| 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 | 29.1 | Very low | 30.4 | Very low | 242 Ų | 242 | 170.6 Ų | 170.6 | 100% | 1.192 | 85% | 0.853 | S | S | * | * | 0 | 116 | 0 | -88.7 | 176.8 | 171.7 | 0 | 0 | 108.5 | |||||
| 2 | L | 30.1 | Very low | 30.4 | Very low | 156 Ų | 156 | 168 Ų | 168 | 82% | 0.817 | 84% | 0.844 | S | S | * | * | trans | 18.2 | 123.6 | 158.7 | -69.5 | 147.8 | 0 | 0 | 0 | 120.4 | T4 | L2-T4 HydrophobicContact CD2-CG2 4.05Š| ||
| 3 | S | 26.3 | Very low | 30.6 | Very low | 122 Ų | 122 | 163.1 Ų | 163.1 | 85% | 0.853 | 83% | 0.828 | S | S | * | * | trans | -138.1 | 107 | 132.3 | -169.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 4 | T | 31.3 | Very low | 30.8 | Very low | 114 Ų | 114 | 163.3 Ų | 163.3 | 70% | 0.699 | 83% | 0.832 | S | S | * | * | trans | -82.3 | 126.6 | 171.4 | 35.6 | 0 | 0 | 0 | 0 | 110 | L2 | L2-T4 HydrophobicContact CD2-CG2 4.05Š| ||
| 5 | S | 30.6 | Very low | 30.7 | Very low | 124 Ų | 124 | 157.4 Ų | 157.4 | 87% | 0.867 | 83% | 0.828 | S | S | * | * | trans | -105.7 | 134.3 | 160.3 | -90.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 6 | R | 31.8 | Very low | 31.3 | Very low | 236 Ų | 236 | 155.7 Ų | 155.7 | 89% | 0.891 | 83% | 0.833 | S | S | * | * | trans | -97.4 | 111.2 | -160.6 | -173.1 | -175.3 | -167.3 | -176.2 | 3.8 | 108.7 | ||||
| 7 | S | 30 | Very low | 31.3 | Very low | 125 Ų | 125 | 150.8 Ų | 150.8 | 87% | 0.874 | 83% | 0.828 | S | S | * | * | trans | -92.9 | 122.6 | 170 | -74.8 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 8 | R | 29.1 | Very low | 31.3 | Very low | 234 Ų | 234 | 152.5 Ų | 152.5 | 88% | 0.883 | 83% | 0.829 | S | S | * | * | trans | -86.4 | 133.5 | -179.1 | -163 | -177.3 | -70.8 | -178.1 | -1.8 | 108.8 | ||||
| 9 | F | 31.8 | Very low | 31.3 | Very low | 162 Ų | 162 | 154.4 Ų | 154.4 | 71% | 0.711 | 83% | 0.832 | S | S | * | * | trans | -40.1 | 137.2 | 169.9 | -105 | -107.5 | 0 | 0 | 0 | 114.9 | R11 | F9-R11 HydrophobicContact CD1-CB 4.37Š| ||
| 10 | I | 31.8 | Very low | 31.4 | Very low | 170 Ų | 170 | 152.8 Ų | 152.8 | 87% | 0.872 | 83% | 0.827 | S | S | * | * | trans | -135.6 | 126.6 | 133.7 | -64.9 | -167.6 | 0 | 0 | 0 | 107.7 | ||||
| 11 | R | 32.7 | Very low | 31.5 | Very low | 192 Ų | 192 | 151.2 Ų | 151.2 | 73% | 0.725 | 82% | 0.823 | S | S | * | * | trans | -117.6 | 125.6 | 172.3 | 178.9 | -167.1 | -76.6 | 176.6 | -5.1 | 107.6 | F9 | F9-R11 HydrophobicContact CD1-CB 4.37Š| ||
| 12 | N | 30.8 | Very low | 31.7 | Very low | 139 Ų | 139 | 144.5 Ų | 144.5 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | trans | 159.2 | 142.1 | 151.6 | -97.7 | 5.2 | 0 | 0 | 0 | 108.2 | ||||
| 13 | T | 32.5 | Very low | 31.8 | Very low | 104 Ų | 104 | 146.1 Ų | 146.1 | 64% | 0.638 | 80% | 0.797 | S | S | * | * | cis | -171.3 | 145.8 | -1.7 | 12.1 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 14 | N | 33.9 | Very low | 32.1 | Very low | 166 Ų | 166 | 148.3 Ų | 148.3 | 89% | 0.888 | 79% | 0.791 | S | S | * | * | trans | 51.9 | 121.9 | 153 | -62.3 | -5.2 | 0 | 0 | 0 | 121 | ||||
| 15 | G | 29.4 | Very low | 32 | Very low | 75 Ų | 75 | 149.6 Ų | 149.6 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | 151.4 | 113.9 | 154.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 16 | S | 39.5 | Very low | 32.2 | Very low | 130 Ų | 130 | 153.3 Ų | 153.3 | 91% | 0.909 | 79% | 0.79 | S | S | * | * | trans | -44.4 | 129.4 | 170.8 | 48.4 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 17 | G | 31.5 | Very low | 32.3 | Very low | 72 Ų | 72 | 149.1 Ų | 149.1 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | trans | 168 | 103.4 | 169.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 18 | E | 31.9 | Very low | 32.7 | Very low | 182 Ų | 182 | 153.6 Ų | 153.6 | 85% | 0.85 | 78% | 0.784 | S | S | * | * | trans | 20.6 | 107.3 | 158.1 | -64.1 | 175.3 | 158.7 | 0 | 0 | 117.6 | V20 | E18-V20 PolarHBondContact O-N 2.96Š| ||
| 19 | E | 30.4 | Very low | 33.3 | Very low | 189 Ų | 189 | 145 Ų | 145 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | trans | -65.1 | 98.2 | 160.7 | -80.7 | -171.5 | 157.4 | 0 | 0 | 109 | T21 | E19-T21 VanDerWaalsContact C-N 3.32Å; E19-T21 PolarHBondContact O-N 3.02Å | ||
| 20 | V | 33.9 | Very low | 33.9 | Very low | 121 Ų | 121 | 141.1 Ų | 141.1 | 73% | 0.733 | 77% | 0.767 | S | S | * | * | trans | -68 | 95.8 | 163 | -179.6 | 0 | 0 | 0 | 0 | 106.9 | E18 T22 | E18-V20 PolarHBondContact O-N 2.96Å; V20-T22 PolarHBondContact O-N 3.07Å | ||
| 21 | T | 33.8 | Very low | 35.1 | Very low | 120 Ų | 120 | 138 Ų | 138 | 74% | 0.736 | 76% | 0.757 | S | S | * | * | trans | -60.3 | 102.8 | 165.2 | 44.7 | 0 | 0 | 0 | 0 | 108 | E19 F23 | E19-T21 VanDerWaalsContact C-N 3.32Å; E19-T21 PolarHBondContact O-N 3.02Å; T21-F23 PolarHBondContact O-N 3.33Å | ||
| 22 | T | 32.5 | Very low | 36.5 | Very low | 102 Ų | 102 | 131.2 Ų | 131.2 | 63% | 0.626 | 74% | 0.739 | S | S | * | * | trans | -61.2 | 109.3 | 169.1 | 46 | 0 | 0 | 0 | 0 | 108.1 | V20 F24 | V20-T22 PolarHBondContact O-N 3.07Å; T22-F24 PolarHBondContact O-N 3.28Å | ||
| 23 | F | 31.9 | Very low | 37.8 | Very low | 190 Ų | 190 | 130.9 Ų | 130.9 | 83% | 0.833 | 73% | 0.733 | S | S | * | * | trans | -64 | 100.8 | 169 | -141.7 | -94.8 | 0 | 0 | 0 | 106.5 | T21 D25 | T21-F23 PolarHBondContact O-N 3.33Å; F23-D25 VanDerWaalsContact C-N 3.27Å; F23-D25 PolarHBondContact O-N 3.07Å | ||
| 24 | F | 33.3 | Very low | 39.2 | Very low | 168 Ų | 168 | 130.8 Ų | 130.8 | 74% | 0.737 | 72% | 0.723 | S | S | * | * | trans | -70.5 | 96.5 | 165.4 | -84.8 | -85.9 | 0 | 0 | 0 | 106.3 | T22 Y26 | T22-F24 PolarHBondContact O-N 3.28Å; F24-Y26 VanDerWaalsContact C-N 3.33Å; F24-Y26 HydrophobicContact CB-CE2 4.48Å; F24-Y26 PolarHBondContact O-N 3.1Å | ||
| 25 | D | 29.1 | Very low | 40.3 | Very low | 140 Ų | 140 | 130 Ų | 130 | 75% | 0.749 | 71% | 0.712 | S | S | * | * | trans | -65.6 | 97.9 | 168 | -150.2 | 2.1 | 0 | 0 | 0 | 106.3 | F23 D27 | F23-D25 VanDerWaalsContact C-N 3.27Å; F23-D25 PolarHBondContact O-N 3.07Å; D25-D27 PolarHBondContact O-N 3.11Å | ||
| 26 | Y | 35.5 | Very low | 41.8 | Very low | 203 Ų | 203 | 130.6 Ų | 130.6 | 80% | 0.796 | 70% | 0.698 | S | S | * | * | trans | -67.4 | 93.5 | 165.5 | -76.7 | -89.2 | 0 | 0 | 0 | 105.4 | F24 Y28 | F24-Y26 VanDerWaalsContact C-N 3.33Å; F24-Y26 HydrophobicContact CB-CE2 4.48Å; F24-Y26 PolarHBondContact O-N 3.1Å; Y26-Y28 PolarHBondContact O-N 2.86Å | ||
| 27 | D | 32.4 | Very low | 43.1 | Very low | 148 Ų | 148 | 125.1 Ų | 125.1 | 79% | 0.791 | 66% | 0.659 | S | S | * | * | trans | -56.8 | 91.6 | 169 | -176.5 | 25.2 | 0 | 0 | 0 | 107.5 | D25 G29 | D25-D27 PolarHBondContact O-N 3.11Å; D27-G29 PolarHBondContact O-N 3.47Å | ||
| 28 | Y | 38.6 | Very low | 44.8 | Very low | 218 Ų | 218 | 126.9 Ų | 126.9 | 86% | 0.855 | 65% | 0.646 | S | S | * | * | trans | -74.2 | 75.4 | 172.7 | -144.4 | -87.7 | 0 | 0 | 0 | 105 | Y26 A30 | Y26-Y28 PolarHBondContact O-N 2.86Å; Y28-A30 PolarHBondContact O-N 2.79Å | ||
| 29 | G | 42.4 | Very low | 46.9 | Very low | 54 Ų | 54 | 124.3 Ų | 124.3 | 56% | 0.557 | 63% | 0.634 | S | S | * | * | trans | -45.9 | 115.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 109 | D27 | D27-G29 PolarHBondContact O-N 3.47Š| ||
| 30 | A | 44 | Very low | 48.9 | Very low | 80 Ų | 80 | 120.5 Ų | 120.5 | 66% | 0.661 | 62% | 0.619 | S | S | * | * | trans | -53.2 | 139.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | Y28 C32 | Y28-A30 PolarHBondContact O-N 2.79Å; A30-C32 PolarHBondContact O-N 3.44Å; A30-C32 VanDerWaalsContact O-N 3.13Å | ||
| 31 | P | 57.6 | Low | 50.8 | Low | 104 Ų | 104 | 115.2 Ų | 115.2 | 68% | 0.675 | 59% | 0.588 | S | S | * | * | trans | -56.9 | 121.9 | 179.4 | 17.9 | -27.4 | 0 | 0 | 0 | 110.5 | H33 | P31-H33 PolarHBondContact O-N 3.06Š| ||
| 32 | C | 61.5 | Low | 53 | Low | 50 Ų | 50 | 111.2 Ų | 111.2 | 34% | 0.338 | 57% | 0.567 | S | S | . | * | trans | -61.4 | 106.8 | -179.1 | -65.6 | 0 | 0 | 0 | 0 | 110.8 | A30 C277 | A30-C32 PolarHBondContact O-N 3.44Å; A30-C32 VanDerWaalsContact O-N 3.13Å; C32-C277 WeakPolarHBondContact CB-SG 3.44Å; C32-C277 VanDerWaalsContact SG-CA 3.55Å; C32-C277 WeakPolarHBondContact SG-CB 3.32Å; C32-C277 CovalentContact SG-SG 2.04Å; C32-C277 PolarHBondContact SG-SG 3.13Å | ||
| 33 | H | 57.8 | Low | 55.4 | Low | 132 Ų | 132 | 113.1 Ų | 113.1 | 61% | 0.611 | 57% | 0.569 | S | S | * | * | trans | -72.6 | 125 | 179.1 | -79.1 | -68.5 | 0 | 0 | 0 | 112.3 | P31 F35 | P31-H33 PolarHBondContact O-N 3.06Å; H33-F35 HydrophobicContact CB-CD2 4.13Å; H33-F35 AromaticContact ND1-CD2 3.98Å; H33-F35 AromaticContact ND1-CE2 3.5Å; H33-F35 WeakPolarHBondContact ND1-CE2 3.45Å | ||
| 34 | K | 61.9 | Low | 57.9 | Low | 102 Ų | 102 | 109 Ų | 109 | 44% | 0.443 | 56% | 0.555 | S | S | . | * | trans | -105.5 | 20.8 | -173.7 | -56.4 | -174.6 | -172.5 | -177.7 | 0 | 114.9 | D36 V37 D284 | K34-D36 PolarHBondContact O-N 3.2Å; K34-V37 PolarHBondContact O-N 3.33Å; K34-D284 WeakPolarHBondContact CE-OD2 3.41Å; K34-D284 IonicContact NZ-OD2 3.04Å; K34-D284 PolarHBondContact NZ-OD2 3.24Å | ||
| 35 | F | 57.1 | Low | 60.4 | Low | 150 Ų | 150 | 102.3 Ų | 102.3 | 66% | 0.658 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -58.1 | -45.5 | -167.9 | -80.9 | -79.7 | 0 | 0 | 0 | 115.2 | H33 V37 K38 | H33-F35 HydrophobicContact CB-CD2 4.13Å; H33-F35 AromaticContact ND1-CD2 3.98Å; H33-F35 AromaticContact ND1-CE2 3.5Å; H33-F35 WeakPolarHBondContact ND1-CE2 3.45Å; F35-V37 PolarHBondContact O-N 3.3Å; F35-V37 VanDerWaalsContact O-N 3.14Å; F35-K38 PolarHBondContact O-N 3.16Å |
| 36 | D | 61.3 | Low | 63.3 | Low | 88 Ų | 88 | 96.7 Ų | 96.7 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63 | -26.1 | -174.8 | -60.7 | -41.9 | 0 | 0 | 0 | 113.8 | K34 I40 R281 | K34-D36 PolarHBondContact O-N 3.2Å; D36-I40 WeakPolarHBondContact O-CG1 3.49Å; D36-I40 PolarHBondContact O-N 3.36Å; D36-R281 IonicContact OD2-CZ 2.69Å; D36-R281 IonicContact OD2-NH1 3.83Å; D36-R281 IonicContact OD2-NH2 3.56Å; D36-R281 PolarHBondContact OD2-NH2 3.4Å |
| 37 | V | 66.6 | Low | 65.9 | Low | 14 Ų | 14 | 90.7 Ų | 90.7 | 9% | 0.085 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -76.3 | -41.2 | -175.1 | -167.7 | 0 | 0 | 0 | 0 | 111.5 | K34 F35 Q39 G41 Q285 Q288 | K34-V37 PolarHBondContact O-N 3.33Å; F35-V37 PolarHBondContact O-N 3.3Å; F35-V37 VanDerWaalsContact O-N 3.14Å; V37-Q39 VanDerWaalsContact C-N 3.29Å; V37-Q39 PolarHBondContact O-N 2.95Å; V37-G41 PolarHBondContact O-N 3.11Å; V37-Q285 HydrophobicContact CB-CG 4.3Å; V37-Q285 HydrophobicContact CG1-CG 3.88Å; V37-Q285 HydrophobicContact CG2-CG 3.4Å; V37-Q288 VanDerWaalsContact CG1-OE1 3.29Å |
| 38 | K | 68.4 | Low | 68.6 | Low | 109 Ų | 109 | 86.1 Ų | 86.1 | 47% | 0.474 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.6 | -38.4 | -179.8 | -71.5 | -174.2 | 176 | -179.6 | 0 | 111 | F35 G41 A42 | F35-K38 PolarHBondContact O-N 3.16Å; K38-G41 PolarHBondContact O-N 3.34Å; K38-A42 WeakPolarHBondContact O-CB 3.45Å; K38-A42 PolarHBondContact O-N 2.88Å |
| 39 | Q | 74.1 | Confident | 71.1 | Confident | 129 Ų | 129 | 76.3 Ų | 76.3 | 60% | 0.603 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -72.3 | -42.9 | -176.8 | -168.5 | 167.4 | 0.5 | 0 | 0 | 113.2 | V37 G41 A42 Q43 | V37-Q39 VanDerWaalsContact C-N 3.29Å; V37-Q39 PolarHBondContact O-N 2.95Å; Q39-G41 VanDerWaalsContact C-N 3.29Å; Q39-G41 PolarHBondContact O-N 3.41Å; Q39-A42 PolarHBondContact O-N 3.42Å; Q39-Q43 PolarHBondContact O-N 3.07Å |
| 40 | I | 73.3 | Confident | 73.4 | Confident | 109 Ų | 109 | 76.4 Ų | 76.4 | 56% | 0.559 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -63.5 | -41.6 | 173.8 | -64 | 170.1 | 0 | 0 | 0 | 109.8 | D36 A42 Q43 L44 | D36-I40 WeakPolarHBondContact O-CG1 3.49Å; D36-I40 PolarHBondContact O-N 3.36Å; I40-A42 PolarHBondContact O-N 3.32Å; I40-Q43 PolarHBondContact O-N 3.35Å; I40-L44 WeakPolarHBondContact O-CB 3.43Å; I40-L44 PolarHBondContact O-N 3.03Å |
| 41 | G | 74.8 | Confident | 75.7 | Confident | 9 Ų | 9 | 77.2 Ų | 77.2 | 9% | 0.093 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -61.2 | -44.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | V37 K38 Q39 Q43 L44 L45 | V37-G41 PolarHBondContact O-N 3.11Å; K38-G41 PolarHBondContact O-N 3.34Å; Q39-G41 VanDerWaalsContact C-N 3.29Å; Q39-G41 PolarHBondContact O-N 3.41Å; G41-Q43 PolarHBondContact O-N 3.35Å; G41-L44 PolarHBondContact O-N 3.22Å; G41-L45 VanDerWaalsContact O-CB 3.32Å; G41-L45 WeakPolarHBondContact O-CB 3.38Å; G41-L45 WeakPolarHBondContact O-CD1 3.49Å; G41-L45 PolarHBondContact O-N 3Å |
| 42 | A | 79.3 | Confident | 77.3 | Confident | 36 Ų | 36 | 72.7 Ų | 72.7 | 30% | 0.298 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.1 | -27.8 | 179 | 0 | 0 | 0 | 0 | 0 | 114 | K38 Q39 I40 P46 A102 | K38-A42 WeakPolarHBondContact O-CB 3.45Å; K38-A42 PolarHBondContact O-N 2.88Å; Q39-A42 PolarHBondContact O-N 3.42Å; I40-A42 PolarHBondContact O-N 3.32Å; A42-P46 WeakPolarHBondContact O-CD 3.32Å; A42-P46 VanDerWaalsContact O-CG 3.31Å; A42-P46 WeakPolarHBondContact O-CG 3.31Å; A42-A102 VanDerWaalsContact CA-O 3.3Å; A42-A102 WeakPolarHBondContact CA-O 3.46Å; A42-A102 WeakPolarHBondContact CB-O 3.42Å |
| 43 | Q | 83.3 | Confident | 78.9 | Confident | 143 Ų | 143 | 73 Ų | 73 | 67% | 0.668 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -88.9 | -36.9 | 178.9 | -66.5 | -178.8 | -2.7 | 0 | 0 | 112.9 | Q39 I40 G41 P47 | Q39-Q43 PolarHBondContact O-N 3.07Å; I40-Q43 PolarHBondContact O-N 3.35Å; G41-Q43 PolarHBondContact O-N 3.35Å; Q43-P47 VanDerWaalsContact O-CD 3.3Å; Q43-P47 WeakPolarHBondContact O-CD 3.25Å; Q43-P47 WeakPolarHBondContact O-CG 3.13Å |
| 44 | L | 83.6 | Confident | 80.5 | Confident | 102 Ų | 102 | 71.5 Ų | 71.5 | 53% | 0.534 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -92.9 | -39.8 | -171.5 | -176.6 | 63.6 | 0 | 0 | 0 | 113.8 | I40 G41 P47 L48 | I40-L44 WeakPolarHBondContact O-CB 3.43Å; I40-L44 PolarHBondContact O-N 3.03Å; G41-L44 PolarHBondContact O-N 3.22Å; L44-P47 WeakPolarHBondContact O-CD 3.32Å; L44-P47 WeakPolarHBondContact O-CG 3.21Å; L44-L48 WeakPolarHBondContact O-CB 3.38Å; L44-L48 PolarHBondContact O-N 2.86Å |
| 45 | L | 85.9 | Confident | 81.9 | Confident | 28 Ų | 28 | 72.9 Ų | 72.9 | 15% | 0.147 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -65.3 | -46.7 | -174.4 | -86 | 71.5 | 0 | 0 | 0 | 112.6 | G41 L48 Y49 A102 | G41-L45 VanDerWaalsContact O-CB 3.32Å; G41-L45 WeakPolarHBondContact O-CB 3.38Å; G41-L45 WeakPolarHBondContact O-CD1 3.49Å; G41-L45 PolarHBondContact O-N 3Å; L45-L48 PolarHBondContact O-N 3.35Å; L45-Y49 HydrophobicContact CB-CD2 4.32Å; L45-Y49 HydrophobicContact CB-CE2 4.02Å; L45-Y49 HydrophobicContact CD2-CE2 3.81Å; L45-Y49 VanDerWaalsContact CD2-OH 3.29Å; L45-Y49 WeakPolarHBondContact CD2-OH 3.22Å; L45-Y49 HydrophobicContact CG-CE1 4.45Å; L45-Y49 HydrophobicContact CG-CE2 4.08Å; L45-Y49 WeakPolarHBondContact O-CB 3.19Å; L45-Y49 VanDerWaalsContact O-CG 3.3Å; L45-Y49 PolarHBondContact O-N 3.18Å; L45-A102 HydrophobicContact CB-CB 3.81Å; L45-A102 HydrophobicContact CD2-CB 4Å |
| 46 | P | 89.4 | Confident | 83.5 | Confident | 23 Ų | 23 | 65.8 Ų | 65.8 | 15% | 0.149 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.2 | -49.8 | -176.4 | -21.4 | 30.7 | 0 | 0 | 0 | 115.3 | A42 L48 S50 A99 A102 A103 | A42-P46 WeakPolarHBondContact O-CD 3.32Å; A42-P46 VanDerWaalsContact O-CG 3.31Å; A42-P46 WeakPolarHBondContact O-CG 3.31Å; P46-L48 VanDerWaalsContact C-N 3.34Å; P46-L48 PolarHBondContact O-N 2.93Å; P46-S50 WeakPolarHBondContact O-CB 3.45Å; P46-S50 PolarHBondContact O-N 3.08Å; P46-S50 PolarHBondContact O-OG 3.25Å; P46-A99 HydrophobicContact CB-CB 4.36Å; P46-A102 HydrophobicContact CG-CB 4.42Å; P46-A103 HydrophobicContact CG-CB 3.9Å |
| 47 | P | 90.6 | Very high | 85.1 | Confident | 77 Ų | 77 | 65 Ų | 65 | 50% | 0.5 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -66.2 | -37.3 | 178.6 | 25.3 | -33.3 | 0 | 0 | 0 | 111.8 | Q43 L44 S50 L51 | Q43-P47 VanDerWaalsContact O-CD 3.3Å; Q43-P47 WeakPolarHBondContact O-CD 3.25Å; Q43-P47 WeakPolarHBondContact O-CG 3.13Å; L44-P47 WeakPolarHBondContact O-CD 3.32Å; L44-P47 WeakPolarHBondContact O-CG 3.21Å; P47-S50 PolarHBondContact O-N 2.88Å; P47-L51 WeakPolarHBondContact O-CB 3.35Å; P47-L51 PolarHBondContact O-N 3.41Å |
| 48 | L | 89.2 | Confident | 86.2 | Confident | 52 Ų | 52 | 68.7 Ų | 68.7 | 27% | 0.272 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.2 | -48.2 | 178.8 | -179 | 60.9 | 0 | 0 | 0 | 111.9 | L44 L45 P46 S50 L51 V52 T292 T296 | L44-L48 WeakPolarHBondContact O-CB 3.38Å; L44-L48 PolarHBondContact O-N 2.86Å; L45-L48 PolarHBondContact O-N 3.35Å; P46-L48 VanDerWaalsContact C-N 3.34Å; P46-L48 PolarHBondContact O-N 2.93Å; L48-S50 VanDerWaalsContact C-N 3.29Å; L48-S50 PolarHBondContact O-N 2.85Å; L48-L51 WeakPolarHBondContact O-CB 3.28Å; L48-L51 PolarHBondContact O-N 3.36Å; L48-V52 HydrophobicContact CD1-CG2 4.44Å; L48-V52 VanDerWaalsContact O-CG2 3.3Å; L48-V52 WeakPolarHBondContact O-CG2 3.49Å; L48-V52 PolarHBondContact O-N 3.15Å; L48-T292 HydrophobicContact CD2-CG2 3.3Å; L48-T292 HydrophobicContact CG-CG2 4.46Å; L48-T296 HydrophobicContact CD1-CG2 4.46Å |
| 49 | Y | 91 | Very high | 87.3 | Confident | 11 Ų | 11 | 64 Ų | 64 | 4% | 0.043 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -63.2 | -36.3 | 176.7 | -71.2 | -7.8 | 0 | 0 | 0 | 112.1 | L45 V52 F53 L95 W98 A99 T292 M295 | L45-Y49 HydrophobicContact CB-CD2 4.32Å; L45-Y49 HydrophobicContact CB-CE2 4.02Å; L45-Y49 HydrophobicContact CD2-CE2 3.81Å; L45-Y49 VanDerWaalsContact CD2-OH 3.29Å; L45-Y49 WeakPolarHBondContact CD2-OH 3.22Å; L45-Y49 HydrophobicContact CG-CE1 4.45Å; L45-Y49 HydrophobicContact CG-CE2 4.08Å; L45-Y49 WeakPolarHBondContact O-CB 3.19Å; L45-Y49 VanDerWaalsContact O-CG 3.3Å; L45-Y49 PolarHBondContact O-N 3.18Å; Y49-V52 PolarHBondContact O-N 3.38Å; Y49-F53 VanDerWaalsContact O-CB 3.25Å; Y49-F53 WeakPolarHBondContact O-CB 3.29Å; Y49-F53 PolarHBondContact O-N 3.49Å; Y49-L95 HydrophobicContact CG-CD2 4.48Å; Y49-W98 HydrophobicContact CD2-CB 4.09Å; Y49-W98 HydrophobicContact CE2-CB 3.93Å; Y49-A99 HydrophobicContact CD2-CB 4.14Å; Y49-T292 HydrophobicContact CE1-CG2 4Å; Y49-T292 PolarHBondContact OH-OG1 2.83Å; Y49-M295 HydrophobicContact CE1-CB 4.46Å; Y49-M295 HydrophobicContact CE1-SD 3.83Å; Y49-M295 HydrophobicContact CE2-SD 4.39Å |
| 50 | S | 91.4 | Very high | 88.1 | Confident | 57 Ų | 57 | 57.9 Ų | 57.9 | 40% | 0.399 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.4 | -43.4 | 174.2 | -59.1 | 0 | 0 | 0 | 0 | 111.8 | P46 P47 L48 F53 I54 | P46-S50 WeakPolarHBondContact O-CB 3.45Å; P46-S50 PolarHBondContact O-N 3.08Å; P46-S50 PolarHBondContact O-OG 3.25Å; P47-S50 PolarHBondContact O-N 2.88Å; L48-S50 VanDerWaalsContact C-N 3.29Å; L48-S50 PolarHBondContact O-N 2.85Å; S50-F53 PolarHBondContact O-N 3.42Å; S50-I54 VanDerWaalsContact O-CG1 3.31Å; S50-I54 WeakPolarHBondContact O-CG1 3.26Å; S50-I54 PolarHBondContact O-N 2.85Å |
| 51 | L | 91.4 | Very high | 89.1 | Confident | 97 Ų | 97 | 56 Ų | 56 | 51% | 0.508 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -61.9 | -49.7 | 175.9 | -166.6 | 74.2 | 0 | 0 | 0 | 111.2 | P47 L48 F53 I54 F55 | P47-L51 WeakPolarHBondContact O-CB 3.35Å; P47-L51 PolarHBondContact O-N 3.41Å; L48-L51 WeakPolarHBondContact O-CB 3.28Å; L48-L51 PolarHBondContact O-N 3.36Å; L51-F53 VanDerWaalsContact C-N 3.3Å; L51-F53 PolarHBondContact O-N 3.05Å; L51-I54 PolarHBondContact O-N 2.9Å; L51-F55 HydrophobicContact CD1-CD2 3.92Å; L51-F55 HydrophobicContact CD1-CE2 3.53Å; L51-F55 HydrophobicContact CG-CD2 3.93Å; L51-F55 HydrophobicContact CG-CE2 4Å; L51-F55 WeakPolarHBondContact O-CD2 3.48Å; L51-F55 PolarHBondContact O-N 3.21Å |
| 52 | V | 92 | Very high | 89.7 | Confident | 8 Ų | 8 | 58 Ų | 58 | 5% | 0.048 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -60.3 | -41.6 | 178.5 | 174.5 | 0 | 0 | 0 | 0 | 110.8 | L48 Y49 G56 L92 L95 T296 C299 | L48-V52 HydrophobicContact CD1-CG2 4.44Å; L48-V52 VanDerWaalsContact O-CG2 3.3Å; L48-V52 WeakPolarHBondContact O-CG2 3.49Å; L48-V52 PolarHBondContact O-N 3.15Å; Y49-V52 PolarHBondContact O-N 3.38Å; V52-G56 WeakPolarHBondContact O-CA 3.29Å; V52-G56 PolarHBondContact O-N 2.95Å; V52-L92 HydrophobicContact CG1-CD2 4.1Å; V52-L92 WeakPolarHBondContact O-CD2 3.5Å; V52-L95 HydrophobicContact CB-CD1 4.05Å; V52-L95 HydrophobicContact CG1-CD1 3.59Å; V52-T296 HydrophobicContact CG2-CG2 3.72Å; V52-C299 HydrophobicContact CG1-CB 4.38Å |
| 53 | F | 93.9 | Very high | 90.2 | Very high | 58 Ų | 58 | 56.3 Ų | 56.3 | 25% | 0.254 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.5 | -51.3 | 176 | 175.6 | -107.1 | 0 | 0 | 0 | 111.7 | Y49 S50 L51 F57 L92 L95 P96 | Y49-F53 VanDerWaalsContact O-CB 3.25Å; Y49-F53 WeakPolarHBondContact O-CB 3.29Å; Y49-F53 PolarHBondContact O-N 3.49Å; S50-F53 PolarHBondContact O-N 3.42Å; L51-F53 VanDerWaalsContact C-N 3.3Å; L51-F53 PolarHBondContact O-N 3.05Å; F53-F57 HydrophobicContact CE2-CB 4.38Å; F53-F57 HydrophobicContact CE2-CD2 4.09Å; F53-F57 HydrophobicContact CE2-CG 4.47Å; F53-F57 HydrophobicContact CZ-CD2 4.31Å; F53-F57 HydrophobicContact CZ-CG 4.48Å; F53-F57 WeakPolarHBondContact O-CB 3.46Å; F53-F57 PolarHBondContact O-N 3.21Å; F53-L92 WeakPolarHBondContact CD2-O 3.41Å; F53-L95 HydrophobicContact CB-CB 4.48Å; F53-P96 HydrophobicContact CD1-CG 4.29Å; F53-P96 HydrophobicContact CD2-CG 3.95Å; F53-P96 HydrophobicContact CE1-CG 4.37Å; F53-P96 HydrophobicContact CE2-CG 4.05Å; F53-P96 HydrophobicContact CG-CG 4.07Å; F53-P96 HydrophobicContact CZ-CG 4.26Å |
| 54 | I | 92.4 | Very high | 90.6 | Very high | 100 Ų | 100 | 50.5 Ų | 50.5 | 51% | 0.513 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.4 | -54.2 | -177.6 | -67 | 164.6 | 0 | 0 | 0 | 110.9 | S50 L51 V58 | S50-I54 VanDerWaalsContact O-CG1 3.31Å; S50-I54 WeakPolarHBondContact O-CG1 3.26Å; S50-I54 PolarHBondContact O-N 2.85Å; L51-I54 PolarHBondContact O-N 2.9Å; I54-V58 WeakPolarHBondContact O-CB 3.28Å; I54-V58 VanDerWaalsContact O-CG2 3.28Å; I54-V58 WeakPolarHBondContact O-CG2 3.47Å; I54-V58 PolarHBondContact O-N 3.49Å; I54-V58 VanDerWaalsContact O-N 3.11Å |
| 55 | F | 90.7 | Very high | 90.8 | Very high | 131 Ų | 131 | 50.1 Ų | 50.1 | 58% | 0.575 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -67.2 | -42.8 | -177.7 | -79.2 | -77.9 | 0 | 0 | 0 | 112.1 | L51 G59 | L51-F55 HydrophobicContact CD1-CD2 3.92Å; L51-F55 HydrophobicContact CD1-CE2 3.53Å; L51-F55 HydrophobicContact CG-CD2 3.93Å; L51-F55 HydrophobicContact CG-CE2 4Å; L51-F55 WeakPolarHBondContact O-CD2 3.48Å; L51-F55 PolarHBondContact O-N 3.21Å; F55-G59 PolarHBondContact O-N 3.24Å |
| 56 | G | 91.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.5 | -43.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V52 N60 L92 | V52-G56 WeakPolarHBondContact O-CA 3.29Å; V52-G56 PolarHBondContact O-N 2.95Å; G56-N60 VanDerWaalsContact O-CB 3.29Å; G56-N60 WeakPolarHBondContact O-CB 3.39Å; G56-N60 PolarHBondContact O-N 2.96Å; G56-N60 PolarHBondContact O-ND2 3.47Å; G56-L92 WeakPolarHBondContact O-CD1 3.18Å |
| 57 | F | 93.3 | Very high | 90.6 | Very high | 73 Ų | 73 | 47.8 Ų | 47.8 | 32% | 0.32 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -66.2 | -50.3 | -179.4 | -172.7 | -90.4 | 0 | 0 | 0 | 111 | F53 G59 M61 L89 I93 | F53-F57 HydrophobicContact CE2-CB 4.38Å; F53-F57 HydrophobicContact CE2-CD2 4.09Å; F53-F57 HydrophobicContact CE2-CG 4.47Å; F53-F57 HydrophobicContact CZ-CD2 4.31Å; F53-F57 HydrophobicContact CZ-CG 4.48Å; F53-F57 WeakPolarHBondContact O-CB 3.46Å; F53-F57 PolarHBondContact O-N 3.21Å; F57-G59 PolarHBondContact O-N 3.46Å; F57-M61 HydrophobicContact CD1-CG 4.02Å; F57-M61 HydrophobicContact CD2-CE 4.4Å; F57-M61 HydrophobicContact CE1-CE 4.31Å; F57-M61 HydrophobicContact CE1-CG 3.76Å; F57-M61 HydrophobicContact CE2-CE 3.57Å; F57-M61 HydrophobicContact CE2-CG 4.34Å; F57-M61 HydrophobicContact CG-CG 4.42Å; F57-M61 HydrophobicContact CZ-CE 3.53Å; F57-M61 HydrophobicContact CZ-CG 3.94Å; F57-M61 WeakPolarHBondContact O-CB 3.44Å; F57-M61 VanDerWaalsContact O-CG 3.24Å; F57-M61 WeakPolarHBondContact O-CG 3.36Å; F57-M61 PolarHBondContact O-N 3.29Å; F57-L89 HydrophobicContact CD2-CD2 3.9Å; F57-L89 HydrophobicContact CE2-CD2 4.32Å; F57-L89 HydrophobicContact CG-CD2 4.45Å; F57-I93 HydrophobicContact CE2-CG2 4.48Å |
| 58 | V | 91.3 | Very high | 90.5 | Very high | 90 Ų | 90 | 47.9 Ų | 47.9 | 55% | 0.545 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -60.9 | -46.2 | 178.2 | 174.3 | 0 | 0 | 0 | 0 | 110.7 | I54 L62 | I54-V58 WeakPolarHBondContact O-CB 3.28Å; I54-V58 VanDerWaalsContact O-CG2 3.28Å; I54-V58 WeakPolarHBondContact O-CG2 3.47Å; I54-V58 PolarHBondContact O-N 3.49Å; I54-V58 VanDerWaalsContact O-N 3.11Å; V58-L62 VanDerWaalsContact O-CB 3.29Å; V58-L62 WeakPolarHBondContact O-CB 3.42Å; V58-L62 PolarHBondContact O-N 3.46Å |
| 59 | G | 90.1 | Very high | 90.2 | Very high | 12 Ų | 12 | 50.1 Ų | 50.1 | 12% | 0.124 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.8 | -51.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | F55 F57 L62 V63 | F55-G59 PolarHBondContact O-N 3.24Å; F57-G59 PolarHBondContact O-N 3.46Å; G59-L62 PolarHBondContact O-N 3.29Å; G59-V63 WeakPolarHBondContact O-CG2 3.35Å; G59-V63 PolarHBondContact O-N 3.28Å; G59-V63 VanDerWaalsContact O-N 3.09Å |
| 60 | N | 92.7 | Very high | 89.6 | Confident | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -71.3 | -35.9 | -177.9 | -73.8 | -66.3 | 0 | 0 | 0 | 112.3 | G56 L62 V63 V64 D88 L89 C298 P302 | G56-N60 VanDerWaalsContact O-CB 3.29Å; G56-N60 WeakPolarHBondContact O-CB 3.39Å; G56-N60 PolarHBondContact O-N 2.96Å; G56-N60 PolarHBondContact O-ND2 3.47Å; N60-L62 VanDerWaalsContact C-N 3.32Å; N60-L62 PolarHBondContact O-N 3.05Å; N60-V63 WeakPolarHBondContact O-CB 3.47Å; N60-V63 PolarHBondContact O-N 2.92Å; N60-V64 WeakPolarHBondContact O-CG2 3.46Å; N60-V64 PolarHBondContact O-N 3.43Å; N60-D88 PolarHBondContact OD1-OD2 2.96Å; N60-L89 HydrophobicContact CB-CD1 4.44Å; N60-L89 HydrophobicContact CB-CD2 3.79Å; N60-L89 HydrophobicContact CB-CG 3.83Å; N60-C298 PolarHBondContact ND2-O 3.09Å; N60-P302 HydrophobicContact CB-CG 4.43Å; N60-P302 WeakPolarHBondContact OD1-CG 3.38Å |
| 61 | M | 92.3 | Very high | 89 | Confident | 68 Ų | 68 | 51.8 Ų | 51.8 | 34% | 0.335 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62 | -40.8 | 172.4 | -77.6 | -59.7 | 177.3 | 0 | 0 | 111.9 | F57 V63 V64 L65 L89 | F57-M61 HydrophobicContact CD1-CG 4.02Å; F57-M61 HydrophobicContact CD2-CE 4.4Å; F57-M61 HydrophobicContact CE1-CE 4.31Å; F57-M61 HydrophobicContact CE1-CG 3.76Å; F57-M61 HydrophobicContact CE2-CE 3.57Å; F57-M61 HydrophobicContact CE2-CG 4.34Å; F57-M61 HydrophobicContact CG-CG 4.42Å; F57-M61 HydrophobicContact CZ-CE 3.53Å; F57-M61 HydrophobicContact CZ-CG 3.94Å; F57-M61 WeakPolarHBondContact O-CB 3.44Å; F57-M61 VanDerWaalsContact O-CG 3.24Å; F57-M61 WeakPolarHBondContact O-CG 3.36Å; F57-M61 PolarHBondContact O-N 3.29Å; M61-V63 VanDerWaalsContact C-N 3.32Å; M61-V63 PolarHBondContact O-N 3.4Å; M61-V64 WeakPolarHBondContact O-CB 3.3Å; M61-V64 PolarHBondContact O-N 3.36Å; M61-L65 WeakPolarHBondContact O-CG 3.32Å; M61-L65 PolarHBondContact O-N 3.46Å; M61-L89 HydrophobicContact CE-CD1 3.6Å; M61-L89 HydrophobicContact CE-CD2 3.84Å; M61-L89 HydrophobicContact CE-CG 4.27Å; M61-L89 HydrophobicContact CG-CD1 4.38Å; M61-L89 HydrophobicContact CG-CD2 4.03Å; M61-L89 HydrophobicContact SD-CD1 3.67Å; M61-L89 HydrophobicContact SD-CD2 4.29Å |
| 62 | L | 89.1 | Confident | 88.6 | Confident | 52 Ų | 52 | 54.1 Ų | 54.1 | 27% | 0.272 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -64.1 | -39 | 176.3 | -174.9 | 50.2 | 0 | 0 | 0 | 111.8 | V58 G59 N60 L65 I66 Y316 | V58-L62 VanDerWaalsContact O-CB 3.29Å; V58-L62 WeakPolarHBondContact O-CB 3.42Å; V58-L62 PolarHBondContact O-N 3.46Å; G59-L62 PolarHBondContact O-N 3.29Å; N60-L62 VanDerWaalsContact C-N 3.32Å; N60-L62 PolarHBondContact O-N 3.05Å; L62-L65 PolarHBondContact O-N 3.15Å; L62-I66 HydrophobicContact CD1-CD1 3.94Å; L62-I66 HydrophobicContact CD1-CG1 4.12Å; L62-I66 HydrophobicContact CG-CD1 3.92Å; L62-I66 WeakPolarHBondContact O-CB 3.23Å; L62-I66 WeakPolarHBondContact O-CG1 3.36Å; L62-I66 PolarHBondContact O-N 3.13Å; L62-Y316 HydrophobicContact CD2-CD1 3.6Å; L62-Y316 HydrophobicContact CD2-CE1 3.13Å; L62-Y316 HydrophobicContact CG-CD1 4.28Å; L62-Y316 HydrophobicContact CG-CE1 3.72Å |
| 63 | V | 89.5 | Confident | 88.3 | Confident | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58.9 | -47.8 | 172.1 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | G59 N60 M61 L65 I66 L67 A85 P302 Y305 | G59-V63 WeakPolarHBondContact O-CG2 3.35Å; G59-V63 PolarHBondContact O-N 3.28Å; G59-V63 VanDerWaalsContact O-N 3.09Å; N60-V63 WeakPolarHBondContact O-CB 3.47Å; N60-V63 PolarHBondContact O-N 2.92Å; M61-V63 VanDerWaalsContact C-N 3.32Å; M61-V63 PolarHBondContact O-N 3.4Å; V63-L65 PolarHBondContact O-N 2.7Å; V63-I66 PolarHBondContact O-N 3.02Å; V63-L67 HydrophobicContact CG1-CD1 3.73Å; V63-L67 HydrophobicContact CG1-CG 4.33Å; V63-L67 WeakPolarHBondContact O-CB 3.42Å; V63-L67 VanDerWaalsContact O-CG 3.24Å; V63-L67 WeakPolarHBondContact O-CG 3.49Å; V63-L67 PolarHBondContact O-N 2.79Å; V63-A85 HydrophobicContact CB-CB 4.42Å; V63-A85 HydrophobicContact CG1-CB 4.01Å; V63-P302 HydrophobicContact CG2-CB 4.29Å; V63-P302 HydrophobicContact CG2-CG 4.4Å; V63-Y305 HydrophobicContact CG1-CD2 4.49Å; V63-Y305 HydrophobicContact CG1-CE2 4.39Å; V63-Y305 HydrophobicContact CG2-CD2 3.81Å; V63-Y305 HydrophobicContact CG2-CE2 4.27Å |
| 64 | V | 91.2 | Very high | 87.7 | Confident | 22 Ų | 22 | 61.1 Ų | 61.1 | 13% | 0.133 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -57.8 | -50.2 | 177 | 171.9 | 0 | 0 | 0 | 0 | 111 | N60 M61 I66 L67 I68 L82 A85 L89 | N60-V64 WeakPolarHBondContact O-CG2 3.46Å; N60-V64 PolarHBondContact O-N 3.43Å; M61-V64 WeakPolarHBondContact O-CB 3.3Å; M61-V64 PolarHBondContact O-N 3.36Å; V64-I66 VanDerWaalsContact C-N 3.34Å; V64-I66 PolarHBondContact O-N 3.25Å; V64-L67 PolarHBondContact O-N 3.47Å; V64-I68 HydrophobicContact CG1-CD1 3.69Å; V64-I68 WeakPolarHBondContact O-CG1 3.38Å; V64-I68 PolarHBondContact O-N 3.14Å; V64-L82 HydrophobicContact CB-CD1 4.3Å; V64-L82 HydrophobicContact CG1-CD1 3.96Å; V64-L82 HydrophobicContact CG2-CD1 4.07Å; V64-A85 HydrophobicContact CG2-CB 3.84Å; V64-L89 HydrophobicContact CG2-CD1 4Å |
