContact O-CG 3.39Å; H202-Q206 PolarHBondContact O-N 3.47Å |
| 203 | L | 82.2 | Confident | 71.2 | Confident | 59 Ų | 59 | 95.8 Ų | 95.8 | 31% | 0.309 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.4 | -41.9 | 175.9 | -67.1 | 173.4 | 0 | 0 | 0 | 110.6 | L199 V200 S205 Q206 Y207 | L199-L203 HydrophobicContact CD1-CD1 4.44Å; L199-L203 HydrophobicContact CD1-CG 4.38Å; L199-L203 HydrophobicContact CG-CD1 4.13Å; L199-L203 HydrophobicContact CG-CG 4.45Å; L199-L203 VanDerWaalsContact O-CG 3.29Å; L199-L203 WeakPolarHBondContact O-CG 3.12Å; L199-L203 PolarHBondContact O-N 2.91Å; V200-L203 PolarHBondContact O-N 3.19Å; L203-S205 VanDerWaalsContact C-N 3.33Å; L203-S205 PolarHBondContact O-N 3.33Å; L203-Q206 PolarHBondContact O-N 3.35Å; L203-Y207 HydrophobicContact CB-CD2 4.45Å; L203-Y207 HydrophobicContact CD2-CD2 4.32Å; L203-Y207 HydrophobicContact CD2-CE2 3.93Å; L203-Y207 WeakPolarHBondContact O-CB 3.46Å; L203-Y207 VanDerWaalsContact O-CD2 3.23Å; L203-Y207 WeakPolarHBondContact O-CD2 3.35Å; L203-Y207 PolarHBondContact O-N 3.09Å |
| 204 | A | 79.1 | Confident | 68.9 | Low | 56 Ų | 56 | 102.2 Ų | 102.2 | 46% | 0.463 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.5 | -35.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | V200 G208 | V200-A204 VanDerWaalsContact O-CB 3.29Å; V200-A204 WeakPolarHBondContact O-CB 3.46Å; V200-A204 PolarHBondContact O-N 3.49Å; A204-G208 WeakPolarHBondContact O-CA 3.35Å; A204-G208 PolarHBondContact O-N 2.84Å |
| 205 | S | 80.6 | Confident | 66.5 | Low | 90 Ų | 90 | 105.9 Ų | 105.9 | 63% | 0.629 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -75.8 | -31.6 | 175.9 | 53.8 | 0 | 0 | 0 | 0 | 113.1 | D201 H202 L203 | D201-S205 WeakPolarHBondContact O-CB 3.44Å; D201-S205 PolarHBondContact O-N 2.95Å; D201-S205 PolarHBondContact O-OG 3.23Å; H202-S205 WeakPolarHBondContact CA-OG 3.48Å; H202-S205 PolarHBondContact O-N 3.45Å; H202-S205 PolarHBondContact O-OG 2.82Å; L203-S205 VanDerWaalsContact C-N 3.33Å; L203-S205 PolarHBondContact O-N 3.33Å |
| 206 | Q | 72.8 | Confident | 64.4 | Low | 104 Ų | 104 | 110.5 Ų | 110.5 | 49% | 0.486 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -75.3 | -34.1 | 175 | -76.4 | -167.7 | -16.4 | 0 | 0 | 113.2 | H202 L203 | H202-Q206 PolarHBondContact CE1-NE2 3.12Å; H202-Q206 VanDerWaalsContact CE1-NE2 3.33Å; H202-Q206 PolarHBondContact NE2-NE2 2.93Å; H202-Q206 WeakPolarHBondContact O-CB 3.39Å; H202-Q206 WeakPolarHBondContact O-CG 3.39Å; H202-Q206 PolarHBondContact O-N 3.47Å; L203-Q206 PolarHBondContact O-N 3.35Å |
| 207 | Y | 64.8 | Low | 62.2 | Low | 121 Ų | 121 | 112.8 Ų | 112.8 | 48% | 0.475 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -114.2 | -7.9 | -173.7 | -61.9 | -74.4 | 0 | 0 | 0 | 114.1 | L203 L209 H210 | L203-Y207 HydrophobicContact CB-CD2 4.45Å; L203-Y207 HydrophobicContact CD2-CD2 4.32Å; L203-Y207 HydrophobicContact CD2-CE2 3.93Å; L203-Y207 WeakPolarHBondContact O-CB 3.46Å; L203-Y207 VanDerWaalsContact O-CD2 3.23Å; L203-Y207 WeakPolarHBondContact O-CD2 3.35Å; L203-Y207 PolarHBondContact O-N 3.09Å; Y207-L209 PolarHBondContact O-N 3.41Å; Y207-H210 WeakPolarHBondContact O-CB 2.91Å; Y207-H210 PolarHBondContact O-N 2.87Å |
| 208 | G | 53.7 | Low | 60.3 | Low | 57 Ų | 57 | 111.1 Ų | 111.1 | 59% | 0.588 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | 21.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | A204 | A204-G208 WeakPolarHBondContact O-CA 3.35Å; A204-G208 PolarHBondContact O-N 2.84Å |
