| 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 | 37.4 | Very low | 41.5 | Very low | 241 Ų | 241 | 141.5 Ų | 141.5 | 100% | 1.187 | 76% | 0.762 | S | S | * | * | 0 | 136.4 | 0 | -71.4 | 172.3 | -179.5 | 0 | 0 | 107.8 | |||||
| 2 | N | 40.8 | Very low | 41.4 | Very low | 146 Ų | 146 | 142.3 Ų | 142.3 | 78% | 0.781 | 76% | 0.763 | S | S | * | * | trans | 82 | 66.2 | 178.3 | -62.6 | 0.7 | 0 | 0 | 0 | 118.3 | ||||
| 3 | V | 42.8 | Very low | 41 | Very low | 148 Ų | 148 | 146.7 Ų | 146.7 | 90% | 0.897 | 77% | 0.771 | S | S | * | * | trans | -112.9 | 69.2 | 155.8 | -176.9 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 4 | T | 47.9 | Very low | 40.6 | Very low | 95 Ų | 95 | 144.4 Ų | 144.4 | 58% | 0.583 | 77% | 0.766 | S | S | * | * | trans | -150.7 | 11 | -176.2 | 29 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 5 | N | 43.4 | Very low | 40.2 | Very low | 141 Ų | 141 | 146.7 Ų | 146.7 | 75% | 0.754 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -108.3 | 9.5 | -178.4 | -81.8 | -0.2 | 0 | 0 | 0 | 115.6 | ||
| 6 | R | 40.8 | Very low | 39.7 | Very low | 238 Ų | 238 | 147.4 Ų | 147.4 | 90% | 0.898 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -98.1 | -13.9 | 178.3 | -117.3 | -178.6 | -170.7 | -175 | 2.3 | 114.7 | ||
| 7 | S | 44.7 | Very low | 39.3 | Very low | 83 Ų | 83 | 146.2 Ų | 146.2 | 58% | 0.58 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -88.5 | -19.8 | -178.8 | 31.8 | 0 | 0 | 0 | 0 | 113.8 | ||
| 8 | L | 40 | Very low | 38.8 | Very low | 115 Ų | 115 | 143.3 Ų | 143.3 | 60% | 0.602 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -7.3 | -178.3 | -73.8 | 165.3 | 0 | 0 | 0 | 114.5 | ||
| 9 | A | 39.7 | Very low | 38.2 | Very low | 85 Ų | 85 | 145.8 Ų | 145.8 | 70% | 0.702 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 10 | V | 38.9 | Very low | 37.9 | Very low | 117 Ų | 117 | 143.2 Ų | 143.2 | 71% | 0.709 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -94.3 | -19.4 | -178.7 | 178.2 | 0 | 0 | 0 | 0 | 112 | ||
| 11 | E | 40.4 | Very low | 37.9 | Very low | 147 Ų | 147 | 145.9 Ų | 145.9 | 69% | 0.687 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | -3 | -173.3 | -101.7 | 167.5 | 170.6 | 0 | 0 | 115.8 | T14 | E11-T14 PolarHBondContact O-OG1 3.08Š|
| 12 | I | 40 | Very low | 38.3 | Very low | 151 Ų | 151 | 140 Ų | 140 | 77% | 0.774 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.7 | 1.8 | -178.2 | -58.4 | 177.6 | 0 | 0 | 0 | 112.8 | T14 | I12-T14 VanDerWaalsContact C-N 3.31Å; I12-T14 PolarHBondContact O-N 3.43Å |
| 13 | K | 36.2 | Very low | 38.9 | Very low | 200 Ų | 200 | 135.7 Ų | 135.7 | 87% | 0.87 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -91.2 | 14.8 | 177.2 | -143.7 | 172.5 | -175.4 | 179.6 | 0 | 114.3 | ||
| 14 | T | 35.3 | Very low | 39.8 | Very low | 115 Ų | 115 | 131.9 Ų | 131.9 | 71% | 0.706 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -108.5 | 15.9 | -169 | -7.1 | 0 | 0 | 0 | 0 | 115 | E11 I12 | E11-T14 PolarHBondContact O-OG1 3.08Å; I12-T14 VanDerWaalsContact C-N 3.31Å; I12-T14 PolarHBondContact O-N 3.43Å |
| 15 | E | 34.9 | Very low | 40.9 | Very low | 178 Ų | 178 | 127.4 Ų | 127.4 | 83% | 0.832 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -142.3 | 83.3 | 175.7 | -71.1 | -178 | 161.3 | 0 | 0 | 110 | ||
| 16 | N | 31.5 | Very low | 42.6 | Very low | 159 Ų | 159 | 124 Ų | 124 | 85% | 0.85 | 67% | 0.67 | S | S | * | * | trans | 175 | 9.4 | 153 | -96.8 | -12.8 | 0 | 0 | 0 | 117.2 | S18 | N16-S18 VanDerWaalsContact C-N 3.34Å; N16-S18 PolarHBondContact O-N 3.25Å | ||
| 17 | S | 33.7 | Very low | 44.6 | Very low | 127 Ų | 127 | 120.3 Ų | 120.3 | 89% | 0.888 | 66% | 0.657 | S | S | * | * | trans | -92.9 | 62 | 174.9 | 60.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 18 | S | 29.2 | Very low | 46.5 | Very low | 94 Ų | 94 | 122.3 Ų | 122.3 | 66% | 0.657 | 66% | 0.657 | S | S | * | * | trans | -79.8 | 134.2 | 149.8 | 49.7 | 0 | 0 | 0 | 0 | 107.9 | N16 | N16-S18 VanDerWaalsContact C-N 3.34Å; N16-S18 PolarHBondContact O-N 3.25Å | ||
| 19 | E | 28.5 | Very low | 48.7 | Very low | 191 Ų | 191 | 119.4 Ų | 119.4 | 89% | 0.893 | 64% | 0.642 | S | S | * | * | S | Bend | trans | 89.8 | 130.4 | 171.1 | -55.7 | 179.3 | 150.5 | 0 | 0 | 117.8 | ||
| 20 | S | 31.5 | Very low | 50.8 | Low | 92 Ų | 92 | 116.9 Ų | 116.9 | 64% | 0.643 | 62% | 0.616 | S | S | * | * | trans | 86 | 74.2 | 166.9 | -175.8 | 0 | 0 | 0 | 0 | 118.1 | T22 | S20-T22 PolarHBondContact O-N 3.29Å; S20-T22 WeakPolarHBondContact OG-CG2 3.39Å | ||
| 21 | E | 38.3 | Very low | 53.1 | Low | 201 Ų | 201 | 115.2 Ų | 115.2 | 94% | 0.939 | 60% | 0.602 | S | S | * | * | trans | -57.6 | 97.2 | 137.1 | -81.8 | -171.6 | 162.9 | 0 | 0 | 106.7 | S23 | E21-S23 VanDerWaalsContact C-N 3.31Å; E21-S23 PolarHBondContact O-N 3.49Å | ||
| 22 | T | 45.6 | Very low | 55.4 | Low | 116 Ų | 116 | 112 Ų | 112 | 71% | 0.712 | 59% | 0.592 | S | S | * | * | trans | -63.7 | 91.6 | -178.9 | 38.5 | 0 | 0 | 0 | 0 | 109 | S20 F24 | S20-T22 PolarHBondContact O-N 3.29Å; S20-T22 WeakPolarHBondContact OG-CG2 3.39Å; T22-F24 PolarHBondContact O-N 3.26Å; T22-F24 VanDerWaalsContact O-N 3.09Å | ||
| 23 | S | 54.6 | Low | 57.7 | Low | 57 Ų | 57 | 105.7 Ų | 105.7 | 40% | 0.399 | 56% | 0.56 | S | S | . | * | trans | -50.8 | 118.2 | 153.4 | 56.3 | 0 | 0 | 0 | 0 | 106.9 | E21 L25 | E21-S23 VanDerWaalsContact C-N 3.31Å; E21-S23 PolarHBondContact O-N 3.49Å; S23-L25 PolarHBondContact O-N 3.22Å; S23-L25 PolarHBondContact OG-O 3.04Å | ||
| 24 | F | 61.1 | Low | 60.3 | Low | 67 Ų | 67 | 98.1 Ų | 98.1 | 29% | 0.294 | 53% | 0.531 | S | S | . | . | S | Bend | trans | -61.1 | -15.4 | -173 | -175.7 | -81.4 | 0 | 0 | 0 | 113 | T22 G236 Q237 F240 | T22-F24 PolarHBondContact O-N 3.26Å; T22-F24 VanDerWaalsContact O-N 3.09Å; F24-G236 WeakPolarHBondContact CZ-O 3.46Å; F24-Q237 HydrophobicContact CD1-CG 4.26Å; F24-Q237 HydrophobicContact CE1-CB 4.09Å; F24-Q237 HydrophobicContact CE1-CG 3.79Å; F24-Q237 WeakPolarHBondContact CE1-O 3.43Å; F24-Q237 HydrophobicContact CZ-CB 4.15Å; F24-Q237 HydrophobicContact CZ-CG 4.35Å; F24-F240 HydrophobicContact CD1-CB 4.02Å; F24-F240 AromaticContact CD1-CD1 3.39Å; F24-F240 HydrophobicContact CD1-CD1 3.39Å; F24-F240 HydrophobicContact CD1-CD2 4.38Å; F24-F240 AromaticContact CD1-CE1 3.91Å; F24-F240 HydrophobicContact CD1-CE1 3.91Å; F24-F240 AromaticContact CD1-CG 3.68Å; F24-F240 HydrophobicContact CD1-CG 3.68Å; F24-F240 HydrophobicContact CE1-CB 3.18Å; F24-F240 AromaticContact CE1-CD1 3.38Å; F24-F240 HydrophobicContact CE1-CD1 3.38Å; F24-F240 HydrophobicContact CE1-CD2 4.3Å; F24-F240 HydrophobicContact CE1-CE1 4.34Å; F24-F240 AromaticContact CE1-CG 3.37Å; F24-F240 HydrophobicContact CE1-CG 3.37Å; F24-F240 HydrophobicContact CZ-CB 3.43Å; F24-F240 VanDerWaalsContact CZ-CB 3.43Å; F24-F240 HydrophobicContact CZ-CD1 4.41Å; F24-F240 AromaticContact CZ-CG 3.98Å; F24-F240 HydrophobicContact CZ-CG 3.98Å |
| 25 | L | 69.9 | Low | 63 | Low | 2 Ų | 2 | 97.5 Ų | 97.5 | 1% | 0.01 | 52% | 0.523 | C | S | . | . | S | Bend | trans | -115.5 | 140.6 | 173 | -65.7 | 177.6 | 0 | 0 | 0 | 109.6 | S23 I29 Q30 L33 F240 I241 | S23-L25 PolarHBondContact O-N 3.22Å; S23-L25 PolarHBondContact OG-O 3.04Å; L25-I29 HydrophobicContact CB-CB 4.27Å; L25-I29 HydrophobicContact CB-CG2 4.33Å; L25-I29 HydrophobicContact CD1-CG2 4.07Å; L25-I29 HydrophobicContact CD2-CB 4.47Å; L25-I29 HydrophobicContact CD2-CD1 4.42Å; L25-I29 HydrophobicContact CD2-CG2 3.84Å; L25-I29 HydrophobicContact CG-CG2 4.31Å; L25-Q30 HydrophobicContact CB-CG 3.71Å; L25-Q30 HydrophobicContact CD1-CG 4.14Å; L25-L33 HydrophobicContact CD1-CD1 3.45Å; L25-L33 VanDerWaalsContact CD1-CD1 3.45Å; L25-F240 HydrophobicContact CD1-CE1 3.59Å; L25-F240 HydrophobicContact CD1-CZ 4.38Å; L25-F240 HydrophobicContact CD2-CD1 4.03Å; L25-F240 HydrophobicContact CD2-CE1 3.89Å; L25-F240 HydrophobicContact CG-CD1 4.22Å; L25-F240 HydrophobicContact CG-CE1 3.6Å; L25-I241 HydrophobicContact CD2-CG1 3.91Å |
| 26 | T | 80.5 | Confident | 65.7 | Low | 68 Ų | 68 | 92.3 Ų | 92.3 | 42% | 0.417 | 50% | 0.5 | S | S | . | . | trans | -59.2 | 150.3 | 168.4 | 63.8 | 0 | 0 | 0 | 0 | 110.3 | E28 I29 Q30 | T26-E28 PolarHBondContact O-N 3.23Å; T26-E28 VanDerWaalsContact O-N 3.09Å; T26-I29 PolarHBondContact O-N 3.18Å; T26-I29 WeakPolarHBondContact OG1-CD1 3.41Å; T26-I29 VanDerWaalsContact OG1-CG1 3.28Å; T26-I29 WeakPolarHBondContact OG1-CG1 3.45Å; T26-I29 PolarHBondContact OG1-N 3.35Å; T26-Q30 PolarHBondContact O-N 3.47Å | ||
| 27 | Y | 82 | Confident | 68.6 | Low | 161 Ų | 161 | 85.3 Ų | 85.3 | 63% | 0.631 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -51.5 | -36.4 | 177.6 | 116.2 | -91.7 | 0 | 0 | 0 | 111.8 | I29 Q30 L31 | Y27-I29 PolarHBondContact O-N 3.43Å; Y27-Q30 PolarHBondContact O-N 3.48Å; Y27-L31 HydrophobicContact CE2-CD2 4.08Å; Y27-L31 WeakPolarHBondContact O-CB 3.27Å; Y27-L31 PolarHBondContact O-N 3.46Å |
| 28 | E | 85 | Confident | 71.5 | Confident | 125 Ų | 125 | 82.9 Ų | 82.9 | 58% | 0.584 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62.2 | -42.8 | 178.7 | -60.4 | 176.1 | 169.1 | 0 | 0 | 111.7 | T26 T32 | T26-E28 PolarHBondContact O-N 3.23Å; T26-E28 VanDerWaalsContact O-N 3.09Å; E28-T32 WeakPolarHBondContact O-CB 3.47Å; E28-T32 PolarHBondContact O-N 3.13Å; E28-T32 PolarHBondContact O-OG1 2.92Å |
| 29 | I | 85 | Confident | 74.6 | Confident | 55 Ų | 55 | 83.5 Ų | 83.5 | 28% | 0.282 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.3 | -44.5 | 177 | -62.1 | 166.1 | 0 | 0 | 0 | 109.9 | L25 T26 Y27 L31 T32 L33 | L25-I29 HydrophobicContact CB-CB 4.27Å; L25-I29 HydrophobicContact CB-CG2 4.33Å; L25-I29 HydrophobicContact CD1-CG2 4.07Å; L25-I29 HydrophobicContact CD2-CB 4.47Å; L25-I29 HydrophobicContact CD2-CD1 4.42Å; L25-I29 HydrophobicContact CD2-CG2 3.84Å; L25-I29 HydrophobicContact CG-CG2 4.31Å; T26-I29 PolarHBondContact O-N 3.18Å; T26-I29 WeakPolarHBondContact OG1-CD1 3.41Å; T26-I29 VanDerWaalsContact OG1-CG1 3.28Å; T26-I29 WeakPolarHBondContact OG1-CG1 3.45Å; T26-I29 PolarHBondContact OG1-N 3.35Å; Y27-I29 PolarHBondContact O-N 3.43Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 2.95Å; I29-T32 PolarHBondContact O-N 3.24Å; I29-L33 HydrophobicContact CG2-CD1 3.89Å; I29-L33 HydrophobicContact CG2-CG 4.19Å; I29-L33 WeakPolarHBondContact O-CB 3.27Å; I29-L33 VanDerWaalsContact O-CG 3.25Å; I29-L33 WeakPolarHBondContact O-CG 3.03Å; I29-L33 PolarHBondContact O-N 3.41Å |
| 30 | Q | 83.7 | Confident | 77.7 | Confident | 32 Ų | 32 | 74.6 Ų | 74.6 | 15% | 0.15 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -60.3 | -43 | 177.3 | -66.5 | -171.6 | -35 | 0 | 0 | 112.2 | L25 T26 Y27 L33 T34 I93 | L25-Q30 HydrophobicContact CB-CG 3.71Å; L25-Q30 HydrophobicContact CD1-CG 4.14Å; T26-Q30 PolarHBondContact O-N 3.47Å; Y27-Q30 PolarHBondContact O-N 3.48Å; Q30-L33 PolarHBondContact O-N 3.49Å; Q30-T34 WeakPolarHBondContact O-CB 3.48Å; Q30-T34 PolarHBondContact O-N 3.49Å; Q30-T34 PolarHBondContact O-OG1 3.42Å; Q30-I93 PolarHBondContact NE2-O 3.19Å; Q30-I93 VanDerWaalsContact NE2-O 3.14Å |
| 31 | L | 87.8 | Confident | 80.7 | Confident | 82 Ų | 82 | 71.6 Ų | 71.6 | 43% | 0.429 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.5 | -47 | 175.4 | 179 | 62 | 0 | 0 | 0 | 110.8 | Y27 I29 L33 T34 L35 | Y27-L31 HydrophobicContact CE2-CD2 4.08Å; Y27-L31 WeakPolarHBondContact O-CB 3.27Å; Y27-L31 PolarHBondContact O-N 3.46Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 2.95Å; L31-L33 PolarHBondContact O-N 2.75Å; L31-T34 PolarHBondContact O-N 3.06Å; L31-L35 HydrophobicContact CD1-CD1 4.47Å; L31-L35 HydrophobicContact CD1-CG 4.4Å; L31-L35 HydrophobicContact CG-CD1 4.31Å; L31-L35 WeakPolarHBondContact O-CG 3.32Å; L31-L35 PolarHBondContact O-N 3.43Å |
| 32 | T | 89.5 | Confident | 83.5 | Confident | 78 Ų | 78 | 67 Ų | 67 | 48% | 0.479 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -59.1 | -47 | 177.9 | -59.3 | 0 | 0 | 0 | 0 | 111.4 | E28 I29 T34 L35 I36 | E28-T32 WeakPolarHBondContact O-CB 3.47Å; E28-T32 PolarHBondContact O-N 3.13Å; E28-T32 PolarHBondContact O-OG1 2.92Å; I29-T32 PolarHBondContact O-N 3.24Å; T32-T34 VanDerWaalsContact C-N 3.34Å; T32-T34 PolarHBondContact O-N 3.3Å; T32-L35 PolarHBondContact O-N 3.4Å; T32-I36 HydrophobicContact CG2-CD1 3.99Å; T32-I36 VanDerWaalsContact O-CG1 3.3Å; T32-I36 WeakPolarHBondContact O-CG1 3.32Å; T32-I36 PolarHBondContact O-N 3.47Å |
| 33 | L | 88.2 | Confident | 85.8 | Confident | 19 Ų | 19 | 64.2 Ų | 64.2 | 10% | 0.099 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62 | -41.5 | 176.9 | -70.3 | 171.6 | 0 | 0 | 0 | 112.1 | L25 I29 Q30 L31 I36 L37 V244 M248 | L25-L33 HydrophobicContact CD1-CD1 3.45Å; L25-L33 VanDerWaalsContact CD1-CD1 3.45Å; I29-L33 HydrophobicContact CG2-CD1 3.89Å; I29-L33 HydrophobicContact CG2-CG 4.19Å; I29-L33 WeakPolarHBondContact O-CB 3.27Å; I29-L33 VanDerWaalsContact O-CG 3.25Å; I29-L33 WeakPolarHBondContact O-CG 3.03Å; I29-L33 PolarHBondContact O-N 3.41Å; Q30-L33 PolarHBondContact O-N 3.49Å; L31-L33 PolarHBondContact O-N 2.75Å; L33-I36 PolarHBondContact O-N 3.33Å; L33-L37 WeakPolarHBondContact O-CB 3.33Å; L33-L37 VanDerWaalsContact O-CG 3.32Å; L33-L37 WeakPolarHBondContact O-CG 3.38Å; L33-L37 PolarHBondContact O-N 3.22Å; L33-V244 HydrophobicContact CD1-CG1 3.73Å; L33-V244 HydrophobicContact CD2-CG1 3.53Å; L33-V244 HydrophobicContact CG-CG1 4.25Å; L33-M248 HydrophobicContact CD2-CG 4.39Å |
| 34 | T | 89.9 | Confident | 87.7 | Confident | 42 Ų | 42 | 61.5 Ų | 61.5 | 26% | 0.258 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.5 | -45.3 | 177.6 | -57.6 | 0 | 0 | 0 | 0 | 110.9 | Q30 L31 T32 I36 L37 V38 I93 | Q30-T34 WeakPolarHBondContact O-CB 3.48Å; Q30-T34 PolarHBondContact O-N 3.49Å; Q30-T34 PolarHBondContact O-OG1 3.42Å; L31-T34 PolarHBondContact O-N 3.06Å; T32-T34 VanDerWaalsContact C-N 3.34Å; T32-T34 PolarHBondContact O-N 3.3Å; T34-I36 PolarHBondContact O-N 3.4Å; T34-L37 PolarHBondContact O-N 3.41Å; T34-V38 VanDerWaalsContact O-CG2 3.3Å; T34-V38 WeakPolarHBondContact O-CG2 3.49Å; T34-V38 PolarHBondContact O-N 3.41Å; T34-I93 HydrophobicContact CG2-CD1 4.04Å; T34-I93 VanDerWaalsContact OG1-CD1 3.31Å; T34-I93 WeakPolarHBondContact OG1-CD1 3.49Å |
| 35 | L | 92.7 | Very high | 89.4 | Confident | 102 Ų | 102 | 60.9 Ų | 60.9 | 53% | 0.534 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62 | -42.5 | 176.4 | -68.3 | 174.8 | 0 | 0 | 0 | 111.8 | L31 T32 V38 L39 | L31-L35 HydrophobicContact CD1-CD1 4.47Å; L31-L35 HydrophobicContact CD1-CG 4.4Å; L31-L35 HydrophobicContact CG-CD1 4.31Å; L31-L35 WeakPolarHBondContact O-CG 3.32Å; L31-L35 PolarHBondContact O-N 3.43Å; T32-L35 PolarHBondContact O-N 3.4Å; L35-V38 PolarHBondContact O-N 3.25Å; L35-L39 VanDerWaalsContact O-CG 3.31Å; L35-L39 WeakPolarHBondContact O-CG 3.48Å; L35-L39 PolarHBondContact O-N 3.21Å |
| 36 | I | 92.4 | Very high | 90.6 | Very high | 69 Ų | 69 | 63.7 Ų | 63.7 | 35% | 0.354 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.4 | -46.1 | 175.4 | -69.2 | 167 | 0 | 0 | 0 | 110.8 | T32 L33 T34 L39 I40 | T32-I36 HydrophobicContact CG2-CD1 3.99Å; T32-I36 VanDerWaalsContact O-CG1 3.3Å; T32-I36 WeakPolarHBondContact O-CG1 3.32Å; T32-I36 PolarHBondContact O-N 3.47Å; L33-I36 PolarHBondContact O-N 3.33Å; T34-I36 PolarHBondContact O-N 3.4Å; I36-L39 PolarHBondContact O-N 3.35Å; I36-I40 HydrophobicContact CG2-CD1 3.77Å; I36-I40 HydrophobicContact CG2-CG1 4.4Å; I36-I40 VanDerWaalsContact O-CG1 3.3Å; I36-I40 WeakPolarHBondContact O-CG1 3.3Å; I36-I40 PolarHBondContact O-N 3.34Å |
| 37 | L | 91.9 | Very high | 91.2 | Very high | 12 Ų | 12 | 60.8 Ų | 60.8 | 6% | 0.063 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.7 | -44 | 178.2 | -78.4 | 166.6 | 0 | 0 | 0 | 112.2 | L33 T34 L39 I40 V41 V85 Y92 M248 Y251 | L33-L37 WeakPolarHBondContact O-CB 3.33Å; L33-L37 VanDerWaalsContact O-CG 3.32Å; L33-L37 WeakPolarHBondContact O-CG 3.38Å; L33-L37 PolarHBondContact O-N 3.22Å; T34-L37 PolarHBondContact O-N 3.41Å; L37-L39 VanDerWaalsContact C-N 3.33Å; L37-L39 PolarHBondContact O-N 3.36Å; L37-I40 PolarHBondContact O-N 3.49Å; L37-V41 WeakPolarHBondContact O-CG2 3.4Å; L37-V41 PolarHBondContact O-N 3.1Å; L37-V85 HydrophobicContact CD2-CG1 3.63Å; L37-Y92 HydrophobicContact CD1-CD2 4.29Å; L37-M248 HydrophobicContact CD1-CE 3.94Å; L37-M248 HydrophobicContact CD1-SD 4.43Å; L37-M248 HydrophobicContact CD2-CE 3.73Å; L37-M248 HydrophobicContact CD2-SD 3.42Å; L37-M248 WeakPolarHBondContact CD2-SD 3.07Å; L37-M248 HydrophobicContact CG-CE 3.87Å; L37-M248 HydrophobicContact CG-SD 3.7Å; L37-Y251 HydrophobicContact CD2-CD2 3.95Å; L37-Y251 HydrophobicContact CD2-CE2 3.97Å |
| 38 | V | 93.7 | Very high | 91.8 | Very high | 75 Ų | 75 | 53.1 Ų | 53.1 | 46% | 0.455 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.2 | -44.9 | 175.6 | 169.9 | 0 | 0 | 0 | 0 | 110.4 | T34 L35 I40 V41 L42 | T34-V38 VanDerWaalsContact O-CG2 3.3Å; T34-V38 WeakPolarHBondContact O-CG2 3.49Å; T34-V38 PolarHBondContact O-N 3.41Å; L35-V38 PolarHBondContact O-N 3.25Å; V38-I40 PolarHBondContact O-N 3.01Å; V38-V41 PolarHBondContact O-N 3.31Å; V38-L42 HydrophobicContact CG1-CD1 3.83Å; V38-L42 HydrophobicContact CG1-CG 4.29Å; V38-L42 WeakPolarHBondContact O-CB 3.45Å; V38-L42 VanDerWaalsContact O-CG 3.26Å; V38-L42 WeakPolarHBondContact O-CG 3.41Å; V38-L42 PolarHBondContact O-N 3.02Å |
| 39 | L | 94.4 | Very high | 92.4 | Very high | 107 Ų | 107 | 50.5 Ų | 50.5 | 56% | 0.56 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -61.9 | -43.9 | 176.4 | -72.1 | 172.6 | 0 | 0 | 0 | 112.2 | L35 I36 L37 V41 L42 V43 | L35-L39 VanDerWaalsContact O-CG 3.31Å; L35-L39 WeakPolarHBondContact O-CG 3.48Å; L35-L39 PolarHBondContact O-N 3.21Å; I36-L39 PolarHBondContact O-N 3.35Å; L37-L39 VanDerWaalsContact C-N 3.33Å; L37-L39 PolarHBondContact O-N 3.36Å; L39-V41 VanDerWaalsContact C-N 3.34Å; L39-V41 PolarHBondContact O-N 3.11Å; L39-L42 PolarHBondContact O-N 2.9Å; L39-V43 WeakPolarHBondContact O-CB 3.09Å; L39-V43 VanDerWaalsContact O-CG2 3.27Å; L39-V43 WeakPolarHBondContact O-CG2 3.23Å; L39-V43 PolarHBondContact O-N 2.97Å |
| 40 | I | 93.9 | Very high | 92.7 | Very high | 5 Ų | 5 | 53.9 Ų | 53.9 | 3% | 0.026 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.5 | -46.2 | 175.6 | -73.6 | 169.6 | 0 | 0 | 0 | 110.5 | I36 L37 V38 G44 V85 M248 L252 C255 | I36-I40 HydrophobicContact CG2-CD1 3.77Å; I36-I40 HydrophobicContact CG2-CG1 4.4Å; I36-I40 VanDerWaalsContact O-CG1 3.3Å; I36-I40 WeakPolarHBondContact O-CG1 3.3Å; I36-I40 PolarHBondContact O-N 3.34Å; L37-I40 PolarHBondContact O-N 3.49Å; V38-I40 PolarHBondContact O-N 3.01Å; I40-G44 WeakPolarHBondContact O-CA 3.45Å; I40-G44 PolarHBondContact O-N 3.42Å; I40-V85 HydrophobicContact CG2-CG1 4.16Å; I40-M248 HydrophobicContact CD1-SD 4.5Å; I40-L252 HydrophobicContact CD1-CD2 4.26Å; I40-L252 HydrophobicContact CD1-CG 4.31Å; I40-L252 HydrophobicContact CG1-CD2 3.95Å; I40-C255 PolarHBondContact O-SG 2.7Å |
| 41 | V | 95.1 | Very high | 93.2 | Very high | 28 Ų | 28 | 52.6 Ų | 52.6 | 17% | 0.17 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.9 | -47.8 | 179.3 | 172 | 0 | 0 | 0 | 0 | 111 | L37 V38 L39 I45 V81 V85 P86 | L37-V41 WeakPolarHBondContact O-CG2 3.4Å; L37-V41 PolarHBondContact O-N 3.1Å; V38-V41 PolarHBondContact O-N 3.31Å; L39-V41 VanDerWaalsContact C-N 3.34Å; L39-V41 PolarHBondContact O-N 3.11Å; V41-I45 HydrophobicContact CG1-CD1 3.63Å; V41-I45 HydrophobicContact CG1-CG1 4.42Å; V41-I45 WeakPolarHBondContact O-CB 3.48Å; V41-I45 VanDerWaalsContact O-CG1 3.23Å; V41-I45 WeakPolarHBondContact O-CG1 3.37Å; V41-I45 PolarHBondContact O-N 3.35Å; V41-V81 HydrophobicContact CB-CG1 4.35Å; V41-V81 HydrophobicContact CG1-CG1 4.28Å; V41-V81 HydrophobicContact CG2-CG1 4.37Å; V41-V85 HydrophobicContact CG2-CB 4.04Å; V41-V85 HydrophobicContact CG2-CG1 3.61Å; V41-P86 HydrophobicContact CG2-CG 4.25Å |
| 42 | L | 95.7 | Very high | 93.4 | Very high | 104 Ų | 104 | 50.4 Ų | 50.4 | 55% | 0.545 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.5 | -49.8 | -179.1 | -69.3 | 176 | 0 | 0 | 0 | 112.2 | V38 L39 A46 | V38-L42 HydrophobicContact CG1-CD1 3.83Å; V38-L42 HydrophobicContact CG1-CG 4.29Å; V38-L42 WeakPolarHBondContact O-CB 3.45Å; V38-L42 VanDerWaalsContact O-CG 3.26Å; V38-L42 WeakPolarHBondContact O-CG 3.41Å; V38-L42 PolarHBondContact O-N 3.02Å; L39-L42 PolarHBondContact O-N 2.9Å; L42-A46 WeakPolarHBondContact O-CB 3.39Å; L42-A46 PolarHBondContact O-N 3.43Å |
| 43 | V | 95.3 | Very high | 93.6 | Very high | 59 Ų | 59 | 48.1 Ų | 48.1 | 36% | 0.358 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -66.4 | -42.3 | 179.5 | 174.8 | 0 | 0 | 0 | 0 | 110.7 | L39 G47 C255 F259 | L39-V43 WeakPolarHBondContact O-CB 3.09Å; L39-V43 VanDerWaalsContact O-CG2 3.27Å; L39-V43 WeakPolarHBondContact O-CG2 3.23Å; L39-V43 PolarHBondContact O-N 2.97Å; V43-G47 PolarHBondContact O-N 3.46Å; V43-C255 HydrophobicContact CG1-CB 4.09Å; V43-F259 HydrophobicContact CG1-CE2 3.94Å; V43-F259 HydrophobicContact CG1-CZ 4.28Å |
| 44 | G | 95 | Very high | 93.6 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.5 | -48.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | I40 N48 | I40-G44 WeakPolarHBondContact O-CA 3.45Å; I40-G44 PolarHBondContact O-N 3.42Å; G44-N48 WeakPolarHBondContact O-CB 3.15Å; G44-N48 PolarHBondContact O-N 2.94Å; G44-N48 PolarHBondContact O-ND2 3.07Å |
| 45 | I | 96.5 | Very high | 93.7 | Very high | 53 Ų | 53 | 47 Ų | 47 | 27% | 0.272 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -65 | -54.1 | 176.8 | -67.3 | 169.6 | 0 | 0 | 0 | 110.2 | V41 G47 N48 V49 L78 V81 L82 | V41-I45 HydrophobicContact CG1-CD1 3.63Å; V41-I45 HydrophobicContact CG1-CG1 4.42Å; V41-I45 WeakPolarHBondContact O-CB 3.48Å; V41-I45 VanDerWaalsContact O-CG1 3.23Å; V41-I45 WeakPolarHBondContact O-CG1 3.37Å; V41-I45 PolarHBondContact O-N 3.35Å; I45-G47 PolarHBondContact O-N 3.29Å; I45-N48 PolarHBondContact O-N 3.46Å; I45-V49 HydrophobicContact CG2-CG2 4.16Å; I45-V49 VanDerWaalsContact O-CB 3.29Å; I45-V49 WeakPolarHBondContact O-CB 3.26Å; I45-V49 VanDerWaalsContact O-CG2 3.23Å; I45-V49 WeakPolarHBondContact O-CG2 3.34Å; I45-V49 PolarHBondContact O-N 2.98Å; I45-L78 HydrophobicContact CB-CD1 4.38Å; I45-L78 HydrophobicContact CG1-CD1 4.12Å; I45-L78 HydrophobicContact CG2-CD1 4.34Å; I45-V81 HydrophobicContact CD1-CG1 4.48Å; I45-V81 HydrophobicContact CG1-CG1 3.84Å; I45-L82 HydrophobicContact CD1-CD2 3.75Å; I45-L82 HydrophobicContact CG1-CD2 4.13Å |
| 46 | A | 95.3 | Very high | 93.7 | Very high | 61 Ų | 61 | 46.3 Ų | 46.3 | 50% | 0.504 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -59.8 | -46.8 | -175 | 0 | 0 | 0 | 0 | 0 | 112.1 | L42 M50 | L42-A46 WeakPolarHBondContact O-CB 3.39Å; L42-A46 PolarHBondContact O-N 3.43Å; A46-M50 WeakPolarHBondContact O-CB 3.3Å; A46-M50 PolarHBondContact O-N 3.23Å |
| 47 | G | 93 | Very high | 93.7 | Very high | 7 Ų | 7 | 52.9 Ų | 52.9 | 7% | 0.072 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.4 | -48.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V43 I45 M50 L51 P258 | V43-G47 PolarHBondContact O-N 3.46Å; I45-G47 PolarHBondContact O-N 3.29Å; G47-M50 PolarHBondContact O-N 3.42Å; G47-L51 WeakPolarHBondContact O-CB 3.07Å; G47-L51 PolarHBondContact O-N 3.17Å; G47-P258 WeakPolarHBondContact O-CB 3.21Å; G47-P258 WeakPolarHBondContact O-CG 3.3Å |
| 48 | N | 94.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -70.1 | -41.2 | -177.8 | -73.3 | -65.6 | 0 | 0 | 0 | 111.8 | G44 I45 M50 L51 M52 L78 S254 | G44-N48 WeakPolarHBondContact O-CB 3.15Å; G44-N48 PolarHBondContact O-N 2.94Å; G44-N48 PolarHBondContact O-ND2 3.07Å; I45-N48 PolarHBondContact O-N 3.46Å; N48-M50 PolarHBondContact O-N 3.44Å; N48-L51 PolarHBondContact O-N 3.11Å; N48-M52 WeakPolarHBondContact O-CB 3.16Å; N48-M52 WeakPolarHBondContact O-CG 3.33Å; N48-M52 PolarHBondContact O-N 2.86Å; N48-L78 HydrophobicContact CB-CB 4.37Å; N48-S254 PolarHBondContact ND2-O 2.92Å |
| 49 | V | 96 | Very high | 93.1 | Very high | 71 Ų | 71 | 58.2 Ų | 58.2 | 43% | 0.43 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.9 | -43.4 | 175 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | I45 M52 A53 L78 | I45-V49 HydrophobicContact CG2-CG2 4.16Å; I45-V49 VanDerWaalsContact O-CB 3.29Å; I45-V49 WeakPolarHBondContact O-CB 3.26Å; I45-V49 VanDerWaalsContact O-CG2 3.23Å; I45-V49 WeakPolarHBondContact O-CG2 3.34Å; I45-V49 PolarHBondContact O-N 2.98Å; V49-M52 PolarHBondContact O-N 3.11Å; V49-A53 WeakPolarHBondContact O-CB 3.3Å; V49-A53 PolarHBondContact O-N 3.3Å; V49-L78 HydrophobicContact CG2-CD1 4.12Å; V49-L78 HydrophobicContact CG2-CD2 4.05Å |
| 50 | M | 92.9 | Very high | 92.6 | Very high | 125 Ų | 125 | 56.5 Ų | 56.5 | 62% | 0.616 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -61.7 | -45.2 | 176.3 | -179.1 | -179 | 65.8 | 0 | 0 | 111.7 | A46 G47 N48 A53 M54 | A46-M50 WeakPolarHBondContact O-CB 3.3Å; A46-M50 PolarHBondContact O-N 3.23Å; G47-M50 PolarHBondContact O-N 3.42Å; N48-M50 PolarHBondContact O-N 3.44Å; M50-A53 PolarHBondContact O-N 3.49Å; M50-M54 WeakPolarHBondContact O-CB 3.48Å; M50-M54 PolarHBondContact O-N 3.43Å |
| 51 | L | 92.7 | Very high | 92.3 | Very high | 5 Ų | 5 | 56.8 Ų | 56.8 | 3% | 0.026 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.1 | -47.7 | 176.9 | 176.1 | 56.9 | 0 | 0 | 0 | 111 | G47 N48 A53 M54 L55 V70 S74 P258 C261 | G47-L51 WeakPolarHBondContact O-CB 3.07Å; G47-L51 PolarHBondContact O-N 3.17Å; N48-L51 PolarHBondContact O-N 3.11Å; L51-A53 PolarHBondContact O-N 3.08Å; L51-M54 HydrophobicContact CD1-CE 3.56Å; L51-M54 PolarHBondContact O-N 3.45Å; L51-L55 HydrophobicContact CD1-CD1 3.9Å; L51-L55 HydrophobicContact CD1-CD2 4.46Å; L51-L55 HydrophobicContact CD1-CG 4Å; L51-L55 HydrophobicContact CG-CD1 4.01Å; L51-L55 VanDerWaalsContact O-CG 3.25Å; L51-L55 WeakPolarHBondContact O-CG 3.4Å; L51-L55 PolarHBondContact O-N 3.37Å; L51-V70 HydrophobicContact CD1-CG1 4.35Å; L51-V70 HydrophobicContact CD2-CG1 3.89Å; L51-V70 HydrophobicContact CG-CG1 4.4Å; L51-S74 WeakPolarHBondContact CD2-OG 3.3Å; L51-P258 HydrophobicContact CB-CB 4.36Å; L51-P258 HydrophobicContact CD2-CB 4.4Å; L51-P258 HydrophobicContact CD2-CG 4.49Å; L51-C261 HydrophobicContact CD1-CB 4.31Å; L51-C261 HydrophobicContact CD2-CB 4.03Å |
