| 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 | 32.5 | Very low | 31.3 | Very low | 242 Ų | 242 | 140.7 Ų | 140.7 | 100% | 1.192 | 77% | 0.774 | S | S | * | * | 0 | 111.1 | 0 | -161 | 165.5 | 171.6 | 0 | 0 | 107.1 | L3 | M1-L3 PolarHBondContact O-N 3.14Š| |||
| 2 | K | 28.9 | Very low | 32.4 | Very low | 204 Ų | 204 | 139.3 Ų | 139.3 | 89% | 0.887 | 77% | 0.772 | S | S | * | * | trans | -74 | 113.4 | -178.2 | -83.4 | -179.6 | 175.2 | 177.3 | 0 | 108.5 | V4 | K2-V4 PolarHBondContact O-N 3.37Å; K2-V4 VanDerWaalsContact O-N 3.15Å | ||
| 3 | L | 27.4 | Very low | 32.9 | Very low | 163 Ų | 163 | 143.6 Ų | 143.6 | 85% | 0.853 | 78% | 0.783 | S | S | * | * | trans | -67.6 | 103.4 | 168.1 | -93.4 | 139.6 | 0 | 0 | 0 | 108.2 | M1 | M1-L3 PolarHBondContact O-N 3.14Š| ||
| 4 | V | 26.9 | Very low | 33.5 | Very low | 112 Ų | 112 | 138.1 Ų | 138.1 | 68% | 0.679 | 76% | 0.76 | S | S | * | * | trans | -97.5 | 103.4 | 168 | -174.7 | 0 | 0 | 0 | 0 | 106.3 | K2 V6 | K2-V4 PolarHBondContact O-N 3.37Å; K2-V4 VanDerWaalsContact O-N 3.15Å; V4-V6 HydrophobicContact CB-CG2 4.48Å; V4-V6 HydrophobicContact CG1-CG2 3.59Å; V4-V6 PolarHBondContact O-N 3.45Å; V4-V6 VanDerWaalsContact O-N 3.15Å | ||
| 5 | V | 32.9 | Very low | 34 | Very low | 136 Ų | 136 | 142.7 Ų | 142.7 | 82% | 0.824 | 77% | 0.774 | S | S | * | * | trans | -76.8 | 95.4 | 170.2 | -178.2 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 6 | V | 27.9 | Very low | 34.3 | Very low | 105 Ų | 105 | 142.7 Ų | 142.7 | 64% | 0.636 | 77% | 0.772 | S | S | * | * | trans | -88.6 | 113.8 | 170.9 | -175.5 | 0 | 0 | 0 | 0 | 107.2 | V4 V8 | V4-V6 HydrophobicContact CB-CG2 4.48Å; V4-V6 HydrophobicContact CG1-CG2 3.59Å; V4-V6 PolarHBondContact O-N 3.45Å; V4-V6 VanDerWaalsContact O-N 3.15Å; V6-V8 HydrophobicContact CG1-CG2 4.3Å; V6-V8 PolarHBondContact O-N 3.25Å | ||
| 7 | A | 30.8 | Very low | 34.7 | Very low | 81 Ų | 81 | 137.8 Ų | 137.8 | 67% | 0.669 | 76% | 0.756 | S | S | * | * | trans | -70 | 115.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 8 | V | 31.8 | Very low | 34.7 | Very low | 118 Ų | 118 | 132.3 Ų | 132.3 | 72% | 0.715 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -97.8 | 132 | 178 | -178.8 | 0 | 0 | 0 | 0 | 108.4 | V6 | V6-V8 HydrophobicContact CG1-CG2 4.3Å; V6-V8 PolarHBondContact O-N 3.25Å |
| 9 | E | 31.5 | Very low | 35 | Very low | 176 Ų | 176 | 132.2 Ų | 132.2 | 82% | 0.822 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 145 | 177.9 | -77.9 | 175.7 | 153.7 | 0 | 0 | 111.7 | ||
| 10 | P | 36.4 | Very low | 35.4 | Very low | 92 Ų | 92 | 134.1 Ų | 134.1 | 60% | 0.597 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 137.7 | -173.3 | 28.2 | -32.7 | 0 | 0 | 0 | 112.7 | V12 | P10-V12 WeakPolarHBondContact O-CG2 3.49Å; P10-V12 PolarHBondContact O-N 2.83Å |
| 11 | D | 37.1 | Very low | 35.4 | Very low | 119 Ų | 119 | 132.8 Ų | 132.8 | 64% | 0.636 | 73% | 0.733 | S | S | * | * | trans | -64.7 | 110.9 | 173 | -82.7 | -38.1 | 0 | 0 | 0 | 110.3 | E13 K26 | D11-E13 PolarHBondContact O-N 3.01Å; D11-K26 IonicContact OD2-NZ 3.39Å | ||
| 12 | V | 45.2 | Very low | 35.6 | Very low | 124 Ų | 124 | 124.9 Ų | 124.9 | 75% | 0.752 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -4.1 | -173.6 | -168.2 | 0 | 0 | 0 | 0 | 112.7 | P10 | P10-V12 WeakPolarHBondContact O-CG2 3.49Å; P10-V12 PolarHBondContact O-N 2.83Å |
| 13 | E | 39 | Very low | 35.8 | Very low | 195 Ų | 195 | 123 Ų | 123 | 91% | 0.911 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 2.2 | -173.6 | -66.6 | -174 | 165 | 0 | 0 | 114.8 | D11 | D11-E13 PolarHBondContact O-N 3.01Š|
| 14 | S | 40.3 | Very low | 36.2 | Very low | 66 Ų | 66 | 124.4 Ų | 124.4 | 46% | 0.462 | 69% | 0.692 | S | S | . | * | S | Bend | trans | -86.1 | 130 | 175.6 | -176.5 | 0 | 0 | 0 | 0 | 111.8 | L16 A17 | S14-L16 PolarHBondContact O-N 2.82Å; S14-A17 WeakPolarHBondContact O-CB 3.41Å; S14-A17 PolarHBondContact O-N 2.83Å |
| 15 | E | 41.9 | Very low | 36.5 | Very low | 207 Ų | 207 | 123.5 Ų | 123.5 | 97% | 0.967 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | -3.2 | 178.4 | -69.3 | -176.8 | 152 | 0 | 0 | 115.3 | ||
| 16 | L | 39 | Very low | 36.2 | Very low | 143 Ų | 143 | 123.8 Ų | 123.8 | 75% | 0.749 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.9 | 14.1 | 171.6 | -84.8 | 105.1 | 0 | 0 | 0 | 114.5 | S14 G18 | S14-L16 PolarHBondContact O-N 2.82Å; L16-G18 VanDerWaalsContact C-N 3.29Å; L16-G18 PolarHBondContact O-N 2.64Å |
| 17 | A | 40.8 | Very low | 36.7 | Very low | 60 Ų | 60 | 128 Ų | 128 | 50% | 0.496 | 70% | 0.696 | S | S | . | * | trans | -71.7 | 74.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | S14 | S14-A17 WeakPolarHBondContact O-CB 3.41Å; S14-A17 PolarHBondContact O-N 2.83Å | ||
| 18 | G | 35.3 | Very low | 37 | Very low | 38 Ų | 38 | 131 Ų | 131 | 39% | 0.392 | 70% | 0.701 | S | S | . | * | trans | -88.5 | 156.6 | 164.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L16 H20 M21 | L16-G18 VanDerWaalsContact C-N 3.29Å; L16-G18 PolarHBondContact O-N 2.64Å; G18-H20 PolarHBondContact O-N 2.95Å; G18-M21 PolarHBondContact O-N 3.22Å | ||
| 19 | P | 40.4 | Very low | 37.4 | Very low | 130 Ų | 130 | 132.3 Ų | 132.3 | 84% | 0.844 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.4 | 0.2 | -172.1 | 24.1 | -33.4 | 0 | 0 | 0 | 115.9 | ||
| 20 | H | 42.7 | Very low | 37.8 | Very low | 171 Ų | 171 | 130.4 Ų | 130.4 | 79% | 0.792 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.3 | 22.9 | -178.1 | -59.8 | -60.1 | 0 | 0 | 0 | 113.7 | G18 P22 | G18-H20 PolarHBondContact O-N 2.95Å; H20-P22 WeakPolarHBondContact O-CD 3.48Å |
| 21 | M | 34 | Very low | 37.8 | Very low | 107 Ų | 107 | 133 Ų | 133 | 53% | 0.527 | 71% | 0.706 | S | S | . | * | trans | -67.7 | 117 | 176.4 | -128.8 | -148.1 | -67.6 | 0 | 0 | 110.7 | G18 | G18-M21 PolarHBondContact O-N 3.22Š| ||
| 22 | P | 36.6 | Very low | 37.7 | Very low | 75 Ų | 75 | 131.8 Ų | 131.8 | 49% | 0.487 | 70% | 0.699 | S | S | . | * | trans | -70.6 | 143.2 | 176.9 | -12.2 | 28.3 | 0 | 0 | 0 | 110 | H20 Y24 | H20-P22 WeakPolarHBondContact O-CD 3.48Å; P22-Y24 HydrophobicContact CB-CD2 4.09Å; P22-Y24 HydrophobicContact CB-CE2 3.7Å; P22-Y24 HydrophobicContact CG-CD2 4.42Å; P22-Y24 HydrophobicContact CG-CE2 3.69Å; P22-Y24 WeakPolarHBondContact O-CD2 3.23Å; P22-Y24 PolarHBondContact O-N 2.88Å | ||
| 23 | M | 34.3 | Very low | 37.5 | Very low | 166 Ų | 166 | 132.3 Ų | 132.3 | 82% | 0.818 | 70% | 0.698 | S | S | * | * | trans | -61.4 | 95.1 | 168.4 | -84.6 | -154.8 | -75.5 | 0 | 0 | 109.9 | ||||
| 24 | Y | 35.5 | Very low | 37.2 | Very low | 192 Ų | 192 | 132.6 Ų | 132.6 | 75% | 0.753 | 69% | 0.691 | S | S | * | * | trans | -94.2 | 123.3 | 164.5 | -71.8 | -76.7 | 0 | 0 | 0 | 108.8 | P22 K26 | P22-Y24 HydrophobicContact CB-CD2 4.09Å; P22-Y24 HydrophobicContact CB-CE2 3.7Å; P22-Y24 HydrophobicContact CG-CD2 4.42Å; P22-Y24 HydrophobicContact CG-CE2 3.69Å; P22-Y24 WeakPolarHBondContact O-CD2 3.23Å; P22-Y24 PolarHBondContact O-N 2.88Å; Y24-K26 PolarHBondContact O-N 2.91Å; Y24-K26 VanDerWaalsContact O-N 3.16Å | ||
| 25 | A | 33 | Very low | 37 | Very low | 93 Ų | 93 | 139.1 Ų | 139.1 | 77% | 0.769 | 71% | 0.706 | S | S | * | * | trans | -58.8 | 119 | 161.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | K27 | A25-K27 PolarHBondContact O-N 3.24Š| ||
| 26 | K | 27.7 | Very low | 36.7 | Very low | 141 Ų | 141 | 135.1 Ų | 135.1 | 61% | 0.613 | 69% | 0.691 | S | S | * | * | trans | -46.6 | 112.2 | 178.4 | -127.5 | 171.1 | -177.2 | 166.6 | 0 | 108.5 | D11 Y24 D28 L29 | D11-K26 IonicContact OD2-NZ 3.39Å; Y24-K26 PolarHBondContact O-N 2.91Å; Y24-K26 VanDerWaalsContact O-N 3.16Å; K26-D28 PolarHBondContact O-N 3.12Å; K26-D28 VanDerWaalsContact O-N 3.09Å; K26-L29 PolarHBondContact O-N 2.67Å | ||
| 27 | K | 38.4 | Very low | 36.4 | Very low | 194 Ų | 194 | 133.8 Ų | 133.8 | 84% | 0.843 | 69% | 0.691 | S | S | * | * | G | 310 helix | trans | -57.5 | -22.6 | -179.9 | -93.6 | -175.3 | 172.6 | -176.4 | 0 | 112.5 | A25 L29 | A25-K27 PolarHBondContact O-N 3.24Å; K27-L29 PolarHBondContact O-N 2.67Å |
| 28 | D | 36.1 | Very low | 36.2 | Very low | 145 Ų | 145 | 139.2 Ų | 139.2 | 78% | 0.775 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -75.2 | -6.7 | -173.9 | -56.2 | -34.1 | 0 | 0 | 0 | 114.4 | K26 | K26-D28 PolarHBondContact O-N 3.12Å; K26-D28 VanDerWaalsContact O-N 3.09Å |
| 29 | L | 41.3 | Very low | 36.3 | Very low | 145 Ų | 145 | 143.8 Ų | 143.8 | 76% | 0.759 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -104.3 | 1.1 | -179.2 | -118 | 108.7 | 0 | 0 | 0 | 115.8 | K26 K27 | K26-L29 PolarHBondContact O-N 2.67Å; K27-L29 PolarHBondContact O-N 2.67Å |
| 30 | L | 38.3 | Very low | 36 | Very low | 135 Ų | 135 | 149 Ų | 149 | 71% | 0.707 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -137.2 | 92.5 | 178.6 | -69 | 173.4 | 0 | 0 | 0 | 112.2 | ||
| 31 | L | 36.8 | Very low | 35.6 | Very low | 146 Ų | 146 | 149.9 Ų | 149.9 | 76% | 0.764 | 73% | 0.731 | S | S | * | * | trans | 71 | 109.8 | 142.3 | -59.9 | 160.9 | 0 | 0 | 0 | 116.4 | D33 | L31-D33 PolarHBondContact O-N 3.12Š| ||
| 32 | D | 34.8 | Very low | 36.1 | Very low | 95 Ų | 95 | 153 Ų | 153 | 51% | 0.508 | 74% | 0.736 | S | S | . | * | trans | -6.9 | 114.3 | 154.9 | -166.5 | -0.6 | 0 | 0 | 0 | 113.4 | R34 Y35 | D32-R34 PolarHBondContact O-N 2.83Å; D32-R34 IonicContact OD1-NE 2.69Å; D32-R34 PolarHBondContact OD1-NE 3.19Å; D32-R34 IonicContact OD2-CZ 3.84Å; D32-R34 VanDerWaalsContact OD2-CZ 3.27Å; D32-R34 IonicContact OD2-NE 3.66Å; D32-R34 PolarHBondContact OD2-NE 3.3Å; D32-R34 IonicContact OD2-NH2 3.27Å; D32-R34 PolarHBondContact OD2-NH2 2.99Å; D32-Y35 PolarHBondContact O-N 2.78Å; D32-Y35 VanDerWaalsContact O-N 3.14Å | ||
