| 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 | 35.5 | Very low | 39.4 | Very low | 228 Ų | 228 | 153 Ų | 153 | 100% | 1.123 | 85% | 0.846 | S | S | * | * | 0 | 94.3 | 0 | -71.9 | -70.4 | -158.1 | 0 | 0 | 105.6 | F3 | M1-F3 PolarHBondContact O-N 2.71Š| |||
| 2 | D | 33.8 | Very low | 39.5 | Very low | 166 Ų | 166 | 156.3 Ų | 156.3 | 89% | 0.888 | 85% | 0.851 | S | S | * | * | trans | -69.5 | 111.9 | -177.1 | -61.4 | -53.9 | 0 | 0 | 0 | 109.1 | K4 | D2-K4 VanDerWaalsContact C-N 3.31Å; D2-K4 PolarHBondContact O-N 3.17Å | ||
| 3 | F | 38.6 | Very low | 39.7 | Very low | 208 Ų | 208 | 149.1 Ų | 149.1 | 91% | 0.912 | 84% | 0.835 | S | S | * | * | trans | -70.6 | 92.8 | 172.4 | -111.8 | -95.3 | 0 | 0 | 0 | 107.7 | M1 E5 | M1-F3 PolarHBondContact O-N 2.71Å; F3-E5 PolarHBondContact O-N 3.21Å; F3-E5 VanDerWaalsContact O-N 3.13Å | ||
| 4 | K | 43 | Very low | 40.5 | Very low | 179 Ų | 179 | 149.1 Ų | 149.1 | 78% | 0.778 | 83% | 0.832 | S | S | * | * | trans | -62 | 112.6 | 173.4 | -164.9 | 164.4 | -174.8 | 172.8 | 0 | 107.9 | D2 L6 | D2-K4 VanDerWaalsContact C-N 3.31Å; D2-K4 PolarHBondContact O-N 3.17Å; K4-L6 VanDerWaalsContact C-N 3.29Å; K4-L6 PolarHBondContact O-N 2.95Å | ||
| 5 | E | 43.3 | Very low | 41.2 | Very low | 184 Ų | 184 | 144.4 Ų | 144.4 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -51.3 | 91.7 | 168.6 | -86.7 | 175.9 | 142.8 | 0 | 0 | 109.9 | F3 G7 | F3-E5 PolarHBondContact O-N 3.21Å; F3-E5 VanDerWaalsContact O-N 3.13Å; E5-G7 PolarHBondContact O-N 2.63Å; E5-G7 VanDerWaalsContact O-N 3.13Å | ||
| 6 | L | 41.3 | Very low | 42.6 | Very low | 175 Ų | 175 | 140.6 Ų | 140.6 | 92% | 0.916 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | 73.8 | 165.7 | -78.7 | 159.3 | 0 | 0 | 0 | 107.4 | K4 | K4-L6 VanDerWaalsContact C-N 3.29Å; K4-L6 PolarHBondContact O-N 2.95Å |
| 7 | G | 41.2 | Very low | 44.8 | Very low | 66 Ų | 66 | 136.5 Ų | 136.5 | 68% | 0.68 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -152.8 | -0.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | E5 D9 | E5-G7 PolarHBondContact O-N 2.63Å; E5-G7 VanDerWaalsContact O-N 3.13Å; G7-D9 PolarHBondContact O-N 3.26Å |
| 8 | A | 41.2 | Very low | 47 | Very low | 89 Ų | 89 | 130 Ų | 130 | 74% | 0.736 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.6 | 4.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 9 | D | 37.1 | Very low | 49.1 | Very low | 162 Ų | 162 | 127.1 Ų | 127.1 | 87% | 0.866 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.2 | 48.9 | 178.9 | -83.3 | -35.3 | 0 | 0 | 0 | 111.8 | G7 S11 | G7-D9 PolarHBondContact O-N 3.26Å; D9-S11 PolarHBondContact O-N 3Å |
| 10 | C | 34.9 | Very low | 51.1 | Low | 128 Ų | 128 | 123.8 Ų | 123.8 | 87% | 0.865 | 69% | 0.692 | S | S | * | * | trans | -83.3 | 83.6 | 147.2 | -89.1 | 0 | 0 | 0 | 0 | 105.9 | E12 | C10-E12 PolarHBondContact O-N 2.89Š| ||
| 11 | S | 43.1 | Very low | 52.8 | Low | 98 Ų | 98 | 120.3 Ų | 120.3 | 69% | 0.685 | 67% | 0.673 | S | S | * | * | trans | -17.7 | 122.9 | 162.5 | -179.4 | 0 | 0 | 0 | 0 | 110 | D9 G13 | D9-S11 PolarHBondContact O-N 3Å; S11-G13 WeakPolarHBondContact O-CA 3.35Å; S11-G13 PolarHBondContact O-N 2.83Å | ||
| 12 | E | 41.2 | Very low | 55.3 | Low | 193 Ų | 193 | 114.2 Ų | 114.2 | 90% | 0.902 | 64% | 0.64 | S | S | * | * | trans | -36.1 | 92 | 159.4 | -104.3 | 167.4 | 153.1 | 0 | 0 | 107.9 | C10 D14 | C10-E12 PolarHBondContact O-N 2.89Å; E12-D14 PolarHBondContact O-N 3.12Å | ||
| 13 | G | 41.8 | Very low | 58 | Low | 62 Ų | 62 | 109 Ų | 109 | 64% | 0.639 | 62% | 0.621 | S | S | * | * | trans | -85.7 | 97.2 | -157.1 | 0 | 0 | 0 | 0 | 0 | 105.6 | S11 T15 | S11-G13 WeakPolarHBondContact O-CA 3.35Å; S11-G13 PolarHBondContact O-N 2.83Å; G13-T15 PolarHBondContact O-N 2.64Å | ||
| 14 | D | 50.9 | Low | 60.4 | Low | 150 Ų | 150 | 103 Ų | 103 | 80% | 0.802 | 60% | 0.598 | S | S | * | * | trans | -1.6 | 97.7 | 169.8 | -89.5 | -26.6 | 0 | 0 | 0 | 110.8 | E12 E16 | E12-D14 PolarHBondContact O-N 3.12Å; D14-E16 VanDerWaalsContact C-N 3.32Å; D14-E16 PolarHBondContact O-N 3.48Å | ||
| 15 | T | 51.6 | Low | 62.7 | Low | 78 Ų | 78 | 97.1 Ų | 97.1 | 48% | 0.479 | 58% | 0.577 | S | S | . | * | trans | -49.7 | 105.8 | 170.6 | 54.9 | 0 | 0 | 0 | 0 | 105.6 | G13 D17 R120 | G13-T15 PolarHBondContact O-N 2.64Å; T15-D17 VanDerWaalsContact O-CA 3.23Å; T15-D17 WeakPolarHBondContact O-CA 2.94Å; T15-D17 PolarHBondContact O-N 3.18Å; T15-R120 HydrophobicContact CG2-CG 3.99Å | ||
| 16 | E | 63.6 | Low | 64.9 | Low | 84 Ų | 84 | 95.8 Ų | 95.8 | 39% | 0.393 | 57% | 0.571 | S | S | . | * | trans | -37.2 | 100.3 | -165.9 | -61.5 | 168.1 | 147.7 | 0 | 0 | 108.3 | D14 L18 V21 I119 R122 | D14-E16 VanDerWaalsContact C-N 3.32Å; D14-E16 PolarHBondContact O-N 3.48Å; E16-L18 PolarHBondContact O-N 3.24Å; E16-V21 HydrophobicContact CB-CG2 4.13Å; E16-I119 HydrophobicContact CB-CG2 3.62Å; E16-I119 HydrophobicContact CG-CG2 4.46Å; E16-I119 VanDerWaalsContact O-CG2 3.25Å; E16-I119 WeakPolarHBondContact O-CG2 3.22Å; E16-R122 IonicContact OE1-NH1 3.82Å; E16-R122 PolarHBondContact OE1-NH1 3.34Å; E16-R122 IonicContact OE2-NH1 3.39Å; E16-R122 PolarHBondContact OE2-NH1 3.41Å | ||
| 17 | D | 80.1 | Confident | 67.3 | Low | 71 Ų | 71 | 95 Ų | 95 | 38% | 0.38 | 56% | 0.56 | S | S | . | * | trans | -65.9 | 133.1 | -163.6 | 180 | 29.8 | 0 | 0 | 0 | 106.6 | T15 D19 S20 V21 R116 | T15-D17 VanDerWaalsContact O-CA 3.23Å; T15-D17 WeakPolarHBondContact O-CA 2.94Å; T15-D17 PolarHBondContact O-N 3.18Å; D17-D19 PolarHBondContact O-N 3.12Å; D17-S20 PolarHBondContact N-OG 2.92Å; D17-S20 WeakPolarHBondContact O-CA 3.32Å; D17-S20 WeakPolarHBondContact O-CB 3.41Å; D17-S20 PolarHBondContact O-N 3.03Å; D17-S20 PolarHBondContact O-OG 3.06Å; D17-V21 PolarHBondContact O-N 3.35Å; D17-V21 VanDerWaalsContact O-N 3.12Å; D17-R116 IonicContact OD1-CZ 3.85Å; D17-R116 IonicContact OD1-NH1 2.81Å; D17-R116 PolarHBondContact OD1-NH1 2.86Å | ||
| 18 | L | 84.3 | Confident | 69.8 | Low | 19 Ų | 19 | 96.5 Ų | 96.5 | 10% | 0.099 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -51.9 | -32 | -172.1 | 176.6 | 66.2 | 0 | 0 | 0 | 110.9 | E16 V21 K22 N112 A115 R116 I119 | E16-L18 PolarHBondContact O-N 3.24Å; L18-V21 PolarHBondContact O-N 2.94Å; L18-K22 WeakPolarHBondContact O-CG 3.47Å; L18-K22 PolarHBondContact O-N 2.92Å; L18-N112 WeakPolarHBondContact CD2-ND2 3.43Å; L18-A115 HydrophobicContact CD1-CB 3.96Å; L18-A115 HydrophobicContact CD2-CB 4.25Å; L18-R116 HydrophobicContact CB-CG 4.17Å; L18-R116 HydrophobicContact CD2-CG 4.22Å; L18-I119 HydrophobicContact CB-CD1 4.18Å; L18-I119 HydrophobicContact CD1-CD1 3.5Å; L18-I119 VanDerWaalsContact CD1-CD1 3.5Å; L18-I119 HydrophobicContact CG-CD1 4.44Å |
| 19 | D | 86.5 | Confident | 72 | Confident | 75 Ų | 75 | 100.7 Ų | 100.7 | 40% | 0.401 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -75.5 | -33.2 | 179 | -58.7 | -39.1 | 0 | 0 | 0 | 112.8 | D17 K22 A23 R116 | D17-D19 PolarHBondContact O-N 3.12Å; D19-K22 PolarHBondContact O-N 2.69Å; D19-K22 IonicContact OD1-NZ 2.8Å; D19-K22 PolarHBondContact OD1-NZ 2.89Å; D19-A23 WeakPolarHBondContact O-CB 3.49Å; D19-A23 PolarHBondContact O-N 3.43Å; D19-R116 IonicContact OD2-NH2 3.63Å |
| 20 | S | 88.5 | Confident | 74.3 | Confident | 61 Ų | 61 | 98 Ų | 98 | 43% | 0.427 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.1 | -40.1 | 169 | 78 | 0 | 0 | 0 | 0 | 112.1 | D17 A23 L24 | D17-S20 PolarHBondContact N-OG 2.92Å; D17-S20 WeakPolarHBondContact O-CA 3.32Å; D17-S20 WeakPolarHBondContact O-CB 3.41Å; D17-S20 PolarHBondContact O-N 3.03Å; D17-S20 PolarHBondContact O-OG 3.06Å; S20-A23 PolarHBondContact O-N 3.28Å; S20-L24 WeakPolarHBondContact O-CB 3.06Å; S20-L24 PolarHBondContact O-N 3.28Å |
| 21 | V | 87.4 | Confident | 76.5 | Confident | 51 Ų | 51 | 99 Ų | 99 | 31% | 0.309 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.8 | -42 | 177.3 | 177.5 | 0 | 0 | 0 | 0 | 110.6 | E16 D17 L18 L24 T25 I119 | E16-V21 HydrophobicContact CB-CG2 4.13Å; D17-V21 PolarHBondContact O-N 3.35Å; D17-V21 VanDerWaalsContact O-N 3.12Å; L18-V21 PolarHBondContact O-N 2.94Å; V21-L24 PolarHBondContact O-N 2.97Å; V21-T25 WeakPolarHBondContact O-CB 3.33Å; V21-T25 PolarHBondContact O-N 3.17Å; V21-T25 PolarHBondContact O-OG1 3.35Å; V21-I119 HydrophobicContact CG2-CD1 4.44Å |
| 22 | K | 88.1 | Confident | 78.2 | Confident | 99 Ų | 99 | 97 Ų | 97 | 43% | 0.43 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.5 | -49.3 | 173.5 | -72.3 | 171 | -168.7 | 156.5 | 0 | 111.5 | L18 D19 L24 T25 E26 | L18-K22 WeakPolarHBondContact O-CG 3.47Å; L18-K22 PolarHBondContact O-N 2.92Å; D19-K22 PolarHBondContact O-N 2.69Å; D19-K22 IonicContact OD1-NZ 2.8Å; D19-K22 PolarHBondContact OD1-NZ 2.89Å; K22-L24 VanDerWaalsContact C-N 3.3Å; K22-L24 PolarHBondContact O-N 3.49Å; K22-T25 WeakPolarHBondContact O-CB 3.38Å; K22-T25 PolarHBondContact O-N 2.89Å; K22-T25 VanDerWaalsContact O-N 3.16Å; K22-E26 PolarHBondContact O-N 2.9Å |
| 23 | A | 90.4 | Very high | 80 | Confident | 57 Ų | 57 | 99.1 Ų | 99.1 | 47% | 0.471 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.6 | -40.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | D19 S20 E26 K27 | D19-A23 WeakPolarHBondContact O-CB 3.49Å; D19-A23 PolarHBondContact O-N 3.43Å; S20-A23 PolarHBondContact O-N 3.28Å; A23-E26 PolarHBondContact O-N 3.4Å; A23-K27 VanDerWaalsContact O-CB 3.3Å; A23-K27 WeakPolarHBondContact O-CB 3.31Å; A23-K27 PolarHBondContact O-N 2.81Å |
| 24 | L | 89.5 | Confident | 82 | Confident | 82 Ų | 82 | 105.1 Ų | 105.1 | 43% | 0.429 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -43.8 | 175.7 | -175.6 | 65.9 | 0 | 0 | 0 | 111.6 | S20 V21 K22 E26 K27 L28 | S20-L24 WeakPolarHBondContact O-CB 3.06Å; S20-L24 PolarHBondContact O-N 3.28Å; V21-L24 PolarHBondContact O-N 2.97Å; K22-L24 VanDerWaalsContact C-N 3.3Å; K22-L24 PolarHBondContact O-N 3.49Å; L24-E26 VanDerWaalsContact C-N 3.31Å; L24-E26 PolarHBondContact O-N 3.24Å; L24-K27 PolarHBondContact O-N 2.85Å; L24-L28 HydrophobicContact CD1-CD1 3.91Å; L24-L28 HydrophobicContact CD1-CG 4.17Å; L24-L28 HydrophobicContact CG-CD1 3.89Å; L24-L28 HydrophobicContact CG-CG 4.41Å; L24-L28 WeakPolarHBondContact O-CB 3.47Å; L24-L28 VanDerWaalsContact O-CG 3.28Å; L24-L28 WeakPolarHBondContact O-CG 3.34Å; L24-L28 PolarHBondContact O-N 3.18Å |
| 25 | T | 89.8 | Confident | 83.6 | Confident | 55 Ų | 55 | 102.3 Ų | 102.3 | 34% | 0.337 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.3 | -43 | 178.5 | -57 | 0 | 0 | 0 | 0 | 111 | V21 K22 L28 K29 L30 | V21-T25 WeakPolarHBondContact O-CB 3.33Å; V21-T25 PolarHBondContact O-N 3.17Å; V21-T25 PolarHBondContact O-OG1 3.35Å; K22-T25 WeakPolarHBondContact O-CB 3.38Å; K22-T25 PolarHBondContact O-N 2.89Å; K22-T25 VanDerWaalsContact O-N 3.16Å; T25-L28 CarbonylContact O-C 3.59Å; T25-L28 PolarHBondContact O-N 3.43Å; T25-K29 PolarHBondContact O-N 3.44Å; T25-L30 HydrophobicContact CG2-CB 3.82Å; T25-L30 PolarHBondContact O-N 2.96Å |
| 26 | E | 89.7 | Confident | 85.2 | Confident | 157 Ų | 157 | 102.4 Ų | 102.4 | 73% | 0.734 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.2 | -48.8 | 175.4 | -174.7 | 178.1 | -177.1 | 0 | 0 | 111.7 | K22 A23 L24 L28 K29 | K22-E26 PolarHBondContact O-N 2.9Å; A23-E26 PolarHBondContact O-N 3.4Å; L24-E26 VanDerWaalsContact C-N 3.31Å; L24-E26 PolarHBondContact O-N 3.24Å; E26-L28 PolarHBondContact O-N 3Å; E26-K29 PolarHBondContact O-N 3.03Å |
| 27 | K | 93.5 | Very high | 86.2 | Confident | 159 Ų | 159 | 103.3 Ų | 103.3 | 69% | 0.691 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -56.3 | -38.8 | 177.2 | -173.1 | 178.2 | 71.9 | -177.2 | 0 | 112 | A23 L24 K29 | A23-K27 VanDerWaalsContact O-CB 3.3Å; A23-K27 WeakPolarHBondContact O-CB 3.31Å; A23-K27 PolarHBondContact O-N 2.81Å; L24-K27 PolarHBondContact O-N 2.85Å; K27-K29 VanDerWaalsContact C-N 3.34Å |
