| 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 | 43.7 | Very low | 56 | Low | 215 Ų | 215 | 99.5 Ų | 99.5 | 100% | 1.059 | 53% | 0.533 | S | S | * | . | 0 | 64.1 | 0 | -63 | 166.7 | 61.2 | 0 | 0 | 110.7 | |||||
| 2 | K | 52.3 | Low | 55.9 | Low | 141 Ų | 141 | 94.4 Ų | 94.4 | 61% | 0.613 | 51% | 0.508 | S | S | * | . | trans | -126.6 | -15.1 | -167.9 | -84.7 | -174.9 | 168.9 | -171.7 | 0 | 116.8 | ||||
| 3 | G | 54.5 | Low | 56 | Low | 22 Ų | 22 | 89.5 Ų | 89.5 | 23% | 0.227 | 48% | 0.483 | C | S | . | . | S | Bend | trans | -83.2 | -18.8 | 170.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | L5 E55 | G3-L5 PolarHBondContact O-N 3.34Å; G3-E55 VanDerWaalsContact CA-OE1 3.27Å; G3-E55 WeakPolarHBondContact CA-OE1 3.36Å; G3-E55 VanDerWaalsContact O-OE1 3.14Å |
| 4 | T | 55.4 | Low | 55.8 | Low | 85 Ų | 85 | 88.2 Ų | 88.2 | 52% | 0.521 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.6 | -26.1 | 173.2 | -22.7 | 0 | 0 | 0 | 0 | 111.2 | L6 L8 | T4-L6 PolarHBondContact O-N 2.78Å; T4-L8 HydrophobicContact CG2-CD1 3.62Å; T4-L8 HydrophobicContact CG2-CG 4.48Å; T4-L8 WeakPolarHBondContact O-CA 3.27Å; T4-L8 WeakPolarHBondContact O-CB 3.03Å; T4-L8 WeakPolarHBondContact O-CD1 3.09Å; T4-L8 WeakPolarHBondContact O-CG 3.45Å; T4-L8 PolarHBondContact O-N 3.49Å |
| 5 | L | 58.2 | Low | 55.3 | Low | 111 Ų | 111 | 93.7 Ų | 93.7 | 58% | 0.581 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -71.1 | -28.7 | -172.7 | -108 | 150.4 | 0 | 0 | 0 | 114 | G3 A9 | G3-L5 PolarHBondContact O-N 3.34Å; L5-A9 WeakPolarHBondContact O-CA 3.06Å; L5-A9 WeakPolarHBondContact O-CB 3.43Å; L5-A9 PolarHBondContact O-N 2.76Å |
| 6 | L | 63 | Low | 55 | Low | 55 Ų | 55 | 95.5 Ų | 95.5 | 29% | 0.288 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -82.9 | -41.9 | -178.3 | -140.3 | 160.2 | 0 | 0 | 0 | 111.1 | T4 A9 L10 E55 | T4-L6 PolarHBondContact O-N 2.78Å; L6-A9 PolarHBondContact O-N 2.68Å; L6-L10 HydrophobicContact CD2-CD1 4.21Å; L6-L10 WeakPolarHBondContact O-CG 3.31Å; L6-L10 PolarHBondContact O-N 3.25Å; L6-E55 WeakPolarHBondContact CB-OE1 3.21Å |
| 7 | L | 57.2 | Low | 54.8 | Low | 120 Ų | 120 | 93.9 Ų | 93.9 | 63% | 0.628 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.8 | -42 | 168.5 | -89.7 | 165.3 | 0 | 0 | 0 | 112.2 | L10 L11 | L7-L10 PolarHBondContact O-N 3.08Å; L7-L11 PolarHBondContact O-N 3.29Å |
| 8 | L | 55.8 | Low | 54.5 | Low | 90 Ų | 90 | 95.1 Ų | 95.1 | 47% | 0.471 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -59.1 | -52.4 | 169.7 | -93 | 148 | 0 | 0 | 0 | 108.9 | T4 L10 L11 V12 | T4-L8 HydrophobicContact CG2-CD1 3.62Å; T4-L8 HydrophobicContact CG2-CG 4.48Å; T4-L8 WeakPolarHBondContact O-CA 3.27Å; T4-L8 WeakPolarHBondContact O-CB 3.03Å; T4-L8 WeakPolarHBondContact O-CD1 3.09Å; T4-L8 WeakPolarHBondContact O-CG 3.45Å; T4-L8 PolarHBondContact O-N 3.49Å; L8-L10 VanDerWaalsContact C-N 3.26Å; L8-L10 PolarHBondContact O-N 2.94Å; L8-L11 CarbonylContact O-C 3.58Å; L8-L11 PolarHBondContact O-N 3.37Å; L8-L11 VanDerWaalsContact O-N 3.08Å; L8-V12 HydrophobicContact CB-CG2 4.42Å; L8-V12 HydrophobicContact CD2-CG2 4.07Å; L8-V12 WeakPolarHBondContact O-CA 3.43Å; L8-V12 WeakPolarHBondContact O-CB 3Å; L8-V12 WeakPolarHBondContact O-CG2 3.42Å; L8-V12 PolarHBondContact O-N 3.23Å |
| 9 | A | 61.4 | Low | 54.3 | Low | 44 Ų | 44 | 97.2 Ų | 97.2 | 36% | 0.364 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -55.2 | -40.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L5 L6 T13 | L5-A9 WeakPolarHBondContact O-CA 3.06Å; L5-A9 WeakPolarHBondContact O-CB 3.43Å; L5-A9 PolarHBondContact O-N 2.76Å; L6-A9 PolarHBondContact O-N 2.68Å; A9-T13 WeakPolarHBondContact O-CB 3.22Å; A9-T13 WeakPolarHBondContact O-CG2 3.43Å; A9-T13 PolarHBondContact O-N 3.4Å; A9-T13 PolarHBondContact O-OG1 3.42Å; A9-T13 VanDerWaalsContact O-OG1 3.11Å |
| 10 | L | 58.9 | Low | 54.4 | Low | 94 Ų | 94 | 97.6 Ų | 97.6 | 49% | 0.492 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -66.9 | -45.3 | 174.7 | -77 | 164 | 0 | 0 | 0 | 112.7 | L6 L7 L8 T13 | L6-L10 HydrophobicContact CD2-CD1 4.21Å; L6-L10 WeakPolarHBondContact O-CG 3.31Å; L6-L10 PolarHBondContact O-N 3.25Å; L7-L10 PolarHBondContact O-N 3.08Å; L8-L10 VanDerWaalsContact C-N 3.26Å; L8-L10 PolarHBondContact O-N 2.94Å; L10-T13 WeakPolarHBondContact CA-OG1 3.38Å; L10-T13 PolarHBondContact O-N 3.14Å; L10-T13 PolarHBondContact O-OG1 3.4Å |
| 11 | L | 55.6 | Low | 54.5 | Low | 118 Ų | 118 | 97.7 Ų | 97.7 | 62% | 0.618 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -63.8 | -44.3 | 174.3 | -110.9 | 102.8 | 0 | 0 | 0 | 112.2 | L7 L8 G14 E15 | L7-L11 PolarHBondContact O-N 3.29Å; L8-L11 CarbonylContact O-C 3.58Å; L8-L11 PolarHBondContact O-N 3.37Å; L8-L11 VanDerWaalsContact O-N 3.08Å; L11-G14 PolarHBondContact O-N 3.06Å; L11-E15 PolarHBondContact O-N 3.44Å |
| 12 | V | 54.8 | Low | 55.3 | Low | 38 Ų | 38 | 93.5 Ų | 93.5 | 23% | 0.23 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -63.8 | -36.6 | 177.5 | 152.2 | 0 | 0 | 0 | 0 | 110.4 | L8 G14 E15 L16 | L8-V12 HydrophobicContact CB-CG2 4.42Å; L8-V12 HydrophobicContact CD2-CG2 4.07Å; L8-V12 WeakPolarHBondContact O-CA 3.43Å; L8-V12 WeakPolarHBondContact O-CB 3Å; L8-V12 WeakPolarHBondContact O-CG2 3.42Å; L8-V12 PolarHBondContact O-N 3.23Å; V12-G14 PolarHBondContact O-N 3.3Å; V12-E15 PolarHBondContact O-N 2.7Å; V12-E15 VanDerWaalsContact O-N 3.12Å; V12-L16 HydrophobicContact CB-CD1 3.74Å; V12-L16 HydrophobicContact CG1-CB 3.98Å; V12-L16 HydrophobicContact CG1-CD1 3.14Å; V12-L16 HydrophobicContact CG1-CG 4.08Å; V12-L16 HydrophobicContact CG2-CD1 3.73Å; V12-L16 WeakPolarHBondContact O-CA 3.33Å; V12-L16 VanDerWaalsContact O-CB 3.22Å; V12-L16 WeakPolarHBondContact O-CB 3.34Å; V12-L16 PolarHBondContact O-N 3.12Å |
| 13 | T | 57.5 | Low | 55.9 | Low | 31 Ų | 31 | 88.3 Ų | 88.3 | 19% | 0.19 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -65.3 | -26.4 | 176.9 | 52.2 | 0 | 0 | 0 | 0 | 113.2 | A9 L10 F18 A23 | A9-T13 WeakPolarHBondContact O-CB 3.22Å; A9-T13 WeakPolarHBondContact O-CG2 3.43Å; A9-T13 PolarHBondContact O-N 3.4Å; A9-T13 PolarHBondContact O-OG1 3.42Å; A9-T13 VanDerWaalsContact O-OG1 3.11Å; L10-T13 WeakPolarHBondContact CA-OG1 3.38Å; L10-T13 PolarHBondContact O-N 3.14Å; L10-T13 PolarHBondContact O-OG1 3.4Å; T13-F18 HydrophobicContact CG2-CB 3.78Å; T13-F18 HydrophobicContact CG2-CG 4.34Å; T13-A23 HydrophobicContact CG2-CB 4.13Å |