| 33 | D | 40.8 | Very low | 36.6 | Very low | 135 Ų | 135 | 153.6 Ų | 153.6 | 72% | 0.722 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -50.5 | -10.3 | -173.3 | -82.6 | -39 | 0 | 0 | 0 | 114.7 | L31 Y35 L36 | L31-D33 PolarHBondContact O-N 3.12Å; D33-Y35 PolarHBondContact O-N 3.35Å; D33-L36 PolarHBondContact O-N 3.34Å; D33-L36 VanDerWaalsContact OD1-CD1 3.25Å; D33-L36 WeakPolarHBondContact OD1-CD1 3.46Å |
| 34 | R | 34.3 | Very low | 37.5 | Very low | 200 Ų | 200 | 154.6 Ų | 154.6 | 76% | 0.755 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -64.6 | -15 | 173.5 | -66.2 | -170.7 | -80.9 | -160.5 | -1.7 | 114.6 | D32 | D32-R34 PolarHBondContact O-N 2.83Å; D32-R34 IonicContact OD1-NE 2.69Å; D32-R34 PolarHBondContact OD1-NE 3.19Å; D32-R34 IonicContact OD2-CZ 3.84Å; D32-R34 VanDerWaalsContact OD2-CZ 3.27Å; D32-R34 IonicContact OD2-NE 3.66Å; D32-R34 PolarHBondContact OD2-NE 3.3Å; D32-R34 IonicContact OD2-NH2 3.27Å; D32-R34 PolarHBondContact OD2-NH2 2.99Å |
| 35 | Y | 34.3 | Very low | 38.6 | Very low | 203 Ų | 203 | 147.2 Ų | 147.2 | 80% | 0.796 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -116.5 | 22.7 | 177.6 | -78.2 | -82.8 | 0 | 0 | 0 | 114.7 | D32 D33 P37 | D32-Y35 PolarHBondContact O-N 2.78Å; D32-Y35 VanDerWaalsContact O-N 3.14Å; D33-Y35 PolarHBondContact O-N 3.35Å; Y35-P37 WeakPolarHBondContact O-CD 3.48Å |
| 36 | L | 36.4 | Very low | 40.4 | Very low | 124 Ų | 124 | 145 Ų | 145 | 65% | 0.649 | 70% | 0.696 | S | S | * | * | trans | -80.5 | 100.9 | 161.4 | -74.9 | 164.5 | 0 | 0 | 0 | 108.1 | D33 H38 | D33-L36 PolarHBondContact O-N 3.34Å; D33-L36 VanDerWaalsContact OD1-CD1 3.25Å; D33-L36 WeakPolarHBondContact OD1-CD1 3.46Å; L36-H38 PolarHBondContact O-N 2.88Å | ||
| 37 | P | 33.6 | Very low | 42.7 | Very low | 114 Ų | 114 | 142.5 Ų | 142.5 | 74% | 0.74 | 69% | 0.689 | S | S | * | * | trans | -56.1 | 123.2 | 166.2 | 25.2 | -32.1 | 0 | 0 | 0 | 106.1 | Y35 T39 | Y35-P37 WeakPolarHBondContact O-CD 3.48Å; P37-T39 PolarHBondContact O-N 3.44Å | ||
| 38 | H | 35.3 | Very low | 44.7 | Very low | 175 Ų | 175 | 141.7 Ų | 141.7 | 81% | 0.81 | 69% | 0.686 | S | S | * | * | trans | -14.9 | 119.5 | 176.3 | -67.9 | -77.8 | 0 | 0 | 0 | 111.6 | L36 R40 | L36-H38 PolarHBondContact O-N 2.88Å; H38-R40 VanDerWaalsContact C-N 3.25Å; H38-R40 WeakPolarHBondContact O-CA 3.25Å; H38-R40 PolarHBondContact O-N 2.81Å | ||
| 39 | T | 37 | Very low | 46.8 | Very low | 134 Ų | 134 | 140.5 Ų | 140.5 | 82% | 0.822 | 68% | 0.675 | S | S | * | * | trans | -26 | 96.4 | 160 | 34.3 | 0 | 0 | 0 | 0 | 108.1 | P37 K41 | P37-T39 PolarHBondContact O-N 3.44Å; T39-K41 PolarHBondContact O-N 3Å | ||
| 40 | R | 34 | Very low | 48.9 | Very low | 240 Ų | 240 | 134.2 Ų | 134.2 | 91% | 0.906 | 64% | 0.642 | S | S | * | * | trans | -65 | 95.6 | -179.8 | -174.8 | 179.3 | -177.3 | -180 | 1 | 101.3 | H38 R42 | H38-R40 VanDerWaalsContact C-N 3.25Å; H38-R40 WeakPolarHBondContact O-CA 3.25Å; H38-R40 PolarHBondContact O-N 2.81Å; R40-R42 VanDerWaalsContact C-N 3.29Å; R40-R42 PolarHBondContact O-N 2.99Å | ||
| 41 | K | 35.9 | Very low | 51.4 | Low | 188 Ų | 188 | 132.2 Ų | 132.2 | 82% | 0.817 | 63% | 0.632 | S | S | * | * | trans | -43.8 | 110.6 | 167 | -82.3 | 179.7 | 175.7 | 176.6 | 0 | 102 | T39 S43 | T39-K41 PolarHBondContact O-N 3Å; K41-S43 PolarHBondContact O-N 3.46Å | ||
| 42 | R | 43.3 | Very low | 54 | Low | 172 Ų | 172 | 131.8 Ų | 131.8 | 65% | 0.649 | 63% | 0.63 | S | S | * | * | trans | -52.8 | 99.8 | 171.4 | -118.4 | -178.5 | -177 | -177.7 | -1.3 | 102.3 | R40 K44 E189 | R40-R42 VanDerWaalsContact C-N 3.29Å; R40-R42 PolarHBondContact O-N 2.99Å; R42-K44 VanDerWaalsContact C-N 3.26Å; R42-K44 PolarHBondContact O-N 3.2Å; R42-E189 WeakPolarHBondContact CB-OE1 3.33Å; R42-E189 HydrophobicContact CG-CG 4.37Å; R42-E189 WeakPolarHBondContact CG-OE1 3.17Å | ||
| 43 | S | 47.1 | Very low | 56.8 | Low | 89 Ų | 89 | 128.4 Ų | 128.4 | 62% | 0.622 | 61% | 0.612 | S | S | * | * | trans | -61.4 | 106.7 | 178.4 | 158.9 | 0 | 0 | 0 | 0 | 100.8 | K41 T45 E189 | K41-S43 PolarHBondContact O-N 3.46Å; S43-T45 PolarHBondContact O-N 3.48Å; S43-E189 VanDerWaalsContact O-OE1 3.08Å | ||
| 44 | K | 53 | Low | 59.3 | Low | 187 Ų | 187 | 123.3 Ų | 123.3 | 81% | 0.813 | 58% | 0.584 | S | S | * | * | trans | -54.7 | 89 | 175.2 | -77.2 | -172.5 | 178.4 | -177.1 | 0 | 105.8 | R42 S46 E189 | R42-K44 VanDerWaalsContact C-N 3.26Å; R42-K44 PolarHBondContact O-N 3.2Å; K44-S46 PolarHBondContact O-N 3.41Å; K44-E189 WeakPolarHBondContact CA-OE2 3.49Å | ||
| 45 | T | 58.9 | Low | 62.1 | Low | 37 Ų | 37 | 117.9 Ų | 117.9 | 23% | 0.227 | 57% | 0.573 | C | S | . | * | trans | -60.1 | 116.6 | 174 | 29.4 | 0 | 0 | 0 | 0 | 103.2 | S43 L47 S187 E189 | S43-T45 PolarHBondContact O-N 3.48Å; T45-L47 PolarHBondContact O-N 3.42Å; T45-S187 WeakPolarHBondContact OG1-CB 3.33Å; T45-S187 PolarHBondContact OG1-OG 3.48Å; T45-E189 PolarHBondContact N-OE2 3.17Å; T45-E189 PolarHBondContact OG1-OE2 3.36Å | ||
| 46 | S | 70.4 | Confident | 65 | Low | 45 Ų | 45 | 109.9 Ų | 109.9 | 32% | 0.315 | 54% | 0.544 | S | S | . | . | trans | -63 | 140.1 | -171.5 | 66.7 | 0 | 0 | 0 | 0 | 107.8 | K44 K48 E49 | K44-S46 PolarHBondContact O-N 3.41Å; S46-K48 PolarHBondContact O-N 2.77Å; S46-E49 PolarHBondContact N-OE1 3.42Å; S46-E49 WeakPolarHBondContact O-CB 3.5Å; S46-E49 PolarHBondContact O-N 3.13Å; S46-E49 PolarHBondContact OG-OE1 2.99Å | ||
| 47 | L | 76.9 | Confident | 67.8 | Low | 90 Ų | 90 | 104 Ų | 104 | 47% | 0.471 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -49.3 | -25.5 | 172.8 | -169.7 | 90 | 0 | 0 | 0 | 111.6 | T45 E49 D50 L51 I54 Y193 | T45-L47 PolarHBondContact O-N 3.42Å; L47-E49 PolarHBondContact O-N 3Å; L47-D50 PolarHBondContact O-N 3.33Å; L47-L51 PolarHBondContact O-N 2.74Å; L47-I54 HydrophobicContact CD1-CD1 4.09Å; L47-Y193 HydrophobicContact CD1-CE2 4.02Å |
| 48 | K | 79.3 | Confident | 70.8 | Confident | 177 Ų | 177 | 100.4 Ų | 100.4 | 77% | 0.77 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62.5 | -35.6 | 175.3 | -60.2 | -175.4 | 177.5 | -176.1 | 0 | 113.4 | S46 L51 | S46-K48 PolarHBondContact O-N 2.77Å; K48-L51 WeakPolarHBondContact O-CB 3.35Å; K48-L51 PolarHBondContact O-N 3.05Å |
| 49 | E | 80.7 | Confident | 73.7 | Confident | 120 Ų | 120 | 96 Ų | 96 | 56% | 0.561 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -69 | -36.7 | 177.1 | -73 | 155.9 | -124.4 | 0 | 0 | 111.5 | S46 L47 | S46-E49 PolarHBondContact N-OE1 3.42Å; S46-E49 WeakPolarHBondContact O-CB 3.5Å; S46-E49 PolarHBondContact O-N 3.13Å; S46-E49 PolarHBondContact OG-OE1 2.99Å; L47-E49 PolarHBondContact O-N 3Å |
| 50 | D | 86.7 | Confident | 76.5 | Confident | 12 Ų | 12 | 89.7 Ų | 89.7 | 6% | 0.064 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -88.4 | -6.4 | 177.7 | -81.1 | -20 | 0 | 0 | 0 | 113.8 | L47 L52 N53 I54 L186 S187 N190 | L47-D50 PolarHBondContact O-N 3.33Å; D50-L52 VanDerWaalsContact C-N 3.3Å; D50-L52 PolarHBondContact O-N 2.95Å; D50-N53 CarbonylContact O-C 3.59Å; D50-N53 WeakPolarHBondContact O-CA 3.46Å; D50-N53 WeakPolarHBondContact O-CB 3.42Å; D50-N53 PolarHBondContact O-N 3.21Å; D50-I54 HydrophobicContact CB-CD1 4.14Å; D50-I54 HydrophobicContact CB-CG1 4.43Å; D50-I54 WeakPolarHBondContact O-CG1 3.49Å; D50-I54 PolarHBondContact O-N 3.31Å; D50-L186 HydrophobicContact CB-CD2 4.41Å; D50-S187 WeakPolarHBondContact OD2-CB 3.42Å; D50-S187 PolarHBondContact OD2-N 3.3Å; D50-S187 PolarHBondContact OD2-OG 3.2Å; D50-N190 WeakPolarHBondContact OD2-CB 3.22Å; D50-N190 PolarHBondContact OD2-ND2 3.39Å |
| 51 | L | 90.4 | Very high | 79.6 | Confident | 93 Ų | 93 | 78.3 Ų | 78.3 | 49% | 0.487 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -56.1 | -43.9 | -173.3 | -178.9 | 64 | 0 | 0 | 0 | 112.3 | L47 K48 N53 I54 V55 | L47-L51 PolarHBondContact O-N 2.74Å; K48-L51 WeakPolarHBondContact O-CB 3.35Å; K48-L51 PolarHBondContact O-N 3.05Å; L51-N53 VanDerWaalsContact C-N 3.31Å; L51-N53 PolarHBondContact O-N 2.83Å; L51-I54 PolarHBondContact O-N 2.68Å; L51-V55 HydrophobicContact CD1-CG2 4.32Å; L51-V55 WeakPolarHBondContact O-CB 3.46Å; L51-V55 VanDerWaalsContact O-CG2 3.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.41Å; L51-V55 PolarHBondContact O-N 3.34Å |
| 52 | L | 91.8 | Very high | 82.5 | Confident | 137 Ų | 137 | 71 Ų | 71 | 72% | 0.717 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -63.7 | -39.4 | 178 | -172.8 | 74.9 | 0 | 0 | 0 | 111.6 | D50 L56 | D50-L52 VanDerWaalsContact C-N 3.3Å; D50-L52 PolarHBondContact O-N 2.95Å; L52-L56 WeakPolarHBondContact O-CB 3.41Å; L52-L56 PolarHBondContact O-N 3.11Å |
| 53 | N | 92.3 | Very high | 85 | Confident | 24 Ų | 24 | 62.8 Ų | 62.8 | 13% | 0.128 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -68 | -42.1 | 177.9 | -67.2 | -30.6 | 0 | 0 | 0 | 111 | D50 L51 L56 L57 M185 L186 K260 | D50-N53 CarbonylContact O-C 3.59Å; D50-N53 WeakPolarHBondContact O-CA 3.46Å; D50-N53 WeakPolarHBondContact O-CB 3.42Å; D50-N53 PolarHBondContact O-N 3.21Å; L51-N53 VanDerWaalsContact C-N 3.31Å; L51-N53 PolarHBondContact O-N 2.83Å; N53-L56 PolarHBondContact O-N 2.92Å; N53-L57 WeakPolarHBondContact O-CB 3.48Å; N53-L57 VanDerWaalsContact O-CG 3.25Å; N53-L57 WeakPolarHBondContact O-CG 3.46Å; N53-L57 PolarHBondContact O-N 3.44Å; N53-M185 HydrophobicContact CB-CG 3.66Å; N53-M185 HydrophobicContact CB-SD 3.6Å; N53-M185 VanDerWaalsContact CG-CG 3.47Å; N53-M185 PolarHBondContact ND2-O 2.85Å; N53-M185 WeakPolarHBondContact OD1-CG 3.41Å; N53-L186 HydrophobicContact CB-CD2 4.34Å; N53-K260 PolarHBondContact OD1-NZ 3.34Å |