| 52 | M | 93.5 | Very high | 92 | Very high | 36 Ų | 36 | 62 Ų | 62 | 18% | 0.177 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -57.5 | -47.3 | 175.6 | -68.9 | 172.2 | 65.7 | 0 | 0 | 111.4 | N48 V49 M54 L55 L56 L71 C75 L78 | N48-M52 WeakPolarHBondContact O-CB 3.16Å; N48-M52 WeakPolarHBondContact O-CG 3.33Å; N48-M52 PolarHBondContact O-N 2.86Å; V49-M52 PolarHBondContact O-N 3.11Å; M52-M54 PolarHBondContact O-N 2.85Å; M52-L55 PolarHBondContact O-N 3.19Å; M52-L56 WeakPolarHBondContact O-CB 3.46Å; M52-L56 VanDerWaalsContact O-CG 3.27Å; M52-L56 WeakPolarHBondContact O-CG 3.34Å; M52-L56 PolarHBondContact O-N 3.17Å; M52-L71 HydrophobicContact CB-CD1 3.9Å; M52-L71 HydrophobicContact CG-CD1 3.83Å; M52-C75 VanDerWaalsContact CE-SG 3.52Å; M52-L78 HydrophobicContact SD-CD2 4.05Å |
| 53 | A | 92.7 | Very high | 91.5 | Very high | 30 Ų | 30 | 60.6 Ų | 60.6 | 25% | 0.248 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -60.2 | -44.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112 | V49 M50 L51 L56 R57 | V49-A53 WeakPolarHBondContact O-CB 3.3Å; V49-A53 PolarHBondContact O-N 3.3Å; M50-A53 PolarHBondContact O-N 3.49Å; L51-A53 PolarHBondContact O-N 3.08Å; A53-L56 PolarHBondContact O-N 3.17Å; A53-R57 VanDerWaalsContact O-CB 3.24Å; A53-R57 WeakPolarHBondContact O-CB 3.33Å; A53-R57 WeakPolarHBondContact O-CG 3.19Å; A53-R57 PolarHBondContact O-N 3.29Å |
| 54 | M | 89.6 | Confident | 91.1 | Very high | 30 Ų | 30 | 60.6 Ų | 60.6 | 15% | 0.148 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.9 | -46.1 | 176.2 | 178.7 | 180 | 53.3 | 0 | 0 | 111.7 | M50 L51 M52 L56 T58 F61 L268 | M50-M54 WeakPolarHBondContact O-CB 3.48Å; M50-M54 PolarHBondContact O-N 3.43Å; L51-M54 HydrophobicContact CD1-CE 3.56Å; L51-M54 PolarHBondContact O-N 3.45Å; M52-M54 PolarHBondContact O-N 2.85Å; M54-L56 VanDerWaalsContact C-N 3.35Å; M54-L56 PolarHBondContact O-N 3.16Å; M54-T58 PolarHBondContact O-N 3Å; M54-T58 PolarHBondContact O-OG1 2.86Å; M54-F61 HydrophobicContact CG-CD2 4.34Å; M54-F61 HydrophobicContact CG-CE2 4.15Å; M54-L268 HydrophobicContact CE-CB 4.09Å; M54-L268 HydrophobicContact CE-CD1 3.93Å; M54-L268 HydrophobicContact CE-CD2 3.33Å; M54-L268 HydrophobicContact CE-CG 3.96Å; M54-L268 HydrophobicContact CG-CD2 4.22Å; M54-L268 HydrophobicContact SD-CB 4.11Å; M54-L268 HydrophobicContact SD-CD2 3.57Å; M54-L268 VanDerWaalsContact SD-CD2 3.57Å; M54-L268 HydrophobicContact SD-CG 4.34Å |
| 55 | L | 90.9 | Very high | 90.8 | Very high | 7 Ų | 7 | 60.7 Ų | 60.7 | 4% | 0.037 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.1 | -35.7 | -179.2 | -66.1 | 173.4 | 0 | 0 | 0 | 112.7 | L51 M52 F61 R62 V70 L71 L268 | L51-L55 HydrophobicContact CD1-CD1 3.9Å; L51-L55 HydrophobicContact CD1-CD2 4.46Å; L51-L55 HydrophobicContact CD1-CG 4Å; L51-L55 HydrophobicContact CG-CD1 4.01Å; L51-L55 VanDerWaalsContact O-CG 3.25Å; L51-L55 WeakPolarHBondContact O-CG 3.4Å; L51-L55 PolarHBondContact O-N 3.37Å; M52-L55 PolarHBondContact O-N 3.19Å; L55-F61 HydrophobicContact CD2-CB 4.15Å; L55-F61 HydrophobicContact CD2-CG 4.27Å; L55-R62 WeakPolarHBondContact O-CG 3.25Å; L55-V70 HydrophobicContact CD1-CB 4.09Å; L55-V70 HydrophobicContact CD1-CG1 3.77Å; L55-L71 HydrophobicContact CB-CD1 4.47Å; L55-L71 HydrophobicContact CD1-CB 4.14Å; L55-L268 HydrophobicContact CD2-CD2 4.21Å |
| 56 | L | 93.4 | Very high | 90.3 | Very high | 89 Ų | 89 | 58.7 Ų | 58.7 | 47% | 0.466 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -80.4 | -37.2 | -179.5 | -68.2 | 172.8 | 0 | 0 | 0 | 112.9 | M52 A53 M54 R62 L71 | M52-L56 WeakPolarHBondContact O-CB 3.46Å; M52-L56 VanDerWaalsContact O-CG 3.27Å; M52-L56 WeakPolarHBondContact O-CG 3.34Å; M52-L56 PolarHBondContact O-N 3.17Å; A53-L56 PolarHBondContact O-N 3.17Å; M54-L56 VanDerWaalsContact C-N 3.35Å; M54-L56 PolarHBondContact O-N 3.16Å; L56-R62 WeakPolarHBondContact O-CD 3.13Å; L56-R62 PolarHBondContact O-NE 3.37Å; L56-R62 VanDerWaalsContact O-NE 3.12Å; L56-L71 HydrophobicContact CD1-CD1 4.23Å; L56-L71 HydrophobicContact CD2-CD1 4.25Å; L56-L71 HydrophobicContact CD2-CD2 3.83Å; L56-L71 HydrophobicContact CG-CD1 3.99Å; L56-L71 HydrophobicContact CG-CD2 4.47Å |
| 57 | R | 91.9 | Very high | 90.1 | Very high | 207 Ų | 207 | 56.2 Ų | 56.2 | 78% | 0.781 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -76.8 | -34 | -176.6 | -70 | 176.7 | -179 | -175.6 | 1.3 | 112.7 | A53 K59 | A53-R57 VanDerWaalsContact O-CB 3.24Å; A53-R57 WeakPolarHBondContact O-CB 3.33Å; A53-R57 WeakPolarHBondContact O-CG 3.19Å; A53-R57 PolarHBondContact O-N 3.29Å; R57-K59 PolarHBondContact O-N 3.44Å |
| 58 | T | 85.6 | Confident | 90.1 | Very high | 31 Ų | 31 | 57.1 Ų | 57.1 | 19% | 0.19 | 30% | 0.297 | C | S | . | . | trans | -87.6 | 114.7 | -176.5 | -50.6 | 0 | 0 | 0 | 0 | 112.2 | M54 A60 F61 R62 V271 | M54-T58 PolarHBondContact O-N 3Å; M54-T58 PolarHBondContact O-OG1 2.86Å; T58-A60 VanDerWaalsContact C-N 3.26Å; T58-A60 HydrophobicContact CG2-CB 4.16Å; T58-A60 PolarHBondContact O-N 3.48Å; T58-F61 HydrophobicContact CG2-CD2 3.67Å; T58-F61 HydrophobicContact CG2-CE2 3.77Å; T58-F61 HydrophobicContact CG2-CG 4.33Å; T58-F61 PolarHBondContact O-N 3.36Å; T58-R62 PolarHBondContact O-N 3.49Å; T58-R62 VanDerWaalsContact O-N 3.17Å; T58-V271 HydrophobicContact CG2-CG1 4.17Å; T58-V271 HydrophobicContact CG2-CG2 4.29Å | ||
| 59 | K | 87.3 | Confident | 90 | Very high | 167 Ų | 167 | 57.3 Ų | 57.3 | 73% | 0.726 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -52 | -40.8 | 178.8 | -70.9 | -177.2 | -179.3 | 178.7 | 0 | 113.2 | R57 F61 R62 A63 | R57-K59 PolarHBondContact O-N 3.44Å; K59-F61 VanDerWaalsContact C-N 3.29Å; K59-F61 PolarHBondContact O-N 2.77Å; K59-R62 PolarHBondContact O-N 3.48Å; K59-A63 PolarHBondContact O-N 3.32Å |
| 60 | A | 85 | Confident | 89.8 | Confident | 72 Ų | 72 | 54.5 Ų | 54.5 | 60% | 0.595 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -61 | -35.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | T58 | T58-A60 VanDerWaalsContact C-N 3.26Å; T58-A60 HydrophobicContact CG2-CB 4.16Å; T58-A60 PolarHBondContact O-N 3.48Å |
| 61 | F | 87 | Confident | 89.9 | Confident | 11 Ų | 11 | 50.1 Ų | 50.1 | 5% | 0.048 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -76.3 | -39.7 | 176.4 | -62.1 | -44.2 | 0 | 0 | 0 | 111.9 | M54 L55 T58 K59 A63 N64 S67 N267 L268 V271 | M54-F61 HydrophobicContact CG-CD2 4.34Å; M54-F61 HydrophobicContact CG-CE2 4.15Å; L55-F61 HydrophobicContact CD2-CB 4.15Å; L55-F61 HydrophobicContact CD2-CG 4.27Å; T58-F61 HydrophobicContact CG2-CD2 3.67Å; T58-F61 HydrophobicContact CG2-CE2 3.77Å; T58-F61 HydrophobicContact CG2-CG 4.33Å; T58-F61 PolarHBondContact O-N 3.36Å; K59-F61 VanDerWaalsContact C-N 3.29Å; K59-F61 PolarHBondContact O-N 2.77Å; F61-A63 PolarHBondContact O-N 3.38Å; F61-N64 PolarHBondContact O-N 2.98Å; F61-S67 WeakPolarHBondContact O-CB 3.11Å; F61-S67 PolarHBondContact O-OG 3.41Å; F61-N267 HydrophobicContact CE1-CB 3.85Å; F61-N267 HydrophobicContact CZ-CB 4.25Å; F61-N267 WeakPolarHBondContact CZ-O 3.35Å; F61-L268 HydrophobicContact CD1-CD2 3.96Å; F61-L268 HydrophobicContact CD2-CD2 3.72Å; F61-L268 HydrophobicContact CE1-CD2 3.5Å; F61-L268 VanDerWaalsContact CE1-CD2 3.5Å; F61-L268 HydrophobicContact CE1-CG 4.15Å; F61-L268 HydrophobicContact CE2-CD2 3.28Å; F61-L268 HydrophobicContact CE2-CG 4.48Å; F61-L268 HydrophobicContact CG-CD2 4.11Å; F61-L268 HydrophobicContact CZ-CB 4.48Å; F61-L268 HydrophobicContact CZ-CD2 3.17Å; F61-L268 HydrophobicContact CZ-CG 3.98Å; F61-V271 HydrophobicContact CE2-CB 4.06Å; F61-V271 HydrophobicContact CE2-CG1 4.15Å; F61-V271 HydrophobicContact CE2-CG2 4Å; F61-V271 HydrophobicContact CZ-CB 4.22Å; F61-V271 HydrophobicContact CZ-CG2 3.88Å |
| 62 | R | 88.6 | Confident | 90 | Very high | 136 Ų | 136 | 51.2 Ų | 51.2 | 51% | 0.513 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -59.9 | -28.8 | 176.1 | -70.1 | -163.1 | -76.4 | 139.3 | -6.4 | 113.9 | L55 L56 T58 K59 N64 P145 | L55-R62 WeakPolarHBondContact O-CG 3.25Å; L56-R62 WeakPolarHBondContact O-CD 3.13Å; L56-R62 PolarHBondContact O-NE 3.37Å; L56-R62 VanDerWaalsContact O-NE 3.12Å; T58-R62 PolarHBondContact O-N 3.49Å; T58-R62 VanDerWaalsContact O-N 3.17Å; K59-R62 PolarHBondContact O-N 3.48Å; R62-N64 VanDerWaalsContact C-N 3.29Å; R62-N64 PolarHBondContact O-N 3.32Å; R62-P145 WeakPolarHBondContact O-CG 3.24Å |
| 63 | A | 85.9 | Confident | 90 | Very high | 75 Ų | 75 | 49.7 Ų | 49.7 | 62% | 0.62 | 26% | 0.259 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.9 | -10.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114 | K59 F61 P145 | K59-A63 PolarHBondContact O-N 3.32Å; F61-A63 PolarHBondContact O-N 3.38Å; A63-P145 WeakPolarHBondContact O-CG 3.49Å |
| 64 | N | 86.2 | Confident | 90.1 | Very high | 60 Ų | 60 | 48.4 Ų | 48.4 | 32% | 0.321 | 25% | 0.247 | S | C | . | . | trans | -101.8 | 123.4 | -175.4 | 173.9 | 19.5 | 0 | 0 | 0 | 111.4 | F61 R62 T66 S67 | F61-N64 PolarHBondContact O-N 2.98Å; R62-N64 VanDerWaalsContact C-N 3.29Å; R62-N64 PolarHBondContact O-N 3.32Å; N64-T66 VanDerWaalsContact C-N 3.26Å; N64-T66 PolarHBondContact ND2-OG1 3.21Å; N64-T66 PolarHBondContact O-N 3.25Å; N64-T66 PolarHBondContact OD1-N 2.85Å; N64-T66 VanDerWaalsContact OD1-N 3.16Å; N64-T66 PolarHBondContact OD1-OG1 3.27Å; N64-S67 PolarHBondContact ND2-OG 3.28Å; N64-S67 VanDerWaalsContact O-CB 3.3Å; N64-S67 WeakPolarHBondContact O-CB 3.45Å; N64-S67 PolarHBondContact O-N 2.8Å; N64-S67 PolarHBondContact O-OG 2.89Å | ||
| 65 | A | 88.8 | Confident | 90.4 | Very high | 2 Ų | 2 | 48.7 Ų | 48.7 | 2% | 0.017 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -54.6 | -38.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | S67 V68 R143 A148 | A65-S67 PolarHBondContact O-N 2.84Å; A65-V68 WeakPolarHBondContact O-CB 3.35Å; A65-V68 PolarHBondContact O-N 2.95Å; A65-V68 VanDerWaalsContact O-N 3.09Å; A65-R143 HydrophobicContact CB-CB 4.45Å; A65-R143 VanDerWaalsContact CB-O 3.3Å; A65-R143 WeakPolarHBondContact CB-O 3.43Å; A65-A148 HydrophobicContact CB-CB 3.98Å; A65-A148 WeakPolarHBondContact O-CB 3.24Å |
| 66 | T | 86.7 | Confident | 90.6 | Very high | 11 Ų | 11 | 48.4 Ų | 48.4 | 7% | 0.067 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -56.8 | -38.6 | 177.6 | -29.4 | 0 | 0 | 0 | 0 | 112.2 | N64 V68 F69 V70 R129 V202 | N64-T66 VanDerWaalsContact C-N 3.26Å; N64-T66 PolarHBondContact ND2-OG1 3.21Å; N64-T66 PolarHBondContact O-N 3.25Å; N64-T66 PolarHBondContact OD1-N 2.85Å; N64-T66 VanDerWaalsContact OD1-N 3.16Å; N64-T66 PolarHBondContact OD1-OG1 3.27Å; T66-V68 PolarHBondContact O-N 3.44Å; T66-F69 PolarHBondContact O-N 3.11Å; T66-F69 VanDerWaalsContact O-N 3.14Å; T66-V70 WeakPolarHBondContact O-CG2 3.45Å; T66-V70 PolarHBondContact O-N 3.44Å; T66-R129 PolarHBondContact OG1-NH2 3.32Å; T66-V202 HydrophobicContact CG2-CG1 4.27Å |
| 67 | S | 89.8 | Confident | 90.7 | Very high | 9 Ų | 9 | 44.2 Ų | 44.2 | 6% | 0.063 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -64.4 | -29.2 | -177.9 | -51 | 0 | 0 | 0 | 0 | 111.6 | F61 N64 A65 L71 | F61-S67 WeakPolarHBondContact O-CB 3.11Å; F61-S67 PolarHBondContact O-OG 3.41Å; N64-S67 PolarHBondContact ND2-OG 3.28Å; N64-S67 VanDerWaalsContact O-CB 3.3Å; N64-S67 WeakPolarHBondContact O-CB 3.45Å; N64-S67 PolarHBondContact O-N 2.8Å; N64-S67 PolarHBondContact O-OG 2.89Å; A65-S67 PolarHBondContact O-N 2.84Å; S67-L71 VanDerWaalsContact O-CB 3.23Å; S67-L71 WeakPolarHBondContact O-CB 3.43Å; S67-L71 PolarHBondContact O-N 2.71Å |
| 68 | V | 93.5 | Very high | 90.8 | Very high | 26 Ų | 26 | 35.8 Ų | 35.8 | 16% | 0.158 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -67.7 | -41.9 | 175.7 | -178.8 | 0 | 0 | 0 | 0 | 110.5 | A65 T66 L71 N72 P145 A148 A149 | A65-V68 WeakPolarHBondContact O-CB 3.35Å; A65-V68 PolarHBondContact O-N 2.95Å; A65-V68 VanDerWaalsContact O-N 3.09Å; T66-V68 PolarHBondContact O-N 3.44Å; V68-L71 PolarHBondContact O-N 2.77Å; V68-N72 PolarHBondContact O-N 3.45Å; V68-N72 PolarHBondContact O-ND2 2.9Å; V68-P145 HydrophobicContact CG2-CB 4.02Å; V68-A148 HydrophobicContact CB-CB 3.8Å; V68-A148 HydrophobicContact CG1-CB 4.07Å; V68-A148 HydrophobicContact CG2-CB 4.24Å; V68-A149 HydrophobicContact CG1-CB 4.23Å |
| 69 | F | 92.1 | Very high | 91.3 | Very high | 4 Ų | 4 | 36.7 Ų | 36.7 | 2% | 0.018 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -66.2 | -43.3 | 175.6 | -60.4 | -53 | 0 | 0 | 0 | 112.1 | T66 L71 N72 L73 L121 V124 M125 D128 A148 Y151 | T66-F69 PolarHBondContact O-N 3.11Å; T66-F69 VanDerWaalsContact O-N 3.14Å; F69-L71 VanDerWaalsContact C-N 3.31Å; F69-L71 PolarHBondContact O-N 2.88Å; F69-N72 PolarHBondContact O-N 3.31Å; F69-L73 WeakPolarHBondContact O-CB 3.27Å; F69-L73 PolarHBondContact O-N 2.73Å; F69-L121 HydrophobicContact CD1-CD2 4.25Å; F69-V124 HydrophobicContact CD1-CG1 4.2Å; F69-V124 HydrophobicContact CE1-CB 4.47Å; F69-V124 HydrophobicContact CE1-CG1 3.43Å; F69-V124 VanDerWaalsContact CE1-CG1 3.43Å; F69-V124 HydrophobicContact CE2-CG1 4.23Å; F69-V124 HydrophobicContact CZ-CG1 3.44Å; F69-V124 VanDerWaalsContact CZ-CG1 3.44Å; F69-M125 HydrophobicContact CB-CG 3.49Å; F69-M125 VanDerWaalsContact CB-CG 3.49Å; F69-M125 HydrophobicContact CB-SD 3.79Å; F69-M125 HydrophobicContact CD2-CG 3.94Å; F69-M125 HydrophobicContact CG-CG 3.85Å; F69-D128 HydrophobicContact CE2-CB 4.21Å; F69-A148 HydrophobicContact CE1-CB 3.98Å; F69-A148 HydrophobicContact CE2-CB 3.98Å; F69-A148 HydrophobicContact CZ-CB 3.68Å; F69-Y151 HydrophobicContact CZ-CD2 4.12Å |
| 70 | V | 91.8 | Very high | 91.6 | Very high | 11 Ų | 11 | 29 Ų | 29 | 7% | 0.067 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63.6 | -38.7 | 176.9 | 179.1 | 0 | 0 | 0 | 0 | 111.2 | L51 L55 T66 L73 S74 M125 C261 | L51-V70 HydrophobicContact CD1-CG1 4.35Å; L51-V70 HydrophobicContact CD2-CG1 3.89Å; L51-V70 HydrophobicContact CG-CG1 4.4Å; L55-V70 HydrophobicContact CD1-CB 4.09Å; L55-V70 HydrophobicContact CD1-CG1 3.77Å; T66-V70 WeakPolarHBondContact O-CG2 3.45Å; T66-V70 PolarHBondContact O-N 3.44Å; V70-L73 PolarHBondContact O-N 3.4Å; V70-S74 PolarHBondContact O-N 3.02Å; V70-S74 PolarHBondContact O-OG 2.99Å; V70-M125 HydrophobicContact CG2-CE 3.92Å; V70-C261 HydrophobicContact CG1-CB 4.39Å |
| 71 | L | 94.6 | Very high | 92.1 | Very high | 34 Ų | 34 | 25.6 Ų | 25.6 | 18% | 0.178 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61 | -48 | 173.9 | -178.8 | 74 | 0 | 0 | 0 | 111.2 | M52 L55 L56 S67 V68 F69 L73 S74 C75 | M52-L71 HydrophobicContact CB-CD1 3.9Å; M52-L71 HydrophobicContact CG-CD1 3.83Å; L55-L71 HydrophobicContact CB-CD1 4.47Å; L55-L71 HydrophobicContact CD1-CB 4.14Å; L56-L71 HydrophobicContact CD1-CD1 4.23Å; L56-L71 HydrophobicContact CD2-CD1 4.25Å; L56-L71 HydrophobicContact CD2-CD2 3.83Å; L56-L71 HydrophobicContact CG-CD1 3.99Å; L56-L71 HydrophobicContact CG-CD2 4.47Å; S67-L71 VanDerWaalsContact O-CB 3.23Å; S67-L71 WeakPolarHBondContact O-CB 3.43Å; S67-L71 PolarHBondContact O-N 2.71Å; V68-L71 PolarHBondContact O-N 2.77Å; F69-L71 VanDerWaalsContact C-N 3.31Å; F69-L71 PolarHBondContact O-N 2.88Å; L71-L73 VanDerWaalsContact C-N 3.31Å; L71-L73 PolarHBondContact O-N 3.16Å; L71-S74 WeakPolarHBondContact O-CB 3.38Å; L71-S74 PolarHBondContact O-N 3.34Å; L71-C75 PolarHBondContact O-N 3.28Å; L71-C75 PolarHBondContact O-SG 3.45Å |
| 72 | N | 95.8 | Very high | 92.5 | Very high | 28 Ų | 28 | 28.6 Ų | 28.6 | 15% | 0.15 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64.9 | -35 | 178.1 | -81.5 | -90.3 | 0 | 0 | 0 | 112.5 | V68 F69 S74 C75 A76 L121 S152 W156 | V68-N72 PolarHBondContact O-N 3.45Å; V68-N72 PolarHBondContact O-ND2 2.9Å; F69-N72 PolarHBondContact O-N 3.31Å; N72-S74 VanDerWaalsContact C-N 3.35Å; N72-C75 WeakPolarHBondContact O-CB 3.49Å; N72-C75 PolarHBondContact O-N 3.25Å; N72-A76 PolarHBondContact O-N 3.45Å; N72-L121 HydrophobicContact CB-CD1 3.8Å; N72-L121 HydrophobicContact CB-CD2 3.8Å; N72-L121 HydrophobicContact CB-CG 4.48Å; N72-S152 WeakPolarHBondContact ND2-CB 3.37Å; N72-S152 PolarHBondContact ND2-OG 2.8Å; N72-W156 PolarHBondContact OD1-NE1 3.32Å |
| 73 | L | 92.7 | Very high | 92.7 | Very high | 4 Ų | 4 | 25.7 Ų | 25.7 | 2% | 0.021 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.3 | -44.7 | 174.5 | -172.9 | 63.9 | 0 | 0 | 0 | 110.2 | F69 V70 L71 C75 A76 D77 L121 L122 L209 | F69-L73 WeakPolarHBondContact O-CB 3.27Å; F69-L73 PolarHBondContact O-N 2.73Å; V70-L73 PolarHBondContact O-N 3.4Å; L71-L73 VanDerWaalsContact C-N 3.31Å; L71-L73 PolarHBondContact O-N 3.16Å; L73-C75 VanDerWaalsContact C-N 3.31Å; L73-C75 PolarHBondContact O-N 3.23Å; L73-A76 WeakPolarHBondContact O-CB 3.34Å; L73-A76 PolarHBondContact O-N 3.04Å; L73-A76 VanDerWaalsContact O-N 3.13Å; L73-D77 PolarHBondContact O-N 3.47Å; L73-L121 HydrophobicContact CB-CD1 4.31Å; L73-L121 HydrophobicContact CD1-CD1 4.48Å; L73-L122 HydrophobicContact CD2-CD2 4.17Å; L73-L209 HydrophobicContact CD2-CD1 4.32Å |
| 74 | S | 95 | Very high | 92.9 | Very high | 2 Ų | 2 | 22.2 Ų | 22.2 | 1% | 0.014 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -62.8 | -36.1 | 175.4 | -47.5 | 0 | 0 | 0 | 0 | 112.3 | L51 V70 L71 N72 L78 | L51-S74 WeakPolarHBondContact CD2-OG 3.3Å; V70-S74 PolarHBondContact O-N 3.02Å; V70-S74 PolarHBondContact O-OG 2.99Å; L71-S74 WeakPolarHBondContact O-CB 3.38Å; L71-S74 PolarHBondContact O-N 3.34Å; N72-S74 VanDerWaalsContact C-N 3.35Å; S74-L78 VanDerWaalsContact O-CB 3.3Å; S74-L78 WeakPolarHBondContact O-CB 3.3Å; S74-L78 PolarHBondContact O-N 2.93Å |
| 75 | C | 96.2 | Very high | 93.2 | Very high | 37 Ų | 37 | 19.4 Ų | 19.4 | 25% | 0.25 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -64.7 | -42.4 | 173.2 | -66.3 | 0 | 0 | 0 | 0 | 111.9 | M52 L71 N72 L73 L78 L79 W156 | M52-C75 VanDerWaalsContact CE-SG 3.52Å; L71-C75 PolarHBondContact O-N 3.28Å; L71-C75 PolarHBondContact O-SG 3.45Å; N72-C75 WeakPolarHBondContact O-CB 3.49Å; N72-C75 PolarHBondContact O-N 3.25Å; L73-C75 VanDerWaalsContact C-N 3.31Å; L73-C75 PolarHBondContact O-N 3.23Å; C75-L78 PolarHBondContact O-N 2.92Å; C75-L79 WeakPolarHBondContact O-CB 3.16Å; C75-L79 VanDerWaalsContact O-CG 3.32Å; C75-L79 WeakPolarHBondContact O-CG 3.12Å; C75-L79 PolarHBondContact O-N 2.97Å; C75-W156 HydrophobicContact CB-CZ2 4.37Å |
| 76 | A | 94.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -62.8 | -45 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | N72 L73 L79 F80 T114 A117 W156 | N72-A76 PolarHBondContact O-N 3.45Å; L73-A76 WeakPolarHBondContact O-CB 3.34Å; L73-A76 PolarHBondContact O-N 3.04Å; L73-A76 VanDerWaalsContact O-N 3.13Å; A76-L79 PolarHBondContact O-N 3.45Å; A76-F80 WeakPolarHBondContact O-CB 3.2Å; A76-F80 PolarHBondContact O-N 3.24Å; A76-T114 WeakPolarHBondContact O-CB 3.1Å; A76-T114 VanDerWaalsContact O-CG2 3.3Å; A76-T114 WeakPolarHBondContact O-CG2 3.46Å; A76-A117 HydrophobicContact CB-CB 4.33Å; A76-W156 HydrophobicContact CB-CH2 3.83Å; A76-W156 HydrophobicContact CB-CZ2 4.14Å |
| 77 | D | 94.8 | Very high | 93.5 | Very high | 2 Ų | 2 | 24.2 Ų | 24.2 | 1% | 0.011 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.7 | -42.3 | 175.3 | -70.8 | -44.2 | 0 | 0 | 0 | 112.5 | L73 F80 V81 S254 N257 | L73-D77 PolarHBondContact O-N 3.47Å; D77-F80 WeakPolarHBondContact O-CB 3.28Å; D77-F80 PolarHBondContact O-N 3.22Å; D77-V81 WeakPolarHBondContact O-CB 3.25Å; D77-V81 VanDerWaalsContact O-CG2 3.27Å; D77-V81 WeakPolarHBondContact O-CG2 3.47Å; D77-V81 PolarHBondContact O-N 3.25Å; D77-S254 WeakPolarHBondContact OD1-CA 3.38Å; D77-S254 WeakPolarHBondContact OD1-CB 3.49Å; D77-S254 PolarHBondContact OD1-OG 3.12Å; D77-N257 PolarHBondContact OD1-ND2 3.04Å; D77-N257 PolarHBondContact OD2-ND2 2.89Å |
| 78 | L | 95.8 | Very high | 93.2 | Very high | 29 Ų | 29 | 25 Ų | 25 | 15% | 0.152 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.9 | -42.8 | 178.3 | -175.3 | 63.2 | 0 | 0 | 0 | 111.7 | I45 N48 V49 M52 S74 C75 F80 V81 L82 | I45-L78 HydrophobicContact CB-CD1 4.38Å; I45-L78 HydrophobicContact CG1-CD1 4.12Å; I45-L78 HydrophobicContact CG2-CD1 4.34Å; N48-L78 HydrophobicContact CB-CB 4.37Å; V49-L78 HydrophobicContact CG2-CD1 4.12Å; V49-L78 HydrophobicContact CG2-CD2 4.05Å; M52-L78 HydrophobicContact SD-CD2 4.05Å; S74-L78 VanDerWaalsContact O-CB 3.3Å; S74-L78 WeakPolarHBondContact O-CB 3.3Å; S74-L78 PolarHBondContact O-N 2.93Å; C75-L78 PolarHBondContact O-N 2.92Å; L78-F80 VanDerWaalsContact C-N 3.33Å; L78-F80 PolarHBondContact O-N 3.44Å; L78-V81 PolarHBondContact O-N 3.27Å; L78-L82 HydrophobicContact CD1-CD1 4.05Å; L78-L82 HydrophobicContact CD1-CG 4.21Å; L78-L82 HydrophobicContact CG-CD1 3.86Å; L78-L82 HydrophobicContact CG-CG 4.41Å; L78-L82 WeakPolarHBondContact O-CB 3.46Å; L78-L82 VanDerWaalsContact O-CG 3.22Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 2.8Å |
| 79 | L | 95.5 | Very high | 92.8 | Very high | 51 Ų | 51 | 23.9 Ų | 23.9 | 27% | 0.267 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -61.6 | -42.2 | 174.8 | -73.7 | 174 | 0 | 0 | 0 | 111.4 | C75 A76 L82 F83 F110 T114 W156 | C75-L79 WeakPolarHBondContact O-CB 3.16Å; C75-L79 VanDerWaalsContact O-CG 3.32Å; C75-L79 WeakPolarHBondContact O-CG 3.12Å; C75-L79 PolarHBondContact O-N 2.97Å; A76-L79 PolarHBondContact O-N 3.45Å; L79-L82 PolarHBondContact O-N 3.24Å; L79-F83 HydrophobicContact CD2-CD2 4Å; L79-F83 HydrophobicContact CD2-CE2 3.74Å; L79-F83 WeakPolarHBondContact O-CB 3.32Å; L79-F83 WeakPolarHBondContact O-CD2 3.21Å; L79-F83 PolarHBondContact O-N 3.12Å; L79-F110 HydrophobicContact CD2-CE1 4.5Å; L79-T114 HydrophobicContact CB-CG2 3.64Å; L79-W156 HydrophobicContact CD1-CH2 3.85Å; L79-W156 HydrophobicContact CD1-CZ3 4.14Å |
| 80 | F | 94 | Very high | 92.5 | Very high | 5 Ų | 5 | 24.7 Ų | 24.7 | 2% | 0.022 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.9 | -47.6 | 176.4 | -179.8 | -96.9 | 0 | 0 | 0 | 111.8 | A76 D77 L78 L82 C84 V85 Q111 T114 Y251 | A76-F80 WeakPolarHBondContact O-CB 3.2Å; A76-F80 PolarHBondContact O-N 3.24Å; D77-F80 WeakPolarHBondContact O-CB 3.28Å; D77-F80 PolarHBondContact O-N 3.22Å; L78-F80 VanDerWaalsContact C-N 3.33Å; L78-F80 PolarHBondContact O-N 3.44Å; F80-L82 VanDerWaalsContact C-N 3.32Å; F80-L82 PolarHBondContact O-N 2.94Å; F80-C84 HydrophobicContact CD2-CB 3.96Å; F80-C84 HydrophobicContact CE2-CB 4.03Å; F80-C84 HydrophobicContact CG-CB 4.41Å; F80-C84 WeakPolarHBondContact O-CA 3.37Å; F80-C84 WeakPolarHBondContact O-CB 3.17Å; F80-C84 PolarHBondContact O-N 3.43Å; F80-V85 HydrophobicContact CD1-CG2 4.13Å; F80-V85 HydrophobicContact CE1-CG2 3.86Å; F80-V85 PolarHBondContact O-N 3.44Å; F80-Q111 HydrophobicContact CE2-CG 4.19Å; F80-T114 HydrophobicContact CB-CG2 4.33Å; F80-T114 WeakPolarHBondContact CD2-OG1 3.33Å; F80-Y251 AromaticContact CE1-CD1 3.44Å; F80-Y251 HydrophobicContact CE1-CD1 3.44Å; F80-Y251 VanDerWaalsContact CE1-CD1 3.44Å; F80-Y251 HydrophobicContact CE1-CE1 4.02Å; F80-Y251 HydrophobicContact CE1-CG 4.24Å; F80-Y251 AromaticContact CZ-CD1 3.36Å; F80-Y251 HydrophobicContact CZ-CD1 3.36Å; F80-Y251 AromaticContact CZ-CE1 3.54Å; F80-Y251 HydrophobicContact CZ-CE1 3.54Å |
| 81 | V | 95.1 | Very high | 92 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.1 | -35.3 | 179.6 | 173.2 | 0 | 0 | 0 | 0 | 112 | V41 I45 D77 L78 P86 | V41-V81 HydrophobicContact CB-CG1 4.35Å; V41-V81 HydrophobicContact CG1-CG1 4.28Å; V41-V81 HydrophobicContact CG2-CG1 4.37Å; I45-V81 HydrophobicContact CD1-CG1 4.48Å; I45-V81 HydrophobicContact CG1-CG1 3.84Å; D77-V81 WeakPolarHBondContact O-CB 3.25Å; D77-V81 VanDerWaalsContact O-CG2 3.27Å; D77-V81 WeakPolarHBondContact O-CG2 3.47Å; D77-V81 PolarHBondContact O-N 3.25Å; L78-V81 PolarHBondContact O-N 3.27Å; V81-P86 WeakPolarHBondContact O-CD 3.23Å |
| 82 | L | 94.5 | Very high | 91.2 | Very high | 75 Ų | 75 | 24.6 Ų | 24.6 | 39% | 0.393 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -78.5 | -43.7 | -179.3 | -70.7 | 172.2 | 0 | 0 | 0 | 113.3 | I45 L78 L79 F80 | I45-L82 HydrophobicContact CD1-CD2 3.75Å; I45-L82 HydrophobicContact CG1-CD2 4.13Å; L78-L82 HydrophobicContact CD1-CD1 4.05Å; L78-L82 HydrophobicContact CD1-CG 4.21Å; L78-L82 HydrophobicContact CG-CD1 3.86Å; L78-L82 HydrophobicContact CG-CG 4.41Å; L78-L82 WeakPolarHBondContact O-CB 3.46Å; L78-L82 VanDerWaalsContact O-CG 3.22Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 2.8Å; L79-L82 PolarHBondContact O-N 3.24Å; F80-L82 VanDerWaalsContact C-N 3.32Å; F80-L82 PolarHBondContact O-N 2.94Å |
| 83 | F | 92.8 | Very high | 90.4 | Very high | 75 Ų | 75 | 26.2 Ų | 26.2 | 33% | 0.329 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -100.4 | -16.7 | -170.7 | -70 | -76.4 | 0 | 0 | 0 | 114.3 | L79 F87 F110 | L79-F83 HydrophobicContact CD2-CD2 4Å; L79-F83 HydrophobicContact CD2-CE2 3.74Å; L79-F83 WeakPolarHBondContact O-CB 3.32Å; L79-F83 WeakPolarHBondContact O-CD2 3.21Å; L79-F83 PolarHBondContact O-N 3.12Å; F83-F87 WeakPolarHBondContact O-CD2 3.45Å; F83-F110 HydrophobicContact CB-CB 3.99Å; F83-F110 HydrophobicContact CB-CD2 3.95Å; F83-F110 HydrophobicContact CB-CG 4.03Å; F83-F110 HydrophobicContact CD1-CD2 4.22Å; F83-F110 HydrophobicContact CD1-CE2 4.21Å; F83-F110 HydrophobicContact CD2-CD1 4.45Å; F83-F110 HydrophobicContact CD2-CD2 4.37Å; F83-F110 HydrophobicContact CD2-CE2 4.44Å; F83-F110 HydrophobicContact CD2-CG 4.38Å; F83-F110 HydrophobicContact CE1-CE2 4.46Å; F83-F110 AromaticContact CG-CD2 3.93Å; F83-F110 HydrophobicContact CG-CD2 3.93Å; F83-F110 HydrophobicContact CG-CE2 4.2Å; F83-F110 HydrophobicContact CG-CG 4.22Å |
| 84 | C | 91.4 | Very high | 89.7 | Confident | 2 Ų | 2 | 30.3 Ų | 30.3 | 1% | 0.014 | 16% | 0.161 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108.7 | -51.8 | -176 | -51.8 | 0 | 0 | 0 | 0 | 112.2 | F80 Q88 Q111 | F80-C84 HydrophobicContact CD2-CB 3.96Å; F80-C84 HydrophobicContact CE2-CB 4.03Å; F80-C84 HydrophobicContact CG-CB 4.41Å; F80-C84 WeakPolarHBondContact O-CA 3.37Å; F80-C84 WeakPolarHBondContact O-CB 3.17Å; F80-C84 PolarHBondContact O-N 3.43Å; C84-Q88 WeakPolarHBondContact O-CB 3.42Å; C84-Q88 PolarHBondContact O-N 2.89Å; C84-Q111 WeakPolarHBondContact SG-CA 3.3Å; C84-Q111 PolarHBondContact SG-N 3.45Å |
| 85 | V | 92.3 | Very high | 88.7 | Confident | 1 Ų | 1 | 33.6 Ų | 33.6 | 1% | 0.006 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.6 | -47.6 | -169 | -178.3 | 0 | 0 | 0 | 0 | 113.3 | L37 I40 V41 F80 G89 Y251 | L37-V85 HydrophobicContact CD2-CG1 3.63Å; I40-V85 HydrophobicContact CG2-CG1 4.16Å; V41-V85 HydrophobicContact CG2-CB 4.04Å; V41-V85 HydrophobicContact CG2-CG1 3.61Å; F80-V85 HydrophobicContact CD1-CG2 4.13Å; F80-V85 HydrophobicContact CE1-CG2 3.86Å; F80-V85 PolarHBondContact O-N 3.44Å; V85-G89 WeakPolarHBondContact O-CA 3.42Å; V85-G89 PolarHBondContact O-N 3.38Å; V85-Y251 HydrophobicContact CG1-CD2 4.02Å; V85-Y251 HydrophobicContact CG1-CE2 4.3Å; V85-Y251 HydrophobicContact CG2-CD1 4.18Å; V85-Y251 HydrophobicContact CG2-CD2 4.15Å; V85-Y251 HydrophobicContact CG2-CE1 4.5Å; V85-Y251 HydrophobicContact CG2-CE2 4.49Å; V85-Y251 HydrophobicContact CG2-CG 3.98Å |