| 14 | G | 53.1 | Low | 56.8 | Low | 71 Ų | 71 | 90.5 Ų | 90.5 | 73% | 0.732 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -77 | -31.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | L11 V12 | L11-G14 PolarHBondContact O-N 3.06Å; V12-G14 PolarHBondContact O-N 3.3Å |
| 15 | E | 48.3 | Very low | 58 | Low | 170 Ų | 170 | 89.7 Ų | 89.7 | 79% | 0.794 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -101.4 | -21.8 | -175.1 | -66.4 | -165.6 | 163.2 | 0 | 0 | 115.3 | L11 V12 | L11-E15 PolarHBondContact O-N 3.44Å; V12-E15 PolarHBondContact O-N 2.7Å; V12-E15 VanDerWaalsContact O-N 3.12Å |
| 16 | L | 50.5 | Low | 59.2 | Low | 123 Ų | 123 | 86.4 Ų | 86.4 | 64% | 0.644 | 51% | 0.51 | S | S | * | . | S | Bend | trans | -112.9 | 6 | -171.5 | -75.1 | 157.2 | 0 | 0 | 0 | 114.6 | V12 F18 | V12-L16 HydrophobicContact CB-CD1 3.74Å; V12-L16 HydrophobicContact CG1-CB 3.98Å; V12-L16 HydrophobicContact CG1-CD1 3.14Å; V12-L16 HydrophobicContact CG1-CG 4.08Å; V12-L16 HydrophobicContact CG2-CD1 3.73Å; V12-L16 WeakPolarHBondContact O-CA 3.33Å; V12-L16 VanDerWaalsContact O-CB 3.22Å; V12-L16 WeakPolarHBondContact O-CB 3.34Å; V12-L16 PolarHBondContact O-N 3.12Å; L16-F18 PolarHBondContact O-N 3.03Å; L16-F18 VanDerWaalsContact O-N 3.14Å |
| 17 | G | 51.6 | Low | 60.2 | Low | 69 Ų | 69 | 88.6 Ų | 88.6 | 71% | 0.711 | 52% | 0.517 | S | S | * | . | trans | 60.4 | 28.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q19 | G17-Q19 PolarHBondContact O-N 3.3Š| ||
| 18 | F | 48.8 | Very low | 61.5 | Low | 114 Ų | 114 | 85.6 Ų | 85.6 | 50% | 0.5 | 50% | 0.504 | S | S | . | . | trans | -53.5 | 137.7 | 166.4 | -129 | -90.4 | 0 | 0 | 0 | 107.8 | T13 L16 T20 | T13-F18 HydrophobicContact CG2-CB 3.78Å; T13-F18 HydrophobicContact CG2-CG 4.34Å; L16-F18 PolarHBondContact O-N 3.03Å; L16-F18 VanDerWaalsContact O-N 3.14Å; F18-T20 PolarHBondContact O-N 3.23Å | ||
| 19 | Q | 50.9 | Low | 63.1 | Low | 136 Ų | 136 | 82.2 Ų | 82.2 | 64% | 0.636 | 49% | 0.49 | S | S | * | . | trans | -54.7 | 108 | 176.4 | -85.4 | -170.6 | 25.3 | 0 | 0 | 108.4 | G17 T21 E22 | G17-Q19 PolarHBondContact O-N 3.3Å; Q19-T21 PolarHBondContact O-N 2.72Å; Q19-E22 HydrophobicContact CB-CG 4.43Å; Q19-E22 PolarHBondContact O-N 2.72Å | ||
| 20 | T | 55.6 | Low | 64.5 | Low | 104 Ų | 104 | 80.5 Ų | 80.5 | 64% | 0.638 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -53.6 | -27 | -178.6 | 48.3 | 0 | 0 | 0 | 0 | 111.3 | F18 E22 A23 C24 | F18-T20 PolarHBondContact O-N 3.23Å; T20-E22 PolarHBondContact O-N 3.31Å; T20-A23 PolarHBondContact O-N 2.96Å; T20-C24 WeakPolarHBondContact O-CB 3.43Å; T20-C24 PolarHBondContact O-N 2.76Å |
| 21 | T | 57.9 | Low | 65.9 | Low | 100 Ų | 100 | 77.7 Ų | 77.7 | 61% | 0.613 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -53.5 | -43.5 | 171.2 | -33 | 0 | 0 | 0 | 0 | 113.6 | Q19 | Q19-T21 PolarHBondContact O-N 2.72Å |
| 22 | E | 59.8 | Low | 67.6 | Low | 128 Ų | 128 | 76 Ų | 76 | 60% | 0.598 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -77.6 | -29.6 | -176 | -66.4 | -159.7 | 152.6 | 0 | 0 | 113 | Q19 T20 P26 | Q19-E22 HydrophobicContact CB-CG 4.43Å; Q19-E22 PolarHBondContact O-N 2.72Å; T20-E22 PolarHBondContact O-N 3.31Å; E22-P26 WeakPolarHBondContact O-CD 3.48Å; E22-P26 VanDerWaalsContact O-CG 3.3Å; E22-P26 WeakPolarHBondContact O-CG 3.47Å |
| 23 | A | 65.5 | Low | 69.4 | Low | 32 Ų | 32 | 78 Ų | 78 | 26% | 0.264 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -84.6 | -26.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | T13 T20 P26 F27 | T13-A23 HydrophobicContact CG2-CB 4.13Å; T20-A23 PolarHBondContact O-N 2.96Å; A23-P26 WeakPolarHBondContact O-CD 3Å; A23-F27 WeakPolarHBondContact O-CB 3.33Å; A23-F27 PolarHBondContact O-N 3.11Å; A23-F27 VanDerWaalsContact O-N 3.12Å |
| 24 | C | 73 | Confident | 71.2 | Confident | 67 Ų | 67 | 77 Ų | 77 | 45% | 0.453 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.9 | -44.5 | -179.8 | -176 | 0 | 0 | 0 | 0 | 112.2 | T20 F27 V28 | T20-C24 WeakPolarHBondContact O-CB 3.43Å; T20-C24 PolarHBondContact O-N 2.76Å; C24-F27 PolarHBondContact O-N 2.76Å; C24-V28 WeakPolarHBondContact O-CB 3.36Å; C24-V28 VanDerWaalsContact O-CG2 3.3Å; C24-V28 WeakPolarHBondContact O-CG2 3.35Å; C24-V28 PolarHBondContact O-N 3.08Å |
| 25 | A | 80.1 | Confident | 73 | Confident | 68 Ų | 68 | 74.7 Ų | 74.7 | 56% | 0.562 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -63.1 | -45.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | F27 G29 | A25-F27 PolarHBondContact O-N 2.8Å; A25-G29 PolarHBondContact O-N 3.12Å |
| 26 | P | 84.8 | Confident | 75 | Confident | 42 Ų | 42 | 69.5 Ų | 69.5 | 27% | 0.273 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -55.8 | -44.5 | 169.4 | -30 | 36.7 | 0 | 0 | 0 | 114.2 | E22 A23 G29 A30 Y45 F49 | E22-P26 WeakPolarHBondContact O-CD 3.48Å; E22-P26 VanDerWaalsContact O-CG 3.3Å; E22-P26 WeakPolarHBondContact O-CG 3.47Å; A23-P26 WeakPolarHBondContact O-CD 3Å; P26-G29 PolarHBondContact O-N 3.41Å; P26-A30 PolarHBondContact O-N 3.3Å; P26-Y45 WeakPolarHBondContact CA-OH 3.32Å; P26-Y45 WeakPolarHBondContact O-CE1 3.41Å; P26-Y45 PolarHBondContact O-OH 2.85Å; P26-Y45 VanDerWaalsContact O-OH 3.05Å; P26-F49 HydrophobicContact CB-CE1 3.93Å; P26-F49 HydrophobicContact CB-CZ 3.79Å; P26-F49 HydrophobicContact CG-CE1 4.08Å; P26-F49 HydrophobicContact CG-CZ 4.16Å |
| 27 | F | 83.6 | Confident | 77 | Confident | 102 Ų | 102 | 64.7 Ų | 64.7 | 45% | 0.447 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -64.7 | -51.6 | -179.9 | 172.6 | -97.6 | 0 | 0 | 0 | 111.9 | A23 C24 A25 G29 A30 Y31 M81 | A23-F27 WeakPolarHBondContact O-CB 3.33Å; A23-F27 PolarHBondContact O-N 3.11Å; A23-F27 VanDerWaalsContact O-N 3.12Å; C24-F27 PolarHBondContact O-N 2.76Å; A25-F27 PolarHBondContact O-N 2.8Å; F27-G29 VanDerWaalsContact C-N 3.28Å; F27-G29 PolarHBondContact O-N 3.45Å; F27-A30 PolarHBondContact O-N 3.46Å; F27-Y31 WeakPolarHBondContact O-CB 3.17Å; F27-Y31 PolarHBondContact O-N 3.26Å; F27-M81 HydrophobicContact CE1-CE 4.4Å; F27-M81 HydrophobicContact CE1-CG 4.39Å; F27-M81 HydrophobicContact CE1-SD 3.54Å; F27-M81 VanDerWaalsContact CE1-SD 3.54Å; F27-M81 HydrophobicContact CZ-SD 4.01Å |