| 54 | I | 92.9 | Very high | 87.3 | Confident | 28 Ų | 28 | 58.6 Ų | 58.6 | 14% | 0.144 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.7 | -48.9 | 175.5 | -69.4 | 168.8 | 0 | 0 | 0 | 110.4 | L47 D50 L51 L56 L57 V58 L186 | L47-I54 HydrophobicContact CD1-CD1 4.09Å; D50-I54 HydrophobicContact CB-CD1 4.14Å; D50-I54 HydrophobicContact CB-CG1 4.43Å; D50-I54 WeakPolarHBondContact O-CG1 3.49Å; D50-I54 PolarHBondContact O-N 3.31Å; L51-I54 PolarHBondContact O-N 2.68Å; I54-L56 VanDerWaalsContact C-N 3.32Å; I54-L56 PolarHBondContact O-N 3.26Å; I54-L57 PolarHBondContact O-N 2.65Å; I54-V58 HydrophobicContact CG2-CG2 4.42Å; I54-V58 WeakPolarHBondContact O-CG2 3.17Å; I54-V58 PolarHBondContact O-N 3.47Å; I54-L186 HydrophobicContact CD1-CD2 4.44Å; I54-L186 HydrophobicContact CG1-CD2 3.57Å |
| 55 | V | 94.5 | Very high | 89.3 | Confident | 87 Ų | 87 | 49.7 Ų | 49.7 | 53% | 0.527 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60.2 | -43.8 | 178.2 | 170.1 | 0 | 0 | 0 | 0 | 110.9 | L51 F59 | L51-V55 HydrophobicContact CD1-CG2 4.32Å; L51-V55 WeakPolarHBondContact O-CB 3.46Å; L51-V55 VanDerWaalsContact O-CG2 3.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.41Å; L51-V55 PolarHBondContact O-N 3.34Å; V55-F59 WeakPolarHBondContact O-CB 3.3Å; V55-F59 PolarHBondContact O-N 2.83Å |
| 56 | L | 95 | Very high | 91 | Very high | 34 Ų | 34 | 47.9 Ų | 47.9 | 18% | 0.178 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.9 | -45.8 | 175.8 | 177.7 | 60.9 | 0 | 0 | 0 | 111.7 | L52 N53 I54 F59 L60 M185 V256 K260 | L52-L56 WeakPolarHBondContact O-CB 3.41Å; L52-L56 PolarHBondContact O-N 3.11Å; N53-L56 PolarHBondContact O-N 2.92Å; I54-L56 VanDerWaalsContact C-N 3.32Å; I54-L56 PolarHBondContact O-N 3.26Å; L56-F59 PolarHBondContact O-N 3.18Å; L56-L60 HydrophobicContact CD1-CD1 4.17Å; L56-L60 HydrophobicContact CD1-CG 4.12Å; L56-L60 HydrophobicContact CG-CD1 4.05Å; L56-L60 HydrophobicContact CG-CG 4.42Å; L56-L60 VanDerWaalsContact O-CG 3.29Å; L56-L60 WeakPolarHBondContact O-CG 3.24Å; L56-L60 PolarHBondContact O-N 3.23Å; L56-M185 HydrophobicContact CD2-CE 4Å; L56-M185 HydrophobicContact CD2-SD 4.07Å; L56-V256 HydrophobicContact CD1-CG2 4.07Å; L56-K260 HydrophobicContact CD2-CD 3.92Å; L56-K260 HydrophobicContact CD2-CG 4.02Å |
| 57 | L | 95.2 | Very high | 92.2 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.8 | -49.7 | 178.6 | -75.1 | 170.9 | 0 | 0 | 0 | 111.6 | N53 I54 F59 L60 Y61 V178 A182 M185 L186 C197 | N53-L57 WeakPolarHBondContact O-CB 3.48Å; N53-L57 VanDerWaalsContact O-CG 3.25Å; N53-L57 WeakPolarHBondContact O-CG 3.46Å; N53-L57 PolarHBondContact O-N 3.44Å; I54-L57 PolarHBondContact O-N 2.65Å; L57-F59 PolarHBondContact O-N 3.29Å; L57-L60 PolarHBondContact O-N 2.79Å; L57-L60 VanDerWaalsContact O-N 3.15Å; L57-Y61 HydrophobicContact CB-CD2 4.32Å; L57-Y61 HydrophobicContact CB-CE2 4.26Å; L57-Y61 HydrophobicContact CD2-CE2 4.46Å; L57-Y61 WeakPolarHBondContact O-CB 3.37Å; L57-Y61 WeakPolarHBondContact O-CD2 3.47Å; L57-Y61 PolarHBondContact O-N 3.4Å; L57-V178 HydrophobicContact CD2-CG1 3.98Å; L57-A182 HydrophobicContact CD1-CB 3.89Å; L57-A182 HydrophobicContact CD2-CB 3.84Å; L57-M185 HydrophobicContact CD1-SD 4.48Å; L57-M185 HydrophobicContact CD2-CE 4.1Å; L57-M185 HydrophobicContact CD2-SD 4.4Å; L57-M185 HydrophobicContact CG-CE 4.42Å; L57-M185 HydrophobicContact CG-SD 4.08Å; L57-L186 HydrophobicContact CD1-CD1 3.89Å; L57-L186 HydrophobicContact CD1-CD2 3.9Å; L57-L186 HydrophobicContact CD1-CG 3.74Å; L57-C197 HydrophobicContact CB-CB 4.27Å |
| 58 | V | 95.4 | Very high | 93 | Very high | 40 Ų | 40 | 42.3 Ų | 42.3 | 24% | 0.242 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -56.7 | -41.4 | 176.6 | 172 | 0 | 0 | 0 | 0 | 110.7 | I54 Y61 L62 C197 V200 G201 | I54-V58 HydrophobicContact CG2-CG2 4.42Å; I54-V58 WeakPolarHBondContact O-CG2 3.17Å; I54-V58 PolarHBondContact O-N 3.47Å; V58-Y61 PolarHBondContact O-N 2.97Å; V58-L62 WeakPolarHBondContact O-CB 3.4Å; V58-L62 PolarHBondContact O-N 3.49Å; V58-C197 HydrophobicContact CG2-CB 3.89Å; V58-V200 HydrophobicContact CG1-CG1 4.17Å; V58-G201 WeakPolarHBondContact O-CA 3.36Å |
| 59 | F | 97 | Very high | 93.7 | Very high | 83 Ų | 83 | 33.9 Ų | 33.9 | 36% | 0.364 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -66.9 | -42.1 | 176.9 | 179.5 | -109.9 | 0 | 0 | 0 | 112.9 | V55 L56 L57 L62 L63 | V55-F59 WeakPolarHBondContact O-CB 3.3Å; V55-F59 PolarHBondContact O-N 2.83Å; L56-F59 PolarHBondContact O-N 3.18Å; L57-F59 PolarHBondContact O-N 3.29Å; F59-L62 WeakPolarHBondContact O-CB 3.39Å; F59-L62 PolarHBondContact O-N 3.11Å; F59-L63 HydrophobicContact CD1-CD1 4.28Å; F59-L63 HydrophobicContact CE1-CD1 3.75Å; F59-L63 HydrophobicContact CE1-CG 4.3Å; F59-L63 HydrophobicContact CE2-CD2 4.41Å; F59-L63 HydrophobicContact CE2-CG 4.46Å; F59-L63 HydrophobicContact CZ-CD1 3.99Å; F59-L63 HydrophobicContact CZ-CD2 4.17Å; F59-L63 HydrophobicContact CZ-CG 4.18Å; F59-L63 WeakPolarHBondContact O-CG 3.36Å; F59-L63 PolarHBondContact O-N 2.91Å |
| 60 | L | 97 | Very high | 94.3 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -64.1 | -40.9 | 175.7 | -70.1 | 174.1 | 0 | 0 | 0 | 111.9 | L56 L57 L62 L63 Q64 L123 V178 W181 V256 | L56-L60 HydrophobicContact CD1-CD1 4.17Å; L56-L60 HydrophobicContact CD1-CG 4.12Å; L56-L60 HydrophobicContact CG-CD1 4.05Å; L56-L60 HydrophobicContact CG-CG 4.42Å; L56-L60 VanDerWaalsContact O-CG 3.29Å; L56-L60 WeakPolarHBondContact O-CG 3.24Å; L56-L60 PolarHBondContact O-N 3.23Å; L57-L60 PolarHBondContact O-N 2.79Å; L57-L60 VanDerWaalsContact O-N 3.15Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L60-L63 PolarHBondContact O-N 3.34Å; L60-Q64 WeakPolarHBondContact O-CG 3.12Å; L60-Q64 PolarHBondContact O-N 3.47Å; L60-L123 HydrophobicContact CD1-CD2 4.3Å; L60-V178 HydrophobicContact CB-CG1 3.96Å; L60-V178 HydrophobicContact CB-CG2 4.09Å; L60-V178 HydrophobicContact CD1-CG1 4.4Å; L60-V178 HydrophobicContact CD1-CG2 4.27Å; L60-W181 HydrophobicContact CD1-CE3 3.89Å; L60-W181 HydrophobicContact CD1-CZ3 3.74Å; L60-V256 HydrophobicContact CD2-CG2 4.24Å |
| 61 | Y | 97.3 | Very high | 94.5 | Very high | 2 Ų | 2 | 27.7 Ų | 27.7 | 1% | 0.008 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -65.2 | -37.3 | 173.3 | -73.9 | -57.4 | 0 | 0 | 0 | 112.1 | L57 V58 Q64 G65 V178 D179 C197 N198 Q202 | L57-Y61 HydrophobicContact CB-CD2 4.32Å; L57-Y61 HydrophobicContact CB-CE2 4.26Å; L57-Y61 HydrophobicContact CD2-CE2 4.46Å; L57-Y61 WeakPolarHBondContact O-CB 3.37Å; L57-Y61 WeakPolarHBondContact O-CD2 3.47Å; L57-Y61 PolarHBondContact O-N 3.4Å; V58-Y61 PolarHBondContact O-N 2.97Å; Y61-Q64 WeakPolarHBondContact O-CB 3.25Å; Y61-Q64 PolarHBondContact O-N 3.34Å; Y61-G65 PolarHBondContact O-N 3.29Å; Y61-V178 HydrophobicContact CD1-CG1 4.02Å; Y61-V178 HydrophobicContact CD2-CG1 4.27Å; Y61-V178 HydrophobicContact CE1-CB 4.14Å; Y61-V178 HydrophobicContact CE1-CG1 3.62Å; Y61-V178 HydrophobicContact CE2-CG1 3.95Å; Y61-V178 HydrophobicContact CG-CG1 4.3Å; Y61-D179 VanDerWaalsContact CE1-OD1 3.24Å; Y61-D179 WeakPolarHBondContact CE1-OD1 3.45Å; Y61-D179 WeakPolarHBondContact OH-CA 3.48Å; Y61-D179 PolarHBondContact OH-OD1 3.49Å; Y61-C197 VanDerWaalsContact CD2-C 3.45Å; Y61-C197 HydrophobicContact CD2-CB 3.98Å; Y61-C197 WeakPolarHBondContact CD2-O 3.34Å; Y61-C197 HydrophobicContact CE2-CB 3.98Å; Y61-N198 HydrophobicContact CD1-CB 4.03Å; Y61-N198 VanDerWaalsContact CD1-ND2 3.27Å; Y61-N198 WeakPolarHBondContact CD1-ND2 3.46Å; Y61-N198 VanDerWaalsContact CD2-CA 3.47Å; Y61-N198 HydrophobicContact CD2-CB 4.23Å; Y61-N198 HydrophobicContact CE1-CB 3.77Å; Y61-N198 WeakPolarHBondContact CE1-ND2 3.37Å; Y61-N198 HydrophobicContact CE2-CB 3.92Å; Y61-N198 HydrophobicContact CG-CB 4.3Å; Y61-Q202 WeakPolarHBondContact O-CA 3.42Å |
| 62 | L | 97 | Very high | 94.5 | Very high | 34 Ų | 34 | 24.1 Ų | 24.1 | 18% | 0.178 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -59.6 | -46.6 | 171.9 | -178.2 | 158.7 | 0 | 0 | 0 | 111.4 | V58 F59 L60 Q64 G65 I66 G201 A204 G205 L208 W245 | V58-L62 WeakPolarHBondContact O-CB 3.4Å; V58-L62 PolarHBondContact O-N 3.49Å; F59-L62 WeakPolarHBondContact O-CB 3.39Å; F59-L62 PolarHBondContact O-N 3.11Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L62-Q64 VanDerWaalsContact C-N 3.26Å; L62-Q64 PolarHBondContact O-N 3.39Å; L62-G65 PolarHBondContact O-N 3.32Å; L62-G65 VanDerWaalsContact O-N 3.09Å; L62-I66 HydrophobicContact CD2-CG1 4.4Å; L62-I66 PolarHBondContact O-N 3.06Å; L62-G201 WeakPolarHBondContact CA-O 3.49Å; L62-A204 HydrophobicContact CD1-CB 4.3Å; L62-G205 VanDerWaalsContact O-CA 3.28Å; L62-G205 WeakPolarHBondContact O-CA 3.14Å; L62-L208 HydrophobicContact CD1-CD1 4.12Å; L62-L208 HydrophobicContact CD2-CD1 4.08Å; L62-L208 HydrophobicContact CG-CD1 4.26Å; L62-W245 HydrophobicContact CD2-CH2 4.2Å; L62-W245 HydrophobicContact CD2-CZ3 4.4Å |
| 63 | L | 96.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -58.6 | -39 | 177.1 | -68.5 | 177.9 | 0 | 0 | 0 | 111.8 | F59 L60 G65 I66 P67 W245 V248 F249 S252 | F59-L63 HydrophobicContact CD1-CD1 4.28Å; F59-L63 HydrophobicContact CE1-CD1 3.75Å; F59-L63 HydrophobicContact CE1-CG 4.3Å; F59-L63 HydrophobicContact CE2-CD2 4.41Å; F59-L63 HydrophobicContact CE2-CG 4.46Å; F59-L63 HydrophobicContact CZ-CD1 3.99Å; F59-L63 HydrophobicContact CZ-CD2 4.17Å; F59-L63 HydrophobicContact CZ-CG 4.18Å; F59-L63 WeakPolarHBondContact O-CG 3.36Å; F59-L63 PolarHBondContact O-N 2.91Å; L60-L63 PolarHBondContact O-N 3.34Å; L63-G65 VanDerWaalsContact C-N 3.34Å; L63-G65 PolarHBondContact O-N 2.9Å; L63-I66 WeakPolarHBondContact O-CB 3.43Å; L63-I66 PolarHBondContact O-N 3.17Å; L63-P67 WeakPolarHBondContact O-CD 3.41Å; L63-W245 HydrophobicContact CD2-CE3 4.36Å; L63-W245 HydrophobicContact CD2-CZ3 4Å; L63-V248 HydrophobicContact CD2-CG1 3.94Å; L63-F249 HydrophobicContact CB-CE1 4.26Å; L63-F249 HydrophobicContact CB-CE2 4.22Å; L63-F249 HydrophobicContact CB-CZ 3.83Å; L63-F249 HydrophobicContact CD2-CD2 4.27Å; L63-F249 HydrophobicContact CD2-CE2 4.04Å; L63-F249 HydrophobicContact CD2-CZ 4.49Å; L63-F249 WeakPolarHBondContact O-CZ 3.46Å; L63-S252 WeakPolarHBondContact CD1-OG 3.38Å |
