| 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 | 39.3 | Very low | 44.2 | Very low | 248 Ų | 248 | 150.3 Ų | 150.3 | 100% | 1.222 | 81% | 0.814 | S | S | * | * | 0 | 119.7 | 0 | -61.8 | -158.5 | -146.9 | 0 | 0 | 107.6 | |||||
| 2 | A | 36.8 | Very low | 44.5 | Very low | 101 Ų | 101 | 157.4 Ų | 157.4 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -82 | 124.9 | -174.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | V4 | A2-V4 PolarHBondContact O-N 3.44Š| ||
| 3 | A | 42 | Very low | 45 | Very low | 95 Ų | 95 | 155.4 Ų | 155.4 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | -83.1 | 108.7 | 170.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | Q5 | A3-Q5 PolarHBondContact O-N 3.36Å; A3-Q5 VanDerWaalsContact O-N 3.17Å | ||
| 4 | V | 47.2 | Very low | 45.5 | Very low | 104 Ų | 104 | 149.2 Ų | 149.2 | 63% | 0.63 | 79% | 0.788 | S | S | * | * | trans | -72.6 | 104.5 | 173.2 | 179.2 | 0 | 0 | 0 | 0 | 107.6 | A2 Y6 | A2-V4 PolarHBondContact O-N 3.44Å; V4-Y6 HydrophobicContact CB-CE2 4.29Å; V4-Y6 HydrophobicContact CG1-CD2 4.14Å; V4-Y6 HydrophobicContact CG1-CE1 4.5Å; V4-Y6 HydrophobicContact CG1-CE2 3.83Å; V4-Y6 PolarHBondContact O-N 3.28Å; V4-Y6 VanDerWaalsContact O-N 3.16Å | ||
| 5 | Q | 43.9 | Very low | 45.9 | Very low | 173 Ų | 173 | 150.3 Ų | 150.3 | 81% | 0.808 | 79% | 0.793 | S | S | * | * | trans | -71.5 | 101.5 | 168.2 | -71.3 | -179.7 | -12.2 | 0 | 0 | 108.3 | A3 Q7 | A3-Q5 PolarHBondContact O-N 3.36Å; A3-Q5 VanDerWaalsContact O-N 3.17Å; Q5-Q7 VanDerWaalsContact C-N 3.35Å; Q5-Q7 PolarHBondContact O-N 2.95Å | ||
| 6 | Y | 40.8 | Very low | 46.5 | Very low | 205 Ų | 205 | 149.4 Ų | 149.4 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -70.4 | 98.2 | 162.4 | -71.1 | -84.9 | 0 | 0 | 0 | 107.3 | V4 G8 | V4-Y6 HydrophobicContact CB-CE2 4.29Å; V4-Y6 HydrophobicContact CG1-CD2 4.14Å; V4-Y6 HydrophobicContact CG1-CE1 4.5Å; V4-Y6 HydrophobicContact CG1-CE2 3.83Å; V4-Y6 PolarHBondContact O-N 3.28Å; V4-Y6 VanDerWaalsContact O-N 3.16Å; Y6-G8 PolarHBondContact O-N 3.18Å | ||
| 7 | Q | 44.3 | Very low | 47.2 | Very low | 179 Ų | 179 | 151.6 Ų | 151.6 | 84% | 0.836 | 78% | 0.778 | S | S | * | * | trans | -60.3 | 106.2 | 164.6 | -78.7 | -176 | -11.2 | 0 | 0 | 107.7 | Q5 R9 | Q5-Q7 VanDerWaalsContact C-N 3.35Å; Q5-Q7 PolarHBondContact O-N 2.95Å; Q7-R9 PolarHBondContact O-N 3.23Å | ||
| 8 | G | 44.4 | Very low | 48.8 | Very low | 73 Ų | 73 | 147.2 Ų | 147.2 | 75% | 0.753 | 76% | 0.756 | S | S | * | * | trans | -59.2 | 103.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | Y6 P10 | Y6-G8 PolarHBondContact O-N 3.18Å; G8-P10 WeakPolarHBondContact O-CD 3.4Å | ||
| 9 | R | 44.3 | Very low | 50.1 | Low | 230 Ų | 230 | 148 Ų | 148 | 87% | 0.868 | 76% | 0.757 | S | S | * | * | trans | -60 | 123.3 | 159.9 | -90.9 | -177.7 | 175.2 | -118.8 | 0.2 | 106.7 | Q7 I11 | Q7-R9 PolarHBondContact O-N 3.23Å; R9-I11 PolarHBondContact O-N 3.08Å | ||
| 10 | P | 49 | Very low | 51.3 | Low | 114 Ų | 114 | 143.8 Ų | 143.8 | 74% | 0.74 | 74% | 0.738 | S | S | * | * | trans | -65.3 | 114.1 | 166.8 | 26.8 | -29.7 | 0 | 0 | 0 | 106.5 | G8 R12 | G8-P10 WeakPolarHBondContact O-CD 3.4Å; P10-R12 PolarHBondContact O-N 2.94Å | ||
| 11 | I | 54.1 | Low | 52.8 | Low | 131 Ų | 131 | 142.2 Ų | 142.2 | 67% | 0.672 | 73% | 0.728 | S | S | * | * | trans | -53.9 | 89.1 | 168.3 | -65.4 | 177.5 | 0 | 0 | 0 | 107.1 | R9 D13 | R9-I11 PolarHBondContact O-N 3.08Å; I11-D13 HydrophobicContact CG2-CB 3.53Å; I11-D13 VanDerWaalsContact CG2-OD1 3.29Å; I11-D13 WeakPolarHBondContact CG2-OD1 3.46Å; I11-D13 WeakPolarHBondContact CG2-OD2 3.42Å; I11-D13 PolarHBondContact O-N 3.29Å; I11-D13 VanDerWaalsContact O-N 3.09Å | ||
| 12 | R | 47.7 | Very low | 54.8 | Low | 236 Ų | 236 | 132.6 Ų | 132.6 | 89% | 0.891 | 68% | 0.684 | S | S | * | * | trans | -79.4 | 60.6 | 160 | -70.3 | -174.7 | 101.1 | -155.6 | 8.3 | 106.8 | P10 S14 | P10-R12 PolarHBondContact O-N 2.94Å; R12-S14 PolarHBondContact O-N 3.15Å | ||
| 13 | D | 50.7 | Low | 57.1 | Low | 131 Ų | 131 | 130 Ų | 130 | 70% | 0.701 | 66% | 0.656 | S | S | * | * | trans | -70.3 | 87.1 | 172.2 | -79.4 | -4.5 | 0 | 0 | 0 | 107.3 | I11 L15 | I11-D13 HydrophobicContact CG2-CB 3.53Å; I11-D13 VanDerWaalsContact CG2-OD1 3.29Å; I11-D13 WeakPolarHBondContact CG2-OD1 3.46Å; I11-D13 WeakPolarHBondContact CG2-OD2 3.42Å; I11-D13 PolarHBondContact O-N 3.29Å; I11-D13 VanDerWaalsContact O-N 3.09Å; D13-L15 PolarHBondContact O-N 3.31Å | ||
| 14 | S | 52.1 | Low | 59.1 | Low | 69 Ų | 69 | 128.9 Ų | 128.9 | 48% | 0.483 | 64% | 0.637 | S | S | . | * | 37.9 | 87.5 | 122.7 | -156 | 0 | 0 | 0 | 0 | 114.5 | R12 H16 | R12-S14 PolarHBondContact O-N 3.15Å; S14-H16 VanDerWaalsContact CB-ND1 3.28Å; S14-H16 WeakPolarHBondContact CB-ND1 3.37Å; S14-H16 PolarHBondContact O-N 3.31Å; S14-H16 PolarHBondContact O-ND1 3.22Å; S14-H16 VanDerWaalsContact OG-CB 3.28Å; S14-H16 WeakPolarHBondContact OG-CB 3.41Å; S14-H16 PolarHBondContact OG-ND1 3.48Å | |||
| 15 | L | 51.6 | Low | 60.9 | Low | 166 Ų | 166 | 132.4 Ų | 132.4 | 87% | 0.869 | 64% | 0.64 | S | S | * | * | trans | -64.9 | 36.6 | 153.7 | -68.5 | 165.8 | 0 | 0 | 0 | 111.3 | D13 W17 | D13-L15 PolarHBondContact O-N 3.31Å; L15-W17 PolarHBondContact O-N 2.68Å | ||
| 16 | H | 55.4 | Low | 62.9 | Low | 136 Ų | 136 | 132 Ų | 132 | 63% | 0.63 | 63% | 0.633 | S | S | * | * | trans | -75.7 | 101.2 | 161.9 | 75.4 | -41.9 | 0 | 0 | 0 | 105.9 | S14 D18 | S14-H16 VanDerWaalsContact CB-ND1 3.28Å; S14-H16 WeakPolarHBondContact CB-ND1 3.37Å; S14-H16 PolarHBondContact O-N 3.31Å; S14-H16 PolarHBondContact O-ND1 3.22Å; S14-H16 VanDerWaalsContact OG-CB 3.28Å; S14-H16 WeakPolarHBondContact OG-CB 3.41Å; S14-H16 PolarHBondContact OG-ND1 3.48Å; H16-D18 PolarHBondContact O-N 2.91Å | ||
| 17 | W | 58.5 | Low | 65 | Low | 186 Ų | 186 | 122.4 Ų | 122.4 | 71% | 0.705 | 60% | 0.596 | S | S | * | * | trans | -71.3 | 118.1 | 158.5 | -69.5 | 101.5 | 0 | 0 | 0 | 105.5 | L15 E19 C22 | L15-W17 PolarHBondContact O-N 2.68Å; W17-E19 PolarHBondContact O-N 3.39Å; W17-C22 VanDerWaalsContact CB-SG 3.57Å | ||
| 18 | D | 76.1 | Confident | 67.1 | Low | 72 Ų | 72 | 117.3 Ų | 117.3 | 39% | 0.385 | 57% | 0.573 | S | S | . | * | trans | -57 | 124.2 | 169.1 | -177.1 | -12.8 | 0 | 0 | 0 | 107.2 | H16 T20 E21 C22 | H16-D18 PolarHBondContact O-N 2.91Å; D18-T20 PolarHBondContact O-N 3.26Å; D18-T20 VanDerWaalsContact O-N 3.11Å; D18-T20 PolarHBondContact OD1-N 3.02Å; D18-T20 VanDerWaalsContact OD1-N 3.1Å; D18-T20 PolarHBondContact OD1-OG1 3.45Å; D18-T20 PolarHBondContact OD2-OG1 2.94Å; D18-T20 VanDerWaalsContact OD2-OG1 3.06Å; D18-E21 HydrophobicContact CB-CB 4.18Å; D18-E21 HydrophobicContact CB-CG 3.91Å; D18-E21 WeakPolarHBondContact O-CB 3.26Å; D18-E21 PolarHBondContact O-N 3.43Å; D18-C22 PolarHBondContact O-N 3.43Å; D18-C22 VanDerWaalsContact O-N 3.12Å | ||
| 19 | E | 73.5 | Confident | 69.2 | Low | 163 Ų | 163 | 115.1 Ų | 115.1 | 76% | 0.762 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -55.3 | -31.8 | -177.1 | -65.3 | 178.3 | 173.6 | 0 | 0 | 110.6 | W17 L23 | W17-E19 PolarHBondContact O-N 3.39Å; E19-L23 WeakPolarHBondContact O-CG 3.43Å; E19-L23 PolarHBondContact O-N 3.41Å; E19-L23 VanDerWaalsContact O-N 3.14Å |
| 20 | T | 74.8 | Confident | 71.5 | Confident | 64 Ų | 64 | 105.1 Ų | 105.1 | 39% | 0.393 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -71 | -36.9 | 176.4 | 65.9 | 0 | 0 | 0 | 0 | 112.9 | D18 L23 N24 | D18-T20 PolarHBondContact O-N 3.26Å; D18-T20 VanDerWaalsContact O-N 3.11Å; D18-T20 PolarHBondContact OD1-N 3.02Å; D18-T20 VanDerWaalsContact OD1-N 3.1Å; D18-T20 PolarHBondContact OD1-OG1 3.45Å; D18-T20 PolarHBondContact OD2-OG1 2.94Å; D18-T20 VanDerWaalsContact OD2-OG1 3.06Å; T20-L23 PolarHBondContact O-N 2.98Å; T20-N24 WeakPolarHBondContact O-CB 3.49Å; T20-N24 PolarHBondContact O-N 3.42Å; T20-N24 PolarHBondContact O-ND2 2.7Å |
| 21 | E | 81.4 | Confident | 73.6 | Confident | 111 Ų | 111 | 99.9 Ų | 99.9 | 52% | 0.519 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.2 | -39.7 | 175 | -72.8 | -176.4 | 173.7 | 0 | 0 | 111.5 | D18 N24 Y25 | D18-E21 HydrophobicContact CB-CB 4.18Å; D18-E21 HydrophobicContact CB-CG 3.91Å; D18-E21 WeakPolarHBondContact O-CB 3.26Å; D18-E21 PolarHBondContact O-N 3.43Å; E21-N24 PolarHBondContact O-N 2.93Å; E21-Y25 WeakPolarHBondContact O-CB 3Å; E21-Y25 PolarHBondContact O-N 2.94Å |
| 22 | C | 81.6 | Confident | 75.5 | Confident | 45 Ų | 45 | 98 Ų | 98 | 30% | 0.304 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -59.5 | -50.4 | 173.9 | -74.3 | 0 | 0 | 0 | 0 | 111.5 | W17 D18 N24 Y25 Y26 | W17-C22 VanDerWaalsContact CB-SG 3.57Å; D18-C22 PolarHBondContact O-N 3.43Å; D18-C22 VanDerWaalsContact O-N 3.12Å; C22-N24 VanDerWaalsContact C-N 3.3Å; C22-N24 PolarHBondContact O-N 3.44Å; C22-Y25 WeakPolarHBondContact O-CB 3.35Å; C22-Y25 PolarHBondContact O-N 3.1Å; C22-Y26 WeakPolarHBondContact O-CD2 3.47Å; C22-Y26 PolarHBondContact O-N 3.29Å; C22-Y26 VanDerWaalsContact O-N 3.13Å |
| 23 | L | 85.7 | Confident | 77.7 | Confident | 47 Ų | 47 | 89.2 Ų | 89.2 | 25% | 0.246 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -59.4 | -44.3 | 178.1 | -69.1 | 171.4 | 0 | 0 | 0 | 110.7 | E19 T20 Y25 Y26 G27 M28 | E19-L23 WeakPolarHBondContact O-CG 3.43Å; E19-L23 PolarHBondContact O-N 3.41Å; E19-L23 VanDerWaalsContact O-N 3.14Å; T20-L23 PolarHBondContact O-N 2.98Å; L23-Y25 PolarHBondContact O-N 3.05Å; L23-Y26 CarbonylContact O-C 3.55Å; L23-Y26 PolarHBondContact O-N 3.3Å; L23-G27 PolarHBondContact O-N 2.94Å; L23-M28 HydrophobicContact CB-CB 4.19Å; L23-M28 HydrophobicContact CD2-CB 3.79Å; L23-M28 HydrophobicContact CD2-CE 4.19Å; L23-M28 HydrophobicContact CD2-SD 4.36Å; L23-M28 PolarHBondContact O-N 2.91Å |
| 24 | N | 84.2 | Confident | 79.8 | Confident | 71 Ų | 71 | 83 Ų | 83 | 38% | 0.38 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -61.2 | -43 | 177.9 | -80.3 | -30.6 | 0 | 0 | 0 | 113.2 | T20 E21 C22 Y26 G27 K154 R156 | T20-N24 WeakPolarHBondContact O-CB 3.49Å; T20-N24 PolarHBondContact O-N 3.42Å; T20-N24 PolarHBondContact O-ND2 2.7Å; E21-N24 PolarHBondContact O-N 2.93Å; C22-N24 VanDerWaalsContact C-N 3.3Å; C22-N24 PolarHBondContact O-N 3.44Å; N24-Y26 PolarHBondContact O-N 3.3Å; N24-G27 PolarHBondContact O-N 2.97Å; N24-K154 PolarHBondContact OD1-NZ 3.12Å; N24-R156 PolarHBondContact O-NH2 2.76Å |
| 25 | Y | 85 | Confident | 81.8 | Confident | 179 Ų | 179 | 79.7 Ų | 79.7 | 70% | 0.702 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -56.6 | -48.2 | 175.2 | 178 | -96.9 | 0 | 0 | 0 | 111.5 | E21 C22 L23 G27 | E21-Y25 WeakPolarHBondContact O-CB 3Å; E21-Y25 PolarHBondContact O-N 2.94Å; C22-Y25 WeakPolarHBondContact O-CB 3.35Å; C22-Y25 PolarHBondContact O-N 3.1Å; L23-Y25 PolarHBondContact O-N 3.05Å; Y25-G27 PolarHBondContact O-N 2.99Å |
| 26 | Y | 85.1 | Confident | 83.9 | Confident | 165 Ų | 165 | 77.1 Ų | 77.1 | 65% | 0.647 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -76.6 | -2.1 | 177.4 | -67 | -66.5 | 0 | 0 | 0 | 114.1 | C22 L23 N24 M28 | C22-Y26 WeakPolarHBondContact O-CD2 3.47Å; C22-Y26 PolarHBondContact O-N 3.29Å; C22-Y26 VanDerWaalsContact O-N 3.13Å; L23-Y26 CarbonylContact O-C 3.55Å; L23-Y26 PolarHBondContact O-N 3.3Å; N24-Y26 PolarHBondContact O-N 3.3Å; Y26-M28 VanDerWaalsContact C-N 3.32Å |
| 27 | G | 85.7 | Confident | 85.8 | Confident | 3 Ų | 3 | 73 Ų | 73 | 3% | 0.031 | 34% | 0.344 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 67.9 | 35.6 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L23 N24 Y25 K154 | L23-G27 PolarHBondContact O-N 2.94Å; N24-G27 PolarHBondContact O-N 2.97Å; Y25-G27 PolarHBondContact O-N 2.99Å; G27-K154 WeakPolarHBondContact O-CB 2.91Å; G27-K154 WeakPolarHBondContact O-CG 3.29Å; G27-K154 PolarHBondContact O-N 3.42Å |
| 28 | M | 88.6 | Confident | 87.5 | Confident | 71 Ų | 71 | 64.2 Ų | 64.2 | 35% | 0.35 | 31% | 0.31 | S | S | . | . | B | Isolated β-bridge | trans | -101.6 | 157 | 174 | -65.4 | 179.5 | 63.1 | 0 | 0 | 111.2 | L23 Y26 H152 K154 | L23-M28 HydrophobicContact CB-CB 4.19Å; L23-M28 HydrophobicContact CD2-CB 3.79Å; L23-M28 HydrophobicContact CD2-CE 4.19Å; L23-M28 HydrophobicContact CD2-SD 4.36Å; L23-M28 PolarHBondContact O-N 2.91Å; Y26-M28 VanDerWaalsContact C-N 3.32Å; M28-H152 CarbonylContact C-O 3.6Å; M28-H152 WeakPolarHBondContact CA-O 3.44Å; M28-H152 WeakPolarHBondContact CB-O 3.28Å; M28-H152 HydrophobicContact CE-CB 3.83Å; M28-K154 WeakPolarHBondContact O-CE 3.43Å |
| 29 | L | 88.9 | Confident | 88.5 | Confident | 27 Ų | 27 | 61 Ų | 61 | 14% | 0.141 | 29% | 0.294 | C | S | . | . | P | Polyproline II helix | trans | -100.3 | 140.3 | 169.6 | -69 | 163.8 | 0 | 0 | 0 | 108.2 | E33 H152 K154 | L29-E33 WeakPolarHBondContact CA-OE2 3.25Å; L29-E33 HydrophobicContact CB-CB 4.35Å; L29-E33 HydrophobicContact CD2-CB 3.8Å; L29-E33 HydrophobicContact CD2-CG 4.49Å; L29-H152 PolarHBondContact N-O 2.85Å; L29-H152 PolarHBondContact O-ND1 3.33Å; L29-K154 HydrophobicContact CD1-CG 4.38Å; L29-K154 HydrophobicContact CD2-CD 4.2Å; L29-K154 HydrophobicContact CD2-CG 3.94Å; L29-K154 HydrophobicContact CG-CD 4.39Å; L29-K154 HydrophobicContact CG-CG 3.67Å |
| 30 | S | 91.6 | Very high | 89.5 | Confident | 21 Ų | 21 | 57.7 Ų | 57.7 | 15% | 0.147 | 29% | 0.289 | C | S | . | . | P | Polyproline II helix | trans | -64 | 160.2 | 159.9 | 62.9 | 0 | 0 | 0 | 0 | 111 | H32 E33 M34 | S30-H32 PolarHBondContact O-N 3.24Å; S30-E33 WeakPolarHBondContact CB-OE2 3.37Å; S30-E33 PolarHBondContact N-OE2 2.88Å; S30-E33 PolarHBondContact O-N 3.44Å; S30-E33 WeakPolarHBondContact OG-CB 3.39Å; S30-E33 WeakPolarHBondContact OG-CG 3.41Å; S30-E33 PolarHBondContact OG-N 3.2Å; S30-E33 PolarHBondContact OG-OE2 3.48Å; S30-M34 PolarHBondContact O-N 3.37Å; S30-M34 VanDerWaalsContact O-N 3.08Å |