| 209 | L | 46.6 | Very low | 58.1 | Low | 162 Ų | 162 | 113.4 Ų | 113.4 | 85% | 0.848 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107 | 2.8 | 156.9 | -79.8 | 160.8 | 0 | 0 | 0 | 112.1 | Y207 D211 | Y207-L209 PolarHBondContact O-N 3.41Å; L209-D211 VanDerWaalsContact C-N 3.26Å; L209-D211 PolarHBondContact O-N 3.18Å |
| 210 | H | 47.6 | Very low | 56.1 | Low | 134 Ų | 134 | 117.7 Ų | 117.7 | 62% | 0.62 | 64% | 0.637 | S | S | * | * | trans | -90 | 57.4 | 168 | -71.2 | -64.4 | 0 | 0 | 0 | 111.6 | Y207 | Y207-H210 WeakPolarHBondContact O-CB 2.91Å; Y207-H210 PolarHBondContact O-N 2.87Å | ||
| 211 | D | 45.4 | Very low | 54.1 | Low | 166 Ų | 166 | 125.7 Ų | 125.7 | 89% | 0.888 | 66% | 0.663 | S | S | * | * | trans | -85.1 | 20.8 | 153.6 | -110.6 | -13.3 | 0 | 0 | 0 | 111.1 | L209 | L209-D211 VanDerWaalsContact C-N 3.26Å; L209-D211 PolarHBondContact O-N 3.18Å | ||
| 212 | Q | 41.9 | Very low | 52.6 | Low | 151 Ų | 151 | 127 Ų | 127 | 71% | 0.706 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -106 | 99.6 | 172.3 | -68 | -175 | -4.5 | 0 | 0 | 109.2 | ||
| 213 | N | 35.6 | Very low | 51 | Low | 135 Ų | 135 | 131.2 Ų | 131.2 | 72% | 0.722 | 69% | 0.693 | S | S | * | * | trans | 76.6 | 50.4 | 153 | -53.7 | -19.1 | 0 | 0 | 0 | 118.8 | ||||
| 214 | W | 42.6 | Very low | 49.3 | Very low | 230 Ų | 230 | 135.2 Ų | 135.2 | 87% | 0.871 | 71% | 0.714 | S | S | * | * | trans | -94.2 | 34.1 | 144.7 | -78.6 | 76.2 | 0 | 0 | 0 | 111.7 | I216 | W214-I216 PolarHBondContact O-N 3.21Š| ||
| 215 | S | 38.6 | Very low | 47.5 | Very low | 89 Ų | 89 | 139.9 Ų | 139.9 | 62% | 0.622 | 73% | 0.729 | S | S | * | * | trans | -62.7 | 89.3 | 149.6 | 57 | 0 | 0 | 0 | 0 | 106.4 | S217 | S215-S217 PolarHBondContact O-N 3.24Š| ||
| 216 | I | 40.6 | Very low | 45.4 | Very low | 137 Ų | 137 | 143 Ų | 143 | 70% | 0.703 | 74% | 0.735 | S | S | * | * | trans | -51.8 | 103.4 | 149.6 | -64.2 | 171.5 | 0 | 0 | 0 | 103.1 | W214 S218 | W214-I216 PolarHBondContact O-N 3.21Å; I216-S218 PolarHBondContact O-N 3.3Å | ||
| 217 | S | 38.3 | Very low | 43.6 | Very low | 87 Ų | 87 | 145.6 Ų | 145.6 | 61% | 0.608 | 75% | 0.752 | S | S | * | * | trans | -59.4 | 95.7 | 171.4 | 52.7 | 0 | 0 | 0 | 0 | 106.1 | S215 E219 | S215-S217 PolarHBondContact O-N 3.24Å; S217-E219 PolarHBondContact O-N 3.16Å | ||
| 218 | S | 42.4 | Very low | 42.1 | Very low | 117 Ų | 117 | 147.4 Ų | 147.4 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | trans | -73.8 | 26.6 | 163.2 | 52.9 | 0 | 0 | 0 | 0 | 111.1 | I216 | I216-S218 PolarHBondContact O-N 3.3Š| ||
| 219 | E | 37 | Very low | 41.2 | Very low | 162 Ų | 162 | 154.3 Ų | 154.3 | 76% | 0.757 | 79% | 0.786 | S | S | * | * | trans | -125.8 | 80.2 | 176.3 | -71.5 | -174.1 | 169.8 | 0 | 0 | 107.5 | S217 | S217-E219 PolarHBondContact O-N 3.16Š| ||
| 220 | N | 43.1 | Very low | 40.8 | Very low | 153 Ų | 153 | 153.7 Ų | 153.7 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -163.2 | 91.6 | 146.4 | -93.7 | -35.2 | 0 | 0 | 0 | 109.2 | ||||
| 221 | K | 36.2 | Very low | 40.1 | Very low | 283 Ų | 283 | 155.5 Ų | 155.5 | 100% | 1.23 | 80% | 0.795 | S | S | * | * | trans | 80 | 0 | 167 | -63.9 | -176.3 | 177.6 | 179.5 | 0 | 118.5 |
Retrieved 221 of 221 residues in 56.3 ms
(Link to these results)