| 28 | L | 92.3 | Very high | 86.5 | Confident | 97 Ų | 97 | 103.8 Ų | 103.8 | 51% | 0.508 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.4 | -0.6 | 179.6 | -64.5 | 179.6 | 0 | 0 | 0 | 113.5 | L24 T25 E26 L30 | L24-L28 HydrophobicContact CD1-CD1 3.91Å; L24-L28 HydrophobicContact CD1-CG 4.17Å; L24-L28 HydrophobicContact CG-CD1 3.89Å; L24-L28 HydrophobicContact CG-CG 4.41Å; L24-L28 WeakPolarHBondContact O-CB 3.47Å; L24-L28 VanDerWaalsContact O-CG 3.28Å; L24-L28 WeakPolarHBondContact O-CG 3.34Å; L24-L28 PolarHBondContact O-N 3.18Å; T25-L28 CarbonylContact O-C 3.59Å; T25-L28 PolarHBondContact O-N 3.43Å; E26-L28 PolarHBondContact O-N 3Å; L28-L30 HydrophobicContact CB-CD1 4.11Å; L28-L30 HydrophobicContact CB-CD2 4.22Å; L28-L30 HydrophobicContact CB-CG 3.71Å; L28-L30 HydrophobicContact CD1-CD1 4.19Å; L28-L30 PolarHBondContact O-N 2.75Å |
| 29 | K | 87.2 | Confident | 86.8 | Confident | 177 Ų | 177 | 107.4 Ų | 107.4 | 77% | 0.77 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.9 | 37.9 | -177.6 | -61.4 | -179.9 | 177.8 | 179.2 | 0 | 112.9 | T25 E26 K27 Q31 | T25-K29 PolarHBondContact O-N 3.44Å; E26-K29 PolarHBondContact O-N 3.03Å; K27-K29 VanDerWaalsContact C-N 3.34Å; K29-Q31 PolarHBondContact O-N 2.99Å |
| 30 | L | 86.1 | Confident | 86.8 | Confident | 104 Ų | 104 | 110.2 Ų | 110.2 | 55% | 0.545 | 54% | 0.535 | S | S | . | . | trans | -72.9 | 114.5 | -178 | -63.3 | 177 | 0 | 0 | 0 | 109.3 | T25 L28 | T25-L30 HydrophobicContact CG2-CB 3.82Å; T25-L30 PolarHBondContact O-N 2.96Å; L28-L30 HydrophobicContact CB-CD1 4.11Å; L28-L30 HydrophobicContact CB-CD2 4.22Å; L28-L30 HydrophobicContact CB-CG 3.71Å; L28-L30 HydrophobicContact CD1-CD1 4.19Å; L28-L30 PolarHBondContact O-N 2.75Å | ||
| 31 | Q | 81.3 | Confident | 86.6 | Confident | 149 Ų | 149 | 110.4 Ų | 110.4 | 70% | 0.696 | 53% | 0.529 | S | S | * | . | trans | -76.5 | 143.5 | 170.4 | -64.2 | -63.4 | -34 | 0 | 0 | 109.9 | K29 R33 | K29-Q31 PolarHBondContact O-N 2.99Å; Q31-R33 PolarHBondContact O-N 3.27Å | ||
| 32 | T | 77.9 | Confident | 86.6 | Confident | 56 Ų | 56 | 114.3 Ų | 114.3 | 34% | 0.344 | 54% | 0.544 | S | S | . | . | trans | -65.1 | 123.3 | 169.3 | 141.2 | 0 | 0 | 0 | 0 | 108.7 | R34 Y37 | T32-R34 PolarHBondContact OG1-N 2.93Å; T32-Y37 HydrophobicContact CG2-CD1 3.39Å; T32-Y37 HydrophobicContact CG2-CE1 3.38Å; T32-Y37 HydrophobicContact CG2-CG 4.21Å | ||
| 33 | R | 79 | Confident | 86.6 | Confident | 238 Ų | 238 | 117.6 Ų | 117.6 | 90% | 0.898 | 55% | 0.553 | S | S | * | * | trans | -91.6 | 6.8 | 179.2 | -65.9 | -171.7 | 173.9 | -166.1 | -1.6 | 113.4 | Q31 P35 | Q31-R33 PolarHBondContact O-N 3.27Å; R33-P35 VanDerWaalsContact O-CD 3.32Å; R33-P35 WeakPolarHBondContact O-CD 3.38Å | ||
| 34 | R | 84.5 | Confident | 86.2 | Confident | 189 Ų | 189 | 117.8 Ų | 117.8 | 71% | 0.713 | 55% | 0.546 | S | S | * | . | trans | -77.2 | 118.1 | -178.6 | -86.8 | -173.8 | 168.3 | -168.9 | -2.7 | 109.9 | T32 S36 Y37 L38 | T32-R34 PolarHBondContact OG1-N 2.93Å; R34-S36 VanDerWaalsContact C-N 3.29Å; R34-S36 PolarHBondContact O-N 3.34Å; R34-Y37 PolarHBondContact O-N 3.5Å; R34-Y37 VanDerWaalsContact O-N 3.11Å; R34-L38 PolarHBondContact O-N 3.03Å | ||
| 35 | P | 83.9 | Confident | 85.9 | Confident | 90 Ų | 90 | 120.6 Ų | 120.6 | 58% | 0.584 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -56.3 | -41.6 | -178.7 | -26.2 | 35.1 | 0 | 0 | 0 | 113.1 | R33 Y37 L38 E39 | R33-P35 VanDerWaalsContact O-CD 3.32Å; R33-P35 WeakPolarHBondContact O-CD 3.38Å; P35-Y37 VanDerWaalsContact C-N 3.29Å; P35-Y37 PolarHBondContact O-N 2.95Å; P35-L38 PolarHBondContact O-N 3Å; P35-E39 WeakPolarHBondContact O-CG 3.4Å; P35-E39 PolarHBondContact O-N 3.45Å |
| 36 | S | 86.8 | Confident | 85.4 | Confident | 81 Ų | 81 | 122.1 Ų | 122.1 | 57% | 0.566 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -61.4 | -33.9 | 179.1 | 56.3 | 0 | 0 | 0 | 0 | 114.1 | R34 W40 | R34-S36 VanDerWaalsContact C-N 3.29Å; R34-S36 PolarHBondContact O-N 3.34Å; S36-W40 WeakPolarHBondContact O-CB 3.38Å; S36-W40 PolarHBondContact O-N 2.97Å; S36-W40 VanDerWaalsContact O-N 3.09Å |
| 37 | Y | 83.9 | Confident | 84.7 | Confident | 102 Ų | 102 | 122.1 Ų | 122.1 | 40% | 0.4 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -72.5 | -41.3 | 177.2 | -178.9 | -89.8 | 0 | 0 | 0 | 111.1 | T32 R34 P35 W40 Q41 | T32-Y37 HydrophobicContact CG2-CD1 3.39Å; T32-Y37 HydrophobicContact CG2-CE1 3.38Å; T32-Y37 HydrophobicContact CG2-CG 4.21Å; R34-Y37 PolarHBondContact O-N 3.5Å; R34-Y37 VanDerWaalsContact O-N 3.11Å; P35-Y37 VanDerWaalsContact C-N 3.29Å; P35-Y37 PolarHBondContact O-N 2.95Å; Y37-W40 HydrophobicContact CD2-CE3 4.27Å; Y37-W40 HydrophobicContact CD2-CZ3 4.48Å; Y37-W40 HydrophobicContact CE2-CE3 4.07Å; Y37-W40 AromaticContact CE2-CZ3 3.83Å; Y37-W40 HydrophobicContact CE2-CZ3 3.83Å; Y37-W40 PolarHBondContact O-N 3.46Å; Y37-Q41 WeakPolarHBondContact O-CB 3.22Å; Y37-Q41 PolarHBondContact O-N 2.96Å |
| 38 | L | 86.3 | Confident | 83.3 | Confident | 82 Ų | 82 | 119.3 Ų | 119.3 | 43% | 0.429 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.2 | -43.3 | 177.4 | -64.4 | 174.7 | 0 | 0 | 0 | 111.3 | R34 P35 W40 Q41 E42 | R34-L38 PolarHBondContact O-N 3.03Å; P35-L38 PolarHBondContact O-N 3Å; L38-W40 PolarHBondContact O-N 2.99Å; L38-Q41 PolarHBondContact O-N 3.15Å; L38-E42 WeakPolarHBondContact O-CB 3.4Å; L38-E42 PolarHBondContact O-N 3.37Å |
| 39 | E | 90.1 | Very high | 82 | Confident | 95 Ų | 95 | 121.9 Ų | 121.9 | 44% | 0.444 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -60.6 | -43.3 | 174 | -73.7 | 176.7 | -154.8 | 0 | 0 | 112.1 | P35 E42 R43 | P35-E39 WeakPolarHBondContact O-CG 3.4Å; P35-E39 PolarHBondContact O-N 3.45Å; E39-E42 PolarHBondContact O-N 3.4Å; E39-R43 WeakPolarHBondContact O-CB 3.33Å; E39-R43 VanDerWaalsContact O-CG 3.22Å; E39-R43 WeakPolarHBondContact O-CG 3.28Å; E39-R43 PolarHBondContact O-N 3.24Å; E39-R43 IonicContact OE2-NH2 3.58Å |
| 40 | W | 87.4 | Confident | 80.5 | Confident | 134 Ų | 134 | 120.3 Ų | 120.3 | 51% | 0.508 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.3 | -42.5 | 175.8 | 169 | 84.7 | 0 | 0 | 0 | 111.9 | S36 Y37 L38 R43 L44 | S36-W40 WeakPolarHBondContact O-CB 3.38Å; S36-W40 PolarHBondContact O-N 2.97Å; S36-W40 VanDerWaalsContact O-N 3.09Å; Y37-W40 HydrophobicContact CD2-CE3 4.27Å; Y37-W40 HydrophobicContact CD2-CZ3 4.48Å; Y37-W40 HydrophobicContact CE2-CE3 4.07Å; Y37-W40 AromaticContact CE2-CZ3 3.83Å; Y37-W40 HydrophobicContact CE2-CZ3 3.83Å; Y37-W40 PolarHBondContact O-N 3.46Å; L38-W40 PolarHBondContact O-N 2.99Å; W40-R43 PolarHBondContact O-N 3Å; W40-L44 HydrophobicContact CD2-CD1 4Å; W40-L44 HydrophobicContact CD2-CG 4.46Å; W40-L44 VanDerWaalsContact CE2-CD1 3.47Å; W40-L44 HydrophobicContact CE3-CD1 4.16Å; W40-L44 HydrophobicContact CH2-CD1 3.4Å; W40-L44 HydrophobicContact CZ2-CD1 3.19Å; W40-L44 HydrophobicContact CZ2-CG 4.2Å; W40-L44 HydrophobicContact CZ3-CD1 3.88Å; W40-L44 PolarHBondContact O-N 3.38Å |
| 41 | Q | 84.4 | Confident | 78.9 | Confident | 65 Ų | 65 | 122.4 Ų | 122.4 | 30% | 0.304 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.6 | -43.9 | 177.5 | -177.3 | 179.1 | -24.9 | 0 | 0 | 111.2 | Y37 L38 L44 Q45 | Y37-Q41 WeakPolarHBondContact O-CB 3.22Å; Y37-Q41 PolarHBondContact O-N 2.96Å; L38-Q41 PolarHBondContact O-N 3.15Å; Q41-L44 PolarHBondContact O-N 3.4Å; Q41-Q45 WeakPolarHBondContact O-CG 3.49Å; Q41-Q45 PolarHBondContact O-N 3.46Å |
| 42 | E | 86.9 | Confident | 77.5 | Confident | 133 Ų | 133 | 126.2 Ų | 126.2 | 62% | 0.621 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61.9 | -42.3 | 174.6 | -175.2 | -179.7 | -156.6 | 0 | 0 | 111.6 | L38 E39 L44 Q45 S46 | L38-E42 WeakPolarHBondContact O-CB 3.4Å; L38-E42 PolarHBondContact O-N 3.37Å; E39-E42 PolarHBondContact O-N 3.4Å; E42-L44 VanDerWaalsContact C-N 3.31Å; E42-L44 PolarHBondContact O-N 3.37Å; E42-Q45 PolarHBondContact O-N 2.9Å; E42-S46 VanDerWaalsContact O-CB 3.27Å; E42-S46 WeakPolarHBondContact O-CB 3.37Å; E42-S46 PolarHBondContact O-N 2.91Å; E42-S46 PolarHBondContact O-OG 3.44Å |
| 43 | R | 87.1 | Confident | 76.2 | Confident | 167 Ų | 167 | 127.1 Ų | 127.1 | 63% | 0.63 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -62.6 | -35 | 175.2 | -73.7 | 173.2 | -169.6 | -165.7 | 7.8 | 113.1 | E39 W40 S46 R47 | E39-R43 WeakPolarHBondContact O-CB 3.33Å; E39-R43 VanDerWaalsContact O-CG 3.22Å; E39-R43 WeakPolarHBondContact O-CG 3.28Å; E39-R43 PolarHBondContact O-N 3.24Å; E39-R43 IonicContact OE2-NH2 3.58Å; W40-R43 PolarHBondContact O-N 3Å; R43-S46 VanDerWaalsContact CA-OG 3.31Å; R43-S46 WeakPolarHBondContact CA-OG 3.28Å; R43-S46 PolarHBondContact O-OG 2.99Å; R43-R47 WeakPolarHBondContact O-CB 3.43Å |
| 44 | L | 83.4 | Confident | 74.8 | Confident | 61 Ų | 61 | 122 Ų | 122 | 32% | 0.319 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69 | -43.8 | 174.4 | -79.4 | -179.3 | 0 | 0 | 0 | 111.8 | W40 Q41 E42 W49 | W40-L44 HydrophobicContact CD2-CD1 4Å; W40-L44 HydrophobicContact CD2-CG 4.46Å; W40-L44 VanDerWaalsContact CE2-CD1 3.47Å; W40-L44 HydrophobicContact CE3-CD1 4.16Å; W40-L44 HydrophobicContact CH2-CD1 3.4Å; W40-L44 HydrophobicContact CZ2-CD1 3.19Å; W40-L44 HydrophobicContact CZ2-CG 4.2Å; W40-L44 HydrophobicContact CZ3-CD1 3.88Å; W40-L44 PolarHBondContact O-N 3.38Å; Q41-L44 PolarHBondContact O-N 3.4Å; E42-L44 VanDerWaalsContact C-N 3.31Å; E42-L44 PolarHBondContact O-N 3.37Å; L44-W49 HydrophobicContact CD2-CZ2 4.04Å |
| 45 | Q | 82.2 | Confident | 73.1 | Confident | 141 Ų | 141 | 116.7 Ų | 116.7 | 66% | 0.659 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -71.6 | -30.7 | -178.6 | -70.1 | -177.7 | -4.9 | 0 | 0 | 113.1 | Q41 E42 R47 | Q41-Q45 WeakPolarHBondContact O-CG 3.49Å; Q41-Q45 PolarHBondContact O-N 3.46Å; E42-Q45 PolarHBondContact O-N 2.9Å; Q45-R47 VanDerWaalsContact C-N 3.35Å |
| 46 | S | 80.6 | Confident | 71.3 | Confident | 87 Ų | 87 | 119.5 Ų | 119.5 | 61% | 0.608 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -6.3 | -179 | 52.5 | 0 | 0 | 0 | 0 | 114.7 | E42 R43 | E42-S46 VanDerWaalsContact O-CB 3.27Å; E42-S46 WeakPolarHBondContact O-CB 3.37Å; E42-S46 PolarHBondContact O-N 2.91Å; E42-S46 PolarHBondContact O-OG 3.44Å; R43-S46 VanDerWaalsContact CA-OG 3.31Å; R43-S46 WeakPolarHBondContact CA-OG 3.28Å; R43-S46 PolarHBondContact O-OG 2.99Å |
| 47 | R | 75.1 | Confident | 69 | Low | 157 Ų | 157 | 121 Ų | 121 | 59% | 0.592 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -88.1 | 135.4 | -171.1 | -165.8 | -176.2 | -171.9 | -134.2 | 4.5 | 110.5 | R43 Q45 W49 | R43-R47 WeakPolarHBondContact O-CB 3.43Å; Q45-R47 VanDerWaalsContact C-N 3.35Å; R47-W49 VanDerWaalsContact C-CD1 3.45Å; R47-W49 VanDerWaalsContact CB-CD1 3.41Å; R47-W49 VanDerWaalsContact CB-NE1 3.26Å; R47-W49 PolarHBondContact O-N 2.95Å |
| 48 | P | 63.6 | Low | 67.1 | Low | 101 Ų | 101 | 121.8 Ų | 121.8 | 66% | 0.656 | 62% | 0.621 | S | S | * | * | G | 310 helix | trans | -66.9 | -6.4 | -165.5 | -23.2 | 33.5 | 0 | 0 | 0 | 118.2 | M50 D51 | P48-M50 VanDerWaalsContact C-N 3.27Å; P48-M50 PolarHBondContact O-N 2.81Å; P48-D51 PolarHBondContact O-N 2.91Å |
| 49 | W | 64.7 | Low | 65 | Low | 150 Ų | 150 | 125.2 Ų | 125.2 | 57% | 0.568 | 64% | 0.64 | S | S | * | * | G | 310 helix | trans | -71.8 | -17.8 | -178.7 | 59.5 | -57.1 | 0 | 0 | 0 | 113.3 | L44 R47 | L44-W49 HydrophobicContact CD2-CZ2 4.04Å; R47-W49 VanDerWaalsContact C-CD1 3.45Å; R47-W49 VanDerWaalsContact CB-CD1 3.41Å; R47-W49 VanDerWaalsContact CB-NE1 3.26Å; R47-W49 PolarHBondContact O-N 2.95Å |
| 50 | M | 56.4 | Low | 62.8 | Low | 145 Ų | 145 | 126.7 Ų | 126.7 | 71% | 0.714 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -82.8 | -20.7 | 171 | -77.3 | -73.4 | -161.1 | 0 | 0 | 113.2 | P48 | P48-M50 VanDerWaalsContact C-N 3.27Å; P48-M50 PolarHBondContact O-N 2.81Å |