| 65 | L | 88.2 | Confident | 87.3 | Confident | 93 Ų | 93 | 58.4 Ų | 58.4 | 49% | 0.487 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.9 | -43.7 | 179.9 | -71.1 | 173.1 | 0 | 0 | 0 | 112 | M61 L62 V63 I68 N69 | M61-L65 WeakPolarHBondContact O-CG 3.32Å; M61-L65 PolarHBondContact O-N 3.46Å; L62-L65 PolarHBondContact O-N 3.15Å; V63-L65 PolarHBondContact O-N 2.7Å; L65-I68 PolarHBondContact O-N 2.91Å; L65-N69 VanDerWaalsContact O-CB 3.23Å; L65-N69 WeakPolarHBondContact O-CB 3.3Å; L65-N69 PolarHBondContact O-N 2.93Å; L65-N69 PolarHBondContact O-ND2 3.02Å |
| 66 | I | 84.9 | Confident | 87.2 | Confident | 2 Ų | 2 | 52.4 Ų | 52.4 | 1% | 0.01 | 27% | 0.269 | C | S | . | . | I | π-helix | trans | -63.4 | -42.9 | 177.7 | -74.6 | 171.2 | 0 | 0 | 0 | 111.1 | L62 V63 V64 C70 K71 F312 L315 Y316 A319 | L62-I66 HydrophobicContact CD1-CD1 3.94Å; L62-I66 HydrophobicContact CD1-CG1 4.12Å; L62-I66 HydrophobicContact CG-CD1 3.92Å; L62-I66 WeakPolarHBondContact O-CB 3.23Å; L62-I66 WeakPolarHBondContact O-CG1 3.36Å; L62-I66 PolarHBondContact O-N 3.13Å; V63-I66 PolarHBondContact O-N 3.02Å; V64-I66 VanDerWaalsContact C-N 3.34Å; V64-I66 PolarHBondContact O-N 3.25Å; I66-C70 WeakPolarHBondContact O-CA 3.27Å; I66-C70 VanDerWaalsContact O-CB 3.26Å; I66-C70 WeakPolarHBondContact O-CB 3.39Å; I66-C70 PolarHBondContact O-N 3.4Å; I66-K71 PolarHBondContact O-N 3.04Å; I66-F312 HydrophobicContact CG2-CD1 4.32Å; I66-F312 HydrophobicContact CG2-CE1 3.93Å; I66-L315 HydrophobicContact CG2-CB 4.42Å; I66-L315 HydrophobicContact CG2-CD2 3.18Å; I66-L315 HydrophobicContact CG2-CG 3.76Å; I66-Y316 HydrophobicContact CD1-CD2 3.65Å; I66-Y316 HydrophobicContact CD1-CE2 3.64Å; I66-Y316 HydrophobicContact CD1-CG 4.14Å; I66-A319 HydrophobicContact CD1-CB 4.28Å; I66-A319 HydrophobicContact CG1-CB 3.98Å |
| 67 | L | 86.1 | Confident | 87 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 28% | 0.275 | C | S | . | . | I | π-helix | trans | -67.2 | -39 | -178.6 | -72.9 | 172.5 | 0 | 0 | 0 | 112.2 | V63 V64 K71 K72 L73 D78 L81 L82 F312 | V63-L67 HydrophobicContact CG1-CD1 3.73Å; V63-L67 HydrophobicContact CG1-CG 4.33Å; V63-L67 WeakPolarHBondContact O-CB 3.42Å; V63-L67 VanDerWaalsContact O-CG 3.24Å; V63-L67 WeakPolarHBondContact O-CG 3.49Å; V63-L67 PolarHBondContact O-N 2.79Å; V64-L67 PolarHBondContact O-N 3.47Å; L67-K71 HydrophobicContact CD2-CG 4.39Å; L67-K71 CarbonylContact O-C 3.02Å; L67-K71 WeakPolarHBondContact O-CB 3.39Å; L67-K72 PolarHBondContact O-N 3.02Å; L67-L73 HydrophobicContact CB-CD2 3.95Å; L67-L73 PolarHBondContact O-N 2.85Å; L67-D78 HydrophobicContact CD2-CB 4.08Å; L67-L81 HydrophobicContact CD1-CB 3.92Å; L67-L82 HydrophobicContact CD1-CB 3.99Å; L67-F312 HydrophobicContact CD2-CZ 4.28Å |
| 68 | I | 87.4 | Confident | 86.8 | Confident | 80 Ų | 80 | 50.6 Ų | 50.6 | 41% | 0.41 | 26% | 0.263 | S | S | . | . | I | π-helix | trans | -77.9 | -53.5 | 179.7 | -64.2 | 173.5 | 0 | 0 | 0 | 110.8 | V64 L65 K72 L82 | V64-I68 HydrophobicContact CG1-CD1 3.69Å; V64-I68 WeakPolarHBondContact O-CG1 3.38Å; V64-I68 PolarHBondContact O-N 3.14Å; L65-I68 PolarHBondContact O-N 2.91Å; I68-K72 WeakPolarHBondContact O-CA 3.37Å; I68-K72 PolarHBondContact O-N 2.69Å; I68-L82 HydrophobicContact CD1-CD1 4.47Å; I68-L82 HydrophobicContact CG1-CD1 4.46Å |
| 69 | N | 83.1 | Confident | 86.8 | Confident | 99 Ų | 99 | 46.9 Ų | 46.9 | 53% | 0.529 | 24% | 0.24 | S | C | . | . | I | π-helix | trans | -82.3 | -40.8 | -168.8 | -62.5 | -27 | 0 | 0 | 0 | 112.8 | L65 | L65-N69 VanDerWaalsContact O-CB 3.23Å; L65-N69 WeakPolarHBondContact O-CB 3.3Å; L65-N69 PolarHBondContact O-N 2.93Å; L65-N69 PolarHBondContact O-ND2 3.02Å |
| 70 | C | 79.5 | Confident | 86.9 | Confident | 42 Ų | 42 | 46.6 Ų | 46.6 | 28% | 0.284 | 24% | 0.236 | S | C | . | . | I | π-helix | trans | -93.7 | -46.8 | -175.3 | -52 | 0 | 0 | 0 | 0 | 111.9 | I66 L315 | I66-C70 WeakPolarHBondContact O-CA 3.27Å; I66-C70 VanDerWaalsContact O-CB 3.26Å; I66-C70 WeakPolarHBondContact O-CB 3.39Å; I66-C70 PolarHBondContact O-N 3.4Å; C70-L315 HydrophobicContact CB-CD1 3.94Å; C70-L315 HydrophobicContact CB-CD2 4.15Å; C70-L315 HydrophobicContact CB-CG 4.07Å |
| 71 | K | 78.2 | Confident | 86.8 | Confident | 61 Ų | 61 | 47.3 Ų | 47.3 | 27% | 0.265 | 24% | 0.239 | S | C | . | . | S | Bend | trans | -85.7 | -24.9 | -175.9 | -68.3 | -89 | -178 | 156.3 | 0 | 113.5 | I66 L67 L73 L315 | I66-K71 PolarHBondContact O-N 3.04Å; L67-K71 HydrophobicContact CD2-CG 4.39Å; L67-K71 CarbonylContact O-C 3.02Å; L67-K71 WeakPolarHBondContact O-CB 3.39Å; K71-L73 PolarHBondContact O-N 3.44Å; K71-L315 HydrophobicContact CD-CD2 4.31Å; K71-L315 HydrophobicContact CG-CD2 3.92Å |
| 72 | K | 83.7 | Confident | 86.8 | Confident | 146 Ų | 146 | 45.1 Ų | 45.1 | 64% | 0.635 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 53.2 | 31.9 | -178 | -55.6 | -174 | 177.3 | -174.1 | 0 | 113.3 | L67 I68 K74 | L67-K72 PolarHBondContact O-N 3.02Å; I68-K72 WeakPolarHBondContact O-CA 3.37Å; I68-K72 PolarHBondContact O-N 2.69Å; K72-K74 HydrophobicContact CB-CG 4.36Å; K72-K74 PolarHBondContact O-N 3.07Å |
| 73 | L | 83.9 | Confident | 87.2 | Confident | 50 Ų | 50 | 43.6 Ų | 43.6 | 26% | 0.262 | 22% | 0.221 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 47.7 | 39.6 | 174.4 | -53.1 | 175.2 | 0 | 0 | 0 | 114.7 | L67 K71 S75 D78 L82 | L67-L73 HydrophobicContact CB-CD2 3.95Å; L67-L73 PolarHBondContact O-N 2.85Å; K71-L73 PolarHBondContact O-N 3.44Å; L73-S75 VanDerWaalsContact C-N 3.28Å; L73-S75 PolarHBondContact O-N 3.36Å; L73-D78 HydrophobicContact CD2-CB 4.33Å; L73-L82 HydrophobicContact CD1-CD2 3.73Å; L73-L82 HydrophobicContact CD2-CB 4.21Å; L73-L82 HydrophobicContact CD2-CD2 3.88Å; L73-L82 HydrophobicContact CG-CD2 4.47Å |
| 74 | K | 82.2 | Confident | 87.4 | Confident | 163 Ų | 163 | 43.6 Ų | 43.6 | 71% | 0.709 | 22% | 0.221 | S | C | * | . | trans | -76.3 | -12.2 | -172.8 | -68 | -177.5 | 179.6 | -175.2 | 0 | 114.5 | K72 | K72-K74 HydrophobicContact CB-CG 4.36Å; K72-K74 PolarHBondContact O-N 3.07Å | ||
| 75 | S | 84.5 | Confident | 87.5 | Confident | 43 Ų | 43 | 42.6 Ų | 42.6 | 30% | 0.301 | 22% | 0.215 | S | C | . | . | S | Bend | trans | -126.2 | 151.7 | -179.4 | 76.7 | 0 | 0 | 0 | 0 | 112.1 | L73 T77 D78 I79 | L73-S75 VanDerWaalsContact C-N 3.28Å; L73-S75 PolarHBondContact O-N 3.36Å; S75-T77 PolarHBondContact O-N 3.4Å; S75-D78 WeakPolarHBondContact CB-OD2 3.21Å; S75-D78 PolarHBondContact N-OD2 3.35Å; S75-D78 WeakPolarHBondContact O-CB 3.17Å; S75-D78 PolarHBondContact O-N 2.91Å; S75-D78 PolarHBondContact OG-N 3.32Å; S75-D78 PolarHBondContact OG-OD2 2.98Å; S75-I79 PolarHBondContact O-N 3.05Å |
| 76 | L | 88.4 | Confident | 87.9 | Confident | 5 Ų | 5 | 41 Ų | 41 | 3% | 0.026 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -55.9 | -36.2 | 175.6 | 174.7 | 155.2 | 0 | 0 | 0 | 112.3 | D78 I79 Y80 D137 R152 F156 | L76-D78 VanDerWaalsContact C-N 3.34Å; L76-D78 PolarHBondContact O-N 3.07Å; L76-I79 WeakPolarHBondContact O-CB 3.38Å; L76-I79 PolarHBondContact O-N 2.9Å; L76-Y80 HydrophobicContact CD2-CD2 3.66Å; L76-Y80 HydrophobicContact CD2-CE1 4.48Å; L76-Y80 HydrophobicContact CD2-CE2 3.23Å; L76-Y80 HydrophobicContact CD2-CG 4.45Å; L76-Y80 HydrophobicContact CG-CE1 4.5Å; L76-Y80 HydrophobicContact CG-CE2 4.04Å; L76-Y80 PolarHBondContact O-N 2.94Å; L76-Y80 VanDerWaalsContact O-N 3.14Å; L76-D137 HydrophobicContact CD2-CB 3.99Å; L76-D137 VanDerWaalsContact CD2-OD1 3.3Å; L76-D137 WeakPolarHBondContact CD2-OD1 3.07Å; L76-R152 HydrophobicContact CD1-CB 4.44Å; L76-F156 HydrophobicContact CD1-CD1 3.74Å; L76-F156 HydrophobicContact CD1-CE1 4.48Å |
| 77 | T | 87.4 | Confident | 88.5 | Confident | 20 Ų | 20 | 41 Ų | 41 | 12% | 0.123 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.5 | -37.8 | 175.3 | -50.3 | 0 | 0 | 0 | 0 | 112.3 | S75 I79 Y80 L81 L134 D137 R138 R152 | S75-T77 PolarHBondContact O-N 3.4Å; T77-I79 VanDerWaalsContact C-N 3.26Å; T77-I79 PolarHBondContact O-N 3.35Å; T77-Y80 PolarHBondContact O-N 3.24Å; T77-L81 HydrophobicContact CG2-CD1 4.13Å; T77-L81 HydrophobicContact CG2-CG 4.39Å; T77-L81 WeakPolarHBondContact O-CB 3.34Å; T77-L81 VanDerWaalsContact O-CG 3.29Å; T77-L81 WeakPolarHBondContact O-CG 3.46Å; T77-L81 PolarHBondContact O-N 3.46Å; T77-L134 HydrophobicContact CG2-CD2 3.81Å; T77-D137 PolarHBondContact OG1-OD2 2.87Å; T77-R138 PolarHBondContact OG1-NH2 3.46Å; T77-R152 PolarHBondContact OG1-NH2 2.97Å |
| 78 | D | 88.3 | Confident | 88.9 | Confident | 15 Ų | 15 | 41.3 Ų | 41.3 | 8% | 0.08 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.5 | -34.6 | 177.3 | -58.7 | -43.3 | 0 | 0 | 0 | 110.9 | L67 L73 S75 L76 L82 | L67-D78 HydrophobicContact CD2-CB 4.08Å; L73-D78 HydrophobicContact CD2-CB 4.33Å; S75-D78 WeakPolarHBondContact CB-OD2 3.21Å; S75-D78 PolarHBondContact N-OD2 3.35Å; S75-D78 WeakPolarHBondContact O-CB 3.17Å; S75-D78 PolarHBondContact O-N 2.91Å; S75-D78 PolarHBondContact OG-N 3.32Å; S75-D78 PolarHBondContact OG-OD2 2.98Å; L76-D78 VanDerWaalsContact C-N 3.34Å; L76-D78 PolarHBondContact O-N 3.07Å; D78-L82 WeakPolarHBondContact O-CB 3.45Å; D78-L82 PolarHBondContact O-N 3.29Å |
| 79 | I | 92 | Very high | 89.3 | Confident | 12 Ų | 12 | 38.3 Ų | 38.3 | 6% | 0.062 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.2 | -46.5 | 175.5 | -59.5 | 169.2 | 0 | 0 | 0 | 110.9 | S75 L76 T77 L82 N83 V154 V158 | S75-I79 PolarHBondContact O-N 3.05Å; L76-I79 WeakPolarHBondContact O-CB 3.38Å; L76-I79 PolarHBondContact O-N 2.9Å; T77-I79 VanDerWaalsContact C-N 3.26Å; T77-I79 PolarHBondContact O-N 3.35Å; I79-L82 WeakPolarHBondContact O-CB 3.44Å; I79-L82 PolarHBondContact O-N 3.5Å; I79-N83 PolarHBondContact O-N 3.14Å; I79-N83 PolarHBondContact O-ND2 3.37Å; I79-V154 HydrophobicContact CD1-CB 4.11Å; I79-V154 HydrophobicContact CD1-CG1 3.78Å; I79-V154 HydrophobicContact CD1-CG2 4.23Å; I79-V158 HydrophobicContact CD1-CG2 4.37Å |
| 80 | Y | 92.5 | Very high | 89.9 | Confident | 6 Ų | 6 | 35.7 Ų | 35.7 | 2% | 0.024 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -67.6 | -38 | 178.7 | -65.2 | -16.6 | 0 | 0 | 0 | 112.4 | L76 T77 L82 N83 L84 F130 L133 L134 D137 T160 | L76-Y80 HydrophobicContact CD2-CD2 3.66Å; L76-Y80 HydrophobicContact CD2-CE1 4.48Å; L76-Y80 HydrophobicContact CD2-CE2 3.23Å; L76-Y80 HydrophobicContact CD2-CG 4.45Å; L76-Y80 HydrophobicContact CG-CE1 4.5Å; L76-Y80 HydrophobicContact CG-CE2 4.04Å; L76-Y80 PolarHBondContact O-N 2.94Å; L76-Y80 VanDerWaalsContact O-N 3.14Å; T77-Y80 PolarHBondContact O-N 3.24Å; Y80-L82 VanDerWaalsContact C-N 3.31Å; Y80-L82 PolarHBondContact O-N 3.03Å; Y80-N83 PolarHBondContact O-N 3.17Å; Y80-L84 WeakPolarHBondContact O-CB 3.5Å; Y80-L84 PolarHBondContact O-N 2.9Å; Y80-F130 HydrophobicContact CD1-CD1 4.27Å; Y80-F130 HydrophobicContact CD1-CE1 4.41Å; Y80-L133 HydrophobicContact CD1-CD1 4.47Å; Y80-L133 HydrophobicContact CD2-CB 3.92Å; Y80-L133 HydrophobicContact CE1-CD1 4.08Å; Y80-L133 HydrophobicContact CE2-CB 3.74Å; Y80-L133 HydrophobicContact CG-CB 4.42Å; Y80-L134 HydrophobicContact CD2-CD2 4.27Å; Y80-L134 HydrophobicContact CD2-CG 4.44Å; Y80-D137 HydrophobicContact CD2-CB 4.47Å; Y80-D137 HydrophobicContact CE2-CB 4.25Å; Y80-T160 WeakPolarHBondContact CE1-OG1 3.46Å; Y80-T160 PolarHBondContact OH-OG1 3.08Å |
| 81 | L | 90.6 | Very high | 90.6 | Very high | 14 Ų | 14 | 34 Ų | 34 | 7% | 0.073 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.5 | -37.6 | 172.8 | -71.5 | 173 | 0 | 0 | 0 | 112 | L67 T77 L84 A85 L134 Y305 F312 | L67-L81 HydrophobicContact CD1-CB 3.92Å; T77-L81 HydrophobicContact CG2-CD1 4.13Å; T77-L81 HydrophobicContact CG2-CG 4.39Å; T77-L81 WeakPolarHBondContact O-CB 3.34Å; T77-L81 VanDerWaalsContact O-CG 3.29Å; T77-L81 WeakPolarHBondContact O-CG 3.46Å; T77-L81 PolarHBondContact O-N 3.46Å; L81-L84 PolarHBondContact O-N 3.47Å; L81-A85 PolarHBondContact O-N 2.93Å; L81-L134 HydrophobicContact CD2-CD1 3.88Å; L81-L134 HydrophobicContact CD2-CD2 4.3Å; L81-L134 HydrophobicContact CG-CD2 4.21Å; L81-Y305 HydrophobicContact CD2-CE1 3.81Å; L81-Y305 WeakPolarHBondContact CD2-OH 3.34Å; L81-F312 HydrophobicContact CD1-CE2 4.44Å |
| 82 | L | 93.1 | Very high | 91.4 | Very high | 23 Ų | 23 | 31 Ų | 31 | 12% | 0.12 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.2 | -47.9 | 174.8 | 176.6 | 67 | 0 | 0 | 0 | 111.1 | V64 L67 I68 L73 D78 I79 Y80 L84 A85 I86 | V64-L82 HydrophobicContact CB-CD1 4.3Å; V64-L82 HydrophobicContact CG1-CD1 3.96Å; V64-L82 HydrophobicContact CG2-CD1 4.07Å; L67-L82 HydrophobicContact CD1-CB 3.99Å; I68-L82 HydrophobicContact CD1-CD1 4.47Å; I68-L82 HydrophobicContact CG1-CD1 4.46Å; L73-L82 HydrophobicContact CD1-CD2 3.73Å; L73-L82 HydrophobicContact CD2-CB 4.21Å; L73-L82 HydrophobicContact CD2-CD2 3.88Å; L73-L82 HydrophobicContact CG-CD2 4.47Å; D78-L82 WeakPolarHBondContact O-CB 3.45Å; D78-L82 PolarHBondContact O-N 3.29Å; I79-L82 WeakPolarHBondContact O-CB 3.44Å; I79-L82 PolarHBondContact O-N 3.5Å; Y80-L82 VanDerWaalsContact C-N 3.31Å; Y80-L82 PolarHBondContact O-N 3.03Å; L82-L84 VanDerWaalsContact C-N 3.31Å; L82-L84 PolarHBondContact O-N 3.48Å; L82-A85 PolarHBondContact O-N 3.03Å; L82-I86 HydrophobicContact CD1-CD1 4.3Å; L82-I86 HydrophobicContact CG-CD1 4.01Å; L82-I86 WeakPolarHBondContact O-CG1 3.41Å; L82-I86 PolarHBondContact O-N 3.23Å |
| 83 | N | 96.1 | Very high | 92 | Very high | 19 Ų | 19 | 27.2 Ų | 27.2 | 10% | 0.102 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -66.6 | -33.5 | 179.8 | -75.9 | -79.3 | 0 | 0 | 0 | 112.6 | I79 Y80 I86 S87 F130 S161 W165 | I79-N83 PolarHBondContact O-N 3.14Å; I79-N83 PolarHBondContact O-ND2 3.37Å; Y80-N83 PolarHBondContact O-N 3.17Å; N83-I86 PolarHBondContact O-N 3.26Å; N83-S87 WeakPolarHBondContact O-CB 2.99Å; N83-S87 PolarHBondContact O-N 3.23Å; N83-S87 PolarHBondContact O-OG 3.37Å; N83-F130 HydrophobicContact CB-CD1 3.69Å; N83-F130 HydrophobicContact CB-CD2 3.71Å; N83-F130 HydrophobicContact CB-CE1 3.43Å; N83-F130 VanDerWaalsContact CB-CE1 3.43Å; N83-F130 HydrophobicContact CB-CE2 3.48Å; N83-F130 VanDerWaalsContact CB-CE2 3.48Å; N83-F130 HydrophobicContact CB-CG 3.85Å; N83-F130 HydrophobicContact CB-CZ 3.33Å; N83-S161 PolarHBondContact ND2-OG 3.48Å; N83-W165 PolarHBondContact OD1-NE1 2.93Å |
| 84 | L | 93.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -62.1 | -48.3 | 171.7 | -179.9 | 56.8 | 0 | 0 | 0 | 111 | Y80 L81 L82 I86 S87 D88 G127 F130 I131 L134 Y305 | Y80-L84 WeakPolarHBondContact O-CB 3.5Å; Y80-L84 PolarHBondContact O-N 2.9Å; L81-L84 PolarHBondContact O-N 3.47Å; L82-L84 VanDerWaalsContact C-N 3.31Å; L82-L84 PolarHBondContact O-N 3.48Å; L84-I86 VanDerWaalsContact C-N 3.32Å; L84-I86 PolarHBondContact O-N 3.44Å; L84-S87 WeakPolarHBondContact O-CB 3.31Å; L84-S87 PolarHBondContact O-N 3.28Å; L84-S87 VanDerWaalsContact O-N 3.1Å; L84-D88 PolarHBondContact O-N 2.94Å; L84-G127 WeakPolarHBondContact CD1-O 3.49Å; L84-F130 HydrophobicContact CB-CB 4.15Å; L84-F130 HydrophobicContact CD1-CB 4.49Å; L84-I131 HydrophobicContact CD1-CD1 4.29Å; L84-I131 HydrophobicContact CD1-CG1 3.91Å; L84-I131 HydrophobicContact CD2-CG1 4.01Å; L84-L134 HydrophobicContact CD2-CD1 3.9Å; L84-Y305 VanDerWaalsContact CD2-OH 3.23Å; L84-Y305 WeakPolarHBondContact CD2-OH 3.32Å |
| 85 | A | 94.2 | Very high | 93 | Very high | 1 Ų | 1 | 17 Ų | 17 | 1% | 0.008 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -61.7 | -38.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | V63 V64 L81 L82 D88 L89 | V63-A85 HydrophobicContact CB-CB 4.42Å; V63-A85 HydrophobicContact CG1-CB 4.01Å; V64-A85 HydrophobicContact CG2-CB 3.84Å; L81-A85 PolarHBondContact O-N 2.93Å; L82-A85 PolarHBondContact O-N 3.03Å; A85-D88 PolarHBondContact O-N 3.2Å; A85-L89 WeakPolarHBondContact O-CB 3.46Å; A85-L89 VanDerWaalsContact O-CG 3.23Å; A85-L89 WeakPolarHBondContact O-CG 3.37Å; A85-L89 PolarHBondContact O-N 3.33Å |
| 86 | I | 96.3 | Very high | 93.5 | Very high | 61 Ų | 61 | 17.6 Ų | 17.6 | 31% | 0.313 | 10% | 0.095 | S | C | . | . | H | α-helix | trans | -63.5 | -42.4 | 173.4 | -68.6 | 167.3 | 0 | 0 | 0 | 110.8 | L82 N83 L84 D88 L89 L90 W165 | L82-I86 HydrophobicContact CD1-CD1 4.3Å; L82-I86 HydrophobicContact CG-CD1 4.01Å; L82-I86 WeakPolarHBondContact O-CG1 3.41Å; L82-I86 PolarHBondContact O-N 3.23Å; N83-I86 PolarHBondContact O-N 3.26Å; L84-I86 VanDerWaalsContact C-N 3.32Å; L84-I86 PolarHBondContact O-N 3.44Å; I86-D88 PolarHBondContact O-N 3.03Å; I86-L89 PolarHBondContact O-N 2.88Å; I86-L90 HydrophobicContact CG2-CD1 4.22Å; I86-L90 HydrophobicContact CG2-CG 4.33Å; I86-L90 WeakPolarHBondContact O-CG 3.28Å; I86-L90 PolarHBondContact O-N 3.25Å; I86-W165 HydrophobicContact CB-CZ2 4.35Å; I86-W165 HydrophobicContact CG2-CH2 4.06Å; I86-W165 HydrophobicContact CG2-CZ2 3.86Å |
| 87 | S | 96.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 18.7 Ų | 18.7 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61.4 | -44.4 | 177.9 | -56 | 0 | 0 | 0 | 0 | 111.5 | N83 L84 L90 F91 G123 W165 | N83-S87 WeakPolarHBondContact O-CB 2.99Å; N83-S87 PolarHBondContact O-N 3.23Å; N83-S87 PolarHBondContact O-OG 3.37Å; L84-S87 WeakPolarHBondContact O-CB 3.31Å; L84-S87 PolarHBondContact O-N 3.28Å; L84-S87 VanDerWaalsContact O-N 3.1Å; S87-L90 PolarHBondContact O-N 2.91Å; S87-F91 PolarHBondContact O-N 3.49Å; S87-F91 VanDerWaalsContact O-N 3.11Å; S87-G123 VanDerWaalsContact O-CA 3.3Å; S87-G123 WeakPolarHBondContact O-CA 3.45Å; S87-W165 VanDerWaalsContact OG-CH2 3.28Å; S87-W165 WeakPolarHBondContact OG-CH2 3.42Å |
| 88 | D | 95.2 | Very high | 93.9 | Very high | 8 Ų | 8 | 20 Ų | 20 | 4% | 0.043 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -63.2 | -41.4 | 174.9 | -70 | -34.1 | 0 | 0 | 0 | 111.5 | N60 L84 A85 I86 F91 L92 C298 N301 | N60-D88 PolarHBondContact OD1-OD2 2.96Å; L84-D88 PolarHBondContact O-N 2.94Å; A85-D88 PolarHBondContact O-N 3.2Å; I86-D88 PolarHBondContact O-N 3.03Å; D88-F91 WeakPolarHBondContact O-CB 3.41Å; D88-F91 PolarHBondContact O-N 2.89Å; D88-L92 WeakPolarHBondContact O-CB 3.46Å; D88-L92 VanDerWaalsContact O-CD1 3.32Å; D88-L92 WeakPolarHBondContact O-CD1 3.3Å; D88-L92 WeakPolarHBondContact O-CG 3.49Å; D88-L92 PolarHBondContact O-N 3.42Å; D88-C298 HydrophobicContact CB-CB 4.28Å; D88-N301 PolarHBondContact OD2-ND2 2.81Å |
| 89 | L | 95.9 | Very high | 94 | Very high | 17 Ų | 17 | 19.6 Ų | 19.6 | 9% | 0.089 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -63.7 | -43.8 | 176.5 | -73.3 | 170.2 | 0 | 0 | 0 | 112.5 | F57 N60 M61 V64 A85 I86 F91 L92 I93 | F57-L89 HydrophobicContact CD2-CD2 3.9Å; F57-L89 HydrophobicContact CE2-CD2 4.32Å; F57-L89 HydrophobicContact CG-CD2 4.45Å; N60-L89 HydrophobicContact CB-CD1 4.44Å; N60-L89 HydrophobicContact CB-CD2 3.79Å; N60-L89 HydrophobicContact CB-CG 3.83Å; M61-L89 HydrophobicContact CE-CD1 3.6Å; M61-L89 HydrophobicContact CE-CD2 3.84Å; M61-L89 HydrophobicContact CE-CG 4.27Å; M61-L89 HydrophobicContact CG-CD1 4.38Å; M61-L89 HydrophobicContact CG-CD2 4.03Å; M61-L89 HydrophobicContact SD-CD1 3.67Å; M61-L89 HydrophobicContact SD-CD2 4.29Å; V64-L89 HydrophobicContact CG2-CD1 4Å; A85-L89 WeakPolarHBondContact O-CB 3.46Å; A85-L89 VanDerWaalsContact O-CG 3.23Å; A85-L89 WeakPolarHBondContact O-CG 3.37Å; A85-L89 PolarHBondContact O-N 3.33Å; I86-L89 PolarHBondContact O-N 2.88Å; L89-F91 PolarHBondContact O-N 2.98Å; L89-L92 HydrophobicContact CD2-CD1 4.4Å; L89-L92 PolarHBondContact O-N 2.99Å; L89-I93 WeakPolarHBondContact O-CG1 3.44Å; L89-I93 WeakPolarHBondContact O-CG2 3.41Å; L89-I93 PolarHBondContact O-N 3.3Å |
| 90 | L | 96.1 | Very high | 94 | Very high | 43 Ų | 43 | 22.1 Ų | 22.1 | 23% | 0.225 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59.9 | -35.8 | 175.6 | -70.5 | 175.1 | 0 | 0 | 0 | 111.8 | I86 S87 I93 T94 L119 I122 W165 | I86-L90 HydrophobicContact CG2-CD1 4.22Å; I86-L90 HydrophobicContact CG2-CG 4.33Å; I86-L90 WeakPolarHBondContact O-CG 3.28Å; I86-L90 PolarHBondContact O-N 3.25Å; S87-L90 PolarHBondContact O-N 2.91Å; L90-I93 HydrophobicContact CD2-CD1 4.43Å; L90-I93 WeakPolarHBondContact O-CG1 3.45Å; L90-T94 WeakPolarHBondContact O-CG2 3.16Å; L90-L119 HydrophobicContact CD2-CD2 3.94Å; L90-I122 HydrophobicContact CD1-CG2 4.22Å; L90-W165 HydrophobicContact CD1-CH2 3.63Å; L90-W165 HydrophobicContact CD1-CZ3 3.77Å |
| 91 | F | 94.8 | Very high | 93.9 | Very high | 6 Ų | 6 | 23.2 Ų | 23.2 | 3% | 0.026 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -70.3 | -49.4 | 174 | -173.9 | -87.2 | 0 | 0 | 0 | 111.5 | S87 D88 L89 I93 T94 L95 Y120 W256 M295 C298 | S87-F91 PolarHBondContact O-N 3.49Å; S87-F91 VanDerWaalsContact O-N 3.11Å; D88-F91 WeakPolarHBondContact O-CB 3.41Å; D88-F91 PolarHBondContact O-N 2.89Å; L89-F91 PolarHBondContact O-N 2.98Å; F91-I93 PolarHBondContact O-N 3.25Å; F91-T94 WeakPolarHBondContact O-CB 3.18Å; F91-T94 PolarHBondContact O-N 3.27Å; F91-T94 VanDerWaalsContact O-N 3.08Å; F91-T94 PolarHBondContact O-OG1 3.21Å; F91-L95 HydrophobicContact CE1-CD2 4.14Å; F91-Y120 AromaticContact CD2-CD2 3.92Å; F91-Y120 HydrophobicContact CD2-CD2 3.92Å; F91-Y120 HydrophobicContact CD2-CE2 4.32Å; F91-Y120 HydrophobicContact CD2-CG 4.41Å; F91-Y120 AromaticContact CE2-CD2 3.26Å; F91-Y120 HydrophobicContact CE2-CD2 3.26Å; F91-Y120 AromaticContact CE2-CE2 3.25Å; F91-Y120 HydrophobicContact CE2-CE2 3.25Å; F91-Y120 HydrophobicContact CE2-CG 4.05Å; F91-Y120 AromaticContact CZ-CD2 3.79Å; F91-Y120 HydrophobicContact CZ-CD2 3.79Å; F91-Y120 AromaticContact CZ-CE2 3.53Å; F91-Y120 HydrophobicContact CZ-CE2 3.53Å; F91-W256 HydrophobicContact CE2-CH2 4.31Å; F91-W256 HydrophobicContact CE2-CZ2 4.4Å; F91-W256 HydrophobicContact CZ-CH2 4.26Å; F91-W256 HydrophobicContact CZ-CZ2 4.3Å; F91-M295 HydrophobicContact CE1-CB 3.98Å; F91-M295 HydrophobicContact CE1-CG 4.27Å; F91-M295 HydrophobicContact CZ-CB 4.06Å; F91-M295 HydrophobicContact CZ-CG 3.89Å; F91-M295 HydrophobicContact CZ-SD 4.29Å; F91-C298 HydrophobicContact CD1-CB 4.16Å |
| 92 | L | 94.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -59.6 | -41.3 | -176.2 | -78.6 | 160.2 | 0 | 0 | 0 | 113.2 | V52 F53 G56 D88 L89 T94 L95 C298 | V52-L92 HydrophobicContact CG1-CD2 4.1Å; V52-L92 WeakPolarHBondContact O-CD2 3.5Å; F53-L92 WeakPolarHBondContact CD2-O 3.41Å; G56-L92 WeakPolarHBondContact O-CD1 3.18Å; D88-L92 WeakPolarHBondContact O-CB 3.46Å; D88-L92 VanDerWaalsContact O-CD1 3.32Å; D88-L92 WeakPolarHBondContact O-CD1 3.3Å; D88-L92 WeakPolarHBondContact O-CG 3.49Å; D88-L92 PolarHBondContact O-N 3.42Å; L89-L92 HydrophobicContact CD2-CD1 4.4Å; L89-L92 PolarHBondContact O-N 2.99Å; L92-T94 PolarHBondContact O-N 2.98Å; L92-L95 HydrophobicContact CD2-CD1 3.85Å; L92-L95 WeakPolarHBondContact O-CB 3.45Å; L92-L95 PolarHBondContact O-N 3.05Å; L92-C298 HydrophobicContact CD2-CB 4.4Å; L92-C298 WeakPolarHBondContact CD2-SG 3.34Å; L92-C298 HydrophobicContact CG-CB 4.17Å |
| 93 | I | 95.4 | Very high | 93.4 | Very high | 65 Ų | 65 | 25 Ų | 25 | 33% | 0.333 | 14% | 0.143 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.9 | -15.2 | 179.2 | 60.4 | 173.7 | 0 | 0 | 0 | 113.1 | F57 L89 L90 F91 L119 | F57-I93 HydrophobicContact CE2-CG2 4.48Å; L89-I93 WeakPolarHBondContact O-CG1 3.44Å; L89-I93 WeakPolarHBondContact O-CG2 3.41Å; L89-I93 PolarHBondContact O-N 3.3Å; L90-I93 HydrophobicContact CD2-CD1 4.43Å; L90-I93 WeakPolarHBondContact O-CG1 3.45Å; F91-I93 PolarHBondContact O-N 3.25Å; I93-L119 HydrophobicContact CD1-CD1 3.99Å |
| 94 | T | 94.8 | Very high | 93 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 16% | 0.162 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.8 | -25.1 | 175.5 | 75.3 | 0 | 0 | 0 | 0 | 113.5 | L90 F91 L92 P96 L97 W98 F116 L119 | L90-T94 WeakPolarHBondContact O-CG2 3.16Å; F91-T94 WeakPolarHBondContact O-CB 3.18Å; F91-T94 PolarHBondContact O-N 3.27Å; F91-T94 VanDerWaalsContact O-N 3.08Å; F91-T94 PolarHBondContact O-OG1 3.21Å; L92-T94 PolarHBondContact O-N 2.98Å; T94-P96 VanDerWaalsContact C-CD 3.48Å; T94-L97 PolarHBondContact O-N 3.24Å; T94-L97 VanDerWaalsContact O-N 3.11Å; T94-W98 PolarHBondContact O-N 3.35Å; T94-W98 PolarHBondContact OG1-NE1 3.06Å; T94-F116 HydrophobicContact CG2-CD1 3.79Å; T94-F116 HydrophobicContact CG2-CE1 4.5Å; T94-L119 HydrophobicContact CG2-CB 3.57Å; T94-L119 HydrophobicContact CG2-CD1 4.4Å |
| 95 | L | 92.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -58.1 | -38.6 | -174.3 | -64.3 | -177 | 0 | 0 | 0 | 114.6 | Y49 V52 F53 F91 L92 L97 W98 A99 M295 | Y49-L95 HydrophobicContact CG-CD2 4.48Å; V52-L95 HydrophobicContact CB-CD1 4.05Å; V52-L95 HydrophobicContact CG1-CD1 3.59Å; F53-L95 HydrophobicContact CB-CB 4.48Å; F91-L95 HydrophobicContact CE1-CD2 4.14Å; L92-L95 HydrophobicContact CD2-CD1 3.85Å; L92-L95 WeakPolarHBondContact O-CB 3.45Å; L92-L95 PolarHBondContact O-N 3.05Å; L95-L97 VanDerWaalsContact C-N 3.27Å; L95-L97 PolarHBondContact O-N 3.39Å; L95-W98 PolarHBondContact O-N 3.49Å; L95-A99 VanDerWaalsContact O-CB 3.31Å; L95-A99 WeakPolarHBondContact O-CB 3.42Å; L95-A99 PolarHBondContact O-N 3.46Å; L95-M295 HydrophobicContact CD2-CB 4.46Å; L95-M295 HydrophobicContact CD2-SD 3.7Å |
| 96 | P | 93.8 | Very high | 92.8 | Very high | 54 Ų | 54 | 32.3 Ų | 32.3 | 35% | 0.351 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -60.1 | -35.4 | 177 | -26 | 36.1 | 0 | 0 | 0 | 113.5 | F53 T94 H100 | F53-P96 HydrophobicContact CD1-CG 4.29Å; F53-P96 HydrophobicContact CD2-CG 3.95Å; F53-P96 HydrophobicContact CE1-CG 4.37Å; F53-P96 HydrophobicContact CE2-CG 4.05Å; F53-P96 HydrophobicContact CG-CG 4.07Å; F53-P96 HydrophobicContact CZ-CG 4.26Å; T94-P96 VanDerWaalsContact C-CD 3.48Å; P96-H100 PolarHBondContact O-N 3.48Å |
| 97 | L | 93.6 | Very high | 92.7 | Very high | 28 Ų | 28 | 33 Ų | 33 | 15% | 0.147 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -74.4 | -39 | 177.7 | -81.8 | 73.3 | 0 | 0 | 0 | 111.3 | T94 L95 A99 H100 S101 W106 F108 F116 | T94-L97 PolarHBondContact O-N 3.24Å; T94-L97 VanDerWaalsContact O-N 3.11Å; L95-L97 VanDerWaalsContact C-N 3.27Å; L95-L97 PolarHBondContact O-N 3.39Å; L97-A99 VanDerWaalsContact C-N 3.32Å; L97-H100 PolarHBondContact O-N 2.83Å; L97-S101 WeakPolarHBondContact O-CB 3.44Å; L97-S101 PolarHBondContact O-N 3.42Å; L97-W106 HydrophobicContact CB-CH2 4.16Å; L97-W106 HydrophobicContact CB-CZ3 4.17Å; L97-W106 HydrophobicContact CD2-CH2 3.82Å; L97-W106 HydrophobicContact CD2-CZ2 4.43Å; L97-F108 HydrophobicContact CB-CE2 4.35Å; L97-F108 HydrophobicContact CD2-CD1 4.48Å; L97-F108 HydrophobicContact CD2-CD2 4.03Å; L97-F108 HydrophobicContact CD2-CE2 4.27Å; L97-F108 HydrophobicContact CD2-CG 4.15Å; L97-F108 HydrophobicContact CG-CD2 4.24Å; L97-F108 HydrophobicContact CG-CE2 3.96Å; L97-F108 HydrophobicContact CG-CZ 4.13Å; L97-F116 HydrophobicContact CB-CD1 4.41Å; L97-F116 HydrophobicContact CD1-CD1 4.28Å; L97-F116 HydrophobicContact CD1-CE1 3.59Å; L97-F116 HydrophobicContact CD1-CZ 3.76Å; L97-F116 HydrophobicContact CD2-CD1 3.76Å; L97-F116 HydrophobicContact CD2-CD2 3.63Å; L97-F116 HydrophobicContact CD2-CE1 3.64Å; L97-F116 HydrophobicContact CD2-CE2 3.49Å; L97-F116 VanDerWaalsContact CD2-CE2 3.49Å; L97-F116 HydrophobicContact CD2-CG 3.76Å; L97-F116 HydrophobicContact CD2-CZ 3.5Å; L97-F116 VanDerWaalsContact CD2-CZ 3.5Å; L97-F116 HydrophobicContact CG-CD1 4.37Å; L97-F116 HydrophobicContact CG-CE1 4.11Å; L97-F116 HydrophobicContact CG-CZ 4.25Å |
| 98 | W | 91.2 | Very high | 92.5 | Very high | 48 Ų | 48 | 36.9 Ų | 36.9 | 18% | 0.182 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.9 | -37.2 | 173.1 | -61.8 | 122.9 | 0 | 0 | 0 | 112 | Y49 T94 L95 S101 A102 W106 | Y49-W98 HydrophobicContact CD2-CB 4.09Å; Y49-W98 HydrophobicContact CE2-CB 3.93Å; T94-W98 PolarHBondContact O-N 3.35Å; T94-W98 PolarHBondContact OG1-NE1 3.06Å; L95-W98 PolarHBondContact O-N 3.49Å; W98-S101 PolarHBondContact O-N 2.87Å; W98-A102 WeakPolarHBondContact O-CB 3.29Å; W98-A102 PolarHBondContact O-N 3.48Å; W98-W106 HydrophobicContact CZ3-CZ3 4.4Å |
| 99 | A | 90.9 | Very high | 92.5 | Very high | 7 Ų | 7 | 37.5 Ų | 37.5 | 6% | 0.058 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.9 | -46.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | P46 Y49 L95 L97 A102 A103 | P46-A99 HydrophobicContact CB-CB 4.36Å; Y49-A99 HydrophobicContact CD2-CB 4.14Å; L95-A99 VanDerWaalsContact O-CB 3.31Å; L95-A99 WeakPolarHBondContact O-CB 3.42Å; L95-A99 PolarHBondContact O-N 3.46Å; L97-A99 VanDerWaalsContact C-N 3.32Å; A99-A102 PolarHBondContact O-N 3.39Å; A99-A103 PolarHBondContact O-N 3.01Å |
| 100 | H | 92.4 | Very high | 92.4 | Very high | 65 Ų | 65 | 40 Ų | 40 | 30% | 0.301 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -61.1 | -46.4 | 174.7 | 178.6 | -82.3 | 0 | 0 | 0 | 111.6 | P96 L97 A102 A103 N104 F108 | P96-H100 PolarHBondContact O-N 3.48Å; L97-H100 PolarHBondContact O-N 2.83Å; H100-A102 PolarHBondContact O-N 3.31Å; H100-A103 PolarHBondContact O-N 2.93Å; H100-N104 PolarHBondContact O-N 3.44Å; H100-F108 HydrophobicContact CB-CE2 4.43Å; H100-F108 HydrophobicContact CB-CZ 4.44Å; H100-F108 AromaticContact ND1-CE2 3.73Å; H100-F108 AromaticContact ND1-CZ 3.94Å |
| 101 | S | 89.5 | Confident | 92.4 | Very high | 28 Ų | 28 | 41.7 Ų | 41.7 | 20% | 0.196 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -70.3 | -16.7 | -179.4 | -168.5 | 0 | 0 | 0 | 0 | 114.2 | L97 W98 N104 | L97-S101 WeakPolarHBondContact O-CB 3.44Å; L97-S101 PolarHBondContact O-N 3.42Å; W98-S101 PolarHBondContact O-N 2.87Å; S101-N104 CarbonylContact C-O 3.21Å; S101-N104 VanDerWaalsContact CA-O 3.3Å; S101-N104 WeakPolarHBondContact CA-O 3.29Å |
| 102 | A | 86.3 | Confident | 92.4 | Very high | 28 Ų | 28 | 45.4 Ų | 45.4 | 23% | 0.231 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -79.6 | -33.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | A42 L45 P46 W98 A99 H100 | A42-A102 VanDerWaalsContact CA-O 3.3Å; A42-A102 WeakPolarHBondContact CA-O 3.46Å; A42-A102 WeakPolarHBondContact CB-O 3.42Å; L45-A102 HydrophobicContact CB-CB 3.81Å; L45-A102 HydrophobicContact CD2-CB 4Å; P46-A102 HydrophobicContact CG-CB 4.42Å; W98-A102 WeakPolarHBondContact O-CB 3.29Å; W98-A102 PolarHBondContact O-N 3.48Å; A99-A102 PolarHBondContact O-N 3.39Å; H100-A102 PolarHBondContact O-N 3.31Å |