| 86 | P | 91 | Very high | 87.8 | Confident | 55 Ų | 55 | 36.2 Ų | 36.2 | 36% | 0.357 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -66.4 | -44.2 | -179.4 | -20.9 | 33.2 | 0 | 0 | 0 | 112.2 | V41 V81 G89 T90 | V41-P86 HydrophobicContact CG2-CG 4.25Å; V81-P86 WeakPolarHBondContact O-CD 3.23Å; P86-G89 PolarHBondContact O-N 3.47Å; P86-T90 PolarHBondContact O-N 2.84Å; P86-T90 VanDerWaalsContact O-N 3.11Å; P86-T90 PolarHBondContact O-OG1 3.15Å; P86-T90 VanDerWaalsContact O-OG1 3.12Å |
| 87 | F | 89.6 | Confident | 87.3 | Confident | 58 Ų | 58 | 39.3 Ų | 39.3 | 25% | 0.254 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -66.7 | -45.9 | -177.8 | -70.5 | -87.5 | 0 | 0 | 0 | 112 | F83 G89 T90 W97 Y99 P103 T107 | F83-F87 WeakPolarHBondContact O-CD2 3.45Å; F87-G89 VanDerWaalsContact C-N 3.3Å; F87-T90 PolarHBondContact O-N 2.91Å; F87-W97 HydrophobicContact CB-CH2 3.71Å; F87-W97 HydrophobicContact CB-CZ3 4.14Å; F87-W97 HydrophobicContact CD1-CH2 4.22Å; F87-W97 HydrophobicContact CD1-CZ2 4.39Å; F87-W97 HydrophobicContact CG-CH2 4.37Å; F87-Y99 HydrophobicContact CD1-CD1 4.43Å; F87-Y99 AromaticContact CD1-CD2 3.71Å; F87-Y99 HydrophobicContact CD1-CD2 3.71Å; F87-Y99 AromaticContact CD1-CE2 3.79Å; F87-Y99 HydrophobicContact CD1-CE2 3.79Å; F87-Y99 HydrophobicContact CD1-CG 4.04Å; F87-Y99 HydrophobicContact CE1-CD1 4.34Å; F87-Y99 HydrophobicContact CE1-CD2 4.39Å; F87-Y99 HydrophobicContact CE1-CG 4.27Å; F87-P103 HydrophobicContact CE1-CB 4.33Å; F87-T107 HydrophobicContact CB-CG2 4.1Å |
| 88 | Q | 84.5 | Confident | 87 | Confident | 25 Ų | 25 | 42.5 Ų | 42.5 | 12% | 0.117 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -69.4 | -32.8 | 175.9 | -168.7 | 61.4 | 38 | 0 | 0 | 111.5 | C84 T90 V91 Y92 Y251 | C84-Q88 WeakPolarHBondContact O-CB 3.42Å; C84-Q88 PolarHBondContact O-N 2.89Å; Q88-T90 VanDerWaalsContact C-N 3.33Å; Q88-T90 PolarHBondContact O-N 3.44Å; Q88-V91 WeakPolarHBondContact O-CB 3.39Å; Q88-V91 PolarHBondContact O-N 3.28Å; Q88-Y92 HydrophobicContact CG-CE2 4.21Å; Q88-Y251 WeakPolarHBondContact CB-OH 3.42Å; Q88-Y251 WeakPolarHBondContact CG-OH 3.2Å |
| 89 | G | 85.3 | Confident | 86.6 | Confident | 3 Ų | 3 | 45.6 Ų | 45.6 | 3% | 0.031 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.8 | -42.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | V85 P86 F87 V91 Y92 I93 | V85-G89 WeakPolarHBondContact O-CA 3.42Å; V85-G89 PolarHBondContact O-N 3.38Å; P86-G89 PolarHBondContact O-N 3.47Å; F87-G89 VanDerWaalsContact C-N 3.3Å; G89-V91 PolarHBondContact O-N 2.92Å; G89-Y92 WeakPolarHBondContact O-CB 3.21Å; G89-Y92 PolarHBondContact O-N 3.36Å; G89-I93 PolarHBondContact O-N 3.34Å |
| 90 | T | 85.6 | Confident | 86.2 | Confident | 22 Ų | 22 | 45.1 Ų | 45.1 | 14% | 0.135 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.4 | -33.4 | 177.5 | -58.5 | 0 | 0 | 0 | 0 | 112.8 | P86 F87 Q88 Y92 I93 L94 P98 Y99 | P86-T90 PolarHBondContact O-N 2.84Å; P86-T90 VanDerWaalsContact O-N 3.11Å; P86-T90 PolarHBondContact O-OG1 3.15Å; P86-T90 VanDerWaalsContact O-OG1 3.12Å; F87-T90 PolarHBondContact O-N 2.91Å; Q88-T90 VanDerWaalsContact C-N 3.33Å; Q88-T90 PolarHBondContact O-N 3.44Å; T90-Y92 PolarHBondContact O-N 3.4Å; T90-I93 PolarHBondContact O-N 2.94Å; T90-I93 VanDerWaalsContact O-N 3.1Å; T90-L94 HydrophobicContact CG2-CD1 3.41Å; T90-L94 VanDerWaalsContact CG2-CD1 3.41Å; T90-L94 HydrophobicContact CG2-CG 3.84Å; T90-L94 PolarHBondContact O-N 2.93Å; T90-P98 HydrophobicContact CG2-CG 3.71Å; T90-Y99 HydrophobicContact CG2-CE2 3.89Å; T90-Y99 PolarHBondContact OG1-OH 3.11Å |
| 91 | V | 80.8 | Confident | 85.5 | Confident | 36 Ų | 36 | 50.7 Ų | 50.7 | 22% | 0.218 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.8 | -31.5 | 177.6 | -177.3 | 0 | 0 | 0 | 0 | 111.7 | Q88 G89 I93 N95 W97 | Q88-V91 WeakPolarHBondContact O-CB 3.39Å; Q88-V91 PolarHBondContact O-N 3.28Å; G89-V91 PolarHBondContact O-N 2.92Å; V91-I93 VanDerWaalsContact C-N 3.31Å; V91-N95 WeakPolarHBondContact O-CA 3.29Å; V91-N95 PolarHBondContact O-N 2.91Å; V91-W97 HydrophobicContact CG2-CE3 3.57Å; V91-W97 HydrophobicContact CG2-CZ3 4.14Å |
| 92 | Y | 78.3 | Confident | 85 | Confident | 7 Ų | 7 | 55.6 Ų | 55.6 | 3% | 0.027 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -76.9 | -20.5 | 177 | -52.7 | -48.2 | 0 | 0 | 0 | 113.4 | L37 Q88 G89 T90 F240 V244 H247 M248 | L37-Y92 HydrophobicContact CD1-CD2 4.29Å; Q88-Y92 HydrophobicContact CG-CE2 4.21Å; G89-Y92 WeakPolarHBondContact O-CB 3.21Å; G89-Y92 PolarHBondContact O-N 3.36Å; T90-Y92 PolarHBondContact O-N 3.4Å; Y92-F240 HydrophobicContact CD1-CZ 4.41Å; Y92-V244 HydrophobicContact CD1-CG2 3.63Å; Y92-V244 HydrophobicContact CE1-CG2 3.74Å; Y92-V244 HydrophobicContact CG-CG1 4.45Å; Y92-V244 HydrophobicContact CG-CG2 4.29Å; Y92-H247 WeakPolarHBondContact OH-CB 3.37Å; Y92-H247 PolarHBondContact OH-CE1 3.45Å; Y92-H247 PolarHBondContact OH-ND1 3.32Å; Y92-M248 HydrophobicContact CD2-CE 3.48Å; Y92-M248 VanDerWaalsContact CD2-CE 3.48Å; Y92-M248 HydrophobicContact CE2-CE 3.35Å; Y92-M248 HydrophobicContact CG-CE 4.5Å |
| 93 | I | 78 | Confident | 84.7 | Confident | 62 Ų | 62 | 53.9 Ų | 53.9 | 32% | 0.318 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -92.8 | -50.9 | -177.4 | -60 | 169.1 | 0 | 0 | 0 | 109.7 | Q30 T34 G89 T90 V91 | Q30-I93 PolarHBondContact NE2-O 3.19Å; Q30-I93 VanDerWaalsContact NE2-O 3.14Å; T34-I93 HydrophobicContact CG2-CD1 4.04Å; T34-I93 VanDerWaalsContact OG1-CD1 3.31Å; T34-I93 WeakPolarHBondContact OG1-CD1 3.49Å; G89-I93 PolarHBondContact O-N 3.34Å; T90-I93 PolarHBondContact O-N 2.94Å; T90-I93 VanDerWaalsContact O-N 3.1Å; V91-I93 VanDerWaalsContact C-N 3.31Å |
| 94 | L | 79.3 | Confident | 84.2 | Confident | 90 Ų | 90 | 51.9 Ų | 51.9 | 47% | 0.471 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -90.5 | -8.9 | -175.6 | -57.3 | -177.6 | 0 | 0 | 0 | 113.5 | T90 N96 P98 | T90-L94 HydrophobicContact CG2-CD1 3.41Å; T90-L94 VanDerWaalsContact CG2-CD1 3.41Å; T90-L94 HydrophobicContact CG2-CG 3.84Å; T90-L94 PolarHBondContact O-N 2.93Å; L94-N96 WeakPolarHBondContact CB-OD1 3.17Å; L94-N96 PolarHBondContact O-N 3.16Å; L94-N96 PolarHBondContact O-OD1 3.22Å; L94-P98 HydrophobicContact CD1-CB 4.15Å; L94-P98 HydrophobicContact CD1-CG 3.73Å |
| 95 | N | 72.4 | Confident | 83.7 | Confident | 71 Ų | 71 | 56.5 Ų | 56.5 | 38% | 0.38 | 30% | 0.302 | S | S | . | . | S | Bend | trans | 55.2 | 11.8 | -171.8 | -61.3 | -53.7 | 0 | 0 | 0 | 114.5 | V91 | V91-N95 WeakPolarHBondContact O-CA 3.29Å; V91-N95 PolarHBondContact O-N 2.91Å |
| 96 | N | 78.4 | Confident | 83.3 | Confident | 91 Ų | 91 | 59 Ų | 59 | 49% | 0.487 | 32% | 0.317 | S | S | . | . | S | Bend | trans | -142.1 | 169.6 | 176 | 71.8 | -2 | 0 | 0 | 0 | 111 | L94 P98 | L94-N96 WeakPolarHBondContact CB-OD1 3.17Å; L94-N96 PolarHBondContact O-N 3.16Å; L94-N96 PolarHBondContact O-OD1 3.22Å; N96-P98 WeakPolarHBondContact O-CD 3.4Å |
| 97 | W | 83.9 | Confident | 82.9 | Confident | 66 Ų | 66 | 56.5 Ų | 56.5 | 25% | 0.25 | 30% | 0.301 | C | S | . | . | trans | -101.3 | 101.6 | 174.5 | -179.7 | -88.7 | 0 | 0 | 0 | 110.3 | F87 V91 Y99 G100 P103 C104 T107 | F87-W97 HydrophobicContact CB-CH2 3.71Å; F87-W97 HydrophobicContact CB-CZ3 4.14Å; F87-W97 HydrophobicContact CD1-CH2 4.22Å; F87-W97 HydrophobicContact CD1-CZ2 4.39Å; F87-W97 HydrophobicContact CG-CH2 4.37Å; V91-W97 HydrophobicContact CG2-CE3 3.57Å; V91-W97 HydrophobicContact CG2-CZ3 4.14Å; W97-Y99 HydrophobicContact CD2-CD2 4.23Å; W97-Y99 AromaticContact CE2-CD2 3.87Å; W97-Y99 HydrophobicContact CH2-CD2 4.2Å; W97-Y99 AromaticContact CZ2-CD2 3.82Å; W97-Y99 HydrophobicContact CZ2-CD2 3.82Å; W97-Y99 HydrophobicContact CZ2-CG 4.34Å; W97-Y99 PolarHBondContact O-N 3.42Å; W97-G100 PolarHBondContact NE1-O 3.08Å; W97-P103 VanDerWaalsContact CZ2-C 3.41Å; W97-P103 HydrophobicContact CZ2-CB 3.85Å; W97-C104 HydrophobicContact CD2-CB 4.32Å; W97-C104 HydrophobicContact CZ2-CB 3.95Å; W97-T107 HydrophobicContact CH2-CG2 4.11Å; W97-T107 WeakPolarHBondContact CH2-OG1 3.41Å | ||
| 98 | P | 88.7 | Confident | 82.5 | Confident | 68 Ų | 68 | 56.4 Ų | 56.4 | 44% | 0.442 | 30% | 0.301 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -7.2 | -173.8 | 36.2 | -41.5 | 0 | 0 | 0 | 114.1 | T90 L94 N96 | T90-P98 HydrophobicContact CG2-CG 3.71Å; L94-P98 HydrophobicContact CD1-CB 4.15Å; L94-P98 HydrophobicContact CD1-CG 3.73Å; N96-P98 WeakPolarHBondContact O-CD 3.4Å |
| 99 | Y | 87.7 | Confident | 82.6 | Confident | 95 Ų | 95 | 58 Ų | 58 | 37% | 0.373 | 31% | 0.308 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | -2.1 | -168.6 | -52.7 | -71.9 | 0 | 0 | 0 | 114.5 | F87 T90 W97 P103 | F87-Y99 HydrophobicContact CD1-CD1 4.43Å; F87-Y99 AromaticContact CD1-CD2 3.71Å; F87-Y99 HydrophobicContact CD1-CD2 3.71Å; F87-Y99 AromaticContact CD1-CE2 3.79Å; F87-Y99 HydrophobicContact CD1-CE2 3.79Å; F87-Y99 HydrophobicContact CD1-CG 4.04Å; F87-Y99 HydrophobicContact CE1-CD1 4.34Å; F87-Y99 HydrophobicContact CE1-CD2 4.39Å; F87-Y99 HydrophobicContact CE1-CG 4.27Å; T90-Y99 HydrophobicContact CG2-CE2 3.89Å; T90-Y99 PolarHBondContact OG1-OH 3.11Å; W97-Y99 HydrophobicContact CD2-CD2 4.23Å; W97-Y99 AromaticContact CE2-CD2 3.87Å; W97-Y99 HydrophobicContact CH2-CD2 4.2Å; W97-Y99 AromaticContact CZ2-CD2 3.82Å; W97-Y99 HydrophobicContact CZ2-CD2 3.82Å; W97-Y99 HydrophobicContact CZ2-CG 4.34Å; W97-Y99 PolarHBondContact O-N 3.42Å; Y99-P103 VanDerWaalsContact O-CD 3.25Å; Y99-P103 WeakPolarHBondContact O-CD 3.44Å; Y99-P103 VanDerWaalsContact O-CG 3.28Å; Y99-P103 WeakPolarHBondContact O-CG 3.18Å |
| 100 | G | 86.3 | Confident | 82.8 | Confident | 40 Ų | 40 | 60.1 Ų | 60.1 | 41% | 0.412 | 32% | 0.316 | S | S | . | . | trans | 73.3 | -176.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | W97 V102 C104 | W97-G100 PolarHBondContact NE1-O 3.08Å; G100-V102 PolarHBondContact O-N 3.01Å; G100-C104 PolarHBondContact O-N 3.43Å | ||
| 101 | F | 79.4 | Confident | 82.8 | Confident | 123 Ų | 123 | 59.7 Ų | 59.7 | 54% | 0.539 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -65.6 | -40.5 | -166.7 | -178 | -105.5 | 0 | 0 | 0 | 115.1 | C104 K105 | F101-C104 WeakPolarHBondContact O-CB 3.41Å; F101-C104 PolarHBondContact O-N 3.41Å; F101-K105 HydrophobicContact CD1-CD 4.25Å; F101-K105 HydrophobicContact CE1-CD 3.63Å; F101-K105 HydrophobicContact CE1-CG 4.47Å; F101-K105 HydrophobicContact CE2-CD 4.23Å; F101-K105 HydrophobicContact CZ-CD 3.68Å; F101-K105 HydrophobicContact CZ-CG 4.47Å; F101-K105 PolarHBondContact O-N 3.45Å; F101-K105 VanDerWaalsContact O-N 3.12Å |
| 102 | V | 85.7 | Confident | 83 | Confident | 103 Ų | 103 | 61.1 Ų | 61.1 | 62% | 0.624 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -66.4 | -54.4 | -174.8 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | G100 C104 K105 T106 | G100-V102 PolarHBondContact O-N 3.01Å; V102-C104 PolarHBondContact O-N 3.21Å; V102-K105 PolarHBondContact O-N 3.43Å; V102-T106 PolarHBondContact O-N 2.88Å; V102-T106 PolarHBondContact O-OG1 3.3Å; V102-T106 VanDerWaalsContact O-OG1 3.06Å |
| 103 | P | 87.8 | Confident | 83.5 | Confident | 39 Ų | 39 | 61 Ų | 61 | 25% | 0.253 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -58.2 | -32.2 | 174.8 | -29.6 | 40.4 | 0 | 0 | 0 | 113.6 | F87 W97 Y99 T106 T107 | F87-P103 HydrophobicContact CE1-CB 4.33Å; W97-P103 VanDerWaalsContact CZ2-C 3.41Å; W97-P103 HydrophobicContact CZ2-CB 3.85Å; Y99-P103 VanDerWaalsContact O-CD 3.25Å; Y99-P103 WeakPolarHBondContact O-CD 3.44Å; Y99-P103 VanDerWaalsContact O-CG 3.28Å; Y99-P103 WeakPolarHBondContact O-CG 3.18Å; P103-T106 PolarHBondContact O-N 3Å; P103-T107 WeakPolarHBondContact O-CB 3.46Å; P103-T107 PolarHBondContact O-N 3.09Å; P103-T107 PolarHBondContact O-OG1 3.26Å |
| 104 | C | 82.8 | Confident | 84.2 | Confident | 33 Ų | 33 | 58.2 Ų | 58.2 | 22% | 0.223 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60.4 | -54.2 | 176.2 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | W97 G100 F101 V102 T106 T107 H108 | W97-C104 HydrophobicContact CD2-CB 4.32Å; W97-C104 HydrophobicContact CZ2-CB 3.95Å; G100-C104 PolarHBondContact O-N 3.43Å; F101-C104 WeakPolarHBondContact O-CB 3.41Å; F101-C104 PolarHBondContact O-N 3.41Å; V102-C104 PolarHBondContact O-N 3.21Å; C104-T106 VanDerWaalsContact C-N 3.34Å; C104-T106 PolarHBondContact O-N 2.89Å; C104-T107 PolarHBondContact O-N 3.2Å; C104-H108 PolarHBondContact O-CD2 3.14Å; C104-H108 PolarHBondContact O-N 3.18Å; C104-H108 VanDerWaalsContact O-N 3.12Å |
| 105 | K | 80.5 | Confident | 84.5 | Confident | 98 Ų | 98 | 55.1 Ų | 55.1 | 43% | 0.426 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.6 | -41.3 | 177.4 | -74.3 | -167 | 164.1 | -174.1 | 0 | 112.5 | F101 V102 F109 | F101-K105 HydrophobicContact CD1-CD 4.25Å; F101-K105 HydrophobicContact CE1-CD 3.63Å; F101-K105 HydrophobicContact CE1-CG 4.47Å; F101-K105 HydrophobicContact CE2-CD 4.23Å; F101-K105 HydrophobicContact CZ-CD 3.68Å; F101-K105 HydrophobicContact CZ-CG 4.47Å; F101-K105 PolarHBondContact O-N 3.45Å; F101-K105 VanDerWaalsContact O-N 3.12Å; V102-K105 PolarHBondContact O-N 3.43Å; K105-F109 WeakPolarHBondContact O-CB 3.41Å; K105-F109 PolarHBondContact O-N 3.29Å |
| 106 | T | 83.6 | Confident | 85.3 | Confident | 53 Ų | 53 | 54 Ų | 54 | 33% | 0.325 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64 | -43.2 | 178.4 | -60.6 | 0 | 0 | 0 | 0 | 111.9 | V102 P103 C104 F109 F110 | V102-T106 PolarHBondContact O-N 2.88Å; V102-T106 PolarHBondContact O-OG1 3.3Å; V102-T106 VanDerWaalsContact O-OG1 3.06Å; P103-T106 PolarHBondContact O-N 3Å; C104-T106 VanDerWaalsContact C-N 3.34Å; C104-T106 PolarHBondContact O-N 2.89Å; T106-F109 WeakPolarHBondContact O-CB 3.27Å; T106-F109 PolarHBondContact O-N 3.04Å; T106-F110 HydrophobicContact CG2-CD2 3.62Å; T106-F110 HydrophobicContact CG2-CE2 3.55Å; T106-F110 VanDerWaalsContact O-CD2 3.3Å; T106-F110 WeakPolarHBondContact O-CD2 3.3Å; T106-F110 PolarHBondContact O-N 2.96Å |
| 107 | T | 83.7 | Confident | 85.9 | Confident | 3 Ų | 3 | 49.7 Ų | 49.7 | 2% | 0.018 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -61.1 | -47.9 | 178.9 | -63.5 | 0 | 0 | 0 | 0 | 110.9 | F87 W97 P103 C104 F110 Q111 | F87-T107 HydrophobicContact CB-CG2 4.1Å; W97-T107 HydrophobicContact CH2-CG2 4.11Å; W97-T107 WeakPolarHBondContact CH2-OG1 3.41Å; P103-T107 WeakPolarHBondContact O-CB 3.46Å; P103-T107 PolarHBondContact O-N 3.09Å; P103-T107 PolarHBondContact O-OG1 3.26Å; C104-T107 PolarHBondContact O-N 3.2Å; T107-F110 PolarHBondContact O-N 3.1Å; T107-Q111 VanDerWaalsContact O-CB 3.28Å; T107-Q111 WeakPolarHBondContact O-CB 3.45Å; T107-Q111 PolarHBondContact O-N 3.17Å |
| 108 | H | 81.1 | Confident | 86.2 | Confident | 56 Ų | 56 | 47 Ų | 47 | 26% | 0.259 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -63.7 | -40.9 | 174.9 | -79.5 | -64 | 0 | 0 | 0 | 112.6 | C104 Q111 Y112 | C104-H108 PolarHBondContact O-CD2 3.14Å; C104-H108 PolarHBondContact O-N 3.18Å; C104-H108 VanDerWaalsContact O-N 3.12Å; H108-Q111 PolarHBondContact ND1-OE1 2.98Å; H108-Q111 PolarHBondContact O-N 3.4Å; H108-Y112 WeakPolarHBondContact O-CD2 3.46Å; H108-Y112 PolarHBondContact O-N 2.9Å; H108-Y112 VanDerWaalsContact O-N 3.13Å |
| 109 | F | 86.3 | Confident | 86.2 | Confident | 58 Ų | 58 | 46.4 Ų | 46.4 | 25% | 0.254 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -57.2 | -53 | 176.1 | 177.1 | -92.2 | 0 | 0 | 0 | 111.4 | K105 T106 Q111 Y112 V113 Q163 V164 | K105-F109 WeakPolarHBondContact O-CB 3.41Å; K105-F109 PolarHBondContact O-N 3.29Å; T106-F109 WeakPolarHBondContact O-CB 3.27Å; T106-F109 PolarHBondContact O-N 3.04Å; F109-Q111 VanDerWaalsContact C-N 3.34Å; F109-Q111 PolarHBondContact O-N 2.87Å; F109-Y112 PolarHBondContact O-N 3.4Å; F109-V113 HydrophobicContact CD1-CG2 4.2Å; F109-V113 HydrophobicContact CD2-CG2 4.3Å; F109-V113 HydrophobicContact CE1-CG2 3.85Å; F109-V113 HydrophobicContact CE2-CG2 3.94Å; F109-V113 HydrophobicContact CG-CG2 4.42Å; F109-V113 HydrophobicContact CZ-CG2 3.71Å; F109-V113 WeakPolarHBondContact O-CB 3.44Å; F109-V113 VanDerWaalsContact O-CG2 3.26Å; F109-V113 WeakPolarHBondContact O-CG2 3.33Å; F109-V113 PolarHBondContact O-N 2.96Å; F109-Q163 HydrophobicContact CD2-CB 4.26Å; F109-Q163 HydrophobicContact CD2-CG 3.53Å; F109-Q163 HydrophobicContact CE2-CB 4.22Å; F109-Q163 HydrophobicContact CE2-CG 3.99Å; F109-Q163 HydrophobicContact CG-CG 4.24Å; F109-V164 HydrophobicContact CE2-CG2 4.07Å |
| 110 | F | 89.8 | Confident | 86.3 | Confident | 48 Ų | 48 | 42.9 Ų | 42.9 | 21% | 0.211 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.1 | -37.5 | 178.8 | -80 | -69.5 | 0 | 0 | 0 | 112.4 | L79 F83 T106 T107 Y112 V113 T114 | L79-F110 HydrophobicContact CD2-CE1 4.5Å; F83-F110 HydrophobicContact CB-CB 3.99Å; F83-F110 HydrophobicContact CB-CD2 3.95Å; F83-F110 HydrophobicContact CB-CG 4.03Å; F83-F110 HydrophobicContact CD1-CD2 4.22Å; F83-F110 HydrophobicContact CD1-CE2 4.21Å; F83-F110 HydrophobicContact CD2-CD1 4.45Å; F83-F110 HydrophobicContact CD2-CD2 4.37Å; F83-F110 HydrophobicContact CD2-CE2 4.44Å; F83-F110 HydrophobicContact CD2-CG 4.38Å; F83-F110 HydrophobicContact CE1-CE2 4.46Å; F83-F110 AromaticContact CG-CD2 3.93Å; F83-F110 HydrophobicContact CG-CD2 3.93Å; F83-F110 HydrophobicContact CG-CE2 4.2Å; F83-F110 HydrophobicContact CG-CG 4.22Å; T106-F110 HydrophobicContact CG2-CD2 3.62Å; T106-F110 HydrophobicContact CG2-CE2 3.55Å; T106-F110 VanDerWaalsContact O-CD2 3.3Å; T106-F110 WeakPolarHBondContact O-CD2 3.3Å; T106-F110 PolarHBondContact O-N 2.96Å; T107-F110 PolarHBondContact O-N 3.1Å; F110-Y112 VanDerWaalsContact C-N 3.35Å; F110-Y112 PolarHBondContact O-N 3.34Å; F110-V113 PolarHBondContact O-N 3.21Å; F110-T114 WeakPolarHBondContact O-CB 3.42Å; F110-T114 VanDerWaalsContact O-CG2 3.24Å; F110-T114 WeakPolarHBondContact O-CG2 3.35Å; F110-T114 PolarHBondContact O-N 2.94Å; F110-T114 PolarHBondContact O-OG1 3.48Å |
| 111 | Q | 84.8 | Confident | 86.5 | Confident | 13 Ų | 13 | 41 Ų | 41 | 6% | 0.061 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -55.5 | -50.6 | 178.1 | 179 | 179.5 | 3.6 | 0 | 0 | 111.1 | F80 C84 T107 H108 F109 T114 M115 | F80-Q111 HydrophobicContact CE2-CG 4.19Å; C84-Q111 WeakPolarHBondContact SG-CA 3.3Å; C84-Q111 PolarHBondContact SG-N 3.45Å; T107-Q111 VanDerWaalsContact O-CB 3.28Å; T107-Q111 WeakPolarHBondContact O-CB 3.45Å; T107-Q111 PolarHBondContact O-N 3.17Å; H108-Q111 PolarHBondContact ND1-OE1 2.98Å; H108-Q111 PolarHBondContact O-N 3.4Å; F109-Q111 VanDerWaalsContact C-N 3.34Å; F109-Q111 PolarHBondContact O-N 2.87Å; Q111-T114 PolarHBondContact O-OG1 3.44Å; Q111-M115 VanDerWaalsContact O-CB 3.29Å; Q111-M115 WeakPolarHBondContact O-CB 3.27Å; Q111-M115 PolarHBondContact O-N 3.3Å |
| 112 | Y | 84.9 | Confident | 86.9 | Confident | 67 Ų | 67 | 35.7 Ų | 35.7 | 26% | 0.263 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -78.2 | -39.1 | -178.1 | -69.6 | -64.1 | 0 | 0 | 0 | 112.9 | H108 F109 F110 T114 M115 F116 | H108-Y112 WeakPolarHBondContact O-CD2 3.46Å; H108-Y112 PolarHBondContact O-N 2.9Å; H108-Y112 VanDerWaalsContact O-N 3.13Å; F109-Y112 PolarHBondContact O-N 3.4Å; F110-Y112 VanDerWaalsContact C-N 3.35Å; F110-Y112 PolarHBondContact O-N 3.34Å; Y112-T114 PolarHBondContact O-N 3.49Å; Y112-M115 HydrophobicContact CD1-CE 3.84Å; Y112-M115 HydrophobicContact CD1-SD 4.5Å; Y112-M115 WeakPolarHBondContact O-CB 3.32Å; Y112-M115 PolarHBondContact O-N 2.87Å; Y112-F116 WeakPolarHBondContact O-CD2 3.38Å; Y112-F116 WeakPolarHBondContact O-CG 3.36Å; Y112-F116 PolarHBondContact O-N 2.8Å |
| 113 | V | 89.6 | Confident | 86.9 | Confident | 4 Ų | 4 | 31.4 Ų | 31.4 | 2% | 0.024 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.3 | -46.5 | 177.5 | 168.5 | 0 | 0 | 0 | 0 | 111.1 | F109 F110 F116 A117 W156 A159 Q163 | F109-V113 HydrophobicContact CD1-CG2 4.2Å; F109-V113 HydrophobicContact CD2-CG2 4.3Å; F109-V113 HydrophobicContact CE1-CG2 3.85Å; F109-V113 HydrophobicContact CE2-CG2 3.94Å; F109-V113 HydrophobicContact CG-CG2 4.42Å; F109-V113 HydrophobicContact CZ-CG2 3.71Å; F109-V113 WeakPolarHBondContact O-CB 3.44Å; F109-V113 VanDerWaalsContact O-CG2 3.26Å; F109-V113 WeakPolarHBondContact O-CG2 3.33Å; F109-V113 PolarHBondContact O-N 2.96Å; F110-V113 PolarHBondContact O-N 3.21Å; V113-F116 PolarHBondContact O-N 3.15Å; V113-A117 WeakPolarHBondContact O-CB 3.46Å; V113-A117 PolarHBondContact O-N 3.05Å; V113-W156 HydrophobicContact CG1-CE3 4.16Å; V113-W156 HydrophobicContact CG1-CZ3 4.05Å; V113-A159 HydrophobicContact CG1-CB 4.31Å; V113-Q163 HydrophobicContact CG2-CB 3.62Å; V113-Q163 HydrophobicContact CG2-CG 3.97Å |
| 114 | T | 91.7 | Very high | 87 | Confident | 3 Ų | 3 | 31.2 Ų | 31.2 | 2% | 0.018 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -68.1 | -36.3 | 179.2 | 56.5 | 0 | 0 | 0 | 0 | 112 | A76 L79 F80 F110 Q111 Y112 S118 | A76-T114 WeakPolarHBondContact O-CB 3.1Å; A76-T114 VanDerWaalsContact O-CG2 3.3Å; A76-T114 WeakPolarHBondContact O-CG2 3.46Å; L79-T114 HydrophobicContact CB-CG2 3.64Å; F80-T114 HydrophobicContact CB-CG2 4.33Å; F80-T114 WeakPolarHBondContact CD2-OG1 3.33Å; F110-T114 WeakPolarHBondContact O-CB 3.42Å; F110-T114 VanDerWaalsContact O-CG2 3.24Å; F110-T114 WeakPolarHBondContact O-CG2 3.35Å; F110-T114 PolarHBondContact O-N 2.94Å; F110-T114 PolarHBondContact O-OG1 3.48Å; Q111-T114 PolarHBondContact O-OG1 3.44Å; Y112-T114 PolarHBondContact O-N 3.49Å; T114-S118 WeakPolarHBondContact O-CB 3.22Å; T114-S118 PolarHBondContact O-N 3.43Å; T114-S118 PolarHBondContact O-OG 2.98Å |
| 115 | M | 86.6 | Confident | 87.2 | Confident | 26 Ų | 26 | 29.7 Ų | 29.7 | 13% | 0.128 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -60.1 | -53.2 | 171.4 | -178.4 | -167.8 | 74.4 | 0 | 0 | 111.5 | Q111 Y112 S118 I119 W217 | Q111-M115 VanDerWaalsContact O-CB 3.29Å; Q111-M115 WeakPolarHBondContact O-CB 3.27Å; Q111-M115 PolarHBondContact O-N 3.3Å; Y112-M115 HydrophobicContact CD1-CE 3.84Å; Y112-M115 HydrophobicContact CD1-SD 4.5Å; Y112-M115 WeakPolarHBondContact O-CB 3.32Å; Y112-M115 PolarHBondContact O-N 2.87Å; M115-S118 PolarHBondContact O-N 2.89Å; M115-I119 HydrophobicContact CG-CD1 4.03Å; M115-I119 WeakPolarHBondContact O-CG1 3.4Å; M115-I119 PolarHBondContact O-N 3.46Å; M115-W217 HydrophobicContact CB-CH2 3.81Å; M115-W217 HydrophobicContact CB-CZ2 4.29Å; M115-W217 HydrophobicContact CB-CZ3 4.43Å; M115-W217 HydrophobicContact CG-CE3 4.36Å; M115-W217 HydrophobicContact CG-CH2 3.56Å; M115-W217 HydrophobicContact CG-CZ2 4.02Å; M115-W217 HydrophobicContact CG-CZ3 3.76Å; M115-W217 HydrophobicContact SD-CE3 3.95Å; M115-W217 HydrophobicContact SD-CH2 3.7Å; M115-W217 HydrophobicContact SD-CZ3 3.3Å; M115-W217 WeakPolarHBondContact SD-CZ3 3.35Å |
| 116 | F | 88 | Confident | 87.4 | Confident | 47 Ų | 47 | 26.8 Ų | 26.8 | 21% | 0.206 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.2 | -43.3 | 179.4 | -71.6 | -55.8 | 0 | 0 | 0 | 112.1 | Y112 V113 S118 I119 W120 A159 V162 | Y112-F116 WeakPolarHBondContact O-CD2 3.38Å; Y112-F116 WeakPolarHBondContact O-CG 3.36Å; Y112-F116 PolarHBondContact O-N 2.8Å; V113-F116 PolarHBondContact O-N 3.15Å; F116-S118 VanDerWaalsContact C-N 3.31Å; F116-S118 PolarHBondContact O-N 2.85Å; F116-I119 PolarHBondContact O-N 3.47Å; F116-W120 PolarHBondContact O-N 2.77Å; F116-A159 HydrophobicContact CB-CB 3.89Å; F116-V162 HydrophobicContact CD2-CB 4.5Å; F116-V162 HydrophobicContact CD2-CG1 3.98Å; F116-V162 HydrophobicContact CE1-CG1 4.2Å; F116-V162 HydrophobicContact CE2-CB 4.49Å; F116-V162 HydrophobicContact CE2-CG1 3.55Å; F116-V162 HydrophobicContact CG-CG1 4.5Å; F116-V162 HydrophobicContact CZ-CG1 3.68Å |
| 117 | A | 91.2 | Very high | 87.5 | Confident | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -56.7 | -45.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | A76 V113 W120 L121 V155 W156 A159 | A76-A117 HydrophobicContact CB-CB 4.33Å; V113-A117 WeakPolarHBondContact O-CB 3.46Å; V113-A117 PolarHBondContact O-N 3.05Å; A117-W120 PolarHBondContact O-N 2.88Å; A117-L121 VanDerWaalsContact O-CB 3.24Å; A117-L121 WeakPolarHBondContact O-CB 3.44Å; A117-L121 WeakPolarHBondContact O-CD1 3.34Å; A117-L121 WeakPolarHBondContact O-CG 3.21Å; A117-L121 PolarHBondContact O-N 3.45Å; A117-V155 HydrophobicContact CB-CG1 4.4Å; A117-W156 HydrophobicContact CB-CD2 4.37Å; A117-W156 HydrophobicContact CB-CE3 4.08Å; A117-W156 HydrophobicContact CB-CH2 4.13Å; A117-W156 HydrophobicContact CB-CZ2 4.41Å; A117-W156 HydrophobicContact CB-CZ3 3.97Å; A117-A159 HydrophobicContact CB-CB 4.43Å |
| 118 | S | 90.9 | Very high | 87.5 | Confident | 9 Ų | 9 | 27.6 Ų | 27.6 | 6% | 0.063 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61.5 | -47.9 | 178.2 | -60.6 | 0 | 0 | 0 | 0 | 112.4 | T114 M115 F116 W120 L121 L122 | T114-S118 WeakPolarHBondContact O-CB 3.22Å; T114-S118 PolarHBondContact O-N 3.43Å; T114-S118 PolarHBondContact O-OG 2.98Å; M115-S118 PolarHBondContact O-N 2.89Å; F116-S118 VanDerWaalsContact C-N 3.31Å; F116-S118 PolarHBondContact O-N 2.85Å; S118-W120 VanDerWaalsContact C-N 3.35Å; S118-W120 PolarHBondContact O-N 3.37Å; S118-L121 PolarHBondContact O-N 3.34Å; S118-L122 WeakPolarHBondContact O-CG 3.46Å; S118-L122 PolarHBondContact O-N 2.93Å |
| 119 | I | 87.3 | Confident | 87.5 | Confident | 57 Ų | 57 | 26.3 Ų | 26.3 | 29% | 0.292 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -58.4 | -47 | 177.9 | -67.2 | 162.8 | 0 | 0 | 0 | 110.8 | M115 F116 L122 T123 L213 | M115-I119 HydrophobicContact CG-CD1 4.03Å; M115-I119 WeakPolarHBondContact O-CG1 3.4Å; M115-I119 PolarHBondContact O-N 3.46Å; F116-I119 PolarHBondContact O-N 3.47Å; I119-L122 PolarHBondContact O-N 2.93Å; I119-T123 PolarHBondContact O-N 3.46Å; I119-T123 PolarHBondContact O-OG1 2.92Å; I119-L213 HydrophobicContact CG1-CD2 3.7Å |
