| 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 | 38.4 | Very low | 52.3 | Low | 254 Ų | 254 | 124.8 Ų | 124.8 | 100% | 1.251 | 69% | 0.687 | S | S | * | * | 0 | 99.4 | 0 | -81.3 | 167.6 | 154.3 | 0 | 0 | 107.9 | |||||
| 2 | A | 46.7 | Very low | 52.7 | Low | 91 Ų | 91 | 130.3 Ų | 130.3 | 75% | 0.752 | 69% | 0.689 | S | S | * | * | trans | -134.7 | 108.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 3 | T | 50.1 | Low | 53.5 | Low | 137 Ų | 137 | 131.3 Ų | 131.3 | 84% | 0.84 | 69% | 0.685 | S | S | * | * | trans | 55.1 | 102.9 | 144.7 | 56.2 | 0 | 0 | 0 | 0 | 119 | N5 | T3-N5 PolarHBondContact O-N 3.35Š| ||
| 4 | E | 51.2 | Low | 53.7 | Low | 178 Ų | 178 | 129.9 Ų | 129.9 | 83% | 0.832 | 68% | 0.678 | S | S | * | * | trans | -49.7 | 128 | 152.2 | -71.9 | -178.3 | 123 | 0 | 0 | 112 | N6 | E4-N6 PolarHBondContact O-N 3.38Š| ||
| 5 | N | 48.9 | Very low | 54.1 | Low | 130 Ų | 130 | 128.5 Ų | 128.5 | 70% | 0.695 | 67% | 0.67 | S | S | * | * | 50.3 | 68.4 | 130 | -59.5 | -28.5 | 0 | 0 | 0 | 118.3 | T3 | T3-N5 PolarHBondContact O-N 3.35Š| |||
| 6 | N | 52.5 | Low | 54.4 | Low | 97 Ų | 97 | 125 Ų | 125 | 52% | 0.519 | 66% | 0.66 | S | S | . | * | trans | -103.1 | 92.6 | 150.8 | -155.9 | -18.5 | 0 | 0 | 0 | 109.4 | E4 N8 I11 | E4-N6 PolarHBondContact O-N 3.38Å; N6-N8 PolarHBondContact O-N 3.05Å; N6-N8 VanDerWaalsContact O-N 3.14Å; N6-I11 WeakPolarHBondContact ND2-CD1 3.47Å | ||
| 7 | K | 57.6 | Low | 54.5 | Low | 191 Ų | 191 | 119.8 Ų | 119.8 | 83% | 0.83 | 63% | 0.634 | S | S | * | * | trans | -69.7 | 1.6 | -176.6 | -72.6 | -178 | 179 | 177.8 | 0 | 114 | P9 | K7-P9 WeakPolarHBondContact O-CD 3.4Š| ||
| 8 | N | 56.5 | Low | 54.7 | Low | 81 Ų | 81 | 116.6 Ų | 116.6 | 43% | 0.433 | 62% | 0.62 | S | S | . | * | trans | -85.8 | 109.6 | -174.7 | -155.7 | -22.6 | 0 | 0 | 0 | 110.9 | N6 A10 I11 R12 | N6-N8 PolarHBondContact O-N 3.05Å; N6-N8 VanDerWaalsContact O-N 3.14Å; N8-A10 PolarHBondContact O-N 3.11Å; N8-I11 HydrophobicContact CB-CB 4.39Å; N8-I11 HydrophobicContact CB-CD1 3.82Å; N8-I11 HydrophobicContact CB-CG1 3.96Å; N8-I11 PolarHBondContact O-N 3.03Å; N8-R12 PolarHBondContact O-N 3.46Å | ||
| 9 | P | 58.9 | Low | 54.7 | Low | 100 Ų | 100 | 113.9 Ų | 113.9 | 65% | 0.649 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -60.7 | -28.9 | -177.3 | 24.9 | -34.3 | 0 | 0 | 0 | 112.3 | K7 I11 R12 F13 | K7-P9 WeakPolarHBondContact O-CD 3.4Å; P9-I11 VanDerWaalsContact C-N 3.3Å; P9-I11 PolarHBondContact O-N 3.48Å; P9-R12 PolarHBondContact O-N 3.03Å; P9-F13 PolarHBondContact O-N 3.28Å |
| 10 | A | 57 | Low | 54.8 | Low | 54 Ų | 54 | 111.7 Ų | 111.7 | 45% | 0.446 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -61.3 | -39.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | N8 F13 L14 | N8-A10 PolarHBondContact O-N 3.11Å; A10-F13 PolarHBondContact O-N 2.95Å; A10-L14 WeakPolarHBondContact O-CB 3.39Å; A10-L14 WeakPolarHBondContact O-CD1 3.4Å; A10-L14 WeakPolarHBondContact O-CG 3.48Å; A10-L14 PolarHBondContact O-N 3.38Å |
| 11 | I | 57.7 | Low | 54.8 | Low | 60 Ų | 60 | 109.2 Ų | 109.2 | 31% | 0.308 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -72.8 | -37.6 | -179.8 | -59.5 | 177.7 | 0 | 0 | 0 | 110.3 | N6 N8 P9 L14 L15 | N6-I11 WeakPolarHBondContact ND2-CD1 3.47Å; N8-I11 HydrophobicContact CB-CB 4.39Å; N8-I11 HydrophobicContact CB-CD1 3.82Å; N8-I11 HydrophobicContact CB-CG1 3.96Å; N8-I11 PolarHBondContact O-N 3.03Å; P9-I11 VanDerWaalsContact C-N 3.3Å; P9-I11 PolarHBondContact O-N 3.48Å; I11-L14 PolarHBondContact O-N 2.99Å; I11-L15 HydrophobicContact CG2-CD1 3.93Å; I11-L15 WeakPolarHBondContact O-CB 3.31Å; I11-L15 WeakPolarHBondContact O-CD1 3.39Å; I11-L15 WeakPolarHBondContact O-CG 3.44Å; I11-L15 PolarHBondContact O-N 3.48Å |
| 12 | R | 57 | Low | 55.8 | Low | 190 Ų | 190 | 102.3 Ų | 102.3 | 72% | 0.717 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -66.1 | -40.2 | 174.1 | -64.7 | -171.2 | 94.6 | -164.6 | 8.6 | 112 | N8 P9 L15 S16 | N8-R12 PolarHBondContact O-N 3.46Å; P9-R12 PolarHBondContact O-N 3.03Å; R12-L15 PolarHBondContact O-N 3.25Å; R12-S16 WeakPolarHBondContact O-CB 3.46Å; R12-S16 PolarHBondContact O-N 3.1Å |
| 13 | F | 62.7 | Low | 56.3 | Low | 144 Ų | 144 | 99.9 Ų | 99.9 | 63% | 0.632 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -62.4 | -49.1 | 175.6 | -173.5 | -99.7 | 0 | 0 | 0 | 110.7 | P9 A10 L15 S16 V17 | P9-F13 PolarHBondContact O-N 3.28Å; A10-F13 PolarHBondContact O-N 2.95Å; F13-L15 VanDerWaalsContact C-N 3.34Å; F13-L15 PolarHBondContact O-N 3.31Å; F13-S16 PolarHBondContact O-N 3.14Å; F13-S16 VanDerWaalsContact O-N 3.12Å; F13-S16 PolarHBondContact O-OG 3.47Å; F13-V17 HydrophobicContact CD1-CG2 4.12Å; F13-V17 HydrophobicContact CE1-CG2 3.8Å; F13-V17 HydrophobicContact CE2-CG2 4.42Å; F13-V17 HydrophobicContact CZ-CG2 3.97Å; F13-V17 VanDerWaalsContact O-CG2 3.31Å; F13-V17 WeakPolarHBondContact O-CG2 3.24Å; F13-V17 PolarHBondContact O-N 3.16Å |
| 14 | L | 57.3 | Low | 56.7 | Low | 111 Ų | 111 | 98.6 Ų | 98.6 | 58% | 0.581 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -56.2 | -45 | 174.8 | -81 | 162.2 | 0 | 0 | 0 | 112.2 | A10 I11 V17 V18 | A10-L14 WeakPolarHBondContact O-CB 3.39Å; A10-L14 WeakPolarHBondContact O-CD1 3.4Å; A10-L14 WeakPolarHBondContact O-CG 3.48Å; A10-L14 PolarHBondContact O-N 3.38Å; I11-L14 PolarHBondContact O-N 2.99Å; L14-V17 PolarHBondContact O-N 3.05Å; L14-V18 WeakPolarHBondContact O-CB 3.49Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 3.16Å |
| 15 | L | 58.7 | Low | 57.1 | Low | 109 Ų | 109 | 94.2 Ų | 94.2 | 57% | 0.571 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.1 | -39.7 | 175.7 | -82.1 | 158.5 | 0 | 0 | 0 | 112.7 | I11 R12 F13 V17 V18 G19 | I11-L15 HydrophobicContact CG2-CD1 3.93Å; I11-L15 WeakPolarHBondContact O-CB 3.31Å; I11-L15 WeakPolarHBondContact O-CD1 3.39Å; I11-L15 WeakPolarHBondContact O-CG 3.44Å; I11-L15 PolarHBondContact O-N 3.48Å; R12-L15 PolarHBondContact O-N 3.25Å; F13-L15 VanDerWaalsContact C-N 3.34Å; F13-L15 PolarHBondContact O-N 3.31Å; L15-V17 VanDerWaalsContact C-N 3.34Å; L15-V18 PolarHBondContact O-N 3.03Å; L15-G19 PolarHBondContact O-N 3.32Å |
| 16 | S | 58.8 | Low | 57.7 | Low | 73 Ų | 73 | 91.6 Ų | 91.6 | 51% | 0.51 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.9 | -37.7 | 178.6 | 85.8 | 0 | 0 | 0 | 0 | 112.1 | R12 F13 S20 | R12-S16 WeakPolarHBondContact O-CB 3.46Å; R12-S16 PolarHBondContact O-N 3.1Å; F13-S16 PolarHBondContact O-N 3.14Å; F13-S16 VanDerWaalsContact O-N 3.12Å; F13-S16 PolarHBondContact O-OG 3.47Å; S16-S20 PolarHBondContact O-N 3.41Å |
| 17 | V | 57.3 | Low | 58.2 | Low | 36 Ų | 36 | 89.4 Ų | 89.4 | 22% | 0.218 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -70.8 | -41.1 | 178.5 | 174.3 | 0 | 0 | 0 | 0 | 110.2 | F13 L14 L15 S20 I26 | F13-V17 HydrophobicContact CD1-CG2 4.12Å; F13-V17 HydrophobicContact CE1-CG2 3.8Å; F13-V17 HydrophobicContact CE2-CG2 4.42Å; F13-V17 HydrophobicContact CZ-CG2 3.97Å; F13-V17 VanDerWaalsContact O-CG2 3.31Å; F13-V17 WeakPolarHBondContact O-CG2 3.24Å; F13-V17 PolarHBondContact O-N 3.16Å; L14-V17 PolarHBondContact O-N 3.05Å; L15-V17 VanDerWaalsContact C-N 3.34Å; V17-S20 PolarHBondContact O-N 3.29Å; V17-S20 PolarHBondContact O-OG 3.43Å; V17-I26 HydrophobicContact CG1-CD1 3.45Å; V17-I26 VanDerWaalsContact CG1-CD1 3.45Å; V17-I26 HydrophobicContact CG1-CG2 4.32Å |
| 18 | V | 57.9 | Low | 58.3 | Low | 62 Ų | 62 | 84.5 Ų | 84.5 | 38% | 0.376 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.9 | -37.7 | 177.3 | 173.1 | 0 | 0 | 0 | 0 | 112.1 | L14 L15 S20 S23 | L14-V18 WeakPolarHBondContact O-CB 3.49Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 3.16Å; L15-V18 PolarHBondContact O-N 3.03Å; V18-S20 VanDerWaalsContact C-N 3.33Å; V18-S20 PolarHBondContact O-N 3.15Å; V18-S23 VanDerWaalsContact O-CB 3.27Å; V18-S23 WeakPolarHBondContact O-CB 3.39Å; V18-S23 PolarHBondContact O-OG 2.89Å; V18-S23 VanDerWaalsContact O-OG 3.05Å |