| 28 | V | 85.1 | Confident | 79 | Confident | 57 Ų | 57 | 65.5 Ų | 65.5 | 35% | 0.345 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.3 | -40.2 | 177.7 | 173.5 | 0 | 0 | 0 | 0 | 110.5 | C24 Y31 V32 M81 | C24-V28 WeakPolarHBondContact O-CB 3.36Å; C24-V28 VanDerWaalsContact O-CG2 3.3Å; C24-V28 WeakPolarHBondContact O-CG2 3.35Å; C24-V28 PolarHBondContact O-N 3.08Å; V28-Y31 PolarHBondContact O-N 3.4Å; V28-V32 HydrophobicContact CG1-CG2 4.38Å; V28-V32 WeakPolarHBondContact O-CG2 3.24Å; V28-V32 PolarHBondContact O-N 3.19Å; V28-M81 HydrophobicContact CG2-CE 4.49Å |
| 29 | G | 88.4 | Confident | 81.2 | Confident | 18 Ų | 18 | 64.7 Ų | 64.7 | 19% | 0.186 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -60.1 | -47.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A25 P26 F27 Y31 V32 K33 Y45 | A25-G29 PolarHBondContact O-N 3.12Å; P26-G29 PolarHBondContact O-N 3.41Å; F27-G29 VanDerWaalsContact C-N 3.28Å; F27-G29 PolarHBondContact O-N 3.45Å; G29-Y31 VanDerWaalsContact C-N 3.35Å; G29-Y31 PolarHBondContact O-N 2.88Å; G29-V32 PolarHBondContact O-N 3.23Å; G29-K33 WeakPolarHBondContact O-CG 3.45Å; G29-K33 PolarHBondContact O-N 3.15Å; G29-Y45 WeakPolarHBondContact CA-OH 3.45Å |
| 30 | A | 89.9 | Confident | 83.4 | Confident | 9 Ų | 9 | 65 Ų | 65 | 7% | 0.074 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | P26 F27 V32 K33 I34 Y45 F59 | P26-A30 PolarHBondContact O-N 3.3Å; F27-A30 PolarHBondContact O-N 3.46Å; A30-V32 PolarHBondContact O-N 2.82Å; A30-K33 PolarHBondContact O-N 3.06Å; A30-K33 VanDerWaalsContact O-N 3.15Å; A30-I34 WeakPolarHBondContact O-CG1 3.34Å; A30-I34 PolarHBondContact O-N 2.99Å; A30-Y45 HydrophobicContact CB-CD1 4.15Å; A30-Y45 HydrophobicContact CB-CE1 3.84Å; A30-F59 HydrophobicContact CB-CE1 4.11Å |
| 31 | Y | 89.3 | Confident | 85.2 | Confident | 35 Ų | 35 | 61.6 Ų | 61.6 | 14% | 0.137 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.3 | -45.2 | 179.6 | -178 | -103 | 0 | 0 | 0 | 113 | F27 V28 G29 K33 I34 L35 S77 P78 M81 | F27-Y31 WeakPolarHBondContact O-CB 3.17Å; F27-Y31 PolarHBondContact O-N 3.26Å; V28-Y31 PolarHBondContact O-N 3.4Å; G29-Y31 VanDerWaalsContact C-N 3.35Å; G29-Y31 PolarHBondContact O-N 2.88Å; Y31-K33 VanDerWaalsContact C-N 3.3Å; Y31-K33 PolarHBondContact O-N 3.24Å; Y31-I34 WeakPolarHBondContact O-CB 3.42Å; Y31-I34 PolarHBondContact O-N 3.1Å; Y31-L35 HydrophobicContact CD1-CD1 3.95Å; Y31-L35 HydrophobicContact CD1-CG 4.4Å; Y31-L35 HydrophobicContact CE1-CD1 3.37Å; Y31-L35 HydrophobicContact CE1-CG 4.05Å; Y31-L35 PolarHBondContact O-N 3.23Å; Y31-S77 WeakPolarHBondContact OH-CB 3.32Å; Y31-S77 PolarHBondContact OH-O 3.14Å; Y31-P78 HydrophobicContact CE1-CG 4.29Å; Y31-M81 HydrophobicContact CD1-CE 3.16Å; Y31-M81 HydrophobicContact CD1-SD 3.72Å; Y31-M81 HydrophobicContact CD2-CE 4.4Å; Y31-M81 HydrophobicContact CD2-SD 3.87Å; Y31-M81 HydrophobicContact CE1-CE 3.39Å; Y31-M81 HydrophobicContact CE1-SD 3.76Å; Y31-M81 HydrophobicContact CE2-SD 3.93Å; Y31-M81 HydrophobicContact CG-CE 3.7Å; Y31-M81 HydrophobicContact CG-SD 3.74Å |
| 32 | V | 91.1 | Very high | 87 | Confident | 82 Ų | 82 | 56.9 Ų | 56.9 | 50% | 0.497 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.6 | -37.8 | 176.3 | 170.7 | 0 | 0 | 0 | 0 | 111.4 | V28 G29 A30 L35 G36 | V28-V32 HydrophobicContact CG1-CG2 4.38Å; V28-V32 WeakPolarHBondContact O-CG2 3.24Å; V28-V32 PolarHBondContact O-N 3.19Å; G29-V32 PolarHBondContact O-N 3.23Å; A30-V32 PolarHBondContact O-N 2.82Å; V32-L35 PolarHBondContact O-N 2.92Å; V32-G36 PolarHBondContact O-N 3.42Å |
| 33 | K | 93.7 | Very high | 88.7 | Confident | 81 Ų | 81 | 52.1 Ų | 52.1 | 35% | 0.352 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -68 | -35.9 | 176.1 | -61.6 | -55.7 | 178.5 | -173 | 0 | 112.4 | G29 A30 Y31 G36 G37 A41 L42 Y45 Q63 | G29-K33 WeakPolarHBondContact O-CG 3.45Å; G29-K33 PolarHBondContact O-N 3.15Å; A30-K33 PolarHBondContact O-N 3.06Å; A30-K33 VanDerWaalsContact O-N 3.15Å; Y31-K33 VanDerWaalsContact C-N 3.3Å; Y31-K33 PolarHBondContact O-N 3.24Å; K33-G36 PolarHBondContact O-N 3.41Å; K33-G37 PolarHBondContact O-N 3.42Å; K33-A41 HydrophobicContact CD-CB 4.14Å; K33-L42 HydrophobicContact CB-CB 4.32Å; K33-L42 HydrophobicContact CB-CD1 4.06Å; K33-Y45 HydrophobicContact CG-CG 4.25Å; K33-Q63 PolarHBondContact O-NE2 2.93Å |
| 34 | I | 93.4 | Very high | 90.1 | Very high | 9 Ų | 9 | 53.4 Ų | 53.4 | 5% | 0.046 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -60 | -54.9 | 172.3 | -68.2 | 168.3 | 0 | 0 | 0 | 109.6 | A30 Y31 G36 G37 L42 F59 I62 Q63 F66 | A30-I34 WeakPolarHBondContact O-CG1 3.34Å; A30-I34 PolarHBondContact O-N 2.99Å; Y31-I34 WeakPolarHBondContact O-CB 3.42Å; Y31-I34 PolarHBondContact O-N 3.1Å; I34-G36 VanDerWaalsContact C-N 3.26Å; I34-G36 PolarHBondContact O-N 3.11Å; I34-G37 PolarHBondContact O-N 3.42Å; I34-L42 HydrophobicContact CG1-CD1 4.1Å; I34-F59 HydrophobicContact CD1-CD1 3.75Å; I34-F59 HydrophobicContact CD1-CE1 4.11Å; I34-F59 HydrophobicContact CG1-CD1 4.32Å; I34-I62 HydrophobicContact CD1-CG2 4.12Å; I34-I62 HydrophobicContact CG2-CG2 3.81Å; I34-Q63 HydrophobicContact CG2-CB 4.28Å; I34-F66 HydrophobicContact CG2-CD2 3.5Å; I34-F66 VanDerWaalsContact CG2-CD2 3.5Å; I34-F66 HydrophobicContact CG2-CE2 4.03Å; I34-F66 HydrophobicContact CG2-CG 4.34Å |
| 35 | L | 92.1 | Very high | 91 | Very high | 23 Ų | 23 | 52 Ų | 52 | 12% | 0.12 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -59.3 | -38.1 | -179.5 | -67.4 | -176.7 | 0 | 0 | 0 | 112.7 | Y31 V32 G37 F66 K74 P78 | Y31-L35 HydrophobicContact CD1-CD1 3.95Å; Y31-L35 HydrophobicContact CD1-CG 4.4Å; Y31-L35 HydrophobicContact CE1-CD1 3.37Å; Y31-L35 HydrophobicContact CE1-CG 4.05Å; Y31-L35 PolarHBondContact O-N 3.23Å; V32-L35 PolarHBondContact O-N 2.92Å; L35-G37 PolarHBondContact O-N 2.86Å; L35-F66 HydrophobicContact CD2-CD1 3.51Å; L35-F66 HydrophobicContact CD2-CD2 4.34Å; L35-F66 HydrophobicContact CD2-CE1 3.57Å; L35-F66 HydrophobicContact CD2-CE2 4.39Å; L35-F66 HydrophobicContact CD2-CG 3.92Å; L35-F66 HydrophobicContact CD2-CZ 4.02Å; L35-K74 PolarHBondContact O-NZ 3Å; L35-P78 HydrophobicContact CD1-CG 3.66Å |