| 31 | L | 93.2 | Very high | 90.5 | Very high | 3 Ų | 3 | 57.6 Ų | 57.6 | 2% | 0.016 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -51.9 | -47.4 | 173.5 | -167 | 58.1 | 0 | 0 | 0 | 111.8 | M34 F35 E121 D128 L131 | L31-M34 HydrophobicContact CD1-CE 3.65Å; L31-M34 CarbonylContact O-C 3.33Å; L31-M34 WeakPolarHBondContact O-CA 3.32Å; L31-M34 WeakPolarHBondContact O-CB 3.38Å; L31-M34 PolarHBondContact O-N 2.71Å; L31-M34 VanDerWaalsContact O-N 3.14Å; L31-F35 HydrophobicContact CD1-CD1 4.49Å; L31-F35 HydrophobicContact CD1-CE1 3.77Å; L31-F35 HydrophobicContact CD1-CZ 3.78Å; L31-F35 HydrophobicContact CD2-CE2 4.12Å; L31-F35 HydrophobicContact CD2-CZ 3.92Å; L31-F35 HydrophobicContact CG-CD2 4.43Å; L31-F35 HydrophobicContact CG-CE1 3.99Å; L31-F35 HydrophobicContact CG-CE2 3.87Å; L31-F35 HydrophobicContact CG-CZ 3.62Å; L31-F35 WeakPolarHBondContact O-CG 3.46Å; L31-F35 PolarHBondContact O-N 2.91Å; L31-E121 HydrophobicContact CD2-CG 4.1Å; L31-E121 WeakPolarHBondContact CD2-OE1 3.42Å; L31-D128 VanDerWaalsContact CB-OD1 3.27Å; L31-D128 WeakPolarHBondContact CB-OD1 3.46Å; L31-L131 HydrophobicContact CD1-CD2 3.69Å |
| 32 | H | 94.5 | Very high | 91.2 | Very high | 92 Ų | 92 | 53 Ų | 53 | 43% | 0.426 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -68.1 | -41.1 | -174.9 | -55.8 | 123 | 0 | 0 | 0 | 112 | S30 M34 F35 E36 E121 | S30-H32 PolarHBondContact O-N 3.24Å; H32-M34 VanDerWaalsContact C-N 3.26Å; H32-M34 PolarHBondContact O-N 2.76Å; H32-F35 WeakPolarHBondContact O-CB 3.48Å; H32-F35 PolarHBondContact O-N 3.05Å; H32-F35 VanDerWaalsContact O-N 3.14Å; H32-E36 WeakPolarHBondContact O-CG 3.34Å; H32-E36 PolarHBondContact O-N 3.22Å; H32-E121 IonicContact CD2-OE2 3.74Å; H32-E121 IonicContact NE2-OE1 3.6Å; H32-E121 IonicContact NE2-OE2 3.31Å; H32-E121 PolarHBondContact NE2-OE2 2.81Å |
| 33 | E | 93.1 | Very high | 91.8 | Very high | 52 Ų | 52 | 53.8 Ų | 53.8 | 24% | 0.243 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60.5 | -38.3 | 171.7 | -74.9 | 169.9 | 113.5 | 0 | 0 | 111.1 | L29 S30 E36 V37 K154 | L29-E33 WeakPolarHBondContact CA-OE2 3.25Å; L29-E33 HydrophobicContact CB-CB 4.35Å; L29-E33 HydrophobicContact CD2-CB 3.8Å; L29-E33 HydrophobicContact CD2-CG 4.49Å; S30-E33 WeakPolarHBondContact CB-OE2 3.37Å; S30-E33 PolarHBondContact N-OE2 2.88Å; S30-E33 PolarHBondContact O-N 3.44Å; S30-E33 WeakPolarHBondContact OG-CB 3.39Å; S30-E33 WeakPolarHBondContact OG-CG 3.41Å; S30-E33 PolarHBondContact OG-N 3.2Å; S30-E33 PolarHBondContact OG-OE2 3.48Å; E33-E36 PolarHBondContact O-N 3.12Å; E33-V37 WeakPolarHBondContact O-CG2 2.95Å; E33-V37 PolarHBondContact O-N 3Å; E33-V37 VanDerWaalsContact O-N 3.15Å; E33-K154 IonicContact OE1-NZ 3.14Å; E33-K154 PolarHBondContact OE1-NZ 2.94Å |
| 34 | M | 94.5 | Very high | 92.2 | Very high | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -65.7 | -40.7 | 175.2 | -179.9 | -82.7 | -60 | 0 | 0 | 111.5 | S30 L31 H32 E36 V37 V38 L131 L134 F149 V150 | S30-M34 PolarHBondContact O-N 3.37Å; S30-M34 VanDerWaalsContact O-N 3.08Å; L31-M34 HydrophobicContact CD1-CE 3.65Å; L31-M34 CarbonylContact O-C 3.33Å; L31-M34 WeakPolarHBondContact O-CA 3.32Å; L31-M34 WeakPolarHBondContact O-CB 3.38Å; L31-M34 PolarHBondContact O-N 2.71Å; L31-M34 VanDerWaalsContact O-N 3.14Å; H32-M34 VanDerWaalsContact C-N 3.26Å; H32-M34 PolarHBondContact O-N 2.76Å; M34-E36 VanDerWaalsContact C-N 3.31Å; M34-E36 PolarHBondContact O-N 3.16Å; M34-V37 PolarHBondContact O-N 3.16Å; M34-V38 HydrophobicContact CG-CG2 4.37Å; M34-V38 WeakPolarHBondContact O-CG2 3.47Å; M34-V38 PolarHBondContact O-N 3.31Å; M34-V38 HydrophobicContact SD-CB 4.44Å; M34-V38 HydrophobicContact SD-CG2 3.74Å; M34-L131 HydrophobicContact CE-CD1 3.99Å; M34-L131 HydrophobicContact CE-CD2 3.72Å; M34-L134 HydrophobicContact CE-CD2 4.15Å; M34-L134 HydrophobicContact SD-CD2 4.05Å; M34-F149 WeakPolarHBondContact CG-O 3.49Å; M34-V150 HydrophobicContact SD-CG1 4.48Å |
| 35 | F | 95.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.5 | -35.9 | 174.1 | -69.3 | -11.6 | 0 | 0 | 0 | 112.8 | L31 H32 G39 L114 L117 L118 E121 L126 L134 | L31-F35 HydrophobicContact CD1-CD1 4.49Å; L31-F35 HydrophobicContact CD1-CE1 3.77Å; L31-F35 HydrophobicContact CD1-CZ 3.78Å; L31-F35 HydrophobicContact CD2-CE2 4.12Å; L31-F35 HydrophobicContact CD2-CZ 3.92Å; L31-F35 HydrophobicContact CG-CD2 4.43Å; L31-F35 HydrophobicContact CG-CE1 3.99Å; L31-F35 HydrophobicContact CG-CE2 3.87Å; L31-F35 HydrophobicContact CG-CZ 3.62Å; L31-F35 WeakPolarHBondContact O-CG 3.46Å; L31-F35 PolarHBondContact O-N 2.91Å; H32-F35 WeakPolarHBondContact O-CB 3.48Å; H32-F35 PolarHBondContact O-N 3.05Å; H32-F35 VanDerWaalsContact O-N 3.14Å; F35-G39 VanDerWaalsContact O-CA 3.23Å; F35-G39 WeakPolarHBondContact O-CA 3.44Å; F35-G39 PolarHBondContact O-N 2.93Å; F35-L114 HydrophobicContact CB-CD1 3.7Å; F35-L117 HydrophobicContact CB-CB 4.12Å; F35-L117 HydrophobicContact CB-CD1 4Å; F35-L117 HydrophobicContact CD1-CB 3.95Å; F35-L117 HydrophobicContact CD1-CD1 3.96Å; F35-L117 HydrophobicContact CD1-CG 4.42Å; F35-L117 HydrophobicContact CD2-CB 3.93Å; F35-L117 HydrophobicContact CE1-CB 4.29Å; F35-L117 HydrophobicContact CE2-CB 4.27Å; F35-L117 HydrophobicContact CG-CB 3.76Å; F35-L117 HydrophobicContact CG-CD1 4.14Å; F35-L117 HydrophobicContact CZ-CB 4.45Å; F35-L118 HydrophobicContact CD2-CD2 3.99Å; F35-L118 HydrophobicContact CD2-CG 4.41Å; F35-L118 HydrophobicContact CE2-CD2 4.43Å; F35-E121 HydrophobicContact CE2-CB 3.93Å; F35-E121 WeakPolarHBondContact CE2-OE2 3.46Å; F35-E121 HydrophobicContact CZ-CB 4.25Å; F35-L126 HydrophobicContact CE1-CD1 3.92Å; F35-L126 HydrophobicContact CZ-CB 4.1Å; F35-L126 HydrophobicContact CZ-CD1 3.84Å; F35-L134 HydrophobicContact CE1-CD2 4.39Å |
| 36 | E | 95.4 | Very high | 93.1 | Very high | 112 Ų | 112 | 50.5 Ų | 50.5 | 52% | 0.523 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.3 | -45.4 | 173.6 | -71.2 | 177.7 | -177.2 | 0 | 0 | 111.4 | H32 E33 M34 S40 L114 | H32-E36 WeakPolarHBondContact O-CG 3.34Å; H32-E36 PolarHBondContact O-N 3.22Å; E33-E36 PolarHBondContact O-N 3.12Å; M34-E36 VanDerWaalsContact C-N 3.31Å; M34-E36 PolarHBondContact O-N 3.16Å; E36-S40 VanDerWaalsContact O-CB 3.23Å; E36-S40 WeakPolarHBondContact O-CB 3.46Å; E36-S40 PolarHBondContact O-N 3.15Å; E36-S40 PolarHBondContact O-OG 3.23Å; E36-L114 HydrophobicContact CG-CD1 3.96Å; E36-L114 HydrophobicContact CG-CD2 4.06Å |
| 37 | V | 94.3 | Very high | 93.5 | Very high | 50 Ų | 50 | 43.5 Ų | 43.5 | 30% | 0.303 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -66.4 | -42.8 | -179.7 | 174.1 | 0 | 0 | 0 | 0 | 112.2 | E33 M34 S40 Q41 F149 | E33-V37 WeakPolarHBondContact O-CG2 2.95Å; E33-V37 PolarHBondContact O-N 3Å; E33-V37 VanDerWaalsContact O-N 3.15Å; M34-V37 PolarHBondContact O-N 3.16Å; V37-S40 PolarHBondContact O-OG 2.95Å; V37-Q41 WeakPolarHBondContact O-CG 3.36Å; V37-Q41 PolarHBondContact O-NE2 3.01Å; V37-F149 HydrophobicContact CG1-CB 4.06Å; V37-F149 HydrophobicContact CG1-CD1 3.69Å; V37-F149 HydrophobicContact CG1-CE1 4.41Å; V37-F149 HydrophobicContact CG1-CG 4.05Å |
| 38 | V | 95.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -76.9 | -46.4 | 179.8 | 175.3 | 0 | 0 | 0 | 0 | 110.4 | M34 S40 Q41 L42 L117 L138 L146 F149 V150 | M34-V38 HydrophobicContact CG-CG2 4.37Å; M34-V38 WeakPolarHBondContact O-CG2 3.47Å; M34-V38 PolarHBondContact O-N 3.31Å; M34-V38 HydrophobicContact SD-CB 4.44Å; M34-V38 HydrophobicContact SD-CG2 3.74Å; V38-S40 VanDerWaalsContact C-N 3.33Å; V38-S40 PolarHBondContact O-N 2.9Å; V38-Q41 PolarHBondContact O-N 2.95Å; V38-L42 PolarHBondContact O-N 2.7Å; V38-L117 HydrophobicContact CB-CD1 4.24Å; V38-L117 HydrophobicContact CG1-CD1 4.18Å; V38-L138 HydrophobicContact CG1-CD1 4.47Å; V38-L146 HydrophobicContact CG1-CD1 4.32Å; V38-F149 HydrophobicContact CG2-CB 4.04Å; V38-V150 HydrophobicContact CG2-CG2 4Å |
| 39 | G | 95.8 | Very high | 93.9 | Very high | 5 Ų | 5 | 46.5 Ų | 46.5 | 5% | 0.052 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65 | -32.2 | -176 | 0 | 0 | 0 | 0 | 0 | 113.8 | F35 Q41 L42 | F35-G39 VanDerWaalsContact O-CA 3.23Å; F35-G39 WeakPolarHBondContact O-CA 3.44Å; F35-G39 PolarHBondContact O-N 2.93Å; G39-Q41 PolarHBondContact O-N 3.33Å; G39-L42 PolarHBondContact O-N 2.77Å |
| 40 | S | 95.7 | Very high | 93.9 | Very high | 93 Ų | 93 | 45.4 Ų | 45.4 | 65% | 0.65 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.1 | -20.4 | 173.2 | 56.4 | 0 | 0 | 0 | 0 | 113.8 | E36 V37 V38 | E36-S40 VanDerWaalsContact O-CB 3.23Å; E36-S40 WeakPolarHBondContact O-CB 3.46Å; E36-S40 PolarHBondContact O-N 3.15Å; E36-S40 PolarHBondContact O-OG 3.23Å; V37-S40 PolarHBondContact O-OG 2.95Å; V38-S40 VanDerWaalsContact C-N 3.33Å; V38-S40 PolarHBondContact O-N 2.9Å |
| 41 | Q | 95.6 | Very high | 93.8 | Very high | 63 Ų | 63 | 45.3 Ų | 45.3 | 29% | 0.294 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -98.9 | -2.8 | 178.6 | -62.6 | -177.9 | 75.5 | 0 | 0 | 113.2 | V37 V38 G39 R143 L146 | V37-Q41 WeakPolarHBondContact O-CG 3.36Å; V37-Q41 PolarHBondContact O-NE2 3.01Å; V38-Q41 PolarHBondContact O-N 2.95Å; G39-Q41 PolarHBondContact O-N 3.33Å; Q41-R143 PolarHBondContact O-NH2 2.74Å; Q41-L146 HydrophobicContact CB-CD1 4.21Å; Q41-L146 HydrophobicContact CB-CD2 3.43Å; Q41-L146 VanDerWaalsContact CB-CD2 3.43Å; Q41-L146 HydrophobicContact CB-CG 4.48Å; Q41-L146 VanDerWaalsContact CD-CD2 3.47Å; Q41-L146 HydrophobicContact CG-CD2 4.08Å |
| 42 | L | 95.9 | Very high | 93.5 | Very high | 15 Ų | 15 | 51.5 Ų | 51.5 | 8% | 0.079 | 28% | 0.276 | C | S | . | . | trans | -75.2 | 132 | 171.9 | -69.3 | 176.3 | 0 | 0 | 0 | 109.6 | V38 G39 D46 I47 L50 L138 L146 | V38-L42 PolarHBondContact O-N 2.7Å; G39-L42 PolarHBondContact O-N 2.77Å; L42-D46 HydrophobicContact CB-CB 4.33Å; L42-D46 HydrophobicContact CD2-CB 4.05Å; L42-I47 HydrophobicContact CB-CG1 4.16Å; L42-L50 HydrophobicContact CD1-CD1 4.28Å; L42-L138 HydrophobicContact CD2-CD2 4.07Å; L42-L146 HydrophobicContact CD2-CD1 3.78Å; L42-L146 HydrophobicContact CG-CD1 4.42Å | ||
| 43 | T | 94.9 | Very high | 92.9 | Very high | 61 Ų | 61 | 50.4 Ų | 50.4 | 37% | 0.374 | 27% | 0.272 | S | S | . | . | trans | -79.1 | 162.4 | 176 | 63.8 | 0 | 0 | 0 | 0 | 110.9 | S45 D46 I47 | T43-S45 PolarHBondContact O-N 2.92Å; T43-S45 PolarHBondContact OG1-OG 3.49Å; T43-D46 WeakPolarHBondContact CB-OD2 3.34Å; T43-D46 PolarHBondContact N-OD2 2.95Å; T43-D46 WeakPolarHBondContact O-CB 2.93Å; T43-D46 PolarHBondContact O-N 2.78Å; T43-D46 PolarHBondContact OG1-N 3.12Å; T43-D46 PolarHBondContact OG1-OD2 3.41Å; T43-I47 WeakPolarHBondContact O-CG1 3.01Å; T43-I47 PolarHBondContact O-N 2.85Å | ||
| 44 | E | 94.1 | Very high | 92.3 | Very high | 138 Ų | 138 | 48.5 Ų | 48.5 | 65% | 0.645 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -56.1 | -40.4 | 175.6 | -171.6 | 171.1 | -161.8 | 0 | 0 | 111.6 | D46 I47 E48 | E44-D46 PolarHBondContact O-N 3.48Å; E44-I47 PolarHBondContact O-N 3.24Å; E44-E48 WeakPolarHBondContact O-CG 3.45Å; E44-E48 PolarHBondContact O-N 3.45Å |
| 45 | S | 93.4 | Very high | 91.5 | Very high | 76 Ų | 76 | 50.3 Ų | 50.3 | 53% | 0.531 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -64.1 | -36.5 | 174.4 | 49.4 | 0 | 0 | 0 | 0 | 113.6 | T43 I47 A49 | T43-S45 PolarHBondContact O-N 2.92Å; T43-S45 PolarHBondContact OG1-OG 3.49Å; S45-I47 VanDerWaalsContact C-N 3.34Å; S45-A49 WeakPolarHBondContact O-CB 3.35Å; S45-A49 PolarHBondContact O-N 3.05Å |
| 46 | D | 94.3 | Very high | 90.6 | Very high | 13 Ų | 13 | 57.2 Ų | 57.2 | 7% | 0.07 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65.5 | -42.8 | 175.6 | -62.6 | -40.9 | 0 | 0 | 0 | 110.2 | L42 T43 E44 A49 L50 L141 R143 | L42-D46 HydrophobicContact CB-CB 4.33Å; L42-D46 HydrophobicContact CD2-CB 4.05Å; T43-D46 WeakPolarHBondContact CB-OD2 3.34Å; T43-D46 PolarHBondContact N-OD2 2.95Å; T43-D46 WeakPolarHBondContact O-CB 2.93Å; T43-D46 PolarHBondContact O-N 2.78Å; T43-D46 PolarHBondContact OG1-N 3.12Å; T43-D46 PolarHBondContact OG1-OD2 3.41Å; E44-D46 PolarHBondContact O-N 3.48Å; D46-A49 PolarHBondContact O-N 3.43Å; D46-L50 WeakPolarHBondContact O-CB 3.23Å; D46-L50 VanDerWaalsContact O-CG 3.26Å; D46-L50 WeakPolarHBondContact O-CG 3.13Å; D46-L50 PolarHBondContact O-N 3.39Å; D46-L141 HydrophobicContact CB-CD1 4.1Å; D46-R143 WeakPolarHBondContact OD2-CD 3.28Å; D46-R143 IonicContact OD2-NE 3.01Å; D46-R143 PolarHBondContact OD2-NE 3.34Å |
| 47 | I | 93.4 | Very high | 89.3 | Confident | 18 Ų | 18 | 56 Ų | 56 | 9% | 0.092 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 179.2 | -64.1 | 163.7 | 0 | 0 | 0 | 110.1 | L42 T43 E44 S45 L50 S51 F110 L116 | L42-I47 HydrophobicContact CB-CG1 4.16Å; T43-I47 WeakPolarHBondContact O-CG1 3.01Å; T43-I47 PolarHBondContact O-N 2.85Å; E44-I47 PolarHBondContact O-N 3.24Å; S45-I47 VanDerWaalsContact C-N 3.34Å; I47-L50 PolarHBondContact O-N 3.04Å; I47-S51 VanDerWaalsContact O-CB 3.25Å; I47-S51 WeakPolarHBondContact O-CB 3.41Å; I47-S51 PolarHBondContact O-N 3.34Å; I47-S51 PolarHBondContact O-OG 3.5Å; I47-F110 HydrophobicContact CG2-CB 3.96Å; I47-L116 HydrophobicContact CG2-CD2 4.47Å |
| 48 | E | 91.7 | Very high | 87.8 | Confident | 101 Ų | 101 | 57.9 Ų | 57.9 | 47% | 0.472 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.5 | -49.2 | 175.6 | -73.6 | -177.1 | 169.7 | 0 | 0 | 111.7 | E44 L50 S51 F52 | E44-E48 WeakPolarHBondContact O-CG 3.45Å; E44-E48 PolarHBondContact O-N 3.45Å; E48-L50 PolarHBondContact O-N 3.17Å; E48-S51 WeakPolarHBondContact CA-OG 3.37Å; E48-S51 PolarHBondContact O-N 3.28Å; E48-S51 PolarHBondContact O-OG 3.43Å; E48-F52 WeakPolarHBondContact O-CB 3.31Å; E48-F52 PolarHBondContact O-N 3.36Å |
| 49 | A | 90.6 | Very high | 86 | Confident | 36 Ų | 36 | 62 Ų | 62 | 30% | 0.298 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.4 | -43.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | S45 D46 F52 L53 L141 | S45-A49 WeakPolarHBondContact O-CB 3.35Å; S45-A49 PolarHBondContact O-N 3.05Å; D46-A49 PolarHBondContact O-N 3.43Å; A49-F52 PolarHBondContact O-N 3.15Å; A49-L53 WeakPolarHBondContact O-CG 3.44Å; A49-L53 PolarHBondContact O-N 3.39Å; A49-L141 HydrophobicContact CB-CD2 3.75Å |