| 103 | A | 86.5 | Confident | 92.5 | Very high | 47 Ų | 47 | 45.4 Ų | 45.4 | 39% | 0.388 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -87 | -33.1 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | P46 A99 H100 | P46-A103 HydrophobicContact CG-CB 3.9Å; A99-A103 PolarHBondContact O-N 3.01Å; H100-A103 PolarHBondContact O-N 2.93Å |
| 104 | N | 88.1 | Confident | 92.5 | Very high | 95 Ų | 95 | 45 Ų | 45 | 51% | 0.508 | 26% | 0.259 | S | S | . | . | S | Bend | trans | -134.8 | 177.8 | -173.3 | -56.1 | -61.1 | 0 | 0 | 0 | 110.7 | H100 S101 | H100-N104 PolarHBondContact O-N 3.44Å; S101-N104 CarbonylContact C-O 3.21Å; S101-N104 VanDerWaalsContact CA-O 3.3Å; S101-N104 WeakPolarHBondContact CA-O 3.29Å |
| 105 | E | 90.2 | Very high | 92.6 | Very high | 78 Ų | 78 | 49.6 Ų | 49.6 | 36% | 0.364 | 28% | 0.283 | S | S | . | . | trans | -72 | 162.5 | 174.4 | 65.6 | 173.4 | -170.6 | 0 | 0 | 114.2 | V107 V187 | E105-V107 HydrophobicContact CG-CG1 3.83Å; E105-V107 PolarHBondContact O-N 3.39Å; E105-V187 HydrophobicContact CB-CG1 3.85Å | ||
| 106 | W | 93.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 29% | 0.289 | C | S | . | . | trans | -78.8 | 99 | 175.3 | -173.4 | -88 | 0 | 0 | 0 | 112.1 | L97 W98 F108 G109 M112 C113 R181 Y188 C190 | L97-W106 HydrophobicContact CB-CH2 4.16Å; L97-W106 HydrophobicContact CB-CZ3 4.17Å; L97-W106 HydrophobicContact CD2-CH2 3.82Å; L97-W106 HydrophobicContact CD2-CZ2 4.43Å; W98-W106 HydrophobicContact CZ3-CZ3 4.4Å; W106-F108 HydrophobicContact CD2-CD2 4.06Å; W106-F108 AromaticContact CE2-CD2 3.96Å; W106-F108 HydrophobicContact CE3-CD2 4.1Å; W106-F108 AromaticContact CH2-CD2 3.98Å; W106-F108 HydrophobicContact CH2-CD2 3.98Å; W106-F108 HydrophobicContact CZ2-CB 3.82Å; W106-F108 AromaticContact CZ2-CD2 3.92Å; W106-F108 HydrophobicContact CZ2-CD2 3.92Å; W106-F108 HydrophobicContact CZ2-CG 4.3Å; W106-F108 HydrophobicContact CZ3-CD2 4.07Å; W106-G109 PolarHBondContact NE1-O 3.48Å; W106-M112 HydrophobicContact CZ2-CB 4.13Å; W106-C113 VanDerWaalsContact CZ2-CA 3.49Å; W106-C113 HydrophobicContact CZ2-CB 3.98Å; W106-R181 PolarHBondContact O-NE 2.83Å; W106-Y188 WeakPolarHBondContact CB-O 3.26Å; W106-Y188 PolarHBondContact N-O 3.49Å; W106-Y188 WeakPolarHBondContact O-CB 3.33Å; W106-C190 HydrophobicContact CB-CB 4.32Å; W106-C190 HydrophobicContact CD2-CB 3.5Å; W106-C190 HydrophobicContact CE3-CB 3.72Å; W106-C190 HydrophobicContact CG-CB 3.75Å; W106-C190 HydrophobicContact CZ2-CB 4.49Å; W106-C190 HydrophobicContact CZ3-CB 4.3Å | ||
| 107 | V | 94 | Very high | 92.8 | Very high | 77 Ų | 77 | 48.7 Ų | 48.7 | 47% | 0.467 | 27% | 0.274 | S | S | . | . | trans | -95.4 | -10.5 | -178.7 | -60 | 0 | 0 | 0 | 0 | 114.9 | E105 G109 | E105-V107 HydrophobicContact CG-CG1 3.83Å; E105-V107 PolarHBondContact O-N 3.39Å; V107-G109 PolarHBondContact O-N 2.94Å | ||
| 108 | F | 93.2 | Very high | 93 | Very high | 80 Ų | 80 | 47.5 Ų | 47.5 | 35% | 0.351 | 27% | 0.269 | S | S | . | . | S | Bend | trans | -77.9 | -0.7 | -171.2 | -53.3 | -76.1 | 0 | 0 | 0 | 114.9 | L97 H100 W106 M112 | L97-F108 HydrophobicContact CB-CE2 4.35Å; L97-F108 HydrophobicContact CD2-CD1 4.48Å; L97-F108 HydrophobicContact CD2-CD2 4.03Å; L97-F108 HydrophobicContact CD2-CE2 4.27Å; L97-F108 HydrophobicContact CD2-CG 4.15Å; L97-F108 HydrophobicContact CG-CD2 4.24Å; L97-F108 HydrophobicContact CG-CE2 3.96Å; L97-F108 HydrophobicContact CG-CZ 4.13Å; H100-F108 HydrophobicContact CB-CE2 4.43Å; H100-F108 HydrophobicContact CB-CZ 4.44Å; H100-F108 AromaticContact ND1-CE2 3.73Å; H100-F108 AromaticContact ND1-CZ 3.94Å; W106-F108 HydrophobicContact CD2-CD2 4.06Å; W106-F108 AromaticContact CE2-CD2 3.96Å; W106-F108 HydrophobicContact CE3-CD2 4.1Å; W106-F108 AromaticContact CH2-CD2 3.98Å; W106-F108 HydrophobicContact CH2-CD2 3.98Å; W106-F108 HydrophobicContact CZ2-CB 3.82Å; W106-F108 AromaticContact CZ2-CD2 3.92Å; W106-F108 HydrophobicContact CZ2-CD2 3.92Å; W106-F108 HydrophobicContact CZ2-CG 4.3Å; W106-F108 HydrophobicContact CZ3-CD2 4.07Å; F108-M112 HydrophobicContact CB-CB 3.69Å; F108-M112 HydrophobicContact CB-CG 4.07Å; F108-M112 WeakPolarHBondContact O-CB 3.49Å; F108-M112 VanDerWaalsContact O-CG 3.29Å; F108-M112 WeakPolarHBondContact O-CG 3.49Å |
| 109 | G | 94.3 | Very high | 93.3 | Very high | 21 Ų | 21 | 46.9 Ų | 46.9 | 22% | 0.216 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | 80.2 | 172.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | W106 V107 C113 | W106-G109 PolarHBondContact NE1-O 3.48Å; V107-G109 PolarHBondContact O-N 2.94Å; G109-C113 PolarHBondContact O-N 2.9Å |
| 110 | N | 94.9 | Very high | 93.5 | Very high | 70 Ų | 70 | 47.1 Ų | 47.1 | 37% | 0.374 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -71.3 | -34.5 | -173.5 | -171.4 | 54.7 | 0 | 0 | 0 | 113.1 | C113 K114 K180 R181 | N110-C113 WeakPolarHBondContact O-CB 3.29Å; N110-C113 PolarHBondContact O-N 3.25Å; N110-K114 PolarHBondContact O-N 3.48Å; N110-K114 VanDerWaalsContact O-N 3.08Å; N110-K180 WeakPolarHBondContact OD1-CA 3.39Å; N110-R181 HydrophobicContact CB-CB 4.12Å; N110-R181 PolarHBondContact OD1-N 3.09Å |
| 111 | A | 95 | Very high | 93.7 | Very high | 79 Ų | 79 | 44.7 Ų | 44.7 | 65% | 0.653 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -62.8 | -46.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | K114 L115 | A111-K114 PolarHBondContact O-N 3.3Å; A111-L115 WeakPolarHBondContact O-CB 3.35Å; A111-L115 PolarHBondContact O-N 3.01Å |
| 112 | M | 95.6 | Very high | 94.1 | Very high | 84 Ų | 84 | 44.7 Ų | 44.7 | 41% | 0.414 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -65.9 | -38.9 | 175.9 | -68.6 | -61.1 | -177.7 | 0 | 0 | 111.8 | W106 F108 K114 L115 F116 | W106-M112 HydrophobicContact CZ2-CB 4.13Å; F108-M112 HydrophobicContact CB-CB 3.69Å; F108-M112 HydrophobicContact CB-CG 4.07Å; F108-M112 WeakPolarHBondContact O-CB 3.49Å; F108-M112 VanDerWaalsContact O-CG 3.29Å; F108-M112 WeakPolarHBondContact O-CG 3.49Å; M112-K114 PolarHBondContact O-N 2.7Å; M112-L115 PolarHBondContact O-N 2.94Å; M112-L115 HydrophobicContact SD-CD2 4.08Å; M112-F116 HydrophobicContact CB-CD2 4.34Å; M112-F116 WeakPolarHBondContact O-CB 3.3Å; M112-F116 VanDerWaalsContact O-CD2 3.31Å; M112-F116 WeakPolarHBondContact O-CD2 3.35Å; M112-F116 PolarHBondContact O-N 2.63Å; M112-F116 HydrophobicContact SD-CD2 4.27Å; M112-F116 HydrophobicContact SD-CE2 3.85Å |
| 113 | C | 96.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -54.3 | -52.8 | 175.2 | 174.7 | 0 | 0 | 0 | 0 | 110.6 | W106 G109 N110 L115 T117 K180 C190 | W106-C113 VanDerWaalsContact CZ2-CA 3.49Å; W106-C113 HydrophobicContact CZ2-CB 3.98Å; G109-C113 PolarHBondContact O-N 2.9Å; N110-C113 WeakPolarHBondContact O-CB 3.29Å; N110-C113 PolarHBondContact O-N 3.25Å; C113-L115 PolarHBondContact O-N 3.34Å; C113-T117 WeakPolarHBondContact O-CB 3.47Å; C113-T117 PolarHBondContact O-N 3.14Å; C113-T117 PolarHBondContact O-OG1 2.83Å; C113-K180 VanDerWaalsContact SG-C 3.56Å; C113-C190 WeakPolarHBondContact CA-SG 3.26Å; C113-C190 HydrophobicContact CB-CB 3.85Å; C113-C190 WeakPolarHBondContact CB-SG 3.4Å; C113-C190 VanDerWaalsContact SG-CA 3.58Å; C113-C190 WeakPolarHBondContact SG-CB 3.44Å; C113-C190 CovalentContact SG-SG 2.03Å; C113-C190 PolarHBondContact SG-SG 3.33Å |
| 114 | K | 96.4 | Very high | 94.9 | Very high | 57 Ų | 57 | 41.6 Ų | 41.6 | 25% | 0.248 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.2 | -42.2 | 177.9 | -70.9 | -174.6 | 172.2 | -61 | 0 | 113.6 | N110 A111 M112 G118 I176 I177 T179 | N110-K114 PolarHBondContact O-N 3.48Å; N110-K114 VanDerWaalsContact O-N 3.08Å; A111-K114 PolarHBondContact O-N 3.3Å; M112-K114 PolarHBondContact O-N 2.7Å; K114-G118 PolarHBondContact O-N 3.22Å; K114-I176 HydrophobicContact CB-CG2 4.28Å; K114-I176 PolarHBondContact NZ-O 3.35Å; K114-I177 PolarHBondContact NZ-O 3.36Å; K114-T179 WeakPolarHBondContact CG-O 3.47Å; K114-T179 PolarHBondContact NZ-O 3.21Å |
| 115 | L | 96.4 | Very high | 95.3 | Very high | 95 Ų | 95 | 37.1 Ų | 37.1 | 50% | 0.497 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -62.2 | -49.6 | 179.6 | 177.5 | 63.4 | 0 | 0 | 0 | 111.6 | A111 M112 C113 G118 L119 | A111-L115 WeakPolarHBondContact O-CB 3.35Å; A111-L115 PolarHBondContact O-N 3.01Å; M112-L115 PolarHBondContact O-N 2.94Å; M112-L115 HydrophobicContact SD-CD2 4.08Å; C113-L115 PolarHBondContact O-N 3.34Å; L115-G118 WeakPolarHBondContact O-CA 3.48Å; L115-G118 PolarHBondContact O-N 3.03Å; L115-G118 VanDerWaalsContact O-N 3.11Å; L115-L119 HydrophobicContact CG-CD1 4.46Å; L115-L119 WeakPolarHBondContact O-CG 3.44Å; L115-L119 PolarHBondContact O-N 3.48Å |
| 116 | F | 96 | Very high | 95.6 | Very high | 29 Ų | 29 | 33.4 Ų | 33.4 | 13% | 0.127 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -72.1 | -33.4 | -177.1 | -83.1 | -96.6 | 0 | 0 | 0 | 112.5 | T94 L97 M112 G118 L119 Y120 | T94-F116 HydrophobicContact CG2-CD1 3.79Å; T94-F116 HydrophobicContact CG2-CE1 4.5Å; L97-F116 HydrophobicContact CB-CD1 4.41Å; L97-F116 HydrophobicContact CD1-CD1 4.28Å; L97-F116 HydrophobicContact CD1-CE1 3.59Å; L97-F116 HydrophobicContact CD1-CZ 3.76Å; L97-F116 HydrophobicContact CD2-CD1 3.76Å; L97-F116 HydrophobicContact CD2-CD2 3.63Å; L97-F116 HydrophobicContact CD2-CE1 3.64Å; L97-F116 HydrophobicContact CD2-CE2 3.49Å; L97-F116 VanDerWaalsContact CD2-CE2 3.49Å; L97-F116 HydrophobicContact CD2-CG 3.76Å; L97-F116 HydrophobicContact CD2-CZ 3.5Å; L97-F116 VanDerWaalsContact CD2-CZ 3.5Å; L97-F116 HydrophobicContact CG-CD1 4.37Å; L97-F116 HydrophobicContact CG-CE1 4.11Å; L97-F116 HydrophobicContact CG-CZ 4.25Å; M112-F116 HydrophobicContact CB-CD2 4.34Å; M112-F116 WeakPolarHBondContact O-CB 3.3Å; M112-F116 VanDerWaalsContact O-CD2 3.31Å; M112-F116 WeakPolarHBondContact O-CD2 3.35Å; M112-F116 PolarHBondContact O-N 2.63Å; M112-F116 HydrophobicContact SD-CD2 4.27Å; M112-F116 HydrophobicContact SD-CE2 3.85Å; F116-G118 VanDerWaalsContact C-N 3.29Å; F116-G118 PolarHBondContact O-N 2.94Å; F116-L119 HydrophobicContact CD1-CD1 4.49Å; F116-L119 PolarHBondContact O-N 3.02Å; F116-Y120 WeakPolarHBondContact O-CB 3.01Å; F116-Y120 PolarHBondContact O-N 3.3Å |
| 117 | T | 95.9 | Very high | 95.7 | Very high | 6 Ų | 6 | 33.7 Ų | 33.7 | 4% | 0.037 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.8 | -40 | 166.2 | -62 | 0 | 0 | 0 | 0 | 111.7 | C113 Y120 H121 T179 | C113-T117 WeakPolarHBondContact O-CB 3.47Å; C113-T117 PolarHBondContact O-N 3.14Å; C113-T117 PolarHBondContact O-OG1 2.83Å; T117-Y120 PolarHBondContact O-N 2.86Å; T117-H121 PolarHBondContact O-CD2 2.97Å; T117-H121 PolarHBondContact O-N 3.39Å; T117-T179 HydrophobicContact CG2-CG2 4.02Å; T117-T179 VanDerWaalsContact OG1-CG2 3.23Å; T117-T179 WeakPolarHBondContact OG1-CG2 3.3Å |
| 118 | G | 97.1 | Very high | 95.7 | Very high | 4 Ų | 4 | 30 Ų | 30 | 4% | 0.041 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.2 | -49.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | K114 L115 F116 Y120 H121 I122 I176 | K114-G118 PolarHBondContact O-N 3.22Å; L115-G118 WeakPolarHBondContact O-CA 3.48Å; L115-G118 PolarHBondContact O-N 3.03Å; L115-G118 VanDerWaalsContact O-N 3.11Å; F116-G118 VanDerWaalsContact C-N 3.29Å; F116-G118 PolarHBondContact O-N 2.94Å; G118-Y120 VanDerWaalsContact C-N 3.32Å; G118-Y120 PolarHBondContact O-N 3.04Å; G118-H121 PolarHBondContact O-N 3.24Å; G118-I122 VanDerWaalsContact O-CB 3.23Å; G118-I122 WeakPolarHBondContact O-CB 3.32Å; G118-I122 WeakPolarHBondContact O-CD1 3.41Å; G118-I122 WeakPolarHBondContact O-CG1 3.48Å; G118-I122 PolarHBondContact O-N 2.79Å; G118-I176 VanDerWaalsContact CA-CG1 3.49Å |
| 119 | L | 97.3 | Very high | 95.9 | Very high | 34 Ų | 34 | 27 Ų | 27 | 18% | 0.178 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59.4 | -41.7 | 176.9 | -68.6 | 173.7 | 0 | 0 | 0 | 112.3 | L90 I93 T94 L115 F116 G123 | L90-L119 HydrophobicContact CD2-CD2 3.94Å; I93-L119 HydrophobicContact CD1-CD1 3.99Å; T94-L119 HydrophobicContact CG2-CB 3.57Å; T94-L119 HydrophobicContact CG2-CD1 4.4Å; L115-L119 HydrophobicContact CG-CD1 4.46Å; L115-L119 WeakPolarHBondContact O-CG 3.44Å; L115-L119 PolarHBondContact O-N 3.48Å; F116-L119 HydrophobicContact CD1-CD1 4.49Å; F116-L119 PolarHBondContact O-N 3.02Å; L119-G123 PolarHBondContact O-N 3.23Å |
| 120 | Y | 95.5 | Very high | 95.9 | Very high | 12 Ų | 12 | 26 Ų | 26 | 5% | 0.047 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -58.3 | -52.5 | 175 | 171.7 | -87.2 | 0 | 0 | 0 | 111.5 | F91 F116 T117 G118 Y124 R206 E291 M295 | F91-Y120 AromaticContact CD2-CD2 3.92Å; F91-Y120 HydrophobicContact CD2-CD2 3.92Å; F91-Y120 HydrophobicContact CD2-CE2 4.32Å; F91-Y120 HydrophobicContact CD2-CG 4.41Å; F91-Y120 AromaticContact CE2-CD2 3.26Å; F91-Y120 HydrophobicContact CE2-CD2 3.26Å; F91-Y120 AromaticContact CE2-CE2 3.25Å; F91-Y120 HydrophobicContact CE2-CE2 3.25Å; F91-Y120 HydrophobicContact CE2-CG 4.05Å; F91-Y120 AromaticContact CZ-CD2 3.79Å; F91-Y120 HydrophobicContact CZ-CD2 3.79Å; F91-Y120 AromaticContact CZ-CE2 3.53Å; F91-Y120 HydrophobicContact CZ-CE2 3.53Å; F116-Y120 WeakPolarHBondContact O-CB 3.01Å; F116-Y120 PolarHBondContact O-N 3.3Å; T117-Y120 PolarHBondContact O-N 2.86Å; G118-Y120 VanDerWaalsContact C-N 3.32Å; G118-Y120 PolarHBondContact O-N 3.04Å; Y120-Y124 VanDerWaalsContact O-CB 3.3Å; Y120-Y124 WeakPolarHBondContact O-CB 3.36Å; Y120-Y124 PolarHBondContact O-N 3.5Å; Y120-R206 PolarHBondContact OH-NH2 2.94Å; Y120-E291 PolarHBondContact OH-OE1 2.85Å; Y120-M295 HydrophobicContact CE2-CE 3.84Å; Y120-M295 HydrophobicContact CE2-SD 4.44Å |
| 121 | H | 95.8 | Very high | 95.8 | Very high | 14 Ų | 14 | 22.8 Ų | 22.8 | 7% | 0.065 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -70.4 | -40.4 | -178.3 | -71.1 | -54.3 | 0 | 0 | 0 | 112.9 | T117 G118 G123 Y124 F125 S172 | T117-H121 PolarHBondContact O-CD2 2.97Å; T117-H121 PolarHBondContact O-N 3.39Å; G118-H121 PolarHBondContact O-N 3.24Å; H121-G123 VanDerWaalsContact C-N 3.35Å; H121-Y124 PolarHBondContact O-N 3.33Å; H121-F125 HydrophobicContact CB-CD2 4.31Å; H121-F125 HydrophobicContact CB-CE2 4.36Å; H121-F125 WeakPolarHBondContact O-CB 3.35Å; H121-F125 VanDerWaalsContact O-CD2 3.23Å; H121-F125 WeakPolarHBondContact O-CD2 3.25Å; H121-F125 PolarHBondContact O-N 3.34Å; H121-S172 VanDerWaalsContact C-OG 3.24Å; H121-S172 VanDerWaalsContact CB-OG 3.26Å; H121-S172 WeakPolarHBondContact CB-OG 3.34Å |
| 122 | I | 97.4 | Very high | 95.7 | Very high | 29 Ų | 29 | 19.7 Ų | 19.7 | 15% | 0.149 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -63.3 | -44 | 178.2 | -71.8 | 167.5 | 0 | 0 | 0 | 109.9 | L90 G118 G126 W165 V169 S172 | L90-I122 HydrophobicContact CD1-CG2 4.22Å; G118-I122 VanDerWaalsContact O-CB 3.23Å; G118-I122 WeakPolarHBondContact O-CB 3.32Å; G118-I122 WeakPolarHBondContact O-CD1 3.41Å; G118-I122 WeakPolarHBondContact O-CG1 3.48Å; G118-I122 PolarHBondContact O-N 2.79Å; I122-G126 WeakPolarHBondContact O-CA 3.45Å; I122-G126 PolarHBondContact O-N 2.94Å; I122-W165 HydrophobicContact CG2-CE3 3.95Å; I122-W165 HydrophobicContact CG2-CZ3 3.55Å; I122-V169 HydrophobicContact CD1-CG2 3.99Å; I122-V169 HydrophobicContact CG1-CG2 4.2Å; I122-S172 WeakPolarHBondContact CG1-OG 3.32Å; I122-S172 PolarHBondContact N-OG 3.48Å; I122-S172 VanDerWaalsContact N-OG 3.16Å |
| 123 | G | 96.3 | Very high | 95.6 | Very high | 2 Ų | 2 | 17.2 Ų | 17.2 | 2% | 0.021 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -63.4 | -44 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S87 L119 H121 G127 | S87-G123 VanDerWaalsContact O-CA 3.3Å; S87-G123 WeakPolarHBondContact O-CA 3.45Å; L119-G123 PolarHBondContact O-N 3.23Å; H121-G123 VanDerWaalsContact C-N 3.35Å; G123-G127 PolarHBondContact O-N 3.44Å |
| 124 | Y | 94.9 | Very high | 95.3 | Very high | 8 Ų | 8 | 17.3 Ų | 17.3 | 3% | 0.031 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -61.3 | -55.6 | 177.2 | 171.7 | -103.1 | 0 | 0 | 0 | 112.8 | Y120 H121 G127 I128 R206 Y252 W256 | Y120-Y124 VanDerWaalsContact O-CB 3.3Å; Y120-Y124 WeakPolarHBondContact O-CB 3.36Å; Y120-Y124 PolarHBondContact O-N 3.5Å; H121-Y124 PolarHBondContact O-N 3.33Å; Y124-G127 PolarHBondContact O-N 3.38Å; Y124-I128 PolarHBondContact O-N 3.43Å; Y124-R206 HydrophobicContact CE1-CG 4.24Å; Y124-Y252 PolarHBondContact OH-OH 2.92Å; Y124-W256 HydrophobicContact CD2-CD2 4.11Å; Y124-W256 AromaticContact CD2-CE2 3.8Å; Y124-W256 HydrophobicContact CD2-CE3 4.18Å; Y124-W256 AromaticContact CD2-CH2 3.66Å; Y124-W256 HydrophobicContact CD2-CH2 3.66Å; Y124-W256 AromaticContact CD2-CZ2 3.57Å; Y124-W256 HydrophobicContact CD2-CZ2 3.57Å; Y124-W256 AromaticContact CD2-CZ3 3.98Å; Y124-W256 HydrophobicContact CD2-CZ3 3.98Å; Y124-W256 AromaticContact CE2-CD2 3.51Å; Y124-W256 HydrophobicContact CE2-CD2 3.51Å; Y124-W256 AromaticContact CE2-CE2 3.67Å; Y124-W256 AromaticContact CE2-CE3 3.55Å; Y124-W256 HydrophobicContact CE2-CE3 3.55Å; Y124-W256 HydrophobicContact CE2-CG 4.11Å; Y124-W256 AromaticContact CE2-CH2 3.92Å; Y124-W256 HydrophobicContact CE2-CH2 3.92Å; Y124-W256 AromaticContact CE2-CZ2 3.88Å; Y124-W256 HydrophobicContact CE2-CZ2 3.88Å; Y124-W256 AromaticContact CE2-CZ3 3.77Å; Y124-W256 HydrophobicContact CE2-CZ3 3.77Å |
| 125 | F | 96.3 | Very high | 95 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -67.9 | -40.7 | -179.1 | -73.2 | -59.4 | 0 | 0 | 0 | 111.8 | H121 G127 I128 F129 A168 A171 M205 L209 | H121-F125 HydrophobicContact CB-CD2 4.31Å; H121-F125 HydrophobicContact CB-CE2 4.36Å; H121-F125 WeakPolarHBondContact O-CB 3.35Å; H121-F125 VanDerWaalsContact O-CD2 3.23Å; H121-F125 WeakPolarHBondContact O-CD2 3.25Å; H121-F125 PolarHBondContact O-N 3.34Å; F125-G127 VanDerWaalsContact C-N 3.34Å; F125-G127 PolarHBondContact O-N 3.41Å; F125-I128 VanDerWaalsContact O-CG2 3.24Å; F125-I128 WeakPolarHBondContact O-CG2 3.24Å; F125-I128 PolarHBondContact O-N 2.9Å; F125-F129 HydrophobicContact CB-CD2 4.4Å; F125-F129 HydrophobicContact CB-CE2 3.95Å; F125-F129 HydrophobicContact CB-CZ 4.39Å; F125-F129 HydrophobicContact CD1-CZ 4.28Å; F125-F129 WeakPolarHBondContact O-CB 3.27Å; F125-F129 WeakPolarHBondContact O-CD2 3.39Å; F125-F129 WeakPolarHBondContact O-CG 3.44Å; F125-F129 PolarHBondContact O-N 2.92Å; F125-A168 HydrophobicContact CB-CB 4.02Å; F125-A171 HydrophobicContact CD1-CB 4.32Å; F125-A171 HydrophobicContact CD2-CB 3.73Å; F125-A171 HydrophobicContact CE1-CB 4.44Å; F125-A171 HydrophobicContact CE2-CB 3.86Å; F125-A171 HydrophobicContact CG-CB 3.98Å; F125-A171 HydrophobicContact CZ-CB 4.22Å; F125-M205 HydrophobicContact CZ-CE 4.13Å; F125-L209 HydrophobicContact CD1-CB 4.48Å; F125-L209 HydrophobicContact CE1-CB 4.16Å; F125-L209 HydrophobicContact CE1-CD1 4.29Å |
| 126 | G | 96.4 | Very high | 94.7 | Very high | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -56.2 | -49.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | I122 I128 F129 F130 | I122-G126 WeakPolarHBondContact O-CA 3.45Å; I122-G126 PolarHBondContact O-N 2.94Å; G126-I128 PolarHBondContact O-N 2.94Å; G126-F129 PolarHBondContact O-N 3.25Å; G126-F130 WeakPolarHBondContact O-CD2 3.28Å; G126-F130 PolarHBondContact O-N 3.15Å |
| 127 | G | 94.6 | Very high | 94.3 | Very high | 6 Ų | 6 | 11.7 Ų | 11.7 | 6% | 0.062 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -55.2 | -53 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L84 G123 Y124 F125 F129 F130 I131 | L84-G127 WeakPolarHBondContact CD1-O 3.49Å; G123-G127 PolarHBondContact O-N 3.44Å; Y124-G127 PolarHBondContact O-N 3.38Å; F125-G127 VanDerWaalsContact C-N 3.34Å; F125-G127 PolarHBondContact O-N 3.41Å; G127-F129 PolarHBondContact O-N 2.98Å; G127-F130 PolarHBondContact O-N 2.96Å; G127-I131 VanDerWaalsContact O-CG1 3.3Å; G127-I131 WeakPolarHBondContact O-CG1 3.47Å; G127-I131 PolarHBondContact O-N 2.99Å |
| 128 | I | 94.6 | Very high | 93.7 | Very high | 1 Ų | 1 | 13.2 Ų | 13.2 | 1% | 0.005 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -66.2 | -39.3 | -179.3 | -173.8 | 52.3 | 0 | 0 | 0 | 112.7 | Y124 F125 G126 F130 I131 I132 P214 Y252 | Y124-I128 PolarHBondContact O-N 3.43Å; F125-I128 VanDerWaalsContact O-CG2 3.24Å; F125-I128 WeakPolarHBondContact O-CG2 3.24Å; F125-I128 PolarHBondContact O-N 2.9Å; G126-I128 PolarHBondContact O-N 2.94Å; I128-F130 PolarHBondContact O-N 3.15Å; I128-I131 PolarHBondContact O-N 3.19Å; I128-I132 HydrophobicContact CG1-CD1 4.3Å; I128-I132 WeakPolarHBondContact O-CG1 3.47Å; I128-I132 PolarHBondContact O-N 3.5Å; I128-P214 HydrophobicContact CD1-CB 3.79Å; I128-P214 HydrophobicContact CD1-CG 3.59Å; I128-P214 HydrophobicContact CG1-CB 4.24Å; I128-P214 HydrophobicContact CG1-CG 3.46Å; I128-P214 VanDerWaalsContact CG1-CG 3.46Å; I128-Y252 HydrophobicContact CB-CE2 3.91Å; I128-Y252 HydrophobicContact CD1-CD1 3.64Å; I128-Y252 HydrophobicContact CD1-CD2 4.08Å; I128-Y252 HydrophobicContact CD1-CE1 3.32Å; I128-Y252 HydrophobicContact CD1-CE2 3.78Å; I128-Y252 HydrophobicContact CD1-CG 4.02Å; I128-Y252 HydrophobicContact CG1-CE1 3.93Å; I128-Y252 HydrophobicContact CG1-CE2 4.11Å |
| 129 | F | 96.6 | Very high | 93.2 | Very high | 17 Ų | 17 | 15.2 Ų | 15.2 | 8% | 0.075 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -66.4 | -38.4 | 178.2 | -62.9 | -27.1 | 0 | 0 | 0 | 112.3 | F125 G126 G127 I131 I132 L133 T164 V167 A168 L209 | F125-F129 HydrophobicContact CB-CD2 4.4Å; F125-F129 HydrophobicContact CB-CE2 3.95Å; F125-F129 HydrophobicContact CB-CZ 4.39Å; F125-F129 HydrophobicContact CD1-CZ 4.28Å; F125-F129 WeakPolarHBondContact O-CB 3.27Å; F125-F129 WeakPolarHBondContact O-CD2 3.39Å; F125-F129 WeakPolarHBondContact O-CG 3.44Å; F125-F129 PolarHBondContact O-N 2.92Å; G126-F129 PolarHBondContact O-N 3.25Å; G127-F129 PolarHBondContact O-N 2.98Å; F129-I131 VanDerWaalsContact C-N 3.35Å; F129-I132 HydrophobicContact CD1-CD1 4.21Å; F129-I132 WeakPolarHBondContact O-CB 3.26Å; F129-I132 PolarHBondContact O-N 3.33Å; F129-L133 WeakPolarHBondContact O-CG 3.39Å; F129-L133 PolarHBondContact O-N 3.14Å; F129-T164 HydrophobicContact CB-CG2 3.41Å; F129-T164 VanDerWaalsContact CB-CG2 3.41Å; F129-T164 HydrophobicContact CD2-CG2 4.17Å; F129-T164 HydrophobicContact CG-CG2 4.26Å; F129-V167 HydrophobicContact CD2-CG1 4.41Å; F129-V167 HydrophobicContact CE2-CB 4.39Å; F129-V167 HydrophobicContact CE2-CG1 3.71Å; F129-V167 HydrophobicContact CZ-CG1 4.12Å; F129-A168 HydrophobicContact CD2-CB 4.24Å; F129-A168 HydrophobicContact CE2-CB 4.33Å; F129-L209 HydrophobicContact CE1-CB 4.27Å; F129-L209 HydrophobicContact CE1-CD2 4.45Å; F129-L209 HydrophobicContact CZ-CB 4.34Å; F129-L209 HydrophobicContact CZ-CD1 4.33Å; F129-L209 HydrophobicContact CZ-CD2 4.39Å |
| 130 | F | 95.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -68.3 | -32.9 | 174 | -75.6 | -62.8 | 0 | 0 | 0 | 112.7 | Y80 N83 L84 G126 G127 I128 L133 L134 S161 T164 W165 | Y80-F130 HydrophobicContact CD1-CD1 4.27Å; Y80-F130 HydrophobicContact CD1-CE1 4.41Å; N83-F130 HydrophobicContact CB-CD1 3.69Å; N83-F130 HydrophobicContact CB-CD2 3.71Å; N83-F130 HydrophobicContact CB-CE1 3.43Å; N83-F130 VanDerWaalsContact CB-CE1 3.43Å; N83-F130 HydrophobicContact CB-CE2 3.48Å; N83-F130 VanDerWaalsContact CB-CE2 3.48Å; N83-F130 HydrophobicContact CB-CG 3.85Å; N83-F130 HydrophobicContact CB-CZ 3.33Å; L84-F130 HydrophobicContact CB-CB 4.15Å; L84-F130 HydrophobicContact CD1-CB 4.49Å; G126-F130 WeakPolarHBondContact O-CD2 3.28Å; G126-F130 PolarHBondContact O-N 3.15Å; G127-F130 PolarHBondContact O-N 2.96Å; I128-F130 PolarHBondContact O-N 3.15Å; F130-L133 HydrophobicContact CD1-CD1 4.05Å; F130-L133 HydrophobicContact CE1-CD1 4.17Å; F130-L133 PolarHBondContact O-N 2.7Å; F130-L134 WeakPolarHBondContact O-CB 3.49Å; F130-L134 VanDerWaalsContact O-CG 3.29Å; F130-L134 WeakPolarHBondContact O-CG 3.23Å; F130-L134 PolarHBondContact O-N 3.35Å; F130-S161 WeakPolarHBondContact CE1-OG 3.44Å; F130-T164 HydrophobicContact CD1-CG2 4.49Å; F130-T164 HydrophobicContact CD2-CG2 4.41Å; F130-T164 HydrophobicContact CE1-CG2 4.1Å; F130-T164 HydrophobicContact CE2-CG2 3.99Å; F130-T164 HydrophobicContact CZ-CG2 3.82Å; F130-W165 HydrophobicContact CE2-CD2 4.3Å; F130-W165 AromaticContact CE2-CE2 3.77Å; F130-W165 AromaticContact CE2-CZ2 3.96Å; F130-W165 HydrophobicContact CE2-CZ2 3.96Å; F130-W165 AromaticContact CE2-NE1 3.83Å; F130-W165 AromaticContact CZ-CD1 4Å; F130-W165 AromaticContact CZ-NE1 3.68Å |
| 131 | I | 92.4 | Very high | 91.9 | Very high | 2 Ų | 2 | 16.3 Ų | 16.3 | 1% | 0.01 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64.4 | -41.7 | 170.9 | -66.8 | 169.9 | 0 | 0 | 0 | 110.9 | L84 G127 I128 F129 L134 T135 I248 M249 Y252 | L84-I131 HydrophobicContact CD1-CD1 4.29Å; L84-I131 HydrophobicContact CD1-CG1 3.91Å; L84-I131 HydrophobicContact CD2-CG1 4.01Å; G127-I131 VanDerWaalsContact O-CG1 3.3Å; G127-I131 WeakPolarHBondContact O-CG1 3.47Å; G127-I131 PolarHBondContact O-N 2.99Å; I128-I131 PolarHBondContact O-N 3.19Å; F129-I131 VanDerWaalsContact C-N 3.35Å; I131-L134 PolarHBondContact O-N 3.01Å; I131-T135 PolarHBondContact O-N 3.11Å; I131-T135 PolarHBondContact O-OG1 3.41Å; I131-I248 HydrophobicContact CD1-CG2 4.04Å; I131-I248 HydrophobicContact CG1-CG2 4.12Å; I131-I248 HydrophobicContact CG2-CG2 4.37Å; I131-M249 HydrophobicContact CG2-CE 3.71Å; I131-M249 HydrophobicContact CG2-CG 3.59Å; I131-M249 HydrophobicContact CG2-SD 4.33Å; I131-Y252 HydrophobicContact CD1-CD2 4.25Å |
| 132 | I | 93.6 | Very high | 91 | Very high | 13 Ų | 13 | 16.2 Ų | 16.2 | 7% | 0.067 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60 | -49 | 173.8 | -72.5 | 162.5 | 0 | 0 | 0 | 110.4 | I128 F129 L134 T135 I136 L213 P214 I217 M249 | I128-I132 HydrophobicContact CG1-CD1 4.3Å; I128-I132 WeakPolarHBondContact O-CG1 3.47Å; I128-I132 PolarHBondContact O-N 3.5Å; F129-I132 HydrophobicContact CD1-CD1 4.21Å; F129-I132 WeakPolarHBondContact O-CB 3.26Å; F129-I132 PolarHBondContact O-N 3.33Å; I132-L134 VanDerWaalsContact C-N 3.33Å; I132-L134 PolarHBondContact O-N 2.9Å; I132-T135 WeakPolarHBondContact O-CB 3.47Å; I132-T135 PolarHBondContact O-N 2.88Å; I132-I136 HydrophobicContact CG2-CD1 3.76Å; I132-I136 HydrophobicContact CG2-CG1 4.4Å; I132-I136 WeakPolarHBondContact O-CG1 3.24Å; I132-I136 PolarHBondContact O-N 3.1Å; I132-L213 HydrophobicContact CD1-CD2 4.24Å; I132-L213 HydrophobicContact CD1-CG 4.26Å; I132-P214 HydrophobicContact CD1-CB 4.24Å; I132-P214 HydrophobicContact CD1-CG 3.83Å; I132-P214 HydrophobicContact CG1-CB 4.27Å; I132-P214 HydrophobicContact CG1-CG 4.37Å; I132-I217 HydrophobicContact CG2-CG1 4.23Å; I132-I217 HydrophobicContact CG2-CG2 4.24Å; I132-M249 HydrophobicContact CG1-CE 4.46Å |
| 133 | L | 93.6 | Very high | 90.2 | Very high | 33 Ų | 33 | 16.7 Ų | 16.7 | 17% | 0.173 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -61.6 | -39.2 | 179 | -74.4 | -179.7 | 0 | 0 | 0 | 112.6 | Y80 F129 F130 T135 I136 D137 T164 | Y80-L133 HydrophobicContact CD1-CD1 4.47Å; Y80-L133 HydrophobicContact CD2-CB 3.92Å; Y80-L133 HydrophobicContact CE1-CD1 4.08Å; Y80-L133 HydrophobicContact CE2-CB 3.74Å; Y80-L133 HydrophobicContact CG-CB 4.42Å; F129-L133 WeakPolarHBondContact O-CG 3.39Å; F129-L133 PolarHBondContact O-N 3.14Å; F130-L133 HydrophobicContact CD1-CD1 4.05Å; F130-L133 HydrophobicContact CE1-CD1 4.17Å; F130-L133 PolarHBondContact O-N 2.7Å; L133-T135 VanDerWaalsContact C-N 3.32Å; L133-I136 PolarHBondContact O-N 2.86Å; L133-D137 VanDerWaalsContact O-CB 3.27Å; L133-D137 WeakPolarHBondContact O-CB 3.37Å; L133-D137 PolarHBondContact O-N 3.4Å; L133-T164 HydrophobicContact CD1-CG2 4.34Å; L133-T164 VanDerWaalsContact CD1-OG1 3.28Å; L133-T164 WeakPolarHBondContact CD1-OG1 3.3Å |
| 134 | L | 90 | Very high | 89.4 | Confident | 2 Ų | 2 | 20.8 Ų | 20.8 | 1% | 0.01 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -61.4 | -41 | 172.5 | -78 | 167.7 | 0 | 0 | 0 | 111.7 | T77 Y80 L81 L84 F130 I131 I132 D137 R138 I245 | T77-L134 HydrophobicContact CG2-CD2 3.81Å; Y80-L134 HydrophobicContact CD2-CD2 4.27Å; Y80-L134 HydrophobicContact CD2-CG 4.44Å; L81-L134 HydrophobicContact CD2-CD1 3.88Å; L81-L134 HydrophobicContact CD2-CD2 4.3Å; L81-L134 HydrophobicContact CG-CD2 4.21Å; L84-L134 HydrophobicContact CD2-CD1 3.9Å; F130-L134 WeakPolarHBondContact O-CB 3.49Å; F130-L134 VanDerWaalsContact O-CG 3.29Å; F130-L134 WeakPolarHBondContact O-CG 3.23Å; F130-L134 PolarHBondContact O-N 3.35Å; I131-L134 PolarHBondContact O-N 3.01Å; I132-L134 VanDerWaalsContact C-N 3.33Å; I132-L134 PolarHBondContact O-N 2.9Å; L134-D137 PolarHBondContact O-N 2.89Å; L134-R138 WeakPolarHBondContact O-CG 3.39Å; L134-R138 PolarHBondContact O-N 3.16Å; L134-I245 HydrophobicContact CB-CD1 4.27Å |
| 135 | T | 89.3 | Confident | 88.5 | Confident | 1 Ų | 1 | 23.1 Ų | 23.1 | 1% | 0.006 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -65.6 | -45.3 | 178.4 | -57 | 0 | 0 | 0 | 0 | 111.5 | I131 I132 L133 R138 Y139 I217 C221 Y222 M249 | I131-T135 PolarHBondContact O-N 3.11Å; I131-T135 PolarHBondContact O-OG1 3.41Å; I132-T135 WeakPolarHBondContact O-CB 3.47Å; I132-T135 PolarHBondContact O-N 2.88Å; L133-T135 VanDerWaalsContact C-N 3.32Å; T135-R138 PolarHBondContact O-N 2.85Å; T135-Y139 WeakPolarHBondContact O-CB 3.28Å; T135-Y139 PolarHBondContact O-N 3.3Å; T135-I217 HydrophobicContact CG2-CG2 4.39Å; T135-C221 HydrophobicContact CG2-CB 3.95Å; T135-Y222 HydrophobicContact CG2-CE2 4.06Å; T135-M249 HydrophobicContact CG2-SD 4.06Å; T135-M249 PolarHBondContact OG1-SD 3.22Å; T135-M249 VanDerWaalsContact OG1-SD 3.33Å |
| 136 | I | 89.9 | Confident | 87.3 | Confident | 53 Ų | 53 | 29 Ų | 29 | 27% | 0.272 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -63.7 | -44.5 | 175.6 | -65.3 | 170 | 0 | 0 | 0 | 110.8 | I132 L133 R138 Y139 L140 I217 | I132-I136 HydrophobicContact CG2-CD1 3.76Å; I132-I136 HydrophobicContact CG2-CG1 4.4Å; I132-I136 WeakPolarHBondContact O-CG1 3.24Å; I132-I136 PolarHBondContact O-N 3.1Å; L133-I136 PolarHBondContact O-N 2.86Å; I136-R138 VanDerWaalsContact C-N 3.29Å; I136-R138 PolarHBondContact O-N 2.83Å; I136-Y139 WeakPolarHBondContact O-CB 3.31Å; I136-Y139 PolarHBondContact O-N 2.77Å; I136-Y139 VanDerWaalsContact O-N 3.16Å; I136-L140 HydrophobicContact CG2-CD1 3.9Å; I136-L140 HydrophobicContact CG2-CG 4.2Å; I136-L140 WeakPolarHBondContact O-CG 3.46Å; I136-L140 PolarHBondContact O-N 2.8Å; I136-I217 HydrophobicContact CD1-CD1 4.46Å; I136-I217 HydrophobicContact CD1-CG2 4.36Å; I136-I217 HydrophobicContact CG1-CG2 3.91Å |