| 36 | G | 90.6 | Very high | 91.5 | Very high | 60 Ų | 60 | 49 Ų | 49 | 62% | 0.619 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | -14.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | V32 K33 I34 N38 | V32-G36 PolarHBondContact O-N 3.42Å; K33-G36 PolarHBondContact O-N 3.41Å; I34-G36 VanDerWaalsContact C-N 3.26Å; I34-G36 PolarHBondContact O-N 3.11Å; G36-N38 PolarHBondContact O-N 2.98Å |
| 37 | G | 91.9 | Very high | 91.9 | Very high | 22 Ų | 22 | 49.6 Ų | 49.6 | 23% | 0.227 | 29% | 0.29 | C | S | . | . | trans | 70.9 | -1.2 | 171.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | K33 I34 L35 N67 | K33-G37 PolarHBondContact O-N 3.42Å; I34-G37 PolarHBondContact O-N 3.42Å; L35-G37 PolarHBondContact O-N 2.86Å; G37-N67 WeakPolarHBondContact CA-OD1 3.4Å; G37-N67 PolarHBondContact O-ND2 3.46Å | ||
| 38 | N | 94.5 | Very high | 92.1 | Very high | 87 Ų | 87 | 51.5 Ų | 51.5 | 47% | 0.465 | 30% | 0.302 | S | S | . | . | trans | -89.9 | 113.3 | -178.7 | -174.9 | -45.6 | 0 | 0 | 0 | 111.3 | G36 L40 A41 L42 Q63 | G36-N38 PolarHBondContact O-N 2.98Å; N38-L40 PolarHBondContact O-N 2.76Å; N38-L40 WeakPolarHBondContact OD1-CB 3.35Å; N38-L40 PolarHBondContact OD1-N 3.45Å; N38-A41 HydrophobicContact CB-CB 3.97Å; N38-A41 PolarHBondContact O-N 2.81Å; N38-A41 PolarHBondContact OD1-N 2.71Å; N38-L42 PolarHBondContact O-N 2.7Å; N38-Q63 PolarHBondContact O-NE2 3.33Å | ||
| 39 | R | 94.6 | Very high | 92.2 | Very high | 96 Ų | 96 | 53.1 Ų | 53.1 | 36% | 0.362 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.6 | -40.2 | -178.1 | -152.8 | 91.2 | 165.8 | -171.6 | -3.4 | 113.5 | N43 E60 D64 | R39-N43 WeakPolarHBondContact O-CB 3.39Å; R39-N43 PolarHBondContact O-N 3.35Å; R39-N43 PolarHBondContact O-ND2 3.34Å; R39-E60 HydrophobicContact CG-CG 4.5Å; R39-E60 VanDerWaalsContact CZ-CG 3.44Å; R39-E60 IonicContact CZ-OE1 3.84Å; R39-E60 IonicContact CZ-OE2 3.93Å; R39-E60 VanDerWaalsContact CZ-OE2 3.31Å; R39-E60 VanDerWaalsContact NE-CG 3.25Å; R39-E60 IonicContact NE-OE1 3.31Å; R39-E60 PolarHBondContact NE-OE1 2.81Å; R39-E60 VanDerWaalsContact NE-OE1 3.1Å; R39-E60 IonicContact NE-OE2 3.1Å; R39-E60 PolarHBondContact NE-OE2 3.03Å; R39-E60 IonicContact NH2-OE1 3.95Å; R39-E60 IonicContact NH2-OE2 2.81Å; R39-E60 PolarHBondContact NH2-OE2 2.74Å; R39-D64 IonicContact CZ-OD2 2.71Å; R39-D64 IonicContact NH1-OD1 2.81Å; R39-D64 PolarHBondContact NH1-OD1 3.1Å; R39-D64 IonicContact NH1-OD2 3.86Å; R39-D64 PolarHBondContact NH1-OD2 3.01Å; R39-D64 IonicContact NH2-OD2 3.35Å |
| 40 | L | 95.9 | Very high | 92 | Very high | 144 Ų | 144 | 59.1 Ų | 59.1 | 75% | 0.754 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -66.5 | -44.2 | 178.8 | -80.6 | 160.6 | 0 | 0 | 0 | 110.6 | N38 N43 A44 | N38-L40 PolarHBondContact O-N 2.76Å; N38-L40 WeakPolarHBondContact OD1-CB 3.35Å; N38-L40 PolarHBondContact OD1-N 3.45Å; L40-N43 PolarHBondContact O-N 2.97Å; L40-A44 VanDerWaalsContact O-CB 3.25Å; L40-A44 WeakPolarHBondContact O-CB 3.36Å; L40-A44 PolarHBondContact O-N 3.33Å |
| 41 | A | 95.1 | Very high | 91.8 | Very high | 32 Ų | 32 | 59 Ų | 59 | 26% | 0.264 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65.1 | -40.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112 | K33 N38 Y45 | K33-A41 HydrophobicContact CD-CB 4.14Å; N38-A41 HydrophobicContact CB-CB 3.97Å; N38-A41 PolarHBondContact O-N 2.81Å; N38-A41 PolarHBondContact OD1-N 2.71Å; A41-Y45 WeakPolarHBondContact O-CB 3.35Å; A41-Y45 PolarHBondContact O-N 3.46Å; A41-Y45 VanDerWaalsContact O-N 3.14Å |
| 42 | L | 95 | Very high | 91.9 | Very high | 0 Ų | 0 | 59.5 Ų | 59.5 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -63.5 | -50.7 | 174.5 | 177.6 | 61.1 | 0 | 0 | 0 | 111.3 | K33 I34 N38 A44 Y45 L46 F59 E60 Q63 | K33-L42 HydrophobicContact CB-CB 4.32Å; K33-L42 HydrophobicContact CB-CD1 4.06Å; I34-L42 HydrophobicContact CG1-CD1 4.1Å; N38-L42 PolarHBondContact O-N 2.7Å; L42-A44 PolarHBondContact O-N 3Å; L42-Y45 WeakPolarHBondContact O-CB 3.3Å; L42-Y45 PolarHBondContact O-N 3.28Å; L42-L46 HydrophobicContact CD1-CD1 4.06Å; L42-L46 HydrophobicContact CD1-CG 4.19Å; L42-L46 HydrophobicContact CG-CD1 4.03Å; L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 3.12Å; L42-F59 HydrophobicContact CD1-CB 4.39Å; L42-F59 HydrophobicContact CD2-CB 4.19Å; L42-E60 HydrophobicContact CD2-CG 4.34Å; L42-Q63 HydrophobicContact CD2-CB 3.97Å; L42-Q63 HydrophobicContact CD2-CG 4.46Å |
| 43 | N | 94.8 | Very high | 91.9 | Very high | 29 Ų | 29 | 59.3 Ų | 59.3 | 16% | 0.155 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -65 | -37.1 | -179.9 | -85.6 | -67.7 | 0 | 0 | 0 | 113.6 | R39 L40 Y45 L46 S47 R56 E60 | R39-N43 WeakPolarHBondContact O-CB 3.39Å; R39-N43 PolarHBondContact O-N 3.35Å; R39-N43 PolarHBondContact O-ND2 3.34Å; L40-N43 PolarHBondContact O-N 2.97Å; N43-Y45 VanDerWaalsContact C-N 3.31Å; N43-L46 PolarHBondContact O-N 3.44Å; N43-S47 WeakPolarHBondContact O-CB 3.49Å; N43-S47 PolarHBondContact O-N 2.99Å; N43-S47 PolarHBondContact O-OG 2.95Å; N43-R56 PolarHBondContact OD1-NH1 3.32Å; N43-E60 PolarHBondContact ND2-OE1 3.43Å |
| 44 | A | 94.6 | Very high | 91.8 | Very high | 58 Ų | 58 | 59.1 Ų | 59.1 | 48% | 0.479 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111 | L40 L42 S47 | L40-A44 VanDerWaalsContact O-CB 3.25Å; L40-A44 WeakPolarHBondContact O-CB 3.36Å; L40-A44 PolarHBondContact O-N 3.33Å; L42-A44 PolarHBondContact O-N 3Å; A44-S47 WeakPolarHBondContact O-CB 3.47Å; A44-S47 PolarHBondContact O-N 3.21Å |
| 45 | Y | 92.5 | Very high | 91.5 | Very high | 38 Ų | 38 | 59.9 Ų | 59.9 | 15% | 0.149 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -63.9 | -49.6 | 176.7 | -169.7 | -101.8 | 0 | 0 | 0 | 112.2 | P26 G29 A30 K33 A41 L42 N43 S47 M48 F49 | P26-Y45 WeakPolarHBondContact CA-OH 3.32Å; P26-Y45 WeakPolarHBondContact O-CE1 3.41Å; P26-Y45 PolarHBondContact O-OH 2.85Å; P26-Y45 VanDerWaalsContact O-OH 3.05Å; G29-Y45 WeakPolarHBondContact CA-OH 3.45Å; A30-Y45 HydrophobicContact CB-CD1 4.15Å; A30-Y45 HydrophobicContact CB-CE1 3.84Å; K33-Y45 HydrophobicContact CG-CG 4.25Å; A41-Y45 WeakPolarHBondContact O-CB 3.35Å; A41-Y45 PolarHBondContact O-N 3.46Å; A41-Y45 VanDerWaalsContact O-N 3.14Å; L42-Y45 WeakPolarHBondContact O-CB 3.3Å; L42-Y45 PolarHBondContact O-N 3.28Å; N43-Y45 VanDerWaalsContact C-N 3.31Å; Y45-S47 PolarHBondContact O-N 3.37Å; Y45-M48 HydrophobicContact CD2-SD 4.35Å; Y45-M48 VanDerWaalsContact O-CB 3.31Å; Y45-M48 WeakPolarHBondContact O-CB 3.37Å; Y45-M48 PolarHBondContact O-N 3.2Å; Y45-F49 HydrophobicContact CD1-CE2 4.05Å; Y45-F49 HydrophobicContact CE1-CD2 4.37Å; Y45-F49 AromaticContact CE1-CE2 3.56Å; Y45-F49 HydrophobicContact CE1-CE2 3.56Å; Y45-F49 HydrophobicContact CE1-CZ 4.33Å; Y45-F49 HydrophobicContact CE2-CE2 4.26Å; Y45-F49 AromaticContact CZ-CE2 3.69Å; Y45-F49 WeakPolarHBondContact O-CD2 3.34Å |