| 64 | Q | 94.3 | Very high | 94.1 | Very high | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -67.5 | -32.9 | 176.4 | -67.5 | 160.9 | -6.2 | 0 | 0 | 113.5 | L60 Y61 L62 I66 P67 Q174 D175 V178 | L60-Q64 WeakPolarHBondContact O-CG 3.12Å; L60-Q64 PolarHBondContact O-N 3.47Å; Y61-Q64 WeakPolarHBondContact O-CB 3.25Å; Y61-Q64 PolarHBondContact O-N 3.34Å; L62-Q64 VanDerWaalsContact C-N 3.26Å; L62-Q64 PolarHBondContact O-N 3.39Å; Q64-I66 PolarHBondContact O-N 3.22Å; Q64-P67 WeakPolarHBondContact O-CD 3.06Å; Q64-Q174 HydrophobicContact CG-CB 4.4Å; Q64-Q174 HydrophobicContact CG-CG 4.21Å; Q64-Q174 VanDerWaalsContact NE2-C 3.31Å; Q64-Q174 PolarHBondContact NE2-O 3.36Å; Q64-D175 VanDerWaalsContact NE2-CA 3.28Å; Q64-D175 PolarHBondContact OE1-OD1 3.3Å; Q64-V178 VanDerWaalsContact NE2-CB 3.32Å |
| 65 | G | 95.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -64.1 | -28.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y61 L62 L63 L68 G69 G205 Y206 | Y61-G65 PolarHBondContact O-N 3.29Å; L62-G65 PolarHBondContact O-N 3.32Å; L62-G65 VanDerWaalsContact O-N 3.09Å; L63-G65 VanDerWaalsContact C-N 3.34Å; L63-G65 PolarHBondContact O-N 2.9Å; G65-L68 WeakPolarHBondContact O-CB 3.45Å; G65-L68 PolarHBondContact O-N 2.87Å; G65-G69 PolarHBondContact O-N 3.11Å; G65-G205 CarbonylContact C-O 3.6Å; G65-G205 CarbonylContact O-C 3.59Å; G65-Y206 VanDerWaalsContact O-CA 3.28Å; G65-Y206 WeakPolarHBondContact O-CA 3.4Å; G65-Y206 PolarHBondContact O-N 3.21Å |
| 66 | I | 95.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -62.9 | -54.1 | -179.4 | -59.8 | -66.5 | 0 | 0 | 0 | 112.3 | L62 L63 Q64 L68 G69 L70 M134 G205 L208 W245 | L62-I66 HydrophobicContact CD2-CG1 4.4Å; L62-I66 PolarHBondContact O-N 3.06Å; L63-I66 WeakPolarHBondContact O-CB 3.43Å; L63-I66 PolarHBondContact O-N 3.17Å; Q64-I66 PolarHBondContact O-N 3.22Å; I66-L68 VanDerWaalsContact C-N 3.28Å; I66-L68 PolarHBondContact O-N 3.08Å; I66-G69 PolarHBondContact O-N 2.96Å; I66-L70 HydrophobicContact CG2-CD1 3.69Å; I66-L70 HydrophobicContact CG2-CG 4.3Å; I66-L70 WeakPolarHBondContact O-CB 3.38Å; I66-L70 WeakPolarHBondContact O-CG 3.39Å; I66-L70 PolarHBondContact O-N 3.45Å; I66-M134 HydrophobicContact CG2-CE 3.89Å; I66-G205 WeakPolarHBondContact CD1-O 3.12Å; I66-L208 HydrophobicContact CD1-CB 3.42Å; I66-L208 VanDerWaalsContact CD1-CB 3.42Å; I66-L208 HydrophobicContact CD1-CD1 4.21Å; I66-L208 HydrophobicContact CD1-CG 4.48Å; I66-W245 HydrophobicContact CB-CD2 4.47Å; I66-W245 HydrophobicContact CD1-CD2 4.13Å; I66-W245 HydrophobicContact CD1-CE3 4.29Å; I66-W245 HydrophobicContact CD1-CH2 3.45Å; I66-W245 VanDerWaalsContact CD1-CH2 3.45Å; I66-W245 HydrophobicContact CD1-CZ2 3.24Å; I66-W245 HydrophobicContact CD1-CZ3 3.98Å; I66-W245 HydrophobicContact CG1-CD2 4.06Å; I66-W245 HydrophobicContact CG1-CE3 3.9Å; I66-W245 HydrophobicContact CG1-CH2 3.78Å; I66-W245 HydrophobicContact CG1-CZ2 3.94Å; I66-W245 HydrophobicContact CG1-CZ3 3.76Å; I66-W245 HydrophobicContact CG2-CB 4.29Å; I66-W245 HydrophobicContact CG2-CD2 3.71Å; I66-W245 HydrophobicContact CG2-CE3 4.21Å; I66-W245 HydrophobicContact CG2-CG 3.72Å |
| 67 | P | 94.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -51.7 | -43.3 | 171.5 | -29.4 | 32.9 | 0 | 0 | 0 | 114.3 | L63 Q64 T71 I130 M134 F167 A171 F249 | L63-P67 WeakPolarHBondContact O-CD 3.41Å; Q64-P67 WeakPolarHBondContact O-CD 3.06Å; P67-T71 WeakPolarHBondContact O-CB 3.36Å; P67-T71 PolarHBondContact O-N 2.95Å; P67-T71 PolarHBondContact O-OG1 2.85Å; P67-I130 HydrophobicContact CG-CG2 4.01Å; P67-M134 HydrophobicContact CG-CE 3.87Å; P67-F167 HydrophobicContact CB-CD1 4.24Å; P67-F167 HydrophobicContact CB-CE1 3.57Å; P67-F167 HydrophobicContact CB-CE2 4.26Å; P67-F167 HydrophobicContact CB-CZ 3.58Å; P67-F167 HydrophobicContact CG-CE1 4.35Å; P67-F167 HydrophobicContact CG-CE2 4.34Å; P67-F167 HydrophobicContact CG-CZ 3.86Å; P67-A171 HydrophobicContact CB-CB 3.82Å; P67-A171 HydrophobicContact CG-CB 4.07Å; P67-F249 HydrophobicContact CG-CZ 4.19Å |
| 68 | L | 94 | Very high | 91.4 | Very high | 18 Ų | 18 | 13.3 Ų | 13.3 | 9% | 0.094 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -62.9 | -49.2 | 178.6 | -78 | 165.3 | 0 | 0 | 0 | 111.1 | G65 I66 T71 A72 F98 Q202 Y206 | G65-L68 WeakPolarHBondContact O-CB 3.45Å; G65-L68 PolarHBondContact O-N 2.87Å; I66-L68 VanDerWaalsContact C-N 3.28Å; I66-L68 PolarHBondContact O-N 3.08Å; L68-T71 PolarHBondContact O-N 2.86Å; L68-A72 WeakPolarHBondContact O-CB 3.36Å; L68-A72 PolarHBondContact O-N 3.19Å; L68-F98 HydrophobicContact CD1-CD1 4.28Å; L68-F98 HydrophobicContact CD1-CE1 3.7Å; L68-F98 HydrophobicContact CD1-CE2 4.21Å; L68-F98 HydrophobicContact CD1-CZ 3.64Å; L68-F98 HydrophobicContact CD2-CD1 4.22Å; L68-F98 HydrophobicContact CD2-CD2 3.45Å; L68-F98 VanDerWaalsContact CD2-CD2 3.45Å; L68-F98 HydrophobicContact CD2-CE1 4.13Å; L68-F98 HydrophobicContact CD2-CE2 3.33Å; L68-F98 HydrophobicContact CD2-CG 3.9Å; L68-F98 HydrophobicContact CD2-CZ 3.69Å; L68-F98 HydrophobicContact CG-CD2 4.27Å; L68-F98 HydrophobicContact CG-CE1 4.1Å; L68-F98 HydrophobicContact CG-CE2 3.67Å; L68-F98 HydrophobicContact CG-CZ 3.56Å; L68-Q202 HydrophobicContact CD1-CG 3.78Å; L68-Y206 HydrophobicContact CB-CD2 4.14Å |
| 69 | G | 93.5 | Very high | 90.3 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -62.4 | -44.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | G65 I66 T71 A72 S73 Y206 G209 N210 | G65-G69 PolarHBondContact O-N 3.11Å; I66-G69 PolarHBondContact O-N 2.96Å; G69-T71 VanDerWaalsContact C-N 3.33Å; G69-T71 PolarHBondContact O-N 3.09Å; G69-A72 PolarHBondContact O-N 2.98Å; G69-S73 PolarHBondContact O-N 3.11Å; G69-Y206 WeakPolarHBondContact CA-O 3.48Å; G69-G209 CarbonylContact C-O 3.55Å; G69-G209 VanDerWaalsContact C-O 3.26Å; G69-N210 WeakPolarHBondContact O-CB 3.38Å |
| 70 | L | 93 | Very high | 89 | Confident | 2 Ų | 2 | 14.3 Ų | 14.3 | 1% | 0.01 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -64.5 | -37.1 | 176.7 | -74.4 | 170.2 | 0 | 0 | 0 | 112.2 | I66 A72 S73 I74 M134 G209 F213 L238 Y241 L242 | I66-L70 HydrophobicContact CG2-CD1 3.69Å; I66-L70 HydrophobicContact CG2-CG 4.3Å; I66-L70 WeakPolarHBondContact O-CB 3.38Å; I66-L70 WeakPolarHBondContact O-CG 3.39Å; I66-L70 PolarHBondContact O-N 3.45Å; L70-A72 VanDerWaalsContact C-N 3.35Å; L70-S73 PolarHBondContact O-N 3.05Å; L70-S73 PolarHBondContact O-OG 2.93Å; L70-I74 WeakPolarHBondContact O-CG1 3.33Å; L70-M134 HydrophobicContact CD1-CE 4.26Å; L70-G209 WeakPolarHBondContact CA-O 3.49Å; L70-G209 WeakPolarHBondContact CD2-O 3.42Å; L70-G209 PolarHBondContact N-O 3.22Å; L70-F213 HydrophobicContact CD2-CB 4.47Å; L70-F213 HydrophobicContact CD2-CD1 4.25Å; L70-F213 HydrophobicContact CD2-CD2 4.41Å; L70-F213 HydrophobicContact CD2-CG 4.07Å; L70-L238 HydrophobicContact CD2-CD1 4.3Å; L70-Y241 HydrophobicContact CD2-CD1 3.79Å; L70-Y241 HydrophobicContact CD2-CE1 3.9Å; L70-L242 HydrophobicContact CD1-CD2 3.89Å |
| 71 | T | 92.8 | Very high | 87.8 | Confident | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -64.9 | -43.2 | 173.6 | -54.8 | 0 | 0 | 0 | 0 | 110.3 | P67 L68 G69 S73 I74 P75 F91 A94 H95 F164 N168 | P67-T71 WeakPolarHBondContact O-CB 3.36Å; P67-T71 PolarHBondContact O-N 2.95Å; P67-T71 PolarHBondContact O-OG1 2.85Å; L68-T71 PolarHBondContact O-N 2.86Å; G69-T71 VanDerWaalsContact C-N 3.33Å; G69-T71 PolarHBondContact O-N 3.09Å; T71-S73 VanDerWaalsContact C-N 3.27Å; T71-S73 PolarHBondContact O-N 3.34Å; T71-I74 PolarHBondContact O-N 3.36Å; T71-P75 WeakPolarHBondContact O-CD 3.32Å; T71-F91 HydrophobicContact CG2-CE1 3.86Å; T71-F91 HydrophobicContact CG2-CZ 3.9Å; T71-F91 WeakPolarHBondContact O-CE1 3.38Å; T71-A94 HydrophobicContact CG2-CB 3.97Å; T71-H95 WeakPolarHBondContact CG2-NE2 3.48Å; T71-F164 HydrophobicContact CG2-CB 4.3Å; T71-F164 HydrophobicContact CG2-CD1 3.82Å; T71-F164 HydrophobicContact CG2-CG 4.41Å; T71-F164 WeakPolarHBondContact OG1-CD1 3.42Å; T71-N168 VanDerWaalsContact CG2-ND2 3.29Å; T71-N168 WeakPolarHBondContact CG2-ND2 3.29Å; T71-N168 PolarHBondContact OG1-ND2 3.47Å |
| 72 | A | 89.6 | Confident | 86.4 | Confident | 17 Ų | 17 | 25.4 Ų | 25.4 | 14% | 0.14 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -69.2 | -21.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | L68 G69 L70 Y206 N210 | L68-A72 WeakPolarHBondContact O-CB 3.36Å; L68-A72 PolarHBondContact O-N 3.19Å; G69-A72 PolarHBondContact O-N 2.98Å; L70-A72 VanDerWaalsContact C-N 3.35Å; A72-Y206 HydrophobicContact CB-CE2 3.58Å; A72-Y206 WeakPolarHBondContact CB-OH 3.45Å; A72-N210 WeakPolarHBondContact CB-ND2 3.28Å |
| 73 | S | 87.1 | Confident | 85.3 | Confident | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -79 | -24.4 | 174.8 | 70.3 | 0 | 0 | 0 | 0 | 113.2 | G69 L70 T71 L76 V77 F213 | G69-S73 PolarHBondContact O-N 3.11Å; L70-S73 PolarHBondContact O-N 3.05Å; L70-S73 PolarHBondContact O-OG 2.93Å; T71-S73 VanDerWaalsContact C-N 3.27Å; T71-S73 PolarHBondContact O-N 3.34Å; S73-L76 WeakPolarHBondContact O-CB 3.44Å; S73-L76 PolarHBondContact O-N 3.36Å; S73-V77 WeakPolarHBondContact O-CG2 3.35Å; S73-V77 PolarHBondContact O-N 3.41Å; S73-F213 WeakPolarHBondContact OG-CD1 3.18Å; S73-F213 WeakPolarHBondContact OG-CE1 3.27Å |
| 74 | I | 87.5 | Confident | 84.5 | Confident | 1 Ų | 1 | 28.1 Ų | 28.1 | 1% | 0.005 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -56 | -48 | -177 | -62.6 | -54.3 | 0 | 0 | 0 | 113.6 | L70 T71 L76 V77 L78 F91 L160 F164 L238 | L70-I74 WeakPolarHBondContact O-CG1 3.33Å; T71-I74 PolarHBondContact O-N 3.36Å; I74-L76 PolarHBondContact O-N 2.88Å; I74-V77 PolarHBondContact O-N 2.83Å; I74-L78 HydrophobicContact CG2-CD1 3.73Å; I74-L78 HydrophobicContact CG2-CG 4.1Å; I74-L78 WeakPolarHBondContact O-CB 3.42Å; I74-L78 VanDerWaalsContact O-CG 3.32Å; I74-L78 WeakPolarHBondContact O-CG 3.49Å; I74-L78 PolarHBondContact O-N 3.48Å; I74-F91 HydrophobicContact CB-CE1 3.89Å; I74-F91 HydrophobicContact CB-CZ 3.72Å; I74-F91 HydrophobicContact CG1-CZ 4.07Å; I74-F91 HydrophobicContact CG2-CE1 4.1Å; I74-F91 HydrophobicContact CG2-CE2 4.01Å; I74-F91 HydrophobicContact CG2-CZ 3.7Å; I74-L160 HydrophobicContact CG2-CD2 3.63Å; I74-L160 HydrophobicContact CG2-CG 4.47Å; I74-F164 HydrophobicContact CD1-CE1 4.25Å; I74-F164 HydrophobicContact CD1-CE2 4.17Å; I74-F164 HydrophobicContact CD1-CZ 3.6Å; I74-F164 HydrophobicContact CG1-CD1 4.43Å; I74-F164 HydrophobicContact CG1-CE1 3.72Å; I74-F164 HydrophobicContact CG1-CE2 3.93Å; I74-F164 HydrophobicContact CG1-CZ 3.44Å; I74-F164 VanDerWaalsContact CG1-CZ 3.44Å; I74-L238 HydrophobicContact CD1-CD2 4.11Å |