| 51 | D | 52.4 | Low | 60.9 | Low | 147 Ų | 147 | 124.7 Ų | 124.7 | 79% | 0.786 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -103.5 | -0.8 | -169.3 | -150.6 | 20.9 | 0 | 0 | 0 | 113.5 | P48 S53 | P48-D51 PolarHBondContact O-N 2.91Å; D51-S53 VanDerWaalsContact C-N 3.25Å; D51-S53 PolarHBondContact O-N 3.42Å |
| 52 | R | 50.8 | Low | 59 | Low | 229 Ų | 229 | 131.4 Ų | 131.4 | 86% | 0.864 | 70% | 0.701 | S | S | * | * | trans | -80.6 | 79.7 | 167 | -93 | -176 | -168.4 | -149.3 | 1.3 | 110 | ||||
| 53 | S | 49.9 | Very low | 56.8 | Low | 76 Ų | 76 | 128 Ų | 128 | 53% | 0.531 | 70% | 0.701 | S | S | . | * | trans | -56.2 | 135.1 | 155.4 | -160.6 | 0 | 0 | 0 | 0 | 108.6 | D51 A55 | D51-S53 VanDerWaalsContact C-N 3.25Å; D51-S53 PolarHBondContact O-N 3.42Å; S53-A55 PolarHBondContact O-N 3.07Å | ||
| 54 | P | 50.9 | Low | 54.8 | Low | 130 Ų | 130 | 128 Ų | 128 | 84% | 0.844 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | 6.3 | 178 | 28.1 | -33.7 | 0 | 0 | 0 | 113.6 | ||
| 55 | A | 47.7 | Very low | 52.5 | Low | 78 Ų | 78 | 131.3 Ų | 131.3 | 65% | 0.645 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | -18.2 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | S53 C57 | S53-A55 PolarHBondContact O-N 3.07Å; A55-C57 PolarHBondContact O-N 2.96Å |
| 56 | D | 47.2 | Very low | 50.6 | Low | 149 Ų | 149 | 129.9 Ų | 129.9 | 80% | 0.797 | 74% | 0.742 | S | S | * | * | trans | -102.2 | 66.6 | 178.7 | -72.6 | -26.5 | 0 | 0 | 0 | 110.7 | P58 | D56-P58 WeakPolarHBondContact O-CD 3.49Š| ||
| 57 | C | 38.1 | Very low | 48.5 | Very low | 111 Ų | 111 | 133.4 Ų | 133.4 | 75% | 0.75 | 75% | 0.751 | S | S | * | * | trans | -85.6 | 112.5 | 148.6 | -80.7 | 0 | 0 | 0 | 0 | 106.8 | A55 D59 | A55-C57 PolarHBondContact O-N 2.96Å; C57-D59 PolarHBondContact O-N 3.05Å | ||
| 58 | P | 43.2 | Very low | 46.8 | Very low | 120 Ų | 120 | 131.3 Ų | 131.3 | 78% | 0.779 | 76% | 0.758 | S | S | * | * | trans | -65.5 | 127.8 | 165.7 | -8.6 | 23.9 | 0 | 0 | 0 | 107.8 | D56 | D56-P58 WeakPolarHBondContact O-CD 3.49Š| ||
| 59 | D | 43 | Very low | 45.7 | Very low | 153 Ų | 153 | 130.8 Ų | 130.8 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -47.1 | 135.5 | 163.9 | -77.1 | -40.5 | 0 | 0 | 0 | 109.2 | C57 A61 | C57-D59 PolarHBondContact O-N 3.05Å; D59-A61 VanDerWaalsContact C-N 3.27Å; D59-A61 PolarHBondContact O-N 3.17Å | ||
| 60 | P | 43.9 | Very low | 44.6 | Very low | 127 Ų | 127 | 131.4 Ų | 131.4 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | trans | -73.6 | 88 | 177.7 | 30.1 | -30.9 | 0 | 0 | 0 | 108.5 | E62 | P60-E62 PolarHBondContact O-N 3.45Š| ||
| 61 | A | 46.3 | Very low | 43.9 | Very low | 91 Ų | 91 | 132 Ų | 132 | 75% | 0.752 | 78% | 0.78 | S | S | * | * | trans | -64.9 | 127.6 | 159.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | D59 G63 | D59-A61 VanDerWaalsContact C-N 3.27Å; D59-A61 PolarHBondContact O-N 3.17Å; A61-G63 PolarHBondContact O-N 3.34Å; A61-G63 VanDerWaalsContact O-N 3.1Å | ||
| 62 | E | 46.6 | Very low | 43.8 | Very low | 207 Ų | 207 | 135.6 Ų | 135.6 | 97% | 0.967 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -43.9 | 111.4 | -178.2 | -61.1 | -170.2 | 158.9 | 0 | 0 | 112.3 | P60 | P60-E62 PolarHBondContact O-N 3.45Š|
| 63 | G | 40.3 | Very low | 43.2 | Very low | 60 Ų | 60 | 130.5 Ų | 130.5 | 62% | 0.619 | 77% | 0.773 | S | S | * | * | trans | -161.7 | 101.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 109 | A61 V65 | A61-G63 PolarHBondContact O-N 3.34Å; A61-G63 VanDerWaalsContact O-N 3.1Å; G63-V65 PolarHBondContact O-N 2.99Å | ||
| 64 | D | 44 | Very low | 43.2 | Very low | 167 Ų | 167 | 132.8 Ų | 132.8 | 89% | 0.893 | 78% | 0.779 | S | S | * | * | trans | -44 | 97 | 178.5 | -162.1 | 14.4 | 0 | 0 | 0 | 112.4 | ||||
| 65 | V | 35.8 | Very low | 43 | Very low | 131 Ų | 131 | 134.1 Ų | 134.1 | 79% | 0.794 | 78% | 0.779 | S | S | * | * | trans | -127.3 | 103.3 | 163.8 | -175.9 | 0 | 0 | 0 | 0 | 107.1 | G63 M67 | G63-V65 PolarHBondContact O-N 2.99Å; V65-M67 PolarHBondContact O-N 3.5Å | ||
| 66 | S | 42 | Very low | 42.9 | Very low | 112 Ų | 112 | 134.8 Ų | 134.8 | 78% | 0.783 | 78% | 0.779 | S | S | * | * | trans | -52.8 | 100.5 | 176.4 | -153.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 67 | M | 37.3 | Very low | 42.6 | Very low | 160 Ų | 160 | 136.2 Ų | 136.2 | 79% | 0.788 | 78% | 0.781 | S | S | * | * | trans | -68.6 | 141.5 | 154.4 | -79.7 | -73 | -160.1 | 0 | 0 | 107.9 | V65 A69 | V65-M67 PolarHBondContact O-N 3.5Å; M67-A69 PolarHBondContact O-N 3.45Å | ||
| 68 | P | 38.4 | Very low | 42.9 | Very low | 113 Ų | 113 | 139.1 Ų | 139.1 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | trans | -63.1 | 120 | 175.1 | 27.8 | -30.8 | 0 | 0 | 0 | 107.5 | I70 | P68-I70 PolarHBondContact O-N 3.24Š| ||
| 69 | A | 40.2 | Very low | 43.1 | Very low | 90 Ų | 90 | 138.6 Ų | 138.6 | 74% | 0.744 | 78% | 0.782 | S | S | * | * | trans | -53 | 107.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | M67 L71 | M67-A69 PolarHBondContact O-N 3.45Å; A69-L71 VanDerWaalsContact C-N 3.32Å; A69-L71 PolarHBondContact O-N 3.43Å | ||
| 70 | I | 43.1 | Very low | 43.7 | Very low | 164 Ų | 164 | 137 Ų | 137 | 84% | 0.841 | 78% | 0.778 | S | S | * | * | trans | -64.1 | 104.2 | 156.7 | -61.9 | 173.5 | 0 | 0 | 0 | 104.5 | P68 R72 | P68-I70 PolarHBondContact O-N 3.24Å; I70-R72 PolarHBondContact O-N 2.95Å | ||
| 71 | L | 41.1 | Very low | 44.2 | Very low | 158 Ų | 158 | 141.1 Ų | 141.1 | 83% | 0.827 | 78% | 0.777 | S | S | * | * | trans | -53.1 | 107.5 | 169.1 | -76.5 | 168.1 | 0 | 0 | 0 | 107.7 | A69 N73 | A69-L71 VanDerWaalsContact C-N 3.32Å; A69-L71 PolarHBondContact O-N 3.43Å; L71-N73 VanDerWaalsContact C-N 3.33Å; L71-N73 PolarHBondContact O-N 2.89Å | ||
| 72 | R | 49.4 | Very low | 45 | Very low | 221 Ų | 221 | 140.5 Ų | 140.5 | 83% | 0.834 | 76% | 0.761 | S | S | * | * | trans | -60.1 | 99.9 | 164.2 | -118.2 | -177.8 | -179.5 | -140.6 | 5.5 | 106.9 | I70 | I70-R72 PolarHBondContact O-N 2.95Š| ||
| 73 | N | 39.4 | Very low | 46.2 | Very low | 123 Ų | 123 | 133.6 Ų | 133.6 | 66% | 0.658 | 73% | 0.73 | S | S | * | * | trans | -101.2 | 107.4 | 165.7 | -176.8 | 40.1 | 0 | 0 | 0 | 107 | L71 N75 | L71-N73 VanDerWaalsContact C-N 3.33Å; L71-N73 PolarHBondContact O-N 2.89Å; N73-N75 PolarHBondContact O-N 2.82Å | ||
| 74 | D | 48.9 | Very low | 47.7 | Very low | 124 Ų | 124 | 136.5 Ų | 136.5 | 66% | 0.663 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | 28.1 | -171.6 | -74.7 | -32.9 | 0 | 0 | 0 | 114.4 | ||
| 75 | N | 46.7 | Very low | 49.6 | Very low | 158 Ų | 158 | 131.1 Ų | 131.1 | 85% | 0.845 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -156.4 | 43.8 | 176.7 | -84.4 | -44.7 | 0 | 0 | 0 | 113.8 | N73 | N73-N75 PolarHBondContact O-N 2.82Š|
| 76 | S | 46 | Very low | 51.9 | Low | 92 Ų | 92 | 127.5 Ų | 127.5 | 64% | 0.643 | 70% | 0.697 | S | S | * | * | trans | -127.2 | 90.4 | 165.4 | -163.8 | 0 | 0 | 0 | 0 | 110.1 | L78 | S76-L78 PolarHBondContact O-N 3.1Š| ||
| 77 | E | 40.9 | Very low | 53.9 | Low | 179 Ų | 179 | 128.8 Ų | 128.8 | 84% | 0.836 | 70% | 0.695 | S | S | * | * | trans | -24.6 | 103.2 | 151.3 | -170.6 | 171.2 | -168.6 | 0 | 0 | 111.5 | V79 | E77-V79 WeakPolarHBondContact O-CG2 3.19Å; E77-V79 PolarHBondContact O-N 3.47Å | ||
| 78 | L | 44.7 | Very low | 56.4 | Low | 172 Ų | 172 | 124.1 Ų | 124.1 | 90% | 0.901 | 68% | 0.676 | S | S | * | * | S | Bend | trans | 40.5 | 21.5 | 143.8 | -126.2 | 120.3 | 0 | 0 | 0 | 121.3 | S76 V80 | S76-L78 PolarHBondContact O-N 3.1Å; L78-V80 PolarHBondContact O-N 2.96Å |
| 79 | V | 47.4 | Very low | 58.9 | Low | 108 Ų | 108 | 123.7 Ų | 123.7 | 66% | 0.655 | 67% | 0.666 | S | S | * | * | trans | -94.3 | 70.7 | 173.8 | -167.2 | 0 | 0 | 0 | 0 | 109.3 | E77 R81 | E77-V79 WeakPolarHBondContact O-CG2 3.19Å; E77-V79 PolarHBondContact O-N 3.47Å; V79-R81 HydrophobicContact CG1-CB 3.85Å; V79-R81 HydrophobicContact CG1-CG 4.24Å; V79-R81 PolarHBondContact O-N 3.28Å | ||
| 80 | V | 54.4 | Low | 61.2 | Low | 120 Ų | 120 | 124.9 Ų | 124.9 | 73% | 0.727 | 66% | 0.66 | S | S | * | * | trans | -65.3 | 87.5 | 141.9 | 177.2 | 0 | 0 | 0 | 0 | 103.7 | L78 N82 I83 | L78-V80 PolarHBondContact O-N 2.96Å; V80-N82 PolarHBondContact O-N 2.62Å; V80-I83 HydrophobicContact CG1-CD1 4.45Å | ||
| 81 | R | 55.5 | Low | 63.4 | Low | 214 Ų | 214 | 120.2 Ų | 120.2 | 81% | 0.808 | 64% | 0.637 | S | S | * | * | trans | -48.1 | 111.1 | -179.6 | -162.5 | 174.5 | -176.5 | 165.6 | -0.1 | 106.4 | V79 I83 | V79-R81 HydrophobicContact CG1-CB 3.85Å; V79-R81 HydrophobicContact CG1-CG 4.24Å; V79-R81 PolarHBondContact O-N 3.28Å; R81-I83 PolarHBondContact O-N 2.74Å | ||
| 82 | N | 62 | Low | 65.8 | Low | 78 Ų | 78 | 113.4 Ų | 113.4 | 42% | 0.417 | 60% | 0.603 | S | S | . | * | trans | -2.2 | 113.7 | 165.3 | 164.7 | -44.3 | 0 | 0 | 0 | 112.2 | V80 C84 G85 F86 | V80-N82 PolarHBondContact O-N 2.62Å; N82-C84 PolarHBondContact O-N 3.2Å; N82-G85 VanDerWaalsContact CG-C 3.5Å; N82-G85 PolarHBondContact ND2-O 3.12Å; N82-G85 VanDerWaalsContact ND2-O 3.17Å; N82-G85 WeakPolarHBondContact OD1-CA 3.37Å; N82-G85 PolarHBondContact OD1-N 2.99Å; N82-F86 CarbonylContact C-O 3.48Å; N82-F86 WeakPolarHBondContact CA-O 3.4Å; N82-F86 PolarHBondContact OD1-N 3.03Å | ||
| 83 | I | 72.5 | Confident | 67.7 | Low | 62 Ų | 62 | 106.4 Ų | 106.4 | 32% | 0.318 | 58% | 0.582 | S | S | . | * | B | Isolated β-bridge | trans | -80.4 | 108 | -178.4 | -65.3 | 169.4 | 0 | 0 | 0 | 106.8 | V80 R81 G85 F86 I89 | V80-I83 HydrophobicContact CG1-CD1 4.45Å; R81-I83 PolarHBondContact O-N 2.74Å; I83-G85 VanDerWaalsContact C-N 3.26Å; I83-G85 PolarHBondContact O-N 2.72Å; I83-G85 VanDerWaalsContact O-N 3.12Å; I83-F86 PolarHBondContact N-O 2.92Å; I83-F86 WeakPolarHBondContact O-CB 3.34Å; I83-F86 VanDerWaalsContact O-CD2 3.32Å; I83-F86 WeakPolarHBondContact O-CD2 3.33Å; I83-F86 PolarHBondContact O-N 2.64Å; I83-I89 HydrophobicContact CD1-CB 4.41Å; I83-I89 HydrophobicContact CD1-CD1 3.95Å; I83-I89 HydrophobicContact CD1-CG1 3.19Å |
| 84 | C | 73 | Confident | 70.2 | Confident | 120 Ų | 120 | 104.8 Ų | 104.8 | 81% | 0.811 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 54.5 | 32.4 | 171.6 | -58.8 | 0 | 0 | 0 | 0 | 116 | N82 | N82-C84 PolarHBondContact O-N 3.2Š|
| 85 | G | 82.5 | Confident | 72.3 | Confident | 55 Ų | 55 | 103.4 Ų | 103.4 | 57% | 0.567 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 101.4 | -11.3 | -176 | 0 | 0 | 0 | 0 | 0 | 114.5 | N82 I83 | N82-G85 VanDerWaalsContact CG-C 3.5Å; N82-G85 PolarHBondContact ND2-O 3.12Å; N82-G85 VanDerWaalsContact ND2-O 3.17Å; N82-G85 WeakPolarHBondContact OD1-CA 3.37Å; N82-G85 PolarHBondContact OD1-N 2.99Å; I83-G85 VanDerWaalsContact C-N 3.26Å; I83-G85 PolarHBondContact O-N 2.72Å; I83-G85 VanDerWaalsContact O-N 3.12Å |
| 86 | F | 85 | Confident | 74.4 | Confident | 55 Ų | 55 | 100.5 Ų | 100.5 | 24% | 0.241 | 54% | 0.543 | C | S | . | . | B | Isolated β-bridge | trans | -98.9 | 144.5 | -175.9 | -58.4 | -80.3 | 0 | 0 | 0 | 113 | N82 I83 D91 A92 F95 | N82-F86 CarbonylContact C-O 3.48Å; N82-F86 WeakPolarHBondContact CA-O 3.4Å; N82-F86 PolarHBondContact OD1-N 3.03Å; I83-F86 PolarHBondContact N-O 2.92Å; I83-F86 WeakPolarHBondContact O-CB 3.34Å; I83-F86 VanDerWaalsContact O-CD2 3.32Å; I83-F86 WeakPolarHBondContact O-CD2 3.33Å; I83-F86 PolarHBondContact O-N 2.64Å; F86-D91 HydrophobicContact CB-CB 4.3Å; F86-D91 HydrophobicContact CD1-CB 4.26Å; F86-A92 HydrophobicContact CB-CB 4.05Å; F86-A92 HydrophobicContact CD1-CB 4.44Å; F86-A92 HydrophobicContact CD2-CB 3.56Å; F86-A92 HydrophobicContact CE2-CB 4.13Å; F86-A92 HydrophobicContact CG-CB 3.75Å; F86-F95 HydrophobicContact CE1-CB 3.71Å; F86-F95 HydrophobicContact CE1-CD1 4.2Å; F86-F95 HydrophobicContact CE1-CD2 4.31Å; F86-F95 AromaticContact CE1-CG 3.8Å; F86-F95 HydrophobicContact CE1-CG 3.8Å; F86-F95 HydrophobicContact CE2-CD1 4.48Å; F86-F95 HydrophobicContact CZ-CB 3.92Å; F86-F95 AromaticContact CZ-CD1 3.58Å; F86-F95 HydrophobicContact CZ-CD1 3.58Å; F86-F95 HydrophobicContact CZ-CD2 4.37Å; F86-F95 HydrophobicContact CZ-CE1 4.2Å; F86-F95 AromaticContact CZ-CG 3.68Å; F86-F95 HydrophobicContact CZ-CG 3.68Å |