| 46 | L | 91.4 | Very high | 91.5 | Very high | 5 Ų | 5 | 62 Ų | 62 | 3% | 0.026 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -62 | -27.1 | 178.1 | -66.7 | 176.2 | 0 | 0 | 0 | 113.1 | L42 N43 M48 F49 Q50 A51 R56 F59 | L42-L46 HydrophobicContact CD1-CD1 4.06Å; L42-L46 HydrophobicContact CD1-CG 4.19Å; L42-L46 HydrophobicContact CG-CD1 4.03Å; L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 3.12Å; N43-L46 PolarHBondContact O-N 3.44Å; L46-M48 VanDerWaalsContact C-N 3.27Å; L46-M48 PolarHBondContact O-N 3.3Å; L46-F49 PolarHBondContact O-N 3.18Å; L46-F49 VanDerWaalsContact O-N 3.15Å; L46-Q50 PolarHBondContact O-N 2.98Å; L46-A51 HydrophobicContact CB-CB 3.77Å; L46-A51 WeakPolarHBondContact O-CB 3.39Å; L46-A51 PolarHBondContact O-N 3.43Å; L46-A51 VanDerWaalsContact O-N 3.14Å; L46-R56 HydrophobicContact CD1-CG 4.2Å; L46-F59 HydrophobicContact CD1-CB 3.71Å; L46-F59 HydrophobicContact CD1-CD2 4.05Å; L46-F59 HydrophobicContact CD1-CG 3.93Å; L46-F59 HydrophobicContact CD2-CD1 4.35Å; L46-F59 HydrophobicContact CD2-CD2 3.85Å; L46-F59 HydrophobicContact CD2-CE1 4.48Å; L46-F59 HydrophobicContact CD2-CE2 4Å; L46-F59 HydrophobicContact CD2-CG 4.05Å; L46-F59 HydrophobicContact CD2-CZ 4.32Å |
| 47 | S | 91.6 | Very high | 91.7 | Very high | 54 Ų | 54 | 62.5 Ų | 62.5 | 38% | 0.378 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -66.2 | -29.2 | 175.9 | -59.8 | 0 | 0 | 0 | 0 | 112.7 | N43 A44 Y45 F49 Q50 R56 | N43-S47 WeakPolarHBondContact O-CB 3.49Å; N43-S47 PolarHBondContact O-N 2.99Å; N43-S47 PolarHBondContact O-OG 2.95Å; A44-S47 WeakPolarHBondContact O-CB 3.47Å; A44-S47 PolarHBondContact O-N 3.21Å; Y45-S47 PolarHBondContact O-N 3.37Å; S47-F49 PolarHBondContact O-N 3.49Å; S47-Q50 PolarHBondContact O-N 3.14Å; S47-Q50 VanDerWaalsContact O-N 3.11Å; S47-R56 PolarHBondContact OG-NH1 3.12Å; S47-R56 PolarHBondContact OG-NH2 3.1Å |
| 48 | M | 88.7 | Confident | 91.7 | Very high | 143 Ų | 143 | 63.9 Ų | 63.9 | 70% | 0.704 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -62.2 | -25.3 | 174.5 | -59.3 | 178.1 | 176.5 | 0 | 0 | 112 | Y45 L46 | Y45-M48 HydrophobicContact CD2-SD 4.35Å; Y45-M48 VanDerWaalsContact O-CB 3.31Å; Y45-M48 WeakPolarHBondContact O-CB 3.37Å; Y45-M48 PolarHBondContact O-N 3.2Å; L46-M48 VanDerWaalsContact C-N 3.27Å; L46-M48 PolarHBondContact O-N 3.3Å |
| 49 | F | 86.2 | Confident | 91.7 | Very high | 91 Ų | 91 | 62 Ų | 62 | 40% | 0.399 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.7 | 11.9 | 179.5 | -55.5 | -80.1 | 0 | 0 | 0 | 113.1 | P26 Y45 L46 S47 A51 | P26-F49 HydrophobicContact CB-CE1 3.93Å; P26-F49 HydrophobicContact CB-CZ 3.79Å; P26-F49 HydrophobicContact CG-CE1 4.08Å; P26-F49 HydrophobicContact CG-CZ 4.16Å; Y45-F49 HydrophobicContact CD1-CE2 4.05Å; Y45-F49 HydrophobicContact CE1-CD2 4.37Å; Y45-F49 AromaticContact CE1-CE2 3.56Å; Y45-F49 HydrophobicContact CE1-CE2 3.56Å; Y45-F49 HydrophobicContact CE1-CZ 4.33Å; Y45-F49 HydrophobicContact CE2-CE2 4.26Å; Y45-F49 AromaticContact CZ-CE2 3.69Å; Y45-F49 WeakPolarHBondContact O-CD2 3.34Å; L46-F49 PolarHBondContact O-N 3.18Å; L46-F49 VanDerWaalsContact O-N 3.15Å; S47-F49 PolarHBondContact O-N 3.49Å; F49-A51 PolarHBondContact O-N 3.06Å |
| 50 | Q | 85.3 | Confident | 91.7 | Very high | 144 Ų | 144 | 58.7 Ų | 58.7 | 67% | 0.673 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.4 | 34.1 | -178.4 | -56 | 176.4 | 29.1 | 0 | 0 | 113.3 | L46 S47 T52 | L46-Q50 PolarHBondContact O-N 2.98Å; S47-Q50 PolarHBondContact O-N 3.14Å; S47-Q50 VanDerWaalsContact O-N 3.11Å; Q50-T52 PolarHBondContact O-N 2.97Å |
| 51 | A | 85.4 | Confident | 91.6 | Very high | 7 Ų | 7 | 58.2 Ų | 58.2 | 6% | 0.058 | 33% | 0.332 | C | S | . | . | trans | -56.1 | 130.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | L46 F49 E55 R56 | L46-A51 HydrophobicContact CB-CB 3.77Å; L46-A51 WeakPolarHBondContact O-CB 3.39Å; L46-A51 PolarHBondContact O-N 3.43Å; L46-A51 VanDerWaalsContact O-N 3.14Å; F49-A51 PolarHBondContact O-N 3.06Å; A51-E55 HydrophobicContact CB-CB 4.28Å; A51-R56 HydrophobicContact CB-CG 4.2Å; A51-R56 PolarHBondContact O-NE 3.25Å | ||
| 52 | T | 90.7 | Very high | 91.5 | Very high | 44 Ų | 44 | 60.3 Ų | 60.3 | 27% | 0.27 | 34% | 0.338 | S | S | . | . | trans | -64.3 | 162.7 | 175.8 | 65 | 0 | 0 | 0 | 0 | 111.4 | Q50 A54 E55 R56 | Q50-T52 PolarHBondContact O-N 2.97Å; T52-A54 PolarHBondContact O-N 3.22Å; T52-E55 VanDerWaalsContact CB-OE2 3.31Å; T52-E55 WeakPolarHBondContact CB-OE2 3.46Å; T52-E55 WeakPolarHBondContact CG2-OE2 3.45Å; T52-E55 PolarHBondContact N-OE2 3.05Å; T52-E55 PolarHBondContact O-N 3.15Å; T52-E55 VanDerWaalsContact OG1-CD 3.3Å; T52-E55 WeakPolarHBondContact OG1-CG 3.44Å; T52-E55 PolarHBondContact OG1-N 3.38Å; T52-E55 PolarHBondContact OG1-OE2 2.91Å; T52-R56 WeakPolarHBondContact O-CG 3.31Å; T52-R56 PolarHBondContact O-N 3.45Å | ||
| 53 | A | 92.3 | Very high | 91.5 | Very high | 78 Ų | 78 | 60.3 Ų | 60.3 | 65% | 0.645 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -57 | -39.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | R56 V57 | A53-R56 PolarHBondContact O-N 3.3Å; A53-V57 WeakPolarHBondContact O-CG2 3.43Å; A53-V57 PolarHBondContact O-N 2.98Å; A53-V57 VanDerWaalsContact O-N 3.12Å |
| 54 | A | 90.5 | Very high | 91.5 | Very high | 77 Ų | 77 | 61.8 Ų | 61.8 | 64% | 0.636 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -66.3 | -41.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | T52 V57 A58 | T52-A54 PolarHBondContact O-N 3.22Å; A54-V57 PolarHBondContact O-N 2.96Å; A54-A58 PolarHBondContact O-N 2.84Å |