| 75 | P | 83.5 | Confident | 83.7 | Confident | 23 Ų | 23 | 32.9 Ų | 32.9 | 15% | 0.149 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.5 | -35.8 | 176.3 | -26.3 | 36.7 | 0 | 0 | 0 | 113.3 | T71 L78 Q79 F91 | T71-P75 WeakPolarHBondContact O-CD 3.32Å; P75-L78 PolarHBondContact O-N 3.49Å; P75-Q79 PolarHBondContact O-N 3.36Å; P75-F91 HydrophobicContact CG-CD1 3.62Å; P75-F91 HydrophobicContact CG-CE1 3.97Å |
| 76 | L | 80.3 | Confident | 83.1 | Confident | 46 Ų | 46 | 41.4 Ų | 41.4 | 24% | 0.241 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -70.5 | -40.5 | 179 | -63.8 | 172.9 | 0 | 0 | 0 | 111.4 | S73 I74 Q79 L214 I316 K322 | S73-L76 WeakPolarHBondContact O-CB 3.44Å; S73-L76 PolarHBondContact O-N 3.36Å; I74-L76 PolarHBondContact O-N 2.88Å; L76-Q79 PolarHBondContact O-N 3.33Å; L76-L214 HydrophobicContact CB-CD1 4.31Å; L76-L214 HydrophobicContact CB-CD2 4.47Å; L76-L214 HydrophobicContact CD1-CD1 3.57Å; L76-I316 HydrophobicContact CD2-CD1 3.99Å; L76-K322 PolarHBondContact O-NZ 2.98Å |
| 77 | V | 79.9 | Confident | 82.5 | Confident | 10 Ų | 10 | 44.7 Ų | 44.7 | 6% | 0.061 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.5 | -43.9 | 172.9 | 175.6 | 0 | 0 | 0 | 0 | 110.5 | S73 I74 Q79 L145 F213 L214 | S73-V77 WeakPolarHBondContact O-CG2 3.35Å; S73-V77 PolarHBondContact O-N 3.41Å; I74-V77 PolarHBondContact O-N 2.83Å; V77-Q79 VanDerWaalsContact C-N 3.31Å; V77-Q79 PolarHBondContact O-N 2.87Å; V77-L145 HydrophobicContact CG1-CD1 4.35Å; V77-F213 HydrophobicContact CG2-CE1 4.15Å; V77-L214 HydrophobicContact CG2-CD2 3.87Å |
| 78 | L | 78.3 | Confident | 81.9 | Confident | 3 Ų | 3 | 45.4 Ų | 45.4 | 2% | 0.016 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -71.4 | -18.5 | -179.1 | -74.8 | -179.2 | 0 | 0 | 0 | 114.8 | I74 P75 N80 R81 V83 L145 P155 L160 | I74-L78 HydrophobicContact CG2-CD1 3.73Å; I74-L78 HydrophobicContact CG2-CG 4.1Å; I74-L78 WeakPolarHBondContact O-CB 3.42Å; I74-L78 VanDerWaalsContact O-CG 3.32Å; I74-L78 WeakPolarHBondContact O-CG 3.49Å; I74-L78 PolarHBondContact O-N 3.48Å; P75-L78 PolarHBondContact O-N 3.49Å; L78-N80 PolarHBondContact O-N 2.92Å; L78-R81 WeakPolarHBondContact O-CB 3.47Å; L78-R81 PolarHBondContact O-N 3.24Å; L78-V83 HydrophobicContact CB-CB 4.49Å; L78-V83 HydrophobicContact CB-CG2 4.01Å; L78-V83 WeakPolarHBondContact O-CG2 3.05Å; L78-L145 HydrophobicContact CD2-CD2 3.55Å; L78-L145 HydrophobicContact CG-CD2 4.19Å; L78-P155 HydrophobicContact CD2-CB 4.36Å; L78-P155 HydrophobicContact CD2-CG 4.15Å; L78-L160 HydrophobicContact CD1-CD2 3.63Å |
| 79 | Q | 72.4 | Confident | 81.5 | Confident | 33 Ų | 33 | 47.1 Ų | 47.1 | 15% | 0.154 | 24% | 0.237 | C | C | . | . | G | 310 helix | trans | -61.8 | -29.9 | -173.5 | -170.1 | 177.8 | 21.5 | 0 | 0 | 113.8 | P75 L76 V77 R81 | P75-Q79 PolarHBondContact O-N 3.36Å; L76-Q79 PolarHBondContact O-N 3.33Å; V77-Q79 VanDerWaalsContact C-N 3.31Å; V77-Q79 PolarHBondContact O-N 2.87Å; Q79-R81 PolarHBondContact O-N 2.98Å |
| 80 | N | 68.6 | Low | 81.2 | Confident | 112 Ų | 112 | 48.9 Ų | 48.9 | 60% | 0.599 | 25% | 0.252 | S | S | * | . | G | 310 helix | trans | -72.7 | -8.4 | 176.5 | -70.2 | -10.4 | 0 | 0 | 0 | 112.9 | L78 K322 | L78-N80 PolarHBondContact O-N 2.92Å; N80-K322 PolarHBondContact ND2-NZ 2.88Å; N80-K322 VanDerWaalsContact OD1-CE 3.25Å; N80-K322 WeakPolarHBondContact OD1-CE 3.31Å; N80-K322 PolarHBondContact OD1-NZ 3.44Å |
| 81 | R | 72.3 | Confident | 81 | Confident | 51 Ų | 51 | 48.9 Ų | 48.9 | 19% | 0.192 | 25% | 0.252 | C | S | . | . | G | 310 helix | trans | -104.1 | 31 | -173.6 | -55.1 | 178.5 | -176.8 | -130.6 | -6.2 | 112.2 | L78 Q79 V83 L145 G146 E148 | L78-R81 WeakPolarHBondContact O-CB 3.47Å; L78-R81 PolarHBondContact O-N 3.24Å; Q79-R81 PolarHBondContact O-N 2.98Å; R81-V83 HydrophobicContact CB-CG2 4.4Å; R81-V83 PolarHBondContact O-N 3.28Å; R81-V83 VanDerWaalsContact O-N 3.09Å; R81-L145 PolarHBondContact NH1-O 3Å; R81-G146 VanDerWaalsContact NH1-C 3.35Å; R81-G146 PolarHBondContact NH1-O 3.42Å; R81-E148 IonicContact NH2-OE1 3.87Å; R81-E148 PolarHBondContact NH2-OE1 2.77Å |
| 82 | H | 67.4 | Low | 80.8 | Confident | 184 Ų | 184 | 51.9 Ų | 51.9 | 85% | 0.852 | 27% | 0.273 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 29 | 179.6 | -58.3 | -70.9 | 0 | 0 | 0 | 114.9 | T84 | H82-T84 PolarHBondContact O-N 3.36Š|
| 83 | V | 73.5 | Confident | 81 | Confident | 16 Ų | 16 | 55.4 Ų | 55.4 | 10% | 0.097 | 29% | 0.285 | C | S | . | . | trans | -73.4 | 120.2 | 179.2 | -179.4 | 0 | 0 | 0 | 0 | 110.5 | L78 R81 Q87 Q88 P155 | L78-V83 HydrophobicContact CB-CB 4.49Å; L78-V83 HydrophobicContact CB-CG2 4.01Å; L78-V83 WeakPolarHBondContact O-CG2 3.05Å; R81-V83 HydrophobicContact CB-CG2 4.4Å; R81-V83 PolarHBondContact O-N 3.28Å; R81-V83 VanDerWaalsContact O-N 3.09Å; V83-Q87 HydrophobicContact CG1-CB 3.46Å; V83-Q87 VanDerWaalsContact CG1-CB 3.46Å; V83-Q87 HydrophobicContact CG1-CG 4.43Å; V83-Q88 HydrophobicContact CG1-CG 4.01Å; V83-Q88 PolarHBondContact O-NE2 2.83Å; V83-P155 HydrophobicContact CG2-CG 4.2Å | ||
| 84 | T | 80.1 | Confident | 81.3 | Confident | 74 Ų | 74 | 55.4 Ų | 55.4 | 45% | 0.454 | 29% | 0.285 | S | S | . | . | trans | -65.5 | 155 | -177 | 63 | 0 | 0 | 0 | 0 | 112.8 | H82 K86 Q87 Q88 | H82-T84 PolarHBondContact O-N 3.36Å; T84-K86 PolarHBondContact O-N 3.47Å; T84-Q87 WeakPolarHBondContact O-CA 3.46Å; T84-Q87 VanDerWaalsContact O-CB 3.3Å; T84-Q87 WeakPolarHBondContact O-CB 3.29Å; T84-Q87 PolarHBondContact O-N 3.03Å; T84-Q87 WeakPolarHBondContact OG1-CB 3.49Å; T84-Q87 WeakPolarHBondContact OG1-CG 3.38Å; T84-Q87 PolarHBondContact OG1-N 3.15Å; T84-Q87 PolarHBondContact OG1-OE1 3.49Å; T84-Q88 PolarHBondContact O-N 2.96Å | ||
| 85 | Y | 78.7 | Confident | 81.5 | Confident | 100 Ų | 100 | 58 Ų | 58 | 39% | 0.392 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -54.5 | -36.6 | 172.6 | -73.4 | -66.7 | 0 | 0 | 0 | 113.3 | Q87 Q88 A89 L313 E317 | Y85-Q87 VanDerWaalsContact C-N 3.3Å; Y85-Q87 PolarHBondContact O-N 3.25Å; Y85-Q88 PolarHBondContact O-N 2.86Å; Y85-A89 WeakPolarHBondContact O-CB 3.37Å; Y85-A89 PolarHBondContact O-N 3.16Å; Y85-L313 HydrophobicContact CD1-CB 4.49Å; Y85-L313 HydrophobicContact CD1-CD1 3.73Å; Y85-L313 HydrophobicContact CE1-CB 3.54Å; Y85-L313 HydrophobicContact CE1-CD1 3.6Å; Y85-L313 HydrophobicContact CE1-CG 4.2Å; Y85-E317 PolarHBondContact OH-OE2 3.42Å |
| 86 | K | 83 | Confident | 82 | Confident | 180 Ų | 180 | 63.1 Ų | 63.1 | 78% | 0.783 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -61.3 | -41.3 | 175.8 | -177.4 | 179.4 | 177.7 | -178.1 | 0 | 111.6 | T84 A90 | T84-K86 PolarHBondContact O-N 3.47Å; K86-A90 PolarHBondContact O-N 3.41Å |
| 87 | Q | 82.8 | Confident | 82.8 | Confident | 68 Ų | 68 | 61 Ų | 61 | 32% | 0.318 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -67.8 | -43.2 | 176.6 | -84.2 | 170.9 | -41.7 | 0 | 0 | 111.5 | V83 T84 Y85 A89 A90 F91 L157 | V83-Q87 HydrophobicContact CG1-CB 3.46Å; V83-Q87 VanDerWaalsContact CG1-CB 3.46Å; V83-Q87 HydrophobicContact CG1-CG 4.43Å; T84-Q87 WeakPolarHBondContact O-CA 3.46Å; T84-Q87 VanDerWaalsContact O-CB 3.3Å; T84-Q87 WeakPolarHBondContact O-CB 3.29Å; T84-Q87 PolarHBondContact O-N 3.03Å; T84-Q87 WeakPolarHBondContact OG1-CB 3.49Å; T84-Q87 WeakPolarHBondContact OG1-CG 3.38Å; T84-Q87 PolarHBondContact OG1-N 3.15Å; T84-Q87 PolarHBondContact OG1-OE1 3.49Å; Y85-Q87 VanDerWaalsContact C-N 3.3Å; Y85-Q87 PolarHBondContact O-N 3.25Å; Q87-A89 VanDerWaalsContact C-N 3.34Å; Q87-A89 PolarHBondContact O-N 3.37Å; Q87-A90 WeakPolarHBondContact O-CB 3.38Å; Q87-A90 PolarHBondContact O-N 3.12Å; Q87-A90 VanDerWaalsContact O-N 3.13Å; Q87-F91 PolarHBondContact O-N 3.24Å; Q87-L157 VanDerWaalsContact CA-CD2 3.45Å; Q87-L157 HydrophobicContact CB-CD2 3.54Å; Q87-L157 HydrophobicContact CG-CD2 3.69Å; Q87-L157 WeakPolarHBondContact O-CD2 3.49Å |
| 88 | Q | 81.7 | Confident | 83.5 | Confident | 16 Ų | 16 | 62 Ų | 62 | 8% | 0.075 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 176 | -63.6 | -178.1 | 44.9 | 0 | 0 | 112.1 | V83 T84 Y85 A90 F91 S92 | V83-Q88 HydrophobicContact CG1-CG 4.01Å; V83-Q88 PolarHBondContact O-NE2 2.83Å; T84-Q88 PolarHBondContact O-N 2.96Å; Y85-Q88 PolarHBondContact O-N 2.86Å; Q88-A90 VanDerWaalsContact C-N 3.3Å; Q88-A90 PolarHBondContact O-N 2.95Å; Q88-F91 WeakPolarHBondContact O-CB 3.34Å; Q88-F91 PolarHBondContact O-N 3.01Å; Q88-S92 PolarHBondContact O-N 2.75Å; Q88-S92 VanDerWaalsContact O-N 3.1Å; Q88-S92 PolarHBondContact O-OG 3.45Å |
| 89 | A | 84.6 | Confident | 84.2 | Confident | 53 Ų | 53 | 66.6 Ų | 66.6 | 44% | 0.438 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.6 | -37.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y85 Q87 F91 S92 | Y85-A89 WeakPolarHBondContact O-CB 3.37Å; Y85-A89 PolarHBondContact O-N 3.16Å; Q87-A89 VanDerWaalsContact C-N 3.34Å; Q87-A89 PolarHBondContact O-N 3.37Å; A89-F91 VanDerWaalsContact C-N 3.28Å; A89-F91 PolarHBondContact O-N 3.31Å; A89-S92 WeakPolarHBondContact O-CB 3.37Å; A89-S92 PolarHBondContact O-N 2.89Å |