| 19 | G | 54.8 | Low | 58.7 | Low | 67 Ų | 67 | 82.5 Ų | 82.5 | 69% | 0.691 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -74.7 | -13.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | L15 G21 | L15-G19 PolarHBondContact O-N 3.32Å; G19-G21 VanDerWaalsContact C-N 3.28Å; G19-G21 PolarHBondContact O-N 3.06Å |
| 20 | S | 56.6 | Low | 59 | Low | 69 Ų | 69 | 82.5 Ų | 82.5 | 48% | 0.483 | 49% | 0.488 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | 1.9 | -173.2 | 68.9 | 0 | 0 | 0 | 0 | 115.8 | S16 V17 V18 N22 | S16-S20 PolarHBondContact O-N 3.41Å; V17-S20 PolarHBondContact O-N 3.29Å; V17-S20 PolarHBondContact O-OG 3.43Å; V18-S20 VanDerWaalsContact C-N 3.33Å; V18-S20 PolarHBondContact O-N 3.15Å; S20-N22 PolarHBondContact O-N 3.16Å |
| 21 | G | 55.5 | Low | 59.2 | Low | 60 Ų | 60 | 84.1 Ų | 84.1 | 62% | 0.619 | 48% | 0.484 | S | S | * | . | S | Bend | trans | 70.4 | -19.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | G19 S23 | G19-G21 VanDerWaalsContact C-N 3.28Å; G19-G21 PolarHBondContact O-N 3.06Å; G21-S23 PolarHBondContact O-N 3.5Å |
| 22 | N | 58.3 | Low | 59.5 | Low | 109 Ų | 109 | 86.7 Ų | 86.7 | 58% | 0.583 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.5 | -0.4 | 169.8 | -80.8 | 6.6 | 0 | 0 | 0 | 113.5 | S20 L24 S25 I26 | S20-N22 PolarHBondContact O-N 3.16Å; N22-L24 PolarHBondContact O-N 2.91Å; N22-L24 VanDerWaalsContact O-N 3.16Å; N22-S25 WeakPolarHBondContact O-CB 3.49Å; N22-S25 PolarHBondContact O-N 3.16Å; N22-I26 HydrophobicContact CB-CD1 4.48Å; N22-I26 WeakPolarHBondContact O-CG1 3.42Å; N22-I26 PolarHBondContact O-N 3.44Å |
| 23 | S | 58.2 | Low | 59.6 | Low | 40 Ų | 40 | 80 Ų | 80 | 28% | 0.28 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.1 | -28.8 | -177.1 | 53.8 | 0 | 0 | 0 | 0 | 113.5 | V18 G21 L27 | V18-S23 VanDerWaalsContact O-CB 3.27Å; V18-S23 WeakPolarHBondContact O-CB 3.39Å; V18-S23 PolarHBondContact O-OG 2.89Å; V18-S23 VanDerWaalsContact O-OG 3.05Å; G21-S23 PolarHBondContact O-N 3.5Å; S23-L27 WeakPolarHBondContact O-CB 3.49Å; S23-L27 PolarHBondContact O-N 3.35Å |
| 24 | L | 58.3 | Low | 59.6 | Low | 110 Ų | 110 | 74.9 Ų | 74.9 | 58% | 0.576 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -70.9 | -38.3 | 175.1 | -158.6 | 73.3 | 0 | 0 | 0 | 112.4 | N22 N28 | N22-L24 PolarHBondContact O-N 2.91Å; N22-L24 VanDerWaalsContact O-N 3.16Å; L24-N28 VanDerWaalsContact O-CB 3.27Å; L24-N28 WeakPolarHBondContact O-CB 3.49Å; L24-N28 PolarHBondContact O-N 3.02Å; L24-N28 PolarHBondContact O-ND2 2.81Å |
| 25 | S | 58.7 | Low | 59.9 | Low | 86 Ų | 86 | 75.3 Ų | 75.3 | 60% | 0.601 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -69.4 | -39.7 | 177.1 | -167.4 | 0 | 0 | 0 | 0 | 111.1 | N22 N28 G29 | N22-S25 WeakPolarHBondContact O-CB 3.49Å; N22-S25 PolarHBondContact O-N 3.16Å; S25-N28 PolarHBondContact O-N 3.49Å; S25-G29 PolarHBondContact O-N 3.1Å |
| 26 | I | 62 | Low | 60 | Low | 74 Ų | 74 | 74 Ų | 74 | 38% | 0.379 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -68.6 | -41.4 | 177.3 | -62.4 | 170.1 | 0 | 0 | 0 | 110.2 | V17 N22 G29 L30 | V17-I26 HydrophobicContact CG1-CD1 3.45Å; V17-I26 VanDerWaalsContact CG1-CD1 3.45Å; V17-I26 HydrophobicContact CG1-CG2 4.32Å; N22-I26 HydrophobicContact CB-CD1 4.48Å; N22-I26 WeakPolarHBondContact O-CG1 3.42Å; N22-I26 PolarHBondContact O-N 3.44Å; I26-G29 PolarHBondContact O-N 2.89Å; I26-L30 HydrophobicContact CG2-CD1 4.01Å; I26-L30 WeakPolarHBondContact O-CB 3.17Å; I26-L30 WeakPolarHBondContact O-CG 3.48Å; I26-L30 PolarHBondContact O-N 3.46Å |
| 27 | L | 62.6 | Low | 60.2 | Low | 51 Ų | 51 | 75.7 Ų | 75.7 | 27% | 0.267 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.5 | -40.8 | 175.7 | -163 | 80.8 | 0 | 0 | 0 | 111.9 | S23 F31 L91 | S23-L27 WeakPolarHBondContact O-CB 3.49Å; S23-L27 PolarHBondContact O-N 3.35Å; L27-F31 VanDerWaalsContact O-CB 3.31Å; L27-F31 WeakPolarHBondContact O-CB 3.2Å; L27-F31 PolarHBondContact O-N 3.33Å; L27-L91 HydrophobicContact CD1-CD2 3.94Å |
| 28 | N | 60.7 | Low | 60.4 | Low | 88 Ų | 88 | 77.7 Ų | 77.7 | 47% | 0.471 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -67 | -39.9 | 175.5 | -75.8 | -16 | 0 | 0 | 0 | 111.7 | L24 S25 F31 L32 | L24-N28 VanDerWaalsContact O-CB 3.27Å; L24-N28 WeakPolarHBondContact O-CB 3.49Å; L24-N28 PolarHBondContact O-N 3.02Å; L24-N28 PolarHBondContact O-ND2 2.81Å; S25-N28 PolarHBondContact O-N 3.49Å; N28-F31 PolarHBondContact O-N 3.36Å; N28-L32 WeakPolarHBondContact O-CB 3.49Å; N28-L32 PolarHBondContact O-N 3.48Å |
| 29 | G | 64.1 | Low | 60.5 | Low | 39 Ų | 39 | 77.3 Ų | 77.3 | 40% | 0.402 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.3 | -47.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112 | S25 I26 F31 L32 S33 | S25-G29 PolarHBondContact O-N 3.1Å; I26-G29 PolarHBondContact O-N 2.89Å; G29-F31 VanDerWaalsContact C-N 3.3Å; G29-F31 PolarHBondContact O-N 3.45Å; G29-L32 PolarHBondContact O-N 2.96Å; G29-S33 PolarHBondContact O-N 3.24Å; G29-S33 PolarHBondContact O-OG 3.44Å; G29-S33 VanDerWaalsContact O-OG 3.13Å |
| 30 | L | 65 | Low | 60.8 | Low | 101 Ų | 101 | 77.6 Ų | 77.6 | 53% | 0.529 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -60.5 | -39.5 | 174.9 | -78.6 | 166.2 | 0 | 0 | 0 | 112.1 | I26 S33 F34 | I26-L30 HydrophobicContact CG2-CD1 4.01Å; I26-L30 WeakPolarHBondContact O-CB 3.17Å; I26-L30 WeakPolarHBondContact O-CG 3.48Å; I26-L30 PolarHBondContact O-N 3.46Å; L30-S33 VanDerWaalsContact C-OG 3.31Å; L30-S33 VanDerWaalsContact CA-OG 3.25Å; L30-S33 WeakPolarHBondContact CA-OG 3.27Å; L30-S33 PolarHBondContact O-OG 3.02Å; L30-F34 VanDerWaalsContact O-CB 3.28Å; L30-F34 WeakPolarHBondContact O-CB 3.45Å; L30-F34 PolarHBondContact O-N 3.3Å |
| 31 | F | 62.4 | Low | 61 | Low | 87 Ų | 87 | 76.4 Ų | 76.4 | 38% | 0.382 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -67.8 | -38.1 | 176.8 | -173.1 | -105 | 0 | 0 | 0 | 112.2 | L27 N28 G29 F34 K35 | L27-F31 VanDerWaalsContact O-CB 3.31Å; L27-F31 WeakPolarHBondContact O-CB 3.2Å; L27-F31 PolarHBondContact O-N 3.33Å; N28-F31 PolarHBondContact O-N 3.36Å; G29-F31 VanDerWaalsContact C-N 3.3Å; G29-F31 PolarHBondContact O-N 3.45Å; F31-F34 PolarHBondContact O-N 3.5Å; F31-K35 HydrophobicContact CD1-CD 4.37Å; F31-K35 HydrophobicContact CE1-CD 3.89Å; F31-K35 HydrophobicContact CE1-CG 4.32Å; F31-K35 HydrophobicContact CZ-CD 4.42Å; F31-K35 PolarHBondContact O-N 3.42Å |
| 32 | L | 63.5 | Low | 61.1 | Low | 115 Ų | 115 | 76.2 Ų | 76.2 | 60% | 0.602 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -69.1 | -41.9 | 176.1 | -171.2 | 65.7 | 0 | 0 | 0 | 111.7 | N28 G29 F34 K35 T36 | N28-L32 WeakPolarHBondContact O-CB 3.49Å; N28-L32 PolarHBondContact O-N 3.48Å; G29-L32 PolarHBondContact O-N 2.96Å; L32-F34 VanDerWaalsContact C-N 3.28Å; L32-F34 PolarHBondContact O-N 3.38Å; L32-K35 PolarHBondContact O-N 3.43Å; L32-T36 PolarHBondContact O-N 2.98Å; L32-T36 PolarHBondContact O-OG1 3.38Å |
| 33 | S | 58.7 | Low | 61.1 | Low | 48 Ų | 48 | 73.6 Ų | 73.6 | 34% | 0.336 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.7 | -37.3 | 172.8 | 52.5 | 0 | 0 | 0 | 0 | 111.6 | G29 L30 T36 I37 | G29-S33 PolarHBondContact O-N 3.24Å; G29-S33 PolarHBondContact O-OG 3.44Å; G29-S33 VanDerWaalsContact O-OG 3.13Å; L30-S33 VanDerWaalsContact C-OG 3.31Å; L30-S33 VanDerWaalsContact CA-OG 3.25Å; L30-S33 WeakPolarHBondContact CA-OG 3.27Å; L30-S33 PolarHBondContact O-OG 3.02Å; S33-T36 VanDerWaalsContact CA-OG1 3.23Å; S33-T36 WeakPolarHBondContact CA-OG1 3.33Å; S33-T36 PolarHBondContact O-N 3.12Å; S33-T36 PolarHBondContact O-OG1 2.9Å; S33-I37 WeakPolarHBondContact O-CB 3.21Å; S33-I37 WeakPolarHBondContact O-CD1 3.48Å; S33-I37 WeakPolarHBondContact O-CG1 3.33Å; S33-I37 PolarHBondContact O-N 2.79Å |