| 137 | D | 87.2 | Confident | 86.1 | Confident | 8 Ų | 8 | 34.9 Ų | 34.9 | 4% | 0.043 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -56.2 | -43 | 176.3 | 166.5 | 62.1 | 0 | 0 | 0 | 111.7 | L76 T77 Y80 L133 L134 A141 R152 | L76-D137 HydrophobicContact CD2-CB 3.99Å; L76-D137 VanDerWaalsContact CD2-OD1 3.3Å; L76-D137 WeakPolarHBondContact CD2-OD1 3.07Å; T77-D137 PolarHBondContact OG1-OD2 2.87Å; Y80-D137 HydrophobicContact CD2-CB 4.47Å; Y80-D137 HydrophobicContact CE2-CB 4.25Å; L133-D137 VanDerWaalsContact O-CB 3.27Å; L133-D137 WeakPolarHBondContact O-CB 3.37Å; L133-D137 PolarHBondContact O-N 3.4Å; L134-D137 PolarHBondContact O-N 2.89Å; D137-A141 VanDerWaalsContact O-CB 3.31Å; D137-A141 WeakPolarHBondContact O-CB 3.37Å; D137-A141 PolarHBondContact O-N 3.19Å; D137-R152 IonicContact OD1-CZ 2.84Å; D137-R152 VanDerWaalsContact OD1-CZ 3.26Å; D137-R152 IonicContact OD1-NE 3.59Å; D137-R152 PolarHBondContact OD1-NE 3.35Å; D137-R152 IonicContact OD1-NH2 2.86Å; D137-R152 PolarHBondContact OD1-NH2 3Å; D137-R152 IonicContact OD2-NH2 3.67Å |
| 138 | R | 84.6 | Confident | 85.1 | Confident | 39 Ų | 39 | 34.9 Ų | 34.9 | 15% | 0.147 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.3 | -44.5 | 175.2 | -69.8 | -55.4 | 92.9 | -171.5 | 6.8 | 112.8 | T77 L134 T135 I136 A141 I142 I245 | T77-R138 PolarHBondContact OG1-NH2 3.46Å; L134-R138 WeakPolarHBondContact O-CG 3.39Å; L134-R138 PolarHBondContact O-N 3.16Å; T135-R138 PolarHBondContact O-N 2.85Å; I136-R138 VanDerWaalsContact C-N 3.29Å; I136-R138 PolarHBondContact O-N 2.83Å; R138-A141 PolarHBondContact O-N 3.02Å; R138-I142 VanDerWaalsContact O-CG1 3.28Å; R138-I142 WeakPolarHBondContact O-CG1 3.24Å; R138-I142 PolarHBondContact O-N 3.14Å; R138-I245 HydrophobicContact CG-CB 4.41Å; R138-I245 HydrophobicContact CG-CD1 3.14Å; R138-I245 HydrophobicContact CG-CG1 4.3Å |
| 139 | Y | 85.4 | Confident | 83.8 | Confident | 45 Ų | 45 | 42.4 Ų | 42.4 | 18% | 0.176 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -56.9 | -51.6 | 177.8 | 170.9 | -101.2 | 0 | 0 | 0 | 111 | T135 I136 A141 I142 V143 H144 C221 I225 | T135-Y139 WeakPolarHBondContact O-CB 3.28Å; T135-Y139 PolarHBondContact O-N 3.3Å; I136-Y139 WeakPolarHBondContact O-CB 3.31Å; I136-Y139 PolarHBondContact O-N 2.77Å; I136-Y139 VanDerWaalsContact O-N 3.16Å; Y139-A141 PolarHBondContact O-N 3.41Å; Y139-I142 PolarHBondContact O-N 3.42Å; Y139-I142 VanDerWaalsContact O-N 3.15Å; Y139-V143 HydrophobicContact CD2-CB 4.29Å; Y139-V143 HydrophobicContact CD2-CG2 3.7Å; Y139-V143 HydrophobicContact CE2-CB 3.98Å; Y139-V143 HydrophobicContact CE2-CG1 4.17Å; Y139-V143 HydrophobicContact CE2-CG2 3.58Å; Y139-V143 WeakPolarHBondContact O-CB 3.3Å; Y139-V143 PolarHBondContact O-N 3.22Å; Y139-H144 AromaticContact CE1-CD2 3.82Å; Y139-C221 VanDerWaalsContact CB-SG 3.6Å; Y139-C221 HydrophobicContact CD2-CB 3.97Å; Y139-C221 WeakPolarHBondContact CD2-O 3.3Å; Y139-C221 HydrophobicContact CG-CB 4.08Å; Y139-I225 HydrophobicContact CD2-CG1 4.19Å |
| 140 | L | 84.4 | Confident | 82.7 | Confident | 44 Ų | 44 | 49.8 Ų | 49.8 | 23% | 0.23 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 179 | -68.1 | 176.5 | 0 | 0 | 0 | 111.9 | I136 I142 H144 A145 F147 | I136-L140 HydrophobicContact CG2-CD1 3.9Å; I136-L140 HydrophobicContact CG2-CG 4.2Å; I136-L140 WeakPolarHBondContact O-CG 3.46Å; I136-L140 PolarHBondContact O-N 2.8Å; L140-I142 PolarHBondContact O-N 3.28Å; L140-H144 HydrophobicContact CD2-CB 4.39Å; L140-H144 CarbonylContact O-C 3.58Å; L140-H144 WeakPolarHBondContact O-CA 3.36Å; L140-H144 PolarHBondContact O-N 3.32Å; L140-A145 PolarHBondContact O-N 2.87Å; L140-F147 HydrophobicContact CD1-CE1 4.38Å; L140-F147 HydrophobicContact CD2-CD1 4.36Å |
| 141 | A | 81.6 | Confident | 81.6 | Confident | 25 Ų | 25 | 50.8 Ų | 50.8 | 21% | 0.207 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.8 | -25.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | D137 R138 Y139 | D137-A141 VanDerWaalsContact O-CB 3.31Å; D137-A141 WeakPolarHBondContact O-CB 3.37Å; D137-A141 PolarHBondContact O-N 3.19Å; R138-A141 PolarHBondContact O-N 3.02Å; Y139-A141 PolarHBondContact O-N 3.41Å |
| 142 | I | 77.3 | Confident | 81 | Confident | 13 Ų | 13 | 54.8 Ų | 54.8 | 7% | 0.067 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -100.3 | -47.6 | -174.8 | -65.6 | 172.4 | 0 | 0 | 0 | 111.8 | R138 Y139 L140 I225 T228 R238 V242 | R138-I142 VanDerWaalsContact O-CG1 3.28Å; R138-I142 WeakPolarHBondContact O-CG1 3.24Å; R138-I142 PolarHBondContact O-N 3.14Å; Y139-I142 PolarHBondContact O-N 3.42Å; Y139-I142 VanDerWaalsContact O-N 3.15Å; L140-I142 PolarHBondContact O-N 3.28Å; I142-I225 HydrophobicContact CD1-CG1 4.45Å; I142-I225 HydrophobicContact CD1-CG2 4.49Å; I142-T228 HydrophobicContact CG2-CG2 4.4Å; I142-R238 HydrophobicContact CD1-CG 4.05Å; I142-R238 HydrophobicContact CG1-CG 3.87Å; I142-V242 HydrophobicContact CD1-CG2 3.11Å |
| 143 | V | 80.6 | Confident | 80.6 | Confident | 38 Ų | 38 | 57.2 Ų | 57.2 | 23% | 0.23 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -88.3 | -33.5 | -173.3 | -175.9 | 0 | 0 | 0 | 0 | 111 | Y139 I225 | Y139-V143 HydrophobicContact CD2-CB 4.29Å; Y139-V143 HydrophobicContact CD2-CG2 3.7Å; Y139-V143 HydrophobicContact CE2-CB 3.98Å; Y139-V143 HydrophobicContact CE2-CG1 4.17Å; Y139-V143 HydrophobicContact CE2-CG2 3.58Å; Y139-V143 WeakPolarHBondContact O-CB 3.3Å; Y139-V143 PolarHBondContact O-N 3.22Å; V143-I225 HydrophobicContact CG2-CG1 4.28Å |
| 144 | H | 80 | Confident | 80.3 | Confident | 88 Ų | 88 | 58.7 Ų | 58.7 | 41% | 0.407 | 31% | 0.308 | S | S | . | . | trans | -125.8 | 51.8 | -175.6 | -62.5 | -68.4 | 0 | 0 | 0 | 112.3 | Y139 L140 V146 F147 A148 | Y139-H144 AromaticContact CE1-CD2 3.82Å; L140-H144 HydrophobicContact CD2-CB 4.39Å; L140-H144 CarbonylContact O-C 3.58Å; L140-H144 WeakPolarHBondContact O-CA 3.36Å; L140-H144 PolarHBondContact O-N 3.32Å; H144-V146 VanDerWaalsContact C-N 3.25Å; H144-V146 PolarHBondContact O-N 2.92Å; H144-V146 VanDerWaalsContact O-N 3.1Å; H144-F147 HydrophobicContact CB-CB 4.39Å; H144-F147 PolarHBondContact O-N 3.2Å; H144-F147 VanDerWaalsContact O-N 3.11Å; H144-A148 WeakPolarHBondContact O-CB 3.41Å; H144-A148 PolarHBondContact O-N 3.46Å | ||
| 145 | A | 74.2 | Confident | 80.3 | Confident | 57 Ų | 57 | 63.6 Ų | 63.6 | 47% | 0.471 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -53.7 | -34.7 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | L140 L149 | L140-A145 PolarHBondContact O-N 2.87Å; A145-L149 PolarHBondContact O-N 3.26Å; A145-L149 VanDerWaalsContact O-N 3.07Å |
| 146 | V | 71.3 | Confident | 80.3 | Confident | 123 Ų | 123 | 68.5 Ų | 68.5 | 75% | 0.745 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -70.1 | -42.2 | 179.9 | -178.7 | 0 | 0 | 0 | 0 | 112 | H144 | H144-V146 VanDerWaalsContact C-N 3.25Å; H144-V146 PolarHBondContact O-N 2.92Å; H144-V146 VanDerWaalsContact O-N 3.1Å |
| 147 | F | 72.2 | Confident | 80.4 | Confident | 125 Ų | 125 | 66 Ų | 66 | 55% | 0.548 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -68.6 | -41.3 | 174.3 | 176.7 | -100.7 | 0 | 0 | 0 | 111 | L140 H144 L149 K150 A151 | L140-F147 HydrophobicContact CD1-CE1 4.38Å; L140-F147 HydrophobicContact CD2-CD1 4.36Å; H144-F147 HydrophobicContact CB-CB 4.39Å; H144-F147 PolarHBondContact O-N 3.2Å; H144-F147 VanDerWaalsContact O-N 3.11Å; F147-L149 VanDerWaalsContact C-N 3.26Å; F147-L149 PolarHBondContact O-N 3.19Å; F147-K150 PolarHBondContact O-N 3.45Å; F147-K150 VanDerWaalsContact O-N 3.07Å; F147-A151 HydrophobicContact CD1-CB 4.33Å; F147-A151 HydrophobicContact CE1-CB 3.89Å; F147-A151 HydrophobicContact CZ-CB 4.03Å; F147-A151 PolarHBondContact O-N 3.43Å |
| 148 | A | 72.5 | Confident | 80.7 | Confident | 6 Ų | 6 | 69 Ų | 69 | 5% | 0.05 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -57.7 | -35.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | H144 K150 R152 | H144-A148 WeakPolarHBondContact O-CB 3.41Å; H144-A148 PolarHBondContact O-N 3.46Å; A148-K150 PolarHBondContact O-N 3.41Å; A148-R152 HydrophobicContact CB-CG 4.27Å; A148-R152 WeakPolarHBondContact O-CB 3.36Å; A148-R152 WeakPolarHBondContact O-CD 3.23Å; A148-R152 WeakPolarHBondContact O-CG 3.3Å; A148-R152 PolarHBondContact O-N 2.91Å; A148-R152 VanDerWaalsContact O-N 3.11Å |
| 149 | L | 69.1 | Low | 81.2 | Confident | 158 Ų | 158 | 70.9 Ų | 70.9 | 83% | 0.827 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -62.9 | -31.1 | 177.7 | -153.5 | 85.2 | 0 | 0 | 0 | 112.6 | A145 F147 | A145-L149 PolarHBondContact O-N 3.26Å; A145-L149 VanDerWaalsContact O-N 3.07Å; F147-L149 VanDerWaalsContact C-N 3.26Å; F147-L149 PolarHBondContact O-N 3.19Å |
| 150 | K | 71.8 | Confident | 81.6 | Confident | 173 Ų | 173 | 69.8 Ų | 69.8 | 75% | 0.752 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -89 | -36.9 | 179.8 | -65.3 | -175.7 | 179.3 | -177.5 | 0 | 113 | F147 A148 | F147-K150 PolarHBondContact O-N 3.45Å; F147-K150 VanDerWaalsContact O-N 3.07Å; A148-K150 PolarHBondContact O-N 3.41Å |
| 151 | A | 72.3 | Confident | 82.2 | Confident | 21 Ų | 21 | 67.9 Ų | 67.9 | 17% | 0.174 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -90.2 | -21.3 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | F147 T153 F156 | F147-A151 HydrophobicContact CD1-CB 4.33Å; F147-A151 HydrophobicContact CE1-CB 3.89Å; F147-A151 HydrophobicContact CZ-CB 4.03Å; F147-A151 PolarHBondContact O-N 3.43Å; A151-T153 PolarHBondContact O-N 3.05Å; A151-F156 WeakPolarHBondContact O-CB 3.49Å; A151-F156 WeakPolarHBondContact O-CG 3.35Å |
| 152 | R | 80.9 | Confident | 83 | Confident | 85 Ų | 85 | 70.6 Ų | 70.6 | 32% | 0.321 | 38% | 0.383 | S | S | . | . | trans | -85.3 | 50.4 | -172.6 | -63.3 | 175.3 | 73.4 | -131.5 | -13.8 | 113.4 | L76 T77 D137 A148 | L76-R152 HydrophobicContact CD1-CB 4.44Å; T77-R152 PolarHBondContact OG1-NH2 2.97Å; D137-R152 IonicContact OD1-CZ 2.84Å; D137-R152 VanDerWaalsContact OD1-CZ 3.26Å; D137-R152 IonicContact OD1-NE 3.59Å; D137-R152 PolarHBondContact OD1-NE 3.35Å; D137-R152 IonicContact OD1-NH2 2.86Å; D137-R152 PolarHBondContact OD1-NH2 3Å; D137-R152 IonicContact OD2-NH2 3.67Å; A148-R152 HydrophobicContact CB-CG 4.27Å; A148-R152 WeakPolarHBondContact O-CB 3.36Å; A148-R152 WeakPolarHBondContact O-CD 3.23Å; A148-R152 WeakPolarHBondContact O-CG 3.3Å; A148-R152 PolarHBondContact O-N 2.91Å; A148-R152 VanDerWaalsContact O-N 3.11Å | ||
| 153 | T | 85.4 | Confident | 84 | Confident | 65 Ų | 65 | 74.4 Ų | 74.4 | 40% | 0.399 | 40% | 0.403 | S | S | . | . | trans | -88.9 | 157.4 | 175.7 | 65.7 | 0 | 0 | 0 | 0 | 111.3 | A151 T155 F156 G157 | A151-T153 PolarHBondContact O-N 3.05Å; T153-T155 VanDerWaalsContact C-N 3.29Å; T153-T155 PolarHBondContact O-N 3.48Å; T153-F156 PolarHBondContact O-N 2.95Å; T153-F156 WeakPolarHBondContact OG1-CB 3.22Å; T153-F156 PolarHBondContact OG1-N 3.03Å; T153-G157 PolarHBondContact O-N 2.84Å; T153-G157 VanDerWaalsContact O-N 3.14Å | ||
| 154 | V | 87.2 | Confident | 84.8 | Confident | 64 Ų | 64 | 73.2 Ų | 73.2 | 39% | 0.388 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -60.1 | -41.2 | 174.3 | 165.7 | 0 | 0 | 0 | 0 | 110.7 | I79 F156 G157 V158 | I79-V154 HydrophobicContact CD1-CB 4.11Å; I79-V154 HydrophobicContact CD1-CG1 3.78Å; I79-V154 HydrophobicContact CD1-CG2 4.23Å; V154-F156 PolarHBondContact O-N 3.04Å; V154-G157 PolarHBondContact O-N 2.91Å; V154-G157 VanDerWaalsContact O-N 3.15Å; V154-V158 HydrophobicContact CG1-CG2 4.43Å; V154-V158 WeakPolarHBondContact O-CG2 3.4Å; V154-V158 PolarHBondContact O-N 2.86Å |
| 155 | T | 89 | Confident | 85.6 | Confident | 105 Ų | 105 | 71.6 Ų | 71.6 | 64% | 0.644 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -58.9 | -45.8 | 178 | -46.8 | 0 | 0 | 0 | 0 | 112 | T153 G157 V158 V159 | T153-T155 VanDerWaalsContact C-N 3.29Å; T153-T155 PolarHBondContact O-N 3.48Å; T155-G157 VanDerWaalsContact C-N 3.33Å; T155-G157 PolarHBondContact O-N 3.48Å; T155-V158 PolarHBondContact O-N 2.76Å; T155-V159 WeakPolarHBondContact O-CG2 3.36Å; T155-V159 PolarHBondContact O-N 3.26Å |
| 156 | F | 89.8 | Confident | 86.8 | Confident | 103 Ų | 103 | 73.3 Ų | 73.3 | 45% | 0.452 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.2 | -44.4 | 176 | -176.7 | -96.3 | 0 | 0 | 0 | 111.2 | L76 A151 T153 V154 V158 V159 T160 | L76-F156 HydrophobicContact CD1-CD1 3.74Å; L76-F156 HydrophobicContact CD1-CE1 4.48Å; A151-F156 WeakPolarHBondContact O-CB 3.49Å; A151-F156 WeakPolarHBondContact O-CG 3.35Å; T153-F156 PolarHBondContact O-N 2.95Å; T153-F156 WeakPolarHBondContact OG1-CB 3.22Å; T153-F156 PolarHBondContact OG1-N 3.03Å; V154-F156 PolarHBondContact O-N 3.04Å; F156-V158 VanDerWaalsContact C-N 3.34Å; F156-V158 PolarHBondContact O-N 2.95Å; F156-V159 PolarHBondContact O-N 3.35Å; F156-T160 HydrophobicContact CD1-CG2 4.03Å; F156-T160 HydrophobicContact CD2-CG2 4.47Å; F156-T160 HydrophobicContact CE1-CG2 3.58Å; F156-T160 HydrophobicContact CE2-CG2 4.06Å; F156-T160 HydrophobicContact CG-CG2 4.46Å; F156-T160 HydrophobicContact CZ-CG2 3.59Å; F156-T160 WeakPolarHBondContact O-CG2 3.38Å; F156-T160 PolarHBondContact O-N 3.13Å; F156-T160 PolarHBondContact O-OG1 3.48Å |
| 157 | G | 90.9 | Very high | 88 | Confident | 0 Ų | 0 | 70.7 Ų | 70.7 | 0% | 0 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -59.8 | -38.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | T153 V154 T155 T160 S161 | T153-G157 PolarHBondContact O-N 2.84Å; T153-G157 VanDerWaalsContact O-N 3.14Å; V154-G157 PolarHBondContact O-N 2.91Å; V154-G157 VanDerWaalsContact O-N 3.15Å; T155-G157 VanDerWaalsContact C-N 3.33Å; T155-G157 PolarHBondContact O-N 3.48Å; G157-T160 PolarHBondContact O-OG1 3.36Å; G157-T160 VanDerWaalsContact O-OG1 3.13Å; G157-S161 VanDerWaalsContact O-CB 3.3Å; G157-S161 WeakPolarHBondContact O-CB 3.37Å; G157-S161 PolarHBondContact O-N 2.96Å; G157-S161 PolarHBondContact O-OG 2.86Å |
| 158 | V | 93.6 | Very high | 89.2 | Confident | 73 Ų | 73 | 64.7 Ų | 64.7 | 44% | 0.442 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -66.8 | -46.9 | 176 | 172.7 | 0 | 0 | 0 | 0 | 111 | I79 V154 T155 F156 S161 V162 | I79-V158 HydrophobicContact CD1-CG2 4.37Å; V154-V158 HydrophobicContact CG1-CG2 4.43Å; V154-V158 WeakPolarHBondContact O-CG2 3.4Å; V154-V158 PolarHBondContact O-N 2.86Å; T155-V158 PolarHBondContact O-N 2.76Å; F156-V158 VanDerWaalsContact C-N 3.34Å; F156-V158 PolarHBondContact O-N 2.95Å; V158-S161 PolarHBondContact O-N 3.31Å; V158-V162 WeakPolarHBondContact O-CG2 3.06Å; V158-V162 PolarHBondContact O-N 3.17Å |
| 159 | V | 95.3 | Very high | 90.4 | Very high | 77 Ų | 77 | 67.4 Ų | 67.4 | 47% | 0.467 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.5 | -47.9 | -179.7 | 172.1 | 0 | 0 | 0 | 0 | 111 | T155 F156 S161 V162 I163 | T155-V159 WeakPolarHBondContact O-CG2 3.36Å; T155-V159 PolarHBondContact O-N 3.26Å; F156-V159 PolarHBondContact O-N 3.35Å; V159-S161 VanDerWaalsContact C-N 3.34Å; V159-S161 PolarHBondContact O-N 3.03Å; V159-V162 PolarHBondContact O-N 3.29Å; V159-I163 HydrophobicContact CG1-CD1 4.01Å; V159-I163 WeakPolarHBondContact O-CG1 3.44Å; V159-I163 PolarHBondContact O-N 3.44Å; V159-I163 VanDerWaalsContact O-N 3.09Å |
| 160 | T | 95.3 | Very high | 91.8 | Very high | 22 Ų | 22 | 66.8 Ų | 66.8 | 14% | 0.135 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.6 | -36 | 178.2 | 54 | 0 | 0 | 0 | 0 | 112.2 | Y80 F156 G157 I163 T164 | Y80-T160 WeakPolarHBondContact CE1-OG1 3.46Å; Y80-T160 PolarHBondContact OH-OG1 3.08Å; F156-T160 HydrophobicContact CD1-CG2 4.03Å; F156-T160 HydrophobicContact CD2-CG2 4.47Å; F156-T160 HydrophobicContact CE1-CG2 3.58Å; F156-T160 HydrophobicContact CE2-CG2 4.06Å; F156-T160 HydrophobicContact CG-CG2 4.46Å; F156-T160 HydrophobicContact CZ-CG2 3.59Å; F156-T160 WeakPolarHBondContact O-CG2 3.38Å; F156-T160 PolarHBondContact O-N 3.13Å; F156-T160 PolarHBondContact O-OG1 3.48Å; G157-T160 PolarHBondContact O-OG1 3.36Å; G157-T160 VanDerWaalsContact O-OG1 3.13Å; T160-I163 PolarHBondContact O-N 3.37Å; T160-T164 WeakPolarHBondContact O-CB 3.4Å; T160-T164 PolarHBondContact O-N 3.15Å; T160-T164 PolarHBondContact O-OG1 3.43Å |
| 161 | S | 96.4 | Very high | 92.9 | Very high | 5 Ų | 5 | 59 Ų | 59 | 4% | 0.035 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.8 | -45 | 173.1 | -75 | 0 | 0 | 0 | 0 | 112.3 | N83 F130 G157 V158 V159 I163 T164 W165 | N83-S161 PolarHBondContact ND2-OG 3.48Å; F130-S161 WeakPolarHBondContact CE1-OG 3.44Å; G157-S161 VanDerWaalsContact O-CB 3.3Å; G157-S161 WeakPolarHBondContact O-CB 3.37Å; G157-S161 PolarHBondContact O-N 2.96Å; G157-S161 PolarHBondContact O-OG 2.86Å; V158-S161 PolarHBondContact O-N 3.31Å; V159-S161 VanDerWaalsContact C-N 3.34Å; V159-S161 PolarHBondContact O-N 3.03Å; S161-I163 PolarHBondContact O-N 3.45Å; S161-T164 WeakPolarHBondContact O-CB 3.38Å; S161-T164 PolarHBondContact O-N 2.93Å; S161-W165 PolarHBondContact O-N 3.25Å |
| 162 | V | 97.6 | Very high | 94.1 | Very high | 81 Ų | 81 | 58 Ų | 58 | 49% | 0.491 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61 | -46.5 | 177.8 | 171.1 | 0 | 0 | 0 | 0 | 110.9 | V158 V159 T164 W165 L166 | V158-V162 WeakPolarHBondContact O-CG2 3.06Å; V158-V162 PolarHBondContact O-N 3.17Å; V159-V162 PolarHBondContact O-N 3.29Å; V162-T164 VanDerWaalsContact C-N 3.27Å; V162-T164 PolarHBondContact O-N 3.4Å; V162-W165 PolarHBondContact O-N 3.21Å; V162-L166 HydrophobicContact CG1-CD1 4.4Å; V162-L166 WeakPolarHBondContact O-CG 3.41Å; V162-L166 PolarHBondContact O-N 3.42Å |
| 163 | I | 97.8 | Very high | 94.8 | Very high | 93 Ų | 93 | 56.6 Ų | 56.6 | 48% | 0.477 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.1 | -42.9 | 176.2 | -65.9 | 166.9 | 0 | 0 | 0 | 110.5 | V159 T160 S161 W165 L166 V167 | V159-I163 HydrophobicContact CG1-CD1 4.01Å; V159-I163 WeakPolarHBondContact O-CG1 3.44Å; V159-I163 PolarHBondContact O-N 3.44Å; V159-I163 VanDerWaalsContact O-N 3.09Å; T160-I163 PolarHBondContact O-N 3.37Å; S161-I163 PolarHBondContact O-N 3.45Å; I163-W165 PolarHBondContact O-N 2.96Å; I163-L166 WeakPolarHBondContact O-CB 3.34Å; I163-L166 PolarHBondContact O-N 3.11Å; I163-V167 HydrophobicContact CG2-CG2 4.44Å; I163-V167 WeakPolarHBondContact O-CG2 3.46Å; I163-V167 PolarHBondContact O-N 2.79Å |
| 164 | T | 97.6 | Very high | 95.2 | Very high | 14 Ų | 14 | 54.1 Ų | 54.1 | 9% | 0.086 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63 | -42.2 | -180 | -59 | 0 | 0 | 0 | 0 | 112.1 | F129 F130 L133 T160 S161 V162 V167 A168 | F129-T164 HydrophobicContact CB-CG2 3.41Å; F129-T164 VanDerWaalsContact CB-CG2 3.41Å; F129-T164 HydrophobicContact CD2-CG2 4.17Å; F129-T164 HydrophobicContact CG-CG2 4.26Å; F130-T164 HydrophobicContact CD1-CG2 4.49Å; F130-T164 HydrophobicContact CD2-CG2 4.41Å; F130-T164 HydrophobicContact CE1-CG2 4.1Å; F130-T164 HydrophobicContact CE2-CG2 3.99Å; F130-T164 HydrophobicContact CZ-CG2 3.82Å; L133-T164 HydrophobicContact CD1-CG2 4.34Å; L133-T164 VanDerWaalsContact CD1-OG1 3.28Å; L133-T164 WeakPolarHBondContact CD1-OG1 3.3Å; T160-T164 WeakPolarHBondContact O-CB 3.4Å; T160-T164 PolarHBondContact O-N 3.15Å; T160-T164 PolarHBondContact O-OG1 3.43Å; S161-T164 WeakPolarHBondContact O-CB 3.38Å; S161-T164 PolarHBondContact O-N 2.93Å; V162-T164 VanDerWaalsContact C-N 3.27Å; V162-T164 PolarHBondContact O-N 3.4Å; T164-V167 PolarHBondContact O-N 2.91Å; T164-A168 WeakPolarHBondContact O-CB 3.01Å; T164-A168 PolarHBondContact O-N 3.47Å |
| 165 | W | 98.3 | Very high | 95.4 | Very high | 53 Ų | 53 | 51.1 Ų | 51.1 | 20% | 0.201 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.2 | -42.7 | 173.9 | -79.4 | 115.2 | 0 | 0 | 0 | 112.2 | N83 I86 S87 L90 I122 F130 S161 V162 I163 V167 A168 V169 | N83-W165 PolarHBondContact OD1-NE1 2.93Å; I86-W165 HydrophobicContact CB-CZ2 4.35Å; I86-W165 HydrophobicContact CG2-CH2 4.06Å; I86-W165 HydrophobicContact CG2-CZ2 3.86Å; S87-W165 VanDerWaalsContact OG-CH2 3.28Å; S87-W165 WeakPolarHBondContact OG-CH2 3.42Å; L90-W165 HydrophobicContact CD1-CH2 3.63Å; L90-W165 HydrophobicContact CD1-CZ3 3.77Å; I122-W165 HydrophobicContact CG2-CE3 3.95Å; I122-W165 HydrophobicContact CG2-CZ3 3.55Å; F130-W165 HydrophobicContact CE2-CD2 4.3Å; F130-W165 AromaticContact CE2-CE2 3.77Å; F130-W165 AromaticContact CE2-CZ2 3.96Å; F130-W165 HydrophobicContact CE2-CZ2 3.96Å; F130-W165 AromaticContact CE2-NE1 3.83Å; F130-W165 AromaticContact CZ-CD1 4Å; F130-W165 AromaticContact CZ-NE1 3.68Å; S161-W165 PolarHBondContact O-N 3.25Å; V162-W165 PolarHBondContact O-N 3.21Å; I163-W165 PolarHBondContact O-N 2.96Å; W165-V167 VanDerWaalsContact C-N 3.34Å; W165-V167 PolarHBondContact O-N 3.3Å; W165-A168 PolarHBondContact O-N 3.27Å; W165-V169 VanDerWaalsContact O-CG2 3.31Å; W165-V169 WeakPolarHBondContact O-CG2 3.28Å; W165-V169 PolarHBondContact O-N 3.19Å |
| 166 | L | 98.1 | Very high | 95.7 | Very high | 93 Ų | 93 | 48.3 Ų | 48.3 | 49% | 0.487 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -59.5 | -46.8 | 175.6 | -68.1 | 173.4 | 0 | 0 | 0 | 111 | V162 I163 A168 V169 F170 | V162-L166 HydrophobicContact CG1-CD1 4.4Å; V162-L166 WeakPolarHBondContact O-CG 3.41Å; V162-L166 PolarHBondContact O-N 3.42Å; I163-L166 WeakPolarHBondContact O-CB 3.34Å; I163-L166 PolarHBondContact O-N 3.11Å; L166-A168 VanDerWaalsContact C-N 3.34Å; L166-A168 PolarHBondContact O-N 3.19Å; L166-V169 PolarHBondContact O-N 3.05Å; L166-F170 HydrophobicContact CB-CD2 4.46Å; L166-F170 HydrophobicContact CB-CE2 4.25Å; L166-F170 WeakPolarHBondContact O-CD2 3.39Å; L166-F170 PolarHBondContact O-N 3.44Å |
| 167 | V | 97.7 | Very high | 96 | Very high | 68 Ų | 68 | 48.2 Ų | 48.2 | 41% | 0.412 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.7 | -41.5 | 177 | 177.9 | 0 | 0 | 0 | 0 | 111.4 | F129 I163 T164 W165 V169 F170 A171 | F129-V167 HydrophobicContact CD2-CG1 4.41Å; F129-V167 HydrophobicContact CE2-CB 4.39Å; F129-V167 HydrophobicContact CE2-CG1 3.71Å; F129-V167 HydrophobicContact CZ-CG1 4.12Å; I163-V167 HydrophobicContact CG2-CG2 4.44Å; I163-V167 WeakPolarHBondContact O-CG2 3.46Å; I163-V167 PolarHBondContact O-N 2.79Å; T164-V167 PolarHBondContact O-N 2.91Å; W165-V167 VanDerWaalsContact C-N 3.34Å; W165-V167 PolarHBondContact O-N 3.3Å; V167-V169 PolarHBondContact O-N 3.21Å; V167-F170 PolarHBondContact O-N 3.44Å; V167-A171 WeakPolarHBondContact O-CB 3.11Å; V167-A171 PolarHBondContact O-N 3.02Å |
| 168 | A | 97.8 | Very high | 96.1 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63 | -40.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | F125 F129 T164 W165 L166 A171 S172 | F125-A168 HydrophobicContact CB-CB 4.02Å; F129-A168 HydrophobicContact CD2-CB 4.24Å; F129-A168 HydrophobicContact CE2-CB 4.33Å; T164-A168 WeakPolarHBondContact O-CB 3.01Å; T164-A168 PolarHBondContact O-N 3.47Å; W165-A168 PolarHBondContact O-N 3.27Å; L166-A168 VanDerWaalsContact C-N 3.34Å; L166-A168 PolarHBondContact O-N 3.19Å; A168-A171 PolarHBondContact O-N 3.48Å; A168-S172 WeakPolarHBondContact O-CB 3.3Å; A168-S172 PolarHBondContact O-N 3.29Å; A168-S172 VanDerWaalsContact O-N 3.11Å; A168-S172 PolarHBondContact O-OG 3.11Å |
| 169 | V | 97.8 | Very high | 96.2 | Very high | 63 Ų | 63 | 46.9 Ų | 46.9 | 38% | 0.382 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -63.5 | -48.8 | 175.2 | 170.1 | 0 | 0 | 0 | 0 | 110.3 | I122 W165 L166 V167 A171 S172 V173 | I122-V169 HydrophobicContact CD1-CG2 3.99Å; I122-V169 HydrophobicContact CG1-CG2 4.2Å; W165-V169 VanDerWaalsContact O-CG2 3.31Å; W165-V169 WeakPolarHBondContact O-CG2 3.28Å; W165-V169 PolarHBondContact O-N 3.19Å; L166-V169 PolarHBondContact O-N 3.05Å; V167-V169 PolarHBondContact O-N 3.21Å; V169-A171 PolarHBondContact O-N 2.98Å; V169-S172 WeakPolarHBondContact O-CA 3.42Å; V169-S172 WeakPolarHBondContact O-CB 3.46Å; V169-S172 PolarHBondContact O-N 3.44Å; V169-V173 WeakPolarHBondContact O-CG2 3.34Å; V169-V173 PolarHBondContact O-N 2.88Å |
| 170 | F | 97.3 | Very high | 96.1 | Very high | 145 Ų | 145 | 47.1 Ų | 47.1 | 64% | 0.636 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -60.2 | -42.7 | 178.1 | -73.5 | -58.6 | 0 | 0 | 0 | 112.6 | L166 V167 S172 V173 | L166-F170 HydrophobicContact CB-CD2 4.46Å; L166-F170 HydrophobicContact CB-CE2 4.25Å; L166-F170 WeakPolarHBondContact O-CD2 3.39Å; L166-F170 PolarHBondContact O-N 3.44Å; V167-F170 PolarHBondContact O-N 3.44Å; F170-S172 PolarHBondContact O-N 3.31Å; F170-V173 WeakPolarHBondContact O-CB 3.17Å; F170-V173 PolarHBondContact O-N 3.47Å |
| 171 | A | 95.4 | Very high | 96.1 | Very high | 8 Ų | 8 | 50 Ų | 50 | 7% | 0.066 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.1 | -25.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | F125 V167 A168 V169 M205 L209 | F125-A171 HydrophobicContact CD1-CB 4.32Å; F125-A171 HydrophobicContact CD2-CB 3.73Å; F125-A171 HydrophobicContact CE1-CB 4.44Å; F125-A171 HydrophobicContact CE2-CB 3.86Å; F125-A171 HydrophobicContact CG-CB 3.98Å; F125-A171 HydrophobicContact CZ-CB 4.22Å; V167-A171 WeakPolarHBondContact O-CB 3.11Å; V167-A171 PolarHBondContact O-N 3.02Å; A168-A171 PolarHBondContact O-N 3.48Å; V169-A171 PolarHBondContact O-N 2.98Å; A171-M205 VanDerWaalsContact O-CE 3.27Å; A171-M205 WeakPolarHBondContact O-CE 3.23Å; A171-L209 HydrophobicContact CB-CD1 4.12Å |
| 172 | S | 96.6 | Very high | 95.9 | Very high | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -83.9 | -19.9 | 179.1 | -56.5 | 0 | 0 | 0 | 0 | 113.8 | H121 I122 A168 V169 F170 G175 I176 | H121-S172 VanDerWaalsContact C-OG 3.24Å; H121-S172 VanDerWaalsContact CB-OG 3.26Å; H121-S172 WeakPolarHBondContact CB-OG 3.34Å; I122-S172 WeakPolarHBondContact CG1-OG 3.32Å; I122-S172 PolarHBondContact N-OG 3.48Å; I122-S172 VanDerWaalsContact N-OG 3.16Å; A168-S172 WeakPolarHBondContact O-CB 3.3Å; A168-S172 PolarHBondContact O-N 3.29Å; A168-S172 VanDerWaalsContact O-N 3.11Å; A168-S172 PolarHBondContact O-OG 3.11Å; V169-S172 WeakPolarHBondContact O-CA 3.42Å; V169-S172 WeakPolarHBondContact O-CB 3.46Å; V169-S172 PolarHBondContact O-N 3.44Å; F170-S172 PolarHBondContact O-N 3.31Å; S172-G175 PolarHBondContact O-N 2.63Å; S172-G175 VanDerWaalsContact O-N 3.14Å; S172-I176 WeakPolarHBondContact O-CG1 3.48Å; S172-I176 PolarHBondContact O-N 3.3Å; S172-I176 VanDerWaalsContact O-N 3.1Å |
| 173 | V | 95.8 | Very high | 95.6 | Very high | 56 Ų | 56 | 54.2 Ų | 54.2 | 34% | 0.339 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -54.5 | -47.6 | -174.8 | 170.9 | 0 | 0 | 0 | 0 | 113.2 | V169 F170 G175 I176 I177 | V169-V173 WeakPolarHBondContact O-CG2 3.34Å; V169-V173 PolarHBondContact O-N 2.88Å; F170-V173 WeakPolarHBondContact O-CB 3.17Å; F170-V173 PolarHBondContact O-N 3.47Å; V173-G175 VanDerWaalsContact C-N 3.31Å; V173-G175 PolarHBondContact O-N 3.48Å; V173-I176 PolarHBondContact O-N 3.01Å; V173-I176 VanDerWaalsContact O-N 3.15Å; V173-I177 HydrophobicContact CG1-CD1 3.56Å; V173-I177 HydrophobicContact CG1-CG1 4.13Å; V173-I177 WeakPolarHBondContact O-CG1 3.4Å; V173-I177 PolarHBondContact O-N 3.23Å |
| 174 | P | 93.8 | Very high | 95 | Very high | 14 Ų | 14 | 53.3 Ų | 53.3 | 9% | 0.091 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59 | -42.9 | 178.9 | -23.8 | 34.6 | 0 | 0 | 0 | 112.3 | I176 I177 F178 F194 | P174-I176 VanDerWaalsContact C-N 3.31Å; P174-I176 PolarHBondContact O-N 2.94Å; P174-I177 PolarHBondContact O-N 3.27Å; P174-F178 VanDerWaalsContact O-CD2 3.24Å; P174-F178 WeakPolarHBondContact O-CD2 3.23Å; P174-F178 PolarHBondContact O-N 2.7Å; P174-F178 VanDerWaalsContact O-N 3.09Å; P174-F194 HydrophobicContact CB-CE1 4.25Å |
| 175 | G | 92.5 | Very high | 94.4 | Very high | 1 Ų | 1 | 59 Ų | 59 | 1% | 0.01 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.1 | -41.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | S172 V173 T179 | S172-G175 PolarHBondContact O-N 2.63Å; S172-G175 VanDerWaalsContact O-N 3.14Å; V173-G175 VanDerWaalsContact C-N 3.31Å; V173-G175 PolarHBondContact O-N 3.48Å; G175-T179 WeakPolarHBondContact O-CB 3.37Å; G175-T179 PolarHBondContact O-N 3.03Å; G175-T179 VanDerWaalsContact O-N 3.11Å; G175-T179 PolarHBondContact O-OG1 2.9Å |
| 176 | I | 95.3 | Very high | 93.9 | Very high | 46 Ų | 46 | 61.3 Ų | 61.3 | 24% | 0.236 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -71 | -40.3 | 179.4 | -62.6 | 164.7 | 0 | 0 | 0 | 111.6 | K114 G118 S172 V173 P174 | K114-I176 HydrophobicContact CB-CG2 4.28Å; K114-I176 PolarHBondContact NZ-O 3.35Å; G118-I176 VanDerWaalsContact CA-CG1 3.49Å; S172-I176 WeakPolarHBondContact O-CG1 3.48Å; S172-I176 PolarHBondContact O-N 3.3Å; S172-I176 VanDerWaalsContact O-N 3.1Å; V173-I176 PolarHBondContact O-N 3.01Å; V173-I176 VanDerWaalsContact O-N 3.15Å; P174-I176 VanDerWaalsContact C-N 3.31Å; P174-I176 PolarHBondContact O-N 2.94Å |
| 177 | I | 95.1 | Very high | 93.4 | Very high | 100 Ų | 100 | 59.8 Ų | 59.8 | 51% | 0.513 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -67.1 | -49.5 | -177.5 | -71.4 | 177 | 0 | 0 | 0 | 110.5 | K114 V173 P174 | K114-I177 PolarHBondContact NZ-O 3.36Å; V173-I177 HydrophobicContact CG1-CD1 3.56Å; V173-I177 HydrophobicContact CG1-CG1 4.13Å; V173-I177 WeakPolarHBondContact O-CG1 3.4Å; V173-I177 PolarHBondContact O-N 3.23Å; P174-I177 PolarHBondContact O-N 3.27Å |