| 50 | L | 88.9 | Confident | 84.2 | Confident | 5 Ų | 5 | 65.4 Ų | 65.4 | 3% | 0.026 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -68.3 | -40.6 | 177.5 | -70.7 | 172.9 | 0 | 0 | 0 | 112.3 | L42 D46 I47 E48 F52 L53 L54 L116 L137 L141 | L42-L50 HydrophobicContact CD1-CD1 4.28Å; D46-L50 WeakPolarHBondContact O-CB 3.23Å; D46-L50 VanDerWaalsContact O-CG 3.26Å; D46-L50 WeakPolarHBondContact O-CG 3.13Å; D46-L50 PolarHBondContact O-N 3.39Å; I47-L50 PolarHBondContact O-N 3.04Å; E48-L50 PolarHBondContact O-N 3.17Å; L50-F52 VanDerWaalsContact C-N 3.29Å; L50-F52 PolarHBondContact O-N 3.24Å; L50-L53 HydrophobicContact CD2-CD1 4.46Å; L50-L53 PolarHBondContact O-N 3.17Å; L50-L54 WeakPolarHBondContact O-CB 3.36Å; L50-L54 WeakPolarHBondContact O-CG 3.23Å; L50-L54 PolarHBondContact O-N 2.91Å; L50-L116 HydrophobicContact CB-CD1 4.27Å; L50-L116 HydrophobicContact CB-CD2 3.56Å; L50-L116 HydrophobicContact CB-CG 4.48Å; L50-L116 HydrophobicContact CD1-CD2 3.55Å; L50-L116 HydrophobicContact CG-CD2 4.18Å; L50-L137 HydrophobicContact CD2-CB 3.99Å; L50-L137 HydrophobicContact CD2-CD1 4.1Å; L50-L137 HydrophobicContact CD2-CD2 3.77Å; L50-L137 HydrophobicContact CD2-CG 4.16Å; L50-L141 HydrophobicContact CD1-CD1 3.71Å; L50-L141 HydrophobicContact CD2-CD1 3.76Å; L50-L141 HydrophobicContact CD2-CG 4.35Å; L50-L141 HydrophobicContact CG-CD1 3.64Å |
| 51 | S | 88.9 | Confident | 82.5 | Confident | 18 Ų | 18 | 66.7 Ų | 66.7 | 13% | 0.126 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.1 | -41.5 | 175.2 | 75.7 | 0 | 0 | 0 | 0 | 111.4 | I47 E48 L54 N55 | I47-S51 VanDerWaalsContact O-CB 3.25Å; I47-S51 WeakPolarHBondContact O-CB 3.41Å; I47-S51 PolarHBondContact O-N 3.34Å; I47-S51 PolarHBondContact O-OG 3.5Å; E48-S51 WeakPolarHBondContact CA-OG 3.37Å; E48-S51 PolarHBondContact O-N 3.28Å; E48-S51 PolarHBondContact O-OG 3.43Å; S51-L54 PolarHBondContact O-N 3.13Å; S51-N55 WeakPolarHBondContact O-CB 3.31Å; S51-N55 PolarHBondContact O-N 2.97Å; S51-N55 PolarHBondContact O-ND2 3.05Å; S51-N55 PolarHBondContact O-OD1 3.48Å |
| 52 | F | 87 | Confident | 81.2 | Confident | 134 Ų | 134 | 66.5 Ų | 66.5 | 59% | 0.588 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -61.7 | -49.7 | 175.2 | 174.4 | -96.5 | 0 | 0 | 0 | 111.3 | E48 A49 L50 L54 N55 E56 | E48-F52 WeakPolarHBondContact O-CB 3.31Å; E48-F52 PolarHBondContact O-N 3.36Å; A49-F52 PolarHBondContact O-N 3.15Å; L50-F52 VanDerWaalsContact C-N 3.29Å; L50-F52 PolarHBondContact O-N 3.24Å; F52-L54 PolarHBondContact O-N 3.38Å; F52-N55 PolarHBondContact O-N 3.32Å; F52-N55 VanDerWaalsContact O-N 3.1Å; F52-E56 PolarHBondContact O-N 3.46Å |
| 53 | L | 82.9 | Confident | 79.7 | Confident | 68 Ų | 68 | 70.8 Ų | 70.8 | 36% | 0.356 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -59.2 | -37.4 | 178.1 | -74.2 | 165 | 0 | 0 | 0 | 112.2 | A49 L50 T57 L137 | A49-L53 WeakPolarHBondContact O-CG 3.44Å; A49-L53 PolarHBondContact O-N 3.39Å; L50-L53 HydrophobicContact CD2-CD1 4.46Å; L50-L53 PolarHBondContact O-N 3.17Å; L53-T57 WeakPolarHBondContact O-CB 3.39Å; L53-T57 VanDerWaalsContact O-CG2 3.32Å; L53-T57 WeakPolarHBondContact O-CG2 3.2Å; L53-T57 PolarHBondContact O-N 3.32Å; L53-T57 VanDerWaalsContact O-N 3.12Å; L53-T57 PolarHBondContact O-OG1 3.36Å; L53-L137 HydrophobicContact CD1-CD2 4.38Å |
| 54 | L | 78.8 | Confident | 78.6 | Confident | 12 Ų | 12 | 72.6 Ų | 72.6 | 6% | 0.063 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -71.8 | -33 | 177.1 | -76.5 | 171.2 | 0 | 0 | 0 | 113.6 | L50 S51 F52 T57 Y58 L116 L120 Y125 | L50-L54 WeakPolarHBondContact O-CB 3.36Å; L50-L54 WeakPolarHBondContact O-CG 3.23Å; L50-L54 PolarHBondContact O-N 2.91Å; S51-L54 PolarHBondContact O-N 3.13Å; F52-L54 PolarHBondContact O-N 3.38Å; L54-T57 PolarHBondContact O-OG1 3.24Å; L54-Y58 WeakPolarHBondContact O-CB 3.43Å; L54-Y58 PolarHBondContact O-N 3.42Å; L54-L116 HydrophobicContact CD1-CD1 3.48Å; L54-L116 VanDerWaalsContact CD1-CD1 3.48Å; L54-L120 HydrophobicContact CD1-CD1 4.5Å; L54-L120 HydrophobicContact CD1-CD2 3.6Å; L54-L120 HydrophobicContact CD1-CG 3.89Å; L54-L120 HydrophobicContact CD2-CD2 3.2Å; L54-L120 HydrophobicContact CD2-CG 4.36Å; L54-L120 HydrophobicContact CG-CD2 3.89Å; L54-Y125 HydrophobicContact CD2-CD2 4.29Å; L54-Y125 HydrophobicContact CD2-CE2 4.12Å |
| 55 | N | 78.3 | Confident | 77.6 | Confident | 38 Ų | 38 | 67 Ų | 67 | 20% | 0.203 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -71.4 | -39.8 | 176.6 | -65.9 | -19.6 | 0 | 0 | 0 | 110.3 | S51 F52 T57 L105 | S51-N55 WeakPolarHBondContact O-CB 3.31Å; S51-N55 PolarHBondContact O-N 2.97Å; S51-N55 PolarHBondContact O-ND2 3.05Å; S51-N55 PolarHBondContact O-OD1 3.48Å; F52-N55 PolarHBondContact O-N 3.32Å; F52-N55 VanDerWaalsContact O-N 3.1Å; N55-T57 PolarHBondContact O-N 2.9Å; N55-L105 HydrophobicContact CB-CD2 3.71Å; N55-L105 HydrophobicContact CB-CG 3.93Å; N55-L105 WeakPolarHBondContact O-CD2 3.24Å; N55-L105 WeakPolarHBondContact OD1-CD1 3.37Å; N55-L105 WeakPolarHBondContact OD1-CG 3.46Å |
| 56 | E | 77.6 | Confident | 76.8 | Confident | 145 Ų | 145 | 63.6 Ų | 63.6 | 68% | 0.678 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -68.6 | -36.5 | 179.4 | -166.3 | 64.6 | -166.4 | 0 | 0 | 112.8 | F52 Y58 | F52-E56 PolarHBondContact O-N 3.46Å; E56-Y58 VanDerWaalsContact C-N 3.33Å; E56-Y58 PolarHBondContact O-N 2.95Å |
| 57 | T | 67.8 | Low | 75.9 | Confident | 87 Ų | 87 | 65 Ų | 65 | 53% | 0.534 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -82.3 | -9.6 | -176.5 | 51.5 | 0 | 0 | 0 | 0 | 114 | L53 L54 N55 | L53-T57 WeakPolarHBondContact O-CB 3.39Å; L53-T57 VanDerWaalsContact O-CG2 3.32Å; L53-T57 WeakPolarHBondContact O-CG2 3.2Å; L53-T57 PolarHBondContact O-N 3.32Å; L53-T57 VanDerWaalsContact O-N 3.12Å; L53-T57 PolarHBondContact O-OG1 3.36Å; L54-T57 PolarHBondContact O-OG1 3.24Å; N55-T57 PolarHBondContact O-N 2.9Å |
| 58 | Y | 63.7 | Low | 74.8 | Confident | 89 Ų | 89 | 66.4 Ų | 66.4 | 35% | 0.349 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -110.5 | 110.2 | 179.2 | -161.8 | -93.7 | 0 | 0 | 0 | 110.5 | L54 E56 A60 L105 | L54-Y58 WeakPolarHBondContact O-CB 3.43Å; L54-Y58 PolarHBondContact O-N 3.42Å; E56-Y58 VanDerWaalsContact C-N 3.33Å; E56-Y58 PolarHBondContact O-N 2.95Å; Y58-A60 PolarHBondContact O-N 3.39Å; Y58-L105 HydrophobicContact CD1-CD1 4.43Å; Y58-L105 WeakPolarHBondContact O-CD2 3.09Å |
| 59 | P | 57.4 | Low | 74 | Confident | 86 Ų | 86 | 68.8 Ų | 68.8 | 56% | 0.558 | 38% | 0.381 | S | S | * | . | trans | -60.8 | 130.2 | 172.6 | 25 | -30.8 | 0 | 0 | 0 | 108.5 | Q61 | P59-Q61 PolarHBondContact O-N 2.89Š| ||
| 60 | A | 58 | Low | 73.1 | Confident | 78 Ų | 78 | 68.5 Ų | 68.5 | 65% | 0.645 | 38% | 0.376 | S | S | * | . | S | Bend | trans | -56.2 | -15.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y58 | Y58-A60 PolarHBondContact O-N 3.39Š|
| 61 | Q | 60.3 | Low | 72.1 | Confident | 120 Ų | 120 | 73.2 Ų | 73.2 | 56% | 0.561 | 40% | 0.404 | S | S | * | . | S | Bend | trans | -102.2 | 129.2 | 177.6 | -67.1 | 176.7 | 1.1 | 0 | 0 | 111.3 | P59 | P59-Q61 PolarHBondContact O-N 2.89Š|
| 62 | H | 66.4 | Low | 70.9 | Confident | 58 Ų | 58 | 79.5 Ų | 79.5 | 27% | 0.269 | 43% | 0.432 | S | S | . | . | trans | -63.2 | 140.1 | 176.3 | -174 | -85.8 | 0 | 0 | 0 | 109.4 | L64 D65 W93 | H62-L64 WeakPolarHBondContact ND1-CB 3.48Å; H62-L64 PolarHBondContact ND1-N 2.91Å; H62-L64 PolarHBondContact O-N 2.98Å; H62-L64 VanDerWaalsContact O-N 3.09Å; H62-D65 HydrophobicContact CB-CB 4.28Å; H62-D65 WeakPolarHBondContact O-CA 3.2Å; H62-D65 WeakPolarHBondContact O-CB 3.19Å; H62-D65 PolarHBondContact O-N 3.23Å; H62-W93 HydrophobicContact CB-CZ2 4.38Å; H62-W93 AromaticContact CE1-CH2 3.91Å; H62-W93 AromaticContact ND1-CH2 3.72Å; H62-W93 AromaticContact ND1-CZ2 3.54Å | ||
| 63 | P | 65.6 | Low | 69.7 | Low | 105 Ų | 105 | 76.1 Ų | 76.1 | 68% | 0.682 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.1 | -25.6 | -177.4 | 22 | -33.5 | 0 | 0 | 0 | 113.5 | W69 | P63-W69 PolarHBondContact O-NE1 3.18Š|
| 64 | L | 71.3 | Confident | 68.5 | Low | 99 Ų | 99 | 75.5 Ų | 75.5 | 52% | 0.518 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.3 | 15.2 | 172.4 | -52.4 | 178.1 | 0 | 0 | 0 | 113.8 | H62 P66 W69 W93 | H62-L64 WeakPolarHBondContact ND1-CB 3.48Å; H62-L64 PolarHBondContact ND1-N 2.91Å; H62-L64 PolarHBondContact O-N 2.98Å; H62-L64 VanDerWaalsContact O-N 3.09Å; L64-P66 WeakPolarHBondContact O-CD 3.44Å; L64-W69 HydrophobicContact CB-CZ2 4.22Å; L64-W69 WeakPolarHBondContact O-CZ2 3.49Å; L64-W93 HydrophobicContact CB-CH2 3.62Å; L64-W93 HydrophobicContact CB-CZ2 4.25Å; L64-W93 HydrophobicContact CB-CZ3 4.19Å; L64-W93 WeakPolarHBondContact O-CH2 3.36Å; L64-W93 WeakPolarHBondContact O-CZ2 3.49Å |
| 65 | D | 74.2 | Confident | 67.7 | Low | 22 Ų | 22 | 85 Ų | 85 | 12% | 0.118 | 47% | 0.472 | C | S | . | . | trans | -73 | 115.2 | 177.4 | -162 | -28.6 | 0 | 0 | 0 | 110.1 | H62 A67 G68 W69 | H62-D65 HydrophobicContact CB-CB 4.28Å; H62-D65 WeakPolarHBondContact O-CA 3.2Å; H62-D65 WeakPolarHBondContact O-CB 3.19Å; H62-D65 PolarHBondContact O-N 3.23Å; D65-A67 PolarHBondContact O-N 2.73Å; D65-A67 VanDerWaalsContact O-N 3.15Å; D65-A67 WeakPolarHBondContact OD1-CB 3.47Å; D65-A67 PolarHBondContact OD1-N 3.01Å; D65-G68 PolarHBondContact O-N 3.47Å; D65-W69 PolarHBondContact O-NE1 3.15Å | ||
| 66 | P | 75.6 | Confident | 66.9 | Low | 4 Ų | 4 | 91 Ų | 91 | 3% | 0.026 | 50% | 0.504 | C | S | . | . | G | 310 helix | trans | -67.1 | -13.1 | 180 | 28 | -35.9 | 0 | 0 | 0 | 114.4 | L64 G68 W69 P85 L89 L90 W93 | L64-P66 WeakPolarHBondContact O-CD 3.44Å; P66-G68 VanDerWaalsContact C-N 3.25Å; P66-W69 HydrophobicContact CB-CD2 4.22Å; P66-W69 HydrophobicContact CB-CE3 3.76Å; P66-W69 HydrophobicContact CB-CZ3 3.93Å; P66-P85 WeakPolarHBondContact O-CB 3.43Å; P66-L89 HydrophobicContact CB-CD2 3.03Å; P66-L89 HydrophobicContact CG-CD2 3.36Å; P66-L90 HydrophobicContact CG-CD2 4.02Å; P66-W93 HydrophobicContact CG-CB 3.95Å; P66-W93 HydrophobicContact CG-CD2 4.42Å; P66-W93 HydrophobicContact CG-CG 3.9Å |
| 67 | A | 76 | Confident | 65.9 | Low | 43 Ų | 43 | 89 Ų | 89 | 36% | 0.355 | 50% | 0.498 | S | S | . | . | G | 310 helix | trans | -67.4 | -26.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | D65 T70 L90 | D65-A67 PolarHBondContact O-N 2.73Å; D65-A67 VanDerWaalsContact O-N 3.15Å; D65-A67 WeakPolarHBondContact OD1-CB 3.47Å; D65-A67 PolarHBondContact OD1-N 3.01Å; A67-T70 PolarHBondContact O-OG1 3.18Å; A67-L90 HydrophobicContact CB-CD2 4.11Å |
| 68 | G | 69.3 | Low | 65.7 | Low | 46 Ų | 46 | 90.8 Ų | 90.8 | 47% | 0.474 | 51% | 0.514 | S | S | . | . | G | 310 helix | trans | -96.1 | 2.1 | 179 | 0 | 0 | 0 | 0 | 0 | 114.3 | D65 P66 T70 | D65-G68 PolarHBondContact O-N 3.47Å; P66-G68 VanDerWaalsContact C-N 3.25Å; G68-T70 VanDerWaalsContact C-N 3.27Å |
| 69 | W | 75.8 | Confident | 65.6 | Low | 151 Ų | 151 | 95 Ų | 95 | 57% | 0.572 | 54% | 0.537 | S | S | * | . | S | Bend | trans | -87.1 | 2.4 | -179.7 | -64 | -10.8 | 0 | 0 | 0 | 113.4 | P63 L64 D65 P66 L89 | P63-W69 PolarHBondContact O-NE1 3.18Å; L64-W69 HydrophobicContact CB-CZ2 4.22Å; L64-W69 WeakPolarHBondContact O-CZ2 3.49Å; D65-W69 PolarHBondContact O-NE1 3.15Å; P66-W69 HydrophobicContact CB-CD2 4.22Å; P66-W69 HydrophobicContact CB-CE3 3.76Å; P66-W69 HydrophobicContact CB-CZ3 3.93Å; W69-L89 HydrophobicContact CZ3-CD2 4.27Å |
| 70 | T | 72 | Confident | 65.7 | Low | 31 Ų | 31 | 94.3 Ų | 94.3 | 19% | 0.19 | 53% | 0.529 | C | S | . | . | S | Bend | trans | -100.6 | 147.2 | -175.5 | 48 | 0 | 0 | 0 | 0 | 111.8 | A67 G68 E72 V83 P85 | A67-T70 PolarHBondContact O-OG1 3.18Å; G68-T70 VanDerWaalsContact C-N 3.27Å; T70-E72 PolarHBondContact O-N 3.02Å; T70-V83 WeakPolarHBondContact CB-O 3.47Å; T70-V83 WeakPolarHBondContact CG2-O 3.49Å; T70-P85 HydrophobicContact CG2-CB 3.71Å; T70-P85 HydrophobicContact CG2-CG 4.16Å |
| 71 | V | 66.8 | Low | 65.8 | Low | 104 Ų | 104 | 95.1 Ų | 95.1 | 63% | 0.63 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -78.9 | 118.6 | 178.1 | 179 | 0 | 0 | 0 | 0 | 107.4 | ||
| 72 | E | 64.8 | Low | 65.9 | Low | 149 Ų | 149 | 90.5 Ų | 90.5 | 70% | 0.696 | 52% | 0.52 | S | S | * | . | P | Polyproline II helix | trans | -64 | 137.6 | 170 | -67.8 | -63.2 | 115.1 | 0 | 0 | 109 | T70 A74 | T70-E72 PolarHBondContact O-N 3.02Å; E72-A74 PolarHBondContact O-N 3.48Å |
| 73 | P | 60.6 | Low | 66.2 | Low | 64 Ų | 64 | 93 Ų | 93 | 42% | 0.416 | 54% | 0.539 | S | S | . | . | P | Polyproline II helix | trans | -60.5 | 136.6 | -178.7 | 27.5 | -35.6 | 0 | 0 | 0 | 110.4 | E75 D80 | P73-E75 PolarHBondContact O-N 3.43Å; P73-D80 WeakPolarHBondContact CB-O 3.23Å |
| 74 | A | 58.9 | Low | 66.3 | Low | 54 Ų | 54 | 91.9 Ų | 91.9 | 45% | 0.446 | 54% | 0.538 | S | S | . | . | P | Polyproline II helix | trans | -61.8 | 128.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | E72 D76 D77 D80 | E72-A74 PolarHBondContact O-N 3.48Å; A74-D76 PolarHBondContact O-N 2.99Å; A74-D77 PolarHBondContact O-N 3.31Å; A74-D80 PolarHBondContact N-OD2 3.31Å |
| 75 | E | 61.9 | Low | 66.5 | Low | 212 Ų | 212 | 89 Ų | 89 | 99% | 0.991 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -13.7 | -175.9 | -57.9 | -177.3 | 179.3 | 0 | 0 | 114 | P73 | P73-E75 PolarHBondContact O-N 3.43Š|
| 76 | D | 60.8 | Low | 66.9 | Low | 165 Ų | 165 | 90.8 Ų | 90.8 | 88% | 0.882 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.4 | -3.3 | -174.3 | -157 | 29.8 | 0 | 0 | 0 | 114.1 | A74 | A74-D76 PolarHBondContact O-N 2.99Š|
| 77 | D | 56 | Low | 67.2 | Low | 102 Ų | 102 | 94.3 Ų | 94.3 | 55% | 0.545 | 56% | 0.563 | S | S | . | * | trans | -126.9 | 104.9 | -179.2 | -153 | -8.9 | 0 | 0 | 0 | 111.5 | A74 E79 D80 | A74-D77 PolarHBondContact O-N 3.31Å; D77-E79 PolarHBondContact O-N 2.78Å; D77-E79 VanDerWaalsContact O-N 3.08Å; D77-D80 HydrophobicContact CB-CB 4.25Å; D77-D80 PolarHBondContact O-N 2.86Å | ||