| 34 | F | 63.2 | Low | 61.2 | Low | 38 Ų | 38 | 75 Ų | 75 | 17% | 0.167 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -67.1 | -42.7 | 176.3 | -170.8 | -96.1 | 0 | 0 | 0 | 112 | L30 F31 L32 T36 I37 L38 M84 L87 | L30-F34 VanDerWaalsContact O-CB 3.28Å; L30-F34 WeakPolarHBondContact O-CB 3.45Å; L30-F34 PolarHBondContact O-N 3.3Å; F31-F34 PolarHBondContact O-N 3.5Å; L32-F34 VanDerWaalsContact C-N 3.28Å; L32-F34 PolarHBondContact O-N 3.38Å; F34-T36 VanDerWaalsContact C-N 3.34Å; F34-T36 PolarHBondContact O-N 2.88Å; F34-I37 PolarHBondContact O-N 3.47Å; F34-L38 VanDerWaalsContact O-CB 3.28Å; F34-L38 WeakPolarHBondContact O-CB 3.38Å; F34-L38 PolarHBondContact O-N 2.72Å; F34-M84 HydrophobicContact CD1-CE 4.09Å; F34-M84 HydrophobicContact CD1-SD 4.49Å; F34-M84 HydrophobicContact CD2-CE 3.76Å; F34-M84 HydrophobicContact CE1-CE 3.51Å; F34-M84 HydrophobicContact CE1-SD 3.46Å; F34-M84 WeakPolarHBondContact CE1-SD 3.18Å; F34-M84 HydrophobicContact CE2-CE 3.13Å; F34-M84 HydrophobicContact CE2-SD 3.87Å; F34-M84 HydrophobicContact CG-CE 4.22Å; F34-M84 HydrophobicContact CZ-CB 4.48Å; F34-M84 HydrophobicContact CZ-CE 3.04Å; F34-M84 HydrophobicContact CZ-CG 4.2Å; F34-M84 HydrophobicContact CZ-SD 3.12Å; F34-M84 WeakPolarHBondContact CZ-SD 3.45Å; F34-L87 HydrophobicContact CD2-CD1 4.35Å; F34-L87 HydrophobicContact CE2-CB 3.91Å; F34-L87 HydrophobicContact CE2-CD1 3.64Å; F34-L87 HydrophobicContact CE2-CG 4.41Å; F34-L87 HydrophobicContact CZ-CB 4.26Å |
| 35 | K | 62.3 | Low | 61 | Low | 119 Ų | 119 | 72.7 Ų | 72.7 | 52% | 0.517 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.2 | -41.1 | 174.2 | -85.1 | -171.3 | 166.9 | -173.4 | 0 | 112.6 | F31 L32 L38 A39 | F31-K35 HydrophobicContact CD1-CD 4.37Å; F31-K35 HydrophobicContact CE1-CD 3.89Å; F31-K35 HydrophobicContact CE1-CG 4.32Å; F31-K35 HydrophobicContact CZ-CD 4.42Å; F31-K35 PolarHBondContact O-N 3.42Å; L32-K35 PolarHBondContact O-N 3.43Å; K35-L38 PolarHBondContact O-N 3.32Å; K35-A39 WeakPolarHBondContact O-CB 3.41Å; K35-A39 PolarHBondContact O-N 2.93Å |
| 36 | T | 62.2 | Low | 61 | Low | 83 Ų | 83 | 74.3 Ų | 74.3 | 51% | 0.509 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -69.6 | -40.8 | 179.1 | 43 | 0 | 0 | 0 | 0 | 111.7 | L32 S33 F34 A39 S40 | L32-T36 PolarHBondContact O-N 2.98Å; L32-T36 PolarHBondContact O-OG1 3.38Å; S33-T36 VanDerWaalsContact CA-OG1 3.23Å; S33-T36 WeakPolarHBondContact CA-OG1 3.33Å; S33-T36 PolarHBondContact O-N 3.12Å; S33-T36 PolarHBondContact O-OG1 2.9Å; F34-T36 VanDerWaalsContact C-N 3.34Å; F34-T36 PolarHBondContact O-N 2.88Å; T36-A39 PolarHBondContact O-N 3.39Å; T36-S40 WeakPolarHBondContact O-CB 3.39Å; T36-S40 PolarHBondContact O-N 3.4Å |
| 37 | I | 62.2 | Low | 60.8 | Low | 107 Ų | 107 | 76.2 Ų | 76.2 | 55% | 0.549 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 173 | -66.9 | 164 | 0 | 0 | 0 | 110.9 | S33 F34 S40 S41 | S33-I37 WeakPolarHBondContact O-CB 3.21Å; S33-I37 WeakPolarHBondContact O-CD1 3.48Å; S33-I37 WeakPolarHBondContact O-CG1 3.33Å; S33-I37 PolarHBondContact O-N 2.79Å; F34-I37 PolarHBondContact O-N 3.47Å; I37-S40 PolarHBondContact O-N 2.93Å; I37-S41 WeakPolarHBondContact O-CB 3.44Å; I37-S41 PolarHBondContact O-N 2.98Å |
| 38 | L | 61 | Low | 60.6 | Low | 79 Ų | 79 | 78 Ų | 78 | 41% | 0.414 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -66.3 | -42.6 | 178 | -176.7 | 55.2 | 0 | 0 | 0 | 111.8 | F34 K35 S41 S42 M84 | F34-L38 VanDerWaalsContact O-CB 3.28Å; F34-L38 WeakPolarHBondContact O-CB 3.38Å; F34-L38 PolarHBondContact O-N 2.72Å; K35-L38 PolarHBondContact O-N 3.32Å; L38-S41 PolarHBondContact O-N 3.3Å; L38-S42 WeakPolarHBondContact O-CB 3.25Å; L38-S42 PolarHBondContact O-N 3.34Å; L38-S42 PolarHBondContact O-OG 3.47Å; L38-M84 HydrophobicContact CB-CE 4.1Å; L38-M84 HydrophobicContact CB-SD 4.41Å; L38-M84 HydrophobicContact CD1-CE 4.14Å; L38-M84 HydrophobicContact CD1-SD 3.66Å; L38-M84 HydrophobicContact CD2-SD 3.97Å; L38-M84 HydrophobicContact CG-SD 4.22Å |
| 39 | A | 59.5 | Low | 60.5 | Low | 53 Ų | 53 | 79 Ų | 79 | 44% | 0.438 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.5 | -43.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | K35 T36 S42 A43 | K35-A39 WeakPolarHBondContact O-CB 3.41Å; K35-A39 PolarHBondContact O-N 2.93Å; T36-A39 PolarHBondContact O-N 3.39Å; A39-S42 WeakPolarHBondContact CA-OG 3.36Å; A39-S42 PolarHBondContact O-N 3.1Å; A39-S42 PolarHBondContact O-OG 3.19Å; A39-A43 WeakPolarHBondContact O-CB 3.33Å; A39-A43 PolarHBondContact O-N 3.46Å |
| 40 | S | 61 | Low | 60.1 | Low | 73 Ų | 73 | 79.2 Ų | 79.2 | 51% | 0.51 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59.8 | -49.2 | 174.1 | -172.2 | 0 | 0 | 0 | 0 | 110.7 | T36 I37 S42 A43 T44 | T36-S40 WeakPolarHBondContact O-CB 3.39Å; T36-S40 PolarHBondContact O-N 3.4Å; I37-S40 PolarHBondContact O-N 2.93Å; S40-S42 VanDerWaalsContact C-N 3.34Å; S40-S42 PolarHBondContact O-N 3.14Å; S40-A43 WeakPolarHBondContact O-CB 3.31Å; S40-A43 PolarHBondContact O-N 2.84Å; S40-A43 VanDerWaalsContact O-N 3.14Å; S40-T44 PolarHBondContact O-N 2.9Å; S40-T44 PolarHBondContact O-OG1 3.05Å |
| 41 | S | 60.9 | Low | 59.7 | Low | 45 Ų | 45 | 78.8 Ų | 78.8 | 32% | 0.315 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -60.4 | -42.5 | 178.9 | -170.9 | 0 | 0 | 0 | 0 | 111.7 | I37 L38 A43 T44 L45 | I37-S41 WeakPolarHBondContact O-CB 3.44Å; I37-S41 PolarHBondContact O-N 2.98Å; L38-S41 PolarHBondContact O-N 3.3Å; S41-A43 PolarHBondContact O-N 3.07Å; S41-T44 PolarHBondContact O-N 3.16Å; S41-L45 WeakPolarHBondContact O-CB 3.45Å; S41-L45 WeakPolarHBondContact O-CG 3.27Å; S41-L45 PolarHBondContact O-N 3.47Å |
| 42 | S | 59.4 | Low | 59.4 | Low | 55 Ų | 55 | 79.3 Ų | 79.3 | 39% | 0.385 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.2 | -36.8 | 175.3 | 64.2 | 0 | 0 | 0 | 0 | 113 | L38 A39 S40 L45 L46 | L38-S42 WeakPolarHBondContact O-CB 3.25Å; L38-S42 PolarHBondContact O-N 3.34Å; L38-S42 PolarHBondContact O-OG 3.47Å; A39-S42 WeakPolarHBondContact CA-OG 3.36Å; A39-S42 PolarHBondContact O-N 3.1Å; A39-S42 PolarHBondContact O-OG 3.19Å; S40-S42 VanDerWaalsContact C-N 3.34Å; S40-S42 PolarHBondContact O-N 3.14Å; S42-L45 PolarHBondContact O-N 2.99Å; S42-L46 WeakPolarHBondContact O-CB 3.47Å; S42-L46 VanDerWaalsContact O-CG 3.29Å; S42-L46 WeakPolarHBondContact O-CG 3.42Å; S42-L46 PolarHBondContact O-N 2.98Å |
| 43 | A | 58.3 | Low | 58.9 | Low | 54 Ų | 54 | 81.1 Ų | 81.1 | 45% | 0.446 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.4 | -41.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | A39 S40 S41 L45 L46 L47 | A39-A43 WeakPolarHBondContact O-CB 3.33Å; A39-A43 PolarHBondContact O-N 3.46Å; S40-A43 WeakPolarHBondContact O-CB 3.31Å; S40-A43 PolarHBondContact O-N 2.84Å; S40-A43 VanDerWaalsContact O-N 3.14Å; S41-A43 PolarHBondContact O-N 3.07Å; A43-L45 VanDerWaalsContact C-N 3.34Å; A43-L46 PolarHBondContact O-N 3Å; A43-L47 WeakPolarHBondContact O-CB 3.23Å; A43-L47 PolarHBondContact O-N 3.37Å |
| 44 | T | 58.8 | Low | 58.5 | Low | 70 Ų | 70 | 85 Ų | 85 | 43% | 0.429 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.7 | -36.5 | 175.7 | -31.7 | 0 | 0 | 0 | 0 | 111.9 | S40 S41 L47 N48 | S40-T44 PolarHBondContact O-N 2.9Å; S40-T44 PolarHBondContact O-OG1 3.05Å; S41-T44 PolarHBondContact O-N 3.16Å; T44-L47 PolarHBondContact O-N 2.86Å; T44-N48 WeakPolarHBondContact O-CB 3.41Å; T44-N48 VanDerWaalsContact O-CG 3.31Å; T44-N48 PolarHBondContact O-N 3.03Å; T44-N48 PolarHBondContact O-ND2 2.93Å |
| 45 | L | 54.2 | Low | 57.9 | Low | 61 Ų | 61 | 90.6 Ų | 90.6 | 32% | 0.319 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.7 | -41.2 | 175.5 | -73.2 | 173.7 | 0 | 0 | 0 | 112.1 | S41 S42 A43 L47 N48 L49 L77 | S41-L45 WeakPolarHBondContact O-CB 3.45Å; S41-L45 WeakPolarHBondContact O-CG 3.27Å; S41-L45 PolarHBondContact O-N 3.47Å; S42-L45 PolarHBondContact O-N 2.99Å; A43-L45 VanDerWaalsContact C-N 3.34Å; L45-L47 VanDerWaalsContact C-N 3.31Å; L45-N48 PolarHBondContact O-N 3.37Å; L45-L49 WeakPolarHBondContact O-CB 3.22Å; L45-L49 WeakPolarHBondContact O-CG 3.47Å; L45-L49 PolarHBondContact O-N 3.44Å; L45-L77 HydrophobicContact CD1-CD2 3.59Å; L45-L77 HydrophobicContact CD2-CD2 3.45Å; L45-L77 VanDerWaalsContact CD2-CD2 3.45Å; L45-L77 HydrophobicContact CD2-CG 4.3Å; L45-L77 HydrophobicContact CG-CD2 4.16Å |