| 90 | A | 87.6 | Confident | 85.2 | Confident | 38 Ų | 38 | 68.3 Ų | 68.3 | 31% | 0.314 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -67.9 | -25.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | K86 Q87 Q88 F93 L157 T161 | K86-A90 PolarHBondContact O-N 3.41Å; Q87-A90 WeakPolarHBondContact O-CB 3.38Å; Q87-A90 PolarHBondContact O-N 3.12Å; Q87-A90 VanDerWaalsContact O-N 3.13Å; Q88-A90 VanDerWaalsContact C-N 3.3Å; Q88-A90 PolarHBondContact O-N 2.95Å; A90-F93 WeakPolarHBondContact O-CD2 3.38Å; A90-L157 HydrophobicContact CB-CD2 3.97Å; A90-T161 WeakPolarHBondContact O-CG2 3.19Å; A90-T161 PolarHBondContact O-OG1 3.44Å |
| 91 | F | 89.7 | Confident | 86.5 | Confident | 2 Ų | 2 | 65.4 Ų | 65.4 | 1% | 0.009 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -75.9 | -28.9 | 171.3 | -174 | -97.6 | 0 | 0 | 0 | 113 | T71 I74 P75 Q87 Q88 A89 F93 A94 L157 L160 T161 F164 | T71-F91 HydrophobicContact CG2-CE1 3.86Å; T71-F91 HydrophobicContact CG2-CZ 3.9Å; T71-F91 WeakPolarHBondContact O-CE1 3.38Å; I74-F91 HydrophobicContact CB-CE1 3.89Å; I74-F91 HydrophobicContact CB-CZ 3.72Å; I74-F91 HydrophobicContact CG1-CZ 4.07Å; I74-F91 HydrophobicContact CG2-CE1 4.1Å; I74-F91 HydrophobicContact CG2-CE2 4.01Å; I74-F91 HydrophobicContact CG2-CZ 3.7Å; P75-F91 HydrophobicContact CG-CD1 3.62Å; P75-F91 HydrophobicContact CG-CE1 3.97Å; Q87-F91 PolarHBondContact O-N 3.24Å; Q88-F91 WeakPolarHBondContact O-CB 3.34Å; Q88-F91 PolarHBondContact O-N 3.01Å; A89-F91 VanDerWaalsContact C-N 3.28Å; A89-F91 PolarHBondContact O-N 3.31Å; F91-F93 PolarHBondContact O-N 3.35Å; F91-A94 HydrophobicContact CE1-CB 4.44Å; F91-A94 HydrophobicContact CE2-CB 4.4Å; F91-A94 HydrophobicContact CZ-CB 4.28Å; F91-A94 WeakPolarHBondContact O-CB 3.44Å; F91-A94 PolarHBondContact O-N 3.06Å; F91-L157 HydrophobicContact CB-CD1 4.16Å; F91-L157 HydrophobicContact CD2-CD1 4.48Å; F91-L160 HydrophobicContact CD2-CD2 4.3Å; F91-L160 HydrophobicContact CD2-CG 4.4Å; F91-L160 HydrophobicContact CE2-CD2 4.09Å; F91-L160 HydrophobicContact CE2-CG 3.94Å; F91-T161 WeakPolarHBondContact CA-OG1 3.43Å; F91-F164 HydrophobicContact CE2-CB 3.85Å; F91-F164 AromaticContact CE2-CD2 3.9Å; F91-F164 HydrophobicContact CE2-CD2 3.9Å; F91-F164 AromaticContact CE2-CG 3.93Å; F91-F164 HydrophobicContact CE2-CG 3.93Å; F91-F164 HydrophobicContact CZ-CB 3.87Å; F91-F164 HydrophobicContact CZ-CD1 4.17Å; F91-F164 HydrophobicContact CZ-CD2 4.03Å; F91-F164 AromaticContact CZ-CG 3.74Å; F91-F164 HydrophobicContact CZ-CG 3.74Å |
| 92 | S | 89.1 | Confident | 87.5 | Confident | 63 Ų | 63 | 67 Ų | 67 | 44% | 0.441 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -56.2 | -24 | 178.1 | -53.8 | 0 | 0 | 0 | 0 | 113.6 | Q88 A89 A94 H95 | Q88-S92 PolarHBondContact O-N 2.75Å; Q88-S92 VanDerWaalsContact O-N 3.1Å; Q88-S92 PolarHBondContact O-OG 3.45Å; A89-S92 WeakPolarHBondContact O-CB 3.37Å; A89-S92 PolarHBondContact O-N 2.89Å; S92-A94 PolarHBondContact O-N 3.02Å; S92-A94 VanDerWaalsContact O-N 3.15Å; S92-H95 PolarHBondContact O-N 3.33Å; S92-H95 VanDerWaalsContact O-N 3.08Å; S92-H95 PolarHBondContact O-ND1 3.35Å |
| 93 | F | 92.5 | Very high | 88.8 | Confident | 91 Ų | 91 | 63.4 Ų | 63.4 | 40% | 0.399 | 33% | 0.329 | S | S | . | . | G | 310 helix | trans | -57.2 | -23.3 | 171.1 | -72.6 | -88.4 | 0 | 0 | 0 | 113.4 | A90 F91 H95 W96 T161 F165 | A90-F93 WeakPolarHBondContact O-CD2 3.38Å; F91-F93 PolarHBondContact O-N 3.35Å; F93-H95 PolarHBondContact O-N 3.22Å; F93-H95 VanDerWaalsContact O-N 3.15Å; F93-W96 AromaticContact CD1-CD2 3.67Å; F93-W96 HydrophobicContact CD1-CD2 3.67Å; F93-W96 AromaticContact CD1-CE2 3.42Å; F93-W96 VanDerWaalsContact CD1-CE2 3.42Å; F93-W96 AromaticContact CD1-CE3 3.94Å; F93-W96 HydrophobicContact CD1-CE3 3.94Å; F93-W96 HydrophobicContact CD1-CG 4.34Å; F93-W96 AromaticContact CD1-CH2 3.84Å; F93-W96 HydrophobicContact CD1-CH2 3.84Å; F93-W96 AromaticContact CD1-CZ2 3.54Å; F93-W96 HydrophobicContact CD1-CZ2 3.54Å; F93-W96 HydrophobicContact CD1-CZ3 4.01Å; F93-W96 AromaticContact CD1-NE1 3.89Å; F93-W96 HydrophobicContact CE1-CD2 4.27Å; F93-W96 AromaticContact CE1-CE2 3.67Å; F93-W96 HydrophobicContact CE1-CE3 4.39Å; F93-W96 AromaticContact CE1-CH2 3.44Å; F93-W96 HydrophobicContact CE1-CH2 3.44Å; F93-W96 VanDerWaalsContact CE1-CH2 3.44Å; F93-W96 AromaticContact CE1-CZ2 3.24Å; F93-W96 HydrophobicContact CE1-CZ2 3.24Å; F93-W96 HydrophobicContact CE1-CZ3 4.01Å; F93-W96 HydrophobicContact CZ-CZ2 4.27Å; F93-W96 VanDerWaalsContact O-CB 3.29Å; F93-W96 WeakPolarHBondContact O-CB 3.36Å; F93-W96 PolarHBondContact O-N 3.37Å; F93-T161 HydrophobicContact CB-CG2 4.22Å; F93-F165 WeakPolarHBondContact O-CD2 3.23Å |
| 94 | A | 93.7 | Very high | 89.9 | Confident | 0 Ų | 0 | 64.5 Ų | 64.5 | 0% | 0 | 33% | 0.331 | C | S | . | . | G | 310 helix | trans | -57.7 | -26.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113 | T71 F91 S92 P97 F164 N168 | T71-A94 HydrophobicContact CG2-CB 3.97Å; F91-A94 HydrophobicContact CE1-CB 4.44Å; F91-A94 HydrophobicContact CE2-CB 4.4Å; F91-A94 HydrophobicContact CZ-CB 4.28Å; F91-A94 WeakPolarHBondContact O-CB 3.44Å; F91-A94 PolarHBondContact O-N 3.06Å; S92-A94 PolarHBondContact O-N 3.02Å; S92-A94 VanDerWaalsContact O-N 3.15Å; A94-P97 VanDerWaalsContact O-CD 3.26Å; A94-P97 WeakPolarHBondContact O-CD 3.01Å; A94-F164 HydrophobicContact CB-CB 3.8Å; A94-N168 WeakPolarHBondContact O-CB 3.23Å; A94-N168 PolarHBondContact O-ND2 2.85Å |
| 95 | H | 92.6 | Very high | 90.6 | Very high | 54 Ų | 54 | 61.7 Ų | 61.7 | 25% | 0.25 | 32% | 0.315 | C | S | . | . | G | 310 helix | trans | -86.4 | -11.7 | 179 | -59.2 | 92.8 | 0 | 0 | 0 | 113.8 | T71 S92 F93 P97 F98 | T71-H95 WeakPolarHBondContact CG2-NE2 3.48Å; S92-H95 PolarHBondContact O-N 3.33Å; S92-H95 VanDerWaalsContact O-N 3.08Å; S92-H95 PolarHBondContact O-ND1 3.35Å; F93-H95 PolarHBondContact O-N 3.22Å; F93-H95 VanDerWaalsContact O-N 3.15Å; H95-P97 VanDerWaalsContact C-N 3.29Å; H95-F98 PolarHBondContact O-N 2.89Å; H95-F98 VanDerWaalsContact O-N 3.11Å |
| 96 | W | 93.8 | Very high | 91.2 | Very high | 132 Ų | 132 | 57.1 Ų | 57.1 | 50% | 0.5 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -54.1 | -34.7 | -178.7 | -83.2 | 23 | 0 | 0 | 0 | 115.2 | F93 F98 S99 L100 F165 | F93-W96 AromaticContact CD1-CD2 3.67Å; F93-W96 HydrophobicContact CD1-CD2 3.67Å; F93-W96 AromaticContact CD1-CE2 3.42Å; F93-W96 VanDerWaalsContact CD1-CE2 3.42Å; F93-W96 AromaticContact CD1-CE3 3.94Å; F93-W96 HydrophobicContact CD1-CE3 3.94Å; F93-W96 HydrophobicContact CD1-CG 4.34Å; F93-W96 AromaticContact CD1-CH2 3.84Å; F93-W96 HydrophobicContact CD1-CH2 3.84Å; F93-W96 AromaticContact CD1-CZ2 3.54Å; F93-W96 HydrophobicContact CD1-CZ2 3.54Å; F93-W96 HydrophobicContact CD1-CZ3 4.01Å; F93-W96 AromaticContact CD1-NE1 3.89Å; F93-W96 HydrophobicContact CE1-CD2 4.27Å; F93-W96 AromaticContact CE1-CE2 3.67Å; F93-W96 HydrophobicContact CE1-CE3 4.39Å; F93-W96 AromaticContact CE1-CH2 3.44Å; F93-W96 HydrophobicContact CE1-CH2 3.44Å; F93-W96 VanDerWaalsContact CE1-CH2 3.44Å; F93-W96 AromaticContact CE1-CZ2 3.24Å; F93-W96 HydrophobicContact CE1-CZ2 3.24Å; F93-W96 HydrophobicContact CE1-CZ3 4.01Å; F93-W96 HydrophobicContact CZ-CZ2 4.27Å; F93-W96 VanDerWaalsContact O-CB 3.29Å; F93-W96 WeakPolarHBondContact O-CB 3.36Å; F93-W96 PolarHBondContact O-N 3.37Å; W96-F98 PolarHBondContact O-N 3.41Å; W96-S99 PolarHBondContact O-N 2.98Å; W96-L100 HydrophobicContact CB-CD1 4.28Å; W96-L100 HydrophobicContact CE3-CD1 4.11Å; W96-L100 WeakPolarHBondContact O-CB 2.94Å; W96-L100 WeakPolarHBondContact O-CG 3.47Å; W96-L100 PolarHBondContact O-N 3.43Å; W96-F165 HydrophobicContact CB-CE2 4.36Å |
| 97 | P | 96.5 | Very high | 91.8 | Very high | 2 Ų | 2 | 50.8 Ų | 50.8 | 1% | 0.013 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -55.9 | -35.2 | 177.5 | -27.4 | 35.8 | 0 | 0 | 0 | 113.8 | A94 H95 S99 L100 K101 W104 F165 N168 F169 A172 | A94-P97 VanDerWaalsContact O-CD 3.26Å; A94-P97 WeakPolarHBondContact O-CD 3.01Å; H95-P97 VanDerWaalsContact C-N 3.29Å; P97-S99 PolarHBondContact O-N 3.34Å; P97-L100 CarbonylContact O-C 3.58Å; P97-L100 PolarHBondContact O-N 3Å; P97-K101 WeakPolarHBondContact O-CA 3.2Å; P97-K101 WeakPolarHBondContact O-CB 3.38Å; P97-K101 PolarHBondContact O-N 3.15Å; P97-W104 HydrophobicContact CB-CH2 3.99Å; P97-W104 HydrophobicContact CB-CZ2 4.48Å; P97-W104 WeakPolarHBondContact O-CH2 3.42Å; P97-F165 HydrophobicContact CG-CD1 4.43Å; P97-F165 HydrophobicContact CG-CD2 3.83Å; P97-F165 HydrophobicContact CG-CE1 4.3Å; P97-F165 HydrophobicContact CG-CE2 3.71Å; P97-F165 HydrophobicContact CG-CG 4.2Å; P97-F165 HydrophobicContact CG-CZ 3.95Å; P97-N168 HydrophobicContact CB-CB 4.43Å; P97-N168 HydrophobicContact CG-CB 4.19Å; P97-F169 HydrophobicContact CB-CB 4.07Å; P97-F169 HydrophobicContact CB-CD2 4.37Å; P97-F169 HydrophobicContact CG-CB 4.12Å; P97-A172 HydrophobicContact CB-CB 4.14Å |
| 98 | F | 94 | Very high | 92.3 | Very high | 30 Ų | 30 | 47.7 Ų | 47.7 | 13% | 0.132 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.5 | -37.9 | 175.9 | -86 | -91.5 | 0 | 0 | 0 | 112.6 | L68 H95 W96 K101 N168 A171 A172 D175 | L68-F98 HydrophobicContact CD1-CD1 4.28Å; L68-F98 HydrophobicContact CD1-CE1 3.7Å; L68-F98 HydrophobicContact CD1-CE2 4.21Å; L68-F98 HydrophobicContact CD1-CZ 3.64Å; L68-F98 HydrophobicContact CD2-CD1 4.22Å; L68-F98 HydrophobicContact CD2-CD2 3.45Å; L68-F98 VanDerWaalsContact CD2-CD2 3.45Å; L68-F98 HydrophobicContact CD2-CE1 4.13Å; L68-F98 HydrophobicContact CD2-CE2 3.33Å; L68-F98 HydrophobicContact CD2-CG 3.9Å; L68-F98 HydrophobicContact CD2-CZ 3.69Å; L68-F98 HydrophobicContact CG-CD2 4.27Å; L68-F98 HydrophobicContact CG-CE1 4.1Å; L68-F98 HydrophobicContact CG-CE2 3.67Å; L68-F98 HydrophobicContact CG-CZ 3.56Å; H95-F98 PolarHBondContact O-N 2.89Å; H95-F98 VanDerWaalsContact O-N 3.11Å; W96-F98 PolarHBondContact O-N 3.41Å; F98-K101 WeakPolarHBondContact O-CG 3.37Å; F98-N168 HydrophobicContact CD2-CB 4.27Å; F98-N168 HydrophobicContact CE2-CB 4.24Å; F98-A171 HydrophobicContact CE2-CB 3.79Å; F98-A171 HydrophobicContact CZ-CB 3.68Å; F98-A172 HydrophobicContact CD1-CB 4.26Å; F98-A172 HydrophobicContact CD2-CB 3.98Å; F98-A172 HydrophobicContact CE1-CB 4.39Å; F98-A172 HydrophobicContact CE2-CB 4.13Å; F98-A172 HydrophobicContact CG-CB 4.06Å; F98-A172 HydrophobicContact CZ-CB 4.34Å; F98-D175 HydrophobicContact CE1-CB 4.02Å |