| 87 | D | 83.8 | Confident | 76.7 | Confident | 138 Ų | 138 | 104.3 Ų | 104.3 | 74% | 0.738 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -72.4 | -32.5 | -179.7 | -64.7 | -38 | 0 | 0 | 0 | 112 | ||
| 88 | T | 89.8 | Confident | 79.2 | Confident | 62 Ų | 62 | 101.2 Ų | 101.2 | 38% | 0.38 | 53% | 0.527 | S | S | . | . | S | Bend | trans | -137.2 | 163.8 | 175.2 | 70.9 | 0 | 0 | 0 | 0 | 113.1 | D90 D91 A92 | T88-D90 VanDerWaalsContact C-N 3.27Å; T88-D90 PolarHBondContact O-N 3.26Å; T88-D91 WeakPolarHBondContact CB-OD2 3.37Å; T88-D91 PolarHBondContact N-OD2 3.06Å; T88-D91 VanDerWaalsContact N-OD2 3.12Å; T88-D91 PolarHBondContact O-N 2.8Å; T88-D91 PolarHBondContact OG1-N 3.46Å; T88-D91 PolarHBondContact OG1-OD2 3.32Å; T88-A92 PolarHBondContact O-N 3.04Å |
| 89 | I | 90.1 | Very high | 81.5 | Confident | 104 Ų | 104 | 98.2 Ų | 98.2 | 53% | 0.533 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.7 | -40.2 | 172.1 | -65.4 | 171 | 0 | 0 | 0 | 110.5 | I83 D91 A92 L93 | I83-I89 HydrophobicContact CD1-CB 4.41Å; I83-I89 HydrophobicContact CD1-CD1 3.95Å; I83-I89 HydrophobicContact CD1-CG1 3.19Å; I89-D91 VanDerWaalsContact C-N 3.31Å; I89-D91 PolarHBondContact O-N 2.94Å; I89-A92 PolarHBondContact O-N 3.14Å; I89-L93 HydrophobicContact CG2-CD1 4.01Å; I89-L93 HydrophobicContact CG2-CG 4.25Å; I89-L93 WeakPolarHBondContact O-CG 3.45Å; I89-L93 PolarHBondContact O-N 3.41Å |
| 90 | D | 89.2 | Confident | 83.7 | Confident | 116 Ų | 116 | 99 Ų | 99 | 62% | 0.62 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.9 | -39.2 | -178.9 | -67 | -52.2 | 0 | 0 | 0 | 111.4 | T88 A92 L93 E94 | T88-D90 VanDerWaalsContact C-N 3.27Å; T88-D90 PolarHBondContact O-N 3.26Å; D90-A92 PolarHBondContact O-N 3.3Å; D90-L93 PolarHBondContact O-N 3.34Å; D90-E94 WeakPolarHBondContact O-CB 3.13Å; D90-E94 PolarHBondContact O-N 2.97Å |
| 91 | D | 88.8 | Confident | 85.6 | Confident | 66 Ų | 66 | 98 Ų | 98 | 35% | 0.353 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 175.2 | -61.5 | -42.5 | 0 | 0 | 0 | 112 | F86 T88 I89 E94 F95 | F86-D91 HydrophobicContact CB-CB 4.3Å; F86-D91 HydrophobicContact CD1-CB 4.26Å; T88-D91 WeakPolarHBondContact CB-OD2 3.37Å; T88-D91 PolarHBondContact N-OD2 3.06Å; T88-D91 VanDerWaalsContact N-OD2 3.12Å; T88-D91 PolarHBondContact O-N 2.8Å; T88-D91 PolarHBondContact OG1-N 3.46Å; T88-D91 PolarHBondContact OG1-OD2 3.32Å; I89-D91 VanDerWaalsContact C-N 3.31Å; I89-D91 PolarHBondContact O-N 2.94Å; D91-E94 PolarHBondContact O-N 3Å; D91-F95 WeakPolarHBondContact O-CB 3.23Å; D91-F95 PolarHBondContact O-N 2.96Å |
| 92 | A | 91.2 | Very high | 87.5 | Confident | 15 Ų | 15 | 91.7 Ų | 91.7 | 12% | 0.124 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -64.7 | -40.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | F86 T88 I89 D90 L96 | F86-A92 HydrophobicContact CB-CB 4.05Å; F86-A92 HydrophobicContact CD1-CB 4.44Å; F86-A92 HydrophobicContact CD2-CB 3.56Å; F86-A92 HydrophobicContact CE2-CB 4.13Å; F86-A92 HydrophobicContact CG-CB 3.75Å; T88-A92 PolarHBondContact O-N 3.04Å; I89-A92 PolarHBondContact O-N 3.14Å; D90-A92 PolarHBondContact O-N 3.3Å; A92-L96 VanDerWaalsContact O-CG 3.31Å; A92-L96 WeakPolarHBondContact O-CG 3.47Å; A92-L96 PolarHBondContact O-N 3.32Å |
| 93 | L | 90.5 | Very high | 88.9 | Confident | 73 Ų | 73 | 90.5 Ų | 90.5 | 38% | 0.382 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -68.3 | -39.5 | 176.2 | -71.1 | 179.5 | 0 | 0 | 0 | 112.2 | I89 D90 L96 R97 | I89-L93 HydrophobicContact CG2-CD1 4.01Å; I89-L93 HydrophobicContact CG2-CG 4.25Å; I89-L93 WeakPolarHBondContact O-CG 3.45Å; I89-L93 PolarHBondContact O-N 3.41Å; D90-L93 PolarHBondContact O-N 3.34Å; L93-L96 PolarHBondContact O-N 2.89Å; L93-R97 VanDerWaalsContact O-CG 3.28Å; L93-R97 WeakPolarHBondContact O-CG 3.27Å; L93-R97 PolarHBondContact O-N 3.43Å |
| 94 | E | 91.9 | Very high | 89.8 | Confident | 90 Ų | 90 | 93.3 Ų | 93.3 | 42% | 0.421 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -68.2 | -39.8 | 177.1 | -162.1 | -174.8 | 156.1 | 0 | 0 | 111.3 | D90 D91 R97 K98 | D90-E94 WeakPolarHBondContact O-CB 3.13Å; D90-E94 PolarHBondContact O-N 2.97Å; D91-E94 PolarHBondContact O-N 3Å; E94-R97 PolarHBondContact O-N 3.42Å; E94-K98 VanDerWaalsContact CD-NZ 3.35Å; E94-K98 HydrophobicContact CG-CD 4.45Å; E94-K98 WeakPolarHBondContact O-CB 3.39Å; E94-K98 WeakPolarHBondContact O-CG 3.39Å; E94-K98 PolarHBondContact O-N 3.36Å; E94-K98 WeakPolarHBondContact OE1-CE 3.48Å; E94-K98 IonicContact OE1-NZ 2.69Å; E94-K98 PolarHBondContact OE1-NZ 3.25Å |
| 95 | F | 91.9 | Very high | 90.8 | Very high | 94 Ų | 94 | 95.4 Ų | 95.4 | 41% | 0.412 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -57.8 | -50 | 171.6 | 176.3 | -98.9 | 0 | 0 | 0 | 111.4 | F86 D91 R97 K98 E99 | F86-F95 HydrophobicContact CE1-CB 3.71Å; F86-F95 HydrophobicContact CE1-CD1 4.2Å; F86-F95 HydrophobicContact CE1-CD2 4.31Å; F86-F95 AromaticContact CE1-CG 3.8Å; F86-F95 HydrophobicContact CE1-CG 3.8Å; F86-F95 HydrophobicContact CE2-CD1 4.48Å; F86-F95 HydrophobicContact CZ-CB 3.92Å; F86-F95 AromaticContact CZ-CD1 3.58Å; F86-F95 HydrophobicContact CZ-CD1 3.58Å; F86-F95 HydrophobicContact CZ-CD2 4.37Å; F86-F95 HydrophobicContact CZ-CE1 4.2Å; F86-F95 AromaticContact CZ-CG 3.68Å; F86-F95 HydrophobicContact CZ-CG 3.68Å; D91-F95 WeakPolarHBondContact O-CB 3.23Å; D91-F95 PolarHBondContact O-N 2.96Å; F95-R97 VanDerWaalsContact C-N 3.31Å; F95-R97 PolarHBondContact O-N 3.48Å; F95-K98 PolarHBondContact O-N 3.46Å; F95-E99 WeakPolarHBondContact O-CB 3.25Å; F95-E99 PolarHBondContact O-N 2.99Å |
| 96 | L | 90.5 | Very high | 91.3 | Very high | 97 Ų | 97 | 98.5 Ų | 98.5 | 51% | 0.508 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -58.9 | -41.3 | 176.4 | -73.7 | 169.8 | 0 | 0 | 0 | 112.3 | A92 L93 E99 L100 | A92-L96 VanDerWaalsContact O-CG 3.31Å; A92-L96 WeakPolarHBondContact O-CG 3.47Å; A92-L96 PolarHBondContact O-N 3.32Å; L93-L96 PolarHBondContact O-N 2.89Å; L96-E99 PolarHBondContact O-N 2.97Å; L96-L100 WeakPolarHBondContact O-CB 3.33Å; L96-L100 VanDerWaalsContact O-CG 3.22Å; L96-L100 WeakPolarHBondContact O-CG 3.37Å; L96-L100 PolarHBondContact O-N 3.13Å |
| 97 | R | 94.8 | Very high | 91.8 | Very high | 172 Ų | 172 | 101 Ų | 101 | 65% | 0.649 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.3 | -43.5 | 175.9 | -74.1 | 169.9 | -179 | 156.8 | 1.6 | 112 | L93 E94 F95 L100 L101 | L93-R97 VanDerWaalsContact O-CG 3.28Å; L93-R97 WeakPolarHBondContact O-CG 3.27Å; L93-R97 PolarHBondContact O-N 3.43Å; E94-R97 PolarHBondContact O-N 3.42Å; F95-R97 VanDerWaalsContact C-N 3.31Å; F95-R97 PolarHBondContact O-N 3.48Å; R97-L100 PolarHBondContact O-N 2.8Å; R97-L101 WeakPolarHBondContact O-CB 3.33Å; R97-L101 PolarHBondContact O-N 3.13Å |
| 98 | K | 93.7 | Very high | 92.2 | Very high | 115 Ų | 115 | 100.5 Ų | 100.5 | 50% | 0.5 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.1 | -44.3 | 177.3 | -75.4 | 169.8 | -178.7 | 161.3 | 0 | 111.3 | E94 F95 L101 T102 | E94-K98 VanDerWaalsContact CD-NZ 3.35Å; E94-K98 HydrophobicContact CG-CD 4.45Å; E94-K98 WeakPolarHBondContact O-CB 3.39Å; E94-K98 WeakPolarHBondContact O-CG 3.39Å; E94-K98 PolarHBondContact O-N 3.36Å; E94-K98 WeakPolarHBondContact OE1-CE 3.48Å; E94-K98 IonicContact OE1-NZ 2.69Å; E94-K98 PolarHBondContact OE1-NZ 3.25Å; F95-K98 PolarHBondContact O-N 3.46Å; K98-L101 PolarHBondContact O-N 3.24Å; K98-T102 WeakPolarHBondContact O-CB 3.37Å; K98-T102 PolarHBondContact O-N 2.92Å; K98-T102 PolarHBondContact O-OG1 2.93Å |
| 99 | E | 93.4 | Very high | 92.4 | Very high | 108 Ų | 108 | 102 Ų | 102 | 51% | 0.505 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.7 | -44.8 | 179.4 | -157.3 | 67.2 | -173.3 | 0 | 0 | 111.1 | F95 L96 L101 T102 A103 | F95-E99 WeakPolarHBondContact O-CB 3.25Å; F95-E99 PolarHBondContact O-N 2.99Å; L96-E99 PolarHBondContact O-N 2.97Å; E99-L101 PolarHBondContact O-N 3.48Å; E99-T102 PolarHBondContact O-N 3.4Å; E99-A103 WeakPolarHBondContact O-CB 3.48Å; E99-A103 PolarHBondContact O-N 3.16Å |
| 100 | L | 94.1 | Very high | 92.6 | Very high | 124 Ų | 124 | 102.2 Ų | 102.2 | 65% | 0.649 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.5 | -42.2 | 175.4 | -73.9 | 172.2 | 0 | 0 | 0 | 112.4 | L96 R97 T102 Q104 | L96-L100 WeakPolarHBondContact O-CB 3.33Å; L96-L100 VanDerWaalsContact O-CG 3.22Å; L96-L100 WeakPolarHBondContact O-CG 3.37Å; L96-L100 PolarHBondContact O-N 3.13Å; R97-L100 PolarHBondContact O-N 2.8Å; L100-T102 VanDerWaalsContact C-N 3.33Å; L100-Q104 WeakPolarHBondContact O-CB 3.36Å; L100-Q104 PolarHBondContact O-N 3.2Å |
| 101 | L | 94.5 | Very high | 92.8 | Very high | 99 Ų | 99 | 101.2 Ų | 101.2 | 52% | 0.518 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.7 | -39.7 | 177.9 | -167.6 | 152.9 | 0 | 0 | 0 | 111.3 | R97 K98 E99 R105 | R97-L101 WeakPolarHBondContact O-CB 3.33Å; R97-L101 PolarHBondContact O-N 3.13Å; K98-L101 PolarHBondContact O-N 3.24Å; E99-L101 PolarHBondContact O-N 3.48Å; L101-R105 WeakPolarHBondContact O-CB 3.39Å; L101-R105 PolarHBondContact O-N 2.8Å |
| 102 | T | 93.9 | Very high | 92.9 | Very high | 83 Ų | 83 | 100.8 Ų | 100.8 | 51% | 0.509 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.9 | -49.8 | 179.1 | -53.8 | 0 | 0 | 0 | 0 | 110.9 | K98 E99 L100 Q104 R105 E106 | K98-T102 WeakPolarHBondContact O-CB 3.37Å; K98-T102 PolarHBondContact O-N 2.92Å; K98-T102 PolarHBondContact O-OG1 2.93Å; E99-T102 PolarHBondContact O-N 3.4Å; L100-T102 VanDerWaalsContact C-N 3.33Å; T102-Q104 VanDerWaalsContact C-N 3.35Å; T102-Q104 PolarHBondContact O-N 3.39Å; T102-R105 PolarHBondContact O-N 2.69Å; T102-E106 PolarHBondContact O-N 2.93Å |
| 103 | A | 91.5 | Very high | 93 | Very high | 52 Ų | 52 | 108.2 Ų | 108.2 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.5 | -41 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | E99 R105 E106 M107 | E99-A103 WeakPolarHBondContact O-CB 3.48Å; E99-A103 PolarHBondContact O-N 3.16Å; A103-R105 VanDerWaalsContact C-N 3.33Å; A103-R105 PolarHBondContact O-N 2.89Å; A103-E106 PolarHBondContact O-N 3.29Å; A103-M107 WeakPolarHBondContact O-CB 3.36Å; A103-M107 PolarHBondContact O-N 2.89Å |
| 104 | Q | 91.8 | Very high | 93.2 | Very high | 121 Ų | 121 | 109 Ų | 109 | 57% | 0.565 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62.1 | -42.4 | 175.5 | -177.4 | -177.5 | 1.3 | 0 | 0 | 111.5 | L100 T102 E106 M107 Q108 | L100-Q104 WeakPolarHBondContact O-CB 3.36Å; L100-Q104 PolarHBondContact O-N 3.2Å; T102-Q104 VanDerWaalsContact C-N 3.35Å; T102-Q104 PolarHBondContact O-N 3.39Å; Q104-E106 VanDerWaalsContact C-N 3.35Å; Q104-M107 PolarHBondContact O-N 2.96Å; Q104-Q108 WeakPolarHBondContact O-CB 3.45Å; Q104-Q108 PolarHBondContact O-N 2.92Å |
| 105 | R | 93.4 | Very high | 93.2 | Very high | 164 Ų | 164 | 106.2 Ų | 106.2 | 62% | 0.619 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.8 | -41.3 | 179.2 | -169.1 | 172.4 | -132.9 | 119.9 | 2.8 | 111.4 | L101 T102 A103 Q108 V109 | L101-R105 WeakPolarHBondContact O-CB 3.39Å; L101-R105 PolarHBondContact O-N 2.8Å; T102-R105 PolarHBondContact O-N 2.69Å; A103-R105 VanDerWaalsContact C-N 3.33Å; A103-R105 PolarHBondContact O-N 2.89Å; R105-Q108 PolarHBondContact O-N 3.07Å; R105-V109 VanDerWaalsContact O-CG2 3.28Å; R105-V109 WeakPolarHBondContact O-CG2 3.4Å; R105-V109 PolarHBondContact O-N 3.48Å |