| 78 | S | 64.6 | Low | 67.7 | Low | 125 Ų | 125 | 99.4 Ų | 99.4 | 87% | 0.874 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | -8.4 | -172.7 | -60.1 | 0 | 0 | 0 | 0 | 114.5 | ||
| 79 | E | 60.8 | Low | 68.4 | Low | 177 Ų | 177 | 101 Ų | 101 | 83% | 0.827 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.6 | -3.5 | -179.7 | -60.9 | -78 | 142.4 | 0 | 0 | 112.9 | D77 A81 | D77-E79 PolarHBondContact O-N 2.78Å; D77-E79 VanDerWaalsContact O-N 3.08Å; E79-A81 VanDerWaalsContact C-N 3.33Å; E79-A81 PolarHBondContact O-N 3.07Å |
| 80 | D | 60.8 | Low | 68.7 | Low | 72 Ų | 72 | 96 Ų | 96 | 39% | 0.385 | 56% | 0.561 | S | S | . | * | trans | -80.2 | 80.6 | 177.8 | -171.6 | 31 | 0 | 0 | 0 | 110 | P73 A74 D77 G82 | P73-D80 WeakPolarHBondContact CB-O 3.23Å; A74-D80 PolarHBondContact N-OD2 3.31Å; D77-D80 HydrophobicContact CB-CB 4.25Å; D77-D80 PolarHBondContact O-N 2.86Å; D80-G82 VanDerWaalsContact C-N 3.28Å; D80-G82 PolarHBondContact O-N 3.09Å | ||
| 81 | A | 58.8 | Low | 69.2 | Low | 94 Ų | 94 | 101.1 Ų | 101.1 | 78% | 0.777 | 58% | 0.577 | S | S | * | * | trans | -72.5 | 87.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | E79 | E79-A81 VanDerWaalsContact C-N 3.33Å; E79-A81 PolarHBondContact O-N 3.07Å | ||
| 82 | G | 64 | Low | 70 | Confident | 24 Ų | 24 | 97.7 Ų | 97.7 | 25% | 0.247 | 56% | 0.559 | C | S | . | * | trans | -42.9 | 154.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | D80 A84 | D80-G82 VanDerWaalsContact C-N 3.28Å; D80-G82 PolarHBondContact O-N 3.09Å; G82-A84 PolarHBondContact O-N 3.15Å | ||
| 83 | V | 72.3 | Confident | 70.7 | Confident | 110 Ų | 110 | 93 Ų | 93 | 67% | 0.667 | 54% | 0.535 | S | S | * | . | trans | -74.5 | 103 | -171.9 | -180 | 0 | 0 | 0 | 0 | 110.3 | T70 | T70-V83 WeakPolarHBondContact CB-O 3.47Å; T70-V83 WeakPolarHBondContact CG2-O 3.49Å | ||
| 84 | A | 66.9 | Low | 71.6 | Confident | 81 Ų | 81 | 98 Ų | 98 | 67% | 0.669 | 55% | 0.546 | S | S | * | . | P | Polyproline II helix | trans | -65.7 | 145.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | G82 | G82-A84 PolarHBondContact O-N 3.15Š|
| 85 | P | 75.8 | Confident | 72.7 | Confident | 38 Ų | 38 | 104.6 Ų | 104.6 | 25% | 0.247 | 56% | 0.559 | C | S | . | * | P | Polyproline II helix | trans | -70.1 | 143.7 | -175.2 | 23.7 | -31.1 | 0 | 0 | 0 | 111.6 | P66 T70 P87 L90 | P66-P85 WeakPolarHBondContact O-CB 3.43Å; T70-P85 HydrophobicContact CG2-CB 3.71Å; T70-P85 HydrophobicContact CG2-CG 4.16Å; P85-P87 WeakPolarHBondContact O-CD 3.32Å; P85-P87 VanDerWaalsContact O-N 3.17Å; P85-L90 HydrophobicContact CB-CD1 4.13Å; P85-L90 HydrophobicContact CB-CG 4.36Å; P85-L90 HydrophobicContact CG-CD1 3.9Å |
| 86 | S | 83.2 | Confident | 73.2 | Confident | 61 Ų | 61 | 100.8 Ų | 100.8 | 43% | 0.427 | 55% | 0.545 | S | S | . | . | P | Polyproline II helix | trans | -56.8 | 121.4 | -177.9 | 171.5 | 0 | 0 | 0 | 0 | 111.5 | Q88 L89 L90 | S86-Q88 PolarHBondContact O-N 3.02Å; S86-L89 PolarHBondContact O-N 3.44Å; S86-L89 VanDerWaalsContact O-N 3.11Å; S86-L90 PolarHBondContact O-N 2.75Å |
| 87 | P | 81.2 | Confident | 73.4 | Confident | 77 Ų | 77 | 94.2 Ų | 94.2 | 50% | 0.5 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.8 | -24.2 | -175.5 | 26 | -34.3 | 0 | 0 | 0 | 112.5 | P85 R91 | P85-P87 WeakPolarHBondContact O-CD 3.32Å; P85-P87 VanDerWaalsContact O-N 3.17Å; P87-R91 VanDerWaalsContact O-CG 3.23Å; P87-R91 WeakPolarHBondContact O-CG 3.47Å; P87-R91 PolarHBondContact O-N 2.95Å; P87-R91 PolarHBondContact O-NE 3.49Å |
| 88 | Q | 86.1 | Confident | 73.2 | Confident | 150 Ų | 150 | 94 Ų | 94 | 70% | 0.701 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -72.9 | -40.2 | 175.2 | -69 | 180 | -10.7 | 0 | 0 | 111.3 | S86 R91 A92 | S86-Q88 PolarHBondContact O-N 3.02Å; Q88-R91 PolarHBondContact O-N 3.01Å; Q88-A92 PolarHBondContact O-N 3.11Å |
| 89 | L | 83.5 | Confident | 72.4 | Confident | 80 Ų | 80 | 94.3 Ų | 94.3 | 42% | 0.419 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -71.5 | -39.3 | -179.5 | -166.6 | 142.8 | 0 | 0 | 0 | 110.8 | P66 W69 S86 R91 A92 W93 | P66-L89 HydrophobicContact CB-CD2 3.03Å; P66-L89 HydrophobicContact CG-CD2 3.36Å; W69-L89 HydrophobicContact CZ3-CD2 4.27Å; S86-L89 PolarHBondContact O-N 3.44Å; S86-L89 VanDerWaalsContact O-N 3.11Å; L89-R91 VanDerWaalsContact C-N 3.33Å; L89-R91 PolarHBondContact O-N 3.37Å; L89-A92 PolarHBondContact O-N 3.02Å; L89-W93 WeakPolarHBondContact O-CB 3.46Å; L89-W93 PolarHBondContact O-N 2.8Å |
| 90 | L | 82.1 | Confident | 71.7 | Confident | 47 Ų | 47 | 89 Ų | 89 | 25% | 0.246 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -58.9 | -41.8 | 169.2 | -73 | 171.1 | 0 | 0 | 0 | 112.6 | P66 A67 P85 S86 R94 | P66-L90 HydrophobicContact CG-CD2 4.02Å; A67-L90 HydrophobicContact CB-CD2 4.11Å; P85-L90 HydrophobicContact CB-CD1 4.13Å; P85-L90 HydrophobicContact CB-CG 4.36Å; P85-L90 HydrophobicContact CG-CD1 3.9Å; S86-L90 PolarHBondContact O-N 2.75Å; L90-R94 WeakPolarHBondContact O-CG 3.37Å; L90-R94 PolarHBondContact O-N 3.01Å |
| 91 | R | 83.3 | Confident | 71.1 | Confident | 138 Ų | 138 | 87.6 Ų | 87.6 | 52% | 0.521 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.5 | -39.6 | 175.3 | -75.7 | 178.1 | -132.9 | 178 | 0.1 | 112 | P87 Q88 L89 R95 | P87-R91 VanDerWaalsContact O-CG 3.23Å; P87-R91 WeakPolarHBondContact O-CG 3.47Å; P87-R91 PolarHBondContact O-N 2.95Å; P87-R91 PolarHBondContact O-NE 3.49Å; Q88-R91 PolarHBondContact O-N 3.01Å; L89-R91 VanDerWaalsContact C-N 3.33Å; L89-R91 PolarHBondContact O-N 3.37Å; R91-R95 WeakPolarHBondContact O-CG 3.38Å; R91-R95 PolarHBondContact O-N 2.9Å |
| 92 | A | 84.6 | Confident | 70.5 | Confident | 32 Ų | 32 | 88.6 Ų | 88.6 | 26% | 0.264 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.9 | -45.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q88 L89 R94 R95 L96 | Q88-A92 PolarHBondContact O-N 3.11Å; L89-A92 PolarHBondContact O-N 3.02Å; A92-R94 VanDerWaalsContact C-N 3.35Å; A92-R94 PolarHBondContact O-N 3.42Å; A92-R95 WeakPolarHBondContact O-CB 3.4Å; A92-R95 PolarHBondContact O-N 3.21Å; A92-L96 WeakPolarHBondContact O-CG 3.49Å; A92-L96 PolarHBondContact O-N 2.92Å |
| 93 | W | 79.6 | Confident | 69.6 | Low | 51 Ų | 51 | 94.9 Ų | 94.9 | 19% | 0.193 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -57.6 | -44.2 | 175.9 | -174.6 | -114.2 | 0 | 0 | 0 | 112.2 | H62 L64 P66 L89 R95 L96 K97 | H62-W93 HydrophobicContact CB-CZ2 4.38Å; H62-W93 AromaticContact CE1-CH2 3.91Å; H62-W93 AromaticContact ND1-CH2 3.72Å; H62-W93 AromaticContact ND1-CZ2 3.54Å; L64-W93 HydrophobicContact CB-CH2 3.62Å; L64-W93 HydrophobicContact CB-CZ2 4.25Å; L64-W93 HydrophobicContact CB-CZ3 4.19Å; L64-W93 WeakPolarHBondContact O-CH2 3.36Å; L64-W93 WeakPolarHBondContact O-CZ2 3.49Å; P66-W93 HydrophobicContact CG-CB 3.95Å; P66-W93 HydrophobicContact CG-CD2 4.42Å; P66-W93 HydrophobicContact CG-CG 3.9Å; L89-W93 WeakPolarHBondContact O-CB 3.46Å; L89-W93 PolarHBondContact O-N 2.8Å; W93-R95 VanDerWaalsContact C-N 3.26Å; W93-R95 PolarHBondContact O-N 2.77Å; W93-L96 PolarHBondContact O-N 3.41Å; W93-L96 VanDerWaalsContact O-N 3.15Å; W93-K97 PolarHBondContact O-N 3.29Å |
| 94 | R | 79.5 | Confident | 68.3 | Low | 168 Ų | 168 | 94.1 Ų | 94.1 | 63% | 0.634 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.1 | -29.4 | 173.9 | -78.3 | -168.2 | -66.3 | -156.1 | -1.1 | 114.2 | L90 A92 | L90-R94 WeakPolarHBondContact O-CG 3.37Å; L90-R94 PolarHBondContact O-N 3.01Å; A92-R94 VanDerWaalsContact C-N 3.35Å; A92-R94 PolarHBondContact O-N 3.42Å |
| 95 | R | 81.9 | Confident | 67.5 | Low | 192 Ų | 192 | 91.8 Ų | 91.8 | 73% | 0.725 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -80.2 | -27.2 | 176.2 | -70.4 | -169.8 | -63.6 | -110.1 | 2.9 | 113.1 | R91 A92 W93 | R91-R95 WeakPolarHBondContact O-CG 3.38Å; R91-R95 PolarHBondContact O-N 2.9Å; A92-R95 WeakPolarHBondContact O-CB 3.4Å; A92-R95 PolarHBondContact O-N 3.21Å; W93-R95 VanDerWaalsContact C-N 3.26Å; W93-R95 PolarHBondContact O-N 2.77Å |
| 96 | L | 71.8 | Confident | 66.1 | Low | 132 Ų | 132 | 98.8 Ų | 98.8 | 69% | 0.691 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -89.6 | -24.6 | -178.6 | -66.9 | 172.9 | 0 | 0 | 0 | 112.9 | A92 W93 P98 | A92-L96 WeakPolarHBondContact O-CG 3.49Å; A92-L96 PolarHBondContact O-N 2.92Å; W93-L96 PolarHBondContact O-N 3.41Å; W93-L96 VanDerWaalsContact O-N 3.15Å; L96-P98 VanDerWaalsContact O-CD 3.28Å; L96-P98 WeakPolarHBondContact O-CD 3.42Å |
| 97 | K | 64.1 | Low | 64.8 | Low | 28 Ų | 28 | 98.8 Ų | 98.8 | 12% | 0.122 | 53% | 0.527 | C | S | . | . | S | Bend | trans | -58.7 | 120.6 | 177.4 | -99.2 | -161.8 | 167.7 | -170.2 | 0 | 109.6 | W93 S99 S101 Q102 | W93-K97 PolarHBondContact O-N 3.29Å; K97-S99 PolarHBondContact O-N 3.19Å; K97-S101 WeakPolarHBondContact CB-OG 3.35Å; K97-S101 WeakPolarHBondContact CD-OG 3.42Å; K97-S101 WeakPolarHBondContact CG-OG 3.45Å; K97-S101 PolarHBondContact NZ-O 3.33Å; K97-Q102 HydrophobicContact CD-CG 3.49Å; K97-Q102 VanDerWaalsContact CD-CG 3.49Å |
| 98 | P | 53.5 | Low | 64 | Low | 97 Ų | 97 | 96.9 Ų | 96.9 | 63% | 0.63 | 51% | 0.513 | S | S | * | . | trans | -57.2 | 134.9 | 163.9 | -15.3 | 28.2 | 0 | 0 | 0 | 107.1 | L96 G100 S101 | L96-P98 VanDerWaalsContact O-CD 3.28Å; L96-P98 WeakPolarHBondContact O-CD 3.42Å; P98-G100 PolarHBondContact O-N 3.37Å; P98-S101 PolarHBondContact O-N 3.35Å; P98-S101 PolarHBondContact O-OG 3.35Å | ||
| 99 | S | 45.9 | Very low | 63.5 | Low | 131 Ų | 131 | 97 Ų | 97 | 92% | 0.916 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.8 | -7.1 | -179.2 | -61.8 | 0 | 0 | 0 | 0 | 114.8 | K97 | K97-S99 PolarHBondContact O-N 3.19Š|
| 100 | G | 47.2 | Very low | 63.6 | Low | 65 Ų | 65 | 93.8 Ų | 93.8 | 67% | 0.67 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -0.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | P98 | P98-G100 PolarHBondContact O-N 3.37Š|
| 101 | S | 48 | Very low | 63.9 | Low | 43 Ų | 43 | 102.5 Ų | 102.5 | 30% | 0.301 | 52% | 0.523 | S | S | . | . | S | Bend | trans | -107.4 | 8.8 | -172.1 | 63.1 | 0 | 0 | 0 | 0 | 115.3 | K97 P98 | K97-S101 WeakPolarHBondContact CB-OG 3.35Å; K97-S101 WeakPolarHBondContact CD-OG 3.42Å; K97-S101 WeakPolarHBondContact CG-OG 3.45Å; K97-S101 PolarHBondContact NZ-O 3.33Å; P98-S101 PolarHBondContact O-N 3.35Å; P98-S101 PolarHBondContact O-OG 3.35Å |
| 102 | Q | 45.8 | Very low | 64.3 | Low | 116 Ų | 116 | 98.2 Ų | 98.2 | 54% | 0.542 | 51% | 0.514 | S | S | . | . | trans | -131.4 | 54.2 | 171.4 | -64.4 | -154.5 | -20.8 | 0 | 0 | 111.1 | K97 P104 | K97-Q102 HydrophobicContact CD-CG 3.49Å; K97-Q102 VanDerWaalsContact CD-CG 3.49Å; Q102-P104 VanDerWaalsContact C-CD 3.48Å; Q102-P104 WeakPolarHBondContact O-CD 3.44Å | ||
| 103 | Q | 45.4 | Very low | 64.8 | Low | 155 Ų | 155 | 96.8 Ų | 96.8 | 72% | 0.724 | 50% | 0.502 | S | S | * | . | trans | -91.8 | 102.7 | 150.3 | -66.3 | -123.6 | -43.7 | 0 | 0 | 104.9 | L105 | Q103-L105 PolarHBondContact O-N 3.34Å; Q103-L105 VanDerWaalsContact O-N 3.16Å | ||
| 104 | P | 45.1 | Very low | 65.6 | Low | 95 Ų | 95 | 96.8 Ų | 96.8 | 62% | 0.617 | 51% | 0.506 | S | S | * | . | trans | -40.9 | 127.6 | 157.6 | -26.6 | 33.7 | 0 | 0 | 0 | 107.3 | Q102 E106 | Q102-P104 VanDerWaalsContact C-CD 3.48Å; Q102-P104 WeakPolarHBondContact O-CD 3.44Å; P104-E106 PolarHBondContact O-N 3.12Å | ||
| 105 | L | 50.1 | Low | 66.3 | Low | 32 Ų | 32 | 93 Ų | 93 | 17% | 0.168 | 50% | 0.496 | C | S | . | . | S | Bend | trans | -66.1 | 25.6 | -179.5 | -157.7 | 80.6 | 0 | 0 | 0 | 111.8 | N55 Y58 Q103 G107 L108 | N55-L105 HydrophobicContact CB-CD2 3.71Å; N55-L105 HydrophobicContact CB-CG 3.93Å; N55-L105 WeakPolarHBondContact O-CD2 3.24Å; N55-L105 WeakPolarHBondContact OD1-CD1 3.37Å; N55-L105 WeakPolarHBondContact OD1-CG 3.46Å; Y58-L105 HydrophobicContact CD1-CD1 4.43Å; Y58-L105 WeakPolarHBondContact O-CD2 3.09Å; Q103-L105 PolarHBondContact O-N 3.34Å; Q103-L105 VanDerWaalsContact O-N 3.16Å; L105-G107 VanDerWaalsContact C-N 3.33Å; L105-G107 PolarHBondContact O-N 3.25Å; L105-G107 VanDerWaalsContact O-N 3.12Å; L105-L108 HydrophobicContact CD1-CD1 3.76Å |
| 106 | E | 46.9 | Very low | 66.8 | Low | 185 Ų | 185 | 83.9 Ų | 83.9 | 86% | 0.864 | 46% | 0.461 | S | S | * | . | S | Bend | trans | -82.8 | 86.5 | 171.1 | -64.8 | -160.6 | 170.7 | 0 | 0 | 107.3 | P104 | P104-E106 PolarHBondContact O-N 3.12Š|
| 107 | G | 54.8 | Low | 67.9 | Low | 60 Ų | 60 | 77.6 Ų | 77.6 | 62% | 0.619 | 43% | 0.428 | S | S | * | . | trans | 89.6 | 47.8 | 165.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | L105 K109 | L105-G107 VanDerWaalsContact C-N 3.33Å; L105-G107 PolarHBondContact O-N 3.25Å; L105-G107 VanDerWaalsContact O-N 3.12Å; G107-K109 PolarHBondContact O-N 3.27Å | ||
| 108 | L | 65.8 | Low | 69.4 | Low | 38 Ų | 38 | 79.4 Ų | 79.4 | 20% | 0.199 | 44% | 0.439 | C | S | . | . | trans | -62.2 | 81.7 | 154.5 | -92 | 122.9 | 0 | 0 | 0 | 108.7 | L105 F110 E119 | L105-L108 HydrophobicContact CD1-CD1 3.76Å; L108-F110 HydrophobicContact CB-CE2 4.05Å; L108-F110 HydrophobicContact CB-CZ 3.96Å; L108-F110 HydrophobicContact CD2-CE1 3.74Å; L108-F110 HydrophobicContact CD2-CZ 3.67Å; L108-F110 HydrophobicContact CG-CZ 4.43Å; L108-F110 WeakPolarHBondContact O-CD2 3.21Å; L108-F110 PolarHBondContact O-N 3.04Å; L108-E119 HydrophobicContact CD2-CG 4.47Å | ||
| 109 | K | 74.9 | Confident | 71.2 | Confident | 151 Ų | 151 | 76.5 Ų | 76.5 | 66% | 0.657 | 42% | 0.417 | S | S | * | . | trans | -87.4 | 97.3 | 172.5 | -171.8 | 170.2 | -176.9 | 166.6 | 0 | 107 | G107 R111 | G107-K109 PolarHBondContact O-N 3.27Å; K109-R111 PolarHBondContact O-N 3.4Å | ||