| 120 | W | 90.5 | Very high | 87.1 | Confident | 20 Ų | 20 | 27.2 Ų | 27.2 | 8% | 0.076 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -77.5 | -32.1 | -176.3 | -63.3 | -14.7 | 0 | 0 | 0 | 113.4 | F116 A117 S118 L122 T123 V124 V155 L158 A159 V162 L182 | F116-W120 PolarHBondContact O-N 2.77Å; A117-W120 PolarHBondContact O-N 2.88Å; S118-W120 VanDerWaalsContact C-N 3.35Å; S118-W120 PolarHBondContact O-N 3.37Å; W120-L122 VanDerWaalsContact C-N 3.33Å; W120-T123 WeakPolarHBondContact O-CB 3.31Å; W120-T123 PolarHBondContact O-N 3.44Å; W120-V124 WeakPolarHBondContact O-CB 3.17Å; W120-V124 VanDerWaalsContact O-CG2 3.31Å; W120-V124 WeakPolarHBondContact O-CG2 3.32Å; W120-V124 PolarHBondContact O-N 3.46Å; W120-V155 HydrophobicContact CB-CB 4.47Å; W120-V155 HydrophobicContact CB-CG1 3.79Å; W120-V155 HydrophobicContact CB-CG2 3.97Å; W120-V155 HydrophobicContact CE3-CG1 4.17Å; W120-V155 WeakPolarHBondContact CZ3-O 3.46Å; W120-L158 HydrophobicContact CE3-CB 3.93Å; W120-L158 VanDerWaalsContact CH2-C 3.44Å; W120-L158 HydrophobicContact CH2-CB 3.57Å; W120-L158 WeakPolarHBondContact CH2-O 3.48Å; W120-L158 HydrophobicContact CZ3-CB 3.09Å; W120-L158 HydrophobicContact CZ3-CD1 4.46Å; W120-L158 HydrophobicContact CZ3-CG 4.39Å; W120-A159 HydrophobicContact CE3-CB 4.25Å; W120-A159 VanDerWaalsContact CZ3-CA 3.46Å; W120-A159 HydrophobicContact CZ3-CB 3.79Å; W120-V162 HydrophobicContact CH2-CB 4.4Å; W120-V162 HydrophobicContact CH2-CG2 3.7Å; W120-V162 HydrophobicContact CZ2-CG2 4.08Å; W120-L182 VanDerWaalsContact CD1-CD2 3.47Å; W120-L182 HydrophobicContact CG-CD2 4.43Å; W120-L182 HydrophobicContact CZ2-CD1 4.31Å |
| 121 | L | 91.3 | Very high | 86.7 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -60.1 | -45.1 | 169.9 | -75.8 | 167.1 | 0 | 0 | 0 | 110.5 | F69 N72 L73 A117 S118 T123 V124 M125 V155 | F69-L121 HydrophobicContact CD1-CD2 4.25Å; N72-L121 HydrophobicContact CB-CD1 3.8Å; N72-L121 HydrophobicContact CB-CD2 3.8Å; N72-L121 HydrophobicContact CB-CG 4.48Å; L73-L121 HydrophobicContact CB-CD1 4.31Å; L73-L121 HydrophobicContact CD1-CD1 4.48Å; A117-L121 VanDerWaalsContact O-CB 3.24Å; A117-L121 WeakPolarHBondContact O-CB 3.44Å; A117-L121 WeakPolarHBondContact O-CD1 3.34Å; A117-L121 WeakPolarHBondContact O-CG 3.21Å; A117-L121 PolarHBondContact O-N 3.45Å; S118-L121 PolarHBondContact O-N 3.34Å; L121-T123 VanDerWaalsContact C-N 3.31Å; L121-T123 PolarHBondContact O-N 2.8Å; L121-V124 PolarHBondContact O-N 3.17Å; L121-M125 WeakPolarHBondContact O-CB 3.23Å; L121-M125 WeakPolarHBondContact O-CG 3.39Å; L121-M125 PolarHBondContact O-N 3.44Å; L121-V155 HydrophobicContact CD2-CG1 4.33Å; L121-V155 HydrophobicContact CG-CG1 3.98Å |
| 122 | L | 86.1 | Confident | 86.4 | Confident | 12 Ų | 12 | 28.9 Ų | 28.9 | 6% | 0.063 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -64.1 | -36.8 | 174.5 | -69.5 | 175.1 | 0 | 0 | 0 | 112.5 | L73 S118 I119 W120 M125 S126 L209 L213 | L73-L122 HydrophobicContact CD2-CD2 4.17Å; S118-L122 WeakPolarHBondContact O-CG 3.46Å; S118-L122 PolarHBondContact O-N 2.93Å; I119-L122 PolarHBondContact O-N 2.93Å; W120-L122 VanDerWaalsContact C-N 3.33Å; L122-M125 HydrophobicContact CD2-SD 4.35Å; L122-M125 PolarHBondContact O-N 3.14Å; L122-S126 WeakPolarHBondContact O-CB 3.23Å; L122-S126 PolarHBondContact O-N 3.45Å; L122-S126 PolarHBondContact O-OG 3.39Å; L122-L209 HydrophobicContact CD1-CB 4.38Å; L122-L209 HydrophobicContact CD2-CB 3.56Å; L122-L209 HydrophobicContact CD2-CD1 3.88Å; L122-L209 HydrophobicContact CD2-CG 4.31Å; L122-L213 HydrophobicContact CD1-CB 4.46Å; L122-L213 HydrophobicContact CD1-CD2 3.95Å |
| 123 | T | 87.5 | Confident | 85.8 | Confident | 13 Ų | 13 | 29.1 Ų | 29.1 | 8% | 0.08 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.2 | -49.1 | 174.6 | -56.6 | 0 | 0 | 0 | 0 | 110.7 | I119 W120 L121 M125 S126 V127 V186 | I119-T123 PolarHBondContact O-N 3.46Å; I119-T123 PolarHBondContact O-OG1 2.92Å; W120-T123 WeakPolarHBondContact O-CB 3.31Å; W120-T123 PolarHBondContact O-N 3.44Å; L121-T123 VanDerWaalsContact C-N 3.31Å; L121-T123 PolarHBondContact O-N 2.8Å; T123-M125 VanDerWaalsContact C-N 3.35Å; T123-M125 PolarHBondContact O-N 3.28Å; T123-S126 WeakPolarHBondContact O-CB 3.29Å; T123-S126 PolarHBondContact O-N 3.29Å; T123-S126 VanDerWaalsContact O-N 3.14Å; T123-V127 WeakPolarHBondContact O-CG2 3.27Å; T123-V127 PolarHBondContact O-N 2.69Å; T123-V186 HydrophobicContact CG2-CG2 4.38Å |
| 124 | V | 89.6 | Confident | 85.1 | Confident | 36 Ų | 36 | 34.4 Ų | 34.4 | 22% | 0.218 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -63.4 | -40.3 | 177.2 | 173.1 | 0 | 0 | 0 | 0 | 111 | F69 W120 L121 S126 V127 D128 V155 | F69-V124 HydrophobicContact CD1-CG1 4.2Å; F69-V124 HydrophobicContact CE1-CB 4.47Å; F69-V124 HydrophobicContact CE1-CG1 3.43Å; F69-V124 VanDerWaalsContact CE1-CG1 3.43Å; F69-V124 HydrophobicContact CE2-CG1 4.23Å; F69-V124 HydrophobicContact CZ-CG1 3.44Å; F69-V124 VanDerWaalsContact CZ-CG1 3.44Å; W120-V124 WeakPolarHBondContact O-CB 3.17Å; W120-V124 VanDerWaalsContact O-CG2 3.31Å; W120-V124 WeakPolarHBondContact O-CG2 3.32Å; W120-V124 PolarHBondContact O-N 3.46Å; L121-V124 PolarHBondContact O-N 3.17Å; V124-S126 VanDerWaalsContact C-N 3.32Å; V124-S126 PolarHBondContact O-N 3.04Å; V124-V127 PolarHBondContact O-N 2.82Å; V124-D128 VanDerWaalsContact O-CB 3.32Å; V124-D128 WeakPolarHBondContact O-CB 3.46Å; V124-D128 PolarHBondContact O-N 3.24Å; V124-V155 HydrophobicContact CG2-CG2 3.96Å |
| 125 | M | 87.2 | Confident | 84.5 | Confident | 1 Ų | 1 | 37.3 Ų | 37.3 | 1% | 0.005 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60.6 | -41.2 | 173.1 | -73.8 | 174.8 | 72.9 | 0 | 0 | 111.6 | F69 V70 L121 L122 T123 D128 R129 V206 L209 | F69-M125 HydrophobicContact CB-CG 3.49Å; F69-M125 VanDerWaalsContact CB-CG 3.49Å; F69-M125 HydrophobicContact CB-SD 3.79Å; F69-M125 HydrophobicContact CD2-CG 3.94Å; F69-M125 HydrophobicContact CG-CG 3.85Å; V70-M125 HydrophobicContact CG2-CE 3.92Å; L121-M125 WeakPolarHBondContact O-CB 3.23Å; L121-M125 WeakPolarHBondContact O-CG 3.39Å; L121-M125 PolarHBondContact O-N 3.44Å; L122-M125 HydrophobicContact CD2-SD 4.35Å; L122-M125 PolarHBondContact O-N 3.14Å; T123-M125 VanDerWaalsContact C-N 3.35Å; T123-M125 PolarHBondContact O-N 3.28Å; M125-D128 PolarHBondContact O-N 3.45Å; M125-R129 VanDerWaalsContact O-CG 3.3Å; M125-R129 WeakPolarHBondContact O-CG 3.46Å; M125-R129 PolarHBondContact O-N 2.82Å; M125-V206 HydrophobicContact CB-CG2 4Å; M125-V206 HydrophobicContact CE-CG2 4.06Å; M125-L209 HydrophobicContact CE-CD1 4.49Å |
| 126 | S | 83.7 | Confident | 84.1 | Confident | 37 Ų | 37 | 38.2 Ų | 38.2 | 26% | 0.259 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -62.5 | -45.2 | 175.6 | -58.4 | 0 | 0 | 0 | 0 | 111.4 | L122 T123 V124 R129 Y130 V206 | L122-S126 WeakPolarHBondContact O-CB 3.23Å; L122-S126 PolarHBondContact O-N 3.45Å; L122-S126 PolarHBondContact O-OG 3.39Å; T123-S126 WeakPolarHBondContact O-CB 3.29Å; T123-S126 PolarHBondContact O-N 3.29Å; T123-S126 VanDerWaalsContact O-N 3.14Å; V124-S126 VanDerWaalsContact C-N 3.32Å; V124-S126 PolarHBondContact O-N 3.04Å; S126-R129 PolarHBondContact O-N 2.98Å; S126-Y130 WeakPolarHBondContact O-CB 3.42Å; S126-Y130 PolarHBondContact O-N 2.99Å; S126-V206 WeakPolarHBondContact OG-CG1 3.29Å |
| 127 | V | 85.2 | Confident | 83.8 | Confident | 55 Ų | 55 | 38.3 Ų | 38.3 | 33% | 0.333 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -64.2 | -45.4 | 177 | 172.7 | 0 | 0 | 0 | 0 | 111.2 | T123 V124 R129 Y130 F131 | T123-V127 WeakPolarHBondContact O-CG2 3.27Å; T123-V127 PolarHBondContact O-N 2.69Å; V124-V127 PolarHBondContact O-N 2.82Å; V127-R129 VanDerWaalsContact C-N 3.32Å; V127-R129 PolarHBondContact O-N 3.24Å; V127-Y130 WeakPolarHBondContact O-CB 3.26Å; V127-Y130 PolarHBondContact O-N 3.37Å; V127-Y130 VanDerWaalsContact O-N 3.15Å; V127-F131 HydrophobicContact CG1-CD2 3.64Å; V127-F131 HydrophobicContact CG1-CE2 3.53Å; V127-F131 VanDerWaalsContact O-CD2 3.27Å; V127-F131 WeakPolarHBondContact O-CD2 3.32Å; V127-F131 PolarHBondContact O-N 3.45Å |
| 128 | D | 84.6 | Confident | 83.3 | Confident | 17 Ų | 17 | 45 Ų | 45 | 9% | 0.091 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.9 | -43.6 | 175.2 | 160.9 | 82.5 | 0 | 0 | 0 | 111.4 | F69 V124 M125 F131 A132 R143 | F69-D128 HydrophobicContact CE2-CB 4.21Å; V124-D128 VanDerWaalsContact O-CB 3.32Å; V124-D128 WeakPolarHBondContact O-CB 3.46Å; V124-D128 PolarHBondContact O-N 3.24Å; M125-D128 PolarHBondContact O-N 3.45Å; D128-F131 PolarHBondContact O-N 2.88Å; D128-A132 WeakPolarHBondContact O-CB 3.14Å; D128-A132 PolarHBondContact O-N 2.91Å; D128-R143 VanDerWaalsContact OD1-CD 3.32Å; D128-R143 WeakPolarHBondContact OD1-CD 3.3Å; D128-R143 WeakPolarHBondContact OD1-CG 3.37Å; D128-R143 IonicContact OD1-CZ 3.97Å; D128-R143 IonicContact OD1-NE 2.88Å; D128-R143 PolarHBondContact OD1-NE 2.92Å; D128-R143 IonicContact OD2-NE 3.77Å |
| 129 | R | 81.3 | Confident | 82.6 | Confident | 30 Ų | 30 | 44.7 Ų | 44.7 | 11% | 0.113 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.8 | -43.7 | 174.3 | -71.4 | -51.2 | 100.3 | 154.8 | 15.1 | 111.9 | T66 M125 S126 V127 F131 A132 L133 R143 V206 | T66-R129 PolarHBondContact OG1-NH2 3.32Å; M125-R129 VanDerWaalsContact O-CG 3.3Å; M125-R129 WeakPolarHBondContact O-CG 3.46Å; M125-R129 PolarHBondContact O-N 2.82Å; S126-R129 PolarHBondContact O-N 2.98Å; V127-R129 VanDerWaalsContact C-N 3.32Å; V127-R129 PolarHBondContact O-N 3.24Å; R129-F131 PolarHBondContact O-N 3.13Å; R129-A132 PolarHBondContact O-N 3.38Å; R129-L133 WeakPolarHBondContact O-CB 3.36Å; R129-L133 VanDerWaalsContact O-CG 3.23Å; R129-L133 WeakPolarHBondContact O-CG 3.28Å; R129-L133 PolarHBondContact O-N 3.25Å; R129-R143 VanDerWaalsContact CZ-NH2 3.32Å; R129-V206 HydrophobicContact CG-CG2 4.17Å |
| 130 | Y | 78.6 | Confident | 82.3 | Confident | 77 Ų | 77 | 46.5 Ų | 46.5 | 30% | 0.302 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -57.5 | -47.9 | 176.3 | 168 | -95.8 | 0 | 0 | 0 | 111.5 | S126 V127 L133 K134 | S126-Y130 WeakPolarHBondContact O-CB 3.42Å; S126-Y130 PolarHBondContact O-N 2.99Å; V127-Y130 WeakPolarHBondContact O-CB 3.26Å; V127-Y130 PolarHBondContact O-N 3.37Å; V127-Y130 VanDerWaalsContact O-N 3.15Å; Y130-L133 PolarHBondContact O-N 2.82Å; Y130-K134 HydrophobicContact CE1-CD 4.1Å; Y130-K134 HydrophobicContact CE2-CB 4.44Å; Y130-K134 HydrophobicContact CE2-CD 3.68Å; Y130-K134 WeakPolarHBondContact O-CB 3.5Å; Y130-K134 PolarHBondContact O-N 2.74Å; Y130-K134 WeakPolarHBondContact OH-CD 3.39Å; Y130-K134 WeakPolarHBondContact OH-CE 3.19Å; Y130-K134 PolarHBondContact OH-NZ 3.34Å |
| 131 | F | 80.9 | Confident | 82 | Confident | 87 Ų | 87 | 48.8 Ų | 48.8 | 38% | 0.382 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -65.2 | -40.2 | 177 | -81.6 | -72.7 | 0 | 0 | 0 | 112.6 | V127 D128 R129 L133 H135 | V127-F131 HydrophobicContact CG1-CD2 3.64Å; V127-F131 HydrophobicContact CG1-CE2 3.53Å; V127-F131 VanDerWaalsContact O-CD2 3.27Å; V127-F131 WeakPolarHBondContact O-CD2 3.32Å; V127-F131 PolarHBondContact O-N 3.45Å; D128-F131 PolarHBondContact O-N 2.88Å; R129-F131 PolarHBondContact O-N 3.13Å; F131-L133 PolarHBondContact O-N 3.01Å; F131-H135 AromaticContact CD1-CD2 3.98Å; F131-H135 CarbonylContact O-C 3.56Å; F131-H135 VanDerWaalsContact O-C 3.28Å; F131-H135 WeakPolarHBondContact O-CA 3.4Å; F131-H135 PolarHBondContact O-N 3.44Å |
| 132 | A | 78.4 | Confident | 81.7 | Confident | 9 Ų | 9 | 54 Ų | 54 | 7% | 0.074 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.7 | -33.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | D128 R129 R199 | D128-A132 WeakPolarHBondContact O-CB 3.14Å; D128-A132 PolarHBondContact O-N 2.91Å; R129-A132 PolarHBondContact O-N 3.38Å; A132-R199 PolarHBondContact O-NH1 3.43Å |
| 133 | L | 72.9 | Confident | 81.8 | Confident | 72 Ų | 72 | 57 Ų | 57 | 38% | 0.377 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -83.6 | -48 | -179.9 | -68.1 | 171.8 | 0 | 0 | 0 | 112.3 | R129 Y130 F131 R199 | R129-L133 WeakPolarHBondContact O-CB 3.36Å; R129-L133 VanDerWaalsContact O-CG 3.23Å; R129-L133 WeakPolarHBondContact O-CG 3.28Å; R129-L133 PolarHBondContact O-N 3.25Å; Y130-L133 PolarHBondContact O-N 2.82Å; F131-L133 PolarHBondContact O-N 3.01Å; L133-R199 HydrophobicContact CD2-CB 3.52Å; L133-R199 HydrophobicContact CD2-CG 4.19Å |
| 134 | K | 74.5 | Confident | 82 | Confident | 114 Ų | 114 | 58.9 Ų | 58.9 | 50% | 0.496 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -83.2 | -35.6 | -172.9 | -170.6 | 177.1 | 174.7 | 165.7 | 0 | 113.7 | Y130 | Y130-K134 HydrophobicContact CE1-CD 4.1Å; Y130-K134 HydrophobicContact CE2-CB 4.44Å; Y130-K134 HydrophobicContact CE2-CD 3.68Å; Y130-K134 WeakPolarHBondContact O-CB 3.5Å; Y130-K134 PolarHBondContact O-N 2.74Å; Y130-K134 WeakPolarHBondContact OH-CD 3.39Å; Y130-K134 WeakPolarHBondContact OH-CE 3.19Å; Y130-K134 PolarHBondContact OH-NZ 3.34Å |
| 135 | H | 77.8 | Confident | 82.1 | Confident | 65 Ų | 65 | 59.1 Ų | 59.1 | 30% | 0.301 | 30% | 0.304 | S | S | . | . | trans | -132.8 | 62.7 | -172.1 | -60.6 | -59 | 0 | 0 | 0 | 111.3 | F131 L137 K138 A139 | F131-H135 AromaticContact CD1-CD2 3.98Å; F131-H135 CarbonylContact O-C 3.56Å; F131-H135 VanDerWaalsContact O-C 3.28Å; F131-H135 WeakPolarHBondContact O-CA 3.4Å; F131-H135 PolarHBondContact O-N 3.44Å; H135-L137 VanDerWaalsContact C-N 3.3Å; H135-L137 PolarHBondContact O-N 3.43Å; H135-K138 HydrophobicContact CB-CB 4.16Å; H135-K138 PolarHBondContact O-N 3.42Å; H135-K138 VanDerWaalsContact O-N 3.11Å; H135-A139 WeakPolarHBondContact O-CB 3.34Å; H135-A139 PolarHBondContact O-N 2.9Å | ||
| 136 | P | 78.2 | Confident | 82.5 | Confident | 45 Ų | 45 | 67.1 Ų | 67.1 | 29% | 0.292 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -55.4 | -42.8 | -170.8 | 22 | -33.8 | 0 | 0 | 0 | 113.2 | A139 V140 | P136-A139 PolarHBondContact O-N 3.39Å; P136-V140 PolarHBondContact O-N 2.92Å |
| 137 | L | 81.5 | Confident | 83 | Confident | 48 Ų | 48 | 67.3 Ų | 67.3 | 25% | 0.251 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.6 | -46.3 | 178.9 | -70.4 | 154.4 | 0 | 0 | 0 | 112.1 | H135 H298 F302 | H135-L137 VanDerWaalsContact C-N 3.3Å; H135-L137 PolarHBondContact O-N 3.43Å; L137-H298 HydrophobicContact CD2-CB 4.37Å; L137-H298 WeakPolarHBondContact CD2-CD2 3.44Å; L137-H298 WeakPolarHBondContact CD2-CE1 3.38Å; L137-H298 VanDerWaalsContact CD2-CG 3.45Å; L137-H298 WeakPolarHBondContact CD2-ND1 3.13Å; L137-H298 VanDerWaalsContact CD2-NE2 3.3Å; L137-H298 WeakPolarHBondContact CD2-NE2 3.42Å; L137-F302 HydrophobicContact CD1-CB 4.27Å; L137-F302 HydrophobicContact CD1-CD2 3.84Å; L137-F302 HydrophobicContact CD2-CD2 4.2Å |
| 138 | K | 80.6 | Confident | 83.4 | Confident | 140 Ų | 140 | 64.7 Ų | 64.7 | 61% | 0.609 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -71.1 | -36.4 | 177.2 | -62.9 | -174.1 | 178.4 | -177.3 | 0 | 111.1 | H135 V140 A141 F142 | H135-K138 HydrophobicContact CB-CB 4.16Å; H135-K138 PolarHBondContact O-N 3.42Å; H135-K138 VanDerWaalsContact O-N 3.11Å; K138-V140 PolarHBondContact O-N 2.92Å; K138-A141 PolarHBondContact O-N 3.17Å; K138-A141 VanDerWaalsContact O-N 3.16Å; K138-F142 WeakPolarHBondContact O-CD2 3.19Å |
| 139 | A | 77.9 | Confident | 84 | Confident | 3 Ų | 3 | 66 Ų | 66 | 3% | 0.025 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.2 | -30.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | H135 P136 A141 F142 R143 | H135-A139 WeakPolarHBondContact O-CB 3.34Å; H135-A139 PolarHBondContact O-N 2.9Å; P136-A139 PolarHBondContact O-N 3.39Å; A139-A141 PolarHBondContact O-N 2.88Å; A139-F142 PolarHBondContact O-N 2.82Å; A139-R143 HydrophobicContact CB-CG 4.19Å; A139-R143 WeakPolarHBondContact O-CB 3.44Å; A139-R143 WeakPolarHBondContact O-CG 3.48Å; A139-R143 PolarHBondContact O-N 3.38Å |
| 140 | V | 80.2 | Confident | 84.7 | Confident | 96 Ų | 96 | 72.3 Ų | 72.3 | 58% | 0.582 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -55.7 | -38.6 | 177.1 | 176.5 | 0 | 0 | 0 | 0 | 112.1 | P136 K138 | P136-V140 PolarHBondContact O-N 2.92Å; K138-V140 PolarHBondContact O-N 2.92Å |
| 141 | A | 84.3 | Confident | 85.5 | Confident | 67 Ų | 67 | 72.5 Ų | 72.5 | 55% | 0.554 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -71.4 | -35.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113 | K138 A139 | K138-A141 PolarHBondContact O-N 3.17Å; K138-A141 VanDerWaalsContact O-N 3.16Å; A139-A141 PolarHBondContact O-N 2.88Å |
| 142 | F | 83.9 | Confident | 86.3 | Confident | 109 Ų | 109 | 68.4 Ų | 68.4 | 48% | 0.478 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -94.2 | -19.2 | -174.3 | -58 | -75.2 | 0 | 0 | 0 | 113.8 | K138 A139 T144 M147 | K138-F142 WeakPolarHBondContact O-CD2 3.19Å; A139-F142 PolarHBondContact O-N 2.82Å; F142-T144 VanDerWaalsContact C-N 3.27Å; F142-T144 PolarHBondContact O-N 2.95Å; F142-M147 HydrophobicContact CD1-CE 4.27Å; F142-M147 VanDerWaalsContact O-CB 3.28Å; F142-M147 WeakPolarHBondContact O-CB 3.19Å |
| 143 | R | 89.3 | Confident | 87.2 | Confident | 77 Ų | 77 | 72 Ų | 72 | 29% | 0.291 | 36% | 0.361 | S | S | . | . | trans | -93 | 45 | -175.3 | -62.7 | -175 | 64.9 | -124.2 | -5.2 | 112.7 | A65 D128 R129 A139 | A65-R143 HydrophobicContact CB-CB 4.45Å; A65-R143 VanDerWaalsContact CB-O 3.3Å; A65-R143 WeakPolarHBondContact CB-O 3.43Å; D128-R143 VanDerWaalsContact OD1-CD 3.32Å; D128-R143 WeakPolarHBondContact OD1-CD 3.3Å; D128-R143 WeakPolarHBondContact OD1-CG 3.37Å; D128-R143 IonicContact OD1-CZ 3.97Å; D128-R143 IonicContact OD1-NE 2.88Å; D128-R143 PolarHBondContact OD1-NE 2.92Å; D128-R143 IonicContact OD2-NE 3.77Å; R129-R143 VanDerWaalsContact CZ-NH2 3.32Å; A139-R143 HydrophobicContact CB-CG 4.19Å; A139-R143 WeakPolarHBondContact O-CB 3.44Å; A139-R143 WeakPolarHBondContact O-CG 3.48Å; A139-R143 PolarHBondContact O-N 3.38Å | ||
| 144 | T | 91.2 | Very high | 88.3 | Confident | 51 Ų | 51 | 72.7 Ų | 72.7 | 31% | 0.313 | 36% | 0.364 | S | S | . | . | S | Bend | trans | -97.9 | 149.7 | 173.5 | 68.1 | 0 | 0 | 0 | 0 | 110.9 | F142 K146 M147 A148 | F142-T144 VanDerWaalsContact C-N 3.27Å; F142-T144 PolarHBondContact O-N 2.95Å; T144-K146 PolarHBondContact O-N 2.91Å; T144-M147 PolarHBondContact O-N 3.46Å; T144-M147 VanDerWaalsContact O-N 3.1Å; T144-M147 VanDerWaalsContact OG1-CG 3.29Å; T144-M147 WeakPolarHBondContact OG1-CG 3.23Å; T144-M147 PolarHBondContact OG1-N 2.93Å; T144-A148 PolarHBondContact O-N 2.79Å |
| 145 | P | 92.7 | Very high | 89.3 | Confident | 41 Ų | 41 | 67.6 Ų | 67.6 | 27% | 0.266 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -55.7 | -34.5 | 176 | -26.9 | 34.9 | 0 | 0 | 0 | 113.4 | R62 A63 V68 A148 A149 | R62-P145 WeakPolarHBondContact O-CG 3.24Å; A63-P145 WeakPolarHBondContact O-CG 3.49Å; V68-P145 HydrophobicContact CG2-CB 4.02Å; P145-A148 PolarHBondContact O-N 3.1Å; P145-A149 WeakPolarHBondContact O-CB 3.45Å; P145-A149 PolarHBondContact O-N 3.25Å |
| 146 | K | 95.1 | Very high | 90.2 | Very high | 170 Ų | 170 | 67 Ų | 67 | 74% | 0.739 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -63.5 | -44.6 | 176.3 | -66.5 | -175.4 | 178.7 | -177.5 | 0 | 111.9 | T144 A149 R150 | T144-K146 PolarHBondContact O-N 2.91Å; K146-A149 PolarHBondContact O-N 2.88Å; K146-R150 WeakPolarHBondContact O-CG 3.43Å; K146-R150 PolarHBondContact O-N 3.3Å; K146-R150 VanDerWaalsContact O-N 3.1Å |
| 147 | M | 94 | Very high | 91.1 | Very high | 40 Ų | 40 | 70.3 Ų | 70.3 | 20% | 0.197 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -68.4 | -41.2 | 176.6 | -69.2 | -62.1 | -76.6 | 0 | 0 | 111.5 | F142 T144 A149 R150 Y151 | F142-M147 HydrophobicContact CD1-CE 4.27Å; F142-M147 VanDerWaalsContact O-CB 3.28Å; F142-M147 WeakPolarHBondContact O-CB 3.19Å; T144-M147 PolarHBondContact O-N 3.46Å; T144-M147 VanDerWaalsContact O-N 3.1Å; T144-M147 VanDerWaalsContact OG1-CG 3.29Å; T144-M147 WeakPolarHBondContact OG1-CG 3.23Å; T144-M147 PolarHBondContact OG1-N 2.93Å; M147-A149 VanDerWaalsContact C-N 3.31Å; M147-A149 PolarHBondContact O-N 3.25Å; M147-R150 WeakPolarHBondContact O-CB 3.35Å; M147-R150 PolarHBondContact O-N 3.3Å; M147-R150 VanDerWaalsContact O-N 3.17Å; M147-Y151 HydrophobicContact CB-CE2 4.14Å; M147-Y151 WeakPolarHBondContact O-CD2 3.13Å; M147-Y151 PolarHBondContact O-N 2.96Å |
| 148 | A | 94.3 | Very high | 91.6 | Very high | 1 Ų | 1 | 71.9 Ų | 71.9 | 1% | 0.008 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -60.1 | -39.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | A65 V68 F69 T144 P145 Y151 S152 | A65-A148 HydrophobicContact CB-CB 3.98Å; A65-A148 WeakPolarHBondContact O-CB 3.24Å; V68-A148 HydrophobicContact CB-CB 3.8Å; V68-A148 HydrophobicContact CG1-CB 4.07Å; V68-A148 HydrophobicContact CG2-CB 4.24Å; F69-A148 HydrophobicContact CE1-CB 3.98Å; F69-A148 HydrophobicContact CE2-CB 3.98Å; F69-A148 HydrophobicContact CZ-CB 3.68Å; T144-A148 PolarHBondContact O-N 2.79Å; P145-A148 PolarHBondContact O-N 3.1Å; A148-Y151 PolarHBondContact O-N 2.94Å; A148-S152 WeakPolarHBondContact O-CB 3.31Å; A148-S152 PolarHBondContact O-N 2.93Å; A148-S152 PolarHBondContact O-OG 3.34Å |
| 149 | A | 96.4 | Very high | 92.1 | Very high | 43 Ų | 43 | 65.2 Ų | 65.2 | 36% | 0.355 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63.5 | -44 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | V68 P145 K146 M147 Y151 S152 V153 | V68-A149 HydrophobicContact CG1-CB 4.23Å; P145-A149 WeakPolarHBondContact O-CB 3.45Å; P145-A149 PolarHBondContact O-N 3.25Å; K146-A149 PolarHBondContact O-N 2.88Å; M147-A149 VanDerWaalsContact C-N 3.31Å; M147-A149 PolarHBondContact O-N 3.25Å; A149-Y151 PolarHBondContact O-N 2.86Å; A149-S152 WeakPolarHBondContact O-CB 3.3Å; A149-S152 PolarHBondContact O-N 3.06Å; A149-V153 WeakPolarHBondContact O-CG2 3.3Å; A149-V153 PolarHBondContact O-N 2.79Å |
| 150 | R | 96.6 | Very high | 92.7 | Very high | 164 Ų | 164 | 67.1 Ų | 67.1 | 62% | 0.619 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -59.1 | -47.4 | 174.6 | -71.6 | 174.3 | 177.9 | 176.5 | -4.4 | 112.2 | K146 M147 S152 V153 I154 | K146-R150 WeakPolarHBondContact O-CG 3.43Å; K146-R150 PolarHBondContact O-N 3.3Å; K146-R150 VanDerWaalsContact O-N 3.1Å; M147-R150 WeakPolarHBondContact O-CB 3.35Å; M147-R150 PolarHBondContact O-N 3.3Å; M147-R150 VanDerWaalsContact O-N 3.17Å; R150-S152 VanDerWaalsContact C-N 3.28Å; R150-S152 PolarHBondContact O-N 3.13Å; R150-V153 PolarHBondContact O-N 3.09Å; R150-I154 WeakPolarHBondContact O-CG1 3.49Å; R150-I154 PolarHBondContact O-N 2.95Å |
| 151 | Y | 95.3 | Very high | 93.2 | Very high | 80 Ų | 80 | 67.4 Ų | 67.4 | 31% | 0.314 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -61.5 | -38.1 | 176 | -62.4 | -42.3 | 0 | 0 | 0 | 112.1 | F69 M147 A148 A149 I154 V155 | F69-Y151 HydrophobicContact CZ-CD2 4.12Å; M147-Y151 HydrophobicContact CB-CE2 4.14Å; M147-Y151 WeakPolarHBondContact O-CD2 3.13Å; M147-Y151 PolarHBondContact O-N 2.96Å; A148-Y151 PolarHBondContact O-N 2.94Å; A149-Y151 PolarHBondContact O-N 2.86Å; Y151-I154 PolarHBondContact O-N 3.21Å; Y151-V155 WeakPolarHBondContact O-CG2 3.46Å; Y151-V155 PolarHBondContact O-N 3.24Å |
| 152 | S | 96.5 | Very high | 93.1 | Very high | 1 Ų | 1 | 65 Ų | 65 | 1% | 0.007 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.9 | -43.3 | 177.1 | -54.5 | 0 | 0 | 0 | 0 | 111.6 | N72 A148 A149 R150 I154 V155 W156 | N72-S152 WeakPolarHBondContact ND2-CB 3.37Å; N72-S152 PolarHBondContact ND2-OG 2.8Å; A148-S152 WeakPolarHBondContact O-CB 3.31Å; A148-S152 PolarHBondContact O-N 2.93Å; A148-S152 PolarHBondContact O-OG 3.34Å; A149-S152 WeakPolarHBondContact O-CB 3.3Å; A149-S152 PolarHBondContact O-N 3.06Å; R150-S152 VanDerWaalsContact C-N 3.28Å; R150-S152 PolarHBondContact O-N 3.13Å; S152-I154 VanDerWaalsContact C-N 3.35Å; S152-I154 PolarHBondContact O-N 3.45Å; S152-V155 WeakPolarHBondContact O-CB 3.39Å; S152-V155 PolarHBondContact O-N 3.46Å; S152-W156 PolarHBondContact O-N 3.43Å |
| 153 | V | 97.4 | Very high | 93.1 | Very high | 84 Ų | 84 | 60.4 Ų | 60.4 | 51% | 0.509 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59.9 | -44.5 | 174.5 | 172 | 0 | 0 | 0 | 0 | 111.3 | A149 R150 V155 W156 L157 | A149-V153 WeakPolarHBondContact O-CG2 3.3Å; A149-V153 PolarHBondContact O-N 2.79Å; R150-V153 PolarHBondContact O-N 3.09Å; V153-V155 VanDerWaalsContact C-N 3.29Å; V153-V155 PolarHBondContact O-N 3.15Å; V153-W156 PolarHBondContact O-N 3.2Å; V153-L157 HydrophobicContact CG1-CD1 3.91Å; V153-L157 HydrophobicContact CG1-CG 4.26Å; V153-L157 WeakPolarHBondContact O-CG 3.41Å; V153-L157 PolarHBondContact O-N 3.03Å |
| 154 | I | 96.7 | Very high | 92.7 | Very high | 87 Ų | 87 | 59.8 Ų | 59.8 | 45% | 0.446 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -59 | -43.4 | 175.9 | -66.7 | 165.4 | 0 | 0 | 0 | 110.7 | R150 Y151 S152 L157 L158 | R150-I154 WeakPolarHBondContact O-CG1 3.49Å; R150-I154 PolarHBondContact O-N 2.95Å; Y151-I154 PolarHBondContact O-N 3.21Å; S152-I154 VanDerWaalsContact C-N 3.35Å; S152-I154 PolarHBondContact O-N 3.45Å; I154-L157 PolarHBondContact O-N 3.46Å; I154-L158 HydrophobicContact CG2-CD1 3.74Å; I154-L158 HydrophobicContact CG2-CG 4.19Å; I154-L158 WeakPolarHBondContact O-CB 3.37Å; I154-L158 VanDerWaalsContact O-CG 3.25Å; I154-L158 WeakPolarHBondContact O-CG 3.49Å; I154-L158 PolarHBondContact O-N 3.09Å |
| 155 | V | 95.1 | Very high | 92 | Very high | 7 Ų | 7 | 59.1 Ų | 59.1 | 4% | 0.042 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59 | -48 | 176.3 | 163.5 | 0 | 0 | 0 | 0 | 111.6 | A117 W120 L121 V124 Y151 S152 V153 L158 A159 | A117-V155 HydrophobicContact CB-CG1 4.4Å; W120-V155 HydrophobicContact CB-CB 4.47Å; W120-V155 HydrophobicContact CB-CG1 3.79Å; W120-V155 HydrophobicContact CB-CG2 3.97Å; W120-V155 HydrophobicContact CE3-CG1 4.17Å; W120-V155 WeakPolarHBondContact CZ3-O 3.46Å; L121-V155 HydrophobicContact CD2-CG1 4.33Å; L121-V155 HydrophobicContact CG-CG1 3.98Å; V124-V155 HydrophobicContact CG2-CG2 3.96Å; Y151-V155 WeakPolarHBondContact O-CG2 3.46Å; Y151-V155 PolarHBondContact O-N 3.24Å; S152-V155 WeakPolarHBondContact O-CB 3.39Å; S152-V155 PolarHBondContact O-N 3.46Å; V153-V155 VanDerWaalsContact C-N 3.29Å; V153-V155 PolarHBondContact O-N 3.15Å; V155-L158 PolarHBondContact O-N 3.14Å; V155-A159 VanDerWaalsContact O-CB 3.31Å; V155-A159 WeakPolarHBondContact O-CB 3.38Å; V155-A159 PolarHBondContact O-N 3.25Å |