| 46 | L | 59 | Low | 57.1 | Low | 120 Ų | 120 | 90.2 Ų | 90.2 | 63% | 0.628 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -37.6 | 172.5 | -74.1 | 170.9 | 0 | 0 | 0 | 111.5 | S42 A43 A50 | S42-L46 WeakPolarHBondContact O-CB 3.47Å; S42-L46 VanDerWaalsContact O-CG 3.29Å; S42-L46 WeakPolarHBondContact O-CG 3.42Å; S42-L46 PolarHBondContact O-N 2.98Å; A43-L46 PolarHBondContact O-N 3Å; L46-A50 WeakPolarHBondContact O-CB 3.3Å; L46-A50 PolarHBondContact O-N 3.09Å |
| 47 | L | 59 | Low | 56.3 | Low | 114 Ų | 114 | 91.3 Ų | 91.3 | 60% | 0.597 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -67.2 | -42.3 | 176.8 | -139.2 | 118.2 | 0 | 0 | 0 | 111.7 | A43 T44 L45 A50 L51 | A43-L47 WeakPolarHBondContact O-CB 3.23Å; A43-L47 PolarHBondContact O-N 3.37Å; T44-L47 PolarHBondContact O-N 2.86Å; L45-L47 VanDerWaalsContact C-N 3.31Å; L47-A50 PolarHBondContact O-N 3.29Å; L47-L51 HydrophobicContact CD2-CD1 4.33Å; L47-L51 WeakPolarHBondContact O-CB 3.19Å; L47-L51 PolarHBondContact O-N 3.3Å |
| 48 | N | 56.9 | Low | 55.5 | Low | 90 Ų | 90 | 95 Ų | 95 | 48% | 0.481 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -69.1 | -37.5 | 176.8 | -75 | -18 | 0 | 0 | 0 | 112 | T44 L45 V52 | T44-N48 WeakPolarHBondContact O-CB 3.41Å; T44-N48 VanDerWaalsContact O-CG 3.31Å; T44-N48 PolarHBondContact O-N 3.03Å; T44-N48 PolarHBondContact O-ND2 2.93Å; L45-N48 PolarHBondContact O-N 3.37Å; N48-V52 VanDerWaalsContact O-CG2 3.26Å; N48-V52 WeakPolarHBondContact O-CG2 3.28Å; N48-V52 PolarHBondContact O-N 2.89Å |
| 49 | L | 58.3 | Low | 54.6 | Low | 107 Ų | 107 | 100.2 Ų | 100.2 | 56% | 0.56 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -68 | -40.6 | 173.4 | -76.4 | 163.9 | 0 | 0 | 0 | 111.7 | L45 L51 V52 E53 | L45-L49 WeakPolarHBondContact O-CB 3.22Å; L45-L49 WeakPolarHBondContact O-CG 3.47Å; L45-L49 PolarHBondContact O-N 3.44Å; L49-L51 VanDerWaalsContact C-N 3.31Å; L49-L51 PolarHBondContact O-N 2.81Å; L49-V52 PolarHBondContact O-N 3.4Å; L49-E53 PolarHBondContact O-N 3.35Å |
| 50 | A | 56.9 | Low | 53.6 | Low | 45 Ų | 45 | 103.1 Ų | 103.1 | 37% | 0.372 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67.8 | -29.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | L46 L47 N54 | L46-A50 WeakPolarHBondContact O-CB 3.3Å; L46-A50 PolarHBondContact O-N 3.09Å; L47-A50 PolarHBondContact O-N 3.29Å; A50-N54 WeakPolarHBondContact O-CB 3.46Å; A50-N54 PolarHBondContact O-N 3.37Å; A50-N54 VanDerWaalsContact O-N 3.13Å; A50-N54 PolarHBondContact O-ND2 2.92Å |
| 51 | L | 57.1 | Low | 52.6 | Low | 92 Ų | 92 | 110.7 Ų | 110.7 | 48% | 0.482 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -70.9 | -44.4 | 170.7 | -87.4 | 160.9 | 0 | 0 | 0 | 111.5 | L47 L49 E53 N54 E55 | L47-L51 HydrophobicContact CD2-CD1 4.33Å; L47-L51 WeakPolarHBondContact O-CB 3.19Å; L47-L51 PolarHBondContact O-N 3.3Å; L49-L51 VanDerWaalsContact C-N 3.31Å; L49-L51 PolarHBondContact O-N 2.81Å; L51-E53 VanDerWaalsContact C-N 3.34Å; L51-E53 PolarHBondContact O-N 3.13Å; L51-N54 PolarHBondContact O-N 2.89Å; L51-E55 PolarHBondContact O-N 2.86Å |
| 52 | V | 54.2 | Low | 51.7 | Low | 98 Ų | 98 | 115.2 Ų | 115.2 | 59% | 0.594 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -64.1 | -38.5 | 176.5 | 172.5 | 0 | 0 | 0 | 0 | 111.4 | N48 L49 C56 | N48-V52 VanDerWaalsContact O-CG2 3.26Å; N48-V52 WeakPolarHBondContact O-CG2 3.28Å; N48-V52 PolarHBondContact O-N 2.89Å; L49-V52 PolarHBondContact O-N 3.4Å; V52-C56 WeakPolarHBondContact O-CB 3.33Å; V52-C56 PolarHBondContact O-N 3.35Å; V52-C56 VanDerWaalsContact O-N 3.13Å |
| 53 | E | 53.6 | Low | 50.7 | Low | 153 Ų | 153 | 117.7 Ų | 117.7 | 72% | 0.715 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -68.7 | -34.1 | 174.6 | -77.6 | -172.7 | 159.9 | 0 | 0 | 112.8 | L49 L51 | L49-E53 PolarHBondContact O-N 3.35Å; L51-E53 VanDerWaalsContact C-N 3.34Å; L51-E53 PolarHBondContact O-N 3.13Å |
| 54 | N | 50.5 | Low | 50.1 | Low | 128 Ų | 128 | 121.7 Ų | 121.7 | 68% | 0.684 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -73.9 | -30.7 | 175.8 | -93.3 | -71.1 | 0 | 0 | 0 | 113.4 | A50 L51 | A50-N54 WeakPolarHBondContact O-CB 3.46Å; A50-N54 PolarHBondContact O-N 3.37Å; A50-N54 VanDerWaalsContact O-N 3.13Å; A50-N54 PolarHBondContact O-ND2 2.92Å; L51-N54 PolarHBondContact O-N 2.89Å |
| 55 | E | 51.6 | Low | 49.4 | Very low | 156 Ų | 156 | 122.4 Ų | 122.4 | 73% | 0.729 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -81.7 | -19.3 | 176.1 | -70.1 | -158.5 | 153.8 | 0 | 0 | 113.4 | L51 S57 | L51-E55 PolarHBondContact O-N 2.86Å; E55-S57 VanDerWaalsContact C-N 3.27Å; E55-S57 PolarHBondContact O-N 3.22Å |
| 56 | C | 43.8 | Very low | 48.9 | Very low | 111 Ų | 111 | 127 Ų | 127 | 75% | 0.75 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | -4.8 | -179.9 | -156.3 | 0 | 0 | 0 | 0 | 114.2 | V52 | V52-C56 WeakPolarHBondContact O-CB 3.33Å; V52-C56 PolarHBondContact O-N 3.35Å; V52-C56 VanDerWaalsContact O-N 3.13Å |
| 57 | S | 47.2 | Very low | 47.9 | Very low | 107 Ų | 107 | 125.2 Ų | 125.2 | 75% | 0.748 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | 7.2 | 178.2 | -172.3 | 0 | 0 | 0 | 0 | 114 | E55 | E55-S57 VanDerWaalsContact C-N 3.27Å; E55-S57 PolarHBondContact O-N 3.22Å |
| 58 | K | 45.4 | Very low | 47.2 | Very low | 183 Ų | 183 | 123.8 Ų | 123.8 | 80% | 0.796 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -117.2 | 122.7 | 171.9 | -73.1 | -177.5 | -179 | 173.7 | 0 | 110.2 | ||
| 59 | E | 40.2 | Very low | 46.5 | Very low | 189 Ų | 189 | 127.5 Ų | 127.5 | 88% | 0.883 | 72% | 0.718 | S | S | * | * | trans | -42.3 | 155.9 | -175.8 | -95.1 | -167.8 | 138.9 | 0 | 0 | 117.3 | R61 | E59-R61 PolarHBondContact O-N 3.29Š| ||
| 60 | P | 39.4 | Very low | 45.6 | Very low | 115 Ų | 115 | 125.6 Ų | 125.6 | 75% | 0.747 | 72% | 0.724 | S | S | * | * | trans | -82.1 | 117.8 | -159.7 | 33.5 | -32.5 | 0 | 0 | 0 | 111.2 | ||||
| 61 | R | 39.9 | Very low | 45 | Very low | 231 Ų | 231 | 129.2 Ų | 129.2 | 87% | 0.872 | 74% | 0.741 | S | S | * | * | trans | -132.8 | 125.7 | 161.4 | -65.7 | -164.6 | 175.1 | -177.3 | 0.6 | 108.6 | E59 | E59-R61 PolarHBondContact O-N 3.29Š| ||
| 62 | T | 41.2 | Very low | 44.3 | Very low | 140 Ų | 140 | 131 Ų | 131 | 86% | 0.859 | 76% | 0.756 | S | S | * | * | trans | 66.5 | 74.3 | 163.4 | 64.2 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 63 | S | 38.8 | Very low | 43.7 | Very low | 108 Ų | 108 | 134.8 Ų | 134.8 | 76% | 0.755 | 77% | 0.765 | S | S | * | * | trans | -111 | 62.2 | 176.6 | 48.4 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 64 | T | 47.4 | Very low | 43.2 | Very low | 137 Ų | 137 | 130.4 Ų | 130.4 | 84% | 0.84 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -125.1 | 5.4 | 171.6 | 47.2 | 0 | 0 | 0 | 0 | 114.6 | ||
| 65 | A | 42.4 | Very low | 43 | Very low | 85 Ų | 85 | 128.2 Ų | 128.2 | 70% | 0.702 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -113.3 | -8.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 66 | L | 43.3 | Very low | 43.1 | Very low | 159 Ų | 159 | 125 Ų | 125 | 83% | 0.832 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -107.3 | -11.9 | -179.5 | -117.8 | 84.6 | 0 | 0 | 0 | 114.7 | A68 | L66-A68 VanDerWaalsContact C-N 3.29Å; L66-A68 PolarHBondContact O-N 3.22Å |
| 67 | A | 39.2 | Very low | 43.4 | Very low | 81 Ų | 81 | 123.1 Ų | 123.1 | 67% | 0.669 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | -5.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 68 | A | 43.3 | Very low | 43.7 | Very low | 84 Ų | 84 | 122.3 Ų | 122.3 | 69% | 0.694 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.8 | -9.7 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | L66 G70 | L66-A68 VanDerWaalsContact C-N 3.29Å; L66-A68 PolarHBondContact O-N 3.22Å; A68-G70 VanDerWaalsContact C-N 3.28Å |
| 69 | E | 42.9 | Very low | 44.2 | Very low | 168 Ų | 168 | 117 Ų | 117 | 79% | 0.785 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -85.9 | -3 | 167.9 | -63.4 | -163.4 | 157.7 | 0 | 0 | 112.5 | ||