| 106 | E | 94.1 | Very high | 93.2 | Very high | 121 Ų | 121 | 105.9 Ų | 105.9 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.9 | -49.5 | 175.8 | -175.8 | 172.3 | -173.6 | 0 | 0 | 111.6 | T102 A103 Q104 Q108 V109 Q110 | T102-E106 PolarHBondContact O-N 2.93Å; A103-E106 PolarHBondContact O-N 3.29Å; Q104-E106 VanDerWaalsContact C-N 3.35Å; E106-Q108 VanDerWaalsContact C-N 3.31Å; E106-Q108 PolarHBondContact O-N 3.48Å; E106-V109 PolarHBondContact O-N 2.89Å; E106-V109 VanDerWaalsContact O-N 3.15Å; E106-Q110 WeakPolarHBondContact O-CG 3.33Å; E106-Q110 PolarHBondContact O-N 3.03Å |
| 107 | M | 94.1 | Very high | 93.4 | Very high | 107 Ų | 107 | 105.6 Ų | 105.6 | 53% | 0.527 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -57.7 | -44.1 | 176.6 | -175.4 | -177.5 | 70.6 | 0 | 0 | 111.5 | A103 Q104 V109 Q110 D111 | A103-M107 WeakPolarHBondContact O-CB 3.36Å; A103-M107 PolarHBondContact O-N 2.89Å; Q104-M107 PolarHBondContact O-N 2.96Å; M107-V109 VanDerWaalsContact C-N 3.33Å; M107-V109 PolarHBondContact O-N 3.39Å; M107-Q110 PolarHBondContact O-N 3.25Å; M107-D111 PolarHBondContact O-N 3.26Å |
| 108 | Q | 93.1 | Very high | 93.3 | Very high | 127 Ų | 127 | 102.9 Ų | 102.9 | 59% | 0.593 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.2 | -37.8 | 178.4 | -170.4 | -178.5 | 20.7 | 0 | 0 | 112.6 | Q104 R105 E106 N112 | Q104-Q108 WeakPolarHBondContact O-CB 3.45Å; Q104-Q108 PolarHBondContact O-N 2.92Å; R105-Q108 PolarHBondContact O-N 3.07Å; E106-Q108 VanDerWaalsContact C-N 3.31Å; E106-Q108 PolarHBondContact O-N 3.48Å; Q108-N112 WeakPolarHBondContact O-CB 3.36Å; Q108-N112 PolarHBondContact O-N 3.38Å |
| 109 | V | 93.1 | Very high | 93.2 | Very high | 95 Ų | 95 | 98.7 Ų | 98.7 | 58% | 0.576 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.8 | -42.1 | 176.1 | 168.7 | 0 | 0 | 0 | 0 | 110.8 | R105 E106 M107 N112 R113 | R105-V109 VanDerWaalsContact O-CG2 3.28Å; R105-V109 WeakPolarHBondContact O-CG2 3.4Å; R105-V109 PolarHBondContact O-N 3.48Å; E106-V109 PolarHBondContact O-N 2.89Å; E106-V109 VanDerWaalsContact O-N 3.15Å; M107-V109 VanDerWaalsContact C-N 3.33Å; M107-V109 PolarHBondContact O-N 3.39Å; V109-N112 PolarHBondContact O-N 3Å; V109-R113 PolarHBondContact O-N 2.91Å |
| 110 | Q | 95.1 | Very high | 93.2 | Very high | 108 Ų | 108 | 100 Ų | 100 | 51% | 0.505 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.7 | -48.1 | 175.8 | -69.4 | -179.2 | 0.7 | 0 | 0 | 111.3 | E106 M107 N112 R113 L114 | E106-Q110 WeakPolarHBondContact O-CG 3.33Å; E106-Q110 PolarHBondContact O-N 3.03Å; M107-Q110 PolarHBondContact O-N 3.25Å; Q110-N112 VanDerWaalsContact C-N 3.34Å; Q110-N112 PolarHBondContact O-N 3.37Å; Q110-R113 WeakPolarHBondContact O-CB 3.18Å; Q110-R113 PolarHBondContact O-N 2.97Å; Q110-L114 WeakPolarHBondContact O-CG 3.44Å; Q110-L114 PolarHBondContact O-N 3.45Å |
| 111 | D | 93.7 | Very high | 93.2 | Very high | 95 Ų | 95 | 98.2 Ų | 98.2 | 51% | 0.508 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.9 | -41.4 | 177.6 | -78.2 | -14.7 | 0 | 0 | 0 | 112.1 | M107 R113 L114 A115 | M107-D111 PolarHBondContact O-N 3.26Å; D111-R113 VanDerWaalsContact C-N 3.33Å; D111-R113 PolarHBondContact O-N 3.26Å; D111-L114 PolarHBondContact O-N 2.93Å; D111-A115 WeakPolarHBondContact O-CB 3.47Å; D111-A115 PolarHBondContact O-N 2.9Å |
| 112 | N | 90.9 | Very high | 93.2 | Very high | 56 Ų | 56 | 101 Ų | 101 | 30% | 0.299 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.5 | -43.4 | 177.2 | -165.5 | -81.8 | 0 | 0 | 0 | 111.6 | L18 Q108 V109 Q110 A115 R116 | L18-N112 WeakPolarHBondContact CD2-ND2 3.43Å; Q108-N112 WeakPolarHBondContact O-CB 3.36Å; Q108-N112 PolarHBondContact O-N 3.38Å; V109-N112 PolarHBondContact O-N 3Å; Q110-N112 VanDerWaalsContact C-N 3.34Å; Q110-N112 PolarHBondContact O-N 3.37Å; N112-A115 PolarHBondContact O-N 3.09Å; N112-R116 WeakPolarHBondContact O-CG 3.34Å; N112-R116 PolarHBondContact O-N 3.25Å; N112-R116 PolarHBondContact OD1-NE 2.7Å |
| 113 | R | 92.6 | Very high | 93.1 | Very high | 171 Ų | 171 | 98.5 Ų | 98.5 | 65% | 0.645 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -61.3 | -48 | 176.6 | 178.8 | -178 | 171.7 | -174.3 | -0.9 | 111.2 | V109 Q110 D111 A115 R116 Q117 | V109-R113 PolarHBondContact O-N 2.91Å; Q110-R113 WeakPolarHBondContact O-CB 3.18Å; Q110-R113 PolarHBondContact O-N 2.97Å; D111-R113 VanDerWaalsContact C-N 3.33Å; D111-R113 PolarHBondContact O-N 3.26Å; R113-A115 PolarHBondContact O-N 3.48Å; R113-R116 PolarHBondContact O-N 3.39Å; R113-Q117 WeakPolarHBondContact O-CG 3.37Å; R113-Q117 PolarHBondContact O-N 2.95Å |
| 114 | L | 94.7 | Very high | 93.2 | Very high | 91 Ų | 91 | 100.5 Ų | 100.5 | 48% | 0.476 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.4 | -44 | 178.3 | -72.7 | 172.5 | 0 | 0 | 0 | 111.6 | Q110 D111 R116 Q117 L118 | Q110-L114 WeakPolarHBondContact O-CG 3.44Å; Q110-L114 PolarHBondContact O-N 3.45Å; D111-L114 PolarHBondContact O-N 2.93Å; L114-R116 VanDerWaalsContact C-N 3.34Å; L114-R116 PolarHBondContact O-N 3.26Å; L114-Q117 PolarHBondContact O-N 3.22Å; L114-L118 WeakPolarHBondContact O-CG 3.37Å; L114-L118 PolarHBondContact O-N 3.38Å |
| 115 | A | 92.7 | Very high | 93.5 | Very high | 31 Ų | 31 | 99 Ų | 99 | 26% | 0.256 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.1 | -45 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | L18 D111 N112 R113 Q117 L118 I119 | L18-A115 HydrophobicContact CD1-CB 3.96Å; L18-A115 HydrophobicContact CD2-CB 4.25Å; D111-A115 WeakPolarHBondContact O-CB 3.47Å; D111-A115 PolarHBondContact O-N 2.9Å; N112-A115 PolarHBondContact O-N 3.09Å; R113-A115 PolarHBondContact O-N 3.48Å; A115-Q117 VanDerWaalsContact C-N 3.35Å; A115-Q117 PolarHBondContact O-N 3.43Å; A115-L118 PolarHBondContact O-N 3.48Å; A115-I119 VanDerWaalsContact O-CG1 3.27Å; A115-I119 WeakPolarHBondContact O-CG1 3.22Å; A115-I119 PolarHBondContact O-N 2.91Å |
| 116 | R | 91.9 | Very high | 93.6 | Very high | 86 Ų | 86 | 97 Ų | 97 | 33% | 0.325 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.3 | -40.2 | 176 | -70.6 | 179 | -175.2 | -81.1 | 0.2 | 112.2 | D17 L18 D19 N112 R113 L114 R120 | D17-R116 IonicContact OD1-CZ 3.85Å; D17-R116 IonicContact OD1-NH1 2.81Å; D17-R116 PolarHBondContact OD1-NH1 2.86Å; L18-R116 HydrophobicContact CB-CG 4.17Å; L18-R116 HydrophobicContact CD2-CG 4.22Å; D19-R116 IonicContact OD2-NH2 3.63Å; N112-R116 WeakPolarHBondContact O-CG 3.34Å; N112-R116 PolarHBondContact O-N 3.25Å; N112-R116 PolarHBondContact OD1-NE 2.7Å; R113-R116 PolarHBondContact O-N 3.39Å; L114-R116 VanDerWaalsContact C-N 3.34Å; L114-R116 PolarHBondContact O-N 3.26Å; R116-R120 WeakPolarHBondContact O-CG 3.46Å; R116-R120 PolarHBondContact O-N 3.24Å; R116-R120 VanDerWaalsContact O-N 3.14Å |
| 117 | Q | 94.2 | Very high | 93.7 | Very high | 91 Ų | 91 | 98.2 Ų | 98.2 | 43% | 0.425 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.2 | -44.7 | 175.7 | -72.3 | -178.5 | -50.2 | 0 | 0 | 112.1 | R113 L114 A115 I119 R120 L121 | R113-Q117 WeakPolarHBondContact O-CG 3.37Å; R113-Q117 PolarHBondContact O-N 2.95Å; L114-Q117 PolarHBondContact O-N 3.22Å; A115-Q117 VanDerWaalsContact C-N 3.35Å; A115-Q117 PolarHBondContact O-N 3.43Å; Q117-I119 VanDerWaalsContact C-N 3.34Å; Q117-I119 PolarHBondContact O-N 2.89Å; Q117-R120 PolarHBondContact O-N 2.96Å; Q117-L121 WeakPolarHBondContact O-CG 3.3Å; Q117-L121 PolarHBondContact O-N 3.29Å |
| 118 | L | 93.9 | Very high | 93.8 | Very high | 116 Ų | 116 | 97.7 Ų | 97.7 | 61% | 0.607 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -63.2 | -39.9 | 178.9 | -73.6 | 171.1 | 0 | 0 | 0 | 112.3 | L114 A115 L121 R122 | L114-L118 WeakPolarHBondContact O-CG 3.37Å; L114-L118 PolarHBondContact O-N 3.38Å; A115-L118 PolarHBondContact O-N 3.48Å; L118-L121 PolarHBondContact O-N 3.37Å; L118-R122 WeakPolarHBondContact O-CB 3.28Å; L118-R122 PolarHBondContact O-N 2.88Å |
| 119 | I | 91.4 | Very high | 94.1 | Very high | 26 Ų | 26 | 97.6 Ų | 97.6 | 13% | 0.133 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -63.2 | -45.1 | 176.5 | -70.1 | 166.5 | 0 | 0 | 0 | 110.9 | E16 L18 V21 A115 Q117 R122 G123 | E16-I119 HydrophobicContact CB-CG2 3.62Å; E16-I119 HydrophobicContact CG-CG2 4.46Å; E16-I119 VanDerWaalsContact O-CG2 3.25Å; E16-I119 WeakPolarHBondContact O-CG2 3.22Å; L18-I119 HydrophobicContact CB-CD1 4.18Å; L18-I119 HydrophobicContact CD1-CD1 3.5Å; L18-I119 VanDerWaalsContact CD1-CD1 3.5Å; L18-I119 HydrophobicContact CG-CD1 4.44Å; V21-I119 HydrophobicContact CG2-CD1 4.44Å; A115-I119 VanDerWaalsContact O-CG1 3.27Å; A115-I119 WeakPolarHBondContact O-CG1 3.22Å; A115-I119 PolarHBondContact O-N 2.91Å; Q117-I119 VanDerWaalsContact C-N 3.34Å; Q117-I119 PolarHBondContact O-N 2.89Å; I119-R122 WeakPolarHBondContact O-CB 3.38Å; I119-R122 PolarHBondContact O-N 3.32Å; I119-G123 PolarHBondContact O-N 3.47Å; I119-G123 VanDerWaalsContact O-N 3.07Å |
| 120 | R | 92.6 | Very high | 94.3 | Very high | 136 Ų | 136 | 96.4 Ų | 96.4 | 51% | 0.513 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -59.6 | -50.6 | 175.5 | -72 | 177.1 | -176.9 | -157.2 | -1.6 | 112.2 | T15 R116 Q117 R122 G123 E124 | T15-R120 HydrophobicContact CG2-CG 3.99Å; R116-R120 WeakPolarHBondContact O-CG 3.46Å; R116-R120 PolarHBondContact O-N 3.24Å; R116-R120 VanDerWaalsContact O-N 3.14Å; Q117-R120 PolarHBondContact O-N 2.96Å; R120-R122 VanDerWaalsContact C-N 3.27Å; R120-R122 PolarHBondContact O-N 3.45Å; R120-G123 PolarHBondContact O-N 3.03Å; R120-E124 PolarHBondContact O-N 3.03Å |
| 121 | L | 94.9 | Very high | 94.5 | Very high | 86 Ų | 86 | 96 Ų | 96 | 45% | 0.45 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59 | -39.1 | 178 | -73.1 | 171.6 | 0 | 0 | 0 | 111.8 | Q117 L118 G123 E124 I125 | Q117-L121 WeakPolarHBondContact O-CG 3.3Å; Q117-L121 PolarHBondContact O-N 3.29Å; L118-L121 PolarHBondContact O-N 3.37Å; L121-G123 VanDerWaalsContact C-N 3.34Å; L121-G123 PolarHBondContact O-N 2.87Å; L121-E124 PolarHBondContact O-N 3.09Å; L121-I125 WeakPolarHBondContact O-CB 3.34Å; L121-I125 WeakPolarHBondContact O-CD1 3.27Å; L121-I125 WeakPolarHBondContact O-CG1 3.31Å; L121-I125 PolarHBondContact O-N 3.05Å |
| 122 | R | 94.2 | Very high | 94.7 | Very high | 157 Ų | 157 | 98.2 Ų | 98.2 | 59% | 0.592 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -59.9 | -44.7 | 175 | 178.3 | -176.4 | 174 | -92.4 | -6.3 | 111.4 | E16 L118 I119 R120 H126 | E16-R122 IonicContact OE1-NH1 3.82Å; E16-R122 PolarHBondContact OE1-NH1 3.34Å; E16-R122 IonicContact OE2-NH1 3.39Å; E16-R122 PolarHBondContact OE2-NH1 3.41Å; L118-R122 WeakPolarHBondContact O-CB 3.28Å; L118-R122 PolarHBondContact O-N 2.88Å; I119-R122 WeakPolarHBondContact O-CB 3.38Å; I119-R122 PolarHBondContact O-N 3.32Å; R120-R122 VanDerWaalsContact C-N 3.27Å; R120-R122 PolarHBondContact O-N 3.45Å; R122-H126 WeakPolarHBondContact O-CB 3.49Å; R122-H126 PolarHBondContact O-N 3.32Å |
| 123 | G | 90.6 | Very high | 95 | Very high | 32 Ų | 32 | 100.3 Ų | 100.3 | 33% | 0.33 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.4 | -47.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | I119 R120 L121 H126 R127 | I119-G123 PolarHBondContact O-N 3.47Å; I119-G123 VanDerWaalsContact O-N 3.07Å; R120-G123 PolarHBondContact O-N 3.03Å; L121-G123 VanDerWaalsContact C-N 3.34Å; L121-G123 PolarHBondContact O-N 2.87Å; G123-H126 PolarHBondContact O-N 3.48Å; G123-R127 PolarHBondContact O-N 2.89Å |
| 124 | E | 95.1 | Very high | 95.3 | Very high | 93 Ų | 93 | 95.7 Ų | 95.7 | 44% | 0.435 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.3 | -47.2 | 177.6 | -71.1 | 171.3 | -168.3 | 0 | 0 | 112.1 | R120 L121 H126 R127 L128 | R120-E124 PolarHBondContact O-N 3.03Å; L121-E124 PolarHBondContact O-N 3.09Å; E124-H126 VanDerWaalsContact C-N 3.28Å; E124-H126 PolarHBondContact O-N 2.97Å; E124-R127 PolarHBondContact O-N 3.33Å; E124-L128 WeakPolarHBondContact O-CB 3.41Å; E124-L128 WeakPolarHBondContact O-CG 3.44Å; E124-L128 PolarHBondContact O-N 3.22Å |