| 110 | F | 86.4 | Confident | 73.3 | Confident | 14 Ų | 14 | 70.5 Ų | 70.5 | 6% | 0.061 | 37% | 0.374 | C | S | . | . | trans | -67.1 | 131.4 | 173.7 | -56.2 | -78.7 | 0 | 0 | 0 | 109.2 | I47 L108 S112 E115 L116 E119 | I47-F110 HydrophobicContact CG2-CB 3.96Å; L108-F110 HydrophobicContact CB-CE2 4.05Å; L108-F110 HydrophobicContact CB-CZ 3.96Å; L108-F110 HydrophobicContact CD2-CE1 3.74Å; L108-F110 HydrophobicContact CD2-CZ 3.67Å; L108-F110 HydrophobicContact CG-CZ 4.43Å; L108-F110 WeakPolarHBondContact O-CD2 3.21Å; L108-F110 PolarHBondContact O-N 3.04Å; F110-S112 VanDerWaalsContact C-N 3.33Å; F110-E115 HydrophobicContact CD1-CB 4.5Å; F110-E115 HydrophobicContact CD1-CG 4.13Å; F110-L116 HydrophobicContact CB-CB 3.99Å; F110-L116 HydrophobicContact CD1-CB 4.15Å; F110-L116 HydrophobicContact CD1-CD1 4.46Å; F110-L116 HydrophobicContact CD2-CB 4.2Å; F110-L116 HydrophobicContact CD2-CD1 3.41Å; F110-L116 VanDerWaalsContact CD2-CD1 3.41Å; F110-L116 HydrophobicContact CD2-CG 4.38Å; F110-L116 HydrophobicContact CE1-CD1 4.49Å; F110-L116 HydrophobicContact CE2-CD1 3.43Å; F110-L116 VanDerWaalsContact CE2-CD1 3.43Å; F110-L116 HydrophobicContact CG-CB 3.83Å; F110-L116 HydrophobicContact CG-CD1 3.94Å; F110-L116 HydrophobicContact CZ-CD1 4Å; F110-E119 HydrophobicContact CE1-CB 3.6Å; F110-E119 HydrophobicContact CE1-CG 3.72Å; F110-E119 HydrophobicContact CZ-CB 4.09Å; F110-E119 HydrophobicContact CZ-CG 3.87Å | ||
| 111 | R | 86.9 | Confident | 75.4 | Confident | 230 Ų | 230 | 70 Ų | 70 | 87% | 0.868 | 36% | 0.355 | S | S | * | . | S | Bend | trans | -81.4 | -20.4 | 179.7 | -65.4 | -178.3 | 178.6 | -177.8 | 0.5 | 112 | K109 E115 | K109-R111 PolarHBondContact O-N 3.4Å; R111-E115 PolarHBondContact N-OE2 3.19Å |
| 112 | S | 93.1 | Very high | 77.4 | Confident | 48 Ų | 48 | 75.5 Ų | 75.5 | 34% | 0.336 | 37% | 0.373 | S | S | . | . | S | Bend | trans | -146 | 157.8 | 179.6 | 73.8 | 0 | 0 | 0 | 0 | 111.7 | F110 L114 E115 L116 | F110-S112 VanDerWaalsContact C-N 3.33Å; S112-L114 PolarHBondContact O-N 3.43Å; S112-L114 PolarHBondContact OG-N 3.08Å; S112-E115 PolarHBondContact O-N 3.22Å; S112-E115 PolarHBondContact OG-N 2.86Å; S112-E115 VanDerWaalsContact OG-N 3.15Å; S112-L116 PolarHBondContact O-N 3.14Å |
| 113 | G | 94.4 | Very high | 79.2 | Confident | 1 Ų | 1 | 72.6 Ų | 72.6 | 1% | 0.01 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62 | -30.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L116 L117 | G113-L116 PolarHBondContact O-N 2.96Å; G113-L117 VanDerWaalsContact O-CG 3.24Å; G113-L117 WeakPolarHBondContact O-CG 3.47Å; G113-L117 PolarHBondContact O-N 3.08Å |
| 114 | L | 95.6 | Very high | 81.2 | Confident | 52 Ų | 52 | 68.1 Ų | 68.1 | 27% | 0.272 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -63.2 | -48.4 | 175.6 | 176 | 62.7 | 0 | 0 | 0 | 111.5 | F35 E36 S112 L116 L117 L118 | F35-L114 HydrophobicContact CB-CD1 3.7Å; E36-L114 HydrophobicContact CG-CD1 3.96Å; E36-L114 HydrophobicContact CG-CD2 4.06Å; S112-L114 PolarHBondContact O-N 3.43Å; S112-L114 PolarHBondContact OG-N 3.08Å; L114-L116 VanDerWaalsContact C-N 3.28Å; L114-L116 PolarHBondContact O-N 2.88Å; L114-L117 PolarHBondContact O-N 2.8Å; L114-L118 HydrophobicContact CD1-CD1 4.17Å; L114-L118 HydrophobicContact CD1-CG 4.25Å; L114-L118 HydrophobicContact CG-CD1 4.05Å; L114-L118 WeakPolarHBondContact O-CG 3.34Å; L114-L118 PolarHBondContact O-N 3.3Å |
| 115 | E | 94.3 | Very high | 83.3 | Confident | 89 Ų | 89 | 67.6 Ų | 67.6 | 42% | 0.416 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60 | -41.3 | 179.5 | -169.2 | -176.5 | -173.2 | 0 | 0 | 111.5 | F110 R111 S112 L118 E119 | F110-E115 HydrophobicContact CD1-CB 4.5Å; F110-E115 HydrophobicContact CD1-CG 4.13Å; R111-E115 PolarHBondContact N-OE2 3.19Å; S112-E115 PolarHBondContact O-N 3.22Å; S112-E115 PolarHBondContact OG-N 2.86Å; S112-E115 VanDerWaalsContact OG-N 3.15Å; E115-L118 PolarHBondContact O-N 3.22Å; E115-E119 WeakPolarHBondContact O-CB 3.48Å; E115-E119 PolarHBondContact O-N 3.37Å |
| 116 | L | 93.7 | Very high | 85.3 | Confident | 0 Ų | 0 | 66.2 Ų | 66.2 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.1 | -46.8 | 174.3 | 172.5 | 74.1 | 0 | 0 | 0 | 112.3 | I47 L50 L54 F110 S112 G113 L114 E119 L120 | I47-L116 HydrophobicContact CG2-CD2 4.47Å; L50-L116 HydrophobicContact CB-CD1 4.27Å; L50-L116 HydrophobicContact CB-CD2 3.56Å; L50-L116 HydrophobicContact CB-CG 4.48Å; L50-L116 HydrophobicContact CD1-CD2 3.55Å; L50-L116 HydrophobicContact CG-CD2 4.18Å; L54-L116 HydrophobicContact CD1-CD1 3.48Å; L54-L116 VanDerWaalsContact CD1-CD1 3.48Å; F110-L116 HydrophobicContact CB-CB 3.99Å; F110-L116 HydrophobicContact CD1-CB 4.15Å; F110-L116 HydrophobicContact CD1-CD1 4.46Å; F110-L116 HydrophobicContact CD2-CB 4.2Å; F110-L116 HydrophobicContact CD2-CD1 3.41Å; F110-L116 VanDerWaalsContact CD2-CD1 3.41Å; F110-L116 HydrophobicContact CD2-CG 4.38Å; F110-L116 HydrophobicContact CE1-CD1 4.49Å; F110-L116 HydrophobicContact CE2-CD1 3.43Å; F110-L116 VanDerWaalsContact CE2-CD1 3.43Å; F110-L116 HydrophobicContact CG-CB 3.83Å; F110-L116 HydrophobicContact CG-CD1 3.94Å; F110-L116 HydrophobicContact CZ-CD1 4Å; S112-L116 PolarHBondContact O-N 3.14Å; G113-L116 PolarHBondContact O-N 2.96Å; L114-L116 VanDerWaalsContact C-N 3.28Å; L114-L116 PolarHBondContact O-N 2.88Å; L116-E119 PolarHBondContact O-N 3.14Å; L116-L120 WeakPolarHBondContact O-CG 3.4Å; L116-L120 PolarHBondContact O-N 3.35Å |
| 117 | L | 95.1 | Very high | 87.5 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -66.9 | -37 | -179.8 | -68.6 | 174.7 | 0 | 0 | 0 | 112.2 | F35 V38 G113 L114 L120 E121 L126 L134 | F35-L117 HydrophobicContact CB-CB 4.12Å; F35-L117 HydrophobicContact CB-CD1 4Å; F35-L117 HydrophobicContact CD1-CB 3.95Å; F35-L117 HydrophobicContact CD1-CD1 3.96Å; F35-L117 HydrophobicContact CD1-CG 4.42Å; F35-L117 HydrophobicContact CD2-CB 3.93Å; F35-L117 HydrophobicContact CE1-CB 4.29Å; F35-L117 HydrophobicContact CE2-CB 4.27Å; F35-L117 HydrophobicContact CG-CB 3.76Å; F35-L117 HydrophobicContact CG-CD1 4.14Å; F35-L117 HydrophobicContact CZ-CB 4.45Å; V38-L117 HydrophobicContact CB-CD1 4.24Å; V38-L117 HydrophobicContact CG1-CD1 4.18Å; G113-L117 VanDerWaalsContact O-CG 3.24Å; G113-L117 WeakPolarHBondContact O-CG 3.47Å; G113-L117 PolarHBondContact O-N 3.08Å; L114-L117 PolarHBondContact O-N 2.8Å; L117-L120 HydrophobicContact CD2-CD1 4.06Å; L117-L120 WeakPolarHBondContact O-CB 3.33Å; L117-L120 PolarHBondContact O-N 2.94Å; L117-E121 PolarHBondContact O-N 3.21Å; L117-E121 VanDerWaalsContact O-N 3.08Å; L117-L126 HydrophobicContact CD2-CD1 4.15Å; L117-L134 HydrophobicContact CD2-CD1 3.58Å; L117-L134 HydrophobicContact CD2-CD2 4.33Å |
| 118 | L | 93.8 | Very high | 89.1 | Confident | 65 Ų | 65 | 61.9 Ų | 61.9 | 34% | 0.34 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -65.7 | -39.1 | 173.5 | -70.6 | 170.9 | 0 | 0 | 0 | 111.9 | F35 L114 E115 L120 E121 K122 | F35-L118 HydrophobicContact CD2-CD2 3.99Å; F35-L118 HydrophobicContact CD2-CG 4.41Å; F35-L118 HydrophobicContact CE2-CD2 4.43Å; L114-L118 HydrophobicContact CD1-CD1 4.17Å; L114-L118 HydrophobicContact CD1-CG 4.25Å; L114-L118 HydrophobicContact CG-CD1 4.05Å; L114-L118 WeakPolarHBondContact O-CG 3.34Å; L114-L118 PolarHBondContact O-N 3.3Å; E115-L118 PolarHBondContact O-N 3.22Å; L118-L120 VanDerWaalsContact C-N 3.31Å; L118-L120 PolarHBondContact O-N 3.18Å; L118-E121 PolarHBondContact O-N 2.93Å; L118-K122 WeakPolarHBondContact O-CB 3.37Å; L118-K122 PolarHBondContact O-N 3.06Å |
| 119 | E | 91.5 | Very high | 90.2 | Very high | 37 Ų | 37 | 63.9 Ų | 63.9 | 17% | 0.173 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.9 | -34.8 | 175.9 | -175 | 63.4 | -159.6 | 0 | 0 | 111.4 | L108 F110 E115 L116 K122 R123 | L108-E119 HydrophobicContact CD2-CG 4.47Å; F110-E119 HydrophobicContact CE1-CB 3.6Å; F110-E119 HydrophobicContact CE1-CG 3.72Å; F110-E119 HydrophobicContact CZ-CB 4.09Å; F110-E119 HydrophobicContact CZ-CG 3.87Å; E115-E119 WeakPolarHBondContact O-CB 3.48Å; E115-E119 PolarHBondContact O-N 3.37Å; L116-E119 PolarHBondContact O-N 3.14Å; E119-K122 PolarHBondContact O-N 3.44Å; E119-K122 IonicContact OE2-NZ 3.09Å; E119-K122 PolarHBondContact OE2-NZ 3.44Å; E119-R123 WeakPolarHBondContact O-CB 3.38Å; E119-R123 WeakPolarHBondContact O-CG 3.28Å; E119-R123 PolarHBondContact O-N 3.07Å; E119-R123 IonicContact OE1-CZ 3.42Å; E119-R123 IonicContact OE1-NE 3.96Å; E119-R123 PolarHBondContact OE1-NE 3.02Å; E119-R123 IonicContact OE1-NH2 3.39Å; E119-R123 PolarHBondContact OE1-NH2 3.19Å |
| 120 | L | 90.8 | Very high | 90.9 | Very high | 4 Ų | 4 | 60 Ų | 60 | 2% | 0.021 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 171.8 | -77.3 | 170.6 | 0 | 0 | 0 | 112.8 | L54 L116 L117 L118 R123 G124 Y125 L126 L137 | L54-L120 HydrophobicContact CD1-CD1 4.5Å; L54-L120 HydrophobicContact CD1-CD2 3.6Å; L54-L120 HydrophobicContact CD1-CG 3.89Å; L54-L120 HydrophobicContact CD2-CD2 3.2Å; L54-L120 HydrophobicContact CD2-CG 4.36Å; L54-L120 HydrophobicContact CG-CD2 3.89Å; L116-L120 WeakPolarHBondContact O-CG 3.4Å; L116-L120 PolarHBondContact O-N 3.35Å; L117-L120 HydrophobicContact CD2-CD1 4.06Å; L117-L120 WeakPolarHBondContact O-CB 3.33Å; L117-L120 PolarHBondContact O-N 2.94Å; L118-L120 VanDerWaalsContact C-N 3.31Å; L118-L120 PolarHBondContact O-N 3.18Å; L120-R123 PolarHBondContact O-N 3.24Å; L120-G124 PolarHBondContact O-N 2.9Å; L120-Y125 HydrophobicContact CD2-CD2 3.89Å; L120-Y125 HydrophobicContact CD2-CG 4.27Å; L120-Y125 PolarHBondContact O-N 2.9Å; L120-L126 HydrophobicContact CB-CD1 3.69Å; L120-L126 HydrophobicContact CB-CG 3.93Å; L120-L126 HydrophobicContact CD1-CD1 3.91Å; L120-L126 HydrophobicContact CG-CD1 4.43Å; L120-L137 HydrophobicContact CD1-CD1 4.45Å |
| 121 | E | 92.2 | Very high | 91.3 | Very high | 56 Ų | 56 | 60.3 Ų | 60.3 | 26% | 0.262 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.8 | -46.7 | 174.9 | -179.4 | -169.7 | -177.7 | 0 | 0 | 111.5 | L31 H32 F35 L117 L118 R123 G124 | L31-E121 HydrophobicContact CD2-CG 4.1Å; L31-E121 WeakPolarHBondContact CD2-OE1 3.42Å; H32-E121 IonicContact CD2-OE2 3.74Å; H32-E121 IonicContact NE2-OE1 3.6Å; H32-E121 IonicContact NE2-OE2 3.31Å; H32-E121 PolarHBondContact NE2-OE2 2.81Å; F35-E121 HydrophobicContact CE2-CB 3.93Å; F35-E121 WeakPolarHBondContact CE2-OE2 3.46Å; F35-E121 HydrophobicContact CZ-CB 4.25Å; L117-E121 PolarHBondContact O-N 3.21Å; L117-E121 VanDerWaalsContact O-N 3.08Å; L118-E121 PolarHBondContact O-N 2.93Å; E121-R123 PolarHBondContact O-N 3.15Å; E121-G124 WeakPolarHBondContact O-CA 3.47Å; E121-G124 PolarHBondContact O-N 3.28Å |
| 122 | K | 89.6 | Confident | 91.6 | Very high | 157 Ų | 157 | 56.3 Ų | 56.3 | 68% | 0.683 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -59.4 | -31.8 | 177.5 | -178.6 | -179.6 | 163.1 | -154.5 | 0 | 112.5 | L118 E119 G124 | L118-K122 WeakPolarHBondContact O-CB 3.37Å; L118-K122 PolarHBondContact O-N 3.06Å; E119-K122 PolarHBondContact O-N 3.44Å; E119-K122 IonicContact OE2-NZ 3.09Å; E119-K122 PolarHBondContact OE2-NZ 3.44Å; K122-G124 VanDerWaalsContact C-N 3.29Å |
| 123 | R | 83.3 | Confident | 91.6 | Very high | 56 Ų | 56 | 56.1 Ų | 56.1 | 21% | 0.211 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.6 | -7.8 | 173.4 | -69.6 | 176.4 | -171.4 | -159.6 | 5.3 | 113.5 | E119 L120 E121 Y125 | E119-R123 WeakPolarHBondContact O-CB 3.38Å; E119-R123 WeakPolarHBondContact O-CG 3.28Å; E119-R123 PolarHBondContact O-N 3.07Å; E119-R123 IonicContact OE1-CZ 3.42Å; E119-R123 IonicContact OE1-NE 3.96Å; E119-R123 PolarHBondContact OE1-NE 3.02Å; E119-R123 IonicContact OE1-NH2 3.39Å; E119-R123 PolarHBondContact OE1-NH2 3.19Å; L120-R123 PolarHBondContact O-N 3.24Å; E121-R123 PolarHBondContact O-N 3.15Å; R123-Y125 HydrophobicContact CB-CD2 3.61Å; R123-Y125 HydrophobicContact CB-CE2 3.7Å; R123-Y125 HydrophobicContact CG-CE2 4.49Å |
| 124 | G | 87.7 | Confident | 91.6 | Very high | 60 Ų | 60 | 56.2 Ų | 56.2 | 62% | 0.619 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.1 | 11.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | L120 E121 K122 | L120-G124 PolarHBondContact O-N 2.9Å; E121-G124 WeakPolarHBondContact O-CA 3.47Å; E121-G124 PolarHBondContact O-N 3.28Å; K122-G124 VanDerWaalsContact C-N 3.29Å |
| 125 | Y | 88.5 | Confident | 91.6 | Very high | 84 Ų | 84 | 56 Ų | 56 | 33% | 0.329 | 31% | 0.311 | S | S | . | . | S | Bend | trans | -74.1 | -30.9 | 174.8 | -67.2 | -70 | 0 | 0 | 0 | 112.1 | L54 L120 R123 P133 | L54-Y125 HydrophobicContact CD2-CD2 4.29Å; L54-Y125 HydrophobicContact CD2-CE2 4.12Å; L120-Y125 HydrophobicContact CD2-CD2 3.89Å; L120-Y125 HydrophobicContact CD2-CG 4.27Å; L120-Y125 PolarHBondContact O-N 2.9Å; R123-Y125 HydrophobicContact CB-CD2 3.61Å; R123-Y125 HydrophobicContact CB-CE2 3.7Å; R123-Y125 HydrophobicContact CG-CE2 4.49Å; Y125-P133 WeakPolarHBondContact O-CG 3.45Å |
| 126 | L | 92.6 | Very high | 91.6 | Very high | 3 Ų | 3 | 56.7 Ų | 56.7 | 2% | 0.016 | 31% | 0.314 | C | S | . | . | trans | -120 | 143.2 | -179.8 | -57.9 | -179.1 | 0 | 0 | 0 | 110.3 | F35 L117 L120 P133 L134 | F35-L126 HydrophobicContact CE1-CD1 3.92Å; F35-L126 HydrophobicContact CZ-CB 4.1Å; F35-L126 HydrophobicContact CZ-CD1 3.84Å; L117-L126 HydrophobicContact CD2-CD1 4.15Å; L120-L126 HydrophobicContact CB-CD1 3.69Å; L120-L126 HydrophobicContact CB-CG 3.93Å; L120-L126 HydrophobicContact CD1-CD1 3.91Å; L120-L126 HydrophobicContact CG-CD1 4.43Å; L126-P133 HydrophobicContact CD2-CB 4.09Å; L126-L134 HydrophobicContact CD1-CB 4.29Å; L126-L134 HydrophobicContact CD1-CD2 4.41Å; L126-L134 HydrophobicContact CD2-CB 3.63Å | ||
| 127 | S | 92.3 | Very high | 91.6 | Very high | 55 Ų | 55 | 58.8 Ų | 58.8 | 39% | 0.385 | 33% | 0.325 | S | S | . | . | B | Isolated β-bridge | trans | -152.1 | 166.3 | 170.4 | 64.2 | 0 | 0 | 0 | 0 | 110.2 | G129 N130 | S127-G129 PolarHBondContact O-N 3.01Å; S127-G129 VanDerWaalsContact O-N 3.12Å; S127-N130 PolarHBondContact N-O 3.05Å; S127-N130 CarbonylContact O-C 3.33Å; S127-N130 PolarHBondContact O-N 3.43Å; S127-N130 PolarHBondContact OG-N 3.05Å |