| 70 | G | 39.9 | Very low | 45 | Very low | 67 Ų | 67 | 110.1 Ų | 110.1 | 69% | 0.691 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -92 | 11.6 | -173.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | A68 | A68-G70 VanDerWaalsContact C-N 3.28Š|
| 71 | V | 42.8 | Very low | 46.2 | Very low | 121 Ų | 121 | 109 Ų | 109 | 73% | 0.733 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -109.2 | -11.9 | -171 | -176 | 0 | 0 | 0 | 0 | 114.7 | ||
| 72 | T | 43 | Very low | 47.3 | Very low | 130 Ų | 130 | 102.9 Ų | 102.9 | 80% | 0.798 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -147.5 | 7 | -177 | 45.2 | 0 | 0 | 0 | 0 | 117.4 | G74 | T72-G74 PolarHBondContact O-N 3.38Š|
| 73 | F | 41 | Very low | 48.5 | Very low | 177 Ų | 177 | 101 Ų | 101 | 78% | 0.776 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -91.3 | 95.1 | 163.3 | -81.8 | -85.9 | 0 | 0 | 0 | 108.8 | N75 | F73-N75 VanDerWaalsContact C-N 3.31Å; F73-N75 PolarHBondContact O-N 3.37Å |
| 74 | G | 43.9 | Very low | 49.7 | Very low | 61 Ų | 61 | 98 Ų | 98 | 63% | 0.629 | 60% | 0.6 | S | S | * | * | trans | -49.1 | 99.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | T72 | T72-G74 PolarHBondContact O-N 3.38Š| ||
| 75 | N | 47.3 | Very low | 50.8 | Low | 83 Ų | 83 | 98 Ų | 98 | 44% | 0.444 | 59% | 0.585 | S | S | . | * | trans | -13 | 108.1 | -169.1 | -155.3 | -9.6 | 0 | 0 | 0 | 112.9 | F73 L77 V78 T79 | F73-N75 VanDerWaalsContact C-N 3.31Å; F73-N75 PolarHBondContact O-N 3.37Å; N75-L77 CarbonylContact O-C 3.6Å; N75-L77 PolarHBondContact O-N 2.87Å; N75-V78 HydrophobicContact CB-CB 4.08Å; N75-V78 HydrophobicContact CB-CG2 3.73Å; N75-V78 WeakPolarHBondContact O-CA 3.42Å; N75-V78 PolarHBondContact O-N 3.09Å; N75-T79 PolarHBondContact O-N 3.27Å; N75-T79 VanDerWaalsContact O-N 3.13Å; N75-T79 PolarHBondContact O-OG1 3.4Å | ||
| 76 | P | 52.4 | Low | 52 | Low | 88 Ų | 88 | 97.1 Ų | 97.1 | 57% | 0.571 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -55.9 | -22.8 | -178.7 | 20.6 | -31.1 | 0 | 0 | 0 | 112.3 | T79 S80 | P76-T79 VanDerWaalsContact CA-OG1 3.29Å; P76-T79 WeakPolarHBondContact CA-OG1 3.45Å; P76-T79 PolarHBondContact O-OG1 2.89Å; P76-S80 WeakPolarHBondContact O-CB 3.32Å; P76-S80 PolarHBondContact O-N 3.01Å; P76-S80 PolarHBondContact O-OG 3.14Å |
| 77 | L | 51.4 | Low | 53.2 | Low | 72 Ų | 72 | 93 Ų | 93 | 38% | 0.377 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.2 | -44.1 | 168.9 | -78 | 164 | 0 | 0 | 0 | 113.6 | L45 N75 S80 L81 | L45-L77 HydrophobicContact CD1-CD2 3.59Å; L45-L77 HydrophobicContact CD2-CD2 3.45Å; L45-L77 VanDerWaalsContact CD2-CD2 3.45Å; L45-L77 HydrophobicContact CD2-CG 4.3Å; L45-L77 HydrophobicContact CG-CD2 4.16Å; N75-L77 CarbonylContact O-C 3.6Å; N75-L77 PolarHBondContact O-N 2.87Å; L77-S80 WeakPolarHBondContact CA-OG 3.22Å; L77-S80 PolarHBondContact O-OG 2.94Å; L77-L81 WeakPolarHBondContact O-CB 3.33Å; L77-L81 PolarHBondContact O-N 2.86Å |
| 78 | V | 52.2 | Low | 54.6 | Low | 89 Ų | 89 | 94.2 Ų | 94.2 | 54% | 0.539 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -74.5 | -38.6 | -179 | 178 | 0 | 0 | 0 | 0 | 110.9 | N75 N82 | N75-V78 HydrophobicContact CB-CB 4.08Å; N75-V78 HydrophobicContact CB-CG2 3.73Å; N75-V78 WeakPolarHBondContact O-CA 3.42Å; N75-V78 PolarHBondContact O-N 3.09Å; V78-N82 VanDerWaalsContact O-CB 3.25Å; V78-N82 WeakPolarHBondContact O-CB 3.37Å; V78-N82 PolarHBondContact O-N 3.44Å |
| 79 | T | 56.6 | Low | 55.8 | Low | 73 Ų | 73 | 97.9 Ų | 97.9 | 45% | 0.448 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67 | -42.2 | 174.4 | 43.5 | 0 | 0 | 0 | 0 | 111.4 | N75 P76 N82 I83 | N75-T79 PolarHBondContact O-N 3.27Å; N75-T79 VanDerWaalsContact O-N 3.13Å; N75-T79 PolarHBondContact O-OG1 3.4Å; P76-T79 VanDerWaalsContact CA-OG1 3.29Å; P76-T79 WeakPolarHBondContact CA-OG1 3.45Å; P76-T79 PolarHBondContact O-OG1 2.89Å; T79-N82 PolarHBondContact O-N 3.31Å; T79-I83 WeakPolarHBondContact O-CD1 3.46Å; T79-I83 WeakPolarHBondContact O-CG1 3.12Å; T79-I83 PolarHBondContact O-N 3.39Å |
| 80 | S | 57.7 | Low | 57.3 | Low | 43 Ų | 43 | 94.8 Ų | 94.8 | 30% | 0.301 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66 | -40 | 175.2 | 64.1 | 0 | 0 | 0 | 0 | 113.1 | P76 L77 I83 M84 | P76-S80 WeakPolarHBondContact O-CB 3.32Å; P76-S80 PolarHBondContact O-N 3.01Å; P76-S80 PolarHBondContact O-OG 3.14Å; L77-S80 WeakPolarHBondContact CA-OG 3.22Å; L77-S80 PolarHBondContact O-OG 2.94Å; S80-I83 PolarHBondContact O-N 2.92Å; S80-M84 WeakPolarHBondContact O-CB 3.43Å; S80-M84 WeakPolarHBondContact O-CG 3.36Å; S80-M84 PolarHBondContact O-N 2.94Å |
| 81 | L | 62.9 | Low | 58.6 | Low | 91 Ų | 91 | 94 Ų | 94 | 48% | 0.476 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.8 | -45.6 | 171.5 | -113.4 | 77.9 | 0 | 0 | 0 | 111.2 | L77 I83 M84 Y85 | L77-L81 WeakPolarHBondContact O-CB 3.33Å; L77-L81 PolarHBondContact O-N 2.86Å; L81-I83 VanDerWaalsContact C-N 3.31Å; L81-I83 PolarHBondContact O-N 2.95Å; L81-M84 WeakPolarHBondContact O-CB 3.46Å; L81-M84 PolarHBondContact O-N 2.94Å; L81-M84 VanDerWaalsContact O-N 3.16Å; L81-Y85 HydrophobicContact CB-CD2 4.42Å; L81-Y85 HydrophobicContact CB-CE2 4.31Å; L81-Y85 HydrophobicContact CD2-CE2 3.89Å; L81-Y85 HydrophobicContact CG-CE2 4.03Å; L81-Y85 WeakPolarHBondContact O-CD2 3.37Å; L81-Y85 PolarHBondContact O-N 2.96Å |
| 82 | N | 63.8 | Low | 59.8 | Low | 103 Ų | 103 | 92.2 Ų | 92.2 | 55% | 0.551 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.8 | -36.4 | -178 | -162.8 | 28.1 | 0 | 0 | 0 | 111.9 | V78 T79 S86 | V78-N82 VanDerWaalsContact O-CB 3.25Å; V78-N82 WeakPolarHBondContact O-CB 3.37Å; V78-N82 PolarHBondContact O-N 3.44Å; T79-N82 PolarHBondContact O-N 3.31Å; N82-S86 WeakPolarHBondContact O-CB 3.28Å; N82-S86 PolarHBondContact O-N 3.26Å; N82-S86 PolarHBondContact O-OG 3.19Å |
| 83 | I | 66.8 | Low | 60.9 | Low | 101 Ų | 101 | 91.4 Ų | 91.4 | 52% | 0.518 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66 | -43.3 | 172.3 | -65.5 | 161.2 | 0 | 0 | 0 | 110.5 | T79 S80 L81 S86 L87 | T79-I83 WeakPolarHBondContact O-CD1 3.46Å; T79-I83 WeakPolarHBondContact O-CG1 3.12Å; T79-I83 PolarHBondContact O-N 3.39Å; S80-I83 PolarHBondContact O-N 2.92Å; L81-I83 VanDerWaalsContact C-N 3.31Å; L81-I83 PolarHBondContact O-N 2.95Å; I83-S86 PolarHBondContact O-N 3.44Å; I83-L87 HydrophobicContact CG2-CD1 3.85Å; I83-L87 HydrophobicContact CG2-CG 4.41Å; I83-L87 WeakPolarHBondContact O-CB 3.4Å; I83-L87 WeakPolarHBondContact O-CG 3.5Å; I83-L87 PolarHBondContact O-N 2.86Å |
| 84 | M | 64.4 | Low | 62 | Low | 45 Ų | 45 | 85.7 Ų | 85.7 | 22% | 0.222 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -58.2 | -48.8 | 175.4 | -84 | -95.5 | 138.5 | 0 | 0 | 112.2 | F34 L38 S80 L81 L87 F88 | F34-M84 HydrophobicContact CD1-CE 4.09Å; F34-M84 HydrophobicContact CD1-SD 4.49Å; F34-M84 HydrophobicContact CD2-CE 3.76Å; F34-M84 HydrophobicContact CE1-CE 3.51Å; F34-M84 HydrophobicContact CE1-SD 3.46Å; F34-M84 WeakPolarHBondContact CE1-SD 3.18Å; F34-M84 HydrophobicContact CE2-CE 3.13Å; F34-M84 HydrophobicContact CE2-SD 3.87Å; F34-M84 HydrophobicContact CG-CE 4.22Å; F34-M84 HydrophobicContact CZ-CB 4.48Å; F34-M84 HydrophobicContact CZ-CE 3.04Å; F34-M84 HydrophobicContact CZ-CG 4.2Å; F34-M84 HydrophobicContact CZ-SD 3.12Å; F34-M84 WeakPolarHBondContact CZ-SD 3.45Å; L38-M84 HydrophobicContact CB-CE 4.1Å; L38-M84 HydrophobicContact CB-SD 4.41Å; L38-M84 HydrophobicContact CD1-CE 4.14Å; L38-M84 HydrophobicContact CD1-SD 3.66Å; L38-M84 HydrophobicContact CD2-SD 3.97Å; L38-M84 HydrophobicContact CG-SD 4.22Å; S80-M84 WeakPolarHBondContact O-CB 3.43Å; S80-M84 WeakPolarHBondContact O-CG 3.36Å; S80-M84 PolarHBondContact O-N 2.94Å; L81-M84 WeakPolarHBondContact O-CB 3.46Å; L81-M84 PolarHBondContact O-N 2.94Å; L81-M84 VanDerWaalsContact O-N 3.16Å; M84-L87 PolarHBondContact O-N 3.34Å; M84-F88 WeakPolarHBondContact O-CB 3.4Å; M84-F88 PolarHBondContact O-N 2.85Å |