| 125 | I | 96.5 | Very high | 95.4 | Very high | 89 Ų | 89 | 96.8 Ų | 96.8 | 46% | 0.456 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.2 | -41.4 | 176.4 | -70.5 | 165.4 | 0 | 0 | 0 | 110.6 | L121 K129 | L121-I125 WeakPolarHBondContact O-CB 3.34Å; L121-I125 WeakPolarHBondContact O-CD1 3.27Å; L121-I125 WeakPolarHBondContact O-CG1 3.31Å; L121-I125 PolarHBondContact O-N 3.05Å; I125-K129 HydrophobicContact CG2-CD 4.06Å; I125-K129 HydrophobicContact CG2-CG 4.49Å; I125-K129 WeakPolarHBondContact O-CB 3.26Å; I125-K129 VanDerWaalsContact O-CG 3.26Å; I125-K129 WeakPolarHBondContact O-CG 3.39Å; I125-K129 PolarHBondContact O-N 3.49Å |
| 126 | H | 95.8 | Very high | 95.7 | Very high | 124 Ų | 124 | 103.6 Ų | 103.6 | 57% | 0.574 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -65.1 | -46.9 | 178.6 | -175.1 | 61.7 | 0 | 0 | 0 | 111.4 | R122 G123 E124 L128 K129 V130 | R122-H126 WeakPolarHBondContact O-CB 3.49Å; R122-H126 PolarHBondContact O-N 3.32Å; G123-H126 PolarHBondContact O-N 3.48Å; E124-H126 VanDerWaalsContact C-N 3.28Å; E124-H126 PolarHBondContact O-N 2.97Å; H126-L128 PolarHBondContact O-N 2.98Å; H126-K129 WeakPolarHBondContact O-CB 3.31Å; H126-K129 PolarHBondContact O-N 3.39Å; H126-V130 WeakPolarHBondContact O-CG2 3.28Å; H126-V130 PolarHBondContact O-N 3.28Å |
| 127 | R | 96.3 | Very high | 96 | Very high | 145 Ų | 145 | 104.2 Ų | 104.2 | 55% | 0.547 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -56.7 | -51.3 | 176.2 | -173.3 | -175.7 | 71.5 | -151.8 | -3.3 | 111.3 | G123 E124 K129 V130 E131 | G123-R127 PolarHBondContact O-N 2.89Å; E124-R127 PolarHBondContact O-N 3.33Å; R127-K129 VanDerWaalsContact C-N 3.29Å; R127-K129 PolarHBondContact O-N 3.17Å; R127-V130 PolarHBondContact O-N 3.11Å; R127-V130 VanDerWaalsContact O-N 3.09Å; R127-E131 WeakPolarHBondContact CG-OE1 3.44Å; R127-E131 IonicContact NE-OE1 3.9Å; R127-E131 WeakPolarHBondContact O-CG 3.32Å; R127-E131 PolarHBondContact O-N 3.28Å |
| 128 | L | 97.6 | Very high | 96.2 | Very high | 96 Ų | 96 | 105.8 Ų | 105.8 | 50% | 0.503 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60 | -38.7 | 178.9 | -71.2 | 172.4 | 0 | 0 | 0 | 112.2 | E124 H126 E131 Q132 | E124-L128 WeakPolarHBondContact O-CB 3.41Å; E124-L128 WeakPolarHBondContact O-CG 3.44Å; E124-L128 PolarHBondContact O-N 3.22Å; H126-L128 PolarHBondContact O-N 2.98Å; L128-E131 PolarHBondContact O-N 2.92Å; L128-Q132 VanDerWaalsContact O-CB 3.28Å; L128-Q132 WeakPolarHBondContact O-CB 3.39Å; L128-Q132 PolarHBondContact O-N 3.17Å |
| 129 | K | 98.2 | Very high | 96.3 | Very high | 125 Ų | 125 | 104.7 Ų | 104.7 | 54% | 0.543 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.1 | -41.6 | 174.9 | -79.4 | 176.7 | 177.8 | -177.8 | 0 | 112.2 | I125 H126 R127 V133 | I125-K129 HydrophobicContact CG2-CD 4.06Å; I125-K129 HydrophobicContact CG2-CG 4.49Å; I125-K129 WeakPolarHBondContact O-CB 3.26Å; I125-K129 VanDerWaalsContact O-CG 3.26Å; I125-K129 WeakPolarHBondContact O-CG 3.39Å; I125-K129 PolarHBondContact O-N 3.49Å; H126-K129 WeakPolarHBondContact O-CB 3.31Å; H126-K129 PolarHBondContact O-N 3.39Å; R127-K129 VanDerWaalsContact C-N 3.29Å; R127-K129 PolarHBondContact O-N 3.17Å; K129-V133 VanDerWaalsContact O-CG2 3.31Å; K129-V133 WeakPolarHBondContact O-CG2 3.5Å; K129-V133 PolarHBondContact O-N 3.28Å |
| 130 | V | 97.9 | Very high | 96.6 | Very high | 70 Ų | 70 | 108.4 Ų | 108.4 | 42% | 0.424 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64 | -49.4 | 176.6 | 172.9 | 0 | 0 | 0 | 0 | 109.9 | H126 R127 Q132 V133 C134 | H126-V130 WeakPolarHBondContact O-CG2 3.28Å; H126-V130 PolarHBondContact O-N 3.28Å; R127-V130 PolarHBondContact O-N 3.11Å; R127-V130 VanDerWaalsContact O-N 3.09Å; V130-Q132 VanDerWaalsContact C-N 3.32Å; V130-Q132 PolarHBondContact O-N 3.21Å; V130-V133 PolarHBondContact O-N 3.3Å; V130-C134 WeakPolarHBondContact O-CB 3.48Å; V130-C134 PolarHBondContact O-N 3.28Å; V130-C134 PolarHBondContact O-SG 3.49Å |
| 131 | E | 97.8 | Very high | 96.9 | Very high | 99 Ų | 99 | 106.2 Ų | 106.2 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -56.1 | -45.6 | 176.7 | -73.8 | 171.2 | -171.2 | 0 | 0 | 111.9 | R127 L128 V133 C134 H135 | R127-E131 WeakPolarHBondContact CG-OE1 3.44Å; R127-E131 IonicContact NE-OE1 3.9Å; R127-E131 WeakPolarHBondContact O-CG 3.32Å; R127-E131 PolarHBondContact O-N 3.28Å; L128-E131 PolarHBondContact O-N 2.92Å; E131-V133 PolarHBondContact O-N 2.89Å; E131-C134 PolarHBondContact O-N 3.47Å; E131-H135 WeakPolarHBondContact O-CB 3.47Å; E131-H135 PolarHBondContact O-N 2.91Å |
| 132 | Q | 98.3 | Very high | 97 | Very high | 143 Ų | 143 | 105.1 Ų | 105.1 | 67% | 0.668 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61 | -44.8 | 177.8 | -175.5 | -178.7 | 29.2 | 0 | 0 | 112.3 | L128 V130 H135 R136 | L128-Q132 VanDerWaalsContact O-CB 3.28Å; L128-Q132 WeakPolarHBondContact O-CB 3.39Å; L128-Q132 PolarHBondContact O-N 3.17Å; V130-Q132 VanDerWaalsContact C-N 3.32Å; V130-Q132 PolarHBondContact O-N 3.21Å; Q132-H135 PolarHBondContact O-N 2.95Å; Q132-R136 PolarHBondContact O-N 2.93Å |
| 133 | V | 97.9 | Very high | 97.1 | Very high | 99 Ų | 99 | 102.2 Ų | 102.2 | 60% | 0.6 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.3 | -41.6 | 178.3 | 170.7 | 0 | 0 | 0 | 0 | 110.8 | K129 V130 E131 R136 H137 | K129-V133 VanDerWaalsContact O-CG2 3.31Å; K129-V133 WeakPolarHBondContact O-CG2 3.5Å; K129-V133 PolarHBondContact O-N 3.28Å; V130-V133 PolarHBondContact O-N 3.3Å; E131-V133 PolarHBondContact O-N 2.89Å; V133-R136 PolarHBondContact O-N 3.32Å; V133-H137 WeakPolarHBondContact O-CB 3.45Å; V133-H137 PolarHBondContact O-N 3.27Å |
| 134 | C | 98.1 | Very high | 97.3 | Very high | 75 Ų | 75 | 102.8 Ų | 102.8 | 51% | 0.507 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.3 | -44.3 | 175.4 | -71.4 | 0 | 0 | 0 | 0 | 111.8 | V130 E131 H137 K138 | V130-C134 WeakPolarHBondContact O-CB 3.48Å; V130-C134 PolarHBondContact O-N 3.28Å; V130-C134 PolarHBondContact O-SG 3.49Å; E131-C134 PolarHBondContact O-N 3.47Å; C134-H137 PolarHBondContact O-N 2.92Å; C134-K138 PolarHBondContact O-N 3.02Å |
| 135 | H | 98.3 | Very high | 97.2 | Very high | 114 Ų | 114 | 101.5 Ų | 101.5 | 53% | 0.528 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.6 | -48.7 | 178 | -172.8 | 58.1 | 0 | 0 | 0 | 111.5 | E131 Q132 H137 K138 E139 | E131-H135 WeakPolarHBondContact O-CB 3.47Å; E131-H135 PolarHBondContact O-N 2.91Å; Q132-H135 PolarHBondContact O-N 2.95Å; H135-H137 VanDerWaalsContact C-N 3.27Å; H135-H137 PolarHBondContact O-N 3.45Å; H135-K138 WeakPolarHBondContact O-CB 3.38Å; H135-K138 PolarHBondContact O-N 3.43Å; H135-K138 VanDerWaalsContact O-N 3.08Å; H135-E139 IonicContact CD2-OE1 2.96Å; H135-E139 IonicContact NE2-OE1 2.89Å; H135-E139 PolarHBondContact NE2-OE1 3.08Å; H135-E139 PolarHBondContact O-N 2.89Å |
| 136 | R | 97.7 | Very high | 97 | Very high | 174 Ų | 174 | 103.9 Ų | 103.9 | 66% | 0.657 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.5 | -37.6 | 176.1 | -173.2 | 175.2 | -177.7 | -176.8 | 1.4 | 112.5 | Q132 V133 K138 E139 M140 | Q132-R136 PolarHBondContact O-N 2.93Å; V133-R136 PolarHBondContact O-N 3.32Å; R136-K138 VanDerWaalsContact C-N 3.34Å; R136-E139 PolarHBondContact O-N 3.2Å; R136-M140 WeakPolarHBondContact O-CG 3.49Å; R136-M140 PolarHBondContact O-N 2.68Å; R136-M140 VanDerWaalsContact O-N 3.14Å |
| 137 | H | 98.3 | Very high | 96.7 | Very high | 99 Ų | 99 | 104.2 Ų | 104.2 | 46% | 0.458 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.6 | -40.1 | 175.6 | -176.1 | 52.5 | 0 | 0 | 0 | 111.9 | V133 C134 H135 M140 L141 | V133-H137 WeakPolarHBondContact O-CB 3.45Å; V133-H137 PolarHBondContact O-N 3.27Å; C134-H137 PolarHBondContact O-N 2.92Å; H135-H137 VanDerWaalsContact C-N 3.27Å; H135-H137 PolarHBondContact O-N 3.45Å; H137-M140 HydrophobicContact CB-CE 4.39Å; H137-M140 PolarHBondContact O-N 2.92Å; H137-L141 WeakPolarHBondContact O-CG 3.4Å; H137-L141 PolarHBondContact O-N 3.04Å |
| 138 | K | 97.9 | Very high | 96.2 | Very high | 124 Ų | 124 | 103.3 Ų | 103.3 | 54% | 0.539 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.3 | -47.7 | 174.4 | -176.4 | 178.2 | 176.8 | 175.5 | 0 | 111.5 | C134 H135 R136 M140 L141 D142 | C134-K138 PolarHBondContact O-N 3.02Å; H135-K138 WeakPolarHBondContact O-CB 3.38Å; H135-K138 PolarHBondContact O-N 3.43Å; H135-K138 VanDerWaalsContact O-N 3.08Å; R136-K138 VanDerWaalsContact C-N 3.34Å; K138-M140 VanDerWaalsContact C-N 3.29Å; K138-M140 PolarHBondContact O-N 3.3Å; K138-L141 WeakPolarHBondContact O-CB 3Å; K138-L141 PolarHBondContact O-N 3.4Å; K138-D142 WeakPolarHBondContact CE-OD2 3.42Å; K138-D142 WeakPolarHBondContact O-CB 3.41Å; K138-D142 VanDerWaalsContact O-CG 3.27Å; K138-D142 PolarHBondContact O-N 3.43Å |
| 139 | E | 97.8 | Very high | 95.5 | Very high | 93 Ų | 93 | 103 Ų | 103 | 44% | 0.435 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -54.8 | -45.6 | 176.1 | -68.8 | 175.7 | 148.9 | 0 | 0 | 111.5 | H135 R136 L141 D142 D143 | H135-E139 IonicContact CD2-OE1 2.96Å; H135-E139 IonicContact NE2-OE1 2.89Å; H135-E139 PolarHBondContact NE2-OE1 3.08Å; H135-E139 PolarHBondContact O-N 2.89Å; R136-E139 PolarHBondContact O-N 3.2Å; E139-L141 VanDerWaalsContact C-N 3.32Å; E139-L141 PolarHBondContact O-N 3.26Å; E139-D142 PolarHBondContact O-N 3.37Å; E139-D143 WeakPolarHBondContact O-CB 3.41Å; E139-D143 VanDerWaalsContact O-CG 3.25Å; E139-D143 PolarHBondContact O-N 3.19Å |
| 140 | M | 97.7 | Very high | 94.5 | Very high | 103 Ų | 103 | 102.6 Ų | 102.6 | 51% | 0.507 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.6 | -34.4 | 176.8 | -68.8 | -173.9 | -59.9 | 0 | 0 | 113.7 | R136 H137 K138 A144 | R136-M140 WeakPolarHBondContact O-CG 3.49Å; R136-M140 PolarHBondContact O-N 2.68Å; R136-M140 VanDerWaalsContact O-N 3.14Å; H137-M140 HydrophobicContact CB-CE 4.39Å; H137-M140 PolarHBondContact O-N 2.92Å; K138-M140 VanDerWaalsContact C-N 3.29Å; K138-M140 PolarHBondContact O-N 3.3Å; M140-A144 WeakPolarHBondContact O-CB 3.49Å; M140-A144 PolarHBondContact O-N 2.87Å |
| 141 | L | 97.9 | Very high | 93.2 | Very high | 90 Ų | 90 | 102.5 Ų | 102.5 | 47% | 0.471 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -72.7 | -40.3 | 175.9 | -71.6 | 174.8 | 0 | 0 | 0 | 111.2 | H137 K138 E139 A144 T145 | H137-L141 WeakPolarHBondContact O-CG 3.4Å; H137-L141 PolarHBondContact O-N 3.04Å; K138-L141 WeakPolarHBondContact O-CB 3Å; K138-L141 PolarHBondContact O-N 3.4Å; E139-L141 VanDerWaalsContact C-N 3.32Å; E139-L141 PolarHBondContact O-N 3.26Å; L141-A144 PolarHBondContact O-N 2.83Å; L141-T145 WeakPolarHBondContact O-CB 3.48Å; L141-T145 PolarHBondContact O-N 2.93Å; L141-T145 PolarHBondContact O-OG1 3.14Å |
| 142 | D | 96.9 | Very high | 91.7 | Very high | 63 Ų | 63 | 104 Ų | 104 | 34% | 0.337 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.9 | -47.9 | 177.1 | -67 | -15 | 0 | 0 | 0 | 109.1 | K138 E139 A144 T145 Y146 | K138-D142 WeakPolarHBondContact CE-OD2 3.42Å; K138-D142 WeakPolarHBondContact O-CB 3.41Å; K138-D142 VanDerWaalsContact O-CG 3.27Å; K138-D142 PolarHBondContact O-N 3.43Å; E139-D142 PolarHBondContact O-N 3.37Å; D142-A144 PolarHBondContact O-N 3.04Å; D142-T145 WeakPolarHBondContact O-CA 3.49Å; D142-T145 WeakPolarHBondContact O-CB 3.4Å; D142-T145 PolarHBondContact O-N 3.06Å; D142-Y146 HydrophobicContact CB-CE2 4.11Å; D142-Y146 WeakPolarHBondContact O-CD2 3.44Å; D142-Y146 PolarHBondContact O-N 2.92Å |