| 128 | D | 89.3 | Confident | 91.6 | Very high | 99 Ų | 99 | 58.9 Ų | 58.9 | 53% | 0.529 | 33% | 0.325 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.4 | -32.3 | 174 | -85.6 | -47.6 | 0 | 0 | 0 | 113.3 | L31 H152 | L31-D128 VanDerWaalsContact CB-OD1 3.27Å; L31-D128 WeakPolarHBondContact CB-OD1 3.46Å; D128-H152 PolarHBondContact O-NE2 2.9Å; D128-H152 IonicContact OD1-CE1 2.95Å; D128-H152 PolarHBondContact OD1-CE1 3.13Å; D128-H152 IonicContact OD1-ND1 3.94Å |
| 129 | G | 88.2 | Confident | 91.6 | Very high | 80 Ų | 80 | 62.2 Ų | 62.2 | 83% | 0.825 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89 | -13.9 | 179 | 0 | 0 | 0 | 0 | 0 | 114.4 | S127 | S127-G129 PolarHBondContact O-N 3.01Å; S127-G129 VanDerWaalsContact O-N 3.12Å |
| 130 | N | 90.8 | Very high | 91.7 | Very high | 70 Ų | 70 | 65 Ų | 65 | 37% | 0.374 | 35% | 0.353 | S | S | . | . | B | Isolated β-bridge | trans | -141.3 | 93.6 | -172.3 | -172.7 | 15.5 | 0 | 0 | 0 | 112 | S127 E132 P133 | S127-N130 PolarHBondContact N-O 3.05Å; S127-N130 CarbonylContact O-C 3.33Å; S127-N130 PolarHBondContact O-N 3.43Å; S127-N130 PolarHBondContact OG-N 3.05Å; N130-E132 PolarHBondContact OD1-N 3.36Å; N130-P133 VanDerWaalsContact OD1-CD 3.32Å; N130-P133 WeakPolarHBondContact OD1-CD 3.21Å |
| 131 | L | 93.7 | Very high | 91.8 | Very high | 20 Ų | 20 | 66 Ų | 66 | 11% | 0.105 | 36% | 0.358 | C | S | . | . | trans | -106.6 | 4.2 | 174.8 | -62.1 | 180 | 0 | 0 | 0 | 113.1 | L31 M34 L134 L135 V150 H152 | L31-L131 HydrophobicContact CD1-CD2 3.69Å; M34-L131 HydrophobicContact CE-CD1 3.99Å; M34-L131 HydrophobicContact CE-CD2 3.72Å; L131-L134 PolarHBondContact O-N 3.19Å; L131-L135 WeakPolarHBondContact O-CG 3.49Å; L131-L135 PolarHBondContact O-N 3.2Å; L131-V150 HydrophobicContact CB-CG1 3.9Å; L131-V150 HydrophobicContact CD1-CG1 3.88Å; L131-V150 HydrophobicContact CG-CG1 4.42Å; L131-H152 WeakPolarHBondContact CD1-NE2 3.28Å | ||
| 132 | E | 93.8 | Very high | 91.9 | Very high | 146 Ų | 146 | 68.4 Ų | 68.4 | 68% | 0.682 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -58.3 | -41.2 | -180 | -175.3 | 171.7 | -162.7 | 0 | 0 | 112.7 | N130 L134 L135 Q136 | N130-E132 PolarHBondContact OD1-N 3.36Å; E132-L134 VanDerWaalsContact C-N 3.34Å; E132-L134 PolarHBondContact O-N 3.12Å; E132-L135 PolarHBondContact O-N 3.26Å; E132-Q136 PolarHBondContact O-N 2.97Å |
| 133 | P | 93 | Very high | 92.2 | Very high | 45 Ų | 45 | 63.3 Ų | 63.3 | 29% | 0.292 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60.5 | -41.9 | 175.7 | -26.2 | 37.5 | 0 | 0 | 0 | 112.6 | Y125 L126 N130 Q136 L137 | Y125-P133 WeakPolarHBondContact O-CG 3.45Å; L126-P133 HydrophobicContact CD2-CB 4.09Å; N130-P133 VanDerWaalsContact OD1-CD 3.32Å; N130-P133 WeakPolarHBondContact OD1-CD 3.21Å; P133-Q136 PolarHBondContact O-N 3.31Å; P133-L137 VanDerWaalsContact O-CG 3.31Å; P133-L137 WeakPolarHBondContact O-CG 3.27Å; P133-L137 PolarHBondContact O-N 2.87Å |
| 134 | L | 94 | Very high | 92.8 | Very high | 2 Ų | 2 | 65.9 Ų | 65.9 | 1% | 0.01 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -64 | -44.1 | 177.2 | 179.9 | 57.1 | 0 | 0 | 0 | 111.6 | M34 F35 L117 L126 L131 E132 Q136 L137 L138 V150 | M34-L134 HydrophobicContact CE-CD2 4.15Å; M34-L134 HydrophobicContact SD-CD2 4.05Å; F35-L134 HydrophobicContact CE1-CD2 4.39Å; L117-L134 HydrophobicContact CD2-CD1 3.58Å; L117-L134 HydrophobicContact CD2-CD2 4.33Å; L126-L134 HydrophobicContact CD1-CB 4.29Å; L126-L134 HydrophobicContact CD1-CD2 4.41Å; L126-L134 HydrophobicContact CD2-CB 3.63Å; L131-L134 PolarHBondContact O-N 3.19Å; E132-L134 VanDerWaalsContact C-N 3.34Å; E132-L134 PolarHBondContact O-N 3.12Å; L134-Q136 VanDerWaalsContact C-N 3.26Å; L134-Q136 PolarHBondContact O-N 3.12Å; L134-L137 PolarHBondContact O-N 3.28Å; L134-L138 HydrophobicContact CD1-CD1 4.37Å; L134-L138 HydrophobicContact CD1-CG 4.27Å; L134-L138 HydrophobicContact CG-CD1 4.27Å; L134-L138 VanDerWaalsContact O-CG 3.31Å; L134-L138 WeakPolarHBondContact O-CG 3.46Å; L134-L138 PolarHBondContact O-N 3.34Å; L134-V150 HydrophobicContact CD2-CG1 4.02Å; L134-V150 HydrophobicContact CD2-CG2 4.05Å; L134-V150 HydrophobicContact CG-CG1 4.36Å; L134-V150 HydrophobicContact CG-CG2 4.22Å |
| 135 | L | 95.2 | Very high | 93.2 | Very high | 49 Ų | 49 | 66.4 Ų | 66.4 | 26% | 0.257 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -59.7 | -38.8 | 175.6 | -71.2 | 170.7 | 0 | 0 | 0 | 111.8 | L131 E132 R139 L147 V150 | L131-L135 WeakPolarHBondContact O-CG 3.49Å; L131-L135 PolarHBondContact O-N 3.2Å; E132-L135 PolarHBondContact O-N 3.26Å; L135-R139 VanDerWaalsContact O-CG 3.28Å; L135-R139 WeakPolarHBondContact O-CG 3.5Å; L135-R139 PolarHBondContact O-N 2.7Å; L135-R139 VanDerWaalsContact O-N 3.17Å; L135-L147 HydrophobicContact CB-CD2 4.43Å; L135-L147 HydrophobicContact CD2-CB 4.41Å; L135-L147 HydrophobicContact CD2-CD2 3.69Å; L135-V150 HydrophobicContact CD2-CB 3.67Å; L135-V150 HydrophobicContact CD2-CG1 3.78Å; L135-V150 HydrophobicContact CD2-CG2 4.22Å; L135-V150 HydrophobicContact CG-CB 4.39Å; L135-V150 HydrophobicContact CG-CG1 3.93Å |
| 136 | Q | 94.9 | Very high | 93.5 | Very high | 103 Ų | 103 | 62.4 Ų | 62.4 | 48% | 0.481 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -70 | -44.2 | 178.3 | -170.7 | 71.3 | -22.8 | 0 | 0 | 111.8 | E132 P133 L134 L138 R139 V140 | E132-Q136 PolarHBondContact O-N 2.97Å; P133-Q136 PolarHBondContact O-N 3.31Å; L134-Q136 VanDerWaalsContact C-N 3.26Å; L134-Q136 PolarHBondContact O-N 3.12Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; Q136-L138 PolarHBondContact O-N 3.38Å; Q136-R139 WeakPolarHBondContact O-CB 3.17Å; Q136-R139 PolarHBondContact O-N 3.31Å; Q136-R139 VanDerWaalsContact O-N 3.13Å; Q136-V140 WeakPolarHBondContact O-CG2 3.21Å; Q136-V140 PolarHBondContact O-N 2.87Å |
| 137 | L | 92.8 | Very high | 93.5 | Very high | 44 Ų | 44 | 64.1 Ų | 64.1 | 23% | 0.23 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -57.4 | -46.3 | 175.3 | -73.9 | 171.2 | 0 | 0 | 0 | 111.3 | L50 L53 L120 P133 L134 R139 V140 L141 | L50-L137 HydrophobicContact CD2-CB 3.99Å; L50-L137 HydrophobicContact CD2-CD1 4.1Å; L50-L137 HydrophobicContact CD2-CD2 3.77Å; L50-L137 HydrophobicContact CD2-CG 4.16Å; L53-L137 HydrophobicContact CD1-CD2 4.38Å; L120-L137 HydrophobicContact CD1-CD1 4.45Å; P133-L137 VanDerWaalsContact O-CG 3.31Å; P133-L137 WeakPolarHBondContact O-CG 3.27Å; P133-L137 PolarHBondContact O-N 2.87Å; L134-L137 PolarHBondContact O-N 3.28Å; L137-R139 VanDerWaalsContact C-N 3.29Å; L137-R139 PolarHBondContact O-N 3.09Å; L137-V140 PolarHBondContact O-N 3.35Å; L137-V140 VanDerWaalsContact O-N 3.16Å; L137-L141 WeakPolarHBondContact O-CG 3.4Å; L137-L141 PolarHBondContact O-N 3.43Å |
| 138 | L | 95.1 | Very high | 93.5 | Very high | 1 Ų | 1 | 63.8 Ų | 63.8 | 1% | 0.005 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.4 | -33.5 | 177.3 | -69.8 | 174.8 | 0 | 0 | 0 | 113 | V38 L42 L134 Q136 T142 R143 L146 L147 V150 | V38-L138 HydrophobicContact CG1-CD1 4.47Å; L42-L138 HydrophobicContact CD2-CD2 4.07Å; L134-L138 HydrophobicContact CD1-CD1 4.37Å; L134-L138 HydrophobicContact CD1-CG 4.27Å; L134-L138 HydrophobicContact CG-CD1 4.27Å; L134-L138 VanDerWaalsContact O-CG 3.31Å; L134-L138 WeakPolarHBondContact O-CG 3.46Å; L134-L138 PolarHBondContact O-N 3.34Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; Q136-L138 PolarHBondContact O-N 3.38Å; L138-T142 PolarHBondContact O-N 3.26Å; L138-R143 HydrophobicContact CD2-CB 4.04Å; L138-R143 PolarHBondContact O-N 3.02Å; L138-L146 HydrophobicContact CD1-CB 3.92Å; L138-L146 HydrophobicContact CD2-CB 4.05Å; L138-L146 HydrophobicContact CD2-CD1 3.93Å; L138-L147 HydrophobicContact CB-CD2 3.7Å; L138-L147 HydrophobicContact CD1-CD2 4.12Å; L138-V150 HydrophobicContact CD1-CG2 3.48Å; L138-V150 VanDerWaalsContact CD1-CG2 3.48Å |
| 139 | R | 95.1 | Very high | 93.6 | Very high | 135 Ų | 135 | 62.7 Ų | 62.7 | 51% | 0.509 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -67.4 | -43.7 | 173.4 | -72.2 | 167 | -179.4 | -172.5 | 1.4 | 111.8 | L135 Q136 L137 L141 T142 L147 | L135-R139 VanDerWaalsContact O-CG 3.28Å; L135-R139 WeakPolarHBondContact O-CG 3.5Å; L135-R139 PolarHBondContact O-N 2.7Å; L135-R139 VanDerWaalsContact O-N 3.17Å; Q136-R139 WeakPolarHBondContact O-CB 3.17Å; Q136-R139 PolarHBondContact O-N 3.31Å; Q136-R139 VanDerWaalsContact O-N 3.13Å; L137-R139 VanDerWaalsContact C-N 3.29Å; L137-R139 PolarHBondContact O-N 3.09Å; R139-L141 VanDerWaalsContact C-N 3.35Å; R139-T142 PolarHBondContact O-N 2.78Å; R139-L147 HydrophobicContact CG-CD1 4.18Å; R139-L147 HydrophobicContact CG-CD2 4.33Å |
| 140 | V | 93.4 | Very high | 93.8 | Very high | 96 Ų | 96 | 59.5 Ų | 59.5 | 58% | 0.582 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -63.3 | -42.1 | 178.7 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | Q136 L137 T142 | Q136-V140 WeakPolarHBondContact O-CG2 3.21Å; Q136-V140 PolarHBondContact O-N 2.87Å; L137-V140 PolarHBondContact O-N 3.35Å; L137-V140 VanDerWaalsContact O-N 3.16Å; V140-T142 PolarHBondContact O-N 3.03Å |
| 141 | L | 92.8 | Very high | 93.6 | Very high | 26 Ų | 26 | 58.6 Ų | 58.6 | 14% | 0.136 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.1 | -0.6 | 174.3 | -64.1 | 178.5 | 0 | 0 | 0 | 114 | D46 A49 L50 L137 R139 R143 | D46-L141 HydrophobicContact CB-CD1 4.1Å; A49-L141 HydrophobicContact CB-CD2 3.75Å; L50-L141 HydrophobicContact CD1-CD1 3.71Å; L50-L141 HydrophobicContact CD2-CD1 3.76Å; L50-L141 HydrophobicContact CD2-CG 4.35Å; L50-L141 HydrophobicContact CG-CD1 3.64Å; L137-L141 WeakPolarHBondContact O-CG 3.4Å; L137-L141 PolarHBondContact O-N 3.43Å; R139-L141 VanDerWaalsContact C-N 3.35Å; L141-R143 HydrophobicContact CB-CG 4.14Å; L141-R143 PolarHBondContact O-N 2.76Å; L141-R143 VanDerWaalsContact O-N 3.15Å |
| 142 | T | 94.5 | Very high | 93.2 | Very high | 105 Ų | 105 | 59.4 Ų | 59.4 | 64% | 0.644 | 30% | 0.303 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62 | 13.4 | -175.7 | 73.7 | 0 | 0 | 0 | 0 | 115.6 | L138 R139 V140 H144 | L138-T142 PolarHBondContact O-N 3.26Å; R139-T142 PolarHBondContact O-N 2.78Å; V140-T142 PolarHBondContact O-N 3.03Å; T142-H144 VanDerWaalsContact C-ND1 3.35Å; T142-H144 PolarHBondContact O-N 3.45Å; T142-H144 PolarHBondContact O-ND1 3.34Å |
| 143 | R | 95.2 | Very high | 92.7 | Very high | 51 Ų | 51 | 60 Ų | 60 | 19% | 0.192 | 30% | 0.303 | C | S | . | . | trans | -79.7 | 59.4 | 175.7 | -63.2 | -68.1 | -72.5 | 134.8 | 5.3 | 112 | Q41 D46 L138 L141 D145 L146 | Q41-R143 PolarHBondContact O-NH2 2.74Å; D46-R143 WeakPolarHBondContact OD2-CD 3.28Å; D46-R143 IonicContact OD2-NE 3.01Å; D46-R143 PolarHBondContact OD2-NE 3.34Å; L138-R143 HydrophobicContact CD2-CB 4.04Å; L138-R143 PolarHBondContact O-N 3.02Å; L141-R143 HydrophobicContact CB-CG 4.14Å; L141-R143 PolarHBondContact O-N 2.76Å; L141-R143 VanDerWaalsContact O-N 3.15Å; R143-D145 VanDerWaalsContact C-OD1 3.25Å; R143-D145 WeakPolarHBondContact CA-OD1 3.34Å; R143-D145 IonicContact CZ-OD1 2.7Å; R143-D145 IonicContact CZ-OD2 3.37Å; R143-D145 IonicContact NE-OD1 2.86Å; R143-D145 IonicContact NH1-OD1 3.48Å; R143-D145 PolarHBondContact NH1-OD1 2.95Å; R143-D145 IonicContact NH1-OD2 3.24Å; R143-D145 PolarHBondContact NH1-OD2 3.26Å; R143-D145 IonicContact NH2-OD1 3.17Å; R143-D145 IonicContact NH2-OD2 3.57Å; R143-D145 PolarHBondContact NH2-OD2 3.44Å; R143-D145 PolarHBondContact O-N 3.4Å; R143-L146 HydrophobicContact CB-CD1 4.09Å; R143-L146 HydrophobicContact CB-CG 4.23Å; R143-L146 PolarHBondContact O-N 3Å; R143-L146 VanDerWaalsContact O-N 3.15Å | ||
| 144 | H | 96.4 | Very high | 92.1 | Very high | 109 Ų | 109 | 60.7 Ų | 60.7 | 51% | 0.505 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67 | -23 | -178.6 | -63.8 | 84.4 | 0 | 0 | 0 | 113.5 | T142 L146 L147 P148 | T142-H144 VanDerWaalsContact C-ND1 3.35Å; T142-H144 PolarHBondContact O-N 3.45Å; T142-H144 PolarHBondContact O-ND1 3.34Å; H144-L146 PolarHBondContact O-N 3.27Å; H144-L147 HydrophobicContact CB-CD1 4.33Å; H144-L147 PolarHBondContact O-N 3.11Å; H144-P148 WeakPolarHBondContact O-CD 3.45Å |
| 145 | D | 94.8 | Very high | 91 | Very high | 71 Ų | 71 | 69.5 Ų | 69.5 | 38% | 0.38 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -24.1 | 173.9 | 59.2 | -49 | 0 | 0 | 0 | 112.7 | R143 P148 F149 | R143-D145 VanDerWaalsContact C-OD1 3.25Å; R143-D145 WeakPolarHBondContact CA-OD1 3.34Å; R143-D145 IonicContact CZ-OD1 2.7Å; R143-D145 IonicContact CZ-OD2 3.37Å; R143-D145 IonicContact NE-OD1 2.86Å; R143-D145 IonicContact NH1-OD1 3.48Å; R143-D145 PolarHBondContact NH1-OD1 2.95Å; R143-D145 IonicContact NH1-OD2 3.24Å; R143-D145 PolarHBondContact NH1-OD2 3.26Å; R143-D145 IonicContact NH2-OD1 3.17Å; R143-D145 IonicContact NH2-OD2 3.57Å; R143-D145 PolarHBondContact NH2-OD2 3.44Å; R143-D145 PolarHBondContact O-N 3.4Å; D145-P148 WeakPolarHBondContact O-CD 3.21Å; D145-F149 WeakPolarHBondContact O-CD2 2.97Å; D145-F149 WeakPolarHBondContact O-CE2 3.38Å |
| 146 | L | 94.8 | Very high | 89.6 | Confident | 0 Ų | 0 | 73.9 Ų | 73.9 | 0% | 0 | 35% | 0.348 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | -23.1 | -179.9 | -58.3 | -173 | 0 | 0 | 0 | 114 | V38 Q41 L42 L138 R143 H144 P148 F149 V150 | V38-L146 HydrophobicContact CG1-CD1 4.32Å; Q41-L146 HydrophobicContact CB-CD1 4.21Å; Q41-L146 HydrophobicContact CB-CD2 3.43Å; Q41-L146 VanDerWaalsContact CB-CD2 3.43Å; Q41-L146 HydrophobicContact CB-CG 4.48Å; Q41-L146 VanDerWaalsContact CD-CD2 3.47Å; Q41-L146 HydrophobicContact CG-CD2 4.08Å; L42-L146 HydrophobicContact CD2-CD1 3.78Å; L42-L146 HydrophobicContact CG-CD1 4.42Å; L138-L146 HydrophobicContact CD1-CB 3.92Å; L138-L146 HydrophobicContact CD2-CB 4.05Å; L138-L146 HydrophobicContact CD2-CD1 3.93Å; R143-L146 HydrophobicContact CB-CD1 4.09Å; R143-L146 HydrophobicContact CB-CG 4.23Å; R143-L146 PolarHBondContact O-N 3Å; R143-L146 VanDerWaalsContact O-N 3.15Å; H144-L146 PolarHBondContact O-N 3.27Å; L146-P148 VanDerWaalsContact C-CD 3.49Å; L146-P148 VanDerWaalsContact C-N 3.33Å; L146-F149 HydrophobicContact CD2-CD2 4.37Å; L146-F149 WeakPolarHBondContact O-CB 3.15Å; L146-F149 PolarHBondContact O-N 3.06Å; L146-V150 PolarHBondContact O-N 2.78Å |