| 178 | F | 94.1 | Very high | 93.1 | Very high | 39 Ų | 39 | 60.3 Ų | 60.3 | 17% | 0.171 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -88.1 | -10.9 | -171.7 | -65.3 | -69.5 | 0 | 0 | 0 | 114.2 | P174 Y193 F194 P195 W198 | P174-F178 VanDerWaalsContact O-CD2 3.24Å; P174-F178 WeakPolarHBondContact O-CD2 3.23Å; P174-F178 PolarHBondContact O-N 2.7Å; P174-F178 VanDerWaalsContact O-N 3.09Å; F178-Y193 PolarHBondContact O-N 2.74Å; F178-F194 HydrophobicContact CB-CD1 3.49Å; F178-F194 VanDerWaalsContact CB-CD1 3.49Å; F178-F194 HydrophobicContact CB-CD2 4.13Å; F178-F194 HydrophobicContact CB-CE1 3.6Å; F178-F194 HydrophobicContact CB-CE2 4.2Å; F178-F194 HydrophobicContact CB-CG 3.79Å; F178-F194 HydrophobicContact CB-CZ 3.96Å; F178-F194 HydrophobicContact CD1-CD1 4.47Å; F178-F194 AromaticContact CD2-CD1 3.35Å; F178-F194 HydrophobicContact CD2-CD1 3.35Å; F178-F194 AromaticContact CD2-CE1 3.39Å; F178-F194 HydrophobicContact CD2-CE1 3.39Å; F178-F194 HydrophobicContact CD2-CG 4.4Å; F178-F194 HydrophobicContact CD2-CZ 4.44Å; F178-F194 HydrophobicContact CE2-CD1 4.2Å; F178-F194 HydrophobicContact CE2-CE1 4.38Å; F178-F194 AromaticContact CG-CD1 3.52Å; F178-F194 HydrophobicContact CG-CD1 3.52Å; F178-F194 AromaticContact CG-CE1 3.82Å; F178-F194 HydrophobicContact CG-CE1 3.82Å; F178-F194 HydrophobicContact CG-CG 4.16Å; F178-P195 HydrophobicContact CD1-CG 4.47Å; F178-P195 VanDerWaalsContact CE1-CD 3.48Å; F178-P195 HydrophobicContact CE1-CG 3.97Å; F178-W198 HydrophobicContact CE1-CG 4.48Å; F178-W198 HydrophobicContact CE2-CB 4.07Å; F178-W198 AromaticContact CE2-CD2 3.61Å; F178-W198 HydrophobicContact CE2-CD2 3.61Å; F178-W198 AromaticContact CE2-CE3 3.73Å; F178-W198 HydrophobicContact CE2-CE3 3.73Å; F178-W198 AromaticContact CE2-CG 3.79Å; F178-W198 HydrophobicContact CE2-CG 3.79Å; F178-W198 HydrophobicContact CE2-CZ3 4.38Å; F178-W198 HydrophobicContact CZ-CB 4.18Å; F178-W198 AromaticContact CZ-CD1 3.8Å; F178-W198 AromaticContact CZ-CD2 3.69Å; F178-W198 HydrophobicContact CZ-CD2 3.69Å; F178-W198 AromaticContact CZ-CE2 3.91Å; F178-W198 HydrophobicContact CZ-CE3 4.26Å; F178-W198 AromaticContact CZ-CG 3.64Å; F178-W198 HydrophobicContact CZ-CG 3.64Å; F178-W198 AromaticContact CZ-NE1 3.94Å |
| 179 | T | 94.4 | Very high | 92.8 | Very high | 7 Ų | 7 | 62.5 Ų | 62.5 | 4% | 0.043 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.1 | 130.2 | 170.6 | -59.4 | 0 | 0 | 0 | 0 | 111 | K114 T117 G175 G191 | K114-T179 WeakPolarHBondContact CG-O 3.47Å; K114-T179 PolarHBondContact NZ-O 3.21Å; T117-T179 HydrophobicContact CG2-CG2 4.02Å; T117-T179 VanDerWaalsContact OG1-CG2 3.23Å; T117-T179 WeakPolarHBondContact OG1-CG2 3.3Å; G175-T179 WeakPolarHBondContact O-CB 3.37Å; G175-T179 PolarHBondContact O-N 3.03Å; G175-T179 VanDerWaalsContact O-N 3.11Å; G175-T179 PolarHBondContact O-OG1 2.9Å; T179-G191 WeakPolarHBondContact CA-O 3.25Å |
| 180 | K | 94.6 | Very high | 92.6 | Very high | 81 Ų | 81 | 60.1 Ų | 60.1 | 35% | 0.352 | 30% | 0.303 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.9 | 159.5 | -179.7 | 53.5 | 173.3 | -179.8 | 166.3 | 0 | 110.8 | N110 C113 G191 Y193 | N110-K180 WeakPolarHBondContact OD1-CA 3.39Å; C113-K180 VanDerWaalsContact SG-C 3.56Å; K180-G191 PolarHBondContact N-O 3.33Å; K180-G191 VanDerWaalsContact N-O 3.09Å; K180-G191 PolarHBondContact O-N 3.11Å; K180-Y193 HydrophobicContact CD-CD2 4.01Å; K180-Y193 HydrophobicContact CD-CG 4.38Å; K180-Y193 VanDerWaalsContact CE-CB 3.46Å; K180-Y193 HydrophobicContact CG-CD2 3.31Å; K180-Y193 HydrophobicContact CG-CE2 3.84Å; K180-Y193 HydrophobicContact CG-CG 4.12Å |
| 181 | R | 94.2 | Very high | 92.2 | Very high | 84 Ų | 84 | 53.6 Ų | 53.6 | 32% | 0.317 | 28% | 0.277 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.4 | 126 | 166.1 | -178.1 | -172.3 | -176.8 | -137.4 | 0.3 | 108.6 | W106 N110 Y188 I189 | W106-R181 PolarHBondContact O-NE 2.83Å; N110-R181 HydrophobicContact CB-CB 4.12Å; N110-R181 PolarHBondContact OD1-N 3.09Å; R181-Y188 HydrophobicContact CG-CD1 4.29Å; R181-Y188 VanDerWaalsContact CZ-CD1 3.45Å; R181-Y188 VanDerWaalsContact NH2-CD1 3.33Å; R181-Y188 VanDerWaalsContact NH2-CD2 3.34Å; R181-I189 WeakPolarHBondContact CA-O 3.47Å |
| 182 | Q | 91.9 | Very high | 92 | Very high | 69 Ų | 69 | 57.6 Ų | 57.6 | 32% | 0.322 | 30% | 0.302 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.7 | 152.1 | 175.5 | -178.9 | 170.1 | -37.3 | 0 | 0 | 109.9 | I189 Y193 | Q182-I189 PolarHBondContact N-O 3.32Å; Q182-I189 PolarHBondContact O-N 2.78Å; Q182-Y193 HydrophobicContact CB-CE1 4.43Å; Q182-Y193 HydrophobicContact CB-CE2 3.83Å; Q182-Y193 WeakPolarHBondContact CB-OH 3.45Å; Q182-Y193 HydrophobicContact CG-CE1 4.47Å |
| 183 | E | 91.4 | Very high | 91.7 | Very high | 104 Ų | 104 | 60.1 Ų | 60.1 | 49% | 0.486 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 125.2 | 174.9 | -172 | 177.9 | 175.8 | 0 | 0 | 109.4 | V187 Y188 | E183-V187 WeakPolarHBondContact CA-O 3.43Å; E183-Y188 HydrophobicContact CB-CD1 4.16Å; E183-Y188 HydrophobicContact CB-CE1 4.01Å; E183-Y188 HydrophobicContact CG-CE1 4.47Å |
| 184 | E | 86.3 | Confident | 91.4 | Very high | 74 Ų | 74 | 59 Ų | 59 | 35% | 0.346 | 30% | 0.302 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.3 | 126.7 | 175.1 | -71.2 | -176.4 | -174.4 | 0 | 0 | 108.6 | S186 V187 I189 Y193 | E184-S186 VanDerWaalsContact C-N 3.26Å; E184-S186 PolarHBondContact O-N 3.1Å; E184-V187 PolarHBondContact N-O 2.96Å; E184-V187 PolarHBondContact O-N 3.39Å; E184-V187 VanDerWaalsContact O-O 3.11Å; E184-I189 HydrophobicContact CB-CD1 4.09Å; E184-Y193 VanDerWaalsContact OE1-CE1 3.25Å; E184-Y193 WeakPolarHBondContact OE1-CE1 3.48Å; E184-Y193 VanDerWaalsContact OE1-CZ 3.31Å; E184-Y193 PolarHBondContact OE1-OH 2.85Å |
| 185 | D | 85.2 | Confident | 91.3 | Very high | 134 Ų | 134 | 61.5 Ų | 61.5 | 72% | 0.717 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.9 | 42.1 | -177.6 | -55 | -36.4 | 0 | 0 | 0 | 113.6 | V187 | D185-V187 PolarHBondContact O-N 3.11Š|
| 186 | S | 87.6 | Confident | 91 | Very high | 102 Ų | 102 | 69.4 Ų | 69.4 | 71% | 0.713 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.3 | 19.6 | -176.1 | -49.5 | 0 | 0 | 0 | 0 | 115 | E184 | E184-S186 VanDerWaalsContact C-N 3.26Å; E184-S186 PolarHBondContact O-N 3.1Å |
| 187 | V | 87.6 | Confident | 90.8 | Very high | 60 Ų | 60 | 69.8 Ų | 69.8 | 36% | 0.364 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 132.9 | 177.8 | 179.6 | 0 | 0 | 0 | 0 | 109.6 | E105 E183 E184 D185 I189 | E105-V187 HydrophobicContact CB-CG1 3.85Å; E183-V187 WeakPolarHBondContact CA-O 3.43Å; E184-V187 PolarHBondContact N-O 2.96Å; E184-V187 PolarHBondContact O-N 3.39Å; E184-V187 VanDerWaalsContact O-O 3.11Å; D185-V187 PolarHBondContact O-N 3.11Å; V187-I189 HydrophobicContact CG1-CG1 4.28Å |
| 188 | Y | 91.1 | Very high | 90.7 | Very high | 79 Ų | 79 | 71 Ų | 71 | 31% | 0.31 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.2 | 125.2 | 174.1 | -70.7 | -77.6 | 0 | 0 | 0 | 111.7 | W106 R181 E183 | W106-Y188 WeakPolarHBondContact CB-O 3.26Å; W106-Y188 PolarHBondContact N-O 3.49Å; W106-Y188 WeakPolarHBondContact O-CB 3.33Å; R181-Y188 HydrophobicContact CG-CD1 4.29Å; R181-Y188 VanDerWaalsContact CZ-CD1 3.45Å; R181-Y188 VanDerWaalsContact NH2-CD1 3.33Å; R181-Y188 VanDerWaalsContact NH2-CD2 3.34Å; E183-Y188 HydrophobicContact CB-CD1 4.16Å; E183-Y188 HydrophobicContact CB-CE1 4.01Å; E183-Y188 HydrophobicContact CG-CE1 4.47Å |
| 189 | I | 90.4 | Very high | 90.5 | Very high | 46 Ų | 46 | 71.8 Ų | 71.8 | 24% | 0.236 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 142.3 | 179.6 | -54.1 | 178.3 | 0 | 0 | 0 | 109.6 | R181 Q182 E184 V187 | R181-I189 WeakPolarHBondContact CA-O 3.47Å; Q182-I189 PolarHBondContact N-O 3.32Å; Q182-I189 PolarHBondContact O-N 2.78Å; E184-I189 HydrophobicContact CB-CD1 4.09Å; V187-I189 HydrophobicContact CG1-CG1 4.28Å |
| 190 | C | 93.3 | Very high | 90.4 | Very high | 13 Ų | 13 | 73.5 Ų | 73.5 | 9% | 0.088 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 105.2 | 166 | 175.1 | 0 | 0 | 0 | 0 | 108.3 | W106 C113 | W106-C190 HydrophobicContact CB-CB 4.32Å; W106-C190 HydrophobicContact CD2-CB 3.5Å; W106-C190 HydrophobicContact CE3-CB 3.72Å; W106-C190 HydrophobicContact CG-CB 3.75Å; W106-C190 HydrophobicContact CZ2-CB 4.49Å; W106-C190 HydrophobicContact CZ3-CB 4.3Å; C113-C190 WeakPolarHBondContact CA-SG 3.26Å; C113-C190 HydrophobicContact CB-CB 3.85Å; C113-C190 WeakPolarHBondContact CB-SG 3.4Å; C113-C190 VanDerWaalsContact SG-CA 3.58Å; C113-C190 WeakPolarHBondContact SG-CB 3.44Å; C113-C190 CovalentContact SG-SG 2.03Å; C113-C190 PolarHBondContact SG-SG 3.33Å |
| 191 | G | 90.4 | Very high | 90.3 | Very high | 9 Ų | 9 | 74.6 Ų | 74.6 | 9% | 0.093 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.4 | 161 | -170.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | T179 K180 Y193 | T179-G191 WeakPolarHBondContact CA-O 3.25Å; K180-G191 PolarHBondContact N-O 3.33Å; K180-G191 VanDerWaalsContact N-O 3.09Å; K180-G191 PolarHBondContact O-N 3.11Å; G191-Y193 WeakPolarHBondContact O-CD2 3.44Å; G191-Y193 VanDerWaalsContact O-CE2 3.28Å; G191-Y193 WeakPolarHBondContact O-CE2 3.17Å |
| 192 | P | 90.8 | Very high | 90.3 | Very high | 91 Ų | 91 | 71 Ų | 71 | 59% | 0.591 | 37% | 0.368 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.6 | 125 | 175.8 | 31.3 | -32.8 | 0 | 0 | 0 | 111.8 | F194 | P192-F194 HydrophobicContact CB-CD2 3.74Å; P192-F194 HydrophobicContact CB-CE2 3.57Å |
| 193 | Y | 91.2 | Very high | 90.3 | Very high | 53 Ų | 53 | 67.8 Ų | 67.8 | 21% | 0.208 | 35% | 0.353 | C | S | . | . | trans | -120.5 | 67.8 | 178.1 | -64 | -87 | 0 | 0 | 0 | 110.8 | F178 K180 Q182 E184 G191 | F178-Y193 PolarHBondContact O-N 2.74Å; K180-Y193 HydrophobicContact CD-CD2 4.01Å; K180-Y193 HydrophobicContact CD-CG 4.38Å; K180-Y193 VanDerWaalsContact CE-CB 3.46Å; K180-Y193 HydrophobicContact CG-CD2 3.31Å; K180-Y193 HydrophobicContact CG-CE2 3.84Å; K180-Y193 HydrophobicContact CG-CG 4.12Å; Q182-Y193 HydrophobicContact CB-CE1 4.43Å; Q182-Y193 HydrophobicContact CB-CE2 3.83Å; Q182-Y193 WeakPolarHBondContact CB-OH 3.45Å; Q182-Y193 HydrophobicContact CG-CE1 4.47Å; E184-Y193 VanDerWaalsContact OE1-CE1 3.25Å; E184-Y193 WeakPolarHBondContact OE1-CE1 3.48Å; E184-Y193 VanDerWaalsContact OE1-CZ 3.31Å; E184-Y193 PolarHBondContact OE1-OH 2.85Å; G191-Y193 WeakPolarHBondContact O-CD2 3.44Å; G191-Y193 VanDerWaalsContact O-CE2 3.28Å; G191-Y193 WeakPolarHBondContact O-CE2 3.17Å | ||
| 194 | F | 89.4 | Confident | 90.5 | Very high | 33 Ų | 33 | 66.3 Ų | 66.3 | 15% | 0.145 | 35% | 0.348 | C | S | . | . | trans | -82.5 | 135.7 | 180 | -69.7 | -91.2 | 0 | 0 | 0 | 111.9 | P174 F178 P192 W198 N199 H202 | P174-F194 HydrophobicContact CB-CE1 4.25Å; F178-F194 HydrophobicContact CB-CD1 3.49Å; F178-F194 VanDerWaalsContact CB-CD1 3.49Å; F178-F194 HydrophobicContact CB-CD2 4.13Å; F178-F194 HydrophobicContact CB-CE1 3.6Å; F178-F194 HydrophobicContact CB-CE2 4.2Å; F178-F194 HydrophobicContact CB-CG 3.79Å; F178-F194 HydrophobicContact CB-CZ 3.96Å; F178-F194 HydrophobicContact CD1-CD1 4.47Å; F178-F194 AromaticContact CD2-CD1 3.35Å; F178-F194 HydrophobicContact CD2-CD1 3.35Å; F178-F194 AromaticContact CD2-CE1 3.39Å; F178-F194 HydrophobicContact CD2-CE1 3.39Å; F178-F194 HydrophobicContact CD2-CG 4.4Å; F178-F194 HydrophobicContact CD2-CZ 4.44Å; F178-F194 HydrophobicContact CE2-CD1 4.2Å; F178-F194 HydrophobicContact CE2-CE1 4.38Å; F178-F194 AromaticContact CG-CD1 3.52Å; F178-F194 HydrophobicContact CG-CD1 3.52Å; F178-F194 AromaticContact CG-CE1 3.82Å; F178-F194 HydrophobicContact CG-CE1 3.82Å; F178-F194 HydrophobicContact CG-CG 4.16Å; P192-F194 HydrophobicContact CB-CD2 3.74Å; P192-F194 HydrophobicContact CB-CE2 3.57Å; F194-W198 HydrophobicContact CD1-CB 4.07Å; F194-N199 HydrophobicContact CB-CB 3.69Å; F194-N199 HydrophobicContact CG-CB 4.48Å; F194-H202 HydrophobicContact CE1-CB 4.05Å; F194-H202 HydrophobicContact CZ-CB 4.31Å; F194-H202 AromaticContact CZ-CD2 3.68Å; F194-H202 AromaticContact CZ-CG 3.88Å | ||
| 195 | P | 91.8 | Very high | 90.9 | Very high | 66 Ų | 66 | 64.1 Ų | 64.1 | 43% | 0.429 | 34% | 0.338 | S | S | . | . | trans | -58.3 | 149.2 | 160.7 | -21.2 | 31.2 | 0 | 0 | 0 | 110.8 | F178 G197 W198 N199 | F178-P195 HydrophobicContact CD1-CG 4.47Å; F178-P195 VanDerWaalsContact CE1-CD 3.48Å; F178-P195 HydrophobicContact CE1-CG 3.97Å; P195-G197 VanDerWaalsContact C-N 3.3Å; P195-G197 PolarHBondContact O-N 2.69Å; P195-G197 VanDerWaalsContact O-N 3.1Å; P195-W198 WeakPolarHBondContact O-CA 3.48Å; P195-W198 PolarHBondContact O-N 3.41Å; P195-N199 PolarHBondContact O-N 3.18Å | ||
| 196 | R | 85.4 | Confident | 91.3 | Very high | 168 Ų | 168 | 58 Ų | 58 | 63% | 0.634 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -47.7 | -46.9 | -174 | -167.2 | 173.4 | -177 | 166.2 | 2.2 | 113.7 | N199 N200 E270 | R196-N199 PolarHBondContact O-N 2.84Å; R196-N200 VanDerWaalsContact O-CG 3.24Å; R196-N200 PolarHBondContact O-N 2.89Å; R196-N200 VanDerWaalsContact O-N 3.14Å; R196-N200 PolarHBondContact O-OD1 3.29Å; R196-E270 IonicContact CZ-OE1 2.7Å; R196-E270 IonicContact NH2-OE1 3.27Å; R196-E270 PolarHBondContact NH2-OE1 3.47Å; R196-E270 IonicContact NH2-OE2 3.26Å; R196-E270 PolarHBondContact NH2-OE2 3.02Å |
| 197 | G | 90.1 | Very high | 91.6 | Very high | 53 Ų | 53 | 53.8 Ų | 53.8 | 55% | 0.546 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | P195 F201 | P195-G197 VanDerWaalsContact C-N 3.3Å; P195-G197 PolarHBondContact O-N 2.69Å; P195-G197 VanDerWaalsContact O-N 3.1Å; G197-F201 WeakPolarHBondContact O-CB 3.49Å; G197-F201 PolarHBondContact O-N 3.4Å |
| 198 | W | 92.9 | Very high | 92 | Very high | 125 Ų | 125 | 55 Ų | 55 | 47% | 0.473 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -72.9 | -33.3 | 177.9 | -78 | 100.4 | 0 | 0 | 0 | 112.5 | F178 F194 P195 F201 H202 | F178-W198 HydrophobicContact CE1-CG 4.48Å; F178-W198 HydrophobicContact CE2-CB 4.07Å; F178-W198 AromaticContact CE2-CD2 3.61Å; F178-W198 HydrophobicContact CE2-CD2 3.61Å; F178-W198 AromaticContact CE2-CE3 3.73Å; F178-W198 HydrophobicContact CE2-CE3 3.73Å; F178-W198 AromaticContact CE2-CG 3.79Å; F178-W198 HydrophobicContact CE2-CG 3.79Å; F178-W198 HydrophobicContact CE2-CZ3 4.38Å; F178-W198 HydrophobicContact CZ-CB 4.18Å; F178-W198 AromaticContact CZ-CD1 3.8Å; F178-W198 AromaticContact CZ-CD2 3.69Å; F178-W198 HydrophobicContact CZ-CD2 3.69Å; F178-W198 AromaticContact CZ-CE2 3.91Å; F178-W198 HydrophobicContact CZ-CE3 4.26Å; F178-W198 AromaticContact CZ-CG 3.64Å; F178-W198 HydrophobicContact CZ-CG 3.64Å; F178-W198 AromaticContact CZ-NE1 3.94Å; F194-W198 HydrophobicContact CD1-CB 4.07Å; P195-W198 WeakPolarHBondContact O-CA 3.48Å; P195-W198 PolarHBondContact O-N 3.41Å; W198-F201 HydrophobicContact CE3-CD1 4.18Å; W198-F201 HydrophobicContact CZ3-CD1 4.3Å; W198-F201 HydrophobicContact CZ3-CE1 4.48Å; W198-F201 PolarHBondContact O-N 3.23Å; W198-H202 VanDerWaalsContact O-CB 3.28Å; W198-H202 WeakPolarHBondContact O-CB 3.3Å; W198-H202 PolarHBondContact O-N 3.45Å |
| 199 | N | 90.9 | Very high | 92.2 | Very high | 56 Ų | 56 | 53 Ų | 53 | 30% | 0.299 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.8 | -48.9 | 173.8 | -167 | 46.9 | 0 | 0 | 0 | 110.5 | F194 P195 R196 F201 H202 T203 | F194-N199 HydrophobicContact CB-CB 3.69Å; F194-N199 HydrophobicContact CG-CB 4.48Å; P195-N199 PolarHBondContact O-N 3.18Å; R196-N199 PolarHBondContact O-N 2.84Å; N199-F201 PolarHBondContact O-N 3.49Å; N199-H202 PolarHBondContact O-N 3.5Å; N199-T203 PolarHBondContact O-N 3Å; N199-T203 PolarHBondContact O-OG1 3.44Å |
| 200 | N | 91.9 | Very high | 92.2 | Very high | 43 Ų | 43 | 50.8 Ų | 50.8 | 23% | 0.23 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.6 | -47.2 | 177 | -65.9 | 2 | 0 | 0 | 0 | 111.6 | R196 T203 I204 T267 F268 | R196-N200 VanDerWaalsContact O-CG 3.24Å; R196-N200 PolarHBondContact O-N 2.89Å; R196-N200 VanDerWaalsContact O-N 3.14Å; R196-N200 PolarHBondContact O-OD1 3.29Å; N200-T203 PolarHBondContact O-N 3.1Å; N200-I204 WeakPolarHBondContact O-CB 3.4Å; N200-I204 VanDerWaalsContact O-CG1 3.3Å; N200-I204 WeakPolarHBondContact O-CG1 3.35Å; N200-I204 PolarHBondContact O-N 2.88Å; N200-T267 VanDerWaalsContact OD1-CG2 3.3Å; N200-T267 WeakPolarHBondContact OD1-CG2 3.29Å; N200-F268 HydrophobicContact CB-CE1 4.23Å; N200-F268 HydrophobicContact CB-CZ 4Å |
| 201 | F | 93.8 | Very high | 92.1 | Very high | 104 Ų | 104 | 51.5 Ų | 51.5 | 46% | 0.456 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -59.2 | -47.3 | 176 | 172.7 | -99.9 | 0 | 0 | 0 | 111.7 | G197 W198 N199 T203 I204 M205 | G197-F201 WeakPolarHBondContact O-CB 3.49Å; G197-F201 PolarHBondContact O-N 3.4Å; W198-F201 HydrophobicContact CE3-CD1 4.18Å; W198-F201 HydrophobicContact CZ3-CD1 4.3Å; W198-F201 HydrophobicContact CZ3-CE1 4.48Å; W198-F201 PolarHBondContact O-N 3.23Å; N199-F201 PolarHBondContact O-N 3.49Å; F201-T203 PolarHBondContact O-N 2.93Å; F201-I204 PolarHBondContact O-N 3.39Å; F201-M205 HydrophobicContact CE1-SD 3.97Å; F201-M205 HydrophobicContact CZ-CB 4.48Å; F201-M205 HydrophobicContact CZ-SD 4.15Å; F201-M205 WeakPolarHBondContact O-CB 3.35Å; F201-M205 PolarHBondContact O-N 3.26Å |
| 202 | H | 92.3 | Very high | 92.3 | Very high | 10 Ų | 10 | 55 Ų | 55 | 5% | 0.046 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -62.1 | -44.6 | -179.3 | -176.4 | 56 | 0 | 0 | 0 | 111.8 | F194 W198 N199 M205 R206 | F194-H202 HydrophobicContact CE1-CB 4.05Å; F194-H202 HydrophobicContact CZ-CB 4.31Å; F194-H202 AromaticContact CZ-CD2 3.68Å; F194-H202 AromaticContact CZ-CG 3.88Å; W198-H202 VanDerWaalsContact O-CB 3.28Å; W198-H202 WeakPolarHBondContact O-CB 3.3Å; W198-H202 PolarHBondContact O-N 3.45Å; N199-H202 PolarHBondContact O-N 3.5Å; H202-M205 PolarHBondContact O-N 3.49Å; H202-R206 VanDerWaalsContact O-CB 3.31Å; H202-R206 WeakPolarHBondContact O-CB 3.38Å; H202-R206 PolarHBondContact O-N 3.41Å |
| 203 | T | 92.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.6 | -45.4 | 177.3 | -63.4 | 0 | 0 | 0 | 0 | 112.2 | N199 N200 F201 R206 N207 I263 L264 T267 F268 | N199-T203 PolarHBondContact O-N 3Å; N199-T203 PolarHBondContact O-OG1 3.44Å; N200-T203 PolarHBondContact O-N 3.1Å; F201-T203 PolarHBondContact O-N 2.93Å; T203-R206 PolarHBondContact O-N 3.04Å; T203-N207 WeakPolarHBondContact O-CB 3.41Å; T203-N207 PolarHBondContact O-N 3.46Å; T203-N207 PolarHBondContact O-ND2 3.48Å; T203-I263 HydrophobicContact CG2-CG1 4.48Å; T203-I263 HydrophobicContact CG2-CG2 4.37Å; T203-L264 HydrophobicContact CG2-CD1 4.12Å; T203-T267 HydrophobicContact CG2-CG2 4.26Å; T203-T267 WeakPolarHBondContact CG2-OG1 3.47Å; T203-T267 PolarHBondContact OG1-OG1 3.36Å; T203-F268 HydrophobicContact CG2-CE2 4.32Å |
| 204 | I | 94.6 | Very high | 92.4 | Very high | 74 Ų | 74 | 51 Ų | 51 | 38% | 0.379 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -64.9 | -47.9 | 177.6 | -68.3 | 167.7 | 0 | 0 | 0 | 110.3 | N200 F201 R206 N207 I208 F268 | N200-I204 WeakPolarHBondContact O-CB 3.4Å; N200-I204 VanDerWaalsContact O-CG1 3.3Å; N200-I204 WeakPolarHBondContact O-CG1 3.35Å; N200-I204 PolarHBondContact O-N 2.88Å; F201-I204 PolarHBondContact O-N 3.39Å; I204-R206 VanDerWaalsContact C-N 3.32Å; I204-R206 PolarHBondContact O-N 2.95Å; I204-N207 PolarHBondContact O-N 2.96Å; I204-I208 HydrophobicContact CG2-CD1 3.62Å; I204-I208 HydrophobicContact CG2-CG1 4.25Å; I204-I208 WeakPolarHBondContact O-CG1 3.4Å; I204-I208 PolarHBondContact O-N 2.98Å; I204-F268 HydrophobicContact CD1-CE2 4.31Å; I204-F268 HydrophobicContact CD1-CZ 3.67Å; I204-F268 HydrophobicContact CG1-CE2 3.92Å; I204-F268 HydrophobicContact CG1-CZ 3.77Å |
| 205 | M | 95.5 | Very high | 92.5 | Very high | 28 Ų | 28 | 53.5 Ų | 53.5 | 14% | 0.138 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -57 | -46 | 178.1 | -177.8 | -165.2 | 78.8 | 0 | 0 | 111 | F125 A171 F201 H202 I208 L209 | F125-M205 HydrophobicContact CZ-CE 4.13Å; A171-M205 VanDerWaalsContact O-CE 3.27Å; A171-M205 WeakPolarHBondContact O-CE 3.23Å; F201-M205 HydrophobicContact CE1-SD 3.97Å; F201-M205 HydrophobicContact CZ-CB 4.48Å; F201-M205 HydrophobicContact CZ-SD 4.15Å; F201-M205 WeakPolarHBondContact O-CB 3.35Å; F201-M205 PolarHBondContact O-N 3.26Å; H202-M205 PolarHBondContact O-N 3.49Å; M205-I208 PolarHBondContact O-N 2.85Å; M205-L209 HydrophobicContact CG-CD1 3.77Å; M205-L209 HydrophobicContact CG-CG 4.39Å; M205-L209 WeakPolarHBondContact O-CB 3.15Å; M205-L209 WeakPolarHBondContact O-CG 3.35Å; M205-L209 PolarHBondContact O-N 3.21Å; M205-L209 HydrophobicContact SD-CD1 4.44Å |
| 206 | R | 93.5 | Very high | 92.6 | Very high | 5 Ų | 5 | 55 Ų | 55 | 2% | 0.019 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.1 | -44.1 | 178.1 | -171.4 | 176.3 | -172 | 176.9 | -1.5 | 111.8 | Y120 Y124 H202 T203 I204 G210 Y259 | Y120-R206 PolarHBondContact OH-NH2 2.94Å; Y124-R206 HydrophobicContact CE1-CG 4.24Å; H202-R206 VanDerWaalsContact O-CB 3.31Å; H202-R206 WeakPolarHBondContact O-CB 3.38Å; H202-R206 PolarHBondContact O-N 3.41Å; T203-R206 PolarHBondContact O-N 3.04Å; I204-R206 VanDerWaalsContact C-N 3.32Å; I204-R206 PolarHBondContact O-N 2.95Å; R206-G210 WeakPolarHBondContact O-CA 3.37Å; R206-G210 PolarHBondContact O-N 3.35Å; R206-Y259 PolarHBondContact NH1-OH 3.33Å |
| 207 | N | 93.9 | Very high | 92.9 | Very high | 13 Ų | 13 | 48.6 Ų | 48.6 | 7% | 0.07 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.6 | -40.6 | 176.2 | -87.9 | -84.7 | 0 | 0 | 0 | 112.3 | T203 I204 L211 V212 N260 | T203-N207 WeakPolarHBondContact O-CB 3.41Å; T203-N207 PolarHBondContact O-N 3.46Å; T203-N207 PolarHBondContact O-ND2 3.48Å; I204-N207 PolarHBondContact O-N 2.96Å; N207-L211 WeakPolarHBondContact O-CA 3.34Å; N207-L211 VanDerWaalsContact O-CB 3.26Å; N207-L211 WeakPolarHBondContact O-CB 3.35Å; N207-L211 PolarHBondContact O-N 2.84Å; N207-V212 PolarHBondContact O-N 2.95Å; N207-N260 PolarHBondContact ND2-O 3.22Å; N207-N260 PolarHBondContact OD1-O 3.29Å; N207-N260 VanDerWaalsContact OD1-O 3.11Å |
| 208 | I | 95.8 | Very high | 92.8 | Very high | 86 Ų | 86 | 46.7 Ų | 46.7 | 44% | 0.441 | 23% | 0.233 | S | C | . | . | I | π-helix | trans | -64.2 | -51.1 | 177.6 | -69.4 | 171.5 | 0 | 0 | 0 | 110.5 | I204 M205 V212 L213 | I204-I208 HydrophobicContact CG2-CD1 3.62Å; I204-I208 HydrophobicContact CG2-CG1 4.25Å; I204-I208 WeakPolarHBondContact O-CG1 3.4Å; I204-I208 PolarHBondContact O-N 2.98Å; M205-I208 PolarHBondContact O-N 2.85Å; I208-V212 PolarHBondContact O-N 2.96Å; I208-L213 VanDerWaalsContact O-CB 3.23Å; I208-L213 WeakPolarHBondContact O-CB 3.38Å; I208-L213 PolarHBondContact O-N 2.97Å |
| 209 | L | 94.9 | Very high | 92.6 | Very high | 37 Ų | 37 | 45.1 Ų | 45.1 | 19% | 0.194 | 24% | 0.237 | C | C | . | . | I | π-helix | trans | -76 | -33.6 | -174.5 | -63.1 | 177 | 0 | 0 | 0 | 113.1 | F125 F129 A171 M205 L213 P214 | F125-L209 HydrophobicContact CD1-CB 4.48Å; F125-L209 HydrophobicContact CE1-CB 4.16Å; F125-L209 HydrophobicContact CE1-CD1 4.29Å; F129-L209 HydrophobicContact CE1-CB 4.27Å; F129-L209 HydrophobicContact CE1-CD2 4.45Å; F129-L209 HydrophobicContact CZ-CB 4.34Å; F129-L209 HydrophobicContact CZ-CD1 4.33Å; F129-L209 HydrophobicContact CZ-CD2 4.39Å; A171-L209 HydrophobicContact CB-CD1 4.12Å; M205-L209 HydrophobicContact CG-CD1 3.77Å; M205-L209 HydrophobicContact CG-CG 4.39Å; M205-L209 WeakPolarHBondContact O-CB 3.15Å; M205-L209 WeakPolarHBondContact O-CG 3.35Å; M205-L209 PolarHBondContact O-N 3.21Å; M205-L209 HydrophobicContact SD-CD1 4.44Å; L209-L213 HydrophobicContact CD2-CD2 4.34Å; L209-P214 VanDerWaalsContact O-CD 3.3Å; L209-P214 WeakPolarHBondContact O-CD 3.18Å; L209-P214 WeakPolarHBondContact O-CG 3.46Å |
| 210 | G | 90.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 24% | 0.243 | C | C | . | . | I | π-helix | trans | -96 | -16.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | R206 Y252 | R206-G210 WeakPolarHBondContact O-CA 3.37Å; R206-G210 PolarHBondContact O-N 3.35Å; G210-Y252 VanDerWaalsContact O-CE1 3.29Å; G210-Y252 WeakPolarHBondContact O-CE1 3.37Å; G210-Y252 PolarHBondContact O-OH 2.93Å; G210-Y252 VanDerWaalsContact O-OH 3.04Å |
| 211 | L | 91.8 | Very high | 92.3 | Very high | 28 Ų | 28 | 44.6 Ų | 44.6 | 15% | 0.147 | 23% | 0.234 | C | C | . | . | I | π-helix | trans | -129.3 | -60 | -178 | -175.5 | 64.4 | 0 | 0 | 0 | 112.4 | N207 P214 L215 F253 T257 N260 | N207-L211 WeakPolarHBondContact O-CA 3.34Å; N207-L211 VanDerWaalsContact O-CB 3.26Å; N207-L211 WeakPolarHBondContact O-CB 3.35Å; N207-L211 PolarHBondContact O-N 2.84Å; L211-P214 WeakPolarHBondContact O-CD 3.27Å; L211-L215 WeakPolarHBondContact O-CB 3.4Å; L211-L215 PolarHBondContact O-N 2.73Å; L211-F253 HydrophobicContact CD1-CD1 3.79Å; L211-F253 HydrophobicContact CD1-CE1 3.94Å; L211-T257 HydrophobicContact CD1-CG2 3.86Å; L211-T257 WeakPolarHBondContact CD1-OG1 3.26Å; L211-T257 HydrophobicContact CD2-CG2 4.35Å; L211-N260 HydrophobicContact CD2-CB 4.45Å |
| 212 | V | 94.6 | Very high | 91.8 | Very high | 81 Ų | 81 | 41.3 Ų | 41.3 | 49% | 0.491 | 22% | 0.219 | S | C | . | . | I | π-helix | trans | -66.5 | -49.5 | -171.8 | -179.2 | 0 | 0 | 0 | 0 | 111.8 | N207 I208 L215 L216 | N207-V212 PolarHBondContact O-N 2.95Å; I208-V212 PolarHBondContact O-N 2.96Å; V212-L215 PolarHBondContact O-N 3.46Å; V212-L216 WeakPolarHBondContact O-CB 3.46Å; V212-L216 PolarHBondContact O-N 3.13Å |
| 213 | L | 93.9 | Very high | 91.4 | Very high | 62 Ų | 62 | 43.4 Ų | 43.4 | 33% | 0.325 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.7 | -50.8 | -179.6 | 173.6 | 71.9 | 0 | 0 | 0 | 111.9 | I132 I208 L209 L215 L216 I217 | I132-L213 HydrophobicContact CD1-CD2 4.24Å; I132-L213 HydrophobicContact CD1-CG 4.26Å; I208-L213 VanDerWaalsContact O-CB 3.23Å; I208-L213 WeakPolarHBondContact O-CB 3.38Å; I208-L213 PolarHBondContact O-N 2.97Å; L209-L213 HydrophobicContact CD2-CD2 4.34Å; L213-L215 VanDerWaalsContact C-N 3.29Å; L213-L215 PolarHBondContact O-N 2.74Å; L213-L216 PolarHBondContact O-N 2.92Å; L213-I217 HydrophobicContact CD1-CG1 4.37Å; L213-I217 WeakPolarHBondContact O-CG1 3.36Å; L213-I217 PolarHBondContact O-N 3.34Å |
| 214 | P | 90.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -56.5 | -41.6 | 174.3 | -24.6 | 31.5 | 0 | 0 | 0 | 113.2 | I128 I132 L209 L211 I217 M218 M249 F253 | I128-P214 HydrophobicContact CD1-CB 3.79Å; I128-P214 HydrophobicContact CD1-CG 3.59Å; I128-P214 HydrophobicContact CG1-CB 4.24Å; I128-P214 HydrophobicContact CG1-CG 3.46Å; I128-P214 VanDerWaalsContact CG1-CG 3.46Å; I132-P214 HydrophobicContact CD1-CB 4.24Å; I132-P214 HydrophobicContact CD1-CG 3.83Å; I132-P214 HydrophobicContact CG1-CB 4.27Å; I132-P214 HydrophobicContact CG1-CG 4.37Å; L209-P214 VanDerWaalsContact O-CD 3.3Å; L209-P214 WeakPolarHBondContact O-CD 3.18Å; L209-P214 WeakPolarHBondContact O-CG 3.46Å; L211-P214 WeakPolarHBondContact O-CD 3.27Å; P214-I217 PolarHBondContact O-N 2.86Å; P214-M218 WeakPolarHBondContact O-CB 3.24Å; P214-M218 PolarHBondContact O-N 3.39Å; P214-M249 HydrophobicContact CB-CE 3.98Å; P214-F253 HydrophobicContact CB-CE1 4.05Å; P214-F253 HydrophobicContact CB-CZ 3.66Å |
| 215 | L | 91.3 | Very high | 90.2 | Very high | 84 Ų | 84 | 40.7 Ų | 40.7 | 44% | 0.44 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -67.9 | -42.9 | -178.3 | -175.3 | 67.5 | 0 | 0 | 0 | 111.5 | L211 V212 L213 M218 V219 F253 | L211-L215 WeakPolarHBondContact O-CB 3.4Å; L211-L215 PolarHBondContact O-N 2.73Å; V212-L215 PolarHBondContact O-N 3.46Å; L213-L215 VanDerWaalsContact C-N 3.29Å; L213-L215 PolarHBondContact O-N 2.74Å; L215-M218 WeakPolarHBondContact O-CB 3.41Å; L215-M218 PolarHBondContact O-N 3.36Å; L215-V219 WeakPolarHBondContact O-CG2 3.42Å; L215-V219 PolarHBondContact O-N 2.88Å; L215-F253 HydrophobicContact CB-CE1 4.18Å; L215-F253 HydrophobicContact CB-CZ 4.04Å; L215-F253 HydrophobicContact CD1-CZ 4.31Å |
| 216 | L | 93.7 | Very high | 89.5 | Confident | 98 Ų | 98 | 44.4 Ų | 44.4 | 51% | 0.513 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -60.1 | -48.1 | 176.5 | 179.1 | 63.1 | 0 | 0 | 0 | 111.2 | V212 L213 M218 V219 I220 | V212-L216 WeakPolarHBondContact O-CB 3.46Å; V212-L216 PolarHBondContact O-N 3.13Å; L213-L216 PolarHBondContact O-N 2.92Å; L216-M218 VanDerWaalsContact C-N 3.29Å; L216-M218 PolarHBondContact O-N 3.45Å; L216-V219 PolarHBondContact O-N 3Å; L216-I220 HydrophobicContact CD1-CD1 3.89Å; L216-I220 HydrophobicContact CD1-CG1 4.41Å; L216-I220 HydrophobicContact CG-CD1 3.9Å; L216-I220 VanDerWaalsContact O-CG1 3.32Å; L216-I220 WeakPolarHBondContact O-CG1 3.28Å; L216-I220 PolarHBondContact O-N 3.4Å |
| 217 | I | 91.3 | Very high | 88.9 | Confident | 33 Ų | 33 | 51.5 Ų | 51.5 | 17% | 0.169 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61 | -42 | 176.9 | -65.3 | -64.4 | 0 | 0 | 0 | 110.6 | I132 T135 I136 L213 P214 I220 C221 | I132-I217 HydrophobicContact CG2-CG1 4.23Å; I132-I217 HydrophobicContact CG2-CG2 4.24Å; T135-I217 HydrophobicContact CG2-CG2 4.39Å; I136-I217 HydrophobicContact CD1-CD1 4.46Å; I136-I217 HydrophobicContact CD1-CG2 4.36Å; I136-I217 HydrophobicContact CG1-CG2 3.91Å; L213-I217 HydrophobicContact CD1-CG1 4.37Å; L213-I217 WeakPolarHBondContact O-CG1 3.36Å; L213-I217 PolarHBondContact O-N 3.34Å; P214-I217 PolarHBondContact O-N 2.86Å; I217-I220 PolarHBondContact O-N 3.4Å; I217-C221 VanDerWaalsContact O-CB 3.25Å; I217-C221 WeakPolarHBondContact O-CB 3.25Å; I217-C221 PolarHBondContact O-N 3.26Å; I217-C221 PolarHBondContact O-SG 3.07Å; I217-C221 VanDerWaalsContact O-SG 3.35Å |
| 218 | M | 87.4 | Confident | 87.9 | Confident | 13 Ų | 13 | 52.4 Ų | 52.4 | 6% | 0.064 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -57.5 | -52.8 | 176.6 | -170 | -179.1 | -161.9 | 0 | 0 | 111.2 | P214 L215 L216 I220 C221 Y222 F246 M249 I250 F253 | P214-M218 WeakPolarHBondContact O-CB 3.24Å; P214-M218 PolarHBondContact O-N 3.39Å; L215-M218 WeakPolarHBondContact O-CB 3.41Å; L215-M218 PolarHBondContact O-N 3.36Å; L216-M218 VanDerWaalsContact C-N 3.29Å; L216-M218 PolarHBondContact O-N 3.45Å; M218-I220 VanDerWaalsContact C-N 3.34Å; M218-I220 PolarHBondContact O-N 3.13Å; M218-C221 PolarHBondContact O-N 2.99Å; M218-Y222 HydrophobicContact CB-CD2 4.36Å; M218-Y222 HydrophobicContact CE-CD2 4.44Å; M218-Y222 HydrophobicContact CE-CE2 4.26Å; M218-Y222 HydrophobicContact CG-CD2 3.46Å; M218-Y222 VanDerWaalsContact CG-CD2 3.46Å; M218-Y222 HydrophobicContact CG-CE2 3.74Å; M218-Y222 WeakPolarHBondContact O-CB 3.48Å; M218-Y222 WeakPolarHBondContact O-CD2 3.34Å; M218-Y222 PolarHBondContact O-N 3.37Å; M218-F246 HydrophobicContact CE-CD2 3.59Å; M218-F246 HydrophobicContact CE-CE2 3.43Å; M218-F246 VanDerWaalsContact CE-CE2 3.43Å; M218-F246 HydrophobicContact CE-CZ 4.27Å; M218-M249 HydrophobicContact CB-SD 4.12Å; M218-M249 HydrophobicContact CE-CB 3.91Å; M218-M249 HydrophobicContact CG-SD 4.18Å; M218-M249 HydrophobicContact SD-CB 4.39Å; M218-M249 HydrophobicContact SD-SD 4.49Å; M218-I250 HydrophobicContact CE-CD1 3.45Å; M218-I250 VanDerWaalsContact CE-CD1 3.45Å; M218-I250 HydrophobicContact CE-CG1 3.78Å; M218-F253 HydrophobicContact SD-CD2 4.08Å; M218-F253 HydrophobicContact SD-CE2 3.53Å; M218-F253 VanDerWaalsContact SD-CE2 3.53Å |