| 85 | Y | 69.2 | Low | 62.6 | Low | 136 Ų | 136 | 90.1 Ų | 90.1 | 53% | 0.533 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62.8 | -43.5 | 176.4 | -76.1 | -65.7 | 0 | 0 | 0 | 111.4 | L81 L87 F88 Y89 | L81-Y85 HydrophobicContact CB-CD2 4.42Å; L81-Y85 HydrophobicContact CB-CE2 4.31Å; L81-Y85 HydrophobicContact CD2-CE2 3.89Å; L81-Y85 HydrophobicContact CG-CE2 4.03Å; L81-Y85 WeakPolarHBondContact O-CD2 3.37Å; L81-Y85 PolarHBondContact O-N 2.96Å; Y85-L87 VanDerWaalsContact C-N 3.33Å; Y85-L87 PolarHBondContact O-N 3.49Å; Y85-F88 PolarHBondContact O-N 3.17Å; Y85-Y89 WeakPolarHBondContact O-CD2 3.18Å; Y85-Y89 PolarHBondContact O-N 3.5Å |
| 86 | S | 68.5 | Low | 63.1 | Low | 67 Ų | 67 | 87.9 Ų | 87.9 | 47% | 0.469 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60.1 | -42.4 | 177.3 | -61.5 | 0 | 0 | 0 | 0 | 112 | N82 I83 Y89 L90 | N82-S86 WeakPolarHBondContact O-CB 3.28Å; N82-S86 PolarHBondContact O-N 3.26Å; N82-S86 PolarHBondContact O-OG 3.19Å; I83-S86 PolarHBondContact O-N 3.44Å; S86-Y89 PolarHBondContact O-N 3.29Å; S86-L90 WeakPolarHBondContact O-CB 3.22Å; S86-L90 PolarHBondContact O-N 2.95Å |
| 87 | L | 67.6 | Low | 63.1 | Low | 72 Ų | 72 | 88.3 Ų | 88.3 | 38% | 0.377 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.7 | -38.5 | 176 | -72.4 | 169.4 | 0 | 0 | 0 | 111.9 | F34 I83 M84 Y85 L90 L91 | F34-L87 HydrophobicContact CD2-CD1 4.35Å; F34-L87 HydrophobicContact CE2-CB 3.91Å; F34-L87 HydrophobicContact CE2-CD1 3.64Å; F34-L87 HydrophobicContact CE2-CG 4.41Å; F34-L87 HydrophobicContact CZ-CB 4.26Å; I83-L87 HydrophobicContact CG2-CD1 3.85Å; I83-L87 HydrophobicContact CG2-CG 4.41Å; I83-L87 WeakPolarHBondContact O-CB 3.4Å; I83-L87 WeakPolarHBondContact O-CG 3.5Å; I83-L87 PolarHBondContact O-N 2.86Å; M84-L87 PolarHBondContact O-N 3.34Å; Y85-L87 VanDerWaalsContact C-N 3.33Å; Y85-L87 PolarHBondContact O-N 3.49Å; L87-L90 PolarHBondContact O-N 2.86Å; L87-L91 WeakPolarHBondContact O-CG 3.39Å; L87-L91 PolarHBondContact O-N 2.84Å |
| 88 | F | 68.4 | Low | 63 | Low | 107 Ų | 107 | 87.9 Ų | 87.9 | 47% | 0.469 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -64.1 | -44.4 | 174.7 | -173.8 | -103.2 | 0 | 0 | 0 | 112.1 | M84 Y85 L90 L91 L92 | M84-F88 WeakPolarHBondContact O-CB 3.4Å; M84-F88 PolarHBondContact O-N 2.85Å; Y85-F88 PolarHBondContact O-N 3.17Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 2.92Å; F88-L91 PolarHBondContact O-N 3.39Å; F88-L92 HydrophobicContact CD1-CD1 3.72Å; F88-L92 HydrophobicContact CD1-CG 4.36Å; F88-L92 HydrophobicContact CE1-CD1 3.35Å; F88-L92 HydrophobicContact CE1-CG 4.08Å; F88-L92 HydrophobicContact CZ-CD1 4.01Å; F88-L92 HydrophobicContact CZ-CG 4.33Å; F88-L92 WeakPolarHBondContact O-CG 3.49Å; F88-L92 PolarHBondContact O-N 3.48Å |
| 89 | Y | 70.1 | Confident | 62.9 | Low | 161 Ų | 161 | 93.4 Ų | 93.4 | 63% | 0.631 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -61.4 | -40.9 | 173.8 | -85.3 | -70.1 | 0 | 0 | 0 | 111.8 | Y85 S86 L92 L93 | Y85-Y89 WeakPolarHBondContact O-CD2 3.18Å; Y85-Y89 PolarHBondContact O-N 3.5Å; S86-Y89 PolarHBondContact O-N 3.29Å; Y89-L92 PolarHBondContact O-N 3.41Å; Y89-L93 WeakPolarHBondContact O-CB 3.33Å; Y89-L93 PolarHBondContact O-N 3.45Å |
| 90 | L | 73.7 | Confident | 62.5 | Low | 103 Ų | 103 | 99 Ų | 99 | 54% | 0.539 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.8 | -41.8 | 176.8 | -168.1 | 68.8 | 0 | 0 | 0 | 111.8 | S86 L87 F88 L93 C94 | S86-L90 WeakPolarHBondContact O-CB 3.22Å; S86-L90 PolarHBondContact O-N 2.95Å; L87-L90 PolarHBondContact O-N 2.86Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 2.92Å; L90-L93 PolarHBondContact O-N 3.35Å; L90-C94 WeakPolarHBondContact O-CB 3.32Å; L90-C94 PolarHBondContact O-N 2.95Å |
| 91 | L | 67 | Low | 62.1 | Low | 50 Ų | 50 | 102.9 Ų | 102.9 | 26% | 0.262 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65 | -40.5 | 176 | -73.4 | 171.9 | 0 | 0 | 0 | 112.4 | L27 L87 F88 C94 R95 | L27-L91 HydrophobicContact CD1-CD2 3.94Å; L87-L91 WeakPolarHBondContact O-CG 3.39Å; L87-L91 PolarHBondContact O-N 2.84Å; F88-L91 PolarHBondContact O-N 3.39Å; L91-C94 PolarHBondContact O-N 3.44Å; L91-R95 PolarHBondContact O-N 2.9Å |
| 92 | L | 68.9 | Low | 61.2 | Low | 85 Ų | 85 | 107 Ų | 107 | 45% | 0.445 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 173.6 | -76.4 | 174.5 | 0 | 0 | 0 | 111.5 | F88 Y89 C94 R95 G96 | F88-L92 HydrophobicContact CD1-CD1 3.72Å; F88-L92 HydrophobicContact CD1-CG 4.36Å; F88-L92 HydrophobicContact CE1-CD1 3.35Å; F88-L92 HydrophobicContact CE1-CG 4.08Å; F88-L92 HydrophobicContact CZ-CD1 4.01Å; F88-L92 HydrophobicContact CZ-CG 4.33Å; F88-L92 WeakPolarHBondContact O-CG 3.49Å; F88-L92 PolarHBondContact O-N 3.48Å; Y89-L92 PolarHBondContact O-N 3.41Å; L92-C94 VanDerWaalsContact C-N 3.35Å; L92-C94 PolarHBondContact O-N 3.43Å; L92-R95 PolarHBondContact O-N 3.41Å; L92-G96 PolarHBondContact O-N 2.83Å |
| 93 | L | 66.3 | Low | 60.5 | Low | 113 Ų | 113 | 105.4 Ų | 105.4 | 59% | 0.592 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.5 | -44 | 176.4 | -155.8 | 86.5 | 0 | 0 | 0 | 110.7 | Y89 L90 R95 G96 L97 | Y89-L93 WeakPolarHBondContact O-CB 3.33Å; Y89-L93 PolarHBondContact O-N 3.45Å; L90-L93 PolarHBondContact O-N 3.35Å; L93-R95 PolarHBondContact O-N 3.35Å; L93-G96 PolarHBondContact O-N 2.83Å; L93-L97 HydrophobicContact CD2-CD1 4.42Å; L93-L97 HydrophobicContact CG-CD1 4.47Å; L93-L97 VanDerWaalsContact O-CG 3.3Å; L93-L97 WeakPolarHBondContact O-CG 3.39Å; L93-L97 PolarHBondContact O-N 2.87Å |
| 94 | C | 62.4 | Low | 59.6 | Low | 56 Ų | 56 | 105.7 Ų | 105.7 | 38% | 0.378 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.5 | -44.6 | 174.4 | -93.2 | 0 | 0 | 0 | 0 | 112.2 | L90 L91 L92 G96 L97 V98 | L90-C94 WeakPolarHBondContact O-CB 3.32Å; L90-C94 PolarHBondContact O-N 2.95Å; L91-C94 PolarHBondContact O-N 3.44Å; L92-C94 VanDerWaalsContact C-N 3.35Å; L92-C94 PolarHBondContact O-N 3.43Å; C94-G96 VanDerWaalsContact C-N 3.29Å; C94-G96 PolarHBondContact O-N 3.16Å; C94-L97 PolarHBondContact O-N 2.92Å; C94-V98 WeakPolarHBondContact O-CB 3.29Å; C94-V98 WeakPolarHBondContact O-CG2 3.19Å; C94-V98 PolarHBondContact O-N 3.19Å |
| 95 | R | 56.8 | Low | 58.7 | Low | 155 Ų | 155 | 107.9 Ų | 107.9 | 59% | 0.585 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.7 | -37.4 | 174.4 | -82.8 | -177.6 | 148.3 | 152.7 | -2.8 | 112.3 | L91 L92 L93 R99 | L91-R95 PolarHBondContact O-N 2.9Å; L92-R95 PolarHBondContact O-N 3.41Å; L93-R95 PolarHBondContact O-N 3.35Å; R95-R99 WeakPolarHBondContact O-CG 3.05Å; R95-R99 PolarHBondContact O-N 3.47Å |
| 96 | G | 57.7 | Low | 57.7 | Low | 36 Ų | 36 | 108.7 Ų | 108.7 | 37% | 0.371 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66 | -42.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113 | L92 L93 C94 R99 R100 | L92-G96 PolarHBondContact O-N 2.83Å; L93-G96 PolarHBondContact O-N 2.83Å; C94-G96 VanDerWaalsContact C-N 3.29Å; C94-G96 PolarHBondContact O-N 3.16Å; G96-R99 PolarHBondContact O-N 3.29Å; G96-R100 PolarHBondContact O-N 2.85Å; G96-R100 VanDerWaalsContact O-N 3.14Å |
| 97 | L | 52.5 | Low | 56.8 | Low | 97 Ų | 97 | 112.9 Ų | 112.9 | 51% | 0.508 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.7 | -41.9 | 177.4 | -70.3 | 171 | 0 | 0 | 0 | 111.8 | L93 C94 R99 R100 E101 | L93-L97 HydrophobicContact CD2-CD1 4.42Å; L93-L97 HydrophobicContact CG-CD1 4.47Å; L93-L97 VanDerWaalsContact O-CG 3.3Å; L93-L97 WeakPolarHBondContact O-CG 3.39Å; L93-L97 PolarHBondContact O-N 2.87Å; C94-L97 PolarHBondContact O-N 2.92Å; L97-R99 PolarHBondContact O-N 2.95Å; L97-R100 PolarHBondContact O-N 2.89Å; L97-R100 VanDerWaalsContact O-N 3.09Å; L97-E101 PolarHBondContact O-N 2.96Å |
| 98 | V | 49.3 | Very low | 56 | Low | 63 Ų | 63 | 113.7 Ų | 113.7 | 38% | 0.382 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.3 | -32.7 | 175.9 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | C94 R102 | C94-V98 WeakPolarHBondContact O-CB 3.29Å; C94-V98 WeakPolarHBondContact O-CG2 3.19Å; C94-V98 PolarHBondContact O-N 3.19Å; V98-R102 WeakPolarHBondContact O-CB 3.47Å; V98-R102 WeakPolarHBondContact O-CG 3.32Å; V98-R102 PolarHBondContact O-N 2.89Å; V98-R102 VanDerWaalsContact O-N 3.09Å |