| 156 | W | 97.2 | Very high | 90.8 | Very high | 53 Ų | 53 | 59 Ų | 59 | 20% | 0.201 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.7 | -44.7 | 177.7 | -75.3 | 109.3 | 0 | 0 | 0 | 112.6 | N72 C75 A76 L79 V113 A117 S152 V153 A159 C160 | N72-W156 PolarHBondContact OD1-NE1 3.32Å; C75-W156 HydrophobicContact CB-CZ2 4.37Å; A76-W156 HydrophobicContact CB-CH2 3.83Å; A76-W156 HydrophobicContact CB-CZ2 4.14Å; L79-W156 HydrophobicContact CD1-CH2 3.85Å; L79-W156 HydrophobicContact CD1-CZ3 4.14Å; V113-W156 HydrophobicContact CG1-CE3 4.16Å; V113-W156 HydrophobicContact CG1-CZ3 4.05Å; A117-W156 HydrophobicContact CB-CD2 4.37Å; A117-W156 HydrophobicContact CB-CE3 4.08Å; A117-W156 HydrophobicContact CB-CH2 4.13Å; A117-W156 HydrophobicContact CB-CZ2 4.41Å; A117-W156 HydrophobicContact CB-CZ3 3.97Å; S152-W156 PolarHBondContact O-N 3.43Å; V153-W156 PolarHBondContact O-N 3.2Å; W156-A159 PolarHBondContact O-N 3.37Å; W156-A159 VanDerWaalsContact O-N 3.09Å; W156-C160 PolarHBondContact O-N 3.19Å; W156-C160 PolarHBondContact O-SG 3.03Å; W156-C160 VanDerWaalsContact O-SG 3.4Å |
| 157 | L | 96.2 | Very high | 89.6 | Confident | 115 Ų | 115 | 54.1 Ų | 54.1 | 60% | 0.602 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -62.1 | -46.1 | 178.9 | -71.8 | 175.1 | 0 | 0 | 0 | 111.8 | V153 I154 A159 L161 | V153-L157 HydrophobicContact CG1-CD1 3.91Å; V153-L157 HydrophobicContact CG1-CG 4.26Å; V153-L157 WeakPolarHBondContact O-CG 3.41Å; V153-L157 PolarHBondContact O-N 3.03Å; I154-L157 PolarHBondContact O-N 3.46Å; L157-A159 PolarHBondContact O-N 3.42Å; L157-L161 VanDerWaalsContact O-CB 3.27Å; L157-L161 WeakPolarHBondContact O-CB 3.26Å; L157-L161 PolarHBondContact O-N 3.4Å |
| 158 | L | 92.5 | Very high | 88.4 | Confident | 80 Ų | 80 | 57.3 Ų | 57.3 | 42% | 0.419 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.7 | -32.5 | 175.9 | -71.2 | 173.9 | 0 | 0 | 0 | 110.6 | W120 I154 V155 L161 V162 | W120-L158 HydrophobicContact CE3-CB 3.93Å; W120-L158 VanDerWaalsContact CH2-C 3.44Å; W120-L158 HydrophobicContact CH2-CB 3.57Å; W120-L158 WeakPolarHBondContact CH2-O 3.48Å; W120-L158 HydrophobicContact CZ3-CB 3.09Å; W120-L158 HydrophobicContact CZ3-CD1 4.46Å; W120-L158 HydrophobicContact CZ3-CG 4.39Å; I154-L158 HydrophobicContact CG2-CD1 3.74Å; I154-L158 HydrophobicContact CG2-CG 4.19Å; I154-L158 WeakPolarHBondContact O-CB 3.37Å; I154-L158 VanDerWaalsContact O-CG 3.25Å; I154-L158 WeakPolarHBondContact O-CG 3.49Å; I154-L158 PolarHBondContact O-N 3.09Å; V155-L158 PolarHBondContact O-N 3.14Å; L158-L161 WeakPolarHBondContact O-CB 3.48Å; L158-L161 PolarHBondContact O-N 2.82Å; L158-V162 WeakPolarHBondContact O-CG2 3.27Å; L158-V162 PolarHBondContact O-N 3.45Å |
| 159 | A | 90.8 | Very high | 86.6 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -78.8 | -43.1 | -170.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | V113 F116 A117 W120 V155 W156 L157 L161 V162 Q163 | V113-A159 HydrophobicContact CG1-CB 4.31Å; F116-A159 HydrophobicContact CB-CB 3.89Å; A117-A159 HydrophobicContact CB-CB 4.43Å; W120-A159 HydrophobicContact CE3-CB 4.25Å; W120-A159 VanDerWaalsContact CZ3-CA 3.46Å; W120-A159 HydrophobicContact CZ3-CB 3.79Å; V155-A159 VanDerWaalsContact O-CB 3.31Å; V155-A159 WeakPolarHBondContact O-CB 3.38Å; V155-A159 PolarHBondContact O-N 3.25Å; W156-A159 PolarHBondContact O-N 3.37Å; W156-A159 VanDerWaalsContact O-N 3.09Å; L157-A159 PolarHBondContact O-N 3.42Å; A159-L161 VanDerWaalsContact C-N 3.33Å; A159-V162 PolarHBondContact O-N 3.26Å; A159-Q163 PolarHBondContact O-N 2.95Å |
| 160 | C | 91.7 | Very high | 84.5 | Confident | 44 Ų | 44 | 66.8 Ų | 66.8 | 30% | 0.297 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -58.1 | -44.7 | 166.2 | -67.3 | 0 | 0 | 0 | 0 | 111.2 | W156 V162 Q163 V164 | W156-C160 PolarHBondContact O-N 3.19Å; W156-C160 PolarHBondContact O-SG 3.03Å; W156-C160 VanDerWaalsContact O-SG 3.4Å; C160-V162 PolarHBondContact O-N 3.39Å; C160-Q163 PolarHBondContact O-N 3Å; C160-V164 WeakPolarHBondContact O-CB 3.34Å; C160-V164 VanDerWaalsContact O-CG2 3.22Å; C160-V164 WeakPolarHBondContact O-CG2 3.3Å; C160-V164 PolarHBondContact O-N 3.5Å |
| 161 | L | 89.3 | Confident | 82.1 | Confident | 101 Ų | 101 | 64.3 Ų | 64.3 | 53% | 0.529 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.8 | -49.2 | 179.3 | 178.7 | 64 | 0 | 0 | 0 | 111.8 | L157 L158 A159 Q163 V164 T165 | L157-L161 VanDerWaalsContact O-CB 3.27Å; L157-L161 WeakPolarHBondContact O-CB 3.26Å; L157-L161 PolarHBondContact O-N 3.4Å; L158-L161 WeakPolarHBondContact O-CB 3.48Å; L158-L161 PolarHBondContact O-N 2.82Å; A159-L161 VanDerWaalsContact C-N 3.33Å; L161-Q163 VanDerWaalsContact C-N 3.26Å; L161-Q163 PolarHBondContact O-N 3.32Å; L161-V164 PolarHBondContact O-N 3.28Å; L161-T165 HydrophobicContact CD1-CG2 4.32Å; L161-T165 WeakPolarHBondContact O-CG2 3.34Å; L161-T165 PolarHBondContact O-N 2.88Å; L161-T165 PolarHBondContact O-OG1 3.26Å |
| 162 | V | 82.6 | Confident | 79.5 | Confident | 16 Ų | 16 | 64.8 Ų | 64.8 | 10% | 0.097 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -59.8 | -37.9 | 177.3 | 169.3 | 0 | 0 | 0 | 0 | 111.4 | F116 W120 L158 A159 C160 T165 A166 W171 | F116-V162 HydrophobicContact CD2-CB 4.5Å; F116-V162 HydrophobicContact CD2-CG1 3.98Å; F116-V162 HydrophobicContact CE1-CG1 4.2Å; F116-V162 HydrophobicContact CE2-CB 4.49Å; F116-V162 HydrophobicContact CE2-CG1 3.55Å; F116-V162 HydrophobicContact CG-CG1 4.5Å; F116-V162 HydrophobicContact CZ-CG1 3.68Å; W120-V162 HydrophobicContact CH2-CB 4.4Å; W120-V162 HydrophobicContact CH2-CG2 3.7Å; W120-V162 HydrophobicContact CZ2-CG2 4.08Å; L158-V162 WeakPolarHBondContact O-CG2 3.27Å; L158-V162 PolarHBondContact O-N 3.45Å; A159-V162 PolarHBondContact O-N 3.26Å; C160-V162 PolarHBondContact O-N 3.39Å; V162-T165 PolarHBondContact O-OG1 2.78Å; V162-A166 PolarHBondContact O-N 2.96Å; V162-W171 HydrophobicContact CG1-CZ2 4.3Å |
| 163 | Q | 83.5 | Confident | 77.1 | Confident | 13 Ų | 13 | 69.8 Ų | 69.8 | 6% | 0.061 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -77.7 | -37 | 179.1 | -173.2 | 54.3 | 31.8 | 0 | 0 | 113.3 | F109 V113 A159 C160 L161 A166 C167 | F109-Q163 HydrophobicContact CD2-CB 4.26Å; F109-Q163 HydrophobicContact CD2-CG 3.53Å; F109-Q163 HydrophobicContact CE2-CB 4.22Å; F109-Q163 HydrophobicContact CE2-CG 3.99Å; F109-Q163 HydrophobicContact CG-CG 4.24Å; V113-Q163 HydrophobicContact CG2-CB 3.62Å; V113-Q163 HydrophobicContact CG2-CG 3.97Å; A159-Q163 PolarHBondContact O-N 2.95Å; C160-Q163 PolarHBondContact O-N 3Å; L161-Q163 VanDerWaalsContact C-N 3.26Å; L161-Q163 PolarHBondContact O-N 3.32Å; Q163-A166 WeakPolarHBondContact O-CB 3.22Å; Q163-A166 PolarHBondContact O-N 3.47Å; Q163-C167 PolarHBondContact NE2-SG 2.89Å; Q163-C167 VanDerWaalsContact NE2-SG 3.36Å; Q163-C167 PolarHBondContact O-N 3.46Å; Q163-C167 PolarHBondContact O-SG 3.34Å; Q163-C167 VanDerWaalsContact O-SG 3.39Å |
| 164 | V | 81.7 | Confident | 74.7 | Confident | 64 Ų | 64 | 68.2 Ų | 68.2 | 39% | 0.388 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -64.3 | -42.3 | 176.1 | 168.8 | 0 | 0 | 0 | 0 | 110.2 | F109 C160 L161 A166 C167 L168 | F109-V164 HydrophobicContact CE2-CG2 4.07Å; C160-V164 WeakPolarHBondContact O-CB 3.34Å; C160-V164 VanDerWaalsContact O-CG2 3.22Å; C160-V164 WeakPolarHBondContact O-CG2 3.3Å; C160-V164 PolarHBondContact O-N 3.5Å; L161-V164 PolarHBondContact O-N 3.28Å; V164-A166 VanDerWaalsContact C-N 3.27Å; V164-A166 PolarHBondContact O-N 2.78Å; V164-C167 PolarHBondContact O-N 3.46Å; V164-L168 HydrophobicContact CG1-CD1 3.86Å; V164-L168 HydrophobicContact CG1-CG 4.38Å; V164-L168 WeakPolarHBondContact O-CG 3.48Å; V164-L168 PolarHBondContact O-N 3.35Å |
| 165 | T | 76.2 | Confident | 72.4 | Confident | 38 Ų | 38 | 66 Ų | 66 | 23% | 0.233 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.6 | -39.1 | 175.3 | 56.7 | 0 | 0 | 0 | 0 | 111.3 | L161 V162 L168 I170 W171 | L161-T165 HydrophobicContact CD1-CG2 4.32Å; L161-T165 WeakPolarHBondContact O-CG2 3.34Å; L161-T165 PolarHBondContact O-N 2.88Å; L161-T165 PolarHBondContact O-OG1 3.26Å; V162-T165 PolarHBondContact O-OG1 2.78Å; T165-L168 PolarHBondContact O-N 3.05Å; T165-I170 CarbonylContact O-C 3.55Å; T165-I170 PolarHBondContact O-N 3.28Å; T165-W171 VanDerWaalsContact C-CD1 3.41Å; T165-W171 VanDerWaalsContact O-CD1 3.29Å; T165-W171 PolarHBondContact OG1-NE1 3.19Å |
| 166 | A | 68.6 | Low | 70.1 | Confident | 39 Ų | 39 | 69.8 Ų | 69.8 | 32% | 0.322 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.6 | -39.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V162 Q163 V164 L168 D169 W171 | V162-A166 PolarHBondContact O-N 2.96Å; Q163-A166 WeakPolarHBondContact O-CB 3.22Å; Q163-A166 PolarHBondContact O-N 3.47Å; V164-A166 VanDerWaalsContact C-N 3.27Å; V164-A166 PolarHBondContact O-N 2.78Å; A166-L168 PolarHBondContact O-N 2.99Å; A166-D169 PolarHBondContact O-N 3.3Å; A166-W171 VanDerWaalsContact N-NE1 3.14Å |
| 167 | C | 69 | Low | 67.7 | Low | 67 Ų | 67 | 75.2 Ų | 75.2 | 45% | 0.453 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -71.4 | -25 | 178.8 | -75.1 | 0 | 0 | 0 | 0 | 114.4 | Q163 V164 D169 | Q163-C167 PolarHBondContact NE2-SG 2.89Å; Q163-C167 VanDerWaalsContact NE2-SG 3.36Å; Q163-C167 PolarHBondContact O-N 3.46Å; Q163-C167 PolarHBondContact O-SG 3.34Å; Q163-C167 VanDerWaalsContact O-SG 3.39Å; V164-C167 PolarHBondContact O-N 3.46Å; C167-D169 VanDerWaalsContact C-N 3.26Å |
| 168 | L | 68 | Low | 65.6 | Low | 107 Ų | 107 | 74.5 Ų | 74.5 | 56% | 0.56 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.6 | 4.1 | 179.3 | -67.6 | 173.2 | 0 | 0 | 0 | 112.8 | V164 T165 A166 I170 | V164-L168 HydrophobicContact CG1-CD1 3.86Å; V164-L168 HydrophobicContact CG1-CG 4.38Å; V164-L168 WeakPolarHBondContact O-CG 3.48Å; V164-L168 PolarHBondContact O-N 3.35Å; T165-L168 PolarHBondContact O-N 3.05Å; A166-L168 PolarHBondContact O-N 2.99Å; L168-I170 HydrophobicContact CB-CB 4.25Å; L168-I170 HydrophobicContact CB-CD1 3.57Å; L168-I170 HydrophobicContact CB-CG1 3.63Å; L168-I170 HydrophobicContact CD1-CD1 3.75Å; L168-I170 HydrophobicContact CG-CD1 4.28Å; L168-I170 WeakPolarHBondContact O-CG1 3.38Å; L168-I170 PolarHBondContact O-N 2.99Å |
| 169 | D | 57.9 | Low | 63.6 | Low | 141 Ų | 141 | 78.9 Ų | 78.9 | 75% | 0.754 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.6 | 17.7 | -166.6 | -67.2 | -41.8 | 0 | 0 | 0 | 113 | A166 C167 W171 | A166-D169 PolarHBondContact O-N 3.3Å; C167-D169 VanDerWaalsContact C-N 3.26Å; D169-W171 PolarHBondContact O-N 3.18Å |
| 170 | I | 52.8 | Low | 61.4 | Low | 102 Ų | 102 | 84.1 Ų | 84.1 | 52% | 0.523 | 44% | 0.441 | S | S | . | . | trans | -84.5 | 61.7 | 173.2 | -53.6 | 169.9 | 0 | 0 | 0 | 106.9 | T165 L168 | T165-I170 CarbonylContact O-C 3.55Å; T165-I170 PolarHBondContact O-N 3.28Å; L168-I170 HydrophobicContact CB-CB 4.25Å; L168-I170 HydrophobicContact CB-CD1 3.57Å; L168-I170 HydrophobicContact CB-CG1 3.63Å; L168-I170 HydrophobicContact CD1-CD1 3.75Å; L168-I170 HydrophobicContact CG-CD1 4.28Å; L168-I170 WeakPolarHBondContact O-CG1 3.38Å; L168-I170 PolarHBondContact O-N 2.99Å | ||
| 171 | W | 46.1 | Very low | 59.5 | Low | 112 Ų | 112 | 89.5 Ų | 89.5 | 42% | 0.424 | 46% | 0.455 | S | S | . | . | trans | -115.5 | 88 | 159.3 | -83.4 | 57.4 | 0 | 0 | 0 | 106.3 | V162 T165 A166 D169 E173 T175 | V162-W171 HydrophobicContact CG1-CZ2 4.3Å; T165-W171 VanDerWaalsContact C-CD1 3.41Å; T165-W171 VanDerWaalsContact O-CD1 3.29Å; T165-W171 PolarHBondContact OG1-NE1 3.19Å; A166-W171 VanDerWaalsContact N-NE1 3.14Å; D169-W171 PolarHBondContact O-N 3.18Å; W171-E173 PolarHBondContact O-N 2.97Å; W171-T175 HydrophobicContact CD2-CG2 4.29Å; W171-T175 HydrophobicContact CE3-CG2 4.36Å; W171-T175 HydrophobicContact CH2-CG2 4.38Å; W171-T175 HydrophobicContact CZ2-CG2 4.41Å; W171-T175 HydrophobicContact CZ3-CG2 4.38Å; W171-T175 WeakPolarHBondContact CZ3-OG1 3.3Å | ||
| 172 | P | 40.3 | Very low | 57.8 | Low | 90 Ų | 90 | 86.5 Ų | 86.5 | 58% | 0.584 | 44% | 0.439 | S | S | * | . | trans | -56.7 | 141.6 | 153.6 | 27.5 | -31 | 0 | 0 | 0 | 106 | G174 | P172-G174 PolarHBondContact O-N 3.4Š| ||
| 173 | E | 46.5 | Very low | 56.4 | Low | 105 Ų | 105 | 90 Ų | 90 | 49% | 0.491 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.1 | -1.9 | -173.2 | -69.6 | -156.7 | -132.1 | 0 | 0 | 117.7 | W171 P323 Y324 | W171-E173 PolarHBondContact O-N 2.97Å; E173-P323 WeakPolarHBondContact OE2-CG 2.97Å; E173-Y324 HydrophobicContact CG-CE1 4.31Å; E173-Y324 HydrophobicContact CG-CE2 3.91Å; E173-Y324 WeakPolarHBondContact CG-OH 3.47Å; E173-Y324 WeakPolarHBondContact OE1-CE2 3.39Å; E173-Y324 PolarHBondContact OE1-OH 3.5Å; E173-Y324 WeakPolarHBondContact OE2-CE2 3.06Å |
| 174 | G | 45.9 | Very low | 54.6 | Low | 51 Ų | 51 | 96.2 Ų | 96.2 | 53% | 0.526 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.1 | -0.8 | -171.9 | 0 | 0 | 0 | 0 | 0 | 117.8 | P172 F176 | P172-G174 PolarHBondContact O-N 3.4Å; G174-F176 PolarHBondContact O-N 3.29Å |
| 175 | T | 49.5 | Very low | 53.1 | Low | 42 Ų | 42 | 95.7 Ų | 95.7 | 26% | 0.258 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.9 | 6.6 | 179.9 | 36.6 | 0 | 0 | 0 | 0 | 114.5 | W171 F177 | W171-T175 HydrophobicContact CD2-CG2 4.29Å; W171-T175 HydrophobicContact CE3-CG2 4.36Å; W171-T175 HydrophobicContact CH2-CG2 4.38Å; W171-T175 HydrophobicContact CZ2-CG2 4.41Å; W171-T175 HydrophobicContact CZ3-CG2 4.38Å; W171-T175 WeakPolarHBondContact CZ3-OG1 3.3Å; T175-F177 PolarHBondContact O-N 2.93Å |
| 176 | F | 44.9 | Very low | 52 | Low | 85 Ų | 85 | 97.2 Ų | 97.2 | 37% | 0.373 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -52.3 | -19.8 | 169.3 | -124 | -94.7 | 0 | 0 | 0 | 114.3 | G174 P323 | G174-F176 PolarHBondContact O-N 3.29Å; F176-P323 HydrophobicContact CE2-CB 4.13Å |
| 177 | F | 47.8 | Very low | 51 | Low | 168 Ų | 168 | 100.7 Ų | 100.7 | 74% | 0.737 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.1 | -40.8 | -176.8 | -99.8 | -88.9 | 0 | 0 | 0 | 114.4 | T175 R179 W181 | T175-F177 PolarHBondContact O-N 2.93Å; F177-R179 PolarHBondContact O-N 3.47Å; F177-W181 WeakPolarHBondContact O-CB 3.32Å; F177-W181 PolarHBondContact O-N 2.99Å; F177-W181 VanDerWaalsContact O-N 3.15Å |
| 178 | L | 52.9 | Low | 49.9 | Very low | 99 Ų | 99 | 105.2 Ų | 105.2 | 52% | 0.518 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -70.3 | -35.3 | -174.4 | -81.4 | 162.4 | 0 | 0 | 0 | 112.7 | W181 L182 | L178-W181 PolarHBondContact O-N 3.3Å; L178-L182 WeakPolarHBondContact O-CD1 3.43Å; L178-L182 WeakPolarHBondContact O-CG 3.48Å; L178-L182 PolarHBondContact O-N 3.42Å; L178-L182 VanDerWaalsContact O-N 3.08Å |
| 179 | R | 48.8 | Very low | 48.8 | Very low | 172 Ų | 172 | 103.6 Ų | 103.6 | 65% | 0.649 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -70.8 | -40.9 | -178.4 | -161.1 | 177.5 | 175.8 | -160.4 | 0.2 | 111.9 | F177 W181 I183 | F177-R179 PolarHBondContact O-N 3.47Å; R179-W181 VanDerWaalsContact C-N 3.34Å; R179-I183 HydrophobicContact CG-CD1 4.37Å; R179-I183 WeakPolarHBondContact O-CG1 3.27Å; R179-I183 PolarHBondContact O-N 2.91Å |
| 180 | K | 45 | Very low | 48.3 | Very low | 111 Ų | 111 | 107.4 Ų | 107.4 | 48% | 0.483 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64 | -38.9 | 172.3 | -79.4 | -173.5 | 174.4 | 180 | 0 | 111.4 | W184 F320 | K180-W184 VanDerWaalsContact O-CB 3.27Å; K180-W184 WeakPolarHBondContact O-CB 3.46Å; K180-W184 PolarHBondContact O-N 3.42Å; K180-F320 PolarHBondContact NZ-O 3.23Å |
| 181 | W | 51.7 | Low | 47.8 | Very low | 157 Ų | 157 | 111.1 Ų | 111.1 | 60% | 0.595 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.1 | -40.6 | 179.6 | -141 | 82.6 | 0 | 0 | 0 | 113.1 | F177 L178 R179 W184 L185 | F177-W181 WeakPolarHBondContact O-CB 3.32Å; F177-W181 PolarHBondContact O-N 2.99Å; F177-W181 VanDerWaalsContact O-N 3.15Å; L178-W181 PolarHBondContact O-N 3.3Å; R179-W181 VanDerWaalsContact C-N 3.34Å; W181-W184 PolarHBondContact O-N 2.95Å; W181-L185 HydrophobicContact CE3-CD1 3.53Å; W181-L185 HydrophobicContact CE3-CG 4.08Å; W181-L185 HydrophobicContact CH2-CD1 4.41Å; W181-L185 HydrophobicContact CZ3-CD1 3.43Å; W181-L185 VanDerWaalsContact CZ3-CD1 3.43Å; W181-L185 HydrophobicContact CZ3-CD2 4.43Å; W181-L185 HydrophobicContact CZ3-CG 4.11Å; W181-L185 WeakPolarHBondContact O-CG 3.11Å; W181-L185 PolarHBondContact O-N 2.89Å |
| 182 | L | 54.6 | Low | 47.6 | Very low | 37 Ų | 37 | 111.5 Ų | 111.5 | 19% | 0.194 | 53% | 0.532 | C | S | . | . | H | α-helix | trans | -70.7 | -42.2 | 179.3 | -72.8 | 158.8 | 0 | 0 | 0 | 112.8 | W120 L178 W184 L185 V186 | W120-L182 VanDerWaalsContact CD1-CD2 3.47Å; W120-L182 HydrophobicContact CG-CD2 4.43Å; W120-L182 HydrophobicContact CZ2-CD1 4.31Å; L178-L182 WeakPolarHBondContact O-CD1 3.43Å; L178-L182 WeakPolarHBondContact O-CG 3.48Å; L178-L182 PolarHBondContact O-N 3.42Å; L178-L182 VanDerWaalsContact O-N 3.08Å; L182-W184 VanDerWaalsContact C-N 3.31Å; L182-W184 PolarHBondContact O-N 3.38Å; L182-L185 PolarHBondContact O-N 2.91Å; L182-V186 WeakPolarHBondContact O-CG2 3.36Å; L182-V186 PolarHBondContact O-N 3.41Å; L182-V186 VanDerWaalsContact O-N 3.09Å |
| 183 | I | 52.9 | Low | 47.6 | Very low | 90 Ų | 90 | 112.4 Ų | 112.4 | 46% | 0.462 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65 | -39.6 | 175.5 | -67.1 | 169.4 | 0 | 0 | 0 | 110 | R179 L185 V186 I187 | R179-I183 HydrophobicContact CG-CD1 4.37Å; R179-I183 WeakPolarHBondContact O-CG1 3.27Å; R179-I183 PolarHBondContact O-N 2.91Å; I183-L185 PolarHBondContact O-N 3.41Å; I183-V186 PolarHBondContact O-N 2.97Å; I183-I187 HydrophobicContact CG2-CD1 3.5Å; I183-I187 VanDerWaalsContact CG2-CD1 3.5Å; I183-I187 HydrophobicContact CG2-CG1 4.25Å; I183-I187 WeakPolarHBondContact O-CB 3.44Å; I183-I187 VanDerWaalsContact O-CG1 3.26Å; I183-I187 WeakPolarHBondContact O-CG1 3.33Å; I183-I187 PolarHBondContact O-N 3.49Å |
| 184 | W | 44.9 | Very low | 47.4 | Very low | 143 Ų | 143 | 116.7 Ų | 116.7 | 54% | 0.542 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.3 | -40.1 | 174.6 | -171.8 | 82.9 | 0 | 0 | 0 | 112.6 | K180 W181 L182 R188 | K180-W184 VanDerWaalsContact O-CB 3.27Å; K180-W184 WeakPolarHBondContact O-CB 3.46Å; K180-W184 PolarHBondContact O-N 3.42Å; W181-W184 PolarHBondContact O-N 2.95Å; L182-W184 VanDerWaalsContact C-N 3.31Å; L182-W184 PolarHBondContact O-N 3.38Å; W184-R188 WeakPolarHBondContact O-CB 3.5Å; W184-R188 PolarHBondContact O-N 3.4Å |
| 185 | L | 50.9 | Low | 47.7 | Very low | 54 Ų | 54 | 120.1 Ų | 120.1 | 28% | 0.283 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.4 | -39.5 | 175 | -79.4 | 176.4 | 0 | 0 | 0 | 113.2 | W181 L182 I183 | W181-L185 HydrophobicContact CE3-CD1 3.53Å; W181-L185 HydrophobicContact CE3-CG 4.08Å; W181-L185 HydrophobicContact CH2-CD1 4.41Å; W181-L185 HydrophobicContact CZ3-CD1 3.43Å; W181-L185 VanDerWaalsContact CZ3-CD1 3.43Å; W181-L185 HydrophobicContact CZ3-CD2 4.43Å; W181-L185 HydrophobicContact CZ3-CG 4.11Å; W181-L185 WeakPolarHBondContact O-CG 3.11Å; W181-L185 PolarHBondContact O-N 2.89Å; L182-L185 PolarHBondContact O-N 2.91Å; I183-L185 PolarHBondContact O-N 3.41Å |
| 186 | V | 52.6 | Low | 47.6 | Very low | 69 Ų | 69 | 122.6 Ų | 122.6 | 42% | 0.418 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -70.9 | -41.7 | 179.1 | 173.4 | 0 | 0 | 0 | 0 | 111 | T123 L182 I183 S189 | T123-V186 HydrophobicContact CG2-CG2 4.38Å; L182-V186 WeakPolarHBondContact O-CG2 3.36Å; L182-V186 PolarHBondContact O-N 3.41Å; L182-V186 VanDerWaalsContact O-N 3.09Å; I183-V186 PolarHBondContact O-N 2.97Å; V186-S189 WeakPolarHBondContact O-CB 3.34Å; V186-S189 PolarHBondContact O-N 3.31Å; V186-S189 PolarHBondContact O-OG 2.95Å |
| 187 | I | 48.1 | Very low | 48 | Very low | 113 Ų | 113 | 129.1 Ų | 129.1 | 58% | 0.579 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -72.9 | -31.2 | 179.8 | -66 | 174.8 | 0 | 0 | 0 | 112 | I183 S189 | I183-I187 HydrophobicContact CG2-CD1 3.5Å; I183-I187 VanDerWaalsContact CG2-CD1 3.5Å; I183-I187 HydrophobicContact CG2-CG1 4.25Å; I183-I187 WeakPolarHBondContact O-CB 3.44Å; I183-I187 VanDerWaalsContact O-CG1 3.26Å; I183-I187 WeakPolarHBondContact O-CG1 3.33Å; I183-I187 PolarHBondContact O-N 3.49Å; I187-S189 PolarHBondContact O-N 2.99Å |
| 188 | R | 45.5 | Very low | 48 | Very low | 162 Ų | 162 | 129.7 Ų | 129.7 | 61% | 0.611 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | -4.9 | 175.9 | -177 | 171.5 | 158.2 | 91.1 | -1.4 | 113.9 | W184 R190 | W184-R188 WeakPolarHBondContact O-CB 3.5Å; W184-R188 PolarHBondContact O-N 3.4Å; R188-R190 PolarHBondContact O-N 2.94Å; R188-R190 VanDerWaalsContact O-N 3.15Å |
| 189 | S | 44.7 | Very low | 48.3 | Very low | 72 Ų | 72 | 131.6 Ų | 131.6 | 50% | 0.503 | 59% | 0.592 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.2 | 8.7 | 179.5 | 71.2 | 0 | 0 | 0 | 0 | 115.6 | V186 I187 | V186-S189 WeakPolarHBondContact O-CB 3.34Å; V186-S189 PolarHBondContact O-N 3.31Å; V186-S189 PolarHBondContact O-OG 2.95Å; I187-S189 PolarHBondContact O-N 2.99Å |
| 190 | R | 48.5 | Very low | 48.8 | Very low | 221 Ų | 221 | 130.3 Ų | 130.3 | 83% | 0.834 | 59% | 0.587 | S | S | * | * | trans | -80.5 | 124.9 | -175.9 | -71.4 | -139.9 | -174.2 | -169.5 | 5.1 | 115.5 | R188 | R188-R190 PolarHBondContact O-N 2.94Å; R188-R190 VanDerWaalsContact O-N 3.15Å | ||
| 191 | Y | 41.5 | Very low | 49.6 | Very low | 181 Ų | 181 | 131 Ų | 131 | 71% | 0.71 | 59% | 0.586 | S | S | * | * | trans | 65.5 | 103.8 | 146.6 | -118.2 | -101 | 0 | 0 | 0 | 120.4 | Q193 | Y191-Q193 HydrophobicContact CD1-CB 4.16Å; Y191-Q193 HydrophobicContact CD1-CG 4.32Å; Y191-Q193 HydrophobicContact CE1-CB 3.78Å; Y191-Q193 HydrophobicContact CE1-CG 3.57Å; Y191-Q193 PolarHBondContact OH-NE2 2.87Å | ||
| 192 | S | 41.7 | Very low | 50 | Low | 119 Ų | 119 | 125.8 Ų | 125.8 | 83% | 0.832 | 57% | 0.572 | S | S | * | * | trans | -141.5 | 118.7 | 145.1 | -177.3 | 0 | 0 | 0 | 0 | 108.6 | K194 | S192-K194 PolarHBondContact O-N 3.44Š| ||
| 193 | Q | 41.8 | Very low | 50.6 | Low | 110 Ų | 110 | 125.7 Ų | 125.7 | 51% | 0.514 | 58% | 0.576 | S | S | . | * | trans | -101.2 | 47.3 | -160.1 | -132.7 | -138.8 | 58.5 | 0 | 0 | 113.8 | Y191 | Y191-Q193 HydrophobicContact CD1-CB 4.16Å; Y191-Q193 HydrophobicContact CD1-CG 4.32Å; Y191-Q193 HydrophobicContact CE1-CB 3.78Å; Y191-Q193 HydrophobicContact CE1-CG 3.57Å; Y191-Q193 PolarHBondContact OH-NE2 2.87Å | ||
| 194 | K | 41.5 | Very low | 51.5 | Low | 194 Ų | 194 | 126.7 Ų | 126.7 | 84% | 0.843 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -139.1 | 69.5 | 177.9 | -77 | -173.2 | 175.8 | 177.4 | 0 | 114 | S192 | S192-K194 PolarHBondContact O-N 3.44Š|
| 195 | T | 51.2 | Low | 52.9 | Low | 124 Ų | 124 | 120.4 Ų | 120.4 | 76% | 0.761 | 55% | 0.554 | S | S | * | * | S | Bend | trans | 174.4 | 88 | 146 | 17.1 | 0 | 0 | 0 | 0 | 110.5 | ||
| 196 | F | 47.7 | Very low | 54.1 | Low | 93 Ų | 93 | 118.1 Ų | 118.1 | 41% | 0.408 | 54% | 0.543 | S | S | . | . | trans | -105.4 | -9.6 | -141.6 | -172.1 | -110.9 | 0 | 0 | 0 | 120.4 | R200 | F196-R200 WeakPolarHBondContact O-CD 3.37Š| ||
| 197 | R | 53.9 | Low | 55.3 | Low | 222 Ų | 222 | 120.7 Ų | 120.7 | 84% | 0.838 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -119 | -13.8 | -166.4 | -81.6 | -179.4 | -171.4 | 170.4 | 3.3 | 120.6 | ||
| 198 | Q | 48.9 | Very low | 56.8 | Low | 180 Ų | 180 | 116.2 Ų | 116.2 | 84% | 0.841 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -118.3 | -19.1 | -177.6 | -88 | 175 | -13 | 0 | 0 | 116.4 | ||
| 199 | R | 58.4 | Low | 58.5 | Low | 140 Ų | 140 | 108.6 Ų | 108.6 | 53% | 0.528 | 50% | 0.498 | S | S | . | . | S | Bend | trans | -89.9 | -6.2 | 177 | -62.1 | -176.8 | -179.7 | -170.7 | 1.9 | 114.1 | A132 L133 R201 | A132-R199 PolarHBondContact O-NH1 3.43Å; L133-R199 HydrophobicContact CD2-CB 3.52Å; L133-R199 HydrophobicContact CD2-CG 4.19Å; R199-R201 VanDerWaalsContact C-N 3.35Å; R199-R201 PolarHBondContact O-N 3.47Å |
| 200 | R | 59.3 | Low | 60.2 | Low | 144 Ų | 144 | 107.1 Ų | 107.1 | 54% | 0.543 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.6 | -32.7 | -178.5 | -104.3 | 179.7 | 159.9 | -166.5 | -11.8 | 114.2 | F196 V202 A203 F204 | F196-R200 WeakPolarHBondContact O-CD 3.37Å; R200-V202 PolarHBondContact O-N 3.5Å; R200-A203 PolarHBondContact O-N 2.98Å; R200-F204 WeakPolarHBondContact O-CB 3.35Å; R200-F204 PolarHBondContact O-N 3.47Å |
| 201 | R | 61.3 | Low | 61.9 | Low | 126 Ų | 126 | 100.6 Ų | 100.6 | 48% | 0.475 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.4 | -41.6 | -173.3 | -66.1 | -174.2 | -175.6 | 136.7 | 6.3 | 113.2 | R199 L205 M264 K266 | R199-R201 VanDerWaalsContact C-N 3.35Å; R199-R201 PolarHBondContact O-N 3.47Å; R201-L205 PolarHBondContact O-N 3.21Å; R201-M264 VanDerWaalsContact O-CG 3.26Å; R201-M264 WeakPolarHBondContact O-CG 2.82Å; R201-K266 VanDerWaalsContact NH1-CD 3.3Å; R201-K266 VanDerWaalsContact NH1-CE 3.29Å |
| 202 | V | 61.2 | Low | 63.7 | Low | 48 Ų | 48 | 94.8 Ų | 94.8 | 29% | 0.291 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -80.5 | -32.7 | -179.6 | -166.1 | 0 | 0 | 0 | 0 | 111.9 | T66 R200 F204 L205 V206 | T66-V202 HydrophobicContact CG2-CG1 4.27Å; R200-V202 PolarHBondContact O-N 3.5Å; V202-F204 VanDerWaalsContact C-N 3.3Å; V202-L205 WeakPolarHBondContact O-CB 3.44Å; V202-L205 PolarHBondContact O-N 3.08Å; V202-V206 WeakPolarHBondContact O-CG2 3.48Å; V202-V206 PolarHBondContact O-N 3.35Å; V202-V206 VanDerWaalsContact O-N 3.11Å |
| 203 | A | 67.1 | Low | 65.5 | Low | 34 Ų | 34 | 90.3 Ų | 90.3 | 28% | 0.281 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -66.1 | -37.7 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | R200 V206 F207 | R200-A203 PolarHBondContact O-N 2.98Å; A203-V206 PolarHBondContact O-N 3.29Å; A203-F207 WeakPolarHBondContact O-CB 3.45Å; A203-F207 PolarHBondContact O-N 3.43Å |
| 204 | F | 72 | Confident | 67.5 | Low | 111 Ų | 111 | 91.1 Ų | 91.1 | 49% | 0.487 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.2 | -38.5 | 173.2 | -172.3 | -107.3 | 0 | 0 | 0 | 111.6 | R200 V202 V206 F207 C208 M264 | R200-F204 WeakPolarHBondContact O-CB 3.35Å; R200-F204 PolarHBondContact O-N 3.47Å; V202-F204 VanDerWaalsContact C-N 3.3Å; F204-V206 PolarHBondContact O-N 3.01Å; F204-F207 HydrophobicContact CD2-CD1 4.45Å; F204-F207 HydrophobicContact CE2-CD1 4.49Å; F204-F207 PolarHBondContact O-N 2.76Å; F204-C208 WeakPolarHBondContact CE1-SG 3.35Å; F204-C208 VanDerWaalsContact CZ-SG 3.56Å; F204-C208 WeakPolarHBondContact O-CB 3.34Å; F204-C208 PolarHBondContact O-N 3.49Å; F204-C208 PolarHBondContact O-SG 3.19Å; F204-M264 HydrophobicContact CD1-CE 3.33Å; F204-M264 HydrophobicContact CD1-SD 3.68Å; F204-M264 HydrophobicContact CE1-CE 3.57Å; F204-M264 HydrophobicContact CE1-SD 4.34Å |