| 99 | S | 92.5 | Very high | 92.6 | Very high | 100 Ų | 100 | 48.5 Ų | 48.5 | 70% | 0.699 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -70.9 | -33 | 175.4 | -53.7 | 0 | 0 | 0 | 0 | 112.6 | W96 P97 | W96-S99 PolarHBondContact O-N 2.98Å; P97-S99 PolarHBondContact O-N 3.34Å |
| 100 | L | 95.1 | Very high | 92.9 | Very high | 69 Ų | 69 | 46.2 Ų | 46.2 | 36% | 0.361 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -95.5 | -0.9 | -175.1 | -62.8 | 178.1 | 0 | 0 | 0 | 113.4 | W96 P97 L102 L103 W104 | W96-L100 HydrophobicContact CB-CD1 4.28Å; W96-L100 HydrophobicContact CE3-CD1 4.11Å; W96-L100 WeakPolarHBondContact O-CB 2.94Å; W96-L100 WeakPolarHBondContact O-CG 3.47Å; W96-L100 PolarHBondContact O-N 3.43Å; P97-L100 CarbonylContact O-C 3.58Å; P97-L100 PolarHBondContact O-N 3Å; L100-L102 PolarHBondContact O-N 3.38Å; L100-L103 HydrophobicContact CB-CD1 4.14Å; L100-L103 HydrophobicContact CD2-CD1 4.17Å; L100-L103 VanDerWaalsContact O-CB 3.3Å; L100-L103 WeakPolarHBondContact O-CB 3.41Å; L100-L103 WeakPolarHBondContact O-CG 3.35Å; L100-L103 PolarHBondContact O-N 3.27Å; L100-W104 HydrophobicContact CB-CH2 4.41Å; L100-W104 HydrophobicContact CB-CZ3 3.89Å; L100-W104 WeakPolarHBondContact O-CZ3 3.3Å |
| 101 | K | 95.4 | Very high | 93 | Very high | 51 Ų | 51 | 47.9 Ų | 47.9 | 22% | 0.222 | 25% | 0.251 | C | S | . | . | G | 310 helix | trans | -52 | -30.1 | -174.4 | 75 | 177.6 | 179.8 | 163.1 | 0 | 113.7 | P97 F98 L103 W104 A105 A172 D175 I176 D179 | P97-K101 WeakPolarHBondContact O-CA 3.2Å; P97-K101 WeakPolarHBondContact O-CB 3.38Å; P97-K101 PolarHBondContact O-N 3.15Å; F98-K101 WeakPolarHBondContact O-CG 3.37Å; K101-L103 PolarHBondContact O-N 2.83Å; K101-L103 VanDerWaalsContact O-N 3.17Å; K101-W104 VanDerWaalsContact CA-CH2 3.47Å; K101-W104 HydrophobicContact CB-CH2 4.2Å; K101-W104 HydrophobicContact CB-CZ2 3.97Å; K101-W104 PolarHBondContact O-N 3.04Å; K101-A105 WeakPolarHBondContact O-CB 3.47Å; K101-A105 PolarHBondContact O-N 3.37Å; K101-A172 HydrophobicContact CB-CB 4.22Å; K101-D175 IonicContact NZ-OD2 2.71Å; K101-D175 PolarHBondContact NZ-OD2 3.24Å; K101-I176 HydrophobicContact CB-CD1 3.85Å; K101-I176 HydrophobicContact CB-CG1 3.96Å; K101-I176 HydrophobicContact CD-CG1 4.07Å; K101-I176 HydrophobicContact CG-CG1 4.16Å; K101-I176 WeakPolarHBondContact O-CD1 3.44Å; K101-D179 IonicContact NZ-OD2 3.75Å; K101-D179 PolarHBondContact NZ-OD2 3.3Å |
| 102 | L | 93.4 | Very high | 93 | Very high | 84 Ų | 84 | 49.8 Ų | 49.8 | 44% | 0.44 | 26% | 0.26 | S | S | . | . | G | 310 helix | trans | -55.3 | -30.9 | 174.6 | -166.6 | 67.4 | 0 | 0 | 0 | 113.4 | L100 W104 P106 L281 M285 | L100-L102 PolarHBondContact O-N 3.38Å; L102-W104 PolarHBondContact O-N 3.45Å; L102-P106 VanDerWaalsContact O-CD 3.3Å; L102-P106 WeakPolarHBondContact O-CD 3.13Å; L102-L281 HydrophobicContact CD1-CD1 3.65Å; L102-L281 HydrophobicContact CD1-CD2 4.2Å; L102-L281 HydrophobicContact CD2-CD1 4.48Å; L102-L281 HydrophobicContact CG-CD1 4.18Å; L102-L281 HydrophobicContact CG-CD2 4.07Å; L102-M285 HydrophobicContact CD2-SD 3.78Å |
| 103 | L | 95.1 | Very high | 92.7 | Very high | 108 Ų | 108 | 49.4 Ų | 49.4 | 57% | 0.565 | 26% | 0.257 | S | S | * | . | G | 310 helix | trans | -66.4 | -36.7 | -176.1 | -64.7 | -178.6 | 0 | 0 | 0 | 112.9 | L100 K101 Y278 | L100-L103 HydrophobicContact CB-CD1 4.14Å; L100-L103 HydrophobicContact CD2-CD1 4.17Å; L100-L103 VanDerWaalsContact O-CB 3.3Å; L100-L103 WeakPolarHBondContact O-CB 3.41Å; L100-L103 WeakPolarHBondContact O-CG 3.35Å; L100-L103 PolarHBondContact O-N 3.27Å; K101-L103 PolarHBondContact O-N 2.83Å; K101-L103 VanDerWaalsContact O-N 3.17Å; L103-Y278 WeakPolarHBondContact O-CE1 3.07Å; L103-Y278 PolarHBondContact O-OH 2.99Å |
| 104 | W | 95.6 | Very high | 92 | Very high | 40 Ų | 40 | 50 Ų | 50 | 15% | 0.152 | 26% | 0.262 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -111 | -4.1 | 179.3 | 66.4 | 96.7 | 0 | 0 | 0 | 113.6 | P97 L100 K101 L102 P106 V107 V108 F169 A172 T173 I176 | P97-W104 HydrophobicContact CB-CH2 3.99Å; P97-W104 HydrophobicContact CB-CZ2 4.48Å; P97-W104 WeakPolarHBondContact O-CH2 3.42Å; L100-W104 HydrophobicContact CB-CH2 4.41Å; L100-W104 HydrophobicContact CB-CZ3 3.89Å; L100-W104 WeakPolarHBondContact O-CZ3 3.3Å; K101-W104 VanDerWaalsContact CA-CH2 3.47Å; K101-W104 HydrophobicContact CB-CH2 4.2Å; K101-W104 HydrophobicContact CB-CZ2 3.97Å; K101-W104 PolarHBondContact O-N 3.04Å; L102-W104 PolarHBondContact O-N 3.45Å; W104-P106 VanDerWaalsContact C-CD 3.45Å; W104-P106 VanDerWaalsContact C-N 3.28Å; W104-V107 WeakPolarHBondContact O-CA 3.39Å; W104-V107 WeakPolarHBondContact O-CB 3.36Å; W104-V107 PolarHBondContact O-N 2.97Å; W104-V108 PolarHBondContact O-N 3.29Å; W104-V108 VanDerWaalsContact O-N 3.13Å; W104-F169 AromaticContact CD2-CE2 3.8Å; W104-F169 HydrophobicContact CD2-CE2 3.8Å; W104-F169 HydrophobicContact CD2-CZ 4.35Å; W104-F169 AromaticContact CE2-CE2 3.56Å; W104-F169 HydrophobicContact CE3-CE2 4.04Å; W104-F169 HydrophobicContact CG-CE2 4.39Å; W104-F169 AromaticContact CH2-CD2 3.77Å; W104-F169 HydrophobicContact CH2-CD2 3.77Å; W104-F169 AromaticContact CH2-CE2 3.81Å; W104-F169 HydrophobicContact CH2-CE2 3.81Å; W104-F169 AromaticContact CZ2-CD2 3.65Å; W104-F169 HydrophobicContact CZ2-CD2 3.65Å; W104-F169 AromaticContact CZ2-CE2 3.59Å; W104-F169 HydrophobicContact CZ2-CE2 3.59Å; W104-F169 HydrophobicContact CZ2-CZ 4.47Å; W104-F169 HydrophobicContact CZ3-CD2 4.35Å; W104-F169 HydrophobicContact CZ3-CE2 4.05Å; W104-A172 HydrophobicContact CZ2-CB 3.97Å; W104-T173 PolarHBondContact NE1-OG1 3.21Å; W104-I176 HydrophobicContact CG-CD1 4.47Å |
| 105 | A | 94.7 | Very high | 91.5 | Very high | 14 Ų | 14 | 61.2 Ų | 61.2 | 12% | 0.116 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -49.6 | -43.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | K101 V107 V108 D109 I176 | K101-A105 WeakPolarHBondContact O-CB 3.47Å; K101-A105 PolarHBondContact O-N 3.37Å; A105-V107 VanDerWaalsContact C-N 3.25Å; A105-V107 PolarHBondContact O-N 3.47Å; A105-V108 PolarHBondContact O-N 2.8Å; A105-V108 VanDerWaalsContact O-N 3.16Å; A105-D109 PolarHBondContact O-N 3.24Å; A105-I176 HydrophobicContact CB-CD1 3.95Å; A105-I176 HydrophobicContact CB-CG1 4.11Å; A105-I176 HydrophobicContact CB-CG2 3.75Å |
| 106 | P | 92.8 | Very high | 90.9 | Very high | 4 Ų | 4 | 64.2 Ų | 64.2 | 3% | 0.026 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.8 | -31.6 | 175.1 | -28.4 | 38.2 | 0 | 0 | 0 | 114.6 | L102 W104 S110 T277 Y278 L281 | L102-P106 VanDerWaalsContact O-CD 3.3Å; L102-P106 WeakPolarHBondContact O-CD 3.13Å; W104-P106 VanDerWaalsContact C-CD 3.45Å; W104-P106 VanDerWaalsContact C-N 3.28Å; P106-S110 VanDerWaalsContact O-CB 3.28Å; P106-S110 WeakPolarHBondContact O-CB 3.43Å; P106-S110 PolarHBondContact O-N 2.93Å; P106-S110 VanDerWaalsContact O-N 3.14Å; P106-S110 PolarHBondContact O-OG 3.02Å; P106-T277 HydrophobicContact CB-CG2 3.75Å; P106-Y278 HydrophobicContact CB-CD1 4.08Å; P106-Y278 HydrophobicContact CB-CD2 3.89Å; P106-Y278 HydrophobicContact CB-CE1 4.03Å; P106-Y278 HydrophobicContact CB-CE2 3.85Å; P106-Y278 HydrophobicContact CB-CG 4Å; P106-Y278 HydrophobicContact CG-CD1 3.81Å; P106-Y278 HydrophobicContact CG-CE1 3.72Å; P106-Y278 HydrophobicContact CG-CE2 4.45Å; P106-Y278 HydrophobicContact CG-CG 4.21Å; P106-L281 HydrophobicContact CG-CB 4.35Å; P106-L281 HydrophobicContact CG-CD2 3.5Å |
| 107 | V | 93.9 | Very high | 90.5 | Very high | 47 Ų | 47 | 58.6 Ų | 58.6 | 29% | 0.285 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -70.1 | -46.8 | 176.7 | -180 | 0 | 0 | 0 | 0 | 109.7 | W104 A105 D109 S110 V111 V274 Y278 | W104-V107 WeakPolarHBondContact O-CA 3.39Å; W104-V107 WeakPolarHBondContact O-CB 3.36Å; W104-V107 PolarHBondContact O-N 2.97Å; A105-V107 VanDerWaalsContact C-N 3.25Å; A105-V107 PolarHBondContact O-N 3.47Å; V107-D109 VanDerWaalsContact C-N 3.26Å; V107-D109 PolarHBondContact O-N 3.32Å; V107-S110 PolarHBondContact O-N 3.37Å; V107-S110 PolarHBondContact O-OG 2.94Å; V107-V111 HydrophobicContact CG1-CG2 4.09Å; V107-V111 WeakPolarHBondContact O-CB 3.39Å; V107-V111 PolarHBondContact O-N 3.46Å; V107-V274 HydrophobicContact CG2-CG1 4.14Å; V107-Y278 HydrophobicContact CG2-CE2 4.03Å |
| 108 | V | 93.2 | Very high | 90.1 | Very high | 3 Ų | 3 | 59 Ų | 59 | 2% | 0.018 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.4 | -39.6 | 176.8 | 178.1 | 0 | 0 | 0 | 0 | 111 | W104 A105 W122 T173 I176 V177 | W104-V108 PolarHBondContact O-N 3.29Å; W104-V108 VanDerWaalsContact O-N 3.13Å; A105-V108 PolarHBondContact O-N 2.8Å; A105-V108 VanDerWaalsContact O-N 3.16Å; V108-W122 HydrophobicContact CG1-CB 4.24Å; V108-W122 HydrophobicContact CG1-CD2 4.13Å; V108-W122 HydrophobicContact CG1-CG 3.85Å; V108-W122 PolarHBondContact O-NE1 2.88Å; V108-W122 VanDerWaalsContact O-NE1 3.11Å; V108-T173 HydrophobicContact CG2-CG2 3.9Å; V108-I176 HydrophobicContact CB-CG2 4.17Å; V108-I176 HydrophobicContact CG1-CG2 4.04Å; V108-I176 HydrophobicContact CG2-CD1 4.46Å; V108-V177 HydrophobicContact CG1-CG2 3.5Å |
| 109 | D | 89.7 | Confident | 90 | Very high | 34 Ų | 34 | 58.1 Ų | 58.1 | 18% | 0.182 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -74 | -25.5 | 179.7 | -79.9 | -30.9 | 0 | 0 | 0 | 114.5 | A105 V107 R119 T277 | A105-D109 PolarHBondContact O-N 3.24Å; V107-D109 VanDerWaalsContact C-N 3.26Å; V107-D109 PolarHBondContact O-N 3.32Å; D109-R119 IonicContact OD1-CZ 2.77Å; D109-R119 IonicContact OD1-NH1 2.97Å; D109-R119 PolarHBondContact OD1-NH1 2.88Å; D109-R119 IonicContact OD1-NH2 2.89Å; D109-T277 HydrophobicContact CB-CG2 4.32Å |