| 143 | D | 96 | Very high | 90.2 | Very high | 96 Ų | 96 | 103.4 Ų | 103.4 | 51% | 0.513 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -54.4 | -49.8 | 174.6 | -70.6 | -17 | 0 | 0 | 0 | 112 | E139 T145 Y146 E147 | E139-D143 WeakPolarHBondContact O-CB 3.41Å; E139-D143 VanDerWaalsContact O-CG 3.25Å; E139-D143 PolarHBondContact O-N 3.19Å; D143-T145 PolarHBondContact O-N 3.33Å; D143-Y146 PolarHBondContact O-N 3.43Å; D143-E147 WeakPolarHBondContact O-CG 3.41Å; D143-E147 PolarHBondContact O-N 3.15Å |
| 144 | A | 95.1 | Very high | 88.4 | Confident | 45 Ų | 45 | 104.6 Ų | 104.6 | 37% | 0.372 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.2 | -28.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | M140 L141 D142 L148 | M140-A144 WeakPolarHBondContact O-CB 3.49Å; M140-A144 PolarHBondContact O-N 2.87Å; L141-A144 PolarHBondContact O-N 2.83Å; D142-A144 PolarHBondContact O-N 3.04Å; A144-L148 WeakPolarHBondContact O-CG 3.46Å; A144-L148 PolarHBondContact O-N 3.25Å |
| 145 | T | 93.4 | Very high | 86.6 | Confident | 66 Ų | 66 | 104.2 Ų | 104.2 | 41% | 0.405 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -72.6 | -44.7 | 176.3 | -55.4 | 0 | 0 | 0 | 0 | 110.2 | L141 D142 D143 E147 L148 E149 | L141-T145 WeakPolarHBondContact O-CB 3.48Å; L141-T145 PolarHBondContact O-N 2.93Å; L141-T145 PolarHBondContact O-OG1 3.14Å; D142-T145 WeakPolarHBondContact O-CA 3.49Å; D142-T145 WeakPolarHBondContact O-CB 3.4Å; D142-T145 PolarHBondContact O-N 3.06Å; D143-T145 PolarHBondContact O-N 3.33Å; T145-E147 PolarHBondContact O-N 3.36Å; T145-L148 PolarHBondContact O-N 2.97Å; T145-L148 VanDerWaalsContact O-N 3.17Å; T145-E149 WeakPolarHBondContact O-CG 3.37Å; T145-E149 PolarHBondContact O-N 3.17Å |
| 146 | Y | 92.6 | Very high | 84.9 | Confident | 139 Ų | 139 | 103.8 Ų | 103.8 | 55% | 0.545 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.6 | -43 | 175 | -68.1 | -60.3 | 0 | 0 | 0 | 112.1 | D142 D143 L148 E149 E150 | D142-Y146 HydrophobicContact CB-CE2 4.11Å; D142-Y146 WeakPolarHBondContact O-CD2 3.44Å; D142-Y146 PolarHBondContact O-N 2.92Å; D143-Y146 PolarHBondContact O-N 3.43Å; Y146-L148 VanDerWaalsContact C-N 3.26Å; Y146-L148 PolarHBondContact O-N 3.28Å; Y146-E149 PolarHBondContact O-N 3.29Å; Y146-E150 WeakPolarHBondContact O-CG 3.41Å; Y146-E150 PolarHBondContact O-N 3.46Å |
| 147 | E | 88.8 | Confident | 83.1 | Confident | 131 Ų | 131 | 101.9 Ų | 101.9 | 61% | 0.612 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.6 | -36.7 | 175.9 | -73.1 | -178 | 3 | 0 | 0 | 112.5 | D143 T145 C151 | D143-E147 WeakPolarHBondContact O-CG 3.41Å; D143-E147 PolarHBondContact O-N 3.15Å; T145-E147 PolarHBondContact O-N 3.36Å; E147-C151 PolarHBondContact O-N 3.39Å; E147-C151 PolarHBondContact O-SG 2.95Å |
| 148 | L | 85.3 | Confident | 81.1 | Confident | 125 Ų | 125 | 102.7 Ų | 102.7 | 65% | 0.654 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -71.4 | -41.9 | 176.9 | -76.9 | 167.7 | 0 | 0 | 0 | 112.3 | A144 T145 Y146 C151 E152 | A144-L148 WeakPolarHBondContact O-CG 3.46Å; A144-L148 PolarHBondContact O-N 3.25Å; T145-L148 PolarHBondContact O-N 2.97Å; T145-L148 VanDerWaalsContact O-N 3.17Å; Y146-L148 VanDerWaalsContact C-N 3.26Å; Y146-L148 PolarHBondContact O-N 3.28Å; L148-C151 PolarHBondContact O-N 3.01Å; L148-E152 PolarHBondContact O-N 3.31Å |
| 149 | E | 83.9 | Confident | 79.1 | Confident | 91 Ų | 91 | 101.4 Ų | 101.4 | 43% | 0.425 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.5 | -44.2 | 176 | -71.9 | 175.7 | -180 | 0 | 0 | 110.8 | T145 Y146 C151 E152 E153 | T145-E149 WeakPolarHBondContact O-CG 3.37Å; T145-E149 PolarHBondContact O-N 3.17Å; Y146-E149 PolarHBondContact O-N 3.29Å; E149-C151 VanDerWaalsContact C-N 3.33Å; E149-C151 PolarHBondContact O-N 3.21Å; E149-E152 PolarHBondContact O-N 3.19Å; E149-E152 VanDerWaalsContact O-N 3.15Å; E149-E153 WeakPolarHBondContact O-CG 3.4Å; E149-E153 PolarHBondContact O-N 3.14Å |
| 150 | E | 76.8 | Confident | 76.9 | Confident | 116 Ų | 116 | 103.9 Ų | 103.9 | 54% | 0.542 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -58.9 | -42.5 | 174.6 | -72.3 | -179.7 | 176.5 | 0 | 0 | 111.7 | Y146 E152 E153 E154 | Y146-E150 WeakPolarHBondContact O-CG 3.41Å; Y146-E150 PolarHBondContact O-N 3.46Å; E150-E152 VanDerWaalsContact C-N 3.34Å; E150-E152 PolarHBondContact O-N 3.33Å; E150-E153 PolarHBondContact O-N 3.33Å; E150-E154 WeakPolarHBondContact O-CB 3.5Å; E150-E154 WeakPolarHBondContact O-CG 3.5Å; E150-E154 PolarHBondContact O-N 3.06Å |
| 151 | C | 70.8 | Confident | 74.9 | Confident | 68 Ų | 68 | 102.7 Ų | 102.7 | 46% | 0.459 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -66.1 | -33.4 | 176.8 | -71.2 | 0 | 0 | 0 | 0 | 113.4 | E147 L148 E149 S155 | E147-C151 PolarHBondContact O-N 3.39Å; E147-C151 PolarHBondContact O-SG 2.95Å; L148-C151 PolarHBondContact O-N 3.01Å; E149-C151 VanDerWaalsContact C-N 3.33Å; E149-C151 PolarHBondContact O-N 3.21Å; C151-S155 WeakPolarHBondContact O-CB 3.47Å; C151-S155 PolarHBondContact O-N 3.35Å; C151-S155 VanDerWaalsContact O-N 3.15Å; C151-S155 PolarHBondContact O-OG 3.03Å |
| 152 | E | 66.2 | Low | 72.7 | Confident | 131 Ų | 131 | 103 Ų | 103 | 61% | 0.612 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -70.4 | -47.2 | 175.3 | -174.9 | 171.5 | -168 | 0 | 0 | 110.7 | L148 E149 E150 E154 S155 D156 | L148-E152 PolarHBondContact O-N 3.31Å; E149-E152 PolarHBondContact O-N 3.19Å; E149-E152 VanDerWaalsContact O-N 3.15Å; E150-E152 VanDerWaalsContact C-N 3.34Å; E150-E152 PolarHBondContact O-N 3.33Å; E152-E154 VanDerWaalsContact C-N 3.35Å; E152-E154 PolarHBondContact O-N 3.05Å; E152-S155 WeakPolarHBondContact O-CA 3.34Å; E152-S155 WeakPolarHBondContact O-CB 3.38Å; E152-S155 PolarHBondContact O-N 2.9Å; E152-S155 VanDerWaalsContact O-N 3.07Å; E152-D156 PolarHBondContact O-N 3.42Å |
| 153 | E | 67.3 | Low | 70.7 | Confident | 130 Ų | 130 | 107.6 Ų | 107.6 | 61% | 0.607 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -61.2 | -41.3 | 176.2 | -69.6 | -176.2 | 176.4 | 0 | 0 | 112.2 | E149 E150 S155 D156 L157 | E149-E153 WeakPolarHBondContact O-CG 3.4Å; E149-E153 PolarHBondContact O-N 3.14Å; E150-E153 PolarHBondContact O-N 3.33Å; E153-S155 VanDerWaalsContact C-N 3.28Å; E153-S155 PolarHBondContact O-N 3.21Å; E153-D156 PolarHBondContact O-N 3.07Å; E153-L157 WeakPolarHBondContact O-CG 3.4Å; E153-L157 PolarHBondContact O-N 2.91Å |
| 154 | E | 59.3 | Low | 68.5 | Low | 124 Ų | 124 | 112.4 Ų | 112.4 | 58% | 0.579 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62.5 | -35.4 | 173.6 | -75.4 | 174.2 | 175 | 0 | 0 | 112.4 | E150 E152 L158 | E150-E154 WeakPolarHBondContact O-CB 3.5Å; E150-E154 WeakPolarHBondContact O-CG 3.5Å; E150-E154 PolarHBondContact O-N 3.06Å; E152-E154 VanDerWaalsContact C-N 3.35Å; E152-E154 PolarHBondContact O-N 3.05Å; E154-L158 WeakPolarHBondContact O-CB 3.18Å; E154-L158 PolarHBondContact O-N 3.45Å |
| 155 | S | 60.3 | Low | 66.6 | Low | 67 Ų | 67 | 112.8 Ų | 112.8 | 47% | 0.469 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -72.9 | -38.3 | 177.1 | -62.9 | 0 | 0 | 0 | 0 | 112 | C151 E152 E153 L158 C159 | C151-S155 WeakPolarHBondContact O-CB 3.47Å; C151-S155 PolarHBondContact O-N 3.35Å; C151-S155 VanDerWaalsContact O-N 3.15Å; C151-S155 PolarHBondContact O-OG 3.03Å; E152-S155 WeakPolarHBondContact O-CA 3.34Å; E152-S155 WeakPolarHBondContact O-CB 3.38Å; E152-S155 PolarHBondContact O-N 2.9Å; E152-S155 VanDerWaalsContact O-N 3.07Å; E153-S155 VanDerWaalsContact C-N 3.28Å; E153-S155 PolarHBondContact O-N 3.21Å; S155-L158 CarbonylContact O-C 3.43Å; S155-L158 WeakPolarHBondContact O-CA 3.39Å; S155-L158 VanDerWaalsContact O-CB 3.28Å; S155-L158 WeakPolarHBondContact O-CB 3.28Å; S155-L158 PolarHBondContact O-N 2.76Å; S155-C159 PolarHBondContact O-N 3.48Å; S155-C159 PolarHBondContact O-SG 3.1Å |
| 156 | D | 62.1 | Low | 64.6 | Low | 104 Ų | 104 | 113.5 Ų | 113.5 | 56% | 0.556 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66.5 | -39.1 | 176.1 | -88.2 | -1.4 | 0 | 0 | 0 | 112.2 | E152 E153 L158 C159 | E152-D156 PolarHBondContact O-N 3.42Å; E153-D156 PolarHBondContact O-N 3.07Å; D156-L158 PolarHBondContact O-N 3.15Å; D156-C159 WeakPolarHBondContact O-CB 3.28Å; D156-C159 PolarHBondContact O-N 3.43Å; D156-C159 VanDerWaalsContact O-N 3.14Å |
| 157 | L | 61 | Low | 62.8 | Low | 134 Ų | 134 | 114.7 Ų | 114.7 | 70% | 0.702 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -64.9 | -26 | 169.8 | -68.5 | 169.8 | 0 | 0 | 0 | 112.4 | E153 | E153-L157 WeakPolarHBondContact O-CG 3.4Å; E153-L157 PolarHBondContact O-N 2.91Å |
| 158 | L | 55.9 | Low | 61.3 | Low | 117 Ų | 117 | 110.7 Ų | 110.7 | 61% | 0.613 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -82.5 | -19.1 | 174.8 | -132.4 | 108.2 | 0 | 0 | 0 | 113.2 | E154 S155 D156 D160 I161 | E154-L158 WeakPolarHBondContact O-CB 3.18Å; E154-L158 PolarHBondContact O-N 3.45Å; S155-L158 CarbonylContact O-C 3.43Å; S155-L158 WeakPolarHBondContact O-CA 3.39Å; S155-L158 VanDerWaalsContact O-CB 3.28Å; S155-L158 WeakPolarHBondContact O-CB 3.28Å; S155-L158 PolarHBondContact O-N 2.76Å; D156-L158 PolarHBondContact O-N 3.15Å; L158-D160 PolarHBondContact O-N 3.39Å; L158-I161 HydrophobicContact CD1-CD1 4.3Å; L158-I161 HydrophobicContact CD2-CD1 4.13Å; L158-I161 HydrophobicContact CG-CD1 3.62Å; L158-I161 HydrophobicContact CG-CG1 4.41Å; L158-I161 VanDerWaalsContact O-CB 3.28Å; L158-I161 WeakPolarHBondContact O-CB 3.37Å; L158-I161 VanDerWaalsContact O-CG1 3.29Å; L158-I161 WeakPolarHBondContact O-CG1 3.29Å; L158-I161 PolarHBondContact O-N 2.92Å; L158-I161 VanDerWaalsContact O-N 3.1Å |
| 159 | C | 55.4 | Low | 59.9 | Low | 96 Ų | 96 | 106.8 Ų | 106.8 | 65% | 0.649 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -71.2 | -16.5 | 177.5 | -75.9 | 0 | 0 | 0 | 0 | 113.2 | S155 D156 I161 | S155-C159 PolarHBondContact O-N 3.48Å; S155-C159 PolarHBondContact O-SG 3.1Å; D156-C159 WeakPolarHBondContact O-CB 3.28Å; D156-C159 PolarHBondContact O-N 3.43Å; D156-C159 VanDerWaalsContact O-N 3.14Å; C159-I161 PolarHBondContact O-N 3.25Å |
| 160 | D | 53.3 | Low | 58.9 | Low | 145 Ų | 145 | 105.6 Ų | 105.6 | 78% | 0.775 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | -4.9 | 169.7 | -77 | -23.7 | 0 | 0 | 0 | 113.2 | L158 | L158-D160 PolarHBondContact O-N 3.39Š|
| 161 | I | 54.2 | Low | 58.2 | Low | 79 Ų | 79 | 104.7 Ų | 104.7 | 41% | 0.405 | 58% | 0.58 | S | S | . | * | S | Bend | trans | -76.8 | 127.9 | 172.4 | -54.7 | -176 | 0 | 0 | 0 | 108.3 | L158 C159 M163 A165 | L158-I161 HydrophobicContact CD1-CD1 4.3Å; L158-I161 HydrophobicContact CD2-CD1 4.13Å; L158-I161 HydrophobicContact CG-CD1 3.62Å; L158-I161 HydrophobicContact CG-CG1 4.41Å; L158-I161 VanDerWaalsContact O-CB 3.28Å; L158-I161 WeakPolarHBondContact O-CB 3.37Å; L158-I161 VanDerWaalsContact O-CG1 3.29Å; L158-I161 WeakPolarHBondContact O-CG1 3.29Å; L158-I161 PolarHBondContact O-N 2.92Å; L158-I161 VanDerWaalsContact O-N 3.1Å; C159-I161 PolarHBondContact O-N 3.25Å; I161-M163 PolarHBondContact O-N 2.66Å; I161-A165 HydrophobicContact CG2-CB 3.4Å; I161-A165 VanDerWaalsContact CG2-CB 3.4Å |
| 162 | P | 51.8 | Low | 57.8 | Low | 97 Ų | 97 | 105.3 Ų | 105.3 | 63% | 0.63 | 58% | 0.584 | S | S | * | * | trans | -51.2 | 131.3 | 179.1 | -21.8 | 29.2 | 0 | 0 | 0 | 109.9 | K164 A165 | P162-K164 PolarHBondContact O-N 3.19Å; P162-A165 PolarHBondContact O-N 2.86Å | ||
| 163 | M | 54.6 | Low | 57.7 | Low | 159 Ų | 159 | 101.5 Ų | 101.5 | 78% | 0.783 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -44.4 | -14.4 | -179.4 | -128.1 | 168.6 | -100.6 | 0 | 0 | 115.3 | I161 A165 A166 F167 | I161-M163 PolarHBondContact O-N 2.66Å; M163-A165 VanDerWaalsContact C-N 3.28Å; M163-A165 PolarHBondContact O-N 3.43Å; M163-A166 PolarHBondContact O-N 2.76Å; M163-F167 VanDerWaalsContact O-CD2 3.24Å; M163-F167 WeakPolarHBondContact O-CD2 3.24Å; M163-F167 WeakPolarHBondContact O-CE2 3.47Å |