| 99 | R | 50.7 | Low | 55.2 | Low | 205 Ų | 205 | 110.1 Ų | 110.1 | 77% | 0.774 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -71.3 | -38.2 | 173.4 | -74.5 | -175.8 | -177.9 | -156.6 | 2 | 112.7 | R95 G96 L97 S103 | R95-R99 WeakPolarHBondContact O-CG 3.05Å; R95-R99 PolarHBondContact O-N 3.47Å; G96-R99 PolarHBondContact O-N 3.29Å; L97-R99 PolarHBondContact O-N 2.95Å; R99-S103 PolarHBondContact O-N 3.14Å |
| 100 | R | 48.7 | Very low | 54.3 | Low | 191 Ų | 191 | 107.1 Ų | 107.1 | 72% | 0.721 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -69.7 | -37 | 175.7 | -77.9 | -173.3 | 179.2 | -176 | 0.9 | 112.3 | G96 L97 S103 N104 | G96-R100 PolarHBondContact O-N 2.85Å; G96-R100 VanDerWaalsContact O-N 3.14Å; L97-R100 PolarHBondContact O-N 2.89Å; L97-R100 VanDerWaalsContact O-N 3.09Å; R100-S103 PolarHBondContact O-N 3.36Å; R100-S103 PolarHBondContact O-OG 3.47Å; R100-N104 PolarHBondContact O-N 3.25Å |
| 101 | E | 48.5 | Very low | 53.5 | Low | 123 Ų | 123 | 109.5 Ų | 109.5 | 58% | 0.575 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -70.9 | -39.2 | 178.2 | -160.7 | 173.8 | -163.6 | 0 | 0 | 111.4 | L97 S103 N104 C105 | L97-E101 PolarHBondContact O-N 2.96Å; E101-S103 VanDerWaalsContact C-N 3.31Å; E101-S103 PolarHBondContact O-N 2.77Å; E101-N104 PolarHBondContact O-N 3.33Å; E101-C105 WeakPolarHBondContact O-CB 3.47Å; E101-C105 PolarHBondContact O-N 2.76Å |
| 102 | R | 43.9 | Very low | 53 | Low | 179 Ų | 179 | 113.6 Ų | 113.6 | 68% | 0.675 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -60.7 | -37 | 172.3 | -80.8 | -172.7 | 179.4 | -176.1 | 0.7 | 112.9 | V98 F106 | V98-R102 WeakPolarHBondContact O-CB 3.47Å; V98-R102 WeakPolarHBondContact O-CG 3.32Å; V98-R102 PolarHBondContact O-N 2.89Å; V98-R102 VanDerWaalsContact O-N 3.09Å; R102-F106 WeakPolarHBondContact O-CB 3.25Å; R102-F106 PolarHBondContact O-N 3.47Å |
| 103 | S | 49.2 | Very low | 52.4 | Low | 68 Ų | 68 | 114.2 Ų | 114.2 | 48% | 0.476 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -69.7 | -34.2 | 179.6 | 79.5 | 0 | 0 | 0 | 0 | 112.8 | R99 R100 E101 K107 | R99-S103 PolarHBondContact O-N 3.14Å; R100-S103 PolarHBondContact O-N 3.36Å; R100-S103 PolarHBondContact O-OG 3.47Å; E101-S103 VanDerWaalsContact C-N 3.31Å; E101-S103 PolarHBondContact O-N 2.77Å; S103-K107 PolarHBondContact O-N 2.86Å |
| 104 | N | 48.3 | Very low | 51.9 | Low | 107 Ų | 107 | 117.8 Ų | 117.8 | 57% | 0.572 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -78.7 | -34.7 | 175.3 | -80.7 | -13.1 | 0 | 0 | 0 | 112.9 | R100 E101 T108 | R100-N104 PolarHBondContact O-N 3.25Å; E101-N104 PolarHBondContact O-N 3.33Å; N104-T108 WeakPolarHBondContact O-CB 3.42Å; N104-T108 PolarHBondContact O-N 2.86Å; N104-T108 VanDerWaalsContact O-N 3.1Å; N104-T108 PolarHBondContact O-OG1 3.32Å |
| 105 | C | 45.1 | Very low | 51.8 | Low | 91 Ų | 91 | 124.8 Ų | 124.8 | 62% | 0.615 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -70.3 | -37 | 176.6 | -145.9 | 0 | 0 | 0 | 0 | 111.3 | E101 T108 G109 | E101-C105 WeakPolarHBondContact O-CB 3.47Å; E101-C105 PolarHBondContact O-N 2.76Å; C105-T108 PolarHBondContact O-N 3.3Å; C105-G109 PolarHBondContact O-N 2.84Å |
| 106 | F | 49.2 | Very low | 51.8 | Low | 154 Ų | 154 | 126.9 Ų | 126.9 | 68% | 0.675 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -67.2 | -40.9 | 176.7 | -147.7 | -104.5 | 0 | 0 | 0 | 112.1 | R102 T108 I110 | R102-F106 WeakPolarHBondContact O-CB 3.25Å; R102-F106 PolarHBondContact O-N 3.47Å; F106-T108 VanDerWaalsContact C-N 3.32Å; F106-T108 PolarHBondContact O-N 2.87Å; F106-I110 HydrophobicContact CD1-CD1 3.44Å; F106-I110 VanDerWaalsContact CD1-CD1 3.44Å; F106-I110 HydrophobicContact CD1-CG1 4.28Å; F106-I110 HydrophobicContact CE1-CD1 3.56Å; F106-I110 HydrophobicContact CE1-CG1 4.36Å; F106-I110 HydrophobicContact CG-CD1 4.38Å; F106-I110 WeakPolarHBondContact O-CB 3.39Å; F106-I110 WeakPolarHBondContact O-CD1 3.29Å; F106-I110 VanDerWaalsContact O-CG1 3.24Å; F106-I110 WeakPolarHBondContact O-CG1 3.18Å; F106-I110 PolarHBondContact O-N 3.41Å |
| 107 | K | 49.3 | Very low | 51.9 | Low | 155 Ų | 155 | 132.3 Ų | 132.3 | 67% | 0.674 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -63.8 | -36 | 173.8 | -89.7 | -178.4 | 176 | 177.9 | 0 | 112.9 | S103 K111 | S103-K107 PolarHBondContact O-N 2.86Å; K107-K111 WeakPolarHBondContact O-CG 3.39Å; K107-K111 PolarHBondContact O-N 3.42Å |
| 108 | T | 50.5 | Low | 52.3 | Low | 88 Ų | 88 | 132.6 Ų | 132.6 | 54% | 0.54 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -77.9 | -41 | 179.4 | -45.4 | 0 | 0 | 0 | 0 | 111.5 | N104 C105 F106 K111 M112 | N104-T108 WeakPolarHBondContact O-CB 3.42Å; N104-T108 PolarHBondContact O-N 2.86Å; N104-T108 VanDerWaalsContact O-N 3.1Å; N104-T108 PolarHBondContact O-OG1 3.32Å; C105-T108 PolarHBondContact O-N 3.3Å; F106-T108 VanDerWaalsContact C-N 3.32Å; F106-T108 PolarHBondContact O-N 2.87Å; T108-K111 PolarHBondContact O-N 3.43Å; T108-M112 PolarHBondContact O-N 2.95Å |
| 109 | G | 50.5 | Low | 52.9 | Low | 33 Ų | 33 | 132.8 Ų | 132.8 | 34% | 0.34 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -61.3 | -46.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | C105 K111 M112 T113 | C105-G109 PolarHBondContact O-N 2.84Å; G109-K111 VanDerWaalsContact C-N 3.32Å; G109-K111 PolarHBondContact O-N 2.97Å; G109-M112 PolarHBondContact O-N 2.98Å; G109-M112 VanDerWaalsContact O-N 3.16Å; G109-T113 PolarHBondContact O-N 3.21Å; G109-T113 PolarHBondContact O-OG1 2.86Å |
| 110 | I | 51.8 | Low | 53.4 | Low | 97 Ų | 97 | 128.6 Ų | 128.6 | 50% | 0.497 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -61 | -40.3 | 177.3 | -68.1 | 166.1 | 0 | 0 | 0 | 111.5 | F106 R114 | F106-I110 HydrophobicContact CD1-CD1 3.44Å; F106-I110 VanDerWaalsContact CD1-CD1 3.44Å; F106-I110 HydrophobicContact CD1-CG1 4.28Å; F106-I110 HydrophobicContact CE1-CD1 3.56Å; F106-I110 HydrophobicContact CE1-CG1 4.36Å; F106-I110 HydrophobicContact CG-CD1 4.38Å; F106-I110 WeakPolarHBondContact O-CB 3.39Å; F106-I110 WeakPolarHBondContact O-CD1 3.29Å; F106-I110 VanDerWaalsContact O-CG1 3.24Å; F106-I110 WeakPolarHBondContact O-CG1 3.18Å; F106-I110 PolarHBondContact O-N 3.41Å; I110-R114 WeakPolarHBondContact O-CB 3.32Å; I110-R114 PolarHBondContact O-N 2.94Å; I110-R114 VanDerWaalsContact O-N 3.1Å |
| 111 | K | 56.5 | Low | 54 | Low | 154 Ų | 154 | 124.6 Ų | 124.6 | 67% | 0.67 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66.9 | -37 | 176.9 | -76.4 | -177 | 179.1 | -177.8 | 0 | 112.3 | K107 T108 G109 R115 | K107-K111 WeakPolarHBondContact O-CG 3.39Å; K107-K111 PolarHBondContact O-N 3.42Å; T108-K111 PolarHBondContact O-N 3.43Å; G109-K111 VanDerWaalsContact C-N 3.32Å; G109-K111 PolarHBondContact O-N 2.97Å; K111-R115 PolarHBondContact O-N 2.98Å |
| 112 | M | 56.5 | Low | 54.7 | Low | 136 Ų | 136 | 123.6 Ų | 123.6 | 67% | 0.67 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -72.7 | -40.9 | 178.4 | -123.5 | 168.8 | -165.9 | 0 | 0 | 112.3 | T108 G109 R114 R115 R116 | T108-M112 PolarHBondContact O-N 2.95Å; G109-M112 PolarHBondContact O-N 2.98Å; G109-M112 VanDerWaalsContact O-N 3.16Å; M112-R114 PolarHBondContact O-N 2.76Å; M112-R115 PolarHBondContact O-N 3.3Å; M112-R116 PolarHBondContact O-N 3.45Å; M112-R116 VanDerWaalsContact O-N 3.15Å |
| 113 | T | 56.1 | Low | 55.6 | Low | 98 Ų | 98 | 118.9 Ų | 118.9 | 60% | 0.601 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -65.5 | -38.7 | 177.2 | -49.2 | 0 | 0 | 0 | 0 | 111.6 | G109 R115 R116 F117 | G109-T113 PolarHBondContact O-N 3.21Å; G109-T113 PolarHBondContact O-OG1 2.86Å; T113-R115 VanDerWaalsContact C-N 3.35Å; T113-R115 PolarHBondContact O-N 2.9Å; T113-R116 PolarHBondContact O-N 2.89Å; T113-F117 PolarHBondContact O-N 3.38Å |