| 205 | L | 73.9 | Confident | 69.7 | Low | 11 Ų | 11 | 85.4 Ų | 85.4 | 6% | 0.058 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -52.2 | -53.8 | 169.7 | -179.4 | 52 | 0 | 0 | 0 | 111.1 | R201 V202 F207 C208 L209 I260 M264 | R201-L205 PolarHBondContact O-N 3.21Å; V202-L205 WeakPolarHBondContact O-CB 3.44Å; V202-L205 PolarHBondContact O-N 3.08Å; L205-F207 VanDerWaalsContact C-N 3.31Å; L205-F207 PolarHBondContact O-N 2.91Å; L205-C208 PolarHBondContact O-N 3.1Å; L205-L209 HydrophobicContact CD1-CD1 3.88Å; L205-L209 HydrophobicContact CD1-CG 4.1Å; L205-L209 HydrophobicContact CG-CD1 3.87Å; L205-L209 WeakPolarHBondContact O-CB 3.28Å; L205-L209 VanDerWaalsContact O-CG 3.27Å; L205-L209 WeakPolarHBondContact O-CG 3.3Å; L205-L209 PolarHBondContact O-N 2.81Å; L205-I260 HydrophobicContact CD1-CB 4.18Å; L205-I260 HydrophobicContact CD1-CG2 3.33Å; L205-M264 HydrophobicContact CB-CB 4.22Å; L205-M264 HydrophobicContact CB-CG 3.6Å; L205-M264 HydrophobicContact CD1-CB 3.79Å; L205-M264 HydrophobicContact CD1-CG 4.08Å; L205-M264 HydrophobicContact CD2-CB 4.41Å; L205-M264 HydrophobicContact CG-CB 4.35Å; L205-M264 HydrophobicContact CG-CG 4.26Å |
| 206 | V | 74.6 | Confident | 71.4 | Confident | 6 Ų | 6 | 81.1 Ų | 81.1 | 4% | 0.036 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.7 | -40.6 | -178.8 | 176.3 | 0 | 0 | 0 | 0 | 111 | M125 S126 R129 V202 A203 F204 L209 A210 | M125-V206 HydrophobicContact CB-CG2 4Å; M125-V206 HydrophobicContact CE-CG2 4.06Å; S126-V206 WeakPolarHBondContact OG-CG1 3.29Å; R129-V206 HydrophobicContact CG-CG2 4.17Å; V202-V206 WeakPolarHBondContact O-CG2 3.48Å; V202-V206 PolarHBondContact O-N 3.35Å; V202-V206 VanDerWaalsContact O-N 3.11Å; A203-V206 PolarHBondContact O-N 3.29Å; F204-V206 PolarHBondContact O-N 3.01Å; V206-L209 PolarHBondContact O-N 2.83Å; V206-A210 WeakPolarHBondContact O-CB 3.34Å; V206-A210 PolarHBondContact O-N 2.88Å |
| 207 | F | 78.6 | Confident | 73.2 | Confident | 124 Ų | 124 | 77.7 Ų | 77.7 | 54% | 0.544 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62.7 | -46 | 175.1 | 177.4 | -98.3 | 0 | 0 | 0 | 112.4 | A203 F204 L205 A210 L211 | A203-F207 WeakPolarHBondContact O-CB 3.45Å; A203-F207 PolarHBondContact O-N 3.43Å; F204-F207 HydrophobicContact CD2-CD1 4.45Å; F204-F207 HydrophobicContact CE2-CD1 4.49Å; F204-F207 PolarHBondContact O-N 2.76Å; L205-F207 VanDerWaalsContact C-N 3.31Å; L205-F207 PolarHBondContact O-N 2.91Å; F207-A210 PolarHBondContact O-N 3.27Å; F207-L211 HydrophobicContact CE1-CD2 4.17Å; F207-L211 HydrophobicContact CZ-CD2 4.45Å; F207-L211 VanDerWaalsContact O-CB 3.3Å; F207-L211 WeakPolarHBondContact O-CB 3.25Å; F207-L211 PolarHBondContact O-N 3.11Å |
| 208 | C | 80.3 | Confident | 74.9 | Confident | 18 Ų | 18 | 70.4 Ų | 70.4 | 12% | 0.122 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.1 | -46.2 | 176.4 | -70.2 | 0 | 0 | 0 | 0 | 111.4 | F204 L205 A210 L211 M212 I260 | F204-C208 WeakPolarHBondContact CE1-SG 3.35Å; F204-C208 VanDerWaalsContact CZ-SG 3.56Å; F204-C208 WeakPolarHBondContact O-CB 3.34Å; F204-C208 PolarHBondContact O-N 3.49Å; F204-C208 PolarHBondContact O-SG 3.19Å; L205-C208 PolarHBondContact O-N 3.1Å; C208-A210 VanDerWaalsContact C-N 3.35Å; C208-A210 PolarHBondContact O-N 2.98Å; C208-L211 PolarHBondContact O-N 3.11Å; C208-M212 WeakPolarHBondContact O-CB 3.46Å; C208-M212 VanDerWaalsContact O-CG 3.3Å; C208-M212 WeakPolarHBondContact O-CG 3.37Å; C208-M212 PolarHBondContact O-N 3.04Å; C208-I260 HydrophobicContact CB-CG2 4.24Å |
| 209 | L | 80 | Confident | 76.8 | Confident | 2 Ų | 2 | 63.3 Ų | 63.3 | 1% | 0.01 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.1 | -44.2 | 176.7 | -69.8 | 167 | 0 | 0 | 0 | 111.5 | L73 L122 M125 L205 V206 L213 N257 I260 | L73-L209 HydrophobicContact CD2-CD1 4.32Å; L122-L209 HydrophobicContact CD1-CB 4.38Å; L122-L209 HydrophobicContact CD2-CB 3.56Å; L122-L209 HydrophobicContact CD2-CD1 3.88Å; L122-L209 HydrophobicContact CD2-CG 4.31Å; M125-L209 HydrophobicContact CE-CD1 4.49Å; L205-L209 HydrophobicContact CD1-CD1 3.88Å; L205-L209 HydrophobicContact CD1-CG 4.1Å; L205-L209 HydrophobicContact CG-CD1 3.87Å; L205-L209 WeakPolarHBondContact O-CB 3.28Å; L205-L209 VanDerWaalsContact O-CG 3.27Å; L205-L209 WeakPolarHBondContact O-CG 3.3Å; L205-L209 PolarHBondContact O-N 2.81Å; V206-L209 PolarHBondContact O-N 2.83Å; L209-L213 WeakPolarHBondContact O-CB 3.39Å; L209-L213 PolarHBondContact O-N 3.23Å; L209-N257 HydrophobicContact CD2-CB 4.46Å; L209-N257 WeakPolarHBondContact CD2-OD1 3.21Å; L209-I260 HydrophobicContact CD2-CB 4.37Å; L209-I260 HydrophobicContact CD2-CD1 3.56Å; L209-I260 HydrophobicContact CG-CD1 4.35Å |
| 210 | A | 80.6 | Confident | 78 | Confident | 41 Ų | 41 | 56.8 Ų | 56.8 | 34% | 0.339 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -68.1 | -40 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | V206 F207 C208 L213 F214 | V206-A210 WeakPolarHBondContact O-CB 3.34Å; V206-A210 PolarHBondContact O-N 2.88Å; F207-A210 PolarHBondContact O-N 3.27Å; C208-A210 VanDerWaalsContact C-N 3.35Å; C208-A210 PolarHBondContact O-N 2.98Å; A210-L213 PolarHBondContact O-N 3Å; A210-F214 PolarHBondContact O-N 3.09Å |
| 211 | L | 83.4 | Confident | 79.2 | Confident | 84 Ų | 84 | 52.7 Ų | 52.7 | 44% | 0.44 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 177.2 | 179 | 63.1 | 0 | 0 | 0 | 111.2 | F207 C208 F214 V215 | F207-L211 HydrophobicContact CE1-CD2 4.17Å; F207-L211 HydrophobicContact CZ-CD2 4.45Å; F207-L211 VanDerWaalsContact O-CB 3.3Å; F207-L211 WeakPolarHBondContact O-CB 3.25Å; F207-L211 PolarHBondContact O-N 3.11Å; C208-L211 PolarHBondContact O-N 3.11Å; L211-F214 WeakPolarHBondContact O-CB 3.49Å; L211-F214 PolarHBondContact O-N 3.33Å; L211-V215 HydrophobicContact CD1-CG2 4.16Å; L211-V215 HydrophobicContact CG-CG2 4.4Å; L211-V215 WeakPolarHBondContact O-CG2 3.46Å; L211-V215 PolarHBondContact O-N 2.85Å |
| 212 | M | 79.8 | Confident | 80.4 | Confident | 59 Ų | 59 | 50.2 Ų | 50.2 | 29% | 0.291 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -66.5 | -41.9 | 176.9 | -69.7 | -175.6 | -170.6 | 0 | 0 | 111 | C208 F214 V215 F216 I256 I260 | C208-M212 WeakPolarHBondContact O-CB 3.46Å; C208-M212 VanDerWaalsContact O-CG 3.3Å; C208-M212 WeakPolarHBondContact O-CG 3.37Å; C208-M212 PolarHBondContact O-N 3.04Å; M212-F214 PolarHBondContact O-N 2.87Å; M212-V215 PolarHBondContact O-N 3.43Å; M212-F216 HydrophobicContact CB-CD2 4.01Å; M212-F216 HydrophobicContact CB-CE2 4.14Å; M212-F216 HydrophobicContact CG-CD2 4.49Å; M212-F216 HydrophobicContact CG-CE2 4.15Å; M212-F216 WeakPolarHBondContact O-CB 3.49Å; M212-F216 WeakPolarHBondContact O-CD2 3.31Å; M212-F216 PolarHBondContact O-N 3.49Å; M212-I256 HydrophobicContact SD-CG2 3.72Å; M212-I260 HydrophobicContact CE-CD1 4.12Å; M212-I260 HydrophobicContact CE-CG1 4.31Å; M212-I260 HydrophobicContact SD-CD1 3.35Å; M212-I260 WeakPolarHBondContact SD-CD1 3.42Å; M212-I260 HydrophobicContact SD-CG1 4.08Å |
| 213 | L | 79.4 | Confident | 81.4 | Confident | 25 Ų | 25 | 47.9 Ų | 47.9 | 13% | 0.131 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -53.9 | -45.1 | 172.5 | -174.6 | 71.4 | 0 | 0 | 0 | 111.2 | I119 L122 L209 A210 W217 N253 | I119-L213 HydrophobicContact CG1-CD2 3.7Å; L122-L213 HydrophobicContact CD1-CB 4.46Å; L122-L213 HydrophobicContact CD1-CD2 3.95Å; L209-L213 WeakPolarHBondContact O-CB 3.39Å; L209-L213 PolarHBondContact O-N 3.23Å; A210-L213 PolarHBondContact O-N 3Å; L213-W217 HydrophobicContact CD1-CG 4.29Å; L213-W217 WeakPolarHBondContact O-CB 3.41Å; L213-W217 PolarHBondContact O-N 3.42Å; L213-W217 VanDerWaalsContact O-N 3.13Å; L213-N253 WeakPolarHBondContact CA-OD1 3.32Å; L213-N253 WeakPolarHBondContact CD1-ND2 3.13Å; L213-N253 PolarHBondContact N-OD1 2.86Å |
| 214 | F | 84.4 | Confident | 81.8 | Confident | 127 Ų | 127 | 48 Ų | 48 | 56% | 0.557 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -64 | -53.6 | 176.9 | -178.6 | -99.1 | 0 | 0 | 0 | 112.6 | A210 L211 M212 F216 W217 L218 | A210-F214 PolarHBondContact O-N 3.09Å; L211-F214 WeakPolarHBondContact O-CB 3.49Å; L211-F214 PolarHBondContact O-N 3.33Å; M212-F214 PolarHBondContact O-N 2.87Å; F214-F216 PolarHBondContact O-N 2.77Å; F214-W217 PolarHBondContact O-N 3Å; F214-L218 HydrophobicContact CE1-CD2 3.92Å; F214-L218 HydrophobicContact CE2-CD1 4.45Å; F214-L218 HydrophobicContact CZ-CD1 4.19Å; F214-L218 HydrophobicContact CZ-CD2 4.04Å; F214-L218 WeakPolarHBondContact O-CB 3.31Å; F214-L218 PolarHBondContact O-N 3.23Å |
| 215 | V | 87.2 | Confident | 82.3 | Confident | 74 Ų | 74 | 47.5 Ų | 47.5 | 45% | 0.448 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.3 | -43.6 | -175.6 | 170.5 | 0 | 0 | 0 | 0 | 111.7 | L211 M212 P219 | L211-V215 HydrophobicContact CD1-CG2 4.16Å; L211-V215 HydrophobicContact CG-CG2 4.4Å; L211-V215 WeakPolarHBondContact O-CG2 3.46Å; L211-V215 PolarHBondContact O-N 2.85Å; M212-V215 PolarHBondContact O-N 3.43Å; V215-P219 VanDerWaalsContact O-CD 3.28Å; V215-P219 WeakPolarHBondContact O-CD 3.32Å |
| 216 | F | 87.9 | Confident | 82.7 | Confident | 34 Ų | 34 | 52.4 Ų | 52.4 | 15% | 0.149 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -77.9 | -27.9 | -175.2 | -74.6 | -103.1 | 0 | 0 | 0 | 112.5 | M212 F214 L249 S250 L252 N253 I256 | M212-F216 HydrophobicContact CB-CD2 4.01Å; M212-F216 HydrophobicContact CB-CE2 4.14Å; M212-F216 HydrophobicContact CG-CD2 4.49Å; M212-F216 HydrophobicContact CG-CE2 4.15Å; M212-F216 WeakPolarHBondContact O-CB 3.49Å; M212-F216 WeakPolarHBondContact O-CD2 3.31Å; M212-F216 PolarHBondContact O-N 3.49Å; F214-F216 PolarHBondContact O-N 2.77Å; F216-L249 HydrophobicContact CB-CG 4.19Å; F216-L249 HydrophobicContact CD1-CD1 3.45Å; F216-L249 VanDerWaalsContact CD1-CD1 3.45Å; F216-L249 HydrophobicContact CD1-CG 3.66Å; F216-L249 WeakPolarHBondContact CD1-O 3.22Å; F216-L249 HydrophobicContact CE1-CD1 3.68Å; F216-L249 HydrophobicContact CE1-CG 4.38Å; F216-L249 HydrophobicContact CG-CD1 4.28Å; F216-L249 HydrophobicContact CG-CG 4.15Å; F216-L249 CarbonylContact O-C 3.28Å; F216-S250 WeakPolarHBondContact O-CA 3.44Å; F216-S250 PolarHBondContact O-N 2.95Å; F216-L252 HydrophobicContact CD1-CB 3.8Å; F216-L252 HydrophobicContact CE1-CB 3.68Å; F216-L252 HydrophobicContact CE1-CD1 4.29Å; F216-N253 HydrophobicContact CB-CB 4.12Å; F216-I256 HydrophobicContact CE1-CD1 3.65Å; F216-I256 HydrophobicContact CE2-CD1 4.11Å; F216-I256 HydrophobicContact CZ-CD1 3.33Å |
| 217 | W | 85.6 | Confident | 82.7 | Confident | 21 Ų | 21 | 54.6 Ų | 54.6 | 8% | 0.08 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -91 | -19.1 | 176.2 | -76.5 | 69.8 | 0 | 0 | 0 | 114.2 | M115 L213 F214 H220 N221 | M115-W217 HydrophobicContact CB-CH2 3.81Å; M115-W217 HydrophobicContact CB-CZ2 4.29Å; M115-W217 HydrophobicContact CB-CZ3 4.43Å; M115-W217 HydrophobicContact CG-CE3 4.36Å; M115-W217 HydrophobicContact CG-CH2 3.56Å; M115-W217 HydrophobicContact CG-CZ2 4.02Å; M115-W217 HydrophobicContact CG-CZ3 3.76Å; M115-W217 HydrophobicContact SD-CE3 3.95Å; M115-W217 HydrophobicContact SD-CH2 3.7Å; M115-W217 HydrophobicContact SD-CZ3 3.3Å; M115-W217 WeakPolarHBondContact SD-CZ3 3.35Å; L213-W217 HydrophobicContact CD1-CG 4.29Å; L213-W217 WeakPolarHBondContact O-CB 3.41Å; L213-W217 PolarHBondContact O-N 3.42Å; L213-W217 VanDerWaalsContact O-N 3.13Å; F214-W217 PolarHBondContact O-N 3Å; W217-H220 AromaticContact CE3-CD2 3.91Å; W217-H220 AromaticContact CZ3-CD2 3.94Å; W217-H220 WeakPolarHBondContact O-CB 3.25Å; W217-H220 PolarHBondContact O-N 3.34Å; W217-N221 PolarHBondContact O-N 2.89Å; W217-N221 PolarHBondContact O-ND2 3.23Å |
| 218 | L | 88.1 | Confident | 82.4 | Confident | 70 Ų | 70 | 51 Ų | 51 | 37% | 0.366 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -57.6 | -49.5 | -174.6 | 175 | 66.7 | 0 | 0 | 0 | 112.4 | F214 H220 N221 I222 | F214-L218 HydrophobicContact CE1-CD2 3.92Å; F214-L218 HydrophobicContact CE2-CD1 4.45Å; F214-L218 HydrophobicContact CZ-CD1 4.19Å; F214-L218 HydrophobicContact CZ-CD2 4.04Å; F214-L218 WeakPolarHBondContact O-CB 3.31Å; F214-L218 PolarHBondContact O-N 3.23Å; L218-H220 VanDerWaalsContact C-N 3.26Å; L218-H220 PolarHBondContact O-N 3.42Å; L218-N221 PolarHBondContact O-N 2.87Å; L218-N221 VanDerWaalsContact O-N 3.17Å; L218-I222 HydrophobicContact CD1-CD1 4.02Å; L218-I222 HydrophobicContact CD1-CG1 4.19Å; L218-I222 HydrophobicContact CG-CD1 3.88Å; L218-I222 HydrophobicContact CG-CG1 4.47Å; L218-I222 WeakPolarHBondContact O-CG1 3.15Å; L218-I222 PolarHBondContact O-N 3.17Å |
| 219 | P | 90.1 | Very high | 82.4 | Confident | 30 Ų | 30 | 56.2 Ų | 56.2 | 20% | 0.195 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.8 | -37.2 | 178.5 | -27.5 | 38.9 | 0 | 0 | 0 | 112.9 | V215 I222 S223 Y242 A246 L249 | V215-P219 VanDerWaalsContact O-CD 3.28Å; V215-P219 WeakPolarHBondContact O-CD 3.32Å; P219-I222 PolarHBondContact O-N 2.65Å; P219-S223 PolarHBondContact O-N 3.19Å; P219-Y242 WeakPolarHBondContact CA-OH 3.2Å; P219-Y242 PolarHBondContact O-OH 3.17Å; P219-Y242 VanDerWaalsContact O-OH 3.05Å; P219-A246 HydrophobicContact CB-CB 3.68Å; P219-L249 HydrophobicContact CG-CD2 3.74Å |
| 220 | H | 84 | Confident | 82.1 | Confident | 4 Ų | 4 | 57.4 Ų | 57.4 | 2% | 0.019 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.6 | -44.9 | 177.7 | 176 | 54.2 | 0 | 0 | 0 | 111.2 | W217 L218 I222 S223 L224 A246 H247 | W217-H220 AromaticContact CE3-CD2 3.91Å; W217-H220 AromaticContact CZ3-CD2 3.94Å; W217-H220 WeakPolarHBondContact O-CB 3.25Å; W217-H220 PolarHBondContact O-N 3.34Å; L218-H220 VanDerWaalsContact C-N 3.26Å; L218-H220 PolarHBondContact O-N 3.42Å; H220-I222 VanDerWaalsContact C-N 3.32Å; H220-I222 PolarHBondContact O-N 2.85Å; H220-S223 PolarHBondContact O-N 3.45Å; H220-S223 PolarHBondContact O-OG 2.96Å; H220-L224 WeakPolarHBondContact O-CG 3.43Å; H220-L224 PolarHBondContact O-N 3.45Å; H220-A246 HydrophobicContact CB-CB 4.47Å; H220-H247 AromaticContact CE1-CD2 3.49Å; H220-H247 PolarHBondContact CE1-CD2 3.33Å; H220-H247 VanDerWaalsContact CE1-CD2 3.49Å; H220-H247 AromaticContact CE1-CE1 3.58Å; H220-H247 AromaticContact CE1-NE2 3.03Å; H220-H247 PolarHBondContact CE1-NE2 2.96Å; H220-H247 AromaticContact ND1-CD2 3.04Å; H220-H247 PolarHBondContact ND1-CD2 3.45Å; H220-H247 AromaticContact ND1-CE1 3.95Å; H220-H247 AromaticContact ND1-CG 3.92Å; H220-H247 AromaticContact ND1-NE2 3.09Å; H220-H247 PolarHBondContact ND1-NE2 3.48Å |
| 221 | N | 84.5 | Confident | 81.5 | Confident | 58 Ų | 58 | 65.1 Ų | 65.1 | 31% | 0.31 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -63.9 | -37.4 | 175.8 | -75.9 | -89 | 0 | 0 | 0 | 111.9 | W217 L218 L224 I225 | W217-N221 PolarHBondContact O-N 2.89Å; W217-N221 PolarHBondContact O-ND2 3.23Å; L218-N221 PolarHBondContact O-N 2.87Å; L218-N221 VanDerWaalsContact O-N 3.17Å; N221-L224 PolarHBondContact O-N 2.74Å; N221-I225 VanDerWaalsContact O-CG1 3.25Å; N221-I225 WeakPolarHBondContact O-CG1 3.42Å; N221-I225 PolarHBondContact O-N 3.49Å |
| 222 | I | 85.9 | Confident | 80.7 | Confident | 73 Ų | 73 | 63.7 Ų | 63.7 | 37% | 0.374 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61.6 | -45 | 173.1 | -67.8 | 167.2 | 0 | 0 | 0 | 110.4 | L218 P219 H220 L224 I225 W226 Y242 | L218-I222 HydrophobicContact CD1-CD1 4.02Å; L218-I222 HydrophobicContact CD1-CG1 4.19Å; L218-I222 HydrophobicContact CG-CD1 3.88Å; L218-I222 HydrophobicContact CG-CG1 4.47Å; L218-I222 WeakPolarHBondContact O-CG1 3.15Å; L218-I222 PolarHBondContact O-N 3.17Å; P219-I222 PolarHBondContact O-N 2.65Å; H220-I222 VanDerWaalsContact C-N 3.32Å; H220-I222 PolarHBondContact O-N 2.85Å; I222-L224 VanDerWaalsContact C-N 3.3Å; I222-L224 PolarHBondContact O-N 3.31Å; I222-I225 PolarHBondContact O-N 3.24Å; I222-W226 PolarHBondContact O-N 3.39Å; I222-Y242 WeakPolarHBondContact CB-OH 3.38Å; I222-Y242 WeakPolarHBondContact CG2-OH 3.28Å |
| 223 | S | 81 | Confident | 79.9 | Confident | 0 Ų | 0 | 70.2 Ų | 70.2 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.7 | -39.2 | 177.2 | 75.8 | 0 | 0 | 0 | 0 | 112.3 | P219 H220 W226 I227 | P219-S223 PolarHBondContact O-N 3.19Å; H220-S223 PolarHBondContact O-N 3.45Å; H220-S223 PolarHBondContact O-OG 2.96Å; S223-W226 PolarHBondContact O-N 2.85Å; S223-I227 VanDerWaalsContact O-CG1 3.29Å; S223-I227 WeakPolarHBondContact O-CG1 3.42Å; S223-I227 PolarHBondContact O-N 2.96Å |
| 224 | L | 77.2 | Confident | 79.3 | Confident | 37 Ų | 37 | 75.6 Ų | 75.6 | 19% | 0.194 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -67.7 | -42.4 | 176.4 | -72 | 171.8 | 0 | 0 | 0 | 111.4 | H220 N221 I222 W226 I227 N228 | H220-L224 WeakPolarHBondContact O-CG 3.43Å; H220-L224 PolarHBondContact O-N 3.45Å; N221-L224 PolarHBondContact O-N 2.74Å; I222-L224 VanDerWaalsContact C-N 3.3Å; I222-L224 PolarHBondContact O-N 3.31Å; L224-W226 VanDerWaalsContact C-N 3.28Å; L224-W226 PolarHBondContact O-N 3.4Å; L224-I227 PolarHBondContact O-N 3.09Å; L224-N228 PolarHBondContact O-N 3.4Å; L224-N228 VanDerWaalsContact O-N 3.11Å; L224-N228 PolarHBondContact O-ND2 3.03Å |
| 225 | I | 81.9 | Confident | 78.7 | Confident | 99 Ų | 99 | 74.4 Ų | 74.4 | 51% | 0.508 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 175.7 | -70 | 164.4 | 0 | 0 | 0 | 109.6 | N221 I222 I227 N228 F229 | N221-I225 VanDerWaalsContact O-CG1 3.25Å; N221-I225 WeakPolarHBondContact O-CG1 3.42Å; N221-I225 PolarHBondContact O-N 3.49Å; I222-I225 PolarHBondContact O-N 3.24Å; I225-I227 PolarHBondContact O-N 3.4Å; I225-N228 PolarHBondContact O-N 2.92Å; I225-F229 HydrophobicContact CG2-CD2 3.99Å; I225-F229 WeakPolarHBondContact O-CB 3.32Å; I225-F229 WeakPolarHBondContact O-CD2 3.41Å; I225-F229 PolarHBondContact O-N 3.17Å |
| 226 | W | 82 | Confident | 78.2 | Confident | 115 Ų | 115 | 72.7 Ų | 72.7 | 44% | 0.436 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -60.3 | -45.8 | 177.1 | -158.2 | -20.4 | 0 | 0 | 0 | 111.5 | I222 S223 L224 N228 G230 V232 W235 F239 | I222-W226 PolarHBondContact O-N 3.39Å; S223-W226 PolarHBondContact O-N 2.85Å; L224-W226 VanDerWaalsContact C-N 3.28Å; L224-W226 PolarHBondContact O-N 3.4Å; W226-N228 VanDerWaalsContact C-N 3.32Å; W226-N228 PolarHBondContact O-N 2.92Å; W226-G230 VanDerWaalsContact O-CA 3.24Å; W226-G230 WeakPolarHBondContact O-CA 3.49Å; W226-G230 PolarHBondContact O-N 3.27Å; W226-V232 VanDerWaalsContact NE1-CG2 3.33Å; W226-W235 AromaticContact CD1-CH2 3.7Å; W226-W235 AromaticContact CD1-CZ3 3.72Å; W226-W235 HydrophobicContact CG-CH2 4.37Å; W226-W235 HydrophobicContact CG-CZ3 4.18Å; W226-W235 AromaticContact NE1-CZ3 3.9Å; W226-F239 HydrophobicContact CB-CE2 3.99Å; W226-F239 HydrophobicContact CB-CZ 4.46Å; W226-F239 AromaticContact CD2-CD2 3.92Å; W226-F239 HydrophobicContact CD2-CD2 3.92Å; W226-F239 AromaticContact CD2-CE2 3.63Å; W226-F239 HydrophobicContact CD2-CE2 3.63Å; W226-F239 AromaticContact CE3-CD2 3.8Å; W226-F239 HydrophobicContact CE3-CD2 3.8Å; W226-F239 AromaticContact CE3-CE2 3.6Å; W226-F239 HydrophobicContact CE3-CE2 3.6Å; W226-F239 HydrophobicContact CG-CD2 4.47Å; W226-F239 AromaticContact CG-CE2 3.81Å; W226-F239 HydrophobicContact CG-CE2 3.81Å; W226-F239 HydrophobicContact CH2-CD2 4.34Å; W226-F239 HydrophobicContact CZ2-CD2 4.45Å; W226-F239 HydrophobicContact CZ3-CD2 4.01Å; W226-F239 HydrophobicContact CZ3-CE2 4.27Å |
| 227 | I | 74 | Confident | 77.6 | Confident | 52 Ų | 52 | 75.4 Ų | 75.4 | 27% | 0.267 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.6 | -35.5 | 179.6 | -66.6 | 162.7 | 0 | 0 | 0 | 112.7 | S223 L224 I225 W235 F239 K243 | S223-I227 VanDerWaalsContact O-CG1 3.29Å; S223-I227 WeakPolarHBondContact O-CG1 3.42Å; S223-I227 PolarHBondContact O-N 2.96Å; L224-I227 PolarHBondContact O-N 3.09Å; I225-I227 PolarHBondContact O-N 3.4Å; I227-W235 HydrophobicContact CG1-CH2 4.4Å; I227-F239 HydrophobicContact CD1-CE1 4.08Å; I227-F239 HydrophobicContact CD1-CZ 3.96Å; I227-F239 HydrophobicContact CG1-CE1 3.83Å; I227-F239 HydrophobicContact CG1-CZ 3.56Å; I227-K243 HydrophobicContact CD1-CD 4.12Å |
| 228 | N | 72.7 | Confident | 77.3 | Confident | 47 Ų | 47 | 81.2 Ų | 81.2 | 25% | 0.251 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -83 | -35.2 | -178.5 | -70.2 | -75.6 | 0 | 0 | 0 | 113.8 | L224 I225 W226 K325 H326 | L224-N228 PolarHBondContact O-N 3.4Å; L224-N228 VanDerWaalsContact O-N 3.11Å; L224-N228 PolarHBondContact O-ND2 3.03Å; I225-N228 PolarHBondContact O-N 2.92Å; W226-N228 VanDerWaalsContact C-N 3.32Å; W226-N228 PolarHBondContact O-N 2.92Å; N228-K325 PolarHBondContact OD1-O 3.05Å; N228-K325 VanDerWaalsContact OD1-O 3.09Å; N228-H326 VanDerWaalsContact CG-CD2 3.49Å; N228-H326 PolarHBondContact ND2-CD2 2.95Å; N228-H326 PolarHBondContact ND2-CE1 2.92Å; N228-H326 PolarHBondContact ND2-NE2 3.22Å; N228-H326 WeakPolarHBondContact OD1-CA 3.44Å; N228-H326 PolarHBondContact OD1-CD2 2.93Å; N228-H326 PolarHBondContact OD1-CE1 3.32Å; N228-H326 PolarHBondContact OD1-ND1 3.42Å; N228-H326 PolarHBondContact OD1-NE2 3.25Å |
| 229 | F | 79.7 | Confident | 77.1 | Confident | 129 Ų | 129 | 79 Ų | 79 | 57% | 0.566 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -118.1 | -12 | -167.7 | -62.5 | -75 | 0 | 0 | 0 | 113.6 | I225 | I225-F229 HydrophobicContact CG2-CD2 3.99Å; I225-F229 WeakPolarHBondContact O-CB 3.32Å; I225-F229 WeakPolarHBondContact O-CD2 3.41Å; I225-F229 PolarHBondContact O-N 3.17Å |
| 230 | G | 73.9 | Confident | 76.7 | Confident | 26 Ų | 26 | 79.6 Ų | 79.6 | 27% | 0.268 | 40% | 0.395 | S | S | . | . | trans | -84.2 | 122.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | W226 V232 | W226-G230 VanDerWaalsContact O-CA 3.24Å; W226-G230 WeakPolarHBondContact O-CA 3.49Å; W226-G230 PolarHBondContact O-N 3.27Å; G230-V232 PolarHBondContact O-N 3.15Å | ||
| 231 | E | 68.7 | Low | 76.7 | Confident | 203 Ų | 203 | 82 Ų | 82 | 95% | 0.949 | 41% | 0.407 | S | S | * | . | trans | -81.7 | 93.8 | 166.3 | -65.6 | 176.1 | -178.7 | 0 | 0 | 107.7 | ||||
| 232 | V | 66.7 | Low | 76.8 | Confident | 54 Ų | 54 | 82.9 Ų | 82.9 | 33% | 0.327 | 41% | 0.406 | S | S | . | . | trans | -122.7 | 117.9 | 173.6 | -171.1 | 0 | 0 | 0 | 0 | 107.4 | W226 G230 D234 W235 | W226-V232 VanDerWaalsContact NE1-CG2 3.33Å; G230-V232 PolarHBondContact O-N 3.15Å; V232-D234 VanDerWaalsContact C-N 3.31Å; V232-D234 VanDerWaalsContact CG1-O 3.3Å; V232-D234 WeakPolarHBondContact CG1-O 3.35Å; V232-W235 HydrophobicContact CB-CD2 4.48Å; V232-W235 HydrophobicContact CB-CE3 4.36Å; V232-W235 HydrophobicContact CB-CH2 4.29Å; V232-W235 HydrophobicContact CB-CZ2 4.38Å; V232-W235 HydrophobicContact CB-CZ3 4.28Å; V232-W235 HydrophobicContact CG2-CH2 4.07Å; V232-W235 HydrophobicContact CG2-CZ3 4.04Å | ||
| 233 | E | 62.9 | Low | 76.7 | Confident | 196 Ų | 196 | 82.5 Ų | 82.5 | 92% | 0.916 | 40% | 0.402 | S | S | * | . | S | Bend | trans | -65.7 | -35.5 | -179.5 | -73.5 | 179.3 | 158.1 | 0 | 0 | 111.7 | ||
| 234 | D | 66 | Low | 76.9 | Confident | 138 Ų | 138 | 82.6 Ų | 82.6 | 74% | 0.738 | 40% | 0.403 | S | S | * | . | trans | -131.1 | 112.8 | 179.5 | -72.5 | -42.3 | 0 | 0 | 0 | 112.3 | V232 G236 | V232-D234 VanDerWaalsContact C-N 3.31Å; V232-D234 VanDerWaalsContact CG1-O 3.3Å; V232-D234 WeakPolarHBondContact CG1-O 3.35Å; D234-G236 VanDerWaalsContact C-N 3.28Å; D234-G236 PolarHBondContact O-N 3.34Å | ||
| 235 | W | 73.3 | Confident | 77.4 | Confident | 103 Ų | 103 | 84.8 Ų | 84.8 | 39% | 0.39 | 42% | 0.418 | S | S | . | . | trans | -73.8 | 81.5 | 170.8 | -61.7 | 102.9 | 0 | 0 | 0 | 110.3 | W226 I227 V232 F239 | W226-W235 AromaticContact CD1-CH2 3.7Å; W226-W235 AromaticContact CD1-CZ3 3.72Å; W226-W235 HydrophobicContact CG-CH2 4.37Å; W226-W235 HydrophobicContact CG-CZ3 4.18Å; W226-W235 AromaticContact NE1-CZ3 3.9Å; I227-W235 HydrophobicContact CG1-CH2 4.4Å; V232-W235 HydrophobicContact CB-CD2 4.48Å; V232-W235 HydrophobicContact CB-CE3 4.36Å; V232-W235 HydrophobicContact CB-CH2 4.29Å; V232-W235 HydrophobicContact CB-CZ2 4.38Å; V232-W235 HydrophobicContact CB-CZ3 4.28Å; V232-W235 HydrophobicContact CG2-CH2 4.07Å; V232-W235 HydrophobicContact CG2-CZ3 4.04Å; W235-F239 HydrophobicContact CB-CD1 4.49Å; W235-F239 HydrophobicContact CD2-CD1 4.09Å; W235-F239 HydrophobicContact CD2-CE1 4.27Å; W235-F239 HydrophobicContact CE3-CB 4.22Å; W235-F239 AromaticContact CE3-CD1 3.23Å; W235-F239 HydrophobicContact CE3-CD1 3.23Å; W235-F239 AromaticContact CE3-CD2 3.89Å; W235-F239 HydrophobicContact CE3-CD2 3.89Å; W235-F239 AromaticContact CE3-CE1 3.48Å; W235-F239 HydrophobicContact CE3-CE1 3.48Å; W235-F239 VanDerWaalsContact CE3-CE1 3.48Å; W235-F239 HydrophobicContact CE3-CE2 4.12Å; W235-F239 AromaticContact CE3-CG 3.47Å; W235-F239 HydrophobicContact CE3-CG 3.47Å; W235-F239 VanDerWaalsContact CE3-CG 3.47Å; W235-F239 AromaticContact CE3-CZ 3.95Å; W235-F239 HydrophobicContact CE3-CZ 3.95Å; W235-F239 HydrophobicContact CH2-CZ 4.4Å; W235-F239 AromaticContact CZ3-CD1 3.78Å; W235-F239 HydrophobicContact CZ3-CD1 3.78Å; W235-F239 AromaticContact CZ3-CD2 3.75Å; W235-F239 HydrophobicContact CZ3-CD2 3.75Å; W235-F239 AromaticContact CZ3-CE1 3.64Å; W235-F239 HydrophobicContact CZ3-CE1 3.64Å; W235-F239 AromaticContact CZ3-CE2 3.63Å; W235-F239 HydrophobicContact CZ3-CE2 3.63Å; W235-F239 AromaticContact CZ3-CG 3.84Å; W235-F239 HydrophobicContact CZ3-CG 3.84Å; W235-F239 AromaticContact CZ3-CZ 3.59Å; W235-F239 HydrophobicContact CZ3-CZ 3.59Å | ||
| 236 | G | 76.4 | Confident | 77.8 | Confident | 38 Ų | 38 | 80.2 Ų | 80.2 | 39% | 0.392 | 40% | 0.395 | S | S | . | . | trans | -69.1 | 172.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | F24 D234 E238 F239 | F24-G236 WeakPolarHBondContact CZ-O 3.46Å; D234-G236 VanDerWaalsContact C-N 3.28Å; D234-G236 PolarHBondContact O-N 3.34Å; G236-E238 PolarHBondContact O-N 3.44Å; G236-E238 VanDerWaalsContact O-N 3.13Å; G236-F239 PolarHBondContact O-N 2.82Å | ||
| 237 | Q | 76 | Confident | 78 | Confident | 90 Ų | 90 | 75.2 Ų | 75.2 | 42% | 0.421 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -46.7 | -44.7 | -175.5 | -160.1 | 172.2 | -29 | 0 | 0 | 114.7 | F24 F239 F240 I241 | F24-Q237 HydrophobicContact CD1-CG 4.26Å; F24-Q237 HydrophobicContact CE1-CB 4.09Å; F24-Q237 HydrophobicContact CE1-CG 3.79Å; F24-Q237 WeakPolarHBondContact CE1-O 3.43Å; F24-Q237 HydrophobicContact CZ-CB 4.15Å; F24-Q237 HydrophobicContact CZ-CG 4.35Å; Q237-F239 PolarHBondContact O-N 3.21Å; Q237-F240 PolarHBondContact O-N 3.47Å; Q237-I241 HydrophobicContact CG-CD1 3.98Å; Q237-I241 HydrophobicContact CG-CG1 4.48Å; Q237-I241 WeakPolarHBondContact O-CG1 3.22Å; Q237-I241 PolarHBondContact O-N 3.27Å |