| 219 | V | 89.5 | Confident | 86.8 | Confident | 92 Ų | 92 | 49.5 Ų | 49.5 | 56% | 0.558 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -58.6 | -45.3 | -179.2 | 172 | 0 | 0 | 0 | 0 | 111.5 | L215 L216 S223 | L215-V219 WeakPolarHBondContact O-CG2 3.42Å; L215-V219 PolarHBondContact O-N 2.88Å; L216-V219 PolarHBondContact O-N 3Å; V219-S223 WeakPolarHBondContact O-CB 3.49Å; V219-S223 PolarHBondContact O-N 3.27Å; V219-S223 VanDerWaalsContact O-N 3.08Å; V219-S223 PolarHBondContact O-OG 2.9Å |
| 220 | I | 89.9 | Confident | 85.7 | Confident | 84 Ų | 84 | 54.4 Ų | 54.4 | 43% | 0.431 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -65.1 | -50.3 | 179.5 | -64.9 | 167.4 | 0 | 0 | 0 | 110.9 | L216 I217 M218 S223 G224 | L216-I220 HydrophobicContact CD1-CD1 3.89Å; L216-I220 HydrophobicContact CD1-CG1 4.41Å; L216-I220 HydrophobicContact CG-CD1 3.9Å; L216-I220 VanDerWaalsContact O-CG1 3.32Å; L216-I220 WeakPolarHBondContact O-CG1 3.28Å; L216-I220 PolarHBondContact O-N 3.4Å; I217-I220 PolarHBondContact O-N 3.4Å; M218-I220 VanDerWaalsContact C-N 3.34Å; M218-I220 PolarHBondContact O-N 3.13Å; I220-S223 PolarHBondContact O-OG 2.81Å; I220-G224 PolarHBondContact O-N 2.93Å |
| 221 | C | 86.8 | Confident | 84.8 | Confident | 5 Ų | 5 | 65.2 Ų | 65.2 | 3% | 0.034 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -66.2 | -46.4 | -176.1 | -72.9 | 0 | 0 | 0 | 0 | 111.9 | T135 Y139 I217 M218 G224 I225 | T135-C221 HydrophobicContact CG2-CB 3.95Å; Y139-C221 VanDerWaalsContact CB-SG 3.6Å; Y139-C221 HydrophobicContact CD2-CB 3.97Å; Y139-C221 WeakPolarHBondContact CD2-O 3.3Å; Y139-C221 HydrophobicContact CG-CB 4.08Å; I217-C221 VanDerWaalsContact O-CB 3.25Å; I217-C221 WeakPolarHBondContact O-CB 3.25Å; I217-C221 PolarHBondContact O-N 3.26Å; I217-C221 PolarHBondContact O-SG 3.07Å; I217-C221 VanDerWaalsContact O-SG 3.35Å; M218-C221 PolarHBondContact O-N 2.99Å; C221-G224 PolarHBondContact O-N 3.48Å; C221-I225 WeakPolarHBondContact O-CB 3.23Å; C221-I225 WeakPolarHBondContact O-CD1 3.33Å; C221-I225 VanDerWaalsContact O-CG1 3.22Å; C221-I225 WeakPolarHBondContact O-CG1 3.19Å; C221-I225 PolarHBondContact O-N 3.32Å |
| 222 | Y | 82.4 | Confident | 83.5 | Confident | 35 Ų | 35 | 66.8 Ų | 66.8 | 14% | 0.137 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -72.4 | -34.1 | -177.2 | -77.5 | -76.4 | 0 | 0 | 0 | 112.9 | T135 M218 G224 I225 L226 V242 F246 | T135-Y222 HydrophobicContact CG2-CE2 4.06Å; M218-Y222 HydrophobicContact CB-CD2 4.36Å; M218-Y222 HydrophobicContact CE-CD2 4.44Å; M218-Y222 HydrophobicContact CE-CE2 4.26Å; M218-Y222 HydrophobicContact CG-CD2 3.46Å; M218-Y222 VanDerWaalsContact CG-CD2 3.46Å; M218-Y222 HydrophobicContact CG-CE2 3.74Å; M218-Y222 WeakPolarHBondContact O-CB 3.48Å; M218-Y222 WeakPolarHBondContact O-CD2 3.34Å; M218-Y222 PolarHBondContact O-N 3.37Å; Y222-G224 PolarHBondContact O-N 3.14Å; Y222-I225 HydrophobicContact CD1-CD1 4.39Å; Y222-I225 HydrophobicContact CE1-CD1 4.45Å; Y222-I225 PolarHBondContact O-N 3.27Å; Y222-L226 VanDerWaalsContact O-CB 3.29Å; Y222-L226 WeakPolarHBondContact O-CB 3.11Å; Y222-L226 PolarHBondContact O-N 3.24Å; Y222-V242 HydrophobicContact CD1-CG1 4.43Å; Y222-V242 HydrophobicContact CE1-CG1 3.82Å; Y222-F246 AromaticContact CD1-CD2 3.73Å; Y222-F246 HydrophobicContact CD1-CD2 3.73Å; Y222-F246 HydrophobicContact CD1-CE2 4.33Å; Y222-F246 HydrophobicContact CD2-CD2 4.07Å; Y222-F246 HydrophobicContact CE1-CB 3.65Å; Y222-F246 AromaticContact CE1-CD2 3.41Å; Y222-F246 HydrophobicContact CE1-CD2 3.41Å; Y222-F246 VanDerWaalsContact CE1-CD2 3.41Å; Y222-F246 HydrophobicContact CE1-CE2 4.41Å; Y222-F246 AromaticContact CE1-CG 3.92Å; Y222-F246 HydrophobicContact CE1-CG 3.92Å; Y222-F246 AromaticContact CE2-CD2 3.8Å; Y222-F246 HydrophobicContact CE2-CD2 3.8Å; Y222-F246 HydrophobicContact CG-CD2 4.07Å; Y222-F246 HydrophobicContact CG-CE2 4.4Å; Y222-F246 AromaticContact CZ-CD2 3.47Å; Y222-F246 VanDerWaalsContact CZ-CD2 3.47Å; Y222-F246 WeakPolarHBondContact OH-CA 3.23Å; Y222-F246 WeakPolarHBondContact OH-CB 3.36Å; Y222-F246 PolarHBondContact OH-N 3.12Å |
| 223 | S | 85 | Confident | 81.7 | Confident | 54 Ų | 54 | 74.3 Ų | 74.3 | 38% | 0.378 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -62.1 | -43 | 173.5 | 63.3 | 0 | 0 | 0 | 0 | 111.7 | V219 I220 K227 | V219-S223 WeakPolarHBondContact O-CB 3.49Å; V219-S223 PolarHBondContact O-N 3.27Å; V219-S223 VanDerWaalsContact O-N 3.08Å; V219-S223 PolarHBondContact O-OG 2.9Å; I220-S223 PolarHBondContact O-OG 2.81Å; S223-K227 WeakPolarHBondContact O-CB 3.19Å; S223-K227 VanDerWaalsContact O-CG 3.29Å; S223-K227 WeakPolarHBondContact O-CG 3.45Å; S223-K227 PolarHBondContact O-N 3.12Å |
| 224 | G | 82.7 | Confident | 79.8 | Confident | 12 Ų | 12 | 78.1 Ų | 78.1 | 12% | 0.124 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -70.4 | -37.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | I220 C221 Y222 T228 | I220-G224 PolarHBondContact O-N 2.93Å; C221-G224 PolarHBondContact O-N 3.48Å; Y222-G224 PolarHBondContact O-N 3.14Å; G224-T228 WeakPolarHBondContact O-CB 3.4Å; G224-T228 PolarHBondContact O-N 2.99Å; G224-T228 PolarHBondContact O-OG1 3.08Å |
| 225 | I | 79.8 | Confident | 78.5 | Confident | 4 Ų | 4 | 83.8 Ų | 83.8 | 2% | 0.021 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -62 | -48.4 | 173.2 | -70.9 | 163.7 | 0 | 0 | 0 | 110.1 | Y139 I142 V143 C221 Y222 T228 L229 V242 | Y139-I225 HydrophobicContact CD2-CG1 4.19Å; I142-I225 HydrophobicContact CD1-CG1 4.45Å; I142-I225 HydrophobicContact CD1-CG2 4.49Å; V143-I225 HydrophobicContact CG2-CG1 4.28Å; C221-I225 WeakPolarHBondContact O-CB 3.23Å; C221-I225 WeakPolarHBondContact O-CD1 3.33Å; C221-I225 VanDerWaalsContact O-CG1 3.22Å; C221-I225 WeakPolarHBondContact O-CG1 3.19Å; C221-I225 PolarHBondContact O-N 3.32Å; Y222-I225 HydrophobicContact CD1-CD1 4.39Å; Y222-I225 HydrophobicContact CE1-CD1 4.45Å; Y222-I225 PolarHBondContact O-N 3.27Å; I225-T228 PolarHBondContact O-N 3.36Å; I225-L229 HydrophobicContact CG2-CD1 3.5Å; I225-L229 HydrophobicContact CG2-CG 4.09Å; I225-L229 WeakPolarHBondContact O-CB 3.46Å; I225-L229 VanDerWaalsContact O-CG 3.26Å; I225-L229 WeakPolarHBondContact O-CG 3.32Å; I225-L229 PolarHBondContact O-N 2.9Å; I225-V242 HydrophobicContact CG2-CG1 3.99Å; I225-V242 HydrophobicContact CG2-CG2 4.2Å |
| 226 | L | 79 | Confident | 76.9 | Confident | 106 Ų | 106 | 89.1 Ų | 89.1 | 56% | 0.555 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -62.3 | -46.1 | -178.5 | -172.2 | 63.3 | 0 | 0 | 0 | 111.4 | Y222 T228 L229 L230 | Y222-L226 VanDerWaalsContact O-CB 3.29Å; Y222-L226 WeakPolarHBondContact O-CB 3.11Å; Y222-L226 PolarHBondContact O-N 3.24Å; L226-T228 VanDerWaalsContact C-N 3.29Å; L226-T228 PolarHBondContact O-N 2.98Å; L226-L229 PolarHBondContact O-N 3Å; L226-L230 HydrophobicContact CG-CD1 4.15Å; L226-L230 WeakPolarHBondContact O-CB 3.47Å; L226-L230 VanDerWaalsContact O-CG 3.28Å; L226-L230 WeakPolarHBondContact O-CG 3.46Å; L226-L230 PolarHBondContact O-N 3.01Å |
| 227 | K | 81.8 | Confident | 75 | Confident | 155 Ų | 155 | 93.6 Ų | 93.6 | 67% | 0.674 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -55.6 | -43.5 | 174 | -75.1 | 176.7 | -178.5 | -179.1 | 0 | 112.1 | S223 R231 | S223-K227 WeakPolarHBondContact O-CB 3.19Å; S223-K227 VanDerWaalsContact O-CG 3.29Å; S223-K227 WeakPolarHBondContact O-CG 3.45Å; S223-K227 PolarHBondContact O-N 3.12Å; K227-R231 PolarHBondContact O-N 3.34Å |
| 228 | T | 73.9 | Confident | 73.7 | Confident | 32 Ų | 32 | 95.2 Ų | 95.2 | 20% | 0.196 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -72.2 | -34.2 | -179.4 | -53.9 | 0 | 0 | 0 | 0 | 112.3 | I142 G224 I225 L226 R231 C232 | I142-T228 HydrophobicContact CG2-CG2 4.4Å; G224-T228 WeakPolarHBondContact O-CB 3.4Å; G224-T228 PolarHBondContact O-N 2.99Å; G224-T228 PolarHBondContact O-OG1 3.08Å; I225-T228 PolarHBondContact O-N 3.36Å; L226-T228 VanDerWaalsContact C-N 3.29Å; L226-T228 PolarHBondContact O-N 2.98Å; T228-R231 PolarHBondContact O-N 2.89Å; T228-C232 PolarHBondContact O-N 3.15Å; T228-C232 VanDerWaalsContact O-N 3.13Å |
| 229 | L | 71.6 | Confident | 72.6 | Confident | 25 Ų | 25 | 98.2 Ų | 98.2 | 13% | 0.131 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -72.6 | -37.8 | 176.4 | -69.7 | 170.9 | 0 | 0 | 0 | 112.1 | I225 L226 R231 C232 R238 | I225-L229 HydrophobicContact CG2-CD1 3.5Å; I225-L229 HydrophobicContact CG2-CG 4.09Å; I225-L229 WeakPolarHBondContact O-CB 3.46Å; I225-L229 VanDerWaalsContact O-CG 3.26Å; I225-L229 WeakPolarHBondContact O-CG 3.32Å; I225-L229 PolarHBondContact O-N 2.9Å; L226-L229 PolarHBondContact O-N 3Å; L229-R231 PolarHBondContact O-N 3.48Å; L229-C232 CarbonylContact O-C 3.38Å; L229-C232 PolarHBondContact O-N 2.96Å; L229-C232 VanDerWaalsContact O-O 3.12Å; L229-R238 VanDerWaalsContact CD2-NH2 3.31Å |
| 230 | L | 72.4 | Confident | 71.5 | Confident | 139 Ų | 139 | 97.9 Ų | 97.9 | 73% | 0.728 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -63.3 | -30.7 | 173.5 | -70.2 | 170.4 | 0 | 0 | 0 | 111.8 | L226 | L226-L230 HydrophobicContact CG-CD1 4.15Å; L226-L230 WeakPolarHBondContact O-CB 3.47Å; L226-L230 VanDerWaalsContact O-CG 3.28Å; L226-L230 WeakPolarHBondContact O-CG 3.46Å; L226-L230 PolarHBondContact O-N 3.01Å |
| 231 | R | 71.7 | Confident | 70.3 | Confident | 227 Ų | 227 | 95.5 Ų | 95.5 | 86% | 0.857 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -82 | -23.4 | 177.9 | -159.3 | 172.7 | -176.7 | 179.5 | 0.9 | 114 | K227 T228 L229 | K227-R231 PolarHBondContact O-N 3.34Å; T228-R231 PolarHBondContact O-N 2.89Å; L229-R231 PolarHBondContact O-N 3.48Å |
| 232 | C | 63.6 | Low | 69.6 | Low | 61 Ų | 61 | 96 Ų | 96 | 41% | 0.412 | 45% | 0.448 | S | S | . | . | trans | -122.4 | 97.2 | -176.5 | -61.7 | 0 | 0 | 0 | 0 | 111.2 | T228 L229 N234 | T228-C232 PolarHBondContact O-N 3.15Å; T228-C232 VanDerWaalsContact O-N 3.13Å; L229-C232 CarbonylContact O-C 3.38Å; L229-C232 PolarHBondContact O-N 2.96Å; L229-C232 VanDerWaalsContact O-O 3.12Å; C232-N234 PolarHBondContact O-N 2.98Å | ||
| 233 | R | 57.5 | Low | 69.2 | Low | 239 Ų | 239 | 102.7 Ų | 102.7 | 90% | 0.902 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.9 | -3.9 | -166.4 | -175.3 | 161.4 | 144.5 | 169.1 | -7.8 | 117 | ||
| 234 | N | 54.2 | Low | 68.7 | Low | 142 Ų | 142 | 101.4 Ų | 101.4 | 76% | 0.759 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -129.3 | 18.4 | -157.4 | -103.1 | -3.5 | 0 | 0 | 0 | 120.8 | C232 | C232-N234 PolarHBondContact O-N 2.98Š|
| 235 | E | 62.2 | Low | 68.4 | Low | 119 Ų | 119 | 101.4 Ų | 101.4 | 56% | 0.556 | 46% | 0.459 | S | S | * | . | trans | -121.5 | 80.4 | -176 | -68.6 | -62.3 | 161.4 | 0 | 0 | 115.6 | K237 R238 H239 | E235-K237 VanDerWaalsContact C-N 3.26Å; E235-K237 PolarHBondContact O-N 3.04Å; E235-K237 VanDerWaalsContact O-N 3.14Å; E235-R238 HydrophobicContact CB-CB 4.18Å; E235-R238 WeakPolarHBondContact O-CB 3.17Å; E235-R238 PolarHBondContact O-N 2.97Å; E235-H239 PolarHBondContact O-CD2 2.97Å | ||
| 236 | K | 58.1 | Low | 68.4 | Low | 196 Ų | 196 | 105.3 Ų | 105.3 | 85% | 0.852 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -51.3 | -34.9 | 179.3 | -71.1 | -179.9 | 179.9 | 176.9 | 0 | 114.5 | R238 | K236-R238 PolarHBondContact O-N 3.41Å |
| 237 | K | 55.1 | Low | 68.6 | Low | 193 Ų | 193 | 102.6 Ų | 102.6 | 84% | 0.839 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -69.7 | -29.1 | 179.5 | -81.1 | 178.2 | 179.6 | 169.3 | 0 | 113.2 | E235 | E235-K237 VanDerWaalsContact C-N 3.26Å; E235-K237 PolarHBondContact O-N 3.04Å; E235-K237 VanDerWaalsContact O-N 3.14Å |
| 238 | R | 62.2 | Low | 68.7 | Low | 67 Ų | 67 | 95.4 Ų | 95.4 | 25% | 0.253 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -73.4 | -35.9 | -177.3 | -159.2 | 170.4 | 76.1 | 174.6 | 5.6 | 111.9 | I142 L229 E235 K236 R240 V242 | I142-R238 HydrophobicContact CD1-CG 4.05Å; I142-R238 HydrophobicContact CG1-CG 3.87Å; L229-R238 VanDerWaalsContact CD2-NH2 3.31Å; E235-R238 HydrophobicContact CB-CB 4.18Å; E235-R238 WeakPolarHBondContact O-CB 3.17Å; E235-R238 PolarHBondContact O-N 2.97Å; K236-R238 PolarHBondContact O-N 3.41Å; R238-R240 VanDerWaalsContact C-N 3.26Å; R238-R240 PolarHBondContact O-N 2.73Å; R238-V242 WeakPolarHBondContact O-CG2 3.29Å |
| 239 | H | 64.9 | Low | 69.3 | Low | 75 Ų | 75 | 93.9 Ų | 93.9 | 35% | 0.347 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.6 | -30.9 | 177.6 | -66.2 | -80.8 | 0 | 0 | 0 | 113.5 | E235 R243 | E235-H239 PolarHBondContact O-CD2 2.97Å; H239-R243 WeakPolarHBondContact O-CB 3.4Å; H239-R243 VanDerWaalsContact O-CG 3.32Å; H239-R243 WeakPolarHBondContact O-CG 3.33Å; H239-R243 PolarHBondContact O-N 2.75Å |
| 240 | R | 67.2 | Low | 70.1 | Confident | 85 Ų | 85 | 95.7 Ų | 95.7 | 32% | 0.321 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -70.8 | -46.7 | -174.2 | -167.8 | -168 | -168.5 | 126.9 | 20.7 | 113.5 | R238 V242 R243 L244 V308 E310 | R238-R240 VanDerWaalsContact C-N 3.26Å; R238-R240 PolarHBondContact O-N 2.73Å; R240-V242 VanDerWaalsContact C-N 3.26Å; R240-V242 PolarHBondContact O-N 3.09Å; R240-R243 PolarHBondContact O-N 3.42Å; R240-L244 PolarHBondContact O-N 3.46Å; R240-V308 PolarHBondContact NE-O 2.81Å; R240-V308 PolarHBondContact NH2-O 3.25Å; R240-E310 VanDerWaalsContact CZ-CB 3.46Å; R240-E310 VanDerWaalsContact CZ-CD 3.4Å; R240-E310 IonicContact CZ-OE1 3.63Å; R240-E310 VanDerWaalsContact CZ-OE1 3.27Å; R240-E310 IonicContact CZ-OE2 2.74Å; R240-E310 IonicContact NH1-OE1 3.76Å; R240-E310 PolarHBondContact NH1-OE1 3.42Å; R240-E310 IonicContact NH1-OE2 2.63Å; R240-E310 PolarHBondContact NH1-OE2 3.01Å; R240-E310 IonicContact NH2-OE1 2.68Å; R240-E310 PolarHBondContact NH2-OE1 3.44Å; R240-E310 IonicContact NH2-OE2 3.03Å |
| 241 | A | 65.3 | Low | 70.9 | Confident | 35 Ų | 35 | 90.1 Ų | 90.1 | 29% | 0.289 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -65.8 | -34 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | I245 | A241-I245 PolarHBondContact O-N 2.64Å |
| 242 | V | 70.6 | Confident | 71.8 | Confident | 14 Ų | 14 | 79.5 Ų | 79.5 | 9% | 0.085 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -64.6 | -46.8 | 172.4 | 177.5 | 0 | 0 | 0 | 0 | 111.1 | I142 Y222 I225 R238 R240 L244 I245 F246 | I142-V242 HydrophobicContact CD1-CG2 3.11Å; Y222-V242 HydrophobicContact CD1-CG1 4.43Å; Y222-V242 HydrophobicContact CE1-CG1 3.82Å; I225-V242 HydrophobicContact CG2-CG1 3.99Å; I225-V242 HydrophobicContact CG2-CG2 4.2Å; R238-V242 WeakPolarHBondContact O-CG2 3.29Å; R240-V242 VanDerWaalsContact C-N 3.26Å; R240-V242 PolarHBondContact O-N 3.09Å; V242-L244 VanDerWaalsContact C-N 3.33Å; V242-L244 PolarHBondContact O-N 2.9Å; V242-I245 PolarHBondContact O-N 2.93Å; V242-F246 VanDerWaalsContact O-CB 3.25Å; V242-F246 WeakPolarHBondContact O-CB 3.29Å; V242-F246 PolarHBondContact O-N 3.4Å |
| 243 | R | 75 | Confident | 73.1 | Confident | 176 Ų | 176 | 77.6 Ų | 77.6 | 66% | 0.664 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -57.8 | -45.4 | 176.4 | -79 | 177.8 | 65.3 | -175.2 | 0.4 | 111.6 | H239 R240 I245 F246 T247 | H239-R243 WeakPolarHBondContact O-CB 3.4Å; H239-R243 VanDerWaalsContact O-CG 3.32Å; H239-R243 WeakPolarHBondContact O-CG 3.33Å; H239-R243 PolarHBondContact O-N 2.75Å; R240-R243 PolarHBondContact O-N 3.42Å; R243-I245 PolarHBondContact O-N 3.35Å; R243-F246 PolarHBondContact O-N 3.02Å; R243-T247 WeakPolarHBondContact O-CB 3.2Å; R243-T247 PolarHBondContact O-N 2.92Å; R243-T247 PolarHBondContact O-OG1 3Å |
| 244 | L | 74.5 | Confident | 74.8 | Confident | 28 Ų | 28 | 71.5 Ų | 71.5 | 15% | 0.147 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -56.7 | -53.3 | 178.2 | 179.6 | 69.2 | 0 | 0 | 0 | 111.9 | R240 V242 F246 T247 I248 I304 Y305 V308 | R240-L244 PolarHBondContact O-N 3.46Å; V242-L244 VanDerWaalsContact C-N 3.33Å; V242-L244 PolarHBondContact O-N 2.9Å; L244-F246 VanDerWaalsContact C-N 3.33Å; L244-F246 PolarHBondContact O-N 2.92Å; L244-T247 PolarHBondContact O-N 3.27Å; L244-I248 HydrophobicContact CD1-CD1 4.39Å; L244-I248 HydrophobicContact CG-CD1 4.12Å; L244-I248 WeakPolarHBondContact O-CG1 3.13Å; L244-I248 PolarHBondContact O-N 3.39Å; L244-I304 HydrophobicContact CD1-CG2 3.65Å; L244-Y305 HydrophobicContact CD1-CD1 4.31Å; L244-Y305 HydrophobicContact CD2-CD1 4.45Å; L244-V308 HydrophobicContact CB-CG1 4.05Å; L244-V308 HydrophobicContact CD1-CB 3.6Å; L244-V308 HydrophobicContact CD1-CG1 3.69Å |
| 245 | I | 75.6 | Confident | 76.7 | Confident | 11 Ų | 11 | 66.6 Ų | 66.6 | 6% | 0.056 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -72 | -31.6 | -175.5 | -73.4 | 166.4 | 0 | 0 | 0 | 111.6 | L134 R138 A241 V242 R243 I248 M249 | L134-I245 HydrophobicContact CB-CD1 4.27Å; R138-I245 HydrophobicContact CG-CB 4.41Å; R138-I245 HydrophobicContact CG-CD1 3.14Å; R138-I245 HydrophobicContact CG-CG1 4.3Å; A241-I245 PolarHBondContact O-N 2.64Å; V242-I245 PolarHBondContact O-N 2.93Å; R243-I245 PolarHBondContact O-N 3.35Å; I245-I248 PolarHBondContact O-N 3.28Å; I245-M249 PolarHBondContact O-N 3.11Å |
| 246 | F | 80.1 | Confident | 78.2 | Confident | 86 Ų | 86 | 61.3 Ų | 61.3 | 38% | 0.377 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -63.3 | -45.2 | 172.3 | -175.9 | -104 | 0 | 0 | 0 | 111.3 | M218 Y222 V242 R243 L244 I248 M249 I250 | M218-F246 HydrophobicContact CE-CD2 3.59Å; M218-F246 HydrophobicContact CE-CE2 3.43Å; M218-F246 VanDerWaalsContact CE-CE2 3.43Å; M218-F246 HydrophobicContact CE-CZ 4.27Å; Y222-F246 AromaticContact CD1-CD2 3.73Å; Y222-F246 HydrophobicContact CD1-CD2 3.73Å; Y222-F246 HydrophobicContact CD1-CE2 4.33Å; Y222-F246 HydrophobicContact CD2-CD2 4.07Å; Y222-F246 HydrophobicContact CE1-CB 3.65Å; Y222-F246 AromaticContact CE1-CD2 3.41Å; Y222-F246 HydrophobicContact CE1-CD2 3.41Å; Y222-F246 VanDerWaalsContact CE1-CD2 3.41Å; Y222-F246 HydrophobicContact CE1-CE2 4.41Å; Y222-F246 AromaticContact CE1-CG 3.92Å; Y222-F246 HydrophobicContact CE1-CG 3.92Å; Y222-F246 AromaticContact CE2-CD2 3.8Å; Y222-F246 HydrophobicContact CE2-CD2 3.8Å; Y222-F246 HydrophobicContact CG-CD2 4.07Å; Y222-F246 HydrophobicContact CG-CE2 4.4Å; Y222-F246 AromaticContact CZ-CD2 3.47Å; Y222-F246 VanDerWaalsContact CZ-CD2 3.47Å; Y222-F246 WeakPolarHBondContact OH-CA 3.23Å; Y222-F246 WeakPolarHBondContact OH-CB 3.36Å; Y222-F246 PolarHBondContact OH-N 3.12Å; V242-F246 VanDerWaalsContact O-CB 3.25Å; V242-F246 WeakPolarHBondContact O-CB 3.29Å; V242-F246 PolarHBondContact O-N 3.4Å; R243-F246 PolarHBondContact O-N 3.02Å; L244-F246 VanDerWaalsContact C-N 3.33Å; L244-F246 PolarHBondContact O-N 2.92Å; F246-I248 PolarHBondContact O-N 3.49Å; F246-M249 PolarHBondContact O-N 3.42Å; F246-I250 HydrophobicContact CD1-CG1 4.12Å; F246-I250 HydrophobicContact CE1-CD1 4.37Å; F246-I250 HydrophobicContact CE1-CG1 3.77Å; F246-I250 HydrophobicContact CE2-CD1 4.31Å; F246-I250 HydrophobicContact CE2-CG1 4.22Å; F246-I250 HydrophobicContact CG-CG1 4.48Å; F246-I250 HydrophobicContact CZ-CD1 3.97Å; F246-I250 HydrophobicContact CZ-CG1 3.84Å; F246-I250 WeakPolarHBondContact O-CG1 3.19Å; F246-I250 PolarHBondContact O-N 3.24Å |
| 247 | T | 84 | Confident | 79.8 | Confident | 50 Ų | 50 | 53.6 Ų | 53.6 | 31% | 0.307 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -60 | -45.2 | 175.2 | -59.5 | 0 | 0 | 0 | 0 | 111.2 | R243 L244 M249 I250 V251 I304 | R243-T247 WeakPolarHBondContact O-CB 3.2Å; R243-T247 PolarHBondContact O-N 2.92Å; R243-T247 PolarHBondContact O-OG1 3Å; L244-T247 PolarHBondContact O-N 3.27Å; T247-M249 PolarHBondContact O-N 2.69Å; T247-I250 PolarHBondContact O-N 2.84Å; T247-V251 HydrophobicContact CG2-CG2 4.36Å; T247-V251 WeakPolarHBondContact O-CB 3.16Å; T247-V251 VanDerWaalsContact O-CG2 3.28Å; T247-V251 WeakPolarHBondContact O-CG2 3.47Å; T247-V251 PolarHBondContact O-N 2.87Å; T247-I304 HydrophobicContact CG2-CG2 4.25Å |
| 248 | I | 84 | Confident | 81.7 | Confident | 3 Ų | 3 | 46.5 Ų | 46.5 | 2% | 0.015 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.2 | -45.9 | 177.3 | -64.9 | 165.9 | 0 | 0 | 0 | 111.1 | I131 L244 I245 F246 V251 Y252 I304 Y305 | I131-I248 HydrophobicContact CD1-CG2 4.04Å; I131-I248 HydrophobicContact CG1-CG2 4.12Å; I131-I248 HydrophobicContact CG2-CG2 4.37Å; L244-I248 HydrophobicContact CD1-CD1 4.39Å; L244-I248 HydrophobicContact CG-CD1 4.12Å; L244-I248 WeakPolarHBondContact O-CG1 3.13Å; L244-I248 PolarHBondContact O-N 3.39Å; I245-I248 PolarHBondContact O-N 3.28Å; F246-I248 PolarHBondContact O-N 3.49Å; I248-V251 PolarHBondContact O-N 2.9Å; I248-Y252 PolarHBondContact O-N 3.46Å; I248-I304 HydrophobicContact CD1-CG2 4.33Å; I248-I304 HydrophobicContact CG1-CB 4.39Å; I248-I304 HydrophobicContact CG1-CD1 4.06Å; I248-I304 HydrophobicContact CG1-CG2 3.68Å; I248-Y305 HydrophobicContact CD1-CD1 4.32Å; I248-Y305 HydrophobicContact CD1-CE1 3.51Å |
| 249 | M | 84.6 | Confident | 83.2 | Confident | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -64.3 | -45.5 | 177.6 | -76.3 | -138.6 | 100.7 | 0 | 0 | 112.9 | I131 I132 T135 P214 M218 I245 F246 T247 V251 Y252 F253 | I131-M249 HydrophobicContact CG2-CE 3.71Å; I131-M249 HydrophobicContact CG2-CG 3.59Å; I131-M249 HydrophobicContact CG2-SD 4.33Å; I132-M249 HydrophobicContact CG1-CE 4.46Å; T135-M249 HydrophobicContact CG2-SD 4.06Å; T135-M249 PolarHBondContact OG1-SD 3.22Å; T135-M249 VanDerWaalsContact OG1-SD 3.33Å; P214-M249 HydrophobicContact CB-CE 3.98Å; M218-M249 HydrophobicContact CB-SD 4.12Å; M218-M249 HydrophobicContact CE-CB 3.91Å; M218-M249 HydrophobicContact CG-SD 4.18Å; M218-M249 HydrophobicContact SD-CB 4.39Å; M218-M249 HydrophobicContact SD-SD 4.49Å; I245-M249 PolarHBondContact O-N 3.11Å; F246-M249 PolarHBondContact O-N 3.42Å; T247-M249 PolarHBondContact O-N 2.69Å; M249-V251 VanDerWaalsContact C-N 3.32Å; M249-V251 PolarHBondContact O-N 2.67Å; M249-Y252 WeakPolarHBondContact O-CB 3.08Å; M249-Y252 PolarHBondContact O-N 3.23Å; M249-F253 HydrophobicContact CB-CE2 4.47Å; M249-F253 HydrophobicContact CE-CE2 4.36Å; M249-F253 WeakPolarHBondContact O-CD2 3.33Å; M249-F253 PolarHBondContact O-N 2.89Å |
| 250 | I | 88.5 | Confident | 84.5 | Confident | 64 Ų | 64 | 40.3 Ų | 40.3 | 33% | 0.328 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61 | -44.4 | 178.7 | -69.2 | -65.8 | 0 | 0 | 0 | 110.6 | M218 F246 T247 Y252 F253 L254 | M218-I250 HydrophobicContact CE-CD1 3.45Å; M218-I250 VanDerWaalsContact CE-CD1 3.45Å; M218-I250 HydrophobicContact CE-CG1 3.78Å; F246-I250 HydrophobicContact CD1-CG1 4.12Å; F246-I250 HydrophobicContact CE1-CD1 4.37Å; F246-I250 HydrophobicContact CE1-CG1 3.77Å; F246-I250 HydrophobicContact CE2-CD1 4.31Å; F246-I250 HydrophobicContact CE2-CG1 4.22Å; F246-I250 HydrophobicContact CG-CG1 4.48Å; F246-I250 HydrophobicContact CZ-CD1 3.97Å; F246-I250 HydrophobicContact CZ-CG1 3.84Å; F246-I250 WeakPolarHBondContact O-CG1 3.19Å; F246-I250 PolarHBondContact O-N 3.24Å; T247-I250 PolarHBondContact O-N 2.84Å; I250-Y252 VanDerWaalsContact C-N 3.32Å; I250-Y252 PolarHBondContact O-N 3.09Å; I250-F253 PolarHBondContact O-N 3.1Å; I250-L254 HydrophobicContact CG2-CD1 3.87Å; I250-L254 HydrophobicContact CG2-CG 4.22Å; I250-L254 VanDerWaalsContact O-CG 3.3Å; I250-L254 WeakPolarHBondContact O-CG 3.48Å; I250-L254 PolarHBondContact O-N 3Å |
| 251 | V | 90.9 | Very high | 85.8 | Confident | 22 Ų | 22 | 40 Ų | 40 | 13% | 0.133 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.3 | -41.5 | 176.8 | 170 | 0 | 0 | 0 | 0 | 111.1 | T247 I248 M249 F253 L254 F255 I300 I304 | T247-V251 HydrophobicContact CG2-CG2 4.36Å; T247-V251 WeakPolarHBondContact O-CB 3.16Å; T247-V251 VanDerWaalsContact O-CG2 3.28Å; T247-V251 WeakPolarHBondContact O-CG2 3.47Å; T247-V251 PolarHBondContact O-N 2.87Å; I248-V251 PolarHBondContact O-N 2.9Å; M249-V251 VanDerWaalsContact C-N 3.32Å; M249-V251 PolarHBondContact O-N 2.67Å; V251-F253 PolarHBondContact O-N 2.68Å; V251-L254 PolarHBondContact O-N 2.99Å; V251-F255 HydrophobicContact CG1-CD2 3.95Å; V251-F255 HydrophobicContact CG1-CE2 3.92Å; V251-F255 WeakPolarHBondContact O-CD2 3.19Å; V251-F255 PolarHBondContact O-N 2.91Å; V251-F255 VanDerWaalsContact O-N 3.12Å; V251-I300 HydrophobicContact CG1-CB 4.28Å; V251-I300 HydrophobicContact CG1-CG2 3.75Å; V251-I304 HydrophobicContact CB-CD1 4.09Å; V251-I304 HydrophobicContact CG1-CD1 4.14Å; V251-I304 HydrophobicContact CG2-CD1 4.02Å |
| 252 | Y | 90.2 | Very high | 87.1 | Confident | 4 Ų | 4 | 39.3 Ų | 39.3 | 2% | 0.016 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -54.8 | -50.2 | 172.9 | 173.8 | -90.8 | 0 | 0 | 0 | 112 | Y124 I128 I131 G210 I248 M249 I250 L254 F255 W256 H297 | Y124-Y252 PolarHBondContact OH-OH 2.92Å; I128-Y252 HydrophobicContact CB-CE2 3.91Å; I128-Y252 HydrophobicContact CD1-CD1 3.64Å; I128-Y252 HydrophobicContact CD1-CD2 4.08Å; I128-Y252 HydrophobicContact CD1-CE1 3.32Å; I128-Y252 HydrophobicContact CD1-CE2 3.78Å; I128-Y252 HydrophobicContact CD1-CG 4.02Å; I128-Y252 HydrophobicContact CG1-CE1 3.93Å; I128-Y252 HydrophobicContact CG1-CE2 4.11Å; I131-Y252 HydrophobicContact CD1-CD2 4.25Å; G210-Y252 VanDerWaalsContact O-CE1 3.29Å; G210-Y252 WeakPolarHBondContact O-CE1 3.37Å; G210-Y252 PolarHBondContact O-OH 2.93Å; G210-Y252 VanDerWaalsContact O-OH 3.04Å; I248-Y252 PolarHBondContact O-N 3.46Å; M249-Y252 WeakPolarHBondContact O-CB 3.08Å; M249-Y252 PolarHBondContact O-N 3.23Å; I250-Y252 VanDerWaalsContact C-N 3.32Å; I250-Y252 PolarHBondContact O-N 3.09Å; Y252-L254 PolarHBondContact O-N 3.45Å; Y252-F255 PolarHBondContact O-N 3.35Å; Y252-W256 AromaticContact CD2-CD1 3.49Å; Y252-W256 VanDerWaalsContact CD2-CD1 3.49Å; Y252-W256 HydrophobicContact CD2-CG 4.33Å; Y252-W256 HydrophobicContact CE1-CB 4.34Å; Y252-W256 HydrophobicContact CE2-CB 4.24Å; Y252-W256 AromaticContact CE2-CD1 3.34Å; Y252-W256 AromaticContact CE2-CG 3.88Å; Y252-W256 HydrophobicContact CE2-CG 3.88Å; Y252-W256 AromaticContact CE2-NE1 3.96Å; Y252-W256 WeakPolarHBondContact O-CB 3.44Å; Y252-W256 PolarHBondContact O-N 3.01Å; Y252-H297 WeakPolarHBondContact CA-NE2 3.36Å; Y252-H297 AromaticContact CD2-CE1 3.86Å; Y252-H297 AromaticContact CD2-NE2 3.9Å |
| 253 | F | 91.3 | Very high | 88 | Confident | 21 Ų | 21 | 39.8 Ų | 39.8 | 9% | 0.092 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.5 | -40.3 | 179.4 | -71.2 | -64.8 | 0 | 0 | 0 | 112.4 | L211 P214 L215 M218 M249 I250 V251 F255 T257 | L211-F253 HydrophobicContact CD1-CD1 3.79Å; L211-F253 HydrophobicContact CD1-CE1 3.94Å; P214-F253 HydrophobicContact CB-CE1 4.05Å; P214-F253 HydrophobicContact CB-CZ 3.66Å; L215-F253 HydrophobicContact CB-CE1 4.18Å; L215-F253 HydrophobicContact CB-CZ 4.04Å; L215-F253 HydrophobicContact CD1-CZ 4.31Å; M218-F253 HydrophobicContact SD-CD2 4.08Å; M218-F253 HydrophobicContact SD-CE2 3.53Å; M218-F253 VanDerWaalsContact SD-CE2 3.53Å; M249-F253 HydrophobicContact CB-CE2 4.47Å; M249-F253 HydrophobicContact CE-CE2 4.36Å; M249-F253 WeakPolarHBondContact O-CD2 3.33Å; M249-F253 PolarHBondContact O-N 2.89Å; I250-F253 PolarHBondContact O-N 3.1Å; V251-F253 PolarHBondContact O-N 2.68Å; F253-F255 PolarHBondContact O-N 2.53Å; F253-T257 WeakPolarHBondContact CA-OG1 3.25Å; F253-T257 WeakPolarHBondContact O-CB 3.38Å; F253-T257 PolarHBondContact O-N 2.99Å; F253-T257 PolarHBondContact O-OG1 3.19Å |
| 254 | L | 93.1 | Very high | 88.8 | Confident | 110 Ų | 110 | 33.9 Ų | 33.9 | 58% | 0.576 | 18% | 0.177 | S | C | * | . | H | α-helix | trans | -59.6 | -37 | 178.4 | -71.9 | 172 | 0 | 0 | 0 | 112.1 | I250 V251 Y252 P258 | I250-L254 HydrophobicContact CG2-CD1 3.87Å; I250-L254 HydrophobicContact CG2-CG 4.22Å; I250-L254 VanDerWaalsContact O-CG 3.3Å; I250-L254 WeakPolarHBondContact O-CG 3.48Å; I250-L254 PolarHBondContact O-N 3Å; V251-L254 PolarHBondContact O-N 2.99Å; Y252-L254 PolarHBondContact O-N 3.45Å; L254-P258 WeakPolarHBondContact O-CD 3.5Å |
| 255 | F | 92.9 | Very high | 89.6 | Confident | 39 Ų | 39 | 34.8 Ų | 34.8 | 17% | 0.171 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -87.3 | -39.6 | -176.1 | -78.1 | -118.3 | 0 | 0 | 0 | 112.5 | V251 Y252 F253 L293 G294 T296 H297 I300 | V251-F255 HydrophobicContact CG1-CD2 3.95Å; V251-F255 HydrophobicContact CG1-CE2 3.92Å; V251-F255 WeakPolarHBondContact O-CD2 3.19Å; V251-F255 PolarHBondContact O-N 2.91Å; V251-F255 VanDerWaalsContact O-N 3.12Å; Y252-F255 PolarHBondContact O-N 3.35Å; F253-F255 PolarHBondContact O-N 2.53Å; F255-L293 HydrophobicContact CD1-CD1 4.18Å; F255-L293 HydrophobicContact CD1-CG 4.46Å; F255-L293 VanDerWaalsContact CD1-O 3.3Å; F255-L293 WeakPolarHBondContact CD1-O 3.34Å; F255-L293 HydrophobicContact CE1-CD1 4.27Å; F255-G294 WeakPolarHBondContact O-CA 3.33Å; F255-T296 WeakPolarHBondContact CD1-OG1 3.5Å; F255-T296 WeakPolarHBondContact CE1-OG1 3.35Å; F255-H297 HydrophobicContact CB-CB 3.93Å; F255-H297 HydrophobicContact CD1-CB 3.99Å; F255-H297 HydrophobicContact CG-CB 4.17Å; F255-I300 HydrophobicContact CE1-CD1 4.42Å; F255-I300 HydrophobicContact CE1-CG1 4.01Å; F255-I300 HydrophobicContact CZ-CD1 4.26Å; F255-I300 HydrophobicContact CZ-CG1 3.99Å |
| 256 | W | 93.6 | Very high | 90.2 | Very high | 9 Ų | 9 | 36.2 Ų | 36.2 | 3% | 0.034 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -97.9 | -24.6 | -173.2 | -76.5 | 105.6 | 0 | 0 | 0 | 115.1 | F91 Y124 Y252 Y259 N260 G294 H297 | F91-W256 HydrophobicContact CE2-CH2 4.31Å; F91-W256 HydrophobicContact CE2-CZ2 4.4Å; F91-W256 HydrophobicContact CZ-CH2 4.26Å; F91-W256 HydrophobicContact CZ-CZ2 4.3Å; Y124-W256 HydrophobicContact CD2-CD2 4.11Å; Y124-W256 AromaticContact CD2-CE2 3.8Å; Y124-W256 HydrophobicContact CD2-CE3 4.18Å; Y124-W256 AromaticContact CD2-CH2 3.66Å; Y124-W256 HydrophobicContact CD2-CH2 3.66Å; Y124-W256 AromaticContact CD2-CZ2 3.57Å; Y124-W256 HydrophobicContact CD2-CZ2 3.57Å; Y124-W256 AromaticContact CD2-CZ3 3.98Å; Y124-W256 HydrophobicContact CD2-CZ3 3.98Å; Y124-W256 AromaticContact CE2-CD2 3.51Å; Y124-W256 HydrophobicContact CE2-CD2 3.51Å; Y124-W256 AromaticContact CE2-CE2 3.67Å; Y124-W256 AromaticContact CE2-CE3 3.55Å; Y124-W256 HydrophobicContact CE2-CE3 3.55Å; Y124-W256 HydrophobicContact CE2-CG 4.11Å; Y124-W256 AromaticContact CE2-CH2 3.92Å; Y124-W256 HydrophobicContact CE2-CH2 3.92Å; Y124-W256 AromaticContact CE2-CZ2 3.88Å; Y124-W256 HydrophobicContact CE2-CZ2 3.88Å; Y124-W256 AromaticContact CE2-CZ3 3.77Å; Y124-W256 HydrophobicContact CE2-CZ3 3.77Å; Y252-W256 AromaticContact CD2-CD1 3.49Å; Y252-W256 VanDerWaalsContact CD2-CD1 3.49Å; Y252-W256 HydrophobicContact CD2-CG 4.33Å; Y252-W256 HydrophobicContact CE1-CB 4.34Å; Y252-W256 HydrophobicContact CE2-CB 4.24Å; Y252-W256 AromaticContact CE2-CD1 3.34Å; Y252-W256 AromaticContact CE2-CG 3.88Å; Y252-W256 HydrophobicContact CE2-CG 3.88Å; Y252-W256 AromaticContact CE2-NE1 3.96Å; Y252-W256 WeakPolarHBondContact O-CB 3.44Å; Y252-W256 PolarHBondContact O-N 3.01Å; W256-Y259 HydrophobicContact CE3-CD1 4.28Å; W256-Y259 HydrophobicContact CZ3-CD1 4.28Å; W256-Y259 PolarHBondContact O-N 3.04Å; W256-N260 PolarHBondContact O-N 3.3Å; W256-N260 PolarHBondContact O-ND2 3.07Å; W256-G294 VanDerWaalsContact CE2-O 3.32Å; W256-G294 VanDerWaalsContact CZ2-O 3.25Å; W256-G294 WeakPolarHBondContact CZ2-O 3.46Å; W256-G294 PolarHBondContact NE1-O 3.44Å; W256-H297 AromaticContact CD1-CG 3.97Å; W256-H297 AromaticContact NE1-CG 3.66Å; W256-H297 AromaticContact NE1-ND1 3.73Å |