| 114 | R | 56.5 | Low | 56.2 | Low | 188 Ų | 188 | 121.7 Ų | 121.7 | 71% | 0.709 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -65.2 | -35.8 | 177.2 | -157.5 | 176.5 | -172.5 | -171.2 | 2 | 112.7 | I110 M112 L118 | I110-R114 WeakPolarHBondContact O-CB 3.32Å; I110-R114 PolarHBondContact O-N 2.94Å; I110-R114 VanDerWaalsContact O-N 3.1Å; M112-R114 PolarHBondContact O-N 2.76Å; R114-L118 HydrophobicContact CG-CD1 4.46Å; R114-L118 WeakPolarHBondContact O-CG 3.35Å; R114-L118 PolarHBondContact O-N 2.87Å; R114-L118 VanDerWaalsContact O-N 3.16Å |
| 115 | R | 59.5 | Low | 56.8 | Low | 202 Ų | 202 | 120.3 Ų | 120.3 | 76% | 0.762 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.2 | -40.6 | 174.8 | -73.5 | -175.1 | -176.3 | -170.3 | 0.7 | 112.5 | K111 M112 T113 L118 S119 | K111-R115 PolarHBondContact O-N 2.98Å; M112-R115 PolarHBondContact O-N 3.3Å; T113-R115 VanDerWaalsContact C-N 3.35Å; T113-R115 PolarHBondContact O-N 2.9Å; R115-L118 PolarHBondContact O-N 3.4Å; R115-S119 PolarHBondContact O-N 3.48Å |
| 116 | R | 58 | Low | 57.6 | Low | 199 Ų | 199 | 122.3 Ų | 122.3 | 75% | 0.751 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -64.4 | -40.2 | 175.2 | -82.9 | -173.4 | 174.8 | -177.6 | -1.2 | 112.3 | M112 T113 S119 L120 | M112-R116 PolarHBondContact O-N 3.45Å; M112-R116 VanDerWaalsContact O-N 3.15Å; T113-R116 PolarHBondContact O-N 2.89Å; R116-S119 PolarHBondContact O-N 3.43Å; R116-L120 PolarHBondContact O-N 3.42Å; R116-L120 VanDerWaalsContact O-N 3.16Å |
| 117 | F | 60.2 | Low | 58.2 | Low | 150 Ų | 150 | 120.2 Ų | 120.2 | 66% | 0.658 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -65.8 | -42.1 | 178 | -165.3 | -95.2 | 0 | 0 | 0 | 112.6 | T113 H121 | T113-F117 PolarHBondContact O-N 3.38Å; F117-H121 PolarHBondContact O-N 2.76Å; F117-H121 VanDerWaalsContact O-N 3.14Å |
| 118 | L | 60.8 | Low | 58.8 | Low | 104 Ų | 104 | 119.2 Ų | 119.2 | 55% | 0.545 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -67.3 | -35.4 | 176.6 | -77.6 | 162.9 | 0 | 0 | 0 | 113 | R114 R115 N122 | R114-L118 HydrophobicContact CG-CD1 4.46Å; R114-L118 WeakPolarHBondContact O-CG 3.35Å; R114-L118 PolarHBondContact O-N 2.87Å; R114-L118 VanDerWaalsContact O-N 3.16Å; R115-L118 PolarHBondContact O-N 3.4Å; L118-N122 PolarHBondContact O-N 3.38Å; L118-N122 VanDerWaalsContact O-N 3.16Å |
| 119 | S | 61.6 | Low | 59.3 | Low | 66 Ų | 66 | 121.9 Ų | 121.9 | 46% | 0.462 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.5 | -47.8 | 175.9 | -165.2 | 0 | 0 | 0 | 0 | 111.5 | R115 R116 H121 N122 D123 | R115-S119 PolarHBondContact O-N 3.48Å; R116-S119 PolarHBondContact O-N 3.43Å; S119-H121 VanDerWaalsContact C-N 3.33Å; S119-H121 PolarHBondContact O-N 2.96Å; S119-N122 PolarHBondContact O-N 2.9Å; S119-D123 PolarHBondContact O-N 2.88Å |
| 120 | L | 61 | Low | 59.8 | Low | 118 Ų | 118 | 125.8 Ų | 125.8 | 62% | 0.618 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -63.2 | -38.2 | 179.2 | -76.5 | 165 | 0 | 0 | 0 | 112.4 | R116 D123 Q124 | R116-L120 PolarHBondContact O-N 3.42Å; R116-L120 VanDerWaalsContact O-N 3.16Å; L120-D123 PolarHBondContact O-N 2.9Å; L120-Q124 WeakPolarHBondContact O-CG 3.48Å; L120-Q124 PolarHBondContact O-N 3.13Å; L120-Q124 VanDerWaalsContact O-N 3.1Å |
| 121 | H | 62 | Low | 60.1 | Low | 106 Ų | 106 | 125.2 Ų | 125.2 | 49% | 0.491 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -69.8 | -33.9 | 178.8 | -158.5 | -76.1 | 0 | 0 | 0 | 112.7 | F117 S119 N125 | F117-H121 PolarHBondContact O-N 2.76Å; F117-H121 VanDerWaalsContact O-N 3.14Å; S119-H121 VanDerWaalsContact C-N 3.33Å; S119-H121 PolarHBondContact O-N 2.96Å; H121-N125 PolarHBondContact O-N 2.75Å |
| 122 | N | 62.2 | Low | 60.2 | Low | 103 Ų | 103 | 126.9 Ų | 126.9 | 55% | 0.551 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -71.9 | -37.8 | 174.6 | -97 | -11.3 | 0 | 0 | 0 | 112.7 | L118 S119 N125 K126 | L118-N122 PolarHBondContact O-N 3.38Å; L118-N122 VanDerWaalsContact O-N 3.16Å; S119-N122 PolarHBondContact O-N 2.9Å; N122-N125 PolarHBondContact O-N 3.39Å; N122-K126 PolarHBondContact O-N 3.44Å |
| 123 | D | 62.7 | Low | 59.9 | Low | 79 Ų | 79 | 134 Ų | 134 | 42% | 0.422 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -67.9 | -37.1 | 177.1 | -71.7 | -26.3 | 0 | 0 | 0 | 111.7 | S119 L120 N125 K126 N127 | S119-D123 PolarHBondContact O-N 2.88Å; L120-D123 PolarHBondContact O-N 2.9Å; D123-N125 PolarHBondContact O-N 3Å; D123-K126 PolarHBondContact O-N 3.13Å; D123-N127 WeakPolarHBondContact O-CB 3.36Å; D123-N127 PolarHBondContact O-N 2.98Å |
| 124 | Q | 62 | Low | 60.1 | Low | 128 Ų | 128 | 135.8 Ų | 135.8 | 60% | 0.598 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.3 | -36.8 | 173.2 | -70.7 | -136 | -16.4 | 0 | 0 | 113 | L120 K128 | L120-Q124 WeakPolarHBondContact O-CG 3.48Å; L120-Q124 PolarHBondContact O-N 3.13Å; L120-Q124 VanDerWaalsContact O-N 3.1Å; Q124-K128 WeakPolarHBondContact O-CB 3.43Å; Q124-K128 WeakPolarHBondContact O-CG 3.26Å; Q124-K128 PolarHBondContact O-N 3.46Å |
| 125 | N | 61.2 | Low | 60.2 | Low | 78 Ų | 78 | 133 Ų | 133 | 42% | 0.417 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -69.5 | -38.7 | 175.6 | -88.5 | -10.1 | 0 | 0 | 0 | 112.5 | H121 N122 D123 K128 Q129 | H121-N125 PolarHBondContact O-N 2.75Å; N122-N125 PolarHBondContact O-N 3.39Å; D123-N125 PolarHBondContact O-N 3Å; N125-K128 PolarHBondContact O-N 3.24Å; N125-Q129 PolarHBondContact O-N 3.13Å; N125-Q129 VanDerWaalsContact O-N 3.11Å |
| 126 | K | 62.3 | Low | 60.3 | Low | 132 Ų | 132 | 129.2 Ų | 129.2 | 57% | 0.574 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -64.6 | -42.7 | 174 | -77.5 | -177.1 | 176.3 | -179.2 | 0 | 112.1 | N122 D123 K128 Q129 N130 | N122-K126 PolarHBondContact O-N 3.44Å; D123-K126 PolarHBondContact O-N 3.13Å; K126-K128 PolarHBondContact O-N 3.06Å; K126-Q129 PolarHBondContact O-N 3.26Å; K126-N130 PolarHBondContact O-N 3.48Å |
| 127 | N | 61.5 | Low | 60.4 | Low | 111 Ų | 111 | 125.1 Ų | 125.1 | 59% | 0.594 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -67 | -36 | 178.1 | -72.8 | -11 | 0 | 0 | 0 | 112.4 | D123 A131 | D123-N127 WeakPolarHBondContact O-CB 3.36Å; D123-N127 PolarHBondContact O-N 2.98Å; N127-A131 WeakPolarHBondContact O-CB 3.34Å; N127-A131 PolarHBondContact O-N 2.86Å |
| 128 | K | 60.9 | Low | 60.4 | Low | 134 Ų | 134 | 123.5 Ų | 123.5 | 58% | 0.583 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -69.4 | -29.7 | 174.3 | -77.7 | -179.3 | 179.6 | 178.5 | 0 | 113.7 | Q124 N125 K126 | Q124-K128 WeakPolarHBondContact O-CB 3.43Å; Q124-K128 WeakPolarHBondContact O-CG 3.26Å; Q124-K128 PolarHBondContact O-N 3.46Å; N125-K128 PolarHBondContact O-N 3.24Å; K126-K128 PolarHBondContact O-N 3.06Å |
| 129 | Q | 60.9 | Low | 60.4 | Low | 143 Ų | 143 | 124.8 Ų | 124.8 | 67% | 0.668 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -76.4 | -37.7 | 174.8 | -77 | -177.3 | -10.5 | 0 | 0 | 112.1 | N125 K126 K132 | N125-Q129 PolarHBondContact O-N 3.13Å; N125-Q129 VanDerWaalsContact O-N 3.11Å; K126-Q129 PolarHBondContact O-N 3.26Å; Q129-K132 PolarHBondContact O-N 3.33Å |
| 130 | N | 60.6 | Low | 60.3 | Low | 116 Ų | 116 | 129 Ų | 129 | 62% | 0.62 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -71.8 | -27.7 | 176.1 | -76.4 | -11.7 | 0 | 0 | 0 | 113.2 | K126 K132 | K126-N130 PolarHBondContact O-N 3.48Å; N130-K132 PolarHBondContact O-N 3.41Å |
| 131 | A | 59.3 | Low | 60.3 | Low | 84 Ų | 84 | 129.8 Ų | 129.8 | 69% | 0.694 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -3.2 | 175 | 0 | 0 | 0 | 0 | 0 | 114.3 | N127 | N127-A131 WeakPolarHBondContact O-CB 3.34Å; N127-A131 PolarHBondContact O-N 2.86Å |
| 132 | K | 58 | Low | 60.1 | Low | 190 Ų | 190 | 131.8 Ų | 131.8 | 83% | 0.826 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.4 | 3.6 | 178.4 | -77.6 | -171.6 | 175.5 | -171 | 0 | 113.7 | Q129 N130 | Q129-K132 PolarHBondContact O-N 3.33Å; N130-K132 PolarHBondContact O-N 3.41Å |
| 133 | R | 50 | Low | 59.9 | Low | 284 Ų | 284 | 134.5 Ų | 134.5 | 100% | 1.072 | 64% | 0.643 | S | S | * | * | trans | -105.4 | 0 | 166.1 | -83.2 | -173.6 | 172.4 | -176.5 | -2.3 | 108.8 |
Retrieved 133 of 133 residues in 84.3 ms
(Link to these results)