| 238 | E | 79 | Confident | 78.7 | Confident | 144 Ų | 144 | 73.3 Ų | 73.3 | 67% | 0.673 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -59.8 | -42.6 | -178.2 | -55.6 | -50.5 | 134.5 | 0 | 0 | 113 | G236 F240 I241 Y242 | G236-E238 PolarHBondContact O-N 3.44Å; G236-E238 VanDerWaalsContact O-N 3.13Å; E238-F240 PolarHBondContact O-N 3.03Å; E238-I241 PolarHBondContact O-N 3.43Å; E238-Y242 WeakPolarHBondContact O-CB 3.47Å; E238-Y242 PolarHBondContact O-N 2.94Å |
| 239 | F | 84 | Confident | 79.5 | Confident | 22 Ų | 22 | 73.5 Ų | 73.5 | 10% | 0.096 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -66.2 | -41.3 | -177 | 177.8 | -99.7 | 0 | 0 | 0 | 111.5 | W226 I227 W235 G236 Q237 Y242 K243 | W226-F239 HydrophobicContact CB-CE2 3.99Å; W226-F239 HydrophobicContact CB-CZ 4.46Å; W226-F239 AromaticContact CD2-CD2 3.92Å; W226-F239 HydrophobicContact CD2-CD2 3.92Å; W226-F239 AromaticContact CD2-CE2 3.63Å; W226-F239 HydrophobicContact CD2-CE2 3.63Å; W226-F239 AromaticContact CE3-CD2 3.8Å; W226-F239 HydrophobicContact CE3-CD2 3.8Å; W226-F239 AromaticContact CE3-CE2 3.6Å; W226-F239 HydrophobicContact CE3-CE2 3.6Å; W226-F239 HydrophobicContact CG-CD2 4.47Å; W226-F239 AromaticContact CG-CE2 3.81Å; W226-F239 HydrophobicContact CG-CE2 3.81Å; W226-F239 HydrophobicContact CH2-CD2 4.34Å; W226-F239 HydrophobicContact CZ2-CD2 4.45Å; W226-F239 HydrophobicContact CZ3-CD2 4.01Å; W226-F239 HydrophobicContact CZ3-CE2 4.27Å; I227-F239 HydrophobicContact CD1-CE1 4.08Å; I227-F239 HydrophobicContact CD1-CZ 3.96Å; I227-F239 HydrophobicContact CG1-CE1 3.83Å; I227-F239 HydrophobicContact CG1-CZ 3.56Å; W235-F239 HydrophobicContact CB-CD1 4.49Å; W235-F239 HydrophobicContact CD2-CD1 4.09Å; W235-F239 HydrophobicContact CD2-CE1 4.27Å; W235-F239 HydrophobicContact CE3-CB 4.22Å; W235-F239 AromaticContact CE3-CD1 3.23Å; W235-F239 HydrophobicContact CE3-CD1 3.23Å; W235-F239 AromaticContact CE3-CD2 3.89Å; W235-F239 HydrophobicContact CE3-CD2 3.89Å; W235-F239 AromaticContact CE3-CE1 3.48Å; W235-F239 HydrophobicContact CE3-CE1 3.48Å; W235-F239 VanDerWaalsContact CE3-CE1 3.48Å; W235-F239 HydrophobicContact CE3-CE2 4.12Å; W235-F239 AromaticContact CE3-CG 3.47Å; W235-F239 HydrophobicContact CE3-CG 3.47Å; W235-F239 VanDerWaalsContact CE3-CG 3.47Å; W235-F239 AromaticContact CE3-CZ 3.95Å; W235-F239 HydrophobicContact CE3-CZ 3.95Å; W235-F239 HydrophobicContact CH2-CZ 4.4Å; W235-F239 AromaticContact CZ3-CD1 3.78Å; W235-F239 HydrophobicContact CZ3-CD1 3.78Å; W235-F239 AromaticContact CZ3-CD2 3.75Å; W235-F239 HydrophobicContact CZ3-CD2 3.75Å; W235-F239 AromaticContact CZ3-CE1 3.64Å; W235-F239 HydrophobicContact CZ3-CE1 3.64Å; W235-F239 AromaticContact CZ3-CE2 3.63Å; W235-F239 HydrophobicContact CZ3-CE2 3.63Å; W235-F239 AromaticContact CZ3-CG 3.84Å; W235-F239 HydrophobicContact CZ3-CG 3.84Å; W235-F239 AromaticContact CZ3-CZ 3.59Å; W235-F239 HydrophobicContact CZ3-CZ 3.59Å; G236-F239 PolarHBondContact O-N 2.82Å; Q237-F239 PolarHBondContact O-N 3.21Å; F239-Y242 WeakPolarHBondContact O-CB 3.38Å; F239-Y242 PolarHBondContact O-N 2.93Å; F239-K243 HydrophobicContact CE1-CB 4.41Å; F239-K243 HydrophobicContact CE1-CD 4.29Å; F239-K243 WeakPolarHBondContact O-CB 3.24Å; F239-K243 PolarHBondContact O-N 2.98Å |
| 240 | F | 81.9 | Confident | 79.9 | Confident | 44 Ų | 44 | 67.5 Ų | 67.5 | 19% | 0.193 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -73.7 | -37.9 | 179.8 | 170.9 | -76.4 | 0 | 0 | 0 | 111.5 | F24 L25 Y92 Q237 E238 Y242 K243 V244 | F24-F240 HydrophobicContact CD1-CB 4.02Å; F24-F240 AromaticContact CD1-CD1 3.39Å; F24-F240 HydrophobicContact CD1-CD1 3.39Å; F24-F240 HydrophobicContact CD1-CD2 4.38Å; F24-F240 AromaticContact CD1-CE1 3.91Å; F24-F240 HydrophobicContact CD1-CE1 3.91Å; F24-F240 AromaticContact CD1-CG 3.68Å; F24-F240 HydrophobicContact CD1-CG 3.68Å; F24-F240 HydrophobicContact CE1-CB 3.18Å; F24-F240 AromaticContact CE1-CD1 3.38Å; F24-F240 HydrophobicContact CE1-CD1 3.38Å; F24-F240 HydrophobicContact CE1-CD2 4.3Å; F24-F240 HydrophobicContact CE1-CE1 4.34Å; F24-F240 AromaticContact CE1-CG 3.37Å; F24-F240 HydrophobicContact CE1-CG 3.37Å; F24-F240 HydrophobicContact CZ-CB 3.43Å; F24-F240 VanDerWaalsContact CZ-CB 3.43Å; F24-F240 HydrophobicContact CZ-CD1 4.41Å; F24-F240 AromaticContact CZ-CG 3.98Å; F24-F240 HydrophobicContact CZ-CG 3.98Å; L25-F240 HydrophobicContact CD1-CE1 3.59Å; L25-F240 HydrophobicContact CD1-CZ 4.38Å; L25-F240 HydrophobicContact CD2-CD1 4.03Å; L25-F240 HydrophobicContact CD2-CE1 3.89Å; L25-F240 HydrophobicContact CG-CD1 4.22Å; L25-F240 HydrophobicContact CG-CE1 3.6Å; Y92-F240 HydrophobicContact CD1-CZ 4.41Å; Q237-F240 PolarHBondContact O-N 3.47Å; E238-F240 PolarHBondContact O-N 3.03Å; F240-Y242 VanDerWaalsContact C-N 3.29Å; F240-Y242 PolarHBondContact O-N 3.48Å; F240-K243 PolarHBondContact O-N 3.47Å; F240-V244 HydrophobicContact CD1-CG2 3.93Å; F240-V244 HydrophobicContact CE1-CG2 3.61Å; F240-V244 HydrophobicContact CE2-CG2 4.43Å; F240-V244 HydrophobicContact CG-CG2 4.44Å; F240-V244 HydrophobicContact CZ-CG2 3.9Å; F240-V244 WeakPolarHBondContact O-CB 3.46Å; F240-V244 VanDerWaalsContact O-CG2 3.24Å; F240-V244 WeakPolarHBondContact O-CG2 3.01Å; F240-V244 PolarHBondContact O-N 2.84Å |
| 241 | I | 82.8 | Confident | 80.7 | Confident | 54 Ų | 54 | 66.4 Ų | 66.4 | 28% | 0.277 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -57.8 | -45.3 | 170.3 | -69 | 171.9 | 0 | 0 | 0 | 110.3 | L25 Q237 E238 V244 T245 | L25-I241 HydrophobicContact CD2-CG1 3.91Å; Q237-I241 HydrophobicContact CG-CD1 3.98Å; Q237-I241 HydrophobicContact CG-CG1 4.48Å; Q237-I241 WeakPolarHBondContact O-CG1 3.22Å; Q237-I241 PolarHBondContact O-N 3.27Å; E238-I241 PolarHBondContact O-N 3.43Å; I241-V244 PolarHBondContact O-N 3.42Å; I241-T245 WeakPolarHBondContact O-CB 3.46Å; I241-T245 PolarHBondContact O-N 3.41Å; I241-T245 PolarHBondContact O-OG1 3.49Å |
| 242 | Y | 87.7 | Confident | 81.7 | Confident | 76 Ų | 76 | 59.8 Ų | 59.8 | 30% | 0.298 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -59.1 | -49.9 | 174.3 | 171.4 | -97.2 | 0 | 0 | 0 | 111.7 | P219 I222 E238 F239 F240 V244 T245 A246 | P219-Y242 WeakPolarHBondContact CA-OH 3.2Å; P219-Y242 PolarHBondContact O-OH 3.17Å; P219-Y242 VanDerWaalsContact O-OH 3.05Å; I222-Y242 WeakPolarHBondContact CB-OH 3.38Å; I222-Y242 WeakPolarHBondContact CG2-OH 3.28Å; E238-Y242 WeakPolarHBondContact O-CB 3.47Å; E238-Y242 PolarHBondContact O-N 2.94Å; F239-Y242 WeakPolarHBondContact O-CB 3.38Å; F239-Y242 PolarHBondContact O-N 2.93Å; F240-Y242 VanDerWaalsContact C-N 3.29Å; F240-Y242 PolarHBondContact O-N 3.48Å; Y242-V244 PolarHBondContact O-N 2.64Å; Y242-T245 PolarHBondContact O-N 2.9Å; Y242-A246 WeakPolarHBondContact O-CB 3.49Å; Y242-A246 PolarHBondContact O-N 3.04Å |
| 243 | K | 83.9 | Confident | 82.8 | Confident | 65 Ų | 65 | 57.6 Ų | 57.6 | 28% | 0.283 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -58.4 | -46.4 | 179.7 | -178.9 | -172.8 | 176.3 | -178.5 | 0 | 111.7 | I227 F239 F240 A246 H247 | I227-K243 HydrophobicContact CD1-CD 4.12Å; F239-K243 HydrophobicContact CE1-CB 4.41Å; F239-K243 HydrophobicContact CE1-CD 4.29Å; F239-K243 WeakPolarHBondContact O-CB 3.24Å; F239-K243 PolarHBondContact O-N 2.98Å; F240-K243 PolarHBondContact O-N 3.47Å; K243-A246 PolarHBondContact O-N 3.03Å; K243-H247 PolarHBondContact O-CD2 2.91Å; K243-H247 PolarHBondContact O-N 3.45Å |
| 244 | V | 85.2 | Confident | 84 | Confident | 2 Ų | 2 | 48.5 Ų | 48.5 | 1% | 0.012 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.6 | -49.2 | 177.5 | 174.3 | 0 | 0 | 0 | 0 | 110.1 | L33 Y92 F240 I241 Y242 A246 H247 M248 | L33-V244 HydrophobicContact CD1-CG1 3.73Å; L33-V244 HydrophobicContact CD2-CG1 3.53Å; L33-V244 HydrophobicContact CG-CG1 4.25Å; Y92-V244 HydrophobicContact CD1-CG2 3.63Å; Y92-V244 HydrophobicContact CE1-CG2 3.74Å; Y92-V244 HydrophobicContact CG-CG1 4.45Å; Y92-V244 HydrophobicContact CG-CG2 4.29Å; F240-V244 HydrophobicContact CD1-CG2 3.93Å; F240-V244 HydrophobicContact CE1-CG2 3.61Å; F240-V244 HydrophobicContact CE2-CG2 4.43Å; F240-V244 HydrophobicContact CG-CG2 4.44Å; F240-V244 HydrophobicContact CZ-CG2 3.9Å; F240-V244 WeakPolarHBondContact O-CB 3.46Å; F240-V244 VanDerWaalsContact O-CG2 3.24Å; F240-V244 WeakPolarHBondContact O-CG2 3.01Å; F240-V244 PolarHBondContact O-N 2.84Å; I241-V244 PolarHBondContact O-N 3.42Å; Y242-V244 PolarHBondContact O-N 2.64Å; V244-A246 VanDerWaalsContact C-N 3.3Å; V244-A246 PolarHBondContact O-N 3.33Å; V244-H247 WeakPolarHBondContact O-CB 3.35Å; V244-H247 PolarHBondContact O-N 3.03Å; V244-H247 VanDerWaalsContact O-N 3.11Å; V244-M248 HydrophobicContact CG1-CE 3.76Å; V244-M248 HydrophobicContact CG1-CG 4.4Å; V244-M248 WeakPolarHBondContact O-CG 3.48Å; V244-M248 PolarHBondContact O-N 3.09Å |
| 245 | T | 87.7 | Confident | 85.1 | Confident | 83 Ų | 83 | 42.2 Ų | 42.2 | 51% | 0.509 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.9 | -41.1 | 178.9 | -56 | 0 | 0 | 0 | 0 | 111.7 | I241 Y242 H247 M248 L249 | I241-T245 WeakPolarHBondContact O-CB 3.46Å; I241-T245 PolarHBondContact O-N 3.41Å; I241-T245 PolarHBondContact O-OG1 3.49Å; Y242-T245 PolarHBondContact O-N 2.9Å; T245-H247 PolarHBondContact O-N 3.46Å; T245-M248 PolarHBondContact O-N 2.74Å; T245-L249 PolarHBondContact O-N 3.19Å |
| 246 | A | 88.6 | Confident | 85.8 | Confident | 3 Ų | 3 | 39.5 Ų | 39.5 | 3% | 0.025 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63.4 | -38.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | P219 H220 Y242 K243 V244 S250 | P219-A246 HydrophobicContact CB-CB 3.68Å; H220-A246 HydrophobicContact CB-CB 4.47Å; Y242-A246 WeakPolarHBondContact O-CB 3.49Å; Y242-A246 PolarHBondContact O-N 3.04Å; K243-A246 PolarHBondContact O-N 3.03Å; V244-A246 VanDerWaalsContact C-N 3.3Å; V244-A246 PolarHBondContact O-N 3.33Å; A246-S250 PolarHBondContact O-N 3.03Å; A246-S250 VanDerWaalsContact O-N 3.1Å |
| 247 | H | 86.7 | Confident | 86.1 | Confident | 10 Ų | 10 | 38 Ų | 38 | 5% | 0.046 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.9 | -44.5 | 171.4 | -85.1 | -132.6 | 0 | 0 | 0 | 112 | Y92 H220 K243 V244 T245 L249 S250 Y251 | Y92-H247 WeakPolarHBondContact OH-CB 3.37Å; Y92-H247 PolarHBondContact OH-CE1 3.45Å; Y92-H247 PolarHBondContact OH-ND1 3.32Å; H220-H247 AromaticContact CE1-CD2 3.49Å; H220-H247 PolarHBondContact CE1-CD2 3.33Å; H220-H247 VanDerWaalsContact CE1-CD2 3.49Å; H220-H247 AromaticContact CE1-CE1 3.58Å; H220-H247 AromaticContact CE1-NE2 3.03Å; H220-H247 PolarHBondContact CE1-NE2 2.96Å; H220-H247 AromaticContact ND1-CD2 3.04Å; H220-H247 PolarHBondContact ND1-CD2 3.45Å; H220-H247 AromaticContact ND1-CE1 3.95Å; H220-H247 AromaticContact ND1-CG 3.92Å; H220-H247 AromaticContact ND1-NE2 3.09Å; H220-H247 PolarHBondContact ND1-NE2 3.48Å; K243-H247 PolarHBondContact O-CD2 2.91Å; K243-H247 PolarHBondContact O-N 3.45Å; V244-H247 WeakPolarHBondContact O-CB 3.35Å; V244-H247 PolarHBondContact O-N 3.03Å; V244-H247 VanDerWaalsContact O-N 3.11Å; T245-H247 PolarHBondContact O-N 3.46Å; H247-L249 VanDerWaalsContact C-N 3.25Å; H247-L249 PolarHBondContact O-N 2.86Å; H247-S250 PolarHBondContact O-N 3.49Å; H247-S250 VanDerWaalsContact O-N 3.11Å; H247-S250 PolarHBondContact O-OG 3.41Å; H247-Y251 HydrophobicContact CB-CE2 4.43Å; H247-Y251 VanDerWaalsContact O-CD1 3.28Å; H247-Y251 WeakPolarHBondContact O-CD1 3.33Å; H247-Y251 PolarHBondContact O-N 3.13Å |
| 248 | M | 88.9 | Confident | 86.5 | Confident | 13 Ų | 13 | 34 Ų | 34 | 6% | 0.064 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -60 | -39.8 | 177.2 | -62.5 | -51.1 | 146.1 | 0 | 0 | 111.5 | L33 L37 I40 Y92 V244 T245 Y251 L252 | L33-M248 HydrophobicContact CD2-CG 4.39Å; L37-M248 HydrophobicContact CD1-CE 3.94Å; L37-M248 HydrophobicContact CD1-SD 4.43Å; L37-M248 HydrophobicContact CD2-CE 3.73Å; L37-M248 HydrophobicContact CD2-SD 3.42Å; L37-M248 WeakPolarHBondContact CD2-SD 3.07Å; L37-M248 HydrophobicContact CG-CE 3.87Å; L37-M248 HydrophobicContact CG-SD 3.7Å; I40-M248 HydrophobicContact CD1-SD 4.5Å; Y92-M248 HydrophobicContact CD2-CE 3.48Å; Y92-M248 VanDerWaalsContact CD2-CE 3.48Å; Y92-M248 HydrophobicContact CE2-CE 3.35Å; Y92-M248 HydrophobicContact CG-CE 4.5Å; V244-M248 HydrophobicContact CG1-CE 3.76Å; V244-M248 HydrophobicContact CG1-CG 4.4Å; V244-M248 WeakPolarHBondContact O-CG 3.48Å; V244-M248 PolarHBondContact O-N 3.09Å; T245-M248 PolarHBondContact O-N 2.74Å; M248-Y251 HydrophobicContact CE-CE2 4.39Å; M248-Y251 PolarHBondContact O-N 3.32Å; M248-Y251 HydrophobicContact SD-CD2 3.98Å; M248-Y251 HydrophobicContact SD-CE2 4.22Å; M248-L252 PolarHBondContact O-N 3.32Å; M248-L252 VanDerWaalsContact O-N 3.15Å |
| 249 | L | 90.5 | Very high | 86.7 | Confident | 51 Ų | 51 | 32.1 Ų | 32.1 | 27% | 0.267 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -61.8 | -47.6 | 174.3 | -166.3 | 70.2 | 0 | 0 | 0 | 110.6 | F216 P219 T245 H247 Y251 L252 | F216-L249 HydrophobicContact CB-CG 4.19Å; F216-L249 HydrophobicContact CD1-CD1 3.45Å; F216-L249 VanDerWaalsContact CD1-CD1 3.45Å; F216-L249 HydrophobicContact CD1-CG 3.66Å; F216-L249 WeakPolarHBondContact CD1-O 3.22Å; F216-L249 HydrophobicContact CE1-CD1 3.68Å; F216-L249 HydrophobicContact CE1-CG 4.38Å; F216-L249 HydrophobicContact CG-CD1 4.28Å; F216-L249 HydrophobicContact CG-CG 4.15Å; F216-L249 CarbonylContact O-C 3.28Å; P219-L249 HydrophobicContact CG-CD2 3.74Å; T245-L249 PolarHBondContact O-N 3.19Å; H247-L249 VanDerWaalsContact C-N 3.25Å; H247-L249 PolarHBondContact O-N 2.86Å; L249-Y251 PolarHBondContact O-N 3.06Å; L249-Y251 VanDerWaalsContact O-N 3.14Å; L249-L252 HydrophobicContact CD1-CD1 4.31Å; L249-L252 WeakPolarHBondContact O-CB 3.28Å; L249-L252 PolarHBondContact O-N 2.9Å; L249-L252 VanDerWaalsContact O-N 3.09Å |
| 250 | S | 87.3 | Confident | 86.5 | Confident | 2 Ų | 2 | 31.9 Ų | 31.9 | 1% | 0.014 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -59.6 | -31.7 | 178.1 | 78.4 | 0 | 0 | 0 | 0 | 112.7 | F216 A246 H247 N253 | F216-S250 WeakPolarHBondContact O-CA 3.44Å; F216-S250 PolarHBondContact O-N 2.95Å; A246-S250 PolarHBondContact O-N 3.03Å; A246-S250 VanDerWaalsContact O-N 3.1Å; H247-S250 PolarHBondContact O-N 3.49Å; H247-S250 VanDerWaalsContact O-N 3.11Å; H247-S250 PolarHBondContact O-OG 3.41Å; S250-N253 VanDerWaalsContact O-CB 3.23Å; S250-N253 WeakPolarHBondContact O-CB 3.24Å; S250-N253 PolarHBondContact O-N 3.45Å |
| 251 | Y | 91 | Very high | 86.3 | Confident | 3 Ų | 3 | 29.9 Ų | 29.9 | 1% | 0.012 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -70.9 | -33.1 | 177.1 | -58 | -16.2 | 0 | 0 | 0 | 114 | L37 F80 V85 Q88 H247 M248 L249 N253 S254 | L37-Y251 HydrophobicContact CD2-CD2 3.95Å; L37-Y251 HydrophobicContact CD2-CE2 3.97Å; F80-Y251 AromaticContact CE1-CD1 3.44Å; F80-Y251 HydrophobicContact CE1-CD1 3.44Å; F80-Y251 VanDerWaalsContact CE1-CD1 3.44Å; F80-Y251 HydrophobicContact CE1-CE1 4.02Å; F80-Y251 HydrophobicContact CE1-CG 4.24Å; F80-Y251 AromaticContact CZ-CD1 3.36Å; F80-Y251 HydrophobicContact CZ-CD1 3.36Å; F80-Y251 AromaticContact CZ-CE1 3.54Å; F80-Y251 HydrophobicContact CZ-CE1 3.54Å; V85-Y251 HydrophobicContact CG1-CD2 4.02Å; V85-Y251 HydrophobicContact CG1-CE2 4.3Å; V85-Y251 HydrophobicContact CG2-CD1 4.18Å; V85-Y251 HydrophobicContact CG2-CD2 4.15Å; V85-Y251 HydrophobicContact CG2-CE1 4.5Å; V85-Y251 HydrophobicContact CG2-CE2 4.49Å; V85-Y251 HydrophobicContact CG2-CG 3.98Å; Q88-Y251 WeakPolarHBondContact CB-OH 3.42Å; Q88-Y251 WeakPolarHBondContact CG-OH 3.2Å; H247-Y251 HydrophobicContact CB-CE2 4.43Å; H247-Y251 VanDerWaalsContact O-CD1 3.28Å; H247-Y251 WeakPolarHBondContact O-CD1 3.33Å; H247-Y251 PolarHBondContact O-N 3.13Å; M248-Y251 HydrophobicContact CE-CE2 4.39Å; M248-Y251 PolarHBondContact O-N 3.32Å; M248-Y251 HydrophobicContact SD-CD2 3.98Å; M248-Y251 HydrophobicContact SD-CE2 4.22Å; L249-Y251 PolarHBondContact O-N 3.06Å; L249-Y251 VanDerWaalsContact O-N 3.14Å; Y251-N253 PolarHBondContact O-N 3.45Å; Y251-S254 PolarHBondContact O-N 3.21Å |
| 252 | L | 90.1 | Very high | 85.9 | Confident | 65 Ų | 65 | 30.1 Ų | 30.1 | 34% | 0.34 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -61.5 | -24.6 | 176 | -74.1 | 169.3 | 0 | 0 | 0 | 112.4 | I40 F216 M248 L249 S254 C255 I256 | I40-L252 HydrophobicContact CD1-CD2 4.26Å; I40-L252 HydrophobicContact CD1-CG 4.31Å; I40-L252 HydrophobicContact CG1-CD2 3.95Å; F216-L252 HydrophobicContact CD1-CB 3.8Å; F216-L252 HydrophobicContact CE1-CB 3.68Å; F216-L252 HydrophobicContact CE1-CD1 4.29Å; M248-L252 PolarHBondContact O-N 3.32Å; M248-L252 VanDerWaalsContact O-N 3.15Å; L249-L252 HydrophobicContact CD1-CD1 4.31Å; L249-L252 WeakPolarHBondContact O-CB 3.28Å; L249-L252 PolarHBondContact O-N 2.9Å; L249-L252 VanDerWaalsContact O-N 3.09Å; L252-S254 VanDerWaalsContact C-N 3.26Å; L252-S254 PolarHBondContact O-N 3.1Å; L252-C255 WeakPolarHBondContact O-CB 3.44Å; L252-C255 PolarHBondContact O-N 3.5Å; L252-I256 WeakPolarHBondContact O-CG1 3.41Å; L252-I256 PolarHBondContact O-N 3.45Å; L252-I256 VanDerWaalsContact O-N 3.17Å |
| 253 | N | 88.1 | Confident | 85 | Confident | 7 Ų | 7 | 33 Ų | 33 | 4% | 0.037 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -55.4 | -41 | 175.5 | -175.1 | 71 | 0 | 0 | 0 | 112.3 | L213 F216 S250 Y251 C255 N257 | L213-N253 WeakPolarHBondContact CA-OD1 3.32Å; L213-N253 WeakPolarHBondContact CD1-ND2 3.13Å; L213-N253 PolarHBondContact N-OD1 2.86Å; F216-N253 HydrophobicContact CB-CB 4.12Å; S250-N253 VanDerWaalsContact O-CB 3.23Å; S250-N253 WeakPolarHBondContact O-CB 3.24Å; S250-N253 PolarHBondContact O-N 3.45Å; Y251-N253 PolarHBondContact O-N 3.45Å; N253-C255 VanDerWaalsContact C-N 3.3Å; N253-C255 PolarHBondContact O-N 3.11Å; N253-N257 PolarHBondContact O-ND2 3.24Å; N253-N257 PolarHBondContact O-OD1 3.32Å |
| 254 | S | 89.4 | Confident | 83.9 | Confident | 5 Ų | 5 | 31.8 Ų | 31.8 | 4% | 0.035 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -73.6 | -20.8 | 179.1 | -66.8 | 0 | 0 | 0 | 0 | 113.6 | N48 D77 Y251 L252 | N48-S254 PolarHBondContact ND2-O 2.92Å; D77-S254 WeakPolarHBondContact OD1-CA 3.38Å; D77-S254 WeakPolarHBondContact OD1-CB 3.49Å; D77-S254 PolarHBondContact OD1-OG 3.12Å; Y251-S254 PolarHBondContact O-N 3.21Å; L252-S254 VanDerWaalsContact C-N 3.26Å; L252-S254 PolarHBondContact O-N 3.1Å |
| 255 | C | 89.2 | Confident | 82.8 | Confident | 7 Ų | 7 | 33.3 Ų | 33.3 | 5% | 0.047 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -81.4 | -33.1 | 177.1 | -63.2 | 0 | 0 | 0 | 0 | 112.7 | I40 V43 L252 N253 F259 | I40-C255 PolarHBondContact O-SG 2.7Å; V43-C255 HydrophobicContact CG1-CB 4.09Å; L252-C255 WeakPolarHBondContact O-CB 3.44Å; L252-C255 PolarHBondContact O-N 3.5Å; N253-C255 VanDerWaalsContact C-N 3.3Å; N253-C255 PolarHBondContact O-N 3.11Å; C255-F259 VanDerWaalsContact O-CD2 3.25Å; C255-F259 WeakPolarHBondContact O-CD2 3.26Å; C255-F259 WeakPolarHBondContact O-CE2 3.25Å |
| 256 | I | 86.7 | Confident | 81.2 | Confident | 45 Ų | 45 | 34.6 Ų | 34.6 | 23% | 0.231 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -82.2 | -25.7 | -171 | -64.4 | 170 | 0 | 0 | 0 | 111.9 | M212 F216 L252 F259 I260 | M212-I256 HydrophobicContact SD-CG2 3.72Å; F216-I256 HydrophobicContact CE1-CD1 3.65Å; F216-I256 HydrophobicContact CE2-CD1 4.11Å; F216-I256 HydrophobicContact CZ-CD1 3.33Å; L252-I256 WeakPolarHBondContact O-CG1 3.41Å; L252-I256 PolarHBondContact O-N 3.45Å; L252-I256 VanDerWaalsContact O-N 3.17Å; I256-F259 WeakPolarHBondContact O-CB 3.46Å; I256-F259 PolarHBondContact O-N 2.95Å; I256-I260 HydrophobicContact CG2-CD1 3.76Å; I256-I260 HydrophobicContact CG2-CG1 3.69Å; I256-I260 WeakPolarHBondContact O-CG1 3.27Å; I256-I260 PolarHBondContact O-N 2.93Å; I256-I260 VanDerWaalsContact O-N 3.08Å |
| 257 | N | 83.9 | Confident | 79.7 | Confident | 7 Ų | 7 | 39.7 Ų | 39.7 | 4% | 0.037 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -52.5 | -46.8 | -176.4 | -72.6 | -18 | 0 | 0 | 0 | 114.7 | D77 L209 N253 F259 I260 C261 | D77-N257 PolarHBondContact OD1-ND2 3.04Å; D77-N257 PolarHBondContact OD2-ND2 2.89Å; L209-N257 HydrophobicContact CD2-CB 4.46Å; L209-N257 WeakPolarHBondContact CD2-OD1 3.21Å; N253-N257 PolarHBondContact O-ND2 3.24Å; N253-N257 PolarHBondContact O-OD1 3.32Å; N257-F259 VanDerWaalsContact C-N 3.34Å; N257-F259 PolarHBondContact O-N 3.25Å; N257-I260 PolarHBondContact O-N 3.38Å; N257-C261 WeakPolarHBondContact O-CB 3.44Å; N257-C261 PolarHBondContact O-N 3.32Å; N257-C261 PolarHBondContact O-SG 2.73Å |
| 258 | P | 84.6 | Confident | 78.1 | Confident | 6 Ų | 6 | 39.7 Ų | 39.7 | 4% | 0.039 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -56.4 | -43.1 | 173.5 | -28.2 | 36.1 | 0 | 0 | 0 | 114.1 | G47 L51 C261 F262 | G47-P258 WeakPolarHBondContact O-CB 3.21Å; G47-P258 WeakPolarHBondContact O-CG 3.3Å; L51-P258 HydrophobicContact CB-CB 4.36Å; L51-P258 HydrophobicContact CD2-CB 4.4Å; L51-P258 HydrophobicContact CD2-CG 4.49Å; P258-C261 PolarHBondContact O-N 3.01Å; P258-F262 VanDerWaalsContact O-CB 3.3Å; P258-F262 WeakPolarHBondContact O-CB 3.44Å; P258-F262 PolarHBondContact O-N 3.04Å |
| 259 | F | 83 | Confident | 76.4 | Confident | 104 Ų | 104 | 41.8 Ų | 41.8 | 46% | 0.456 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -66 | -47 | -179.4 | -62.8 | -83.5 | 0 | 0 | 0 | 111.1 | V43 C255 I256 N257 C261 F262 F263 | V43-F259 HydrophobicContact CG1-CE2 3.94Å; V43-F259 HydrophobicContact CG1-CZ 4.28Å; C255-F259 VanDerWaalsContact O-CD2 3.25Å; C255-F259 WeakPolarHBondContact O-CD2 3.26Å; C255-F259 WeakPolarHBondContact O-CE2 3.25Å; I256-F259 WeakPolarHBondContact O-CB 3.46Å; I256-F259 PolarHBondContact O-N 2.95Å; N257-F259 VanDerWaalsContact C-N 3.34Å; N257-F259 PolarHBondContact O-N 3.25Å; F259-C261 VanDerWaalsContact C-N 3.32Å; F259-C261 PolarHBondContact O-N 3.46Å; F259-F262 PolarHBondContact O-N 3.38Å; F259-F263 HydrophobicContact CB-CD2 4.41Å; F259-F263 WeakPolarHBondContact O-CD2 3.33Å; F259-F263 PolarHBondContact O-N 3.22Å |
| 260 | I | 80.2 | Confident | 74.4 | Confident | 17 Ų | 17 | 43.9 Ų | 43.9 | 9% | 0.087 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.2 | -45.2 | 178.1 | -50.2 | 162.4 | 0 | 0 | 0 | 109.9 | L205 C208 L209 M212 I256 N257 F262 F263 M264 | L205-I260 HydrophobicContact CD1-CB 4.18Å; L205-I260 HydrophobicContact CD1-CG2 3.33Å; C208-I260 HydrophobicContact CB-CG2 4.24Å; L209-I260 HydrophobicContact CD2-CB 4.37Å; L209-I260 HydrophobicContact CD2-CD1 3.56Å; L209-I260 HydrophobicContact CG-CD1 4.35Å; M212-I260 HydrophobicContact CE-CD1 4.12Å; M212-I260 HydrophobicContact CE-CG1 4.31Å; M212-I260 HydrophobicContact SD-CD1 3.35Å; M212-I260 WeakPolarHBondContact SD-CD1 3.42Å; M212-I260 HydrophobicContact SD-CG1 4.08Å; I256-I260 HydrophobicContact CG2-CD1 3.76Å; I256-I260 HydrophobicContact CG2-CG1 3.69Å; I256-I260 WeakPolarHBondContact O-CG1 3.27Å; I256-I260 PolarHBondContact O-N 2.93Å; I256-I260 VanDerWaalsContact O-N 3.08Å; N257-I260 PolarHBondContact O-N 3.38Å; I260-F262 PolarHBondContact O-N 3.46Å; I260-F263 PolarHBondContact O-N 3.13Å; I260-M264 WeakPolarHBondContact O-CB 3.29Å; I260-M264 PolarHBondContact O-N 3.35Å |
| 261 | C | 76.8 | Confident | 72.8 | Confident | 2 Ų | 2 | 46.2 Ų | 46.2 | 1% | 0.014 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.6 | -45.9 | 179.2 | -70 | 0 | 0 | 0 | 0 | 111.2 | L51 V70 N257 P258 F259 S265 L268 | L51-C261 HydrophobicContact CD1-CB 4.31Å; L51-C261 HydrophobicContact CD2-CB 4.03Å; V70-C261 HydrophobicContact CG1-CB 4.39Å; N257-C261 WeakPolarHBondContact O-CB 3.44Å; N257-C261 PolarHBondContact O-N 3.32Å; N257-C261 PolarHBondContact O-SG 2.73Å; P258-C261 PolarHBondContact O-N 3.01Å; F259-C261 VanDerWaalsContact C-N 3.32Å; F259-C261 PolarHBondContact O-N 3.46Å; C261-S265 PolarHBondContact O-N 3.39Å; C261-L268 WeakPolarHBondContact O-CD1 3.47Å |
| 262 | F | 73.6 | Confident | 70.8 | Confident | 60 Ų | 60 | 47.8 Ų | 47.8 | 26% | 0.263 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.8 | -49.2 | 177.8 | -177.5 | -99.4 | 0 | 0 | 0 | 112.5 | P258 F259 I260 Q269 | P258-F262 VanDerWaalsContact O-CB 3.3Å; P258-F262 WeakPolarHBondContact O-CB 3.44Å; P258-F262 PolarHBondContact O-N 3.04Å; F259-F262 PolarHBondContact O-N 3.38Å; I260-F262 PolarHBondContact O-N 3.46Å; F262-Q269 HydrophobicContact CE1-CG 4.43Å; F262-Q269 WeakPolarHBondContact O-CG 3.36Å |
| 263 | F | 68.9 | Low | 69 | Low | 136 Ų | 136 | 50.9 Ų | 50.9 | 60% | 0.596 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -72.5 | -29.4 | -176.7 | -78.2 | -68.8 | 0 | 0 | 0 | 113.8 | F259 I260 Q269 | F259-F263 HydrophobicContact CB-CD2 4.41Å; F259-F263 WeakPolarHBondContact O-CD2 3.33Å; F259-F263 PolarHBondContact O-N 3.22Å; I260-F263 PolarHBondContact O-N 3.13Å; F263-Q269 PolarHBondContact O-NE2 2.88Å; F263-Q269 VanDerWaalsContact O-NE2 3.11Å |
| 264 | M | 61.5 | Low | 67 | Low | 40 Ų | 40 | 53.2 Ų | 53.2 | 20% | 0.197 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -85.7 | -24.6 | -174.7 | -158.8 | 59.2 | 69.9 | 0 | 0 | 113.8 | R201 F204 L205 I260 | R201-M264 VanDerWaalsContact O-CG 3.26Å; R201-M264 WeakPolarHBondContact O-CG 2.82Å; F204-M264 HydrophobicContact CD1-CE 3.33Å; F204-M264 HydrophobicContact CD1-SD 3.68Å; F204-M264 HydrophobicContact CE1-CE 3.57Å; F204-M264 HydrophobicContact CE1-SD 4.34Å; L205-M264 HydrophobicContact CB-CB 4.22Å; L205-M264 HydrophobicContact CB-CG 3.6Å; L205-M264 HydrophobicContact CD1-CB 3.79Å; L205-M264 HydrophobicContact CD1-CG 4.08Å; L205-M264 HydrophobicContact CD2-CB 4.41Å; L205-M264 HydrophobicContact CG-CB 4.35Å; L205-M264 HydrophobicContact CG-CG 4.26Å; I260-M264 WeakPolarHBondContact O-CB 3.29Å; I260-M264 PolarHBondContact O-N 3.35Å |
| 265 | S | 61.4 | Low | 65 | Low | 33 Ų | 33 | 56.4 Ų | 56.4 | 23% | 0.231 | 32% | 0.321 | C | S | . | . | trans | -97.4 | 102.2 | 178 | -172.5 | 0 | 0 | 0 | 0 | 110.3 | C261 N267 L268 Q269 | C261-S265 PolarHBondContact O-N 3.39Å; S265-N267 PolarHBondContact O-N 3.09Å; S265-N267 VanDerWaalsContact O-N 3.08Å; S265-L268 WeakPolarHBondContact O-CA 3.2Å; S265-L268 PolarHBondContact O-N 3Å; S265-L268 WeakPolarHBondContact OG-CG 3.48Å; S265-L268 PolarHBondContact OG-N 3.11Å; S265-Q269 PolarHBondContact O-N 2.73Å; S265-Q269 VanDerWaalsContact O-N 3.11Å | ||
| 266 | K | 55.4 | Low | 63 | Low | 111 Ų | 111 | 67.6 Ų | 67.6 | 48% | 0.483 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -51.5 | -33.6 | 171.2 | -70.7 | -156.3 | 173.7 | -168.7 | 0 | 112.3 | R201 L268 Q269 T270 | R201-K266 VanDerWaalsContact NH1-CD 3.3Å; R201-K266 VanDerWaalsContact NH1-CE 3.29Å; K266-L268 VanDerWaalsContact C-N 3.34Å; K266-L268 PolarHBondContact O-N 3.31Å; K266-Q269 PolarHBondContact O-N 3.04Å; K266-T270 PolarHBondContact O-N 3.18Å; K266-T270 PolarHBondContact O-OG1 2.99Å |