| 147 | L | 94.3 | Very high | 87.9 | Confident | 40 Ų | 40 | 75.5 Ų | 75.5 | 21% | 0.209 | 37% | 0.365 | C | S | . | . | G | 310 helix | trans | -53.4 | -41.7 | 178.3 | -54.6 | 173.4 | 0 | 0 | 0 | 113.4 | L135 L138 R139 H144 F149 V150 | L135-L147 HydrophobicContact CB-CD2 4.43Å; L135-L147 HydrophobicContact CD2-CB 4.41Å; L135-L147 HydrophobicContact CD2-CD2 3.69Å; L138-L147 HydrophobicContact CB-CD2 3.7Å; L138-L147 HydrophobicContact CD1-CD2 4.12Å; R139-L147 HydrophobicContact CG-CD1 4.18Å; R139-L147 HydrophobicContact CG-CD2 4.33Å; H144-L147 HydrophobicContact CB-CD1 4.33Å; H144-L147 PolarHBondContact O-N 3.11Å; L147-F149 PolarHBondContact O-N 3.1Å; L147-F149 VanDerWaalsContact O-N 3.12Å; L147-V150 PolarHBondContact O-N 3.38Å |
| 148 | P | 91.6 | Very high | 85.8 | Confident | 47 Ų | 47 | 79.8 Ų | 79.8 | 31% | 0.305 | 39% | 0.393 | S | S | . | . | G | 310 helix | trans | -48.5 | -27.4 | 168.7 | -38.8 | 42.7 | 0 | 0 | 0 | 117.9 | H144 D145 L146 R155 | H144-P148 WeakPolarHBondContact O-CD 3.45Å; D145-P148 WeakPolarHBondContact O-CD 3.21Å; L146-P148 VanDerWaalsContact C-CD 3.49Å; L146-P148 VanDerWaalsContact C-N 3.33Å; P148-R155 VanDerWaalsContact CB-NH2 3.27Å; P148-R155 PolarHBondContact O-NE 3.21Å; P148-R155 PolarHBondContact O-NH2 2.82Å |
| 149 | F | 91.5 | Very high | 83.7 | Confident | 76 Ų | 76 | 84.6 Ų | 84.6 | 33% | 0.333 | 43% | 0.427 | S | S | . | . | G | 310 helix | trans | -99.3 | -15.7 | -174.3 | -60.1 | -80.3 | 0 | 0 | 0 | 112.8 | M34 V37 V38 D145 L146 L147 S151 | M34-F149 WeakPolarHBondContact CG-O 3.49Å; V37-F149 HydrophobicContact CG1-CB 4.06Å; V37-F149 HydrophobicContact CG1-CD1 3.69Å; V37-F149 HydrophobicContact CG1-CE1 4.41Å; V37-F149 HydrophobicContact CG1-CG 4.05Å; V38-F149 HydrophobicContact CG2-CB 4.04Å; D145-F149 WeakPolarHBondContact O-CD2 2.97Å; D145-F149 WeakPolarHBondContact O-CE2 3.38Å; L146-F149 HydrophobicContact CD2-CD2 4.37Å; L146-F149 WeakPolarHBondContact O-CB 3.15Å; L146-F149 PolarHBondContact O-N 3.06Å; L147-F149 PolarHBondContact O-N 3.1Å; L147-F149 VanDerWaalsContact O-N 3.12Å; F149-S151 PolarHBondContact O-N 3.04Å |
| 150 | V | 92.8 | Very high | 81.9 | Confident | 14 Ų | 14 | 82.6 Ų | 82.6 | 9% | 0.085 | 43% | 0.431 | C | S | . | . | S | Bend | trans | -78.5 | 69.3 | 171.4 | -173.1 | 0 | 0 | 0 | 0 | 108.8 | M34 V38 L131 L134 L135 L138 L146 L147 | M34-V150 HydrophobicContact SD-CG1 4.48Å; V38-V150 HydrophobicContact CG2-CG2 4Å; L131-V150 HydrophobicContact CB-CG1 3.9Å; L131-V150 HydrophobicContact CD1-CG1 3.88Å; L131-V150 HydrophobicContact CG-CG1 4.42Å; L134-V150 HydrophobicContact CD2-CG1 4.02Å; L134-V150 HydrophobicContact CD2-CG2 4.05Å; L134-V150 HydrophobicContact CG-CG1 4.36Å; L134-V150 HydrophobicContact CG-CG2 4.22Å; L135-V150 HydrophobicContact CD2-CB 3.67Å; L135-V150 HydrophobicContact CD2-CG1 3.78Å; L135-V150 HydrophobicContact CD2-CG2 4.22Å; L135-V150 HydrophobicContact CG-CB 4.39Å; L135-V150 HydrophobicContact CG-CG1 3.93Å; L138-V150 HydrophobicContact CD1-CG2 3.48Å; L138-V150 VanDerWaalsContact CD1-CG2 3.48Å; L146-V150 PolarHBondContact O-N 2.78Å; L147-V150 PolarHBondContact O-N 3.38Å |
| 151 | S | 86.6 | Confident | 80.2 | Confident | 51 Ų | 51 | 86 Ų | 86 | 36% | 0.357 | 44% | 0.44 | S | S | . | . | S | Bend | trans | -152.9 | 139.6 | 175.6 | -177.1 | 0 | 0 | 0 | 0 | 109.1 | F149 K153 | F149-S151 PolarHBondContact O-N 3.04Å; S151-K153 PolarHBondContact O-N 3.28Å; S151-K153 VanDerWaalsContact O-N 3.12Å; S151-K153 PolarHBondContact OG-N 3.14Å |
| 152 | H | 83.8 | Confident | 78.4 | Confident | 37 Ų | 37 | 96.4 Ų | 96.4 | 17% | 0.171 | 48% | 0.478 | C | S | . | . | S | Bend | trans | -68.9 | -3 | 170.5 | -63.3 | -84.1 | 0 | 0 | 0 | 112.9 | M28 L29 D128 L131 | M28-H152 CarbonylContact C-O 3.6Å; M28-H152 WeakPolarHBondContact CA-O 3.44Å; M28-H152 WeakPolarHBondContact CB-O 3.28Å; M28-H152 HydrophobicContact CE-CB 3.83Å; L29-H152 PolarHBondContact N-O 2.85Å; L29-H152 PolarHBondContact O-ND1 3.33Å; D128-H152 PolarHBondContact O-NE2 2.9Å; D128-H152 IonicContact OD1-CE1 2.95Å; D128-H152 PolarHBondContact OD1-CE1 3.13Å; D128-H152 IonicContact OD1-ND1 3.94Å; L131-H152 WeakPolarHBondContact CD1-NE2 3.28Å |
| 153 | K | 83.6 | Confident | 76.5 | Confident | 157 Ų | 157 | 98.2 Ų | 98.2 | 68% | 0.683 | 48% | 0.482 | S | S | * | . | B | Isolated β-bridge | trans | -99.6 | 122 | -176.7 | -168.3 | 173.4 | 178.4 | 177.9 | 0 | 111.4 | S151 R155 | S151-K153 PolarHBondContact O-N 3.28Å; S151-K153 VanDerWaalsContact O-N 3.12Å; S151-K153 PolarHBondContact OG-N 3.14Å; K153-R155 PolarHBondContact O-N 3.33Å |
| 154 | K | 80.2 | Confident | 74.2 | Confident | 61 Ų | 61 | 99 Ų | 99 | 27% | 0.265 | 51% | 0.506 | S | S | . | . | trans | -63.3 | 128.1 | 173 | -65.8 | -180 | 170 | 175.7 | 0 | 109.2 | N24 G27 M28 L29 E33 R156 | N24-K154 PolarHBondContact OD1-NZ 3.12Å; G27-K154 WeakPolarHBondContact O-CB 2.91Å; G27-K154 WeakPolarHBondContact O-CG 3.29Å; G27-K154 PolarHBondContact O-N 3.42Å; M28-K154 WeakPolarHBondContact O-CE 3.43Å; L29-K154 HydrophobicContact CD1-CG 4.38Å; L29-K154 HydrophobicContact CD2-CD 4.2Å; L29-K154 HydrophobicContact CD2-CG 3.94Å; L29-K154 HydrophobicContact CG-CD 4.39Å; L29-K154 HydrophobicContact CG-CG 3.67Å; E33-K154 IonicContact OE1-NZ 3.14Å; E33-K154 PolarHBondContact OE1-NZ 2.94Å; K154-R156 PolarHBondContact O-N 2.9Å | ||
| 155 | R | 71.8 | Confident | 71.5 | Confident | 187 Ų | 187 | 100.6 Ų | 100.6 | 71% | 0.706 | 51% | 0.514 | S | S | * | . | trans | -72.6 | 98.3 | 172.6 | -70.4 | -178 | 173 | -125.3 | -12.6 | 108.6 | P148 K153 | P148-R155 VanDerWaalsContact CB-NH2 3.27Å; P148-R155 PolarHBondContact O-NE 3.21Å; P148-R155 PolarHBondContact O-NH2 2.82Å; K153-R155 PolarHBondContact O-N 3.33Å | ||
| 156 | R | 66.4 | Low | 68.8 | Low | 141 Ų | 141 | 108.4 Ų | 108.4 | 53% | 0.532 | 54% | 0.538 | S | S | . | . | trans | -91.4 | 125.2 | 174.5 | -66.1 | -175.1 | -179.9 | 178.6 | -0.3 | 109.9 | N24 K154 V158 | N24-R156 PolarHBondContact O-NH2 2.76Å; K154-R156 PolarHBondContact O-N 2.9Å; R156-V158 PolarHBondContact O-N 2.93Å | ||
| 157 | T | 57.8 | Low | 66.4 | Low | 137 Ų | 137 | 115.9 Ų | 115.9 | 84% | 0.84 | 57% | 0.571 | S | S | * | * | trans | -71.3 | 99 | 169.5 | -59.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 158 | V | 49.8 | Very low | 63.9 | Low | 133 Ų | 133 | 122.8 Ų | 122.8 | 81% | 0.806 | 60% | 0.602 | S | S | * | * | S | Bend | trans | 30 | 119.9 | 169.3 | -72 | 0 | 0 | 0 | 0 | 119.8 | R156 | R156-V158 PolarHBondContact O-N 2.93Š|
| 159 | S | 49.6 | Very low | 61.6 | Low | 103 Ų | 103 | 126.2 Ų | 126.2 | 72% | 0.72 | 62% | 0.617 | S | S | * | * | trans | 78.1 | 110.8 | 176.2 | -154.3 | 0 | 0 | 0 | 0 | 115.8 | E161 | S159-E161 PolarHBondContact O-N 3.26Š| ||
| 160 | P | 58.1 | Low | 59.3 | Low | 92 Ų | 92 | 130.1 Ų | 130.1 | 60% | 0.597 | 64% | 0.641 | S | S | * | * | trans | -63.6 | 107.3 | 163.5 | -6 | 21 | 0 | 0 | 0 | 107.5 | R162 | P160-R162 PolarHBondContact O-N 2.89Š| ||
| 161 | E | 58.5 | Low | 56.6 | Low | 167 Ų | 167 | 136.9 Ų | 136.9 | 78% | 0.78 | 67% | 0.669 | S | S | * | * | trans | -57.9 | 113.9 | 158.6 | -83.8 | -178.3 | 155.2 | 0 | 0 | 106.7 | S159 I163 | S159-E161 PolarHBondContact O-N 3.26Å; E161-I163 HydrophobicContact CB-CG1 4.41Å; E161-I163 PolarHBondContact O-N 2.82Å | ||
| 162 | R | 55 | Low | 54.6 | Low | 246 Ų | 246 | 140.4 Ų | 140.4 | 93% | 0.928 | 69% | 0.689 | S | S | * | * | trans | -68.8 | 86.7 | 163.5 | -63.9 | -159.2 | -166 | 161.1 | 3.6 | 105.9 | P160 G164 | P160-R162 PolarHBondContact O-N 2.89Å; R162-G164 PolarHBondContact O-N 3.06Å | ||
| 163 | I | 53 | Low | 52.7 | Low | 142 Ų | 142 | 147.2 Ų | 147.2 | 73% | 0.728 | 72% | 0.721 | S | S | * | * | trans | -62.6 | 96 | 164.7 | -64.4 | 146.8 | 0 | 0 | 0 | 104.4 | E161 Q165 | E161-I163 HydrophobicContact CB-CG1 4.41Å; E161-I163 PolarHBondContact O-N 2.82Å; I163-Q165 PolarHBondContact O-N 2.81Å | ||
| 164 | G | 47.1 | Very low | 50.6 | Low | 67 Ų | 67 | 147.7 Ų | 147.7 | 69% | 0.691 | 73% | 0.73 | S | S | * | * | trans | -62.6 | 97.2 | 166.2 | 0 | 0 | 0 | 0 | 0 | 105.8 | R162 R166 | R162-G164 PolarHBondContact O-N 3.06Å; G164-R166 PolarHBondContact O-N 3.08Å | ||
| 165 | Q | 40.5 | Very low | 48.8 | Very low | 143 Ų | 143 | 150.7 Ų | 150.7 | 67% | 0.668 | 75% | 0.753 | S | S | * | * | trans | -62.4 | 88.8 | 172.1 | -163.2 | 169.2 | 21.1 | 0 | 0 | 106.4 | I163 F167 | I163-Q165 PolarHBondContact O-N 2.81Å; Q165-F167 HydrophobicContact CB-CE2 4.31Å; Q165-F167 HydrophobicContact CG-CD2 4.12Å; Q165-F167 HydrophobicContact CG-CE2 3.83Å; Q165-F167 HydrophobicContact CG-CZ 4.26Å; Q165-F167 PolarHBondContact O-N 2.85Å | ||
| 166 | R | 38.9 | Very low | 47 | Very low | 236 Ų | 236 | 151.3 Ų | 151.3 | 89% | 0.891 | 76% | 0.761 | S | S | * | * | trans | -63.3 | 97.6 | 159.8 | -74.4 | -165.3 | -171.7 | -159.1 | 4.1 | 104.3 | G164 E168 | G164-R166 PolarHBondContact O-N 3.08Å; R166-E168 PolarHBondContact O-N 2.85Å | ||
| 167 | F | 42.5 | Very low | 45.9 | Very low | 156 Ų | 156 | 147.9 Ų | 147.9 | 68% | 0.684 | 77% | 0.77 | S | S | * | * | trans | -59.9 | 96.3 | 155.2 | -76.8 | -89.6 | 0 | 0 | 0 | 105.5 | Q165 L169 | Q165-F167 HydrophobicContact CB-CE2 4.31Å; Q165-F167 HydrophobicContact CG-CD2 4.12Å; Q165-F167 HydrophobicContact CG-CE2 3.83Å; Q165-F167 HydrophobicContact CG-CZ 4.26Å; Q165-F167 PolarHBondContact O-N 2.85Å; F167-L169 PolarHBondContact O-N 3.42Å | ||
| 168 | E | 43.5 | Very low | 45 | Very low | 186 Ų | 186 | 148.4 Ų | 148.4 | 87% | 0.869 | 77% | 0.767 | S | S | * | * | trans | -70.5 | 76.1 | 164.8 | -168.2 | 162.9 | -154.1 | 0 | 0 | 106.1 | R166 D170 | R166-E168 PolarHBondContact O-N 2.85Å; E168-D170 VanDerWaalsContact C-N 3.26Å; E168-D170 PolarHBondContact O-N 3.09Å; E168-D170 VanDerWaalsContact O-N 3.08Å | ||
| 169 | L | 41.7 | Very low | 44.7 | Very low | 119 Ų | 119 | 150.9 Ų | 150.9 | 62% | 0.623 | 77% | 0.77 | S | S | * | * | trans | -75.6 | 92.4 | 168.7 | -161.4 | 98.8 | 0 | 0 | 0 | 105.3 | F167 K171 | F167-L169 PolarHBondContact O-N 3.42Å; L169-K171 VanDerWaalsContact C-N 3.32Å; L169-K171 HydrophobicContact CD2-CD 3.5Å; L169-K171 VanDerWaalsContact CD2-CD 3.5Å; L169-K171 VanDerWaalsContact CD2-CE 3.5Å; L169-K171 HydrophobicContact CD2-CG 3.82Å; L169-K171 HydrophobicContact CG-CD 4.43Å; L169-K171 HydrophobicContact CG-CG 4.29Å; L169-K171 PolarHBondContact O-N 2.8Å | ||
| 170 | D | 44.8 | Very low | 44 | Very low | 157 Ų | 157 | 153.4 Ų | 153.4 | 84% | 0.84 | 77% | 0.77 | S | S | * | * | trans | -55.8 | 97.3 | 170.4 | -155 | 9.1 | 0 | 0 | 0 | 108.2 | E168 | E168-D170 VanDerWaalsContact C-N 3.26Å; E168-D170 PolarHBondContact O-N 3.09Å; E168-D170 VanDerWaalsContact O-N 3.08Å | ||
| 171 | K | 36.4 | Very low | 43.1 | Very low | 156 Ų | 156 | 154.3 Ų | 154.3 | 68% | 0.678 | 78% | 0.779 | S | S | * | * | trans | -139 | 93.7 | 172.1 | -78.1 | -167.1 | -176.7 | 167.4 | 0 | 108.3 | L169 | L169-K171 VanDerWaalsContact C-N 3.32Å; L169-K171 HydrophobicContact CD2-CD 3.5Å; L169-K171 VanDerWaalsContact CD2-CD 3.5Å; L169-K171 VanDerWaalsContact CD2-CE 3.5Å; L169-K171 HydrophobicContact CD2-CG 3.82Å; L169-K171 HydrophobicContact CG-CD 4.43Å; L169-K171 HydrophobicContact CG-CG 4.29Å; L169-K171 PolarHBondContact O-N 2.8Å | ||
| 172 | T | 43.4 | Very low | 42 | Very low | 125 Ų | 125 | 152.8 Ų | 152.8 | 77% | 0.767 | 79% | 0.785 | S | S | * | * | trans | 2.8 | 115.6 | 136.8 | 33.7 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 173 | E | 43.6 | Very low | 41.2 | Very low | 180 Ų | 180 | 152 Ų | 152 | 84% | 0.841 | 78% | 0.782 | S | S | * | * | trans | 38.7 | 102.4 | 143.4 | -61.8 | -175.2 | 164.5 | 0 | 0 | 117.8 | ||||
| 174 | L | 40.1 | Very low | 40.5 | Very low | 167 Ų | 167 | 154.1 Ų | 154.1 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | trans | -146.8 | 95.8 | 137.5 | -121.5 | 135.8 | 0 | 0 | 0 | 110.5 | ||||
| 175 | V | 41.7 | Very low | 40.2 | Very low | 124 Ų | 124 | 156.8 Ų | 156.8 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | trans | -58.8 | 127.5 | 158.9 | 170.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 176 | F | 35.5 | Very low | 40.2 | Very low | 200 Ų | 200 | 156.9 Ų | 156.9 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | trans | -162.4 | 119.2 | 133.6 | -101.9 | -74.6 | 0 | 0 | 0 | 108.9 | ||||
| 177 | G | 41.6 | Very low | 40 | Very low | 70 Ų | 70 | 152.9 Ų | 152.9 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | -75.8 | 155.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 178 | L | 39.2 | Very low | 40 | Very low | 148 Ų | 148 | 150.3 Ų | 150.3 | 78% | 0.775 | 79% | 0.789 | S | S | * | * | trans | -154.1 | 101 | 153.7 | -165.6 | 61 | 0 | 0 | 0 | 109.3 | ||||
| 179 | Q | 43.8 | Very low | 39.9 | Very low | 185 Ų | 185 | 149 Ų | 149 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | -68.5 | 121.2 | 163 | -77 | 179.7 | -24.1 | 0 | 0 | 108.6 | ||||
| 180 | H | 36 | Very low | 39.9 | Very low | 156 Ų | 156 | 149.2 Ų | 149.2 | 72% | 0.722 | 80% | 0.796 | S | S | * | * | trans | -145.2 | 129.4 | 149.8 | -75.8 | -60 | 0 | 0 | 0 | 110.4 | ||||
| 181 | S | 39.3 | Very low | 39.4 | Very low | 111 Ų | 111 | 147.2 Ų | 147.2 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 129.3 | 179 | 59 | 0 | 0 | 0 | 0 | 112.7 | ||
| 182 | C | 34.5 | Very low | 39.4 | Very low | 134 Ų | 134 | 149.4 Ų | 149.4 | 91% | 0.905 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -96.3 | 117.7 | 158.3 | -90.2 | 0 | 0 | 0 | 0 | 108.7 | ||
| 183 | R | 37.6 | Very low | 39.2 | Very low | 230 Ų | 230 | 148.9 Ų | 148.9 | 87% | 0.868 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 133.6 | 176.7 | -75.9 | -162.2 | 154.7 | -155.4 | -6.2 | 111.1 | T185 | R183-T185 PolarHBondContact O-N 3.02Š|