| 164 | K | 51.1 | Low | 57.5 | Low | 196 Ų | 196 | 100.9 Ų | 100.9 | 85% | 0.852 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | -21.2 | 169.8 | -67.6 | 178.5 | 178.8 | 177.7 | 0 | 114.4 | P162 | P162-K164 PolarHBondContact O-N 3.19Š|
| 165 | A | 54.7 | Low | 57.6 | Low | 53 Ų | 53 | 102.8 Ų | 102.8 | 44% | 0.438 | 57% | 0.571 | S | S | . | * | S | Bend | trans | -87.9 | -22.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | I161 P162 M163 F167 A168 | I161-A165 HydrophobicContact CG2-CB 3.4Å; I161-A165 VanDerWaalsContact CG2-CB 3.4Å; P162-A165 PolarHBondContact O-N 2.86Å; M163-A165 VanDerWaalsContact C-N 3.28Å; M163-A165 PolarHBondContact O-N 3.43Å; A165-F167 PolarHBondContact O-N 3.42Å; A165-A168 WeakPolarHBondContact O-CB 3.43Å; A165-A168 PolarHBondContact O-N 3.18Å |
| 166 | A | 52.2 | Low | 57.9 | Low | 81 Ų | 81 | 105.6 Ų | 105.6 | 67% | 0.669 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | -11.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | M163 | M163-A166 PolarHBondContact O-N 2.76Š|
| 167 | F | 53.1 | Low | 58 | Low | 165 Ų | 165 | 103 Ų | 103 | 72% | 0.724 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | 1.9 | 174.2 | -64.6 | -74.5 | 0 | 0 | 0 | 113.9 | M163 A165 | M163-F167 VanDerWaalsContact O-CD2 3.24Å; M163-F167 WeakPolarHBondContact O-CD2 3.24Å; M163-F167 WeakPolarHBondContact O-CE2 3.47Å; A165-F167 PolarHBondContact O-N 3.42Å |
| 168 | A | 57.4 | Low | 58.3 | Low | 47 Ų | 47 | 98.3 Ų | 98.3 | 39% | 0.388 | 55% | 0.553 | S | S | . | * | S | Bend | trans | -77.1 | 138.2 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | A165 S170 | A165-A168 WeakPolarHBondContact O-CB 3.43Å; A165-A168 PolarHBondContact O-N 3.18Å; A168-S170 PolarHBondContact O-N 3.25Å |
| 169 | L | 56.7 | Low | 58.9 | Low | 43 Ų | 43 | 95.9 Ų | 95.9 | 23% | 0.225 | 54% | 0.544 | C | S | . | . | trans | -44.9 | 140.5 | 179.2 | -65.6 | 175.1 | 0 | 0 | 0 | 111.1 | L173 K174 L178 K180 I183 | L169-L173 HydrophobicContact CB-CB 4.04Å; L169-L173 HydrophobicContact CB-CD1 4.07Å; L169-L173 HydrophobicContact CD1-CB 4.46Å; L169-L173 HydrophobicContact CD1-CD1 4.49Å; L169-L173 HydrophobicContact CD2-CD1 4.07Å; L169-L173 HydrophobicContact CG-CD1 4.45Å; L169-K174 WeakPolarHBondContact O-CE 3.27Å; L169-L178 VanDerWaalsContact CD1-O 3.27Å; L169-L178 WeakPolarHBondContact CD1-O 3.34Å; L169-K180 HydrophobicContact CD1-CB 4.4Å; L169-K180 HydrophobicContact CG-CB 4.43Å; L169-I183 HydrophobicContact CD1-CD1 3.76Å; L169-I183 HydrophobicContact CD2-CD1 4.07Å | ||
| 170 | S | 62.8 | Low | 59.6 | Low | 65 Ų | 65 | 97.7 Ų | 97.7 | 46% | 0.455 | 54% | 0.541 | S | S | . | . | trans | -46.1 | 143.9 | -179.4 | 56.8 | 0 | 0 | 0 | 0 | 111.2 | A168 P172 L173 K174 | A168-S170 PolarHBondContact O-N 3.25Å; S170-P172 VanDerWaalsContact O-N 3.07Å; S170-L173 PolarHBondContact O-N 3.45Å; S170-K174 PolarHBondContact O-N 3.45Å | ||
| 171 | T | 61 | Low | 60.2 | Low | 97 Ų | 97 | 97.9 Ų | 97.9 | 60% | 0.595 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -39.3 | -42.6 | 177.3 | 16.5 | 0 | 0 | 0 | 0 | 114.7 | L173 K174 H175 | T171-L173 VanDerWaalsContact C-N 3.35Å; T171-L173 PolarHBondContact O-N 2.87Å; T171-K174 PolarHBondContact O-N 3.36Å; T171-H175 PolarHBondContact O-N 3.34Å; T171-H175 PolarHBondContact O-ND1 3.34Å |
| 172 | P | 63.2 | Low | 60.8 | Low | 82 Ų | 82 | 95.6 Ų | 95.6 | 53% | 0.532 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.9 | -34.3 | 176.3 | 18.7 | -31.9 | 0 | 0 | 0 | 114.7 | S170 | S170-P172 VanDerWaalsContact O-N 3.07Å |
| 173 | L | 63.7 | Low | 61.7 | Low | 50 Ų | 50 | 94.6 Ų | 94.6 | 26% | 0.262 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -74.5 | -31.5 | -179.7 | -65.5 | 173.8 | 0 | 0 | 0 | 112.4 | L169 S170 T171 L176 L178 I183 | L169-L173 HydrophobicContact CB-CB 4.04Å; L169-L173 HydrophobicContact CB-CD1 4.07Å; L169-L173 HydrophobicContact CD1-CB 4.46Å; L169-L173 HydrophobicContact CD1-CD1 4.49Å; L169-L173 HydrophobicContact CD2-CD1 4.07Å; L169-L173 HydrophobicContact CG-CD1 4.45Å; S170-L173 PolarHBondContact O-N 3.45Å; T171-L173 VanDerWaalsContact C-N 3.35Å; T171-L173 PolarHBondContact O-N 2.87Å; L173-L176 PolarHBondContact O-N 3.37Å; L173-L178 HydrophobicContact CB-CB 4.37Å; L173-L178 HydrophobicContact CD2-CD1 3.88Å; L173-L178 WeakPolarHBondContact O-CB 3.39Å; L173-L178 PolarHBondContact O-N 3.42Å; L173-I183 HydrophobicContact CD1-CD1 4.44Å |
| 174 | K | 64.4 | Low | 62.3 | Low | 118 Ų | 118 | 93.3 Ų | 93.3 | 51% | 0.513 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.9 | -42 | 175.3 | -70.9 | -179.4 | -178.2 | 171.5 | 0 | 112.2 | L169 S170 T171 L176 G177 | L169-K174 WeakPolarHBondContact O-CE 3.27Å; S170-K174 PolarHBondContact O-N 3.45Å; T171-K174 PolarHBondContact O-N 3.36Å; K174-L176 PolarHBondContact O-N 3.01Å; K174-G177 PolarHBondContact O-N 3.26Å |
| 175 | H | 60.1 | Low | 63.1 | Low | 163 Ų | 163 | 86.8 Ų | 86.8 | 76% | 0.755 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.6 | -22.8 | 177.7 | -69.2 | 95.9 | 0 | 0 | 0 | 112.9 | T171 G177 | T171-H175 PolarHBondContact O-N 3.34Å; T171-H175 PolarHBondContact O-ND1 3.34Å; H175-G177 VanDerWaalsContact C-N 3.34Å |
| 176 | L | 67.1 | Low | 63.7 | Low | 126 Ų | 126 | 95 Ų | 95 | 66% | 0.66 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.9 | 7.5 | 174.4 | -65.8 | 167.4 | 0 | 0 | 0 | 113.4 | L173 K174 L178 | L173-L176 PolarHBondContact O-N 3.37Å; K174-L176 PolarHBondContact O-N 3.01Å; L176-L178 HydrophobicContact CB-CD1 4.19Å; L176-L178 HydrophobicContact CB-CG 4.04Å; L176-L178 PolarHBondContact O-N 3.27Å |
| 177 | G | 64.8 | Low | 64.2 | Low | 50 Ų | 50 | 100.3 Ų | 100.3 | 52% | 0.515 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.1 | 12.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | K174 H175 T179 N182 | K174-G177 PolarHBondContact O-N 3.26Å; H175-G177 VanDerWaalsContact C-N 3.34Å; G177-T179 PolarHBondContact O-N 3Å; G177-N182 PolarHBondContact O-ND2 3.48Å |
| 178 | L | 66.3 | Low | 64.5 | Low | 35 Ų | 35 | 99.3 Ų | 99.3 | 18% | 0.183 | 51% | 0.509 | C | S | . | . | trans | -84.9 | 118.6 | -177.8 | -57.7 | 179 | 0 | 0 | 0 | 109.7 | L169 L173 L176 F188 | L169-L178 VanDerWaalsContact CD1-O 3.27Å; L169-L178 WeakPolarHBondContact CD1-O 3.34Å; L173-L178 HydrophobicContact CB-CB 4.37Å; L173-L178 HydrophobicContact CD2-CD1 3.88Å; L173-L178 WeakPolarHBondContact O-CB 3.39Å; L173-L178 PolarHBondContact O-N 3.42Å; L176-L178 HydrophobicContact CB-CD1 4.19Å; L176-L178 HydrophobicContact CB-CG 4.04Å; L176-L178 PolarHBondContact O-N 3.27Å; L178-F188 HydrophobicContact CD2-CD1 3.7Å; L178-F188 HydrophobicContact CD2-CE1 3.85Å | ||
| 179 | T | 69.1 | Low | 64.5 | Low | 66 Ų | 66 | 101.7 Ų | 101.7 | 41% | 0.405 | 52% | 0.523 | S | S | . | . | trans | -105.3 | 160.1 | 173 | 68.4 | 0 | 0 | 0 | 0 | 110 | G177 M181 N182 I183 | G177-T179 PolarHBondContact O-N 3Å; T179-M181 PolarHBondContact O-N 3.14Å; T179-M181 VanDerWaalsContact O-N 3.08Å; T179-N182 PolarHBondContact N-ND2 3.23Å; T179-N182 WeakPolarHBondContact O-CB 3.38Å; T179-N182 PolarHBondContact O-N 3.17Å; T179-N182 PolarHBondContact OG1-N 3.05Å; T179-N182 PolarHBondContact OG1-ND2 3.08Å; T179-I183 PolarHBondContact O-N 3.31Å | ||
| 180 | K | 69.6 | Low | 64.4 | Low | 135 Ų | 135 | 107.6 Ų | 107.6 | 59% | 0.587 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -57.2 | -28.6 | 177.5 | -166.5 | 174.7 | -177.5 | 174.9 | 0 | 111.5 | L169 N184 | L169-K180 HydrophobicContact CD1-CB 4.4Å; L169-K180 HydrophobicContact CG-CB 4.43Å; K180-N184 WeakPolarHBondContact O-CB 3.48Å; K180-N184 PolarHBondContact O-N 3.08Å; K180-N184 VanDerWaalsContact O-N 3.14Å; K180-N184 PolarHBondContact O-ND2 2.64Å |
| 181 | M | 66.8 | Low | 63.6 | Low | 148 Ų | 148 | 114.1 Ų | 114.1 | 73% | 0.729 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -68.1 | -43 | 174.4 | -159.6 | -173.8 | -33.7 | 0 | 0 | 112.4 | T179 S185 | T179-M181 PolarHBondContact O-N 3.14Å; T179-M181 VanDerWaalsContact O-N 3.08Å; M181-S185 VanDerWaalsContact O-CB 3.31Å; M181-S185 WeakPolarHBondContact O-CB 3.31Å; M181-S185 PolarHBondContact O-N 3.3Å; M181-S185 VanDerWaalsContact O-N 3.08Å; M181-S185 PolarHBondContact O-OG 2.94Å |
| 182 | N | 66.6 | Low | 63.7 | Low | 31 Ų | 31 | 115 Ų | 115 | 17% | 0.166 | 60% | 0.597 | C | S | . | * | H | α-helix | trans | -65.4 | -41.3 | 178.6 | -68.4 | -32.9 | 0 | 0 | 0 | 111.9 | G177 T179 S185 R186 R187 | G177-N182 PolarHBondContact O-ND2 3.48Å; T179-N182 PolarHBondContact N-ND2 3.23Å; T179-N182 WeakPolarHBondContact O-CB 3.38Å; T179-N182 PolarHBondContact O-N 3.17Å; T179-N182 PolarHBondContact OG1-N 3.05Å; T179-N182 PolarHBondContact OG1-ND2 3.08Å; N182-S185 PolarHBondContact O-OG 3.32Å; N182-R186 PolarHBondContact O-N 3.24Å; N182-R186 VanDerWaalsContact O-N 3.08Å; N182-R187 PolarHBondContact O-N 3.48Å |
| 183 | I | 70.7 | Confident | 63.7 | Low | 77 Ų | 77 | 116.7 Ų | 116.7 | 40% | 0.395 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -67.8 | -48.6 | 178.9 | -61.2 | 175.2 | 0 | 0 | 0 | 110.9 | L169 L173 T179 S185 R186 | L169-I183 HydrophobicContact CD1-CD1 3.76Å; L169-I183 HydrophobicContact CD2-CD1 4.07Å; L173-I183 HydrophobicContact CD1-CD1 4.44Å; T179-I183 PolarHBondContact O-N 3.31Å; I183-S185 PolarHBondContact O-N 3.08Å; I183-R186 PolarHBondContact O-N 3.5Å |
| 184 | N | 66.9 | Low | 63.7 | Low | 131 Ų | 131 | 120.4 Ų | 120.4 | 70% | 0.701 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -67.9 | -24.5 | -178.9 | -76.3 | -14.2 | 0 | 0 | 0 | 113.2 | K180 | K180-N184 WeakPolarHBondContact O-CB 3.48Å; K180-N184 PolarHBondContact O-N 3.08Å; K180-N184 VanDerWaalsContact O-N 3.14Å; K180-N184 PolarHBondContact O-ND2 2.64Å |
| 185 | S | 68.2 | Low | 63.7 | Low | 60 Ų | 60 | 120.6 Ų | 120.6 | 42% | 0.42 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -99 | 0 | 178.8 | 62.9 | 0 | 0 | 0 | 0 | 114.3 | M181 N182 I183 R187 | M181-S185 VanDerWaalsContact O-CB 3.31Å; M181-S185 WeakPolarHBondContact O-CB 3.31Å; M181-S185 PolarHBondContact O-N 3.3Å; M181-S185 VanDerWaalsContact O-N 3.08Å; M181-S185 PolarHBondContact O-OG 2.94Å; N182-S185 PolarHBondContact O-OG 3.32Å; I183-S185 PolarHBondContact O-N 3.08Å; S185-R187 PolarHBondContact O-N 3.11Å; S185-R187 VanDerWaalsContact O-N 3.11Å |
| 186 | R | 68 | Low | 63.9 | Low | 224 Ų | 224 | 117.9 Ų | 117.9 | 85% | 0.845 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 48.9 | 31.9 | -174.9 | -59.4 | -175.2 | 178.6 | -141.9 | 0.1 | 113.6 | N182 I183 | N182-R186 PolarHBondContact O-N 3.24Å; N182-R186 VanDerWaalsContact O-N 3.08Å; I183-R186 PolarHBondContact O-N 3.5Å |
| 187 | R | 62.8 | Low | 63.7 | Low | 193 Ų | 193 | 117.4 Ų | 117.4 | 73% | 0.728 | 62% | 0.615 | S | S | * | * | trans | -112.8 | 102.1 | -179 | -79.1 | 179.1 | 155.1 | -151.1 | -7.6 | 108.4 | N182 S185 | N182-R187 PolarHBondContact O-N 3.48Å; S185-R187 PolarHBondContact O-N 3.11Å; S185-R187 VanDerWaalsContact O-N 3.11Å | ||
| 188 | F | 59 | Low | 63.6 | Low | 145 Ų | 145 | 122.2 Ų | 122.2 | 64% | 0.636 | 62% | 0.622 | S | S | * | * | trans | -83.9 | 114.9 | 167.7 | -58.5 | -79.8 | 0 | 0 | 0 | 107.5 | L178 | L178-F188 HydrophobicContact CD2-CD1 3.7Å; L178-F188 HydrophobicContact CD2-CE1 3.85Å | ||
| 189 | S | 56.6 | Low | 63.4 | Low | 97 Ų | 97 | 128.9 Ų | 128.9 | 68% | 0.678 | 66% | 0.656 | S | S | * | * | trans | -86.9 | 109.1 | 162.2 | 57.1 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 190 | L | 55.7 | Low | 62.9 | Low | 167 Ų | 167 | 134.2 Ų | 134.2 | 87% | 0.874 | 68% | 0.677 | S | S | * | * | trans | -85.7 | 129.6 | 168 | -66.7 | 169.2 | 0 | 0 | 0 | 107.9 | ||||
| 191 | C | 44.2 | Very low | 62.3 | Low | 202 Ų | 202 | 134.1 Ų | 134.1 | 100% | 1.365 | 69% | 0.685 | S | S | * | * | trans | -87.8 | 0 | 157.8 | -70.3 | 0 | 0 | 0 | 0 | 108.6 |
Retrieved 191 of 191 residues in 130.6 ms
(Link to these results)