| 55 | E | 87.4 | Confident | 91.4 | Very high | 26 Ų | 26 | 62.6 Ų | 62.6 | 12% | 0.121 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -65 | -42.8 | 176.8 | -72.7 | 161.8 | 141.1 | 0 | 0 | 111.4 | G3 L6 A51 T52 V57 A58 F59 | G3-E55 VanDerWaalsContact CA-OE1 3.27Å; G3-E55 WeakPolarHBondContact CA-OE1 3.36Å; G3-E55 VanDerWaalsContact O-OE1 3.14Å; L6-E55 WeakPolarHBondContact CB-OE1 3.21Å; A51-E55 HydrophobicContact CB-CB 4.28Å; T52-E55 VanDerWaalsContact CB-OE2 3.31Å; T52-E55 WeakPolarHBondContact CB-OE2 3.46Å; T52-E55 WeakPolarHBondContact CG2-OE2 3.45Å; T52-E55 PolarHBondContact N-OE2 3.05Å; T52-E55 PolarHBondContact O-N 3.15Å; T52-E55 VanDerWaalsContact OG1-CD 3.3Å; T52-E55 WeakPolarHBondContact OG1-CG 3.44Å; T52-E55 PolarHBondContact OG1-N 3.38Å; T52-E55 PolarHBondContact OG1-OE2 2.91Å; E55-V57 VanDerWaalsContact C-N 3.33Å; E55-V57 PolarHBondContact O-N 3.45Å; E55-A58 WeakPolarHBondContact O-CB 3.3Å; E55-A58 PolarHBondContact O-N 2.87Å; E55-A58 VanDerWaalsContact O-N 3.1Å; E55-F59 WeakPolarHBondContact O-CD2 3.12Å; E55-F59 PolarHBondContact O-N 3.47Å |
| 56 | R | 92.3 | Very high | 91.3 | Very high | 68 Ų | 68 | 62.8 Ų | 62.8 | 26% | 0.257 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -56.5 | -49 | 175.4 | -69 | 169.1 | -174.8 | -117.1 | 1.2 | 111.2 | N43 L46 S47 A51 T52 A53 A58 F59 E60 | N43-R56 PolarHBondContact OD1-NH1 3.32Å; L46-R56 HydrophobicContact CD1-CG 4.2Å; S47-R56 PolarHBondContact OG-NH1 3.12Å; S47-R56 PolarHBondContact OG-NH2 3.1Å; A51-R56 HydrophobicContact CB-CG 4.2Å; A51-R56 PolarHBondContact O-NE 3.25Å; T52-R56 WeakPolarHBondContact O-CG 3.31Å; T52-R56 PolarHBondContact O-N 3.45Å; A53-R56 PolarHBondContact O-N 3.3Å; R56-A58 VanDerWaalsContact C-N 3.25Å; R56-A58 PolarHBondContact O-N 3.48Å; R56-F59 PolarHBondContact O-N 2.93Å; R56-E60 VanDerWaalsContact O-CB 3.24Å; R56-E60 WeakPolarHBondContact O-CB 3.42Å; R56-E60 WeakPolarHBondContact O-CG 2.92Å; R56-E60 PolarHBondContact O-N 3.49Å |
| 57 | V | 94.4 | Very high | 91.3 | Very high | 69 Ų | 69 | 65.9 Ų | 65.9 | 42% | 0.418 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.2 | -37.2 | 177.4 | 170.9 | 0 | 0 | 0 | 0 | 111.7 | A53 A54 E55 K61 | A53-V57 WeakPolarHBondContact O-CG2 3.43Å; A53-V57 PolarHBondContact O-N 2.98Å; A53-V57 VanDerWaalsContact O-N 3.12Å; A54-V57 PolarHBondContact O-N 2.96Å; E55-V57 VanDerWaalsContact C-N 3.33Å; E55-V57 PolarHBondContact O-N 3.45Å; V57-K61 WeakPolarHBondContact O-CG 3.25Å; V57-K61 PolarHBondContact O-N 2.99Å; V57-K61 VanDerWaalsContact O-N 3.08Å |
| 58 | A | 93.6 | Very high | 91.3 | Very high | 51 Ų | 51 | 71.1 Ų | 71.1 | 42% | 0.421 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -65.2 | -49.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | A54 E55 R56 E60 K61 I62 | A54-A58 PolarHBondContact O-N 2.84Å; E55-A58 WeakPolarHBondContact O-CB 3.3Å; E55-A58 PolarHBondContact O-N 2.87Å; E55-A58 VanDerWaalsContact O-N 3.1Å; R56-A58 VanDerWaalsContact C-N 3.25Å; R56-A58 PolarHBondContact O-N 3.48Å; A58-E60 VanDerWaalsContact C-N 3.29Å; A58-E60 PolarHBondContact O-N 3.42Å; A58-K61 PolarHBondContact O-N 3.49Å; A58-I62 WeakPolarHBondContact O-CG1 3.45Å; A58-I62 PolarHBondContact O-N 3.16Å |
| 59 | F | 92.9 | Very high | 91.4 | Very high | 48 Ų | 48 | 68.9 Ų | 68.9 | 21% | 0.211 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.4 | -37.7 | 177.5 | -87.1 | -81.7 | 0 | 0 | 0 | 112.8 | A30 I34 L42 L46 E55 R56 I62 Q63 | A30-F59 HydrophobicContact CB-CE1 4.11Å; I34-F59 HydrophobicContact CD1-CD1 3.75Å; I34-F59 HydrophobicContact CD1-CE1 4.11Å; I34-F59 HydrophobicContact CG1-CD1 4.32Å; L42-F59 HydrophobicContact CD1-CB 4.39Å; L42-F59 HydrophobicContact CD2-CB 4.19Å; L46-F59 HydrophobicContact CD1-CB 3.71Å; L46-F59 HydrophobicContact CD1-CD2 4.05Å; L46-F59 HydrophobicContact CD1-CG 3.93Å; L46-F59 HydrophobicContact CD2-CD1 4.35Å; L46-F59 HydrophobicContact CD2-CD2 3.85Å; L46-F59 HydrophobicContact CD2-CE1 4.48Å; L46-F59 HydrophobicContact CD2-CE2 4Å; L46-F59 HydrophobicContact CD2-CG 4.05Å; L46-F59 HydrophobicContact CD2-CZ 4.32Å; E55-F59 WeakPolarHBondContact O-CD2 3.12Å; E55-F59 PolarHBondContact O-N 3.47Å; R56-F59 PolarHBondContact O-N 2.93Å; F59-I62 PolarHBondContact O-N 3Å; F59-Q63 PolarHBondContact O-N 3.28Å |
| 60 | E | 94.4 | Very high | 91.4 | Very high | 26 Ų | 26 | 68 Ų | 68 | 12% | 0.121 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.2 | -42.5 | 175.7 | -81.5 | -177.5 | 165.1 | 0 | 0 | 112.7 | R39 L42 N43 R56 A58 I62 Q63 D64 | R39-E60 HydrophobicContact CG-CG 4.5Å; R39-E60 VanDerWaalsContact CZ-CG 3.44Å; R39-E60 IonicContact CZ-OE1 3.84Å; R39-E60 IonicContact CZ-OE2 3.93Å; R39-E60 VanDerWaalsContact CZ-OE2 3.31Å; R39-E60 VanDerWaalsContact NE-CG 3.25Å; R39-E60 IonicContact NE-OE1 3.31Å; R39-E60 PolarHBondContact NE-OE1 2.81Å; R39-E60 VanDerWaalsContact NE-OE1 3.1Å; R39-E60 IonicContact NE-OE2 3.1Å; R39-E60 PolarHBondContact NE-OE2 3.03Å; R39-E60 IonicContact NH2-OE1 3.95Å; R39-E60 IonicContact NH2-OE2 2.81Å; R39-E60 PolarHBondContact NH2-OE2 2.74Å; L42-E60 HydrophobicContact CD2-CG 4.34Å; N43-E60 PolarHBondContact ND2-OE1 3.43Å; R56-E60 VanDerWaalsContact O-CB 3.24Å; R56-E60 WeakPolarHBondContact O-CB 3.42Å; R56-E60 WeakPolarHBondContact O-CG 2.92Å; R56-E60 PolarHBondContact O-N 3.49Å; A58-E60 VanDerWaalsContact C-N 3.29Å; A58-E60 PolarHBondContact O-N 3.42Å; E60-I62 VanDerWaalsContact C-N 3.31Å; E60-I62 PolarHBondContact O-N 2.88Å; E60-Q63 WeakPolarHBondContact O-CB 3.45Å; E60-Q63 PolarHBondContact O-N 3.42Å; E60-D64 PolarHBondContact O-N 3.05Å |
| 61 | K | 94.8 | Very high | 91.3 | Very high | 135 Ų | 135 | 67.8 Ų | 67.8 | 59% | 0.587 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -62.5 | -38.4 | 174.5 | -74 | 176.7 | 179.1 | -173.7 | 0 | 112.4 | V57 A58 Q63 D64 C65 | V57-K61 WeakPolarHBondContact O-CG 3.25Å; V57-K61 PolarHBondContact O-N 2.99Å; V57-K61 VanDerWaalsContact O-N 3.08Å; A58-K61 PolarHBondContact O-N 3.49Å; K61-Q63 VanDerWaalsContact C-N 3.33Å; K61-D64 PolarHBondContact O-N 3.33Å; K61-C65 PolarHBondContact O-N 3.46Å; K61-C65 PolarHBondContact O-SG 3.2Å; K61-C65 VanDerWaalsContact O-SG 3.34Å |