| 257 | T | 93.2 | Very high | 90.5 | Very high | 34 Ų | 34 | 33.3 Ų | 33.3 | 21% | 0.209 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.3 | -43.9 | 180 | -54.4 | 0 | 0 | 0 | 0 | 112.8 | L211 F253 Y259 N260 I261 | L211-T257 HydrophobicContact CD1-CG2 3.86Å; L211-T257 WeakPolarHBondContact CD1-OG1 3.26Å; L211-T257 HydrophobicContact CD2-CG2 4.35Å; F253-T257 WeakPolarHBondContact CA-OG1 3.25Å; F253-T257 WeakPolarHBondContact O-CB 3.38Å; F253-T257 PolarHBondContact O-N 2.99Å; F253-T257 PolarHBondContact O-OG1 3.19Å; T257-Y259 VanDerWaalsContact C-N 3.26Å; T257-Y259 PolarHBondContact O-N 3.37Å; T257-N260 PolarHBondContact O-N 2.79Å; T257-I261 HydrophobicContact CG2-CD1 3.6Å; T257-I261 HydrophobicContact CG2-CG1 4.06Å; T257-I261 WeakPolarHBondContact O-CG1 3.27Å; T257-I261 PolarHBondContact O-N 3.35Å |
| 258 | P | 94.6 | Very high | 90.7 | Very high | 43 Ų | 43 | 33.2 Ų | 33.2 | 28% | 0.279 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -54.4 | -45.6 | 178.5 | -26.1 | 35.5 | 0 | 0 | 0 | 111.9 | L254 I261 V262 T290 L293 | L254-P258 WeakPolarHBondContact O-CD 3.5Å; P258-I261 PolarHBondContact O-N 3.21Å; P258-V262 VanDerWaalsContact O-CG2 3.27Å; P258-V262 WeakPolarHBondContact O-CG2 3.3Å; P258-V262 PolarHBondContact O-N 3.32Å; P258-T290 HydrophobicContact CB-CG2 3.69Å; P258-L293 HydrophobicContact CG-CD2 4.34Å |
| 259 | Y | 93 | Very high | 90.7 | Very high | 12 Ų | 12 | 34.7 Ų | 34.7 | 5% | 0.047 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -65.7 | -45.6 | 178.9 | 176.6 | -92.1 | 0 | 0 | 0 | 112.8 | R206 W256 T257 I261 V262 I263 T287 T290 E291 | R206-Y259 PolarHBondContact NH1-OH 3.33Å; W256-Y259 HydrophobicContact CE3-CD1 4.28Å; W256-Y259 HydrophobicContact CZ3-CD1 4.28Å; W256-Y259 PolarHBondContact O-N 3.04Å; T257-Y259 VanDerWaalsContact C-N 3.26Å; T257-Y259 PolarHBondContact O-N 3.37Å; Y259-I261 VanDerWaalsContact C-N 3.28Å; Y259-I261 PolarHBondContact O-N 3.15Å; Y259-V262 PolarHBondContact O-N 3.03Å; Y259-I263 HydrophobicContact CE1-CD1 4.25Å; Y259-I263 HydrophobicContact CE1-CG2 4.29Å; Y259-I263 WeakPolarHBondContact O-CG2 3.28Å; Y259-I263 PolarHBondContact O-N 2.99Å; Y259-T287 HydrophobicContact CD2-CG2 4.43Å; Y259-T287 HydrophobicContact CE2-CG2 3.8Å; Y259-T290 WeakPolarHBondContact CA-OG1 3.48Å; Y259-E291 HydrophobicContact CD2-CB 3.5Å; Y259-E291 HydrophobicContact CD2-CG 4.07Å; Y259-E291 HydrophobicContact CE2-CB 3.42Å; Y259-E291 VanDerWaalsContact CE2-CB 3.42Å; Y259-E291 HydrophobicContact CE2-CG 3.68Å; Y259-E291 HydrophobicContact CG-CB 4.5Å |
| 260 | N | 93.1 | Very high | 90.4 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.4 | -36.1 | 179.4 | -78 | -71.3 | 0 | 0 | 0 | 112.4 | N207 L211 W256 T257 I263 L264 | N207-N260 PolarHBondContact ND2-O 3.22Å; N207-N260 PolarHBondContact OD1-O 3.29Å; N207-N260 VanDerWaalsContact OD1-O 3.11Å; L211-N260 HydrophobicContact CD2-CB 4.45Å; W256-N260 PolarHBondContact O-N 3.3Å; W256-N260 PolarHBondContact O-ND2 3.07Å; T257-N260 PolarHBondContact O-N 2.79Å; N260-I263 VanDerWaalsContact O-CG2 3.3Å; N260-I263 WeakPolarHBondContact O-CG2 3.25Å; N260-L264 WeakPolarHBondContact O-CB 3.47Å; N260-L264 PolarHBondContact O-N 2.92Å |
| 261 | I | 93.3 | Very high | 90.2 | Very high | 80 Ų | 80 | 46.6 Ų | 46.6 | 41% | 0.41 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -68.8 | -48.6 | 174.6 | -67.8 | 175.7 | 0 | 0 | 0 | 110.5 | T257 P258 Y259 I263 L264 L265 | T257-I261 HydrophobicContact CG2-CD1 3.6Å; T257-I261 HydrophobicContact CG2-CG1 4.06Å; T257-I261 WeakPolarHBondContact O-CG1 3.27Å; T257-I261 PolarHBondContact O-N 3.35Å; P258-I261 PolarHBondContact O-N 3.21Å; Y259-I261 VanDerWaalsContact C-N 3.28Å; Y259-I261 PolarHBondContact O-N 3.15Å; I261-I263 PolarHBondContact O-N 3.41Å; I261-L264 WeakPolarHBondContact O-CB 3.34Å; I261-L264 PolarHBondContact O-N 2.99Å; I261-L264 VanDerWaalsContact O-N 3.17Å; I261-L265 HydrophobicContact CG2-CD1 4.03Å; I261-L265 HydrophobicContact CG2-CG 4.37Å; I261-L265 WeakPolarHBondContact O-CG 3.37Å; I261-L265 PolarHBondContact O-N 3.09Å |
| 262 | V | 92.4 | Very high | 89.7 | Confident | 19 Ų | 19 | 50.1 Ų | 50.1 | 12% | 0.115 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.6 | -42.1 | -177.3 | 174.4 | 0 | 0 | 0 | 0 | 111.4 | P258 Y259 L264 L265 N266 L283 A286 T287 T290 | P258-V262 VanDerWaalsContact O-CG2 3.27Å; P258-V262 WeakPolarHBondContact O-CG2 3.3Å; P258-V262 PolarHBondContact O-N 3.32Å; Y259-V262 PolarHBondContact O-N 3.03Å; V262-L264 VanDerWaalsContact C-N 3.29Å; V262-L264 PolarHBondContact O-N 2.73Å; V262-L265 PolarHBondContact O-N 3.34Å; V262-N266 WeakPolarHBondContact O-CB 3.25Å; V262-N266 PolarHBondContact O-N 3.49Å; V262-L283 HydrophobicContact CG1-CD2 4.24Å; V262-A286 HydrophobicContact CG1-CB 3.82Å; V262-A286 HydrophobicContact CG2-CB 4.17Å; V262-T287 WeakPolarHBondContact CG1-OG1 3.17Å; V262-T290 HydrophobicContact CG2-CG2 4.21Å |
| 263 | I | 90.6 | Very high | 89.2 | Confident | 25 Ų | 25 | 52.5 Ų | 52.5 | 13% | 0.128 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -66.6 | -31.6 | 176.6 | -164 | 169.9 | 0 | 0 | 0 | 112.3 | T203 Y259 N260 I261 T267 | T203-I263 HydrophobicContact CG2-CG1 4.48Å; T203-I263 HydrophobicContact CG2-CG2 4.37Å; Y259-I263 HydrophobicContact CE1-CD1 4.25Å; Y259-I263 HydrophobicContact CE1-CG2 4.29Å; Y259-I263 WeakPolarHBondContact O-CG2 3.28Å; Y259-I263 PolarHBondContact O-N 2.99Å; N260-I263 VanDerWaalsContact O-CG2 3.3Å; N260-I263 WeakPolarHBondContact O-CG2 3.25Å; I261-I263 PolarHBondContact O-N 3.41Å; I263-T267 WeakPolarHBondContact O-CB 3.46Å; I263-T267 PolarHBondContact O-N 2.71Å; I263-T267 PolarHBondContact O-OG1 3.11Å |
| 264 | L | 92 | Very high | 88.7 | Confident | 51 Ų | 51 | 53.9 Ų | 53.9 | 27% | 0.267 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -65 | -48.2 | 172.7 | -172.5 | 73.1 | 0 | 0 | 0 | 110.6 | T203 N260 I261 V262 N266 T267 F268 | T203-L264 HydrophobicContact CG2-CD1 4.12Å; N260-L264 WeakPolarHBondContact O-CB 3.47Å; N260-L264 PolarHBondContact O-N 2.92Å; I261-L264 WeakPolarHBondContact O-CB 3.34Å; I261-L264 PolarHBondContact O-N 2.99Å; I261-L264 VanDerWaalsContact O-N 3.17Å; V262-L264 VanDerWaalsContact C-N 3.29Å; V262-L264 PolarHBondContact O-N 2.73Å; L264-N266 VanDerWaalsContact C-N 3.34Å; L264-N266 PolarHBondContact O-N 2.84Å; L264-T267 PolarHBondContact O-N 3.26Å; L264-F268 HydrophobicContact CD1-CD2 3.82Å; L264-F268 HydrophobicContact CD1-CE2 3.87Å; L264-F268 HydrophobicContact CG-CD2 4.37Å; L264-F268 WeakPolarHBondContact O-CD2 3.07Å; L264-F268 PolarHBondContact O-N 3.49Å; L264-F268 VanDerWaalsContact O-N 3.08Å |
| 265 | L | 90.5 | Very high | 87.8 | Confident | 47 Ų | 47 | 52.4 Ų | 52.4 | 25% | 0.246 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.1 | -41.6 | 176 | -66.5 | 175.2 | 0 | 0 | 0 | 111.6 | I261 V262 T267 F268 Q269 F272 L274 L283 | I261-L265 HydrophobicContact CG2-CD1 4.03Å; I261-L265 HydrophobicContact CG2-CG 4.37Å; I261-L265 WeakPolarHBondContact O-CG 3.37Å; I261-L265 PolarHBondContact O-N 3.09Å; V262-L265 PolarHBondContact O-N 3.34Å; L265-T267 VanDerWaalsContact C-N 3.35Å; L265-T267 PolarHBondContact O-N 2.8Å; L265-F268 CarbonylContact O-C 3.32Å; L265-F268 PolarHBondContact O-N 3.42Å; L265-Q269 WeakPolarHBondContact O-CA 3.04Å; L265-Q269 WeakPolarHBondContact O-CG 3.5Å; L265-Q269 PolarHBondContact O-N 2.64Å; L265-Q269 VanDerWaalsContact O-N 3.13Å; L265-F272 HydrophobicContact CD2-CD1 4.28Å; L265-F272 HydrophobicContact CD2-CD2 3.72Å; L265-F272 HydrophobicContact CD2-CE1 4.43Å; L265-F272 HydrophobicContact CD2-CE2 3.89Å; L265-F272 HydrophobicContact CD2-CG 3.93Å; L265-F272 HydrophobicContact CD2-CZ 4.25Å; L265-L274 HydrophobicContact CB-CD1 4.4Å; L265-L274 HydrophobicContact CD2-CD1 4.34Å; L265-L283 HydrophobicContact CB-CD2 3.98Å |
| 266 | N | 87.6 | Confident | 87.4 | Confident | 42 Ų | 42 | 55.4 Ų | 55.4 | 23% | 0.225 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -67.4 | -34.4 | 179.9 | -157.8 | 32.9 | 0 | 0 | 0 | 112.6 | V262 L264 Q269 L283 D284 | V262-N266 WeakPolarHBondContact O-CB 3.25Å; V262-N266 PolarHBondContact O-N 3.49Å; L264-N266 VanDerWaalsContact C-N 3.34Å; L264-N266 PolarHBondContact O-N 2.84Å; N266-Q269 WeakPolarHBondContact O-CG 3.45Å; N266-Q269 PolarHBondContact OD1-NE2 2.86Å; N266-L283 HydrophobicContact CB-CB 4.43Å; N266-D284 PolarHBondContact ND2-OD1 2.96Å; N266-D284 VanDerWaalsContact ND2-OD1 3.13Å |
| 267 | T | 87.1 | Confident | 86.6 | Confident | 25 Ų | 25 | 58.1 Ų | 58.1 | 15% | 0.153 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -76.8 | -33.7 | 178.6 | -56.1 | 0 | 0 | 0 | 0 | 112.1 | N200 T203 I263 L264 L265 | N200-T267 VanDerWaalsContact OD1-CG2 3.3Å; N200-T267 WeakPolarHBondContact OD1-CG2 3.29Å; T203-T267 HydrophobicContact CG2-CG2 4.26Å; T203-T267 WeakPolarHBondContact CG2-OG1 3.47Å; T203-T267 PolarHBondContact OG1-OG1 3.36Å; I263-T267 WeakPolarHBondContact O-CB 3.46Å; I263-T267 PolarHBondContact O-N 2.71Å; I263-T267 PolarHBondContact O-OG1 3.11Å; L264-T267 PolarHBondContact O-N 3.26Å; L265-T267 VanDerWaalsContact C-N 3.35Å; L265-T267 PolarHBondContact O-N 2.8Å |
| 268 | F | 88.1 | Confident | 86.1 | Confident | 48 Ų | 48 | 63.1 Ų | 63.1 | 21% | 0.211 | 34% | 0.338 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.1 | 36 | -174.9 | -63.1 | -75.9 | 0 | 0 | 0 | 112.7 | N200 T203 I204 L264 L265 E270 F271 F272 | N200-F268 HydrophobicContact CB-CE1 4.23Å; N200-F268 HydrophobicContact CB-CZ 4Å; T203-F268 HydrophobicContact CG2-CE2 4.32Å; I204-F268 HydrophobicContact CD1-CE2 4.31Å; I204-F268 HydrophobicContact CD1-CZ 3.67Å; I204-F268 HydrophobicContact CG1-CE2 3.92Å; I204-F268 HydrophobicContact CG1-CZ 3.77Å; L264-F268 HydrophobicContact CD1-CD2 3.82Å; L264-F268 HydrophobicContact CD1-CE2 3.87Å; L264-F268 HydrophobicContact CG-CD2 4.37Å; L264-F268 WeakPolarHBondContact O-CD2 3.07Å; L264-F268 PolarHBondContact O-N 3.49Å; L264-F268 VanDerWaalsContact O-N 3.08Å; L265-F268 CarbonylContact O-C 3.32Å; L265-F268 PolarHBondContact O-N 3.42Å; F268-E270 VanDerWaalsContact C-N 3.32Å; F268-E270 PolarHBondContact O-N 2.85Å; F268-F271 HydrophobicContact CB-CB 4.24Å; F268-F271 WeakPolarHBondContact O-CB 3.31Å; F268-F271 PolarHBondContact O-N 2.92Å; F268-F272 HydrophobicContact CB-CD2 3.97Å; F268-F272 HydrophobicContact CB-CE2 3.83Å; F268-F272 VanDerWaalsContact O-CD2 3.22Å; F268-F272 WeakPolarHBondContact O-CD2 3.35Å; F268-F272 PolarHBondContact O-N 3.24Å; F268-F272 VanDerWaalsContact O-N 3.15Å |
| 269 | Q | 84.1 | Confident | 85.4 | Confident | 34 Ų | 34 | 62.2 Ų | 62.2 | 16% | 0.159 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -54 | -44.7 | -177.6 | -74 | 177.3 | -12.6 | 0 | 0 | 113.2 | L265 N266 F271 F272 G273 L274 T280 L283 | L265-Q269 WeakPolarHBondContact O-CA 3.04Å; L265-Q269 WeakPolarHBondContact O-CG 3.5Å; L265-Q269 PolarHBondContact O-N 2.64Å; L265-Q269 VanDerWaalsContact O-N 3.13Å; N266-Q269 WeakPolarHBondContact O-CG 3.45Å; N266-Q269 PolarHBondContact OD1-NE2 2.86Å; Q269-F271 VanDerWaalsContact C-N 3.27Å; Q269-F271 PolarHBondContact O-N 3.45Å; Q269-F272 CarbonylContact O-C 3.52Å; Q269-F272 PolarHBondContact O-N 2.95Å; Q269-G273 PolarHBondContact O-N 3.33Å; Q269-L274 HydrophobicContact CB-CB 4.31Å; Q269-L274 HydrophobicContact CG-CB 4.39Å; Q269-L274 PolarHBondContact O-N 3.49Å; Q269-T280 PolarHBondContact NE2-OG1 3.25Å; Q269-T280 PolarHBondContact OE1-OG1 3.49Å; Q269-L283 HydrophobicContact CG-CD1 3.86Å |
| 270 | E | 78.9 | Confident | 84.8 | Confident | 143 Ų | 143 | 63.2 Ų | 63.2 | 67% | 0.668 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -59.6 | -37.9 | 178 | -70.5 | 174.8 | -170.7 | 0 | 0 | 112 | R196 F268 G273 | R196-E270 IonicContact CZ-OE1 2.7Å; R196-E270 IonicContact NH2-OE1 3.27Å; R196-E270 PolarHBondContact NH2-OE1 3.47Å; R196-E270 IonicContact NH2-OE2 3.26Å; R196-E270 PolarHBondContact NH2-OE2 3.02Å; F268-E270 VanDerWaalsContact C-N 3.32Å; F268-E270 PolarHBondContact O-N 2.85Å; E270-G273 PolarHBondContact O-N 3.03Å |
| 271 | F | 83.1 | Confident | 84.1 | Confident | 170 Ų | 170 | 67.2 Ų | 67.2 | 75% | 0.746 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -71.7 | -33.7 | -179.9 | -173.3 | -95.1 | 0 | 0 | 0 | 112.2 | F268 Q269 | F268-F271 HydrophobicContact CB-CB 4.24Å; F268-F271 WeakPolarHBondContact O-CB 3.31Å; F268-F271 PolarHBondContact O-N 2.92Å; Q269-F271 VanDerWaalsContact C-N 3.27Å; Q269-F271 PolarHBondContact O-N 3.45Å |
| 272 | F | 81.6 | Confident | 83.6 | Confident | 97 Ų | 97 | 68.3 Ų | 68.3 | 43% | 0.425 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -90.9 | 0.8 | 179 | -68 | -67 | 0 | 0 | 0 | 113.9 | L265 F268 Q269 L274 | L265-F272 HydrophobicContact CD2-CD1 4.28Å; L265-F272 HydrophobicContact CD2-CD2 3.72Å; L265-F272 HydrophobicContact CD2-CE1 4.43Å; L265-F272 HydrophobicContact CD2-CE2 3.89Å; L265-F272 HydrophobicContact CD2-CG 3.93Å; L265-F272 HydrophobicContact CD2-CZ 4.25Å; F268-F272 HydrophobicContact CB-CD2 3.97Å; F268-F272 HydrophobicContact CB-CE2 3.83Å; F268-F272 VanDerWaalsContact O-CD2 3.22Å; F268-F272 WeakPolarHBondContact O-CD2 3.35Å; F268-F272 PolarHBondContact O-N 3.24Å; F268-F272 VanDerWaalsContact O-N 3.15Å; Q269-F272 CarbonylContact O-C 3.52Å; Q269-F272 PolarHBondContact O-N 2.95Å; F272-L274 VanDerWaalsContact C-N 3.33Å; F272-L274 HydrophobicContact CB-CD1 3.96Å; F272-L274 HydrophobicContact CB-CG 4.09Å |
| 273 | G | 79.1 | Confident | 83.3 | Confident | 54 Ų | 54 | 68.3 Ų | 68.3 | 56% | 0.557 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69 | 27.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114 | Q269 E270 | Q269-G273 PolarHBondContact O-N 3.33Å; E270-G273 PolarHBondContact O-N 3.03Å |
| 274 | L | 80.4 | Confident | 82.7 | Confident | 49 Ų | 49 | 68.6 Ų | 68.6 | 26% | 0.257 | 36% | 0.359 | S | S | . | . | trans | -102.5 | 24.5 | -176.8 | -63.9 | 172.7 | 0 | 0 | 0 | 113 | L265 Q269 F272 N276 S279 L283 | L265-L274 HydrophobicContact CB-CD1 4.4Å; L265-L274 HydrophobicContact CD2-CD1 4.34Å; Q269-L274 HydrophobicContact CB-CB 4.31Å; Q269-L274 HydrophobicContact CG-CB 4.39Å; Q269-L274 PolarHBondContact O-N 3.49Å; F272-L274 VanDerWaalsContact C-N 3.33Å; F272-L274 HydrophobicContact CB-CD1 3.96Å; F272-L274 HydrophobicContact CB-CG 4.09Å; L274-N276 PolarHBondContact O-N 2.64Å; L274-S279 WeakPolarHBondContact O-CB 3.41Å; L274-L283 HydrophobicContact CB-CD1 4.4Å; L274-L283 HydrophobicContact CD1-CD1 4.23Å | ||
| 275 | S | 75.3 | Confident | 82.2 | Confident | 80 Ų | 80 | 69.2 Ų | 69.2 | 56% | 0.559 | 36% | 0.361 | S | S | * | . | trans | -76.5 | 15.8 | -171.7 | 57.1 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 276 | N | 82.8 | Confident | 82 | Confident | 101 Ų | 101 | 68.6 Ų | 68.6 | 54% | 0.54 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -85.9 | 149.8 | -179.7 | -61.6 | -31.9 | 0 | 0 | 0 | 111.2 | L274 E278 S279 T280 | L274-N276 PolarHBondContact O-N 2.64Å; N276-E278 VanDerWaalsContact C-N 3.31Å; N276-E278 PolarHBondContact O-N 3.23Å; N276-S279 PolarHBondContact O-N 3.09Å; N276-T280 PolarHBondContact O-N 3.14Å; N276-T280 PolarHBondContact O-OG1 2.99Å; N276-T280 VanDerWaalsContact O-OG1 3.09Å |
| 277 | C | 78.5 | Confident | 81.9 | Confident | 66 Ų | 66 | 67.5 Ų | 67.5 | 45% | 0.446 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -60 | -40.2 | 179.9 | -175.8 | 0 | 0 | 0 | 0 | 112.3 | C32 T280 R281 | C32-C277 WeakPolarHBondContact CB-SG 3.44Å; C32-C277 VanDerWaalsContact SG-CA 3.55Å; C32-C277 WeakPolarHBondContact SG-CB 3.32Å; C32-C277 CovalentContact SG-SG 2.04Å; C32-C277 PolarHBondContact SG-SG 3.13Å; C277-T280 PolarHBondContact O-N 3.42Å; C277-R281 WeakPolarHBondContact O-CB 3.45Å; C277-R281 PolarHBondContact O-N 3.08Å |
| 278 | E | 80.9 | Confident | 81.6 | Confident | 139 Ų | 139 | 70 Ų | 70 | 65% | 0.65 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -63.1 | -46.5 | 175.4 | -173.8 | 176.8 | -179 | 0 | 0 | 111.7 | N276 T280 R281 Q282 | N276-E278 VanDerWaalsContact C-N 3.31Å; N276-E278 PolarHBondContact O-N 3.23Å; E278-T280 VanDerWaalsContact C-N 3.34Å; E278-T280 PolarHBondContact O-N 2.9Å; E278-R281 PolarHBondContact O-N 2.87Å; E278-Q282 WeakPolarHBondContact O-CB 3.24Å; E278-Q282 WeakPolarHBondContact O-CG 3.38Å; E278-Q282 PolarHBondContact O-N 2.9Å; E278-Q282 PolarHBondContact OE1-NE2 2.84Å |
| 279 | S | 80.5 | Confident | 81.5 | Confident | 25 Ų | 25 | 72.7 Ų | 72.7 | 18% | 0.175 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62 | -40.4 | 177.1 | -56.2 | 0 | 0 | 0 | 0 | 112.1 | L274 N276 Q282 L283 | L274-S279 WeakPolarHBondContact O-CB 3.41Å; N276-S279 PolarHBondContact O-N 3.09Å; S279-Q282 PolarHBondContact O-N 3.27Å; S279-L283 WeakPolarHBondContact O-CB 3.47Å; S279-L283 VanDerWaalsContact O-CG 3.24Å; S279-L283 WeakPolarHBondContact O-CG 3.3Å; S279-L283 PolarHBondContact O-N 3.26Å |
| 280 | T | 79.9 | Confident | 81.8 | Confident | 33 Ų | 33 | 72 Ų | 72 | 20% | 0.202 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -62.9 | -45.6 | 175.7 | -59.6 | 0 | 0 | 0 | 0 | 111.4 | Q269 N276 C277 E278 Q282 L283 D284 | Q269-T280 PolarHBondContact NE2-OG1 3.25Å; Q269-T280 PolarHBondContact OE1-OG1 3.49Å; N276-T280 PolarHBondContact O-N 3.14Å; N276-T280 PolarHBondContact O-OG1 2.99Å; N276-T280 VanDerWaalsContact O-OG1 3.09Å; C277-T280 PolarHBondContact O-N 3.42Å; E278-T280 VanDerWaalsContact C-N 3.34Å; E278-T280 PolarHBondContact O-N 2.9Å; T280-Q282 PolarHBondContact O-N 3.44Å; T280-L283 PolarHBondContact O-N 3.19Å; T280-D284 PolarHBondContact O-N 3.36Å |
| 281 | R | 78.8 | Confident | 82.3 | Confident | 84 Ų | 84 | 67.2 Ų | 67.2 | 32% | 0.317 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 176.8 | 179.1 | 177.1 | 163.4 | 157.4 | -2.8 | 111.7 | D36 C277 E278 D284 Q285 | D36-R281 IonicContact OD2-CZ 2.69Å; D36-R281 IonicContact OD2-NH1 3.83Å; D36-R281 IonicContact OD2-NH2 3.56Å; D36-R281 PolarHBondContact OD2-NH2 3.4Å; C277-R281 WeakPolarHBondContact O-CB 3.45Å; C277-R281 PolarHBondContact O-N 3.08Å; E278-R281 PolarHBondContact O-N 2.87Å; R281-D284 PolarHBondContact O-N 3.08Å; R281-Q285 WeakPolarHBondContact O-CG 3.42Å; R281-Q285 PolarHBondContact O-N 2.94Å; R281-Q285 VanDerWaalsContact O-N 3.07Å |
| 282 | Q | 84 | Confident | 82.5 | Confident | 103 Ų | 103 | 59.8 Ų | 59.8 | 48% | 0.481 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -65.4 | -40.5 | 177 | -72.1 | 178.4 | 7.1 | 0 | 0 | 112 | E278 S279 T280 Q285 A286 | E278-Q282 WeakPolarHBondContact O-CB 3.24Å; E278-Q282 WeakPolarHBondContact O-CG 3.38Å; E278-Q282 PolarHBondContact O-N 2.9Å; E278-Q282 PolarHBondContact OE1-NE2 2.84Å; S279-Q282 PolarHBondContact O-N 3.27Å; T280-Q282 PolarHBondContact O-N 3.44Å; Q282-Q285 PolarHBondContact O-N 2.03Å; Q282-A286 VanDerWaalsContact O-CB 3.25Å; Q282-A286 WeakPolarHBondContact O-CB 3.02Å; Q282-A286 PolarHBondContact O-N 3.19Å |
| 283 | L | 84.5 | Confident | 82.9 | Confident | 19 Ų | 19 | 58.6 Ų | 58.6 | 10% | 0.099 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -66.9 | -38.1 | 177.4 | -76.1 | 169.2 | 0 | 0 | 0 | 112.3 | V262 L265 N266 Q269 L274 S279 T280 A286 T287 | V262-L283 HydrophobicContact CG1-CD2 4.24Å; L265-L283 HydrophobicContact CB-CD2 3.98Å; N266-L283 HydrophobicContact CB-CB 4.43Å; Q269-L283 HydrophobicContact CG-CD1 3.86Å; L274-L283 HydrophobicContact CB-CD1 4.4Å; L274-L283 HydrophobicContact CD1-CD1 4.23Å; S279-L283 WeakPolarHBondContact O-CB 3.47Å; S279-L283 VanDerWaalsContact O-CG 3.24Å; S279-L283 WeakPolarHBondContact O-CG 3.3Å; S279-L283 PolarHBondContact O-N 3.26Å; T280-L283 PolarHBondContact O-N 3.19Å; L283-A286 PolarHBondContact O-N 3.34Å; L283-T287 WeakPolarHBondContact O-CB 3.21Å; L283-T287 PolarHBondContact O-N 2.58Å; L283-T287 PolarHBondContact O-OG1 3.03Å |
| 284 | D | 79.9 | Confident | 83.4 | Confident | 30 Ų | 30 | 56 Ų | 56 | 16% | 0.16 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.5 | -42.9 | 174.8 | -78.7 | -16.5 | 0 | 0 | 0 | 111.8 | K34 N266 T280 R281 T287 Q288 | K34-D284 WeakPolarHBondContact CE-OD2 3.41Å; K34-D284 IonicContact NZ-OD2 3.04Å; K34-D284 PolarHBondContact NZ-OD2 3.24Å; N266-D284 PolarHBondContact ND2-OD1 2.96Å; N266-D284 VanDerWaalsContact ND2-OD1 3.13Å; T280-D284 PolarHBondContact O-N 3.36Å; R281-D284 PolarHBondContact O-N 3.08Å; D284-T287 WeakPolarHBondContact O-CB 3.29Å; D284-T287 PolarHBondContact O-N 3.18Å; D284-Q288 PolarHBondContact O-N 2.98Å; D284-Q288 VanDerWaalsContact O-N 3.11Å |
| 285 | Q | 80.4 | Confident | 83.7 | Confident | 65 Ų | 65 | 54.1 Ų | 54.1 | 30% | 0.304 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59.7 | -48.6 | 172.5 | -75.2 | 176.4 | -18.5 | 0 | 0 | 111.1 | V37 R281 Q282 T287 Q288 V289 | V37-Q285 HydrophobicContact CB-CG 4.3Å; V37-Q285 HydrophobicContact CG1-CG 3.88Å; V37-Q285 HydrophobicContact CG2-CG 3.4Å; R281-Q285 WeakPolarHBondContact O-CG 3.42Å; R281-Q285 PolarHBondContact O-N 2.94Å; R281-Q285 VanDerWaalsContact O-N 3.07Å; Q282-Q285 PolarHBondContact O-N 2.03Å; Q285-T287 VanDerWaalsContact C-N 3.26Å; Q285-T287 PolarHBondContact O-N 3.11Å; Q285-Q288 PolarHBondContact O-N 3.37Å; Q285-V289 WeakPolarHBondContact O-CG2 3.32Å; Q285-V289 PolarHBondContact O-N 2.93Å |
| 286 | A | 86.2 | Confident | 84.3 | Confident | 33 Ų | 33 | 51.4 Ų | 51.4 | 27% | 0.273 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -60.6 | -37.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | V262 Q282 L283 V289 T290 | V262-A286 HydrophobicContact CG1-CB 3.82Å; V262-A286 HydrophobicContact CG2-CB 4.17Å; Q282-A286 VanDerWaalsContact O-CB 3.25Å; Q282-A286 WeakPolarHBondContact O-CB 3.02Å; Q282-A286 PolarHBondContact O-N 3.19Å; L283-A286 PolarHBondContact O-N 3.34Å; A286-V289 PolarHBondContact O-N 2.91Å; A286-T290 VanDerWaalsContact O-CB 3.27Å; A286-T290 WeakPolarHBondContact O-CB 3.04Å; A286-T290 VanDerWaalsContact O-CG2 3.25Å; A286-T290 WeakPolarHBondContact O-CG2 3.46Å; A286-T290 PolarHBondContact O-N 3.01Å; A286-T290 PolarHBondContact O-OG1 3.11Å |
| 287 | T | 85.9 | Confident | 84.6 | Confident | 20 Ų | 20 | 47 Ų | 47 | 12% | 0.123 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.9 | -49 | 177.2 | -59.6 | 0 | 0 | 0 | 0 | 110.2 | Y259 V262 L283 D284 Q285 V289 T290 E291 | Y259-T287 HydrophobicContact CD2-CG2 4.43Å; Y259-T287 HydrophobicContact CE2-CG2 3.8Å; V262-T287 WeakPolarHBondContact CG1-OG1 3.17Å; L283-T287 WeakPolarHBondContact O-CB 3.21Å; L283-T287 PolarHBondContact O-N 2.58Å; L283-T287 PolarHBondContact O-OG1 3.03Å; D284-T287 WeakPolarHBondContact O-CB 3.29Å; D284-T287 PolarHBondContact O-N 3.18Å; Q285-T287 VanDerWaalsContact C-N 3.26Å; Q285-T287 PolarHBondContact O-N 3.11Å; T287-V289 PolarHBondContact O-N 3.24Å; T287-T290 PolarHBondContact O-OG1 3.46Å; T287-E291 WeakPolarHBondContact O-CB 3.07Å; T287-E291 PolarHBondContact O-N 3.08Å |
| 288 | Q | 81.6 | Confident | 84.9 | Confident | 78 Ų | 78 | 44 Ų | 44 | 36% | 0.364 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64 | -43.5 | 179.9 | -67.4 | -179.9 | 23.5 | 0 | 0 | 112.8 | V37 D284 Q285 T292 | V37-Q288 VanDerWaalsContact CG1-OE1 3.29Å; D284-Q288 PolarHBondContact O-N 2.98Å; D284-Q288 VanDerWaalsContact O-N 3.11Å; Q285-Q288 PolarHBondContact O-N 3.37Å; Q288-T292 WeakPolarHBondContact O-CB 3.3Å; Q288-T292 PolarHBondContact O-N 3.31Å; Q288-T292 PolarHBondContact O-OG1 3.01Å |
| 289 | V | 85.8 | Confident | 85.1 | Confident | 103 Ų | 103 | 38.1 Ų | 38.1 | 62% | 0.624 | 20% | 0.203 | S | C | * | . | H | α-helix | trans | -66.7 | -47.7 | 179.9 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | Q285 A286 T287 E291 T292 L293 | Q285-V289 WeakPolarHBondContact O-CG2 3.32Å; Q285-V289 PolarHBondContact O-N 2.93Å; A286-V289 PolarHBondContact O-N 2.91Å; T287-V289 PolarHBondContact O-N 3.24Å; V289-E291 VanDerWaalsContact C-N 3.32Å; V289-E291 PolarHBondContact O-N 2.81Å; V289-T292 WeakPolarHBondContact O-CB 3.33Å; V289-T292 PolarHBondContact O-N 3.4Å; V289-L293 PolarHBondContact O-N 3.4Å |
| 290 | T | 90.4 | Very high | 85.3 | Confident | 19 Ų | 19 | 38.7 Ų | 38.7 | 12% | 0.117 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -69.6 | -31.4 | -180 | 56.6 | 0 | 0 | 0 | 0 | 112.2 | P258 Y259 V262 A286 T287 L293 G294 | P258-T290 HydrophobicContact CB-CG2 3.69Å; Y259-T290 WeakPolarHBondContact CA-OG1 3.48Å; V262-T290 HydrophobicContact CG2-CG2 4.21Å; A286-T290 VanDerWaalsContact O-CB 3.27Å; A286-T290 WeakPolarHBondContact O-CB 3.04Å; A286-T290 VanDerWaalsContact O-CG2 3.25Å; A286-T290 WeakPolarHBondContact O-CG2 3.46Å; A286-T290 PolarHBondContact O-N 3.01Å; A286-T290 PolarHBondContact O-OG1 3.11Å; T287-T290 PolarHBondContact O-OG1 3.46Å; T290-L293 WeakPolarHBondContact O-CB 3.35Å; T290-L293 PolarHBondContact O-N 2.84Å; T290-G294 PolarHBondContact O-N 2.81Å |
| 291 | E | 89.1 | Confident | 85.4 | Confident | 44 Ų | 44 | 37.1 Ų | 37.1 | 21% | 0.206 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.8 | -48.9 | 172.8 | -168.6 | 165.9 | -167.8 | 0 | 0 | 110.3 | Y120 Y259 T287 V289 L293 G294 M295 | Y120-E291 PolarHBondContact OH-OE1 2.85Å; Y259-E291 HydrophobicContact CD2-CB 3.5Å; Y259-E291 HydrophobicContact CD2-CG 4.07Å; Y259-E291 HydrophobicContact CE2-CB 3.42Å; Y259-E291 VanDerWaalsContact CE2-CB 3.42Å; Y259-E291 HydrophobicContact CE2-CG 3.68Å; Y259-E291 HydrophobicContact CG-CB 4.5Å; T287-E291 WeakPolarHBondContact O-CB 3.07Å; T287-E291 PolarHBondContact O-N 3.08Å; V289-E291 VanDerWaalsContact C-N 3.32Å; V289-E291 PolarHBondContact O-N 2.81Å; E291-L293 VanDerWaalsContact C-N 3.28Å; E291-L293 PolarHBondContact O-N 3.04Å; E291-G294 CarbonylContact O-C 3.51Å; E291-G294 WeakPolarHBondContact O-CA 3.33Å; E291-G294 PolarHBondContact O-N 3.22Å; E291-M295 HydrophobicContact CG-CE 3.67Å; E291-M295 HydrophobicContact CG-CG 4.37Å; E291-M295 WeakPolarHBondContact O-CG 3.49Å; E291-M295 PolarHBondContact O-N 2.63Å |
| 292 | T | 86.3 | Confident | 85.5 | Confident | 13 Ų | 13 | 33.5 Ų | 33.5 | 8% | 0.08 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -57.5 | -43.2 | 177.8 | -64.2 | 0 | 0 | 0 | 0 | 111.2 | L48 Y49 Q288 V289 M295 T296 | L48-T292 HydrophobicContact CD2-CG2 3.3Å; L48-T292 HydrophobicContact CG-CG2 4.46Å; Y49-T292 HydrophobicContact CE1-CG2 4Å; Y49-T292 PolarHBondContact OH-OG1 2.83Å; Q288-T292 WeakPolarHBondContact O-CB 3.3Å; Q288-T292 PolarHBondContact O-N 3.31Å; Q288-T292 PolarHBondContact O-OG1 3.01Å; V289-T292 WeakPolarHBondContact O-CB 3.33Å; V289-T292 PolarHBondContact O-N 3.4Å; T292-M295 PolarHBondContact O-N 2.97Å; T292-T296 VanDerWaalsContact O-CG2 3.28Å; T292-T296 WeakPolarHBondContact O-CG2 3.41Å; T292-T296 PolarHBondContact O-N 3.07Å |
| 293 | L | 89.9 | Confident | 85.3 | Confident | 72 Ų | 72 | 32.4 Ų | 32.4 | 38% | 0.377 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -57.4 | -51.1 | 170.8 | 179.3 | 65.5 | 0 | 0 | 0 | 110.9 | F255 P258 V289 T290 E291 M295 T296 | F255-L293 HydrophobicContact CD1-CD1 4.18Å; F255-L293 HydrophobicContact CD1-CG 4.46Å; F255-L293 VanDerWaalsContact CD1-O 3.3Å; F255-L293 WeakPolarHBondContact CD1-O 3.34Å; F255-L293 HydrophobicContact CE1-CD1 4.27Å; P258-L293 HydrophobicContact CG-CD2 4.34Å; V289-L293 PolarHBondContact O-N 3.4Å; T290-L293 WeakPolarHBondContact O-CB 3.35Å; T290-L293 PolarHBondContact O-N 2.84Å; E291-L293 VanDerWaalsContact C-N 3.28Å; E291-L293 PolarHBondContact O-N 3.04Å; L293-M295 VanDerWaalsContact C-N 3.3Å; L293-M295 PolarHBondContact O-N 3.13Å; L293-T296 PolarHBondContact O-N 3.05Å; L293-T296 VanDerWaalsContact O-N 3.08Å; L293-T296 PolarHBondContact O-OG1 2.82Å |
| 294 | G | 90.3 | Very high | 85 | Confident | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -55.2 | -42.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | F255 W256 T290 E291 T296 H297 | F255-G294 WeakPolarHBondContact O-CA 3.33Å; W256-G294 VanDerWaalsContact CE2-O 3.32Å; W256-G294 VanDerWaalsContact CZ2-O 3.25Å; W256-G294 WeakPolarHBondContact CZ2-O 3.46Å; W256-G294 PolarHBondContact NE1-O 3.44Å; T290-G294 PolarHBondContact O-N 2.81Å; E291-G294 CarbonylContact O-C 3.51Å; E291-G294 WeakPolarHBondContact O-CA 3.33Å; E291-G294 PolarHBondContact O-N 3.22Å; G294-T296 VanDerWaalsContact C-N 3.26Å; G294-T296 PolarHBondContact O-N 2.94Å; G294-H297 WeakPolarHBondContact O-CB 3.5Å; G294-H297 PolarHBondContact O-N 3.07Å; G294-H297 VanDerWaalsContact O-N 3.07Å |
| 295 | M | 86.6 | Confident | 84.6 | Confident | 9 Ų | 9 | 30.7 Ų | 30.7 | 4% | 0.044 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.6 | -35.1 | 178 | -57.8 | -150.4 | -173.7 | 0 | 0 | 112.2 | Y49 F91 L95 Y120 E291 T292 L293 H297 C298 | Y49-M295 HydrophobicContact CE1-CB 4.46Å; Y49-M295 HydrophobicContact CE1-SD 3.83Å; Y49-M295 HydrophobicContact CE2-SD 4.39Å; F91-M295 HydrophobicContact CE1-CB 3.98Å; F91-M295 HydrophobicContact CE1-CG 4.27Å; F91-M295 HydrophobicContact CZ-CB 4.06Å; F91-M295 HydrophobicContact CZ-CG 3.89Å; F91-M295 HydrophobicContact CZ-SD 4.29Å; L95-M295 HydrophobicContact CD2-CB 4.46Å; L95-M295 HydrophobicContact CD2-SD 3.7Å; Y120-M295 HydrophobicContact CE2-CE 3.84Å; Y120-M295 HydrophobicContact CE2-SD 4.44Å; E291-M295 HydrophobicContact CG-CE 3.67Å; E291-M295 HydrophobicContact CG-CG 4.37Å; E291-M295 WeakPolarHBondContact O-CG 3.49Å; E291-M295 PolarHBondContact O-N 2.63Å; T292-M295 PolarHBondContact O-N 2.97Å; L293-M295 VanDerWaalsContact C-N 3.3Å; L293-M295 PolarHBondContact O-N 3.13Å; M295-H297 PolarHBondContact O-N 2.04Å; M295-C298 PolarHBondContact O-SG 3.43Å |