| 110 | S | 89.6 | Confident | 90 | Very high | 5 Ų | 5 | 54.9 Ų | 54.9 | 4% | 0.035 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -103.4 | -29.5 | -172.8 | 56.3 | 0 | 0 | 0 | 0 | 114.5 | P106 V107 M271 V274 | P106-S110 VanDerWaalsContact O-CB 3.28Å; P106-S110 WeakPolarHBondContact O-CB 3.43Å; P106-S110 PolarHBondContact O-N 2.93Å; P106-S110 VanDerWaalsContact O-N 3.14Å; P106-S110 PolarHBondContact O-OG 3.02Å; V107-S110 PolarHBondContact O-N 3.37Å; V107-S110 PolarHBondContact O-OG 2.94Å; S110-M271 WeakPolarHBondContact CA-O 3.25Å; S110-M271 WeakPolarHBondContact CB-O 3.42Å; S110-V274 WeakPolarHBondContact OG-CA 3.42Å; S110-V274 VanDerWaalsContact OG-CG2 3.26Å; S110-V274 WeakPolarHBondContact OG-CG2 3.25Å |
| 111 | V | 90.2 | Very high | 89.9 | Confident | 72 Ų | 72 | 52.7 Ų | 52.7 | 44% | 0.436 | 26% | 0.261 | S | S | . | . | S | Bend | trans | -98.9 | 103.8 | -178.1 | 179.7 | 0 | 0 | 0 | 0 | 108.8 | V107 W122 V274 | V107-V111 HydrophobicContact CG1-CG2 4.09Å; V107-V111 WeakPolarHBondContact O-CB 3.39Å; V107-V111 PolarHBondContact O-N 3.46Å; V111-W122 HydrophobicContact CB-CZ2 4.35Å; V111-W122 HydrophobicContact CG1-CZ2 4.45Å; V111-W122 PolarHBondContact O-NE1 3.3Å; V111-V274 HydrophobicContact CG2-CG2 3.93Å |
| 112 | F | 89 | Confident | 89.9 | Confident | 42 Ų | 42 | 53.7 Ų | 53.7 | 18% | 0.184 | 26% | 0.264 | C | S | . | . | trans | -153.7 | 163.9 | 178.1 | 61.9 | -87.6 | 0 | 0 | 0 | 112.1 | M114 R118 R272 | F112-M114 HydrophobicContact CD2-SD 4.5Å; F112-M114 HydrophobicContact CE2-CG 4.38Å; F112-M114 HydrophobicContact CE2-SD 3.55Å; F112-M114 VanDerWaalsContact CE2-SD 3.55Å; F112-M114 HydrophobicContact CZ-SD 4.13Å; F112-R118 HydrophobicContact CB-CB 4.5Å; F112-R118 HydrophobicContact CB-CG 4.3Å; F112-R118 HydrophobicContact CD1-CB 4.28Å; F112-R118 HydrophobicContact CD1-CG 3.7Å; F112-R118 HydrophobicContact CD2-CB 3.74Å; F112-R118 HydrophobicContact CD2-CG 4.11Å; F112-R118 HydrophobicContact CE1-CB 4.45Å; F112-R118 HydrophobicContact CE1-CG 3.97Å; F112-R118 HydrophobicContact CE2-CB 3.92Å; F112-R118 HydrophobicContact CE2-CG 4.33Å; F112-R118 HydrophobicContact CG-CB 3.93Å; F112-R118 HydrophobicContact CG-CG 3.78Å; F112-R118 HydrophobicContact CZ-CB 4.28Å; F112-R118 HydrophobicContact CZ-CG 4.28Å; F112-R272 HydrophobicContact CE1-CG 4.49Å | ||
| 113 | S | 84 | Confident | 90 | Very high | 56 Ų | 56 | 49.7 Ų | 49.7 | 39% | 0.392 | 24% | 0.243 | S | C | . | . | trans | -92.7 | 117.2 | 175.7 | -176.8 | 0 | 0 | 0 | 0 | 110.9 | R115 F116 G117 S121 | S113-R115 PolarHBondContact O-N 2.99Å; S113-R115 VanDerWaalsContact O-N 3.15Å; S113-F116 PolarHBondContact O-N 3.21Å; S113-G117 PolarHBondContact O-N 2.99Å; S113-S121 WeakPolarHBondContact CB-OG 3.45Å; S113-S121 PolarHBondContact N-OG 2.84Å; S113-S121 PolarHBondContact O-OG 3.41Å | ||
| 114 | M | 78.3 | Confident | 90 | Very high | 102 Ų | 102 | 45.2 Ų | 45.2 | 50% | 0.502 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -58.2 | -27.9 | 177 | -69.2 | -71.5 | -68.9 | 0 | 0 | 113 | F112 | F112-M114 HydrophobicContact CD2-SD 4.5Å; F112-M114 HydrophobicContact CE2-CG 4.38Å; F112-M114 HydrophobicContact CE2-SD 3.55Å; F112-M114 VanDerWaalsContact CE2-SD 3.55Å; F112-M114 HydrophobicContact CZ-SD 4.13Å |
| 115 | R | 81.5 | Confident | 90 | Very high | 236 Ų | 236 | 46.2 Ų | 46.2 | 89% | 0.891 | 23% | 0.231 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -73.1 | -35.4 | -179.3 | -173.8 | 177.7 | -179.6 | 179.5 | 0.6 | 112.3 | S113 | S113-R115 PolarHBondContact O-N 2.99Å; S113-R115 VanDerWaalsContact O-N 3.15Å |
| 116 | F | 81 | Confident | 90.1 | Very high | 118 Ų | 118 | 45.9 Ų | 45.9 | 52% | 0.518 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | -24.9 | -178.8 | -86.2 | -89.3 | 0 | 0 | 0 | 112.9 | S113 K120 | S113-F116 PolarHBondContact O-N 3.21Å; F116-K120 WeakPolarHBondContact O-CE 3.4Å |
| 117 | G | 85.4 | Confident | 90.3 | Very high | 14 Ų | 14 | 45.7 Ų | 45.7 | 14% | 0.144 | 23% | 0.226 | C | C | . | . | trans | 101.6 | 151 | -170.4 | 0 | 0 | 0 | 0 | 0 | 111 | S113 R119 S121 E262 | S113-G117 PolarHBondContact O-N 2.99Å; G117-R119 PolarHBondContact O-N 3.42Å; G117-S121 WeakPolarHBondContact O-CB 3.22Å; G117-S121 PolarHBondContact O-N 3.34Å; G117-S121 VanDerWaalsContact O-N 3.08Å; G117-S121 PolarHBondContact O-OG 3.36Å; G117-E262 WeakPolarHBondContact CA-OE2 3.49Å | ||
| 118 | R | 87.9 | Confident | 90.5 | Very high | 9 Ų | 9 | 46.5 Ų | 46.5 | 3% | 0.034 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -43.3 | -173.9 | -179.9 | 169.8 | 60.7 | 155.3 | -3.4 | 111.6 | F112 E262 E265 | F112-R118 HydrophobicContact CB-CB 4.5Å; F112-R118 HydrophobicContact CB-CG 4.3Å; F112-R118 HydrophobicContact CD1-CB 4.28Å; F112-R118 HydrophobicContact CD1-CG 3.7Å; F112-R118 HydrophobicContact CD2-CB 3.74Å; F112-R118 HydrophobicContact CD2-CG 4.11Å; F112-R118 HydrophobicContact CE1-CB 4.45Å; F112-R118 HydrophobicContact CE1-CG 3.97Å; F112-R118 HydrophobicContact CE2-CB 3.92Å; F112-R118 HydrophobicContact CE2-CG 4.33Å; F112-R118 HydrophobicContact CG-CB 3.93Å; F112-R118 HydrophobicContact CG-CG 3.78Å; F112-R118 HydrophobicContact CZ-CB 4.28Å; F112-R118 HydrophobicContact CZ-CG 4.28Å; R118-E262 PolarHBondContact N-OE2 2.91Å; R118-E265 WeakPolarHBondContact CB-OE2 3.05Å; R118-E265 WeakPolarHBondContact CD-OE2 3.06Å; R118-E265 IonicContact CZ-OE1 2.59Å; R118-E265 IonicContact CZ-OE2 3.89Å; R118-E265 IonicContact NE-OE1 3.34Å; R118-E265 PolarHBondContact NE-OE1 3.21Å; R118-E265 IonicContact NE-OE2 2.72Å; R118-E265 PolarHBondContact NE-OE2 2.92Å; R118-E265 IonicContact NH2-OE1 3.46Å; R118-E265 PolarHBondContact NH2-OE1 3.14Å; R118-E265 IonicContact NH2-OE2 3.88Å; R118-E265 PolarHBondContact NH2-OE2 3Å |
| 119 | R | 92 | Very high | 90.7 | Very high | 13 Ų | 13 | 50.3 Ų | 50.3 | 5% | 0.049 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | -46 | -173.1 | -55.5 | -55.3 | -177.7 | -168.4 | 8.1 | 111.5 | D109 G117 S121 W122 L123 V177 G180 W181 E262 | D109-R119 IonicContact OD1-CZ 2.77Å; D109-R119 IonicContact OD1-NH1 2.97Å; D109-R119 PolarHBondContact OD1-NH1 2.88Å; D109-R119 IonicContact OD1-NH2 2.89Å; G117-R119 PolarHBondContact O-N 3.42Å; R119-S121 VanDerWaalsContact C-N 3.26Å; R119-S121 PolarHBondContact O-N 2.98Å; R119-W122 PolarHBondContact O-N 3.29Å; R119-W122 VanDerWaalsContact O-N 3.15Å; R119-L123 WeakPolarHBondContact O-CB 3.4Å; R119-L123 PolarHBondContact O-N 3.46Å; R119-V177 HydrophobicContact CB-CG1 4.15Å; R119-V177 VanDerWaalsContact O-CG1 3.26Å; R119-V177 WeakPolarHBondContact O-CG1 3.34Å; R119-G180 PolarHBondContact NE-O 2.77Å; R119-G180 PolarHBondContact NH2-O 3.21Å; R119-G180 VanDerWaalsContact NH2-O 3.11Å; R119-W181 HydrophobicContact CB-CB 4.19Å; R119-W181 HydrophobicContact CB-CD2 4.08Å; R119-W181 HydrophobicContact CB-CG 3.84Å; R119-W181 HydrophobicContact CG-CB 3.93Å; R119-W181 HydrophobicContact CG-CG 3.81Å; R119-E262 PolarHBondContact N-OE1 2.94Å; R119-E262 PolarHBondContact N-OE2 3.22Å; R119-E262 VanDerWaalsContact N-OE2 3.15Å |
| 120 | K | 91.7 | Very high | 91.1 | Very high | 32 Ų | 32 | 48.7 Ų | 48.7 | 14% | 0.139 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.8 | -30.1 | 176 | -75.8 | -173.5 | -69.3 | 179.9 | 0 | 112.9 | F116 W122 I124 K260 E262 | F116-K120 WeakPolarHBondContact O-CE 3.4Å; K120-W122 PolarHBondContact O-N 3.3Å; K120-W122 VanDerWaalsContact O-N 3.16Å; K120-I124 HydrophobicContact CB-CG1 4.14Å; K120-I124 HydrophobicContact CG-CG1 4.29Å; K120-I124 WeakPolarHBondContact O-CB 3.33Å; K120-I124 PolarHBondContact O-N 2.96Å; K120-K260 PolarHBondContact NZ-O 3.2Å; K120-E262 WeakPolarHBondContact CA-OE1 3.25Å; K120-E262 WeakPolarHBondContact CB-OE1 3.2Å; K120-E262 WeakPolarHBondContact CE-OE1 3.49Å; K120-E262 HydrophobicContact CG-CG 4.48Å; K120-E262 WeakPolarHBondContact CG-OE1 3.37Å; K120-E262 PolarHBondContact N-OE1 2.83Å |
| 121 | S | 93.1 | Very high | 91.5 | Very high | 23 Ų | 23 | 48.5 Ų | 48.5 | 16% | 0.161 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -55.8 | -29.6 | 175.1 | -71.5 | 0 | 0 | 0 | 0 | 113.2 | S113 G117 R119 P125 | S113-S121 WeakPolarHBondContact CB-OG 3.45Å; S113-S121 PolarHBondContact N-OG 2.84Å; S113-S121 PolarHBondContact O-OG 3.41Å; G117-S121 WeakPolarHBondContact O-CB 3.22Å; G117-S121 PolarHBondContact O-N 3.34Å; G117-S121 VanDerWaalsContact O-N 3.08Å; G117-S121 PolarHBondContact O-OG 3.36Å; R119-S121 VanDerWaalsContact C-N 3.26Å; R119-S121 PolarHBondContact O-N 2.98Å; S121-P125 WeakPolarHBondContact O-CD 3.44Å; S121-P125 WeakPolarHBondContact O-CG 3.26Å |
| 122 | W | 95 | Very high | 91.8 | Very high | 72 Ų | 72 | 49.6 Ų | 49.6 | 27% | 0.273 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -108.6 | -40.7 | 176.7 | -74.8 | 99.1 | 0 | 0 | 0 | 113.2 | V108 V111 R119 K120 I124 P125 T126 T173 V177 | V108-W122 HydrophobicContact CG1-CB 4.24Å; V108-W122 HydrophobicContact CG1-CD2 4.13Å; V108-W122 HydrophobicContact CG1-CG 3.85Å; V108-W122 PolarHBondContact O-NE1 2.88Å; V108-W122 VanDerWaalsContact O-NE1 3.11Å; V111-W122 HydrophobicContact CB-CZ2 4.35Å; V111-W122 HydrophobicContact CG1-CZ2 4.45Å; V111-W122 PolarHBondContact O-NE1 3.3Å; R119-W122 PolarHBondContact O-N 3.29Å; R119-W122 VanDerWaalsContact O-N 3.15Å; K120-W122 PolarHBondContact O-N 3.3Å; K120-W122 VanDerWaalsContact O-N 3.16Å; W122-I124 VanDerWaalsContact C-N 3.35Å; W122-I124 PolarHBondContact O-N 3.46Å; W122-P125 WeakPolarHBondContact O-CD 3.36Å; W122-T126 HydrophobicContact CE3-CG2 4.38Å; W122-T126 WeakPolarHBondContact O-CB 3.35Å; W122-T126 VanDerWaalsContact O-CG2 3.24Å; W122-T126 WeakPolarHBondContact O-CG2 3.37Å; W122-T126 PolarHBondContact O-N 2.61Å; W122-T126 PolarHBondContact O-OG1 2.92Å; W122-T173 HydrophobicContact CE3-CG2 4.2Å; W122-V177