| 267 | N | 55.8 | Low | 60.5 | Low | 110 Ų | 110 | 69.8 Ų | 69.8 | 59% | 0.588 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -65.9 | -36.5 | 176.6 | -63.1 | -9 | 0 | 0 | 0 | 111.9 | F61 S265 V271 | F61-N267 HydrophobicContact CE1-CB 3.85Å; F61-N267 HydrophobicContact CZ-CB 4.25Å; F61-N267 WeakPolarHBondContact CZ-O 3.35Å; S265-N267 PolarHBondContact O-N 3.09Å; S265-N267 VanDerWaalsContact O-N 3.08Å; N267-V271 WeakPolarHBondContact O-CG2 3.22Å; N267-V271 PolarHBondContact O-N 3.24Å |
| 268 | L | 53.3 | Low | 58.2 | Low | 10 Ų | 10 | 78.6 Ų | 78.6 | 5% | 0.052 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -71.7 | -36.9 | 176.5 | -64.3 | 173.4 | 0 | 0 | 0 | 111.1 | M54 L55 F61 C261 S265 K266 V271 G272 | M54-L268 HydrophobicContact CE-CB 4.09Å; M54-L268 HydrophobicContact CE-CD1 3.93Å; M54-L268 HydrophobicContact CE-CD2 3.33Å; M54-L268 HydrophobicContact CE-CG 3.96Å; M54-L268 HydrophobicContact CG-CD2 4.22Å; M54-L268 HydrophobicContact SD-CB 4.11Å; M54-L268 HydrophobicContact SD-CD2 3.57Å; M54-L268 VanDerWaalsContact SD-CD2 3.57Å; M54-L268 HydrophobicContact SD-CG 4.34Å; L55-L268 HydrophobicContact CD2-CD2 4.21Å; F61-L268 HydrophobicContact CD1-CD2 3.96Å; F61-L268 HydrophobicContact CD2-CD2 3.72Å; F61-L268 HydrophobicContact CE1-CD2 3.5Å; F61-L268 VanDerWaalsContact CE1-CD2 3.5Å; F61-L268 HydrophobicContact CE1-CG 4.15Å; F61-L268 HydrophobicContact CE2-CD2 3.28Å; F61-L268 HydrophobicContact CE2-CG 4.48Å; F61-L268 HydrophobicContact CG-CD2 4.11Å; F61-L268 HydrophobicContact CZ-CB 4.48Å; F61-L268 HydrophobicContact CZ-CD2 3.17Å; F61-L268 HydrophobicContact CZ-CG 3.98Å; C261-L268 WeakPolarHBondContact O-CD1 3.47Å; S265-L268 WeakPolarHBondContact O-CA 3.2Å; S265-L268 PolarHBondContact O-N 3Å; S265-L268 WeakPolarHBondContact OG-CG 3.48Å; S265-L268 PolarHBondContact OG-N 3.11Å; K266-L268 VanDerWaalsContact C-N 3.34Å; K266-L268 PolarHBondContact O-N 3.31Å; L268-V271 PolarHBondContact O-N 2.89Å; L268-G272 PolarHBondContact O-N 3.14Å |
| 269 | Q | 54.1 | Low | 55.6 | Low | 57 Ų | 57 | 82.4 Ų | 82.4 | 27% | 0.266 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.6 | -46.2 | 174 | -66.5 | 177.6 | -16.5 | 0 | 0 | 111.9 | F262 F263 S265 K266 V271 G272 L273 | F262-Q269 HydrophobicContact CE1-CG 4.43Å; F262-Q269 WeakPolarHBondContact O-CG 3.36Å; F263-Q269 PolarHBondContact O-NE2 2.88Å; F263-Q269 VanDerWaalsContact O-NE2 3.11Å; S265-Q269 PolarHBondContact O-N 2.73Å; S265-Q269 VanDerWaalsContact O-N 3.11Å; K266-Q269 PolarHBondContact O-N 3.04Å; Q269-V271 VanDerWaalsContact C-N 3.34Å; Q269-V271 PolarHBondContact O-N 3.07Å; Q269-G272 PolarHBondContact O-N 3.33Å; Q269-L273 WeakPolarHBondContact O-CB 3.34Å; Q269-L273 VanDerWaalsContact O-CG 3.27Å; Q269-L273 WeakPolarHBondContact O-CG 3.32Å; Q269-L273 PolarHBondContact O-N 3.36Å |
| 270 | T | 48.2 | Very low | 53.1 | Low | 94 Ų | 94 | 80.9 Ų | 80.9 | 58% | 0.577 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -62.6 | -40.8 | 179.8 | -52.6 | 0 | 0 | 0 | 0 | 111.7 | K266 A274 | K266-T270 PolarHBondContact O-N 3.18Å; K266-T270 PolarHBondContact O-OG1 2.99Å; T270-A274 WeakPolarHBondContact O-CB 3.14Å; T270-A274 PolarHBondContact O-N 3.39Å |
| 271 | V | 53 | Low | 50.9 | Low | 52 Ų | 52 | 86 Ų | 86 | 32% | 0.315 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -74.8 | -40.3 | 178.8 | 176 | 0 | 0 | 0 | 0 | 112 | T58 F61 N267 L268 Q269 L273 A274 G275 | T58-V271 HydrophobicContact CG2-CG1 4.17Å; T58-V271 HydrophobicContact CG2-CG2 4.29Å; F61-V271 HydrophobicContact CE2-CB 4.06Å; F61-V271 HydrophobicContact CE2-CG1 4.15Å; F61-V271 HydrophobicContact CE2-CG2 4Å; F61-V271 HydrophobicContact CZ-CB 4.22Å; F61-V271 HydrophobicContact CZ-CG2 3.88Å; N267-V271 WeakPolarHBondContact O-CG2 3.22Å; N267-V271 PolarHBondContact O-N 3.24Å; L268-V271 PolarHBondContact O-N 2.89Å; Q269-V271 VanDerWaalsContact C-N 3.34Å; Q269-V271 PolarHBondContact O-N 3.07Å; V271-L273 VanDerWaalsContact C-N 3.31Å; V271-L273 PolarHBondContact O-N 3.24Å; V271-A274 PolarHBondContact O-N 2.76Å; V271-G275 PolarHBondContact O-N 3.36Å |
| 272 | G | 49.6 | Very low | 48.9 | Very low | 36 Ų | 36 | 92 Ų | 92 | 37% | 0.371 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.8 | -35.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | L268 Q269 | L268-G272 PolarHBondContact O-N 3.14Å; Q269-G272 PolarHBondContact O-N 3.33Å |
| 273 | L | 52.6 | Low | 47.3 | Very low | 129 Ų | 129 | 94.7 Ų | 94.7 | 68% | 0.675 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -82.2 | -38 | 176 | -65.1 | 171 | 0 | 0 | 0 | 112.4 | Q269 V271 G275 R276 | Q269-L273 WeakPolarHBondContact O-CB 3.34Å; Q269-L273 VanDerWaalsContact O-CG 3.27Å; Q269-L273 WeakPolarHBondContact O-CG 3.32Å; Q269-L273 PolarHBondContact O-N 3.36Å; V271-L273 VanDerWaalsContact C-N 3.31Å; V271-L273 PolarHBondContact O-N 3.24Å; L273-G275 VanDerWaalsContact C-N 3.29Å; L273-G275 PolarHBondContact O-N 2.98Å; L273-R276 PolarHBondContact O-N 3.35Å |
| 274 | A | 46.6 | Very low | 46.2 | Very low | 57 Ų | 57 | 91.4 Ų | 91.4 | 47% | 0.471 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -71.4 | -21.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | T270 V271 R276 S277 | T270-A274 WeakPolarHBondContact O-CB 3.14Å; T270-A274 PolarHBondContact O-N 3.39Å; V271-A274 PolarHBondContact O-N 2.76Å; A274-R276 PolarHBondContact O-N 3.22Å; A274-R276 VanDerWaalsContact O-N 3.07Å; A274-S277 PolarHBondContact O-N 3.29Å; A274-S277 VanDerWaalsContact O-O 3.12Å |
| 275 | G | 47.2 | Very low | 45 | Very low | 72 Ų | 72 | 94.5 Ų | 94.5 | 74% | 0.742 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -9.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | V271 L273 | V271-G275 PolarHBondContact O-N 3.36Å; L273-G275 VanDerWaalsContact C-N 3.29Å; L273-G275 PolarHBondContact O-N 2.98Å |
| 276 | R | 45.6 | Very low | 44 | Very low | 241 Ų | 241 | 96 Ų | 96 | 91% | 0.909 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -4.5 | 169.9 | -90.5 | 180 | 167 | 172.6 | -3.8 | 114.4 | L273 A274 | L273-R276 PolarHBondContact O-N 3.35Å; A274-R276 PolarHBondContact O-N 3.22Å; A274-R276 VanDerWaalsContact O-N 3.07Å |
| 277 | S | 35.2 | Very low | 43 | Very low | 92 Ų | 92 | 95.1 Ų | 95.1 | 64% | 0.643 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -119.9 | 112.5 | 179.8 | -168.2 | 0 | 0 | 0 | 0 | 110.7 | A274 | A274-S277 PolarHBondContact O-N 3.29Å; A274-S277 VanDerWaalsContact O-O 3.12Å |
| 278 | H | 35.1 | Very low | 42.2 | Very low | 191 Ų | 191 | 94.2 Ų | 94.2 | 88% | 0.884 | 60% | 0.602 | S | S | * | * | trans | -50.8 | 142 | 168.8 | -85.3 | -43 | 0 | 0 | 0 | 112.6 | ||||
| 279 | G | 30.2 | Very low | 41.6 | Very low | 86 Ų | 86 | 100 Ų | 100 | 89% | 0.887 | 63% | 0.629 | S | S | * | * | trans | 67.9 | 88.9 | 146.3 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 280 | G | 31.2 | Very low | 41 | Very low | 72 Ų | 72 | 101.9 Ų | 101.9 | 74% | 0.742 | 64% | 0.644 | S | S | * | * | trans | -158.5 | 111.9 | 166.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | C282 | G280-C282 PolarHBondContact O-N 2.96Š| ||
| 281 | S | 33.3 | Very low | 40.6 | Very low | 124 Ų | 124 | 106.6 Ų | 106.6 | 87% | 0.867 | 65% | 0.652 | S | S | * | * | trans | -57.9 | 121.9 | 177.7 | -177.5 | 0 | 0 | 0 | 0 | 111.8 | N283 | S281-N283 PolarHBondContact O-N 3.49Š| ||
| 282 | C | 36 | Very low | 40.1 | Very low | 128 Ų | 128 | 110.8 Ų | 110.8 | 87% | 0.865 | 67% | 0.668 | S | S | * | * | trans | -83.5 | 114.4 | 170.3 | -101.5 | 0 | 0 | 0 | 0 | 109.6 | G280 A284 | G280-C282 PolarHBondContact O-N 2.96Å; C282-A284 PolarHBondContact O-N 2.85Å | ||
| 283 | N | 39.4 | Very low | 39.9 | Very low | 117 Ų | 117 | 114 Ų | 114 | 63% | 0.626 | 68% | 0.677 | S | S | * | * | trans | -60.4 | 111.9 | -176.1 | -142.4 | -2.7 | 0 | 0 | 0 | 112 | S281 D285 A286 | S281-N283 PolarHBondContact O-N 3.49Å; N283-D285 PolarHBondContact O-N 3.49Å; N283-A286 PolarHBondContact O-N 2.9Å | ||
| 284 | A | 45.1 | Very low | 39.5 | Very low | 67 Ų | 67 | 112 Ų | 112 | 55% | 0.554 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -62.3 | -24.5 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | C282 C287 N288 | C282-A284 PolarHBondContact O-N 2.85Å; A284-C287 WeakPolarHBondContact O-CB 3.25Å; A284-C287 PolarHBondContact O-N 2.84Å; A284-N288 PolarHBondContact O-N 3.22Å |
| 285 | D | 37 | Very low | 39.3 | Very low | 106 Ų | 106 | 112.6 Ų | 112.6 | 57% | 0.567 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -70 | -35 | -176.8 | -63.4 | -33.1 | 0 | 0 | 0 | 113.1 | N283 C287 N288 Q289 | N283-D285 PolarHBondContact O-N 3.49Å; D285-C287 PolarHBondContact O-N 3.41Å; D285-N288 PolarHBondContact O-N 3.12Å; D285-Q289 PolarHBondContact O-N 3.32Å; D285-Q289 VanDerWaalsContact O-N 3.08Å |
| 286 | A | 39.4 | Very low | 39.3 | Very low | 63 Ų | 63 | 112.1 Ų | 112.1 | 52% | 0.521 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -63.9 | -31.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | N283 V290 | N283-A286 PolarHBondContact O-N 2.9Å; A286-V290 WeakPolarHBondContact O-CG2 3.3Å; A286-V290 PolarHBondContact O-N 2.78Å |
| 287 | C | 34.3 | Very low | 39.2 | Very low | 94 Ų | 94 | 105.8 Ų | 105.8 | 64% | 0.635 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -74.3 | -37.8 | 178.1 | -159.1 | 0 | 0 | 0 | 0 | 111.8 | A284 D285 R291 | A284-C287 WeakPolarHBondContact O-CB 3.25Å; A284-C287 PolarHBondContact O-N 2.84Å; D285-C287 PolarHBondContact O-N 3.41Å; C287-R291 PolarHBondContact O-N 3.22Å |
| 288 | N | 40.5 | Very low | 40 | Very low | 90 Ų | 90 | 104.6 Ų | 104.6 | 48% | 0.481 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -68.8 | -38.2 | 177.2 | -81.3 | -24.2 | 0 | 0 | 0 | 112.5 | A284 D285 R291 Q292 | A284-N288 PolarHBondContact O-N 3.22Å; D285-N288 PolarHBondContact O-N 3.12Å; N288-R291 WeakPolarHBondContact O-CB 3.28Å; N288-R291 PolarHBondContact O-N 3.45Å; N288-Q292 PolarHBondContact O-N 2.96Å; N288-Q292 VanDerWaalsContact O-N 3.13Å |
| 289 | Q | 40.8 | Very low | 40.7 | Very low | 132 Ų | 132 | 103.3 Ų | 103.3 | 62% | 0.617 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -68.9 | -37 | -179.3 | -161.8 | 149.2 | 8.8 | 0 | 0 | 112.7 | D285 R291 Q292 N293 | D285-Q289 PolarHBondContact O-N 3.32Å; D285-Q289 VanDerWaalsContact O-N 3.08Å; Q289-R291 VanDerWaalsContact C-N 3.32Å; Q289-R291 PolarHBondContact O-N 3.06Å; Q289-Q292 PolarHBondContact O-N 3.12Å; Q289-N293 PolarHBondContact O-N 3.47Å |
| 290 | V | 40.9 | Very low | 41.7 | Very low | 96 Ų | 96 | 105.3 Ų | 105.3 | 58% | 0.582 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.7 | -37.9 | 171.6 | 174.8 | 0 | 0 | 0 | 0 | 111.2 | A286 Q292 N293 V294 | A286-V290 WeakPolarHBondContact O-CG2 3.3Å; A286-V290 PolarHBondContact O-N 2.78Å; V290-Q292 PolarHBondContact O-N 3.35Å; V290-N293 PolarHBondContact O-N 3.39Å; V290-V294 HydrophobicContact CG1-CG2 4.43Å; V290-V294 VanDerWaalsContact O-CG2 3.27Å; V290-V294 WeakPolarHBondContact O-CG2 3.39Å; V290-V294 PolarHBondContact O-N 3.35Å; V290-V294 VanDerWaalsContact O-N 3.11Å |
| 291 | R | 38.6 | Very low | 42.3 | Very low | 193 Ų | 193 | 104.6 Ų | 104.6 | 73% | 0.728 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.1 | -38.6 | 179.3 | -161.3 | 177.8 | -165.2 | 177.4 | 2.8 | 112.7 | C287 N288 Q289 S295 | C287-R291 PolarHBondContact O-N 3.22Å; N288-R291 WeakPolarHBondContact O-CB 3.28Å; N288-R291 PolarHBondContact O-N 3.45Å; Q289-R291 VanDerWaalsContact C-N 3.32Å; Q289-R291 PolarHBondContact O-N 3.06Å; R291-S295 PolarHBondContact O-N 3.31Å |
| 292 | Q | 44.1 | Very low | 42.9 | Very low | 140 Ų | 140 | 104.3 Ų | 104.3 | 65% | 0.654 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -72.3 | -40.3 | 177.2 | -71.1 | -171.2 | -10.5 | 0 | 0 | 112.6 | N288 Q289 V290 V294 S295 S296 | N288-Q292 PolarHBondContact O-N 2.96Å; N288-Q292 VanDerWaalsContact O-N 3.13Å; Q289-Q292 PolarHBondContact O-N 3.12Å; V290-Q292 PolarHBondContact O-N 3.35Å; Q292-V294 VanDerWaalsContact C-N 3.28Å; Q292-V294 PolarHBondContact O-N 2.95Å; Q292-S295 PolarHBondContact O-N 3.47Å; Q292-S295 PolarHBondContact O-OG 2.89Å; Q292-S296 PolarHBondContact O-N 3.4Å |
| 293 | N | 44.2 | Very low | 43.5 | Very low | 105 Ų | 105 | 105.3 Ų | 105.3 | 56% | 0.561 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.5 | -34.7 | 177 | -72.7 | -15.7 | 0 | 0 | 0 | 112 | Q289 V290 S296 L297 | Q289-N293 PolarHBondContact O-N 3.47Å; V290-N293 PolarHBondContact O-N 3.39Å; N293-S296 PolarHBondContact O-OG 3.24Å; N293-S296 VanDerWaalsContact O-OG 3.04Å; N293-L297 PolarHBondContact O-N 2.79Å |
| 294 | V | 45.3 | Very low | 43.8 | Very low | 86 Ų | 86 | 102.4 Ų | 102.4 | 52% | 0.521 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -69.2 | -35.2 | 175.6 | 173.1 | 0 | 0 | 0 | 0 | 112.3 | V290 Q292 H298 | V290-V294 HydrophobicContact CG1-CG2 4.43Å; V290-V294 VanDerWaalsContact O-CG2 3.27Å; V290-V294 WeakPolarHBondContact O-CG2 3.39Å; V290-V294 PolarHBondContact O-N 3.35Å; V290-V294 VanDerWaalsContact O-N 3.11Å; Q292-V294 VanDerWaalsContact C-N 3.28Å; Q292-V294 PolarHBondContact O-N 2.95Å; V294-H298 WeakPolarHBondContact O-CB 3.24Å; V294-H298 PolarHBondContact O-N 2.65Å; V294-H298 VanDerWaalsContact O-N 3.1Å |
| 295 | S | 41.7 | Very low | 43.9 | Very low | 70 Ų | 70 | 103.6 Ų | 103.6 | 49% | 0.49 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -71.5 | -36.6 | -179.4 | 74 | 0 | 0 | 0 | 0 | 112.8 | R291 Q292 H298 K299 | R291-S295 PolarHBondContact O-N 3.31Å; Q292-S295 PolarHBondContact O-N 3.47Å; Q292-S295 PolarHBondContact O-OG 2.89Å; S295-H298 WeakPolarHBondContact O-CB 3.46Å; S295-H298 PolarHBondContact O-N 3.01Å; S295-K299 PolarHBondContact O-N 2.91Å |
| 296 | S | 47.2 | Very low | 44.2 | Very low | 62 Ų | 62 | 104.7 Ų | 104.7 | 43% | 0.434 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.4 | -42.3 | 175.8 | 72.8 | 0 | 0 | 0 | 0 | 112.1 | Q292 N293 H298 K299 Q300 | Q292-S296 PolarHBondContact O-N 3.4Å; N293-S296 PolarHBondContact O-OG 3.24Å; N293-S296 VanDerWaalsContact O-OG 3.04Å; S296-H298 VanDerWaalsContact C-N 3.3Å; S296-H298 PolarHBondContact O-N 2.8Å; S296-K299 PolarHBondContact O-N 3.42Å; S296-Q300 PolarHBondContact O-N 3.45Å |
| 297 | L | 43.6 | Very low | 44.5 | Very low | 107 Ų | 107 | 106 Ų | 106 | 56% | 0.56 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -66.7 | -32.9 | 177.6 | -156.1 | 75.7 | 0 | 0 | 0 | 111.8 | N293 K299 Q300 T301 | N293-L297 PolarHBondContact O-N 2.79Å; L297-K299 VanDerWaalsContact C-N 3.34Å; L297-K299 PolarHBondContact O-N 3.12Å; L297-Q300 PolarHBondContact O-N 3.09Å; L297-T301 PolarHBondContact O-N 3.44Å; L297-T301 PolarHBondContact O-OG1 2.99Å |
| 298 | H | 51.1 | Low | 44.7 | Very low | 67 Ų | 67 | 108.7 Ų | 108.7 | 31% | 0.31 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.8 | -39.1 | 174.8 | -127.9 | -147.8 | 0 | 0 | 0 | 112.2 | L137 V294 S295 S296 F302 | L137-H298 HydrophobicContact CD2-CB 4.37Å; L137-H298 WeakPolarHBondContact CD2-CD2 3.44Å; L137-H298 WeakPolarHBondContact CD2-CE1 3.38Å; L137-H298 VanDerWaalsContact CD2-CG 3.45Å; L137-H298 WeakPolarHBondContact CD2-ND1 3.13Å; L137-H298 VanDerWaalsContact CD2-NE2 3.3Å; L137-H298 WeakPolarHBondContact CD2-NE2 3.42Å; V294-H298 WeakPolarHBondContact O-CB 3.24Å; V294-H298 PolarHBondContact O-N 2.65Å; V294-H298 VanDerWaalsContact O-N 3.1Å; S295-H298 WeakPolarHBondContact O-CB 3.46Å; S295-H298 PolarHBondContact O-N 3.01Å; S296-H298 VanDerWaalsContact C-N 3.3Å; S296-H298 PolarHBondContact O-N 2.8Å; H298-F302 PolarHBondContact O-N 3.39Å; H298-F302 VanDerWaalsContact O-N 3.17Å |
| 299 | K | 50.3 | Low | 44.3 | Very low | 164 Ų | 164 | 109 Ų | 109 | 71% | 0.713 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -65.5 | -44.9 | 176.7 | -76.6 | -174.7 | 175.3 | -176.4 | 0 | 112 | S295 S296 L297 T301 F302 Q303 | S295-K299 PolarHBondContact O-N 2.91Å; S296-K299 PolarHBondContact O-N 3.42Å; L297-K299 VanDerWaalsContact C-N 3.34Å; L297-K299 PolarHBondContact O-N 3.12Å; K299-T301 PolarHBondContact O-N 3.06Å; K299-F302 PolarHBondContact O-N 2.8Å; K299-Q303 PolarHBondContact O-N 3.19Å |
| 300 | Q | 51.7 | Low | 44.1 | Very low | 129 Ų | 129 | 110.1 Ų | 110.1 | 60% | 0.603 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.2 | -37.9 | -179.6 | -69.5 | 178.3 | -6.8 | 0 | 0 | 112.3 | S296 L297 Q303 A304 | S296-Q300 PolarHBondContact O-N 3.45Å; L297-Q300 PolarHBondContact O-N 3.09Å; Q300-Q303 PolarHBondContact O-N 3.5Å; Q300-A304 PolarHBondContact O-N 3.48Å |
| 301 | T | 44.1 | Very low | 43.6 | Very low | 57 Ų | 57 | 110.4 Ų | 110.4 | 35% | 0.35 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -71.3 | -32.2 | 179 | -42.3 | 0 | 0 | 0 | 0 | 112 | L297 K299 A304 V305 | L297-T301 PolarHBondContact O-N 3.44Å; L297-T301 PolarHBondContact O-OG1 2.99Å; K299-T301 PolarHBondContact O-N 3.06Å; T301-A304 PolarHBondContact O-N 3.26Å; T301-V305 HydrophobicContact CG2-CG2 4.46Å; T301-V305 VanDerWaalsContact O-CG2 3.32Å; T301-V305 WeakPolarHBondContact O-CG2 2.93Å; T301-V305 PolarHBondContact O-N 3.47Å |
| 302 | F | 45.3 | Very low | 43.4 | Very low | 117 Ų | 117 | 109.7 Ų | 109.7 | 51% | 0.513 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -66 | -37.5 | 177.8 | -165 | -90.1 | 0 | 0 | 0 | 112.1 | L137 H298 K299 N306 | L137-F302 HydrophobicContact CD1-CB 4.27Å; L137-F302 HydrophobicContact CD1-CD2 3.84Å; L137-F302 HydrophobicContact CD2-CD2 4.2Å; H298-F302 PolarHBondContact O-N 3.39Å; H298-F302 VanDerWaalsContact O-N 3.17Å; K299-F302 PolarHBondContact O-N 2.8Å; F302-N306 PolarHBondContact O-N 2.49Å |
| 303 | Q | 49.5 | Very low | 42.5 | Very low | 150 Ų | 150 | 113.2 Ų | 113.2 | 70% | 0.701 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -68.4 | -37.1 | 177.1 | -72.7 | 177.1 | -50 | 0 | 0 | 112.5 | K299 Q300 V305 | K299-Q303 PolarHBondContact O-N 3.19Å; Q300-Q303 PolarHBondContact O-N 3.5Å; Q303-V305 PolarHBondContact O-N 3.27Å |
| 304 | A | 45.3 | Very low | 41.7 | Very low | 55 Ų | 55 | 116 Ų | 116 | 46% | 0.455 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -75.4 | -21 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q300 T301 S307 | Q300-A304 PolarHBondContact O-N 3.48Å; T301-A304 PolarHBondContact O-N 3.26Å; A304-S307 PolarHBondContact O-OG 2.94Å |
| 305 | V | 47.5 | Very low | 40.9 | Very low | 92 Ų | 92 | 118.9 Ų | 118.9 | 56% | 0.558 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -89.4 | -24.7 | -179.1 | 176 | 0 | 0 | 0 | 0 | 112 | T301 Q303 S307 L308 | T301-V305 HydrophobicContact CG2-CG2 4.46Å; T301-V305 VanDerWaalsContact O-CG2 3.32Å; T301-V305 WeakPolarHBondContact O-CG2 2.93Å; T301-V305 PolarHBondContact O-N 3.47Å; Q303-V305 PolarHBondContact O-N 3.27Å; V305-S307 PolarHBondContact O-N 3.5Å; V305-L308 PolarHBondContact O-N 2.96Å |
| 306 | N | 43.6 | Very low | 40.3 | Very low | 129 Ų | 129 | 120 Ų | 120 | 69% | 0.69 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | -12.8 | 175.3 | -108.5 | 11 | 0 | 0 | 0 | 113.8 | F302 | F302-N306 PolarHBondContact O-N 2.49Š|
| 307 | S | 45.1 | Very low | 39.1 | Very low | 91 Ų | 91 | 123 Ų | 123 | 64% | 0.636 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | 1 | 178.8 | 55.6 | 0 | 0 | 0 | 0 | 114.5 | A304 V305 | A304-S307 PolarHBondContact O-OG 2.94Å; V305-S307 PolarHBondContact O-N 3.5Å |
| 308 | L | 37.9 | Very low | 38.7 | Very low | 150 Ų | 150 | 123.1 Ų | 123.1 | 79% | 0.785 | 66% | 0.664 | S | S | * | * | trans | -135.1 | 79.4 | -174.8 | -76 | 156.4 | 0 | 0 | 0 | 110.7 | V305 | V305-L308 PolarHBondContact O-N 2.96Š| ||
| 309 | S | 32.4 | Very low | 37.6 | Very low | 98 Ų | 98 | 125 Ų | 125 | 69% | 0.685 | 68% | 0.68 | S | S | * | * | trans | -130.7 | 158.1 | 164.5 | 69.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 310 | I | 36.8 | Very low | 36.5 | Very low | 154 Ų | 154 | 125.7 Ų | 125.7 | 79% | 0.79 | 68% | 0.683 | S | S | * | * | trans | 90.3 | 121.6 | -178.2 | -51 | 166.8 | 0 | 0 | 0 | 111.4 | ||||
| 311 | T | 30.7 | Very low | 35.3 | Very low | 102 Ų | 102 | 125.5 Ų | 125.5 | 63% | 0.626 | 69% | 0.686 | S | S | * | * | cis | -171.1 | 152 | 7.9 | 26.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 312 | H | 33.2 | Very low | 34.5 | Very low | 179 Ų | 179 | 131 Ų | 131 | 83% | 0.829 | 71% | 0.706 | S | S | * | * | 152.2 | 131 | 128.7 | -83.6 | 86.1 | 0 | 0 | 0 | 113.3 | |||||
| 313 | Y | 26.3 | Very low | 33.8 | Very low | 214 Ų | 214 | 127.6 Ų | 127.6 | 84% | 0.839 | 70% | 0.695 | S | S | * | * | trans | -110.7 | 169.6 | -172.6 | -105.5 | -98.7 | 0 | 0 | 0 | 109.9 | ||||
| 314 | E | 27.9 | Very low | 33 | Very low | 162 Ų | 162 | 125.5 Ų | 125.5 | 76% | 0.757 | 68% | 0.682 | S | S | * | * | trans | 85.2 | 141.9 | 158.9 | -49.4 | -140.3 | 150.7 | 0 | 0 | 116.6 | ||||
| 315 | L | 28.7 | Very low | 32.2 | Very low | 147 Ų | 147 | 130.8 Ų | 130.8 | 77% | 0.77 | 69% | 0.694 | S | S | * | * | cis | -168.3 | 156.5 | 25.7 | -120.3 | 142.8 | 0 | 0 | 0 | 110.8 | ||||
| 316 | A | 27.6 | Very low | 31.5 | Very low | 94 Ų | 94 | 130.8 Ų | 130.8 | 78% | 0.777 | 69% | 0.688 | S | S | * | * | trans | 90.4 | 107.5 | 142.5 | 0 | 0 | 0 | 0 | 0 | 125.7 | ||||
| 317 | C | 23 | Very low | 31 | Very low | 125 Ų | 125 | 133 Ų | 133 | 85% | 0.845 | 69% | 0.694 | S | S | * | * | trans | -27.8 | -173.8 | 144.6 | -87.8 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 318 | P | 34.6 | Very low | 30.4 | Very low | 109 Ų | 109 | 133.8 Ų | 133.8 | 71% | 0.708 | 70% | 0.699 | S | S | * | * | cis | -142.1 | -163.8 | -47.6 | 41.4 | -21.2 | 0 | 0 | 0 | 112.2 | ||||
| 319 | V | 28.8 | Very low | 30.2 | Very low | 108 Ų | 108 | 131.1 Ų | 131.1 | 66% | 0.655 | 69% | 0.691 | S | S | * | * | trans | 159.7 | 139.1 | 130.3 | -159.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 320 | F | 26.6 | Very low | 30.2 | Very low | 177 Ų | 177 | 131.5 Ų | 131.5 | 78% | 0.776 | 69% | 0.694 | S | S | * | * | trans | 116.4 | 142.6 | 151.3 | -66.3 | -68.6 | 0 | 0 | 0 | 121.4 | K180 | K180-F320 PolarHBondContact NZ-O 3.23Š| ||
| 321 | N | 26.9 | Very low | 30 | Very low | 125 Ų | 125 | 132.5 Ų | 132.5 | 67% | 0.668 | 70% | 0.696 | S | S | * | * | trans | -127.4 | 151.8 | -156.5 | -98.1 | -17.6 | 0 | 0 | 0 | 111.7 | ||||
| 322 | F | 26.9 | Very low | 29.9 | Very low | 174 Ų | 174 | 138.8 Ų | 138.8 | 76% | 0.763 | 71% | 0.708 | S | S | * | * | 154.3 | 148.8 | 121.6 | -99 | -87.1 | 0 | 0 | 0 | 115.3 | |||||
| 323 | P | 31.4 | Very low | 29.7 | Very low | 44 Ų | 44 | 135.5 Ų | 135.5 | 29% | 0.286 | 70% | 0.702 | S | S | . | * | trans | -122 | 167.3 | -167.9 | 38 | -19.9 | 0 | 0 | 0 | 116.8 | E173 F176 | E173-P323 WeakPolarHBondContact OE2-CG 2.97Å; F176-P323 HydrophobicContact CE2-CB 4.13Å | ||
| 324 | Y | 31 | Very low | 30 | Very low | 107 Ų | 107 | 131.9 Ų | 131.9 | 42% | 0.42 | 70% | 0.702 | S | S | . | * | 165.3 | 138 | 121.1 | -107 | -66.5 | 0 | 0 | 0 | 119.7 | E173 | E173-Y324 HydrophobicContact CG-CE1 4.31Å; E173-Y324 HydrophobicContact CG-CE2 3.91Å; E173-Y324 WeakPolarHBondContact CG-OH 3.47Å; E173-Y324 WeakPolarHBondContact OE1-CE2 3.39Å; E173-Y324 PolarHBondContact OE1-OH 3.5Å; E173-Y324 WeakPolarHBondContact OE2-CE2 3.06Å | |||
| 325 | K | 29.5 | Very low | 30.1 | Very low | 165 Ų | 165 | 131.2 Ų | 131.2 | 72% | 0.717 | 70% | 0.704 | S | S | * | * | trans | 36.3 | 132.9 | 149 | -91.2 | 170.2 | -178.3 | 173 | 0 | 125.4 | N228 | N228-K325 PolarHBondContact OD1-O 3.05Å; N228-K325 VanDerWaalsContact OD1-O 3.09Å | ||
| 326 | H | 33.2 | Very low | 30.4 | Very low | 93 Ų | 93 | 135.6 Ų | 135.6 | 43% | 0.431 | 73% | 0.727 | S | S | . | * | trans | -114 | 146.5 | 174.8 | -121.6 | -48.2 | 0 | 0 | 0 | 112.6 | N228 | N228-H326 VanDerWaalsContact CG-CD2 3.49Å; N228-H326 PolarHBondContact ND2-CD2 2.95Å; N228-H326 PolarHBondContact ND2-CE1 2.92Å; N228-H326 PolarHBondContact ND2-NE2 3.22Å; N228-H326 WeakPolarHBondContact OD1-CA 3.44Å; N228-H326 PolarHBondContact OD1-CD2 2.93Å; N228-H326 PolarHBondContact OD1-CE1 3.32Å; N228-H326 PolarHBondContact OD1-ND1 3.42Å; N228-H326 PolarHBondContact OD1-NE2 3.25Å | ||
| 327 | Q | 32.7 | Very low | 30.6 | Very low | 174 Ų | 174 | 137.7 Ų | 137.7 | 81% | 0.813 | 72% | 0.724 | S | S | * | * | trans | -113.6 | 23.1 | -153.7 | -166.3 | 146.7 | -25.5 | 0 | 0 | 116.1 | ||||
| 328 | C | 32.2 | Very low | 31 | Very low | 109 Ų | 109 | 138.4 Ų | 138.4 | 74% | 0.736 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -4.3 | -169.9 | -84 | 0 | 0 | 0 | 0 | 117.3 | ||
| 329 | C | 33.4 | Very low | 30.8 | Very low | 93 Ų | 93 | 140 Ų | 140 | 63% | 0.628 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | 8.7 | -174.6 | -73.8 | 0 | 0 | 0 | 0 | 115 | E331 | C329-E331 PolarHBondContact O-N 3.45Š|
| 330 | S | 31.6 | Very low | 30.9 | Very low | 106 Ų | 106 | 141.9 Ų | 141.9 | 74% | 0.741 | 72% | 0.722 | S | S | * | * | trans | -91.8 | 64.2 | -175.7 | 174.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 331 | E | 32.6 | Very low | 31.2 | Very low | 176 Ų | 176 | 139.7 Ų | 139.7 | 82% | 0.822 | 72% | 0.719 | S | S | * | * | trans | -126.8 | 101.7 | 157.1 | -75.8 | -173.5 | 172.8 | 0 | 0 | 108.3 | C329 | C329-E331 PolarHBondContact O-N 3.45Š| ||
| 332 | R | 29.4 | Very low | 31.4 | Very low | 234 Ų | 234 | 140.7 Ų | 140.7 | 88% | 0.883 | 72% | 0.722 | S | S | * | * | trans | -68 | 143.3 | 165.7 | -100.2 | -173.3 | -89.3 | -163.6 | -5.6 | 108.2 | V334 | R332-V334 PolarHBondContact O-N 3.21Š| ||
| 333 | P | 28.4 | Very low | 31.8 | Very low | 110 Ų | 110 | 138.3 Ų | 138.3 | 71% | 0.714 | 72% | 0.719 | S | S | * | * | trans | -63.5 | 125.1 | 172.6 | 27.6 | -30.9 | 0 | 0 | 0 | 108.7 | N335 | P333-N335 PolarHBondContact O-N 3.35Š| ||
| 334 | V | 33.2 | Very low | 31.8 | Very low | 137 Ų | 137 | 145.5 Ų | 145.5 | 83% | 0.83 | 75% | 0.753 | S | S | * | * | trans | -69.2 | 109.4 | 165.1 | -179 | 0 | 0 | 0 | 0 | 105.9 | R332 L336 | R332-V334 PolarHBondContact O-N 3.21Å; V334-L336 PolarHBondContact O-N 3.17Å | ||
| 335 | N | 31.1 | Very low | 31.9 | Very low | 148 Ų | 148 | 148.8 Ų | 148.8 | 79% | 0.791 | 78% | 0.78 | S | S | * | * | trans | -64.2 | 121.5 | 166.4 | -71.2 | -33.9 | 0 | 0 | 0 | 107.8 | P333 | P333-N335 PolarHBondContact O-N 3.35Š| ||
| 336 | L | 34.8 | Very low | 32.1 | Very low | 240 Ų | 240 | 147.3 Ų | 147.3 | 100% | 1.257 | 79% | 0.786 | S | S | * | * | trans | -80 | 0 | 159.1 | -93.7 | 157.1 | 0 | 0 | 0 | 109.8 | V334 | V334-L336 PolarHBondContact O-N 3.17Š|
Retrieved 336 of 336 residues in 478.3 ms
(Link to these results)