| 296 | T | 87.8 | Confident | 83.9 | Confident | 23 Ų | 23 | 29 Ų | 29 | 14% | 0.141 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -67 | -15.4 | 178.6 | 69.5 | 0 | 0 | 0 | 0 | 113.7 | L48 V52 F255 T292 L293 G294 C298 C299 | L48-T296 HydrophobicContact CD1-CG2 4.46Å; V52-T296 HydrophobicContact CG2-CG2 3.72Å; F255-T296 WeakPolarHBondContact CD1-OG1 3.5Å; F255-T296 WeakPolarHBondContact CE1-OG1 3.35Å; T292-T296 VanDerWaalsContact O-CG2 3.28Å; T292-T296 WeakPolarHBondContact O-CG2 3.41Å; T292-T296 PolarHBondContact O-N 3.07Å; L293-T296 PolarHBondContact O-N 3.05Å; L293-T296 VanDerWaalsContact O-N 3.08Å; L293-T296 PolarHBondContact O-OG1 2.82Å; G294-T296 VanDerWaalsContact C-N 3.26Å; G294-T296 PolarHBondContact O-N 2.94Å; T296-C298 PolarHBondContact O-N 3.18Å; T296-C299 PolarHBondContact O-N 3.2Å; T296-C299 PolarHBondContact O-SG 2.9Å |
| 297 | H | 89.9 | Confident | 82.8 | Confident | 8 Ų | 8 | 35.1 Ų | 35.1 | 4% | 0.037 | 19% | 0.187 | C | C | . | . | G | 310 helix | trans | -55.1 | -37.7 | 178 | 173.4 | -96.9 | 0 | 0 | 0 | 113.3 | Y252 F255 W256 G294 M295 C299 I300 | Y252-H297 WeakPolarHBondContact CA-NE2 3.36Å; Y252-H297 AromaticContact CD2-CE1 3.86Å; Y252-H297 AromaticContact CD2-NE2 3.9Å; F255-H297 HydrophobicContact CB-CB 3.93Å; F255-H297 HydrophobicContact CD1-CB 3.99Å; F255-H297 HydrophobicContact CG-CB 4.17Å; W256-H297 AromaticContact CD1-CG 3.97Å; W256-H297 AromaticContact NE1-CG 3.66Å; W256-H297 AromaticContact NE1-ND1 3.73Å; G294-H297 WeakPolarHBondContact O-CB 3.5Å; G294-H297 PolarHBondContact O-N 3.07Å; G294-H297 VanDerWaalsContact O-N 3.07Å; M295-H297 PolarHBondContact O-N 2.04Å; H297-C299 PolarHBondContact O-N 3.17Å; H297-C299 VanDerWaalsContact O-N 3.13Å; H297-I300 WeakPolarHBondContact O-CB 3.3Å; H297-I300 PolarHBondContact O-N 3.22Å |
| 298 | C | 85.3 | Confident | 81.5 | Confident | 3 Ų | 3 | 36.1 Ų | 36.1 | 2% | 0.02 | 19% | 0.192 | C | C | . | . | G | 310 helix | trans | -63.5 | -20.4 | -173.2 | 61.8 | 0 | 0 | 0 | 0 | 114.2 | N60 D88 F91 L92 M295 T296 | N60-C298 PolarHBondContact ND2-O 3.09Å; D88-C298 HydrophobicContact CB-CB 4.28Å; F91-C298 HydrophobicContact CD1-CB 4.16Å; L92-C298 HydrophobicContact CD2-CB 4.4Å; L92-C298 WeakPolarHBondContact CD2-SG 3.34Å; L92-C298 HydrophobicContact CG-CB 4.17Å; M295-C298 PolarHBondContact O-SG 3.43Å; T296-C298 PolarHBondContact O-N 3.18Å |
| 299 | C | 85 | Confident | 80.5 | Confident | 17 Ų | 17 | 32.8 Ų | 32.8 | 12% | 0.115 | 18% | 0.179 | C | C | . | . | G | 310 helix | trans | -90.1 | -9.8 | 175 | 72.9 | 0 | 0 | 0 | 0 | 113.6 | V52 T296 H297 | V52-C299 HydrophobicContact CG1-CB 4.38Å; T296-C299 PolarHBondContact O-N 3.2Å; T296-C299 PolarHBondContact O-SG 2.9Å; H297-C299 PolarHBondContact O-N 3.17Å; H297-C299 VanDerWaalsContact O-N 3.13Å |
| 300 | I | 84.1 | Confident | 79.1 | Confident | 37 Ų | 37 | 33.9 Ų | 33.9 | 19% | 0.19 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -82.3 | -28.3 | -176.1 | -50.4 | -61.1 | 0 | 0 | 0 | 111.9 | V251 F255 H297 I303 I304 | V251-I300 HydrophobicContact CG1-CB 4.28Å; V251-I300 HydrophobicContact CG1-CG2 3.75Å; F255-I300 HydrophobicContact CE1-CD1 4.42Å; F255-I300 HydrophobicContact CE1-CG1 4.01Å; F255-I300 HydrophobicContact CZ-CD1 4.26Å; F255-I300 HydrophobicContact CZ-CG1 3.99Å; H297-I300 WeakPolarHBondContact O-CB 3.3Å; H297-I300 PolarHBondContact O-N 3.22Å; I300-I303 HydrophobicContact CD1-CD1 4.39Å; I300-I303 WeakPolarHBondContact O-CB 3.36Å; I300-I303 PolarHBondContact O-N 2.95Å; I300-I303 VanDerWaalsContact O-N 3.12Å; I300-I304 HydrophobicContact CG2-CD1 3.82Å; I300-I304 HydrophobicContact CG2-CG1 3.94Å; I300-I304 WeakPolarHBondContact O-CG1 3.31Å; I300-I304 PolarHBondContact O-N 3.26Å |
| 301 | N | 82.3 | Confident | 77.4 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -56.2 | -51.3 | -178.9 | -73.6 | -25.5 | 0 | 0 | 0 | 113.2 | D88 I303 I304 Y305 | D88-N301 PolarHBondContact OD2-ND2 2.81Å; N301-I303 VanDerWaalsContact C-N 3.31Å; N301-I303 PolarHBondContact O-N 2.89Å; N301-I304 PolarHBondContact O-N 2.88Å; N301-Y305 HydrophobicContact CB-CE2 4.23Å; N301-Y305 WeakPolarHBondContact O-CD2 3.28Å; N301-Y305 WeakPolarHBondContact O-CE2 3.5Å; N301-Y305 PolarHBondContact O-N 3.32Å; N301-Y305 VanDerWaalsContact O-N 3.08Å |
| 302 | P | 81.3 | Confident | 75.8 | Confident | 8 Ų | 8 | 39.5 Ų | 39.5 | 5% | 0.052 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -58.7 | -38.1 | 173.7 | -25.7 | 35 | 0 | 0 | 0 | 114.2 | N60 V63 Y305 A306 | N60-P302 HydrophobicContact CB-CG 4.43Å; N60-P302 WeakPolarHBondContact OD1-CG 3.38Å; V63-P302 HydrophobicContact CG2-CB 4.29Å; V63-P302 HydrophobicContact CG2-CG 4.4Å; P302-Y305 PolarHBondContact O-N 3.02Å; P302-A306 PolarHBondContact O-N 3.34Å |
| 303 | I | 78.7 | Confident | 74.4 | Confident | 79 Ų | 79 | 46 Ų | 46 | 41% | 0.405 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -62.4 | -48 | 177.5 | -63.4 | 175 | 0 | 0 | 0 | 109.4 | I300 N301 Y305 A306 F307 | I300-I303 HydrophobicContact CD1-CD1 4.39Å; I300-I303 WeakPolarHBondContact O-CB 3.36Å; I300-I303 PolarHBondContact O-N 2.95Å; I300-I303 VanDerWaalsContact O-N 3.12Å; N301-I303 VanDerWaalsContact C-N 3.31Å; N301-I303 PolarHBondContact O-N 2.89Å; I303-Y305 VanDerWaalsContact C-N 3.28Å; I303-Y305 PolarHBondContact O-N 3.33Å; I303-A306 PolarHBondContact O-N 2.91Å; I303-A306 VanDerWaalsContact O-N 3.14Å; I303-F307 HydrophobicContact CG2-CD2 3.59Å; I303-F307 HydrophobicContact CG2-CE2 3.78Å; I303-F307 VanDerWaalsContact O-CD2 3.25Å; I303-F307 WeakPolarHBondContact O-CD2 3.31Å; I303-F307 PolarHBondContact O-N 3.37Å |
| 304 | I | 77.4 | Confident | 72.8 | Confident | 11 Ų | 11 | 45.7 Ų | 45.7 | 6% | 0.056 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.5 | -42.1 | 177 | -65.6 | 166.8 | 0 | 0 | 0 | 110.7 | L244 T247 I248 V251 I300 N301 A306 V308 | L244-I304 HydrophobicContact CD1-CG2 3.65Å; T247-I304 HydrophobicContact CG2-CG2 4.25Å; I248-I304 HydrophobicContact CD1-CG2 4.33Å; I248-I304 HydrophobicContact CG1-CB 4.39Å; I248-I304 HydrophobicContact CG1-CD1 4.06Å; I248-I304 HydrophobicContact CG1-CG2 3.68Å; V251-I304 HydrophobicContact CB-CD1 4.09Å; V251-I304 HydrophobicContact CG1-CD1 4.14Å; V251-I304 HydrophobicContact CG2-CD1 4.02Å; I300-I304 HydrophobicContact CG2-CD1 3.82Å; I300-I304 HydrophobicContact CG2-CG1 3.94Å; I300-I304 WeakPolarHBondContact O-CG1 3.31Å; I300-I304 PolarHBondContact O-N 3.26Å; N301-I304 PolarHBondContact O-N 2.88Å; I304-A306 PolarHBondContact O-N 3.38Å; I304-V308 HydrophobicContact CG2-CB 4.36Å; I304-V308 HydrophobicContact CG2-CG2 4.1Å; I304-V308 VanDerWaalsContact O-CB 3.26Å; I304-V308 WeakPolarHBondContact O-CB 3.25Å; I304-V308 PolarHBondContact O-N 3.38Å |
| 305 | Y | 72.4 | Confident | 71.1 | Confident | 3 Ų | 3 | 47 Ų | 47 | 1% | 0.012 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63 | -41.9 | 176.8 | -57.4 | -39.5 | 0 | 0 | 0 | 112.8 | V63 L81 L84 L244 I248 N301 P302 I303 G309 F312 | V63-Y305 HydrophobicContact CG1-CD2 4.49Å; V63-Y305 HydrophobicContact CG1-CE2 4.39Å; V63-Y305 HydrophobicContact CG2-CD2 3.81Å; V63-Y305 HydrophobicContact CG2-CE2 4.27Å; L81-Y305 HydrophobicContact CD2-CE1 3.81Å; L81-Y305 WeakPolarHBondContact CD2-OH 3.34Å; L84-Y305 VanDerWaalsContact CD2-OH 3.23Å; L84-Y305 WeakPolarHBondContact CD2-OH 3.32Å; L244-Y305 HydrophobicContact CD1-CD1 4.31Å; L244-Y305 HydrophobicContact CD2-CD1 4.45Å; I248-Y305 HydrophobicContact CD1-CD1 4.32Å; I248-Y305 HydrophobicContact CD1-CE1 3.51Å; N301-Y305 HydrophobicContact CB-CE2 4.23Å; N301-Y305 WeakPolarHBondContact O-CD2 3.28Å; N301-Y305 WeakPolarHBondContact O-CE2 3.5Å; N301-Y305 PolarHBondContact O-N 3.32Å; N301-Y305 VanDerWaalsContact O-N 3.08Å; P302-Y305 PolarHBondContact O-N 3.02Å; I303-Y305 VanDerWaalsContact C-N 3.28Å; I303-Y305 PolarHBondContact O-N 3.33Å; Y305-G309 WeakPolarHBondContact O-CA 3.34Å; Y305-G309 PolarHBondContact O-N 3.25Å; Y305-G309 VanDerWaalsContact O-N 3.15Å; Y305-F312 WeakPolarHBondContact O-CB 3.48Å |
| 306 | A | 66.4 | Low | 69.8 | Low | 30 Ų | 30 | 48.5 Ų | 48.5 | 25% | 0.248 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -66.8 | -40.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | P302 I303 I304 | P302-A306 PolarHBondContact O-N 3.34Å; I303-A306 PolarHBondContact O-N 2.91Å; I303-A306 VanDerWaalsContact O-N 3.14Å; I304-A306 PolarHBondContact O-N 3.38Å |
| 307 | F | 62.6 | Low | 68.3 | Low | 161 Ų | 161 | 53.5 Ų | 53.5 | 71% | 0.706 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -88.9 | -36.4 | -175.5 | -74.2 | -76 | 0 | 0 | 0 | 113.8 | I303 | I303-F307 HydrophobicContact CG2-CD2 3.59Å; I303-F307 HydrophobicContact CG2-CE2 3.78Å; I303-F307 VanDerWaalsContact O-CD2 3.25Å; I303-F307 WeakPolarHBondContact O-CD2 3.31Å; I303-F307 PolarHBondContact O-N 3.37Å |
| 308 | V | 59.3 | Low | 66.6 | Low | 40 Ų | 40 | 56.9 Ų | 56.9 | 24% | 0.242 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -95.1 | -23.6 | -173.6 | -175.1 | 0 | 0 | 0 | 0 | 111.9 | R240 L244 I304 | R240-V308 PolarHBondContact NE-O 2.81Å; R240-V308 PolarHBondContact NH2-O 3.25Å; L244-V308 HydrophobicContact CB-CG1 4.05Å; L244-V308 HydrophobicContact CD1-CB 3.6Å; L244-V308 HydrophobicContact CD1-CG1 3.69Å; I304-V308 HydrophobicContact CG2-CB 4.36Å; I304-V308 HydrophobicContact CG2-CG2 4.1Å; I304-V308 VanDerWaalsContact O-CB 3.26Å; I304-V308 WeakPolarHBondContact O-CB 3.25Å; I304-V308 PolarHBondContact O-N 3.38Å |
| 309 | G | 59.5 | Low | 65.1 | Low | 8 Ų | 8 | 58.2 Ų | 58.2 | 8% | 0.082 | 29% | 0.289 | C | S | . | . | trans | -102.3 | 96.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y305 K311 F312 R313 | Y305-G309 WeakPolarHBondContact O-CA 3.34Å; Y305-G309 PolarHBondContact O-N 3.25Å; Y305-G309 VanDerWaalsContact O-N 3.15Å; G309-K311 PolarHBondContact O-N 2.85Å; G309-K311 VanDerWaalsContact O-N 3.11Å; G309-F312 WeakPolarHBondContact O-CA 3.44Å; G309-F312 PolarHBondContact O-N 3.39Å; G309-R313 PolarHBondContact O-N 2.97Å | ||
| 310 | E | 57.2 | Low | 63.7 | Low | 126 Ų | 126 | 64.7 Ų | 64.7 | 59% | 0.589 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -56 | -31.3 | 171.6 | -87.4 | 156.3 | -127.4 | 0 | 0 | 112.6 | R240 F312 R313 S314 | R240-E310 VanDerWaalsContact CZ-CB 3.46Å; R240-E310 VanDerWaalsContact CZ-CD 3.4Å; R240-E310 IonicContact CZ-OE1 3.63Å; R240-E310 VanDerWaalsContact CZ-OE1 3.27Å; R240-E310 IonicContact CZ-OE2 2.74Å; R240-E310 IonicContact NH1-OE1 3.76Å; R240-E310 PolarHBondContact NH1-OE1 3.42Å; R240-E310 IonicContact NH1-OE2 2.63Å; R240-E310 PolarHBondContact NH1-OE2 3.01Å; R240-E310 IonicContact NH2-OE1 2.68Å; R240-E310 PolarHBondContact NH2-OE1 3.44Å; R240-E310 IonicContact NH2-OE2 3.03Å; E310-F312 VanDerWaalsContact C-N 3.31Å; E310-F312 PolarHBondContact O-N 2.94Å; E310-R313 PolarHBondContact O-N 2.74Å; E310-S314 PolarHBondContact O-N 3.47Å |
| 311 | K | 55 | Low | 62.2 | Low | 168 Ų | 168 | 65.8 Ų | 65.8 | 73% | 0.73 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -65.3 | -34.1 | 174.8 | -77.4 | -169.9 | 178.2 | -176.2 | 0 | 112.4 | G309 L315 | G309-K311 PolarHBondContact O-N 2.85Å; G309-K311 VanDerWaalsContact O-N 3.11Å; K311-L315 WeakPolarHBondContact O-CB 3.45Å; K311-L315 PolarHBondContact O-N 3.28Å |
| 312 | F | 54.9 | Low | 60.5 | Low | 14 Ų | 14 | 68.7 Ų | 68.7 | 6% | 0.061 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -75.9 | -40.8 | 173.9 | -94.5 | -83.6 | 0 | 0 | 0 | 110.1 | I66 L67 L81 Y305 G309 E310 S314 L315 Y316 | I66-F312 HydrophobicContact CG2-CD1 4.32Å; I66-F312 HydrophobicContact CG2-CE1 3.93Å; L67-F312 HydrophobicContact CD2-CZ 4.28Å; L81-F312 HydrophobicContact CD1-CE2 4.44Å; Y305-F312 WeakPolarHBondContact O-CB 3.48Å; G309-F312 WeakPolarHBondContact O-CA 3.44Å; G309-F312 PolarHBondContact O-N 3.39Å; E310-F312 VanDerWaalsContact C-N 3.31Å; E310-F312 PolarHBondContact O-N 2.94Å; F312-S314 PolarHBondContact O-N 3.22Å; F312-L315 CarbonylContact O-C 3.5Å; F312-L315 WeakPolarHBondContact O-CA 3.34Å; F312-L315 WeakPolarHBondContact O-CB 3.44Å; F312-L315 PolarHBondContact O-N 3.03Å; F312-Y316 HydrophobicContact CB-CD2 4.42Å; F312-Y316 HydrophobicContact CD1-CD2 4.39Å; F312-Y316 HydrophobicContact CD1-CE2 4.04Å; F312-Y316 VanDerWaalsContact O-CD2 3.3Å; F312-Y316 WeakPolarHBondContact O-CD2 3.34Å; F312-Y316 PolarHBondContact O-N 2.99Å |
| 313 | R | 57.7 | Low | 58.8 | Low | 149 Ų | 149 | 79.2 Ų | 79.2 | 56% | 0.562 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -55.9 | -46.9 | 175.9 | -167.5 | 173 | 178.6 | 163.4 | -0.4 | 113.2 | G309 E310 L315 Y316 H317 | G309-R313 PolarHBondContact O-N 2.97Å; E310-R313 PolarHBondContact O-N 2.74Å; R313-L315 VanDerWaalsContact C-N 3.26Å; R313-L315 PolarHBondContact O-N 3.45Å; R313-Y316 PolarHBondContact O-N 3Å; R313-H317 PolarHBondContact O-CD2 3.37Å; R313-H317 PolarHBondContact O-N 3.37Å; R313-H317 VanDerWaalsContact O-N 3.15Å |
| 314 | S | 55.7 | Low | 57.5 | Low | 66 Ų | 66 | 83.3 Ų | 83.3 | 46% | 0.462 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -61.1 | -36.9 | 173 | 173.7 | 0 | 0 | 0 | 0 | 111.8 | E310 F312 I318 | E310-S314 PolarHBondContact O-N 3.47Å; F312-S314 PolarHBondContact O-N 3.22Å; S314-I318 WeakPolarHBondContact O-CB 3.34Å; S314-I318 WeakPolarHBondContact O-CD1 3.34Å; S314-I318 WeakPolarHBondContact O-CG1 3.42Å; S314-I318 PolarHBondContact O-N 3.33Å |
| 315 | L | 55.1 | Low | 55.6 | Low | 27 Ų | 27 | 86.6 Ų | 86.6 | 14% | 0.141 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -76.9 | -25.1 | 179.5 | -147.7 | 65.7 | 0 | 0 | 0 | 113.8 | I66 C70 K71 K311 F312 R313 I318 A319 | I66-L315 HydrophobicContact CG2-CB 4.42Å; I66-L315 HydrophobicContact CG2-CD2 3.18Å; I66-L315 HydrophobicContact CG2-CG 3.76Å; C70-L315 HydrophobicContact CB-CD1 3.94Å; C70-L315 HydrophobicContact CB-CD2 4.15Å; C70-L315 HydrophobicContact CB-CG 4.07Å; K71-L315 HydrophobicContact CD-CD2 4.31Å; K71-L315 HydrophobicContact CG-CD2 3.92Å; K311-L315 WeakPolarHBondContact O-CB 3.45Å; K311-L315 PolarHBondContact O-N 3.28Å; F312-L315 CarbonylContact O-C 3.5Å; F312-L315 WeakPolarHBondContact O-CA 3.34Å; F312-L315 WeakPolarHBondContact O-CB 3.44Å; F312-L315 PolarHBondContact O-N 3.03Å; R313-L315 VanDerWaalsContact C-N 3.26Å; R313-L315 PolarHBondContact O-N 3.45Å; L315-I318 CarbonylContact O-C 3.5Å; L315-A319 WeakPolarHBondContact O-CA 3.31Å; L315-A319 WeakPolarHBondContact O-CB 3.3Å; L315-A319 PolarHBondContact O-N 3.14Å |
| 316 | Y | 58.9 | Low | 54 | Low | 41 Ų | 41 | 91.7 Ų | 91.7 | 16% | 0.161 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -70.5 | -47.1 | 170.4 | -93.7 | -107 | 0 | 0 | 0 | 109.8 | L62 I66 F312 R313 I318 A319 L320 | L62-Y316 HydrophobicContact CD2-CD1 3.6Å; L62-Y316 HydrophobicContact CD2-CE1 3.13Å; L62-Y316 HydrophobicContact CG-CD1 4.28Å; L62-Y316 HydrophobicContact CG-CE1 3.72Å; I66-Y316 HydrophobicContact CD1-CD2 3.65Å; I66-Y316 HydrophobicContact CD1-CE2 3.64Å; I66-Y316 HydrophobicContact CD1-CG 4.14Å; F312-Y316 HydrophobicContact CB-CD2 4.42Å; F312-Y316 HydrophobicContact CD1-CD2 4.39Å; F312-Y316 HydrophobicContact CD1-CE2 4.04Å; F312-Y316 VanDerWaalsContact O-CD2 3.3Å; F312-Y316 WeakPolarHBondContact O-CD2 3.34Å; F312-Y316 PolarHBondContact O-N 2.99Å; R313-Y316 PolarHBondContact O-N 3Å; Y316-I318 VanDerWaalsContact C-N 3.28Å; Y316-I318 PolarHBondContact O-N 3.39Å; Y316-A319 PolarHBondContact O-N 3.49Å; Y316-A319 VanDerWaalsContact O-N 3.1Å; Y316-L320 WeakPolarHBondContact O-CD1 3.36Å; Y316-L320 PolarHBondContact O-N 3.41Å |
| 317 | H | 56.6 | Low | 52.8 | Low | 128 Ų | 128 | 98.8 Ų | 98.8 | 59% | 0.593 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.5 | -38.3 | 172.6 | -73.2 | -64.8 | 0 | 0 | 0 | 112 | R313 G321 | R313-H317 PolarHBondContact O-CD2 3.37Å; R313-H317 PolarHBondContact O-N 3.37Å; R313-H317 VanDerWaalsContact O-N 3.15Å; H317-G321 PolarHBondContact O-N 2.68Å |
| 318 | I | 53.6 | Low | 51.6 | Low | 78 Ų | 78 | 99.7 Ų | 99.7 | 40% | 0.4 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -73.9 | -30.8 | 172.7 | -66.7 | 163.4 | 0 | 0 | 0 | 111.2 | S314 L315 Y316 L320 G321 C322 | S314-I318 WeakPolarHBondContact O-CB 3.34Å; S314-I318 WeakPolarHBondContact O-CD1 3.34Å; S314-I318 WeakPolarHBondContact O-CG1 3.42Å; S314-I318 PolarHBondContact O-N 3.33Å; L315-I318 CarbonylContact O-C 3.5Å; Y316-I318 VanDerWaalsContact C-N 3.28Å; Y316-I318 PolarHBondContact O-N 3.39Å; I318-L320 VanDerWaalsContact C-N 3.29Å; I318-L320 PolarHBondContact O-N 3.4Å; I318-G321 CarbonylContact O-C 3.59Å; I318-G321 WeakPolarHBondContact O-CA 3.3Å; I318-G321 PolarHBondContact O-N 3.06Å; I318-C322 HydrophobicContact CG2-CB 4.41Å; I318-C322 VanDerWaalsContact CG2-SG 3.56Å; I318-C322 WeakPolarHBondContact O-CA 3.36Å; I318-C322 WeakPolarHBondContact O-CB 3.49Å; I318-C322 PolarHBondContact O-N 3.28Å |
| 319 | A | 53.2 | Low | 50.3 | Low | 32 Ų | 32 | 106.5 Ų | 106.5 | 26% | 0.264 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -69 | -31.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I66 L315 Y316 G321 | I66-A319 HydrophobicContact CD1-CB 4.28Å; I66-A319 HydrophobicContact CG1-CB 3.98Å; L315-A319 WeakPolarHBondContact O-CA 3.31Å; L315-A319 WeakPolarHBondContact O-CB 3.3Å; L315-A319 PolarHBondContact O-N 3.14Å; Y316-A319 PolarHBondContact O-N 3.49Å; Y316-A319 VanDerWaalsContact O-N 3.1Å; A319-G321 VanDerWaalsContact C-N 3.31Å |
| 320 | L | 56.2 | Low | 49.2 | Very low | 153 Ų | 153 | 111.8 Ų | 111.8 | 80% | 0.801 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -70.4 | -24.2 | 167.4 | -84.1 | 134.7 | 0 | 0 | 0 | 113 | Y316 I318 | Y316-L320 WeakPolarHBondContact O-CD1 3.36Å; Y316-L320 PolarHBondContact O-N 3.41Å; I318-L320 VanDerWaalsContact C-N 3.29Å; I318-L320 PolarHBondContact O-N 3.4Å |
| 321 | G | 51.3 | Low | 48.3 | Very low | 59 Ų | 59 | 112.4 Ų | 112.4 | 61% | 0.608 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -106.5 | -13.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | H317 I318 A319 R323 | H317-G321 PolarHBondContact O-N 2.68Å; I318-G321 CarbonylContact O-C 3.59Å; I318-G321 WeakPolarHBondContact O-CA 3.3Å; I318-G321 PolarHBondContact O-N 3.06Å; A319-G321 VanDerWaalsContact C-N 3.31Å; G321-R323 PolarHBondContact O-N 2.85Å |
| 322 | C | 47 | Very low | 47.3 | Very low | 61 Ų | 61 | 110.3 Ų | 110.3 | 41% | 0.412 | 60% | 0.599 | S | S | . | * | S | Bend | trans | -74.5 | 90.7 | 171.2 | -103.5 | 0 | 0 | 0 | 0 | 102.6 | I318 I324 | I318-C322 HydrophobicContact CG2-CB 4.41Å; I318-C322 VanDerWaalsContact CG2-SG 3.56Å; I318-C322 WeakPolarHBondContact O-CA 3.36Å; I318-C322 WeakPolarHBondContact O-CB 3.49Å; I318-C322 PolarHBondContact O-N 3.28Å; C322-I324 PolarHBondContact O-N 3.23Å |
| 323 | R | 47 | Very low | 46.3 | Very low | 229 Ų | 229 | 113.3 Ų | 113.3 | 86% | 0.864 | 63% | 0.634 | S | S | * | * | trans | -39.5 | 122.3 | 154.6 | -69.1 | -173.7 | -177.9 | -157.9 | 0.4 | 105.9 | G321 A325 | G321-R323 PolarHBondContact O-N 2.85Å; R323-A325 PolarHBondContact O-N 3.45Å | ||
| 324 | I | 49.5 | Very low | 45.2 | Very low | 166 Ų | 166 | 109.5 Ų | 109.5 | 85% | 0.851 | 64% | 0.641 | S | S | * | * | trans | -57.6 | 82.1 | 165.9 | -60.7 | 167.5 | 0 | 0 | 0 | 104.4 | C322 P326 | C322-I324 PolarHBondContact O-N 3.23Å; I324-P326 WeakPolarHBondContact O-CD 3.38Å | ||
| 325 | A | 39.4 | Very low | 44.3 | Very low | 80 Ų | 80 | 113.1 Ų | 113.1 | 66% | 0.661 | 66% | 0.663 | S | S | * | * | trans | -72.1 | 122.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 105.2 | R323 | R323-A325 PolarHBondContact O-N 3.45Š| ||
| 326 | P | 37.1 | Very low | 43.7 | Very low | 110 Ų | 110 | 115.6 Ų | 115.6 | 71% | 0.714 | 70% | 0.695 | S | S | * | * | trans | -59.2 | 144.9 | 174.2 | 8.3 | -3.2 | 0 | 0 | 0 | 108.4 | I324 Q328 | I324-P326 WeakPolarHBondContact O-CD 3.38Å; P326-Q328 VanDerWaalsContact C-N 3.3Å; P326-Q328 PolarHBondContact O-N 2.99Å | ||
| 327 | L | 42.9 | Very low | 42.4 | Very low | 178 Ų | 178 | 118.6 Ų | 118.6 | 93% | 0.932 | 73% | 0.728 | S | S | * | * | trans | -49.5 | 87.1 | 174.1 | -84 | 144.3 | 0 | 0 | 0 | 111.4 | K329 | L327-K329 PolarHBondContact O-N 3.48Š| ||
| 328 | Q | 35.5 | Very low | 41.3 | Very low | 180 Ų | 180 | 124.1 Ų | 124.1 | 84% | 0.841 | 74% | 0.744 | S | S | * | * | trans | -82.5 | 106.2 | 164.1 | -148.3 | 100.2 | 35.1 | 0 | 0 | 106.8 | P326 | P326-Q328 VanDerWaalsContact C-N 3.3Å; P326-Q328 PolarHBondContact O-N 2.99Å | ||
| 329 | K | 33.9 | Very low | 40.5 | Very low | 184 Ų | 184 | 126.8 Ų | 126.8 | 80% | 0.8 | 77% | 0.766 | S | S | * | * | trans | -52.5 | 138.2 | 171.3 | -65.7 | 179.5 | 179.6 | 177.9 | 0 | 109.2 | L327 V331 | L327-K329 PolarHBondContact O-N 3.48Å; K329-V331 PolarHBondContact O-N 3.46Å | ||
| 330 | P | 36.1 | Very low | 39.5 | Very low | 118 Ų | 118 | 128.9 Ų | 128.9 | 77% | 0.766 | 79% | 0.791 | S | S | * | * | trans | -66.8 | 119.7 | 170.6 | 26.7 | -30 | 0 | 0 | 0 | 108.7 | C332 | P330-C332 PolarHBondContact O-N 3.49Š| ||
| 331 | V | 37.9 | Very low | 38.5 | Very low | 140 Ų | 140 | 130.9 Ų | 130.9 | 85% | 0.848 | 79% | 0.793 | S | S | * | * | trans | -68.5 | 114.9 | 163.4 | 175.9 | 0 | 0 | 0 | 0 | 106.5 | K329 G333 | K329-V331 PolarHBondContact O-N 3.46Å; V331-G333 PolarHBondContact O-N 3.29Å; V331-G333 VanDerWaalsContact O-N 3.15Å | ||
| 332 | C | 32.8 | Very low | 37.5 | Very low | 124 Ų | 124 | 135.4 Ų | 135.4 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | trans | -67.5 | 106.4 | 171.5 | -71.6 | 0 | 0 | 0 | 0 | 109.2 | P330 | P330-C332 PolarHBondContact O-N 3.49Š| ||
| 333 | G | 34.4 | Very low | 36.8 | Very low | 76 Ų | 76 | 139.5 Ų | 139.5 | 78% | 0.784 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 126.2 | 164.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | V331 | V331-G333 PolarHBondContact O-N 3.29Å; V331-G333 VanDerWaalsContact O-N 3.15Å |
| 334 | G | 35.2 | Very low | 36.1 | Very low | 69 Ų | 69 | 136.5 Ų | 136.5 | 71% | 0.711 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 164.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 335 | P | 36.8 | Very low | 35.2 | Very low | 142 Ų | 142 | 136.5 Ų | 136.5 | 92% | 0.922 | 82% | 0.816 | S | S | * | * | S | Bend | trans | -85.3 | 123.6 | -169 | 32.4 | -30.6 | 0 | 0 | 0 | 111.9 | ||
| 336 | G | 42.1 | Very low | 34.8 | Very low | 79 Ų | 79 | 138 Ų | 138 | 81% | 0.814 | 82% | 0.817 | S | S | * | * | trans | 168.4 | 70.1 | 169.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 337 | A | 32.7 | Very low | 34.5 | Very low | 104 Ų | 104 | 139.3 Ų | 139.3 | 86% | 0.86 | 82% | 0.823 | S | S | * | * | trans | -158.4 | 125.8 | 157.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 338 | R | 33.3 | Very low | 33.8 | Very low | 244 Ų | 244 | 139.9 Ų | 139.9 | 92% | 0.921 | 82% | 0.821 | S | S | * | * | trans | -72.8 | 153.4 | 178 | -66.8 | 179.1 | -163.9 | -165.9 | 2.8 | 111.5 | ||||
| 339 | P | 35.9 | Very low | 33.5 | Very low | 134 Ų | 134 | 134.7 Ų | 134.7 | 87% | 0.87 | 82% | 0.816 | S | S | * | * | trans | -83.6 | 117.9 | 175.1 | 31.5 | -29.5 | 0 | 0 | 0 | 111.6 | ||||
| 340 | G | 32.8 | Very low | 33.4 | Very low | 77 Ų | 77 | 134.5 Ų | 134.5 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | trans | -106.1 | 118.7 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 341 | K | 34 | Very low | 33.2 | Very low | 195 Ų | 195 | 136.4 Ų | 136.4 | 85% | 0.848 | 83% | 0.826 | S | S | * | * | trans | -11.6 | 135.3 | 169.1 | -64.6 | 175.4 | 177.1 | 177.7 | 0 | 119.9 | ||||
| 342 | N | 31.3 | Very low | 32.8 | Very low | 153 Ų | 153 | 137.3 Ų | 137.3 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | 45.6 | 132.3 | 137.4 | -65.1 | -14.5 | 0 | 0 | 0 | 120.3 | ||||
| 343 | V | 32.4 | Very low | 32.6 | Very low | 148 Ų | 148 | 135.2 Ų | 135.2 | 90% | 0.897 | 83% | 0.825 | S | S | * | * | -167.1 | 138.8 | 108.9 | 150.5 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 344 | K | 31.6 | Very low | 32.4 | Very low | 166 Ų | 166 | 143.3 Ų | 143.3 | 72% | 0.722 | 83% | 0.832 | S | S | * | * | trans | -76.7 | 161.1 | 178.1 | -74.8 | 176.7 | 167.2 | -172.6 | 0 | 112.3 | ||||
| 345 | E | 31.6 | Very low | 32.2 | Very low | 165 Ų | 165 | 143.3 Ų | 143.3 | 77% | 0.771 | 83% | 0.832 | S | S | * | * | trans | 67.8 | 144.7 | 144.4 | -76.2 | 165.1 | -168.1 | 0 | 0 | 116.6 | ||||
| 346 | T | 30.8 | Very low | 32 | Very low | 111 Ų | 111 | 146.8 Ų | 146.8 | 68% | 0.681 | 83% | 0.833 | S | S | * | * | cis | -166.4 | 136.8 | -1.9 | -87.4 | 0 | 0 | 0 | 0 | 105.1 | Q348 | T346-Q348 PolarHBondContact O-N 3.43Š| ||
| 347 | T | 29.8 | Very low | 31.4 | Very low | 139 Ų | 139 | 146.4 Ų | 146.4 | 85% | 0.853 | 83% | 0.828 | S | S | * | * | trans | -85.6 | 99.7 | 170.5 | -46 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 348 | Q | 29.6 | Very low | 31.3 | Very low | 189 Ų | 189 | 151.1 Ų | 151.1 | 88% | 0.883 | 83% | 0.83 | S | S | * | * | trans | -164.3 | 128.3 | 156.8 | -145 | 103.2 | 16.7 | 0 | 0 | 109.9 | T346 | T346-Q348 PolarHBondContact O-N 3.43Š| ||
| 349 | G | 28.9 | Very low | 31 | Very low | 72 Ų | 72 | 144.1 Ų | 144.1 | 74% | 0.742 | 82% | 0.818 | S | S | * | * | trans | 123.5 | 49.4 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | L351 | G349-L351 PolarHBondContact O-N 3.06Š| ||
| 350 | L | 31.7 | Very low | 30.7 | Very low | 179 Ų | 179 | 145.5 Ų | 145.5 | 94% | 0.937 | 82% | 0.818 | S | S | * | * | trans | -78.8 | 80.6 | 156.1 | -166.3 | 93.8 | 0 | 0 | 0 | 107.3 | ||||
| 351 | L | 31.1 | Very low | 30.5 | Very low | 158 Ų | 158 | 145.2 Ų | 145.2 | 83% | 0.827 | 82% | 0.815 | S | S | * | * | trans | -158.8 | 113.5 | 163.2 | -100.6 | 165.9 | 0 | 0 | 0 | 108.6 | G349 | G349-L351 PolarHBondContact O-N 3.06Š| ||
| 352 | D | 29.9 | Very low | 30.2 | Very low | 159 Ų | 159 | 147.7 Ų | 147.7 | 85% | 0.85 | 82% | 0.819 | S | S | * | * | trans | 73 | 124.1 | 150.7 | -129.8 | -11.7 | 0 | 0 | 0 | 119.8 | ||||
| 353 | G | 28.9 | Very low | 30.2 | Very low | 80 Ų | 80 | 144.5 Ų | 144.5 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | -175.9 | 56.7 | -173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 354 | R | 30.6 | Very low | 31 | Very low | 247 Ų | 247 | 142.8 Ų | 142.8 | 93% | 0.932 | 81% | 0.806 | S | S | * | * | trans | -122.1 | 109.8 | 161.6 | -150.5 | -176.9 | -157.4 | -174 | 6.5 | 108.9 | ||||
| 355 | G | 29.9 | Very low | 31 | Very low | 69 Ų | 69 | 143.6 Ų | 143.6 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | trans | 134.5 | 95.3 | 157.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 356 | K | 32.6 | Very low | 31 | Very low | 215 Ų | 215 | 140.1 Ų | 140.1 | 94% | 0.935 | 81% | 0.812 | S | S | * | * | trans | 33.7 | 124.6 | 131.2 | -71.7 | -178.8 | 173.1 | 177.9 | 0 | 118.4 | ||||
| 357 | G | 29 | Very low | 31.1 | Very low | 70 Ų | 70 | 140.1 Ų | 140.1 | 72% | 0.722 | 82% | 0.817 | S | S | * | * | 127.3 | 121.2 | 112.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | |||||
| 358 | K | 30.6 | Very low | 31.4 | Very low | 203 Ų | 203 | 141.1 Ų | 141.1 | 88% | 0.883 | 82% | 0.816 | S | S | * | * | trans | 68.3 | 114.3 | 139.7 | -79.7 | -175 | 174.2 | -178.3 | 0 | 120.2 | ||||
| 359 | S | 28.7 | Very low | 31.7 | Very low | 98 Ų | 98 | 141.1 Ų | 141.1 | 69% | 0.685 | 82% | 0.816 | S | S | * | * | 98.2 | 132.9 | 114.3 | 81.4 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 360 | N | 28.7 | Very low | 32 | Very low | 162 Ų | 162 | 141.5 Ų | 141.5 | 87% | 0.866 | 82% | 0.82 | S | S | * | * | trans | 71.3 | 115.5 | 143.7 | -72.7 | -2 | 0 | 0 | 0 | 119.7 | ||||
| 361 | G | 28.3 | Very low | 32.2 | Very low | 71 Ų | 71 | 144.9 Ų | 144.9 | 73% | 0.732 | 82% | 0.82 | S | S | * | * | 125.9 | 122.8 | 108.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 362 | R | 28.6 | Very low | 32.7 | Very low | 248 Ų | 248 | 147.2 Ų | 147.2 | 94% | 0.936 | 83% | 0.827 | S | S | * | * | trans | 65.3 | 116.3 | 147.6 | -84.6 | 177.3 | -171.3 | 168.8 | 3.3 | 120.2 | ||||
| 363 | A | 30.3 | Very low | 33.5 | Very low | 85 Ų | 85 | 143.4 Ų | 143.4 | 70% | 0.702 | 83% | 0.825 | S | S | * | * | trans | -74.9 | -175.7 | 137 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 364 | P | 50.6 | Low | 34.1 | Very low | 113 Ų | 113 | 148.3 Ų | 148.3 | 73% | 0.734 | 86% | 0.858 | S | S | * | * | cis | -136.5 | -158.2 | -14 | 27.4 | -1.4 | 0 | 0 | 0 | 112.3 | ||||
| 365 | E | 30.3 | Very low | 34.2 | Very low | 183 Ų | 183 | 143.4 Ų | 143.4 | 86% | 0.855 | 85% | 0.854 | S | S | * | * | trans | 100 | 115.4 | 164.6 | -62.7 | -173.7 | 143.1 | 0 | 0 | 115.9 | ||||
| 366 | A | 33.1 | Very low | 34.5 | Very low | 92 Ų | 92 | 147.3 Ų | 147.3 | 76% | 0.76 | 86% | 0.861 | S | S | * | * | cis | 95.3 | 113.5 | 46.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 367 | S | 32.4 | Very low | 34.6 | Very low | 111 Ų | 111 | 143.5 Ų | 143.5 | 78% | 0.776 | 86% | 0.857 | S | S | * | * | trans | -177.3 | 112.9 | 150.7 | 24.9 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 368 | L | 36.4 | Very low | 34.9 | Very low | 160 Ų | 160 | 147.8 Ų | 147.8 | 84% | 0.838 | 87% | 0.865 | S | S | * | * | 53.3 | 114.3 | 90.5 | -79.6 | 152.8 | 0 | 0 | 0 | 110.5 | |||||
| 369 | Q | 34.4 | Very low | 35.2 | Very low | 188 Ų | 188 | 144.4 Ų | 144.4 | 88% | 0.879 | 86% | 0.864 | S | S | * | * | -176.5 | 157.5 | 62.1 | -110.5 | 158.6 | -32.9 | 0 | 0 | 109.8 | |||||
| 370 | G | 35.4 | Very low | 35.6 | Very low | 81 Ų | 81 | 147.5 Ų | 147.5 | 84% | 0.835 | 88% | 0.876 | S | S | * | * | trans | 145.6 | 96 | 147.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 371 | R | 37.5 | Very low | 36.1 | Very low | 250 Ų | 250 | 146.4 Ų | 146.4 | 94% | 0.943 | 88% | 0.877 | S | S | * | * | trans | -107.8 | 115.6 | -179.2 | -166.2 | -173.8 | -164.3 | -179.7 | 3.6 | 106.5 | ||||
| 372 | E | 40.9 | Very low | 36.7 | Very low | 207 Ų | 207 | 152.2 Ų | 152.2 | 97% | 0.967 | 89% | 0.888 | S | S | * | * | trans | -127 | 127.8 | 163.1 | -82.6 | -175.2 | 131.9 | 0 | 0 | 108.7 | ||||
| 373 | G | 46.6 | Very low | 37.4 | Very low | 79 Ų | 79 | 144.3 Ų | 144.3 | 81% | 0.814 | 88% | 0.884 | S | S | * | * | trans | -141.1 | 120.9 | 167 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 374 | A | 40.8 | Very low | 38 | Very low | 182 Ų | 182 | 149.6 Ų | 149.6 | 100% | 1.504 | 90% | 0.901 | S | S | * | * | trans | 166.5 | 0 | 143.9 | 0 | 0 | 0 | 0 | 0 | 107.8 |
Retrieved 374 of 374 residues in 1912.1 ms
(Link to these results)