| 62 | I | 92.9 | Very high | 91.1 | Very high | 76 Ų | 76 | 72 Ų | 72 | 39% | 0.39 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.9 | -43.2 | 175.2 | -59.2 | 167.3 | 0 | 0 | 0 | 109.7 | I34 A58 F59 E60 D64 C65 F66 | I34-I62 HydrophobicContact CD1-CG2 4.12Å; I34-I62 HydrophobicContact CG2-CG2 3.81Å; A58-I62 WeakPolarHBondContact O-CG1 3.45Å; A58-I62 PolarHBondContact O-N 3.16Å; F59-I62 PolarHBondContact O-N 3Å; E60-I62 VanDerWaalsContact C-N 3.31Å; E60-I62 PolarHBondContact O-N 2.88Å; I62-D64 VanDerWaalsContact C-N 3.31Å; I62-D64 PolarHBondContact O-N 3.16Å; I62-C65 WeakPolarHBondContact O-CB 3.45Å; I62-C65 PolarHBondContact O-N 3.26Å; I62-F66 HydrophobicContact CG2-CD2 4.1Å; I62-F66 HydrophobicContact CG2-CE2 4.04Å; I62-F66 WeakPolarHBondContact O-CD2 3.4Å; I62-F66 PolarHBondContact O-N 3.3Å; I62-F66 VanDerWaalsContact O-N 3.12Å |
| 63 | Q | 94.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 72.3 Ų | 72.3 | 0% | 0 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -61.2 | -39.7 | 174.9 | 177.7 | 174.2 | 81.4 | 0 | 0 | 112 | K33 I34 N38 L42 F59 E60 K61 F66 N67 | K33-Q63 PolarHBondContact O-NE2 2.93Å; I34-Q63 HydrophobicContact CG2-CB 4.28Å; N38-Q63 PolarHBondContact O-NE2 3.33Å; L42-Q63 HydrophobicContact CD2-CB 3.97Å; L42-Q63 HydrophobicContact CD2-CG 4.46Å; F59-Q63 PolarHBondContact O-N 3.28Å; E60-Q63 WeakPolarHBondContact O-CB 3.45Å; E60-Q63 PolarHBondContact O-N 3.42Å; K61-Q63 VanDerWaalsContact C-N 3.33Å; Q63-F66 PolarHBondContact O-N 3.38Å; Q63-N67 WeakPolarHBondContact O-CB 3.44Å; Q63-N67 PolarHBondContact O-N 3.21Å; Q63-N67 PolarHBondContact O-ND2 3.46Å |
| 64 | D | 95.3 | Very high | 90.2 | Very high | 59 Ų | 59 | 70 Ų | 70 | 32% | 0.316 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.2 | -46.1 | 175.8 | -65.6 | -25.7 | 0 | 0 | 0 | 110.9 | R39 E60 K61 I62 F66 N67 E68 | R39-D64 IonicContact CZ-OD2 2.71Å; R39-D64 IonicContact NH1-OD1 2.81Å; R39-D64 PolarHBondContact NH1-OD1 3.1Å; R39-D64 IonicContact NH1-OD2 3.86Å; R39-D64 PolarHBondContact NH1-OD2 3.01Å; R39-D64 IonicContact NH2-OD2 3.35Å; E60-D64 PolarHBondContact O-N 3.05Å; K61-D64 PolarHBondContact O-N 3.33Å; I62-D64 VanDerWaalsContact C-N 3.31Å; I62-D64 PolarHBondContact O-N 3.16Å; D64-F66 VanDerWaalsContact C-N 3.3Å; D64-F66 PolarHBondContact O-N 3.49Å; D64-N67 WeakPolarHBondContact O-CB 3.46Å; D64-N67 PolarHBondContact O-N 2.98Å; D64-E68 WeakPolarHBondContact O-CG 3.46Å; D64-E68 PolarHBondContact O-N 2.8Å |
| 65 | C | 92.1 | Very high | 89.7 | Confident | 76 Ų | 76 | 72.7 Ų | 72.7 | 51% | 0.514 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -55.5 | -43.6 | 174.1 | -67.1 | 0 | 0 | 0 | 0 | 112.3 | K61 I62 E68 E69 | K61-C65 PolarHBondContact O-N 3.46Å; K61-C65 PolarHBondContact O-SG 3.2Å; K61-C65 VanDerWaalsContact O-SG 3.34Å; I62-C65 WeakPolarHBondContact O-CB 3.45Å; I62-C65 PolarHBondContact O-N 3.26Å; C65-E68 PolarHBondContact O-N 2.93Å; C65-E69 WeakPolarHBondContact O-CG 3.09Å; C65-E69 PolarHBondContact O-N 2.92Å |
| 66 | F | 90.8 | Very high | 89.6 | Confident | 42 Ų | 42 | 77.9 Ų | 77.9 | 18% | 0.184 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -68.9 | -34.8 | 175.8 | -84.2 | -73.9 | 0 | 0 | 0 | 112.4 | I34 L35 I62 Q63 D64 E68 E69 K74 S77 | I34-F66 HydrophobicContact CG2-CD2 3.5Å; I34-F66 VanDerWaalsContact CG2-CD2 3.5Å; I34-F66 HydrophobicContact CG2-CE2 4.03Å; I34-F66 HydrophobicContact CG2-CG 4.34Å; L35-F66 HydrophobicContact CD2-CD1 3.51Å; L35-F66 HydrophobicContact CD2-CD2 4.34Å; L35-F66 HydrophobicContact CD2-CE1 3.57Å; L35-F66 HydrophobicContact CD2-CE2 4.39Å; L35-F66 HydrophobicContact CD2-CG 3.92Å; L35-F66 HydrophobicContact CD2-CZ 4.02Å; I62-F66 HydrophobicContact CG2-CD2 4.1Å; I62-F66 HydrophobicContact CG2-CE2 4.04Å; I62-F66 WeakPolarHBondContact O-CD2 3.4Å; I62-F66 PolarHBondContact O-N 3.3Å; I62-F66 VanDerWaalsContact O-N 3.12Å; Q63-F66 PolarHBondContact O-N 3.38Å; D64-F66 VanDerWaalsContact C-N 3.3Å; D64-F66 PolarHBondContact O-N 3.49Å; F66-E68 VanDerWaalsContact C-N 3.26Å; F66-E68 PolarHBondContact O-N 3.21Å; F66-E69 WeakPolarHBondContact O-CB 2.72Å; F66-E69 PolarHBondContact O-N 3.11Å; F66-E69 VanDerWaalsContact O-N 3.16Å; F66-K74 HydrophobicContact CD1-CG 4.36Å; F66-K74 WeakPolarHBondContact O-CE 3.46Å; F66-S77 WeakPolarHBondContact CE1-OG 3.43Å |
| 67 | N | 91.6 | Very high | 89 | Confident | 69 Ų | 69 | 75.1 Ų | 75.1 | 37% | 0.369 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -67.3 | -27.1 | 178.7 | -75.7 | -19.2 | 0 | 0 | 0 | 113.3 | G37 Q63 D64 E69 K74 | G37-N67 WeakPolarHBondContact CA-OD1 3.4Å; G37-N67 PolarHBondContact O-ND2 3.46Å; Q63-N67 WeakPolarHBondContact O-CB 3.44Å; Q63-N67 PolarHBondContact O-N 3.21Å; Q63-N67 PolarHBondContact O-ND2 3.46Å; D64-N67 WeakPolarHBondContact O-CB 3.46Å; D64-N67 PolarHBondContact O-N 2.98Å; N67-E69 VanDerWaalsContact C-N 3.31Å; N67-K74 PolarHBondContact OD1-NZ 3.48Å |
| 68 | E | 92.2 | Very high | 88.4 | Confident | 165 Ų | 165 | 74.3 Ų | 74.3 | 77% | 0.771 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -76.1 | -20.8 | 173.3 | -67 | 177.5 | 152.4 | 0 | 0 | 112.5 | D64 C65 F66 | D64-E68 WeakPolarHBondContact O-CG 3.46Å; D64-E68 PolarHBondContact O-N 2.8Å; C65-E68 PolarHBondContact O-N 2.93Å; F66-E68 VanDerWaalsContact C-N 3.26Å; F66-E68 PolarHBondContact O-N 3.21Å |
| 69 | E | 89.1 | Confident | 87.7 | Confident | 96 Ų | 96 | 78 Ų | 78 | 45% | 0.449 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -78.9 | 152.1 | 179.2 | -72.8 | -71.5 | 146.6 | 0 | 0 | 113 | C65 F66 N67 T73 | C65-E69 WeakPolarHBondContact O-CG 3.09Å; C65-E69 PolarHBondContact O-N 2.92Å; F66-E69 WeakPolarHBondContact O-CB 2.72Å; F66-E69 PolarHBondContact O-N 3.11Å; F66-E69 VanDerWaalsContact O-N 3.16Å; N67-E69 VanDerWaalsContact C-N 3.31Å; E69-T73 HydrophobicContact CB-CG2 4.18Å; E69-T73 HydrophobicContact CG-CG2 4.21Å; E69-T73 WeakPolarHBondContact OE2-CG2 3.35Å; E69-T73 PolarHBondContact OE2-OG1 3.35Å |
| 70 | P | 87.6 | Confident | 87 | Confident | 72 Ų | 72 | 82.6 Ų | 82.6 | 47% | 0.468 | 43% | 0.426 | S | S | . | . | trans | -56.7 | 148.1 | 170.4 | -22.2 | 32.5 | 0 | 0 | 0 | 112.5 | T72 T73 K74 | P70-T72 PolarHBondContact O-N 3.22Å; P70-T72 VanDerWaalsContact O-N 3.08Å; P70-T73 WeakPolarHBondContact O-CA 3.18Å; P70-T73 WeakPolarHBondContact O-CB 3.07Å; P70-T73 PolarHBondContact O-N 2.96Å; P70-K74 PolarHBondContact O-N 3.38Å | ||