| 184 | E | 38.5 | Very low | 39 | Very low | 186 Ų | 186 | 148.8 Ų | 148.8 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | trans | -47.5 | 114.6 | 160.8 | -168.4 | 162.2 | -156.9 | 0 | 0 | 109.5 | ||||
| 185 | T | 40.6 | Very low | 38.7 | Very low | 123 Ų | 123 | 150 Ų | 150 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -115.5 | 100.5 | 171.2 | -56.2 | 0 | 0 | 0 | 0 | 106.4 | R183 M187 | R183-T185 PolarHBondContact O-N 3.02Å; T185-M187 PolarHBondContact O-N 2.81Å | ||
| 186 | D | 40.7 | Very low | 38.3 | Very low | 145 Ų | 145 | 152.6 Ų | 152.6 | 78% | 0.775 | 81% | 0.81 | S | S | * | * | trans | -56.4 | 128 | 167 | -89.6 | -43.2 | 0 | 0 | 0 | 110 | ||||
| 187 | M | 36 | Very low | 38.4 | Very low | 152 Ų | 152 | 149.3 Ų | 149.3 | 75% | 0.749 | 81% | 0.806 | S | S | * | * | trans | -140.3 | 118 | 161.2 | -108 | -53.8 | -44.6 | 0 | 0 | 109.5 | T185 | T185-M187 PolarHBondContact O-N 2.81Š| ||
| 188 | P | 42.6 | Very low | 38 | Very low | 102 Ų | 102 | 153.1 Ų | 153.1 | 66% | 0.662 | 82% | 0.816 | S | S | * | * | trans | -73.3 | 150.9 | -173.4 | 28.6 | -36.2 | 0 | 0 | 0 | 114.1 | ||||
| 189 | L | 41.4 | Very low | 37.6 | Very low | 160 Ų | 160 | 153 Ų | 153 | 84% | 0.838 | 82% | 0.816 | S | S | * | * | trans | -52.6 | 144.1 | 173.4 | -74 | 92 | 0 | 0 | 0 | 112.9 | S191 | L189-S191 PolarHBondContact O-N 2.96Š| ||
| 190 | P | 41.6 | Very low | 37.2 | Very low | 123 Ų | 123 | 151.3 Ų | 151.3 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | trans | -86.3 | 104.9 | 165.2 | 32 | -27.5 | 0 | 0 | 0 | 110.6 | F192 | P190-F192 PolarHBondContact O-N 2.99Š| ||
| 191 | S | 33.8 | Very low | 37 | Very low | 115 Ų | 115 | 154 Ų | 154 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | trans | -68 | 108.6 | 160.4 | -59.2 | 0 | 0 | 0 | 0 | 109.6 | L189 | L189-S191 PolarHBondContact O-N 2.96Š| ||
| 192 | F | 36 | Very low | 36.8 | Very low | 201 Ų | 201 | 153.8 Ų | 153.8 | 88% | 0.882 | 82% | 0.815 | S | S | * | * | trans | -107.3 | 81.6 | 174.2 | -138.5 | -89.8 | 0 | 0 | 0 | 110.2 | P190 | P190-F192 PolarHBondContact O-N 2.99Š| ||
| 193 | T | 39.6 | Very low | 37.7 | Very low | 114 Ų | 114 | 153.2 Ų | 153.2 | 70% | 0.699 | 81% | 0.81 | S | S | * | * | trans | -143.8 | 120 | 153.9 | 34.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 194 | Q | 40.1 | Very low | 37.5 | Very low | 178 Ų | 178 | 146.9 Ų | 146.9 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | trans | 74.8 | 106.9 | 138.8 | -60.6 | 179.6 | 88.8 | 0 | 0 | 119.2 | ||||
| 195 | Q | 32.2 | Very low | 37.8 | Very low | 194 Ų | 194 | 144.4 Ų | 144.4 | 91% | 0.907 | 81% | 0.807 | S | S | * | * | trans | -147.3 | 108.5 | 142.6 | -68.2 | -167.3 | -15.5 | 0 | 0 | 109.9 | ||||
| 196 | L | 34.8 | Very low | 37.3 | Very low | 177 Ų | 177 | 142.1 Ų | 142.1 | 93% | 0.927 | 81% | 0.807 | S | S | * | * | trans | -142.9 | 129.4 | 142.8 | -85.3 | 178.2 | 0 | 0 | 0 | 108.1 | ||||
| 197 | T | 35.9 | Very low | 37.2 | Very low | 131 Ų | 131 | 141 Ų | 141 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | -75.6 | 144.2 | -165.8 | 28.4 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 198 | T | 34.1 | Very low | 37.1 | Very low | 150 Ų | 150 | 138.7 Ų | 138.7 | 92% | 0.92 | 81% | 0.81 | S | S | * | * | trans | -155.8 | 138.2 | 133.4 | -31.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 199 | D | 30.5 | Very low | 36.6 | Very low | 145 Ų | 145 | 139.4 Ų | 139.4 | 78% | 0.775 | 81% | 0.812 | S | S | * | * | trans | -89 | 173.8 | -172.5 | -159.2 | -4.6 | 0 | 0 | 0 | 112 | ||||
| 200 | I | 35.8 | Very low | 36.5 | Very low | 150 Ų | 150 | 142.9 Ų | 142.9 | 77% | 0.769 | 81% | 0.814 | S | S | * | * | trans | 110.1 | 95.4 | 164 | -50.9 | 162.8 | 0 | 0 | 0 | 117.1 | ||||
| 201 | Y | 31.4 | Very low | 36.3 | Very low | 213 Ų | 213 | 143.9 Ų | 143.9 | 84% | 0.835 | 82% | 0.818 | S | S | * | * | trans | 45.8 | 115.1 | 143.7 | -92.4 | -99.2 | 0 | 0 | 0 | 124.4 | ||||
| 202 | S | 35.2 | Very low | 36.7 | Very low | 106 Ų | 106 | 148.7 Ų | 148.7 | 74% | 0.741 | 82% | 0.819 | S | S | * | * | 69.1 | 154.4 | 127.9 | -76.2 | 0 | 0 | 0 | 0 | 124.3 | |||||
| 203 | P | 53.5 | Low | 37.1 | Very low | 122 Ų | 122 | 151.2 Ų | 151.2 | 79% | 0.792 | 82% | 0.822 | S | S | * | * | trans | -114.2 | 153.2 | -142.1 | 40 | -29.6 | 0 | 0 | 0 | 116.1 | ||||
| 204 | A | 32.2 | Very low | 37.5 | Very low | 97 Ų | 97 | 153.4 Ų | 153.4 | 80% | 0.802 | 82% | 0.822 | S | S | * | * | trans | -170.9 | 152.9 | 150.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 205 | P | 45.3 | Very low | 37.6 | Very low | 135 Ų | 135 | 152.9 Ų | 152.9 | 88% | 0.877 | 82% | 0.817 | S | S | * | * | trans | -90.1 | 139.2 | -172.7 | 35.3 | -30.8 | 0 | 0 | 0 | 112.3 | ||||
| 206 | G | 30.3 | Very low | 38.2 | Very low | 74 Ų | 74 | 152 Ų | 152 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | -162.4 | 123.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 207 | S | 38.9 | Very low | 38.5 | Very low | 122 Ų | 122 | 147.3 Ų | 147.3 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | trans | -52.2 | 145.9 | 172.5 | 53.1 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 208 | S | 34 | Very low | 39.1 | Very low | 103 Ų | 103 | 148.9 Ų | 148.9 | 72% | 0.72 | 80% | 0.798 | S | S | * | * | trans | 179.1 | 123.5 | 131.4 | -161.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 209 | T | 32.8 | Very low | 39.6 | Very low | 117 Ų | 117 | 145.1 Ų | 145.1 | 72% | 0.718 | 79% | 0.788 | S | S | * | * | trans | 45.4 | 127.4 | 140.3 | 62.5 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 210 | R | 39.2 | Very low | 40.4 | Very low | 233 Ų | 233 | 150.4 Ų | 150.4 | 88% | 0.879 | 80% | 0.798 | S | S | * | * | trans | 53 | 114 | 135.5 | -80 | 170.5 | 63.7 | 170.2 | -2.4 | 118.3 | ||||
| 211 | T | 36.3 | Very low | 40.9 | Very low | 144 Ų | 144 | 149 Ų | 149 | 88% | 0.883 | 80% | 0.801 | S | S | * | * | -160.2 | 113.5 | 113.1 | 28.8 | 0 | 0 | 0 | 0 | 110.4 | R213 | T211-R213 PolarHBondContact O-N 3.16Š| |||
| 212 | R | 42.5 | Very low | 41.7 | Very low | 216 Ų | 216 | 150.1 Ų | 150.1 | 82% | 0.815 | 80% | 0.804 | S | S | * | * | trans | -84.9 | 100.9 | 176.9 | -179.3 | 179.4 | 170.3 | -175.9 | 1 | 108.8 | K214 | R212-K214 PolarHBondContact O-N 3.04Š| ||
| 213 | R | 44.6 | Very low | 42.6 | Very low | 254 Ų | 254 | 156.3 Ų | 156.3 | 96% | 0.958 | 81% | 0.811 | S | S | * | * | trans | -68.8 | 118.3 | 171.2 | -133.2 | 173.7 | -176.9 | 174.4 | 0.4 | 108.7 | T211 | T211-R213 PolarHBondContact O-N 3.16Š| ||
| 214 | K | 47.5 | Very low | 42.4 | Very low | 160 Ų | 160 | 156.9 Ų | 156.9 | 70% | 0.696 | 82% | 0.815 | S | S | * | * | trans | -107.6 | 150.7 | 175.7 | -112.4 | -175.6 | 178.5 | -179.9 | 0 | 109.3 | R212 | R212-K214 PolarHBondContact O-N 3.04Š| ||
| 215 | K | 42.8 | Very low | 43.2 | Very low | 168 Ų | 168 | 162 Ų | 162 | 73% | 0.73 | 82% | 0.819 | S | S | * | * | trans | 87.7 | 136.8 | 164.1 | -77.3 | -175.4 | 162.7 | 177.3 | 0 | 116 | ||||
| 216 | R | 43.7 | Very low | 43.2 | Very low | 176 Ų | 176 | 165.3 Ų | 165.3 | 66% | 0.664 | 82% | 0.82 | S | S | * | * | cis | -155.4 | 119 | 12.7 | -113.9 | 164.5 | -158.2 | -85.4 | 11.2 | 107.8 | ||||
| 217 | G | 42.9 | Very low | 43.8 | Very low | 78 Ų | 78 | 167.2 Ų | 167.2 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | trans | -97.7 | 128.2 | 160.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | G219 | G217-G219 PolarHBondContact O-N 3.17Š| ||
| 218 | H | 48 | Very low | 44.1 | Very low | 164 Ų | 164 | 166.8 Ų | 166.8 | 76% | 0.759 | 81% | 0.814 | S | S | * | * | trans | -79.9 | 75 | 175.2 | -69 | -81.5 | 0 | 0 | 0 | 109.7 | ||||
| 219 | G | 43.3 | Very low | 44.4 | Very low | 70 Ų | 70 | 172.4 Ų | 172.4 | 72% | 0.722 | 82% | 0.819 | S | S | * | * | trans | -83.5 | 113.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | G217 S221 | G217-G219 PolarHBondContact O-N 3.17Å; G219-S221 PolarHBondContact O-N 3.47Å | ||
| 220 | W | 47.2 | Very low | 44.7 | Very low | 256 Ų | 256 | 178.5 Ų | 178.5 | 97% | 0.97 | 83% | 0.829 | S | S | * | * | trans | -58.8 | 122.6 | 166.8 | -69.4 | 44 | 0 | 0 | 0 | 108.5 | ||||
| 221 | S | 48 | Very low | 44.9 | Very low | 121 Ų | 121 | 173.8 Ų | 173.8 | 85% | 0.846 | 83% | 0.826 | S | S | * | * | trans | -141.8 | 119.3 | 169.2 | -170.4 | 0 | 0 | 0 | 0 | 110.8 | G219 | G219-S221 PolarHBondContact O-N 3.47Š| ||
| 222 | R | 47.7 | Very low | 45.6 | Very low | 236 Ų | 236 | 175.3 Ų | 175.3 | 89% | 0.891 | 82% | 0.823 | S | S | * | * | trans | -80.4 | 143.4 | 178.2 | -48.9 | -172.1 | -147.1 | -165.9 | 6.3 | 109.7 | ||||
| 223 | R | 53.2 | Low | 45.9 | Very low | 236 Ų | 236 | 170.7 Ų | 170.7 | 89% | 0.891 | 82% | 0.821 | S | S | * | * | trans | 145.3 | 121.8 | 136.5 | -80.8 | 176.3 | -171.2 | -121.8 | 4.1 | 110.9 | ||||
| 224 | P | 49.1 | Very low | 46 | Very low | 135 Ų | 135 | 166.3 Ų | 166.3 | 88% | 0.877 | 82% | 0.816 | S | S | * | * | trans | -80.7 | 129.3 | 164.6 | 24.7 | -17 | 0 | 0 | 0 | 110.2 | ||||
| 225 | K | 49.9 | Very low | 46.2 | Very low | 203 Ų | 203 | 164.7 Ų | 164.7 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -84.9 | 122.2 | 177.8 | -168.1 | 167.8 | -178.6 | 176.7 | 0 | 109.5 | T227 | K225-T227 PolarHBondContact O-N 3.36Š| ||
| 226 | K | 45.5 | Very low | 46.5 | Very low | 206 Ų | 206 | 164.5 Ų | 164.5 | 90% | 0.896 | 83% | 0.828 | S | S | * | * | trans | -44.1 | 109.8 | 172.3 | -167.4 | 172.1 | -175.2 | 177.3 | 0 | 111.4 | ||||
| 227 | T | 43.2 | Very low | 46.8 | Very low | 114 Ų | 114 | 162.3 Ų | 162.3 | 70% | 0.699 | 84% | 0.836 | S | S | * | * | trans | -95.4 | 104.6 | 166.9 | 158.5 | 0 | 0 | 0 | 0 | 108.3 | K225 R229 | K225-T227 PolarHBondContact O-N 3.36Å; T227-R229 PolarHBondContact O-N 3.38Å | ||
| 228 | S | 43.7 | Very low | 47 | Very low | 113 Ų | 113 | 164.5 Ų | 164.5 | 79% | 0.79 | 84% | 0.839 | S | S | * | * | trans | -63.8 | 112.2 | 162.2 | 171.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 229 | R | 41.8 | Very low | 47.4 | Very low | 221 Ų | 221 | 160.8 Ų | 160.8 | 83% | 0.834 | 84% | 0.837 | S | S | * | * | trans | -106.8 | 124.1 | 157.1 | -83.9 | -170.6 | -177.6 | -160.9 | 1.3 | 107.7 | T227 V231 | T227-R229 PolarHBondContact O-N 3.38Å; R229-V231 PolarHBondContact O-N 3.48Å | ||
| 230 | R | 39.2 | Very low | 47.7 | Very low | 245 Ų | 245 | 163.5 Ų | 163.5 | 93% | 0.925 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 124.8 | 169.7 | -84.6 | -176.3 | 170.2 | -131.6 | 1.4 | 109.1 | ||
| 231 | V | 41.9 | Very low | 47.8 | Very low | 134 Ų | 134 | 160.6 Ų | 160.6 | 81% | 0.812 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 121.8 | 166.4 | 175.6 | 0 | 0 | 0 | 0 | 107.7 | R229 | R229-V231 PolarHBondContact O-N 3.48Š|
| 232 | Q | 52.5 | Low | 47.8 | Very low | 176 Ų | 176 | 164.8 Ų | 164.8 | 82% | 0.822 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 135.4 | 158.2 | -78.8 | -170.2 | 34.2 | 0 | 0 | 107.9 | ||
| 233 | P | 48 | Very low | 48.1 | Very low | 119 Ų | 119 | 160.3 Ų | 160.3 | 77% | 0.773 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 132.7 | 174.5 | -11.2 | 26.7 | 0 | 0 | 0 | 111.2 | ||
| 234 | L | 47.6 | Very low | 48.2 | Very low | 162 Ų | 162 | 154.8 Ų | 154.8 | 85% | 0.848 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 146.1 | 165 | -87.2 | 85 | 0 | 0 | 0 | 110.6 | ||
| 235 | P | 50.1 | Low | 48.2 | Very low | 125 Ų | 125 | 154.7 Ų | 154.7 | 81% | 0.812 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 141.7 | 170.3 | -7.8 | 24.7 | 0 | 0 | 0 | 112 | ||
| 236 | L | 49.6 | Very low | 47.8 | Very low | 165 Ų | 165 | 152.3 Ų | 152.3 | 86% | 0.864 | 87% | 0.872 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 150.3 | 172.5 | -69.7 | 156.2 | 0 | 0 | 0 | 112 | ||
| 237 | P | 50 | Low | 47.9 | Very low | 130 Ų | 130 | 149.6 Ų | 149.6 | 84% | 0.844 | 87% | 0.871 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 133.5 | 174 | 29.8 | -31.8 | 0 | 0 | 0 | 111.9 | ||
| 238 | S | 48.4 | Very low | 48.2 | Very low | 123 Ų | 123 | 151.5 Ų | 151.5 | 86% | 0.86 | 88% | 0.88 | S | S | * | * | P | Polyproline II helix | trans | -80 | 145.4 | 173.2 | 53.2 | 0 | 0 | 0 | 0 | 112.5 | ||
| 239 | A | 55.3 | Low | 48.4 | Very low | 87 Ų | 87 | 153.6 Ų | 153.6 | 72% | 0.719 | 89% | 0.885 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 167 | -170.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 240 | P | 50.4 | Low | 48.8 | Very low | 126 Ų | 126 | 149.6 Ų | 149.6 | 82% | 0.818 | 89% | 0.888 | S | S | * | * | P | Polyproline II helix | trans | -81 | 141.2 | -168 | 32.1 | -31.7 | 0 | 0 | 0 | 113.2 | K242 | P240-K242 PolarHBondContact O-N 3.23Š|
| 241 | Q | 48.1 | Very low | 49.4 | Very low | 196 Ų | 196 | 143.7 Ų | 143.7 | 92% | 0.916 | 89% | 0.885 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 118.5 | 179.2 | -64.8 | 178.7 | -22.4 | 0 | 0 | 110.7 | ||
| 242 | K | 47.8 | Very low | 49.9 | Very low | 208 Ų | 208 | 144.3 Ų | 144.3 | 90% | 0.904 | 89% | 0.89 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 120.9 | 164.2 | -88.6 | -177.9 | 171.5 | -171.7 | 0 | 109 | P240 | P240-K242 PolarHBondContact O-N 3.23Š|
| 243 | V | 55.8 | Low | 49.7 | Very low | 143 Ų | 143 | 142.1 Ų | 142.1 | 87% | 0.867 | 90% | 0.895 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 133.9 | 161.9 | -74.2 | 0 | 0 | 0 | 0 | 109.4 | ||
| 244 | S | 55.1 | Low | 49.8 | Very low | 120 Ų | 120 | 143.8 Ų | 143.8 | 84% | 0.839 | 91% | 0.905 | S | S | * | * | trans | -114.9 | 120.4 | 169 | -170.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 245 | C | 47.9 | Very low | 50 | Low | 132 Ų | 132 | 142.3 Ų | 142.3 | 89% | 0.892 | 91% | 0.909 | S | S | * | * | trans | -79 | 138.2 | 163.4 | -61.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 246 | G | 41.9 | Very low | 50 | Low | 153 Ų | 153 | 143.9 Ų | 143.9 | 100% | 1.577 | 92% | 0.918 | S | S | * | * | trans | -173.7 | 0 | 173.4 | 0 | 0 | 0 | 0 | 0 | 108.9 |
Retrieved 246 of 246 residues in 225.5 ms
(Link to these results)