| 71 | L | 82.1 | Confident | 85.9 | Confident | 140 Ų | 140 | 84.9 Ų | 84.9 | 73% | 0.733 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -55.9 | -30.8 | 175.6 | -174 | 65.4 | 0 | 0 | 0 | 112.6 | K74 L75 | L71-K74 PolarHBondContact O-N 3.14Å; L71-L75 WeakPolarHBondContact O-CB 3.5Å; L71-L75 PolarHBondContact O-N 2.96Å |
| 72 | T | 82.1 | Confident | 84.2 | Confident | 94 Ų | 94 | 86.5 Ų | 86.5 | 58% | 0.577 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -65.3 | -35.9 | 175.6 | 51.1 | 0 | 0 | 0 | 0 | 112.6 | P70 K76 | P70-T72 PolarHBondContact O-N 3.22Å; P70-T72 VanDerWaalsContact O-N 3.08Å; T72-K76 WeakPolarHBondContact O-CB 3.37Å; T72-K76 VanDerWaalsContact O-CG 3.32Å; T72-K76 WeakPolarHBondContact O-CG 3.28Å; T72-K76 PolarHBondContact O-N 3.35Å |
| 73 | T | 81.3 | Confident | 83.7 | Confident | 51 Ų | 51 | 87.1 Ų | 87.1 | 31% | 0.313 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -64.4 | -52.6 | 172.5 | -57.2 | 0 | 0 | 0 | 0 | 109.3 | E69 P70 L75 K76 S77 | E69-T73 HydrophobicContact CB-CG2 4.18Å; E69-T73 HydrophobicContact CG-CG2 4.21Å; E69-T73 WeakPolarHBondContact OE2-CG2 3.35Å; E69-T73 PolarHBondContact OE2-OG1 3.35Å; P70-T73 WeakPolarHBondContact O-CA 3.18Å; P70-T73 WeakPolarHBondContact O-CB 3.07Å; P70-T73 PolarHBondContact O-N 2.96Å; T73-L75 VanDerWaalsContact C-N 3.27Å; T73-L75 PolarHBondContact O-N 3.05Å; T73-K76 PolarHBondContact O-N 3.18Å; T73-S77 PolarHBondContact O-N 3.04Å; T73-S77 PolarHBondContact O-OG 3.46Å |
| 74 | K | 81.5 | Confident | 83.2 | Confident | 31 Ų | 31 | 91.6 Ų | 91.6 | 14% | 0.135 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -55.1 | -39 | 179.1 | -68.3 | -173.5 | 168.1 | -153.4 | 0 | 113.6 | L35 F66 N67 P70 L71 P78 | L35-K74 PolarHBondContact O-NZ 3Å; F66-K74 HydrophobicContact CD1-CG 4.36Å; F66-K74 WeakPolarHBondContact O-CE 3.46Å; N67-K74 PolarHBondContact OD1-NZ 3.48Å; P70-K74 PolarHBondContact O-N 3.38Å; L71-K74 PolarHBondContact O-N 3.14Å; K74-P78 WeakPolarHBondContact O-CD 3.48Å |
| 75 | L | 81.1 | Confident | 82.5 | Confident | 133 Ų | 133 | 93.4 Ų | 93.4 | 70% | 0.696 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -75.8 | -26.8 | -178.6 | -162.3 | 71.3 | 0 | 0 | 0 | 112.7 | L71 T73 | L71-L75 WeakPolarHBondContact O-CB 3.5Å; L71-L75 PolarHBondContact O-N 2.96Å; T73-L75 VanDerWaalsContact C-N 3.27Å; T73-L75 PolarHBondContact O-N 3.05Å |
| 76 | K | 84.3 | Confident | 81.9 | Confident | 135 Ų | 135 | 94.5 Ų | 94.5 | 59% | 0.587 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -85.7 | -25.5 | 175.9 | -72.6 | -179.8 | 178.7 | -174.1 | 0 | 112.8 | T72 T73 Q79 | T72-K76 WeakPolarHBondContact O-CB 3.37Å; T72-K76 VanDerWaalsContact O-CG 3.32Å; T72-K76 WeakPolarHBondContact O-CG 3.28Å; T72-K76 PolarHBondContact O-N 3.35Å; T73-K76 PolarHBondContact O-N 3.18Å; K76-Q79 VanDerWaalsContact O-CB 3.28Å; K76-Q79 WeakPolarHBondContact O-CB 3.34Å; K76-Q79 PolarHBondContact O-N 3.25Å |
| 77 | S | 80.3 | Confident | 81.4 | Confident | 10 Ų | 10 | 97.8 Ų | 97.8 | 7% | 0.07 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -55.2 | -40.6 | -177.9 | -49 | 0 | 0 | 0 | 0 | 114.2 | Y31 F66 T73 Q79 I80 | Y31-S77 WeakPolarHBondContact OH-CB 3.32Å; Y31-S77 PolarHBondContact OH-O 3.14Å; F66-S77 WeakPolarHBondContact CE1-OG 3.43Å; T73-S77 PolarHBondContact O-N 3.04Å; T73-S77 PolarHBondContact O-OG 3.46Å; S77-Q79 PolarHBondContact O-N 3.21Å; S77-I80 WeakPolarHBondContact O-CB 3.45Å; S77-I80 PolarHBondContact O-N 3.22Å; S77-I80 VanDerWaalsContact O-N 3.11Å |
| 78 | P | 81.9 | Confident | 80.7 | Confident | 51 Ų | 51 | 99.7 Ų | 99.7 | 33% | 0.331 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -58.9 | -29.9 | 174.3 | -26.4 | 34.4 | 0 | 0 | 0 | 114.3 | Y31 L35 K74 I80 M81 T82 | Y31-P78 HydrophobicContact CE1-CG 4.29Å; L35-P78 HydrophobicContact CD1-CG 3.66Å; K74-P78 WeakPolarHBondContact O-CD 3.48Å; P78-I80 PolarHBondContact O-N 2.99Å; P78-M81 PolarHBondContact O-N 3.37Å; P78-M81 VanDerWaalsContact O-N 3.1Å; P78-T82 PolarHBondContact O-N 2.91Å; P78-T82 PolarHBondContact O-OG1 3.08Å |
| 79 | Q | 78.4 | Confident | 79.9 | Confident | 129 Ų | 129 | 95 Ų | 95 | 60% | 0.603 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -70.4 | -20.7 | -179.8 | -54.7 | 175.5 | 24.3 | 0 | 0 | 112.4 | K76 S77 M81 T82 | K76-Q79 VanDerWaalsContact O-CB 3.28Å; K76-Q79 WeakPolarHBondContact O-CB 3.34Å; K76-Q79 PolarHBondContact O-N 3.25Å; S77-Q79 PolarHBondContact O-N 3.21Å; Q79-M81 VanDerWaalsContact C-N 3.33Å; Q79-T82 PolarHBondContact O-OG1 3.06Å |
| 80 | I | 78.1 | Confident | 79.1 | Confident | 144 Ų | 144 | 94.9 Ų | 94.9 | 74% | 0.738 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -80.3 | -22.9 | 175 | -53.6 | 172.6 | 0 | 0 | 0 | 110.4 | S77 P78 | S77-I80 WeakPolarHBondContact O-CB 3.45Å; S77-I80 PolarHBondContact O-N 3.22Å; S77-I80 VanDerWaalsContact O-N 3.11Å; P78-I80 PolarHBondContact O-N 2.99Å |
| 81 | M | 71.1 | Confident | 78.4 | Confident | 75 Ų | 75 | 96.8 Ų | 96.8 | 37% | 0.369 | 52% | 0.516 | S | S | . | . | trans | -96.4 | -6.2 | -174.3 | -158.3 | 174.2 | 68.6 | 0 | 0 | 113.6 | F27 V28 Y31 P78 Q79 | F27-M81 HydrophobicContact CE1-CE 4.4Å; F27-M81 HydrophobicContact CE1-CG 4.39Å; F27-M81 HydrophobicContact CE1-SD 3.54Å; F27-M81 VanDerWaalsContact CE1-SD 3.54Å; F27-M81 HydrophobicContact CZ-SD 4.01Å; V28-M81 HydrophobicContact CG2-CE 4.49Å; Y31-M81 HydrophobicContact CD1-CE 3.16Å; Y31-M81 HydrophobicContact CD1-SD 3.72Å; Y31-M81 HydrophobicContact CD2-CE 4.4Å; Y31-M81 HydrophobicContact CD2-SD 3.87Å; Y31-M81 HydrophobicContact CE1-CE 3.39Å; Y31-M81 HydrophobicContact CE1-SD 3.76Å; Y31-M81 HydrophobicContact CE2-SD 3.93Å; Y31-M81 HydrophobicContact CG-CE 3.7Å; Y31-M81 HydrophobicContact CG-SD 3.74Å; P78-M81 PolarHBondContact O-N 3.37Å; P78-M81 VanDerWaalsContact O-N 3.1Å; Q79-M81 VanDerWaalsContact C-N 3.33Å | ||
| 82 | T | 59.2 | Low | 78.1 | Confident | 169 Ų | 169 | 92.9 Ų | 92.9 | 100% | 1.037 | 50% | 0.496 | S | S | * | . | trans | -93.5 | 0 | 169.5 | 33.8 | 0 | 0 | 0 | 0 | 111.6 | P78 Q79 | P78-T82 PolarHBondContact O-N 2.91Å; P78-T82 PolarHBondContact O-OG1 3.08Å; Q79-T82 PolarHBondContact O-OG1 3.06Å |
Retrieved 82 of 82 residues in 82.8 ms
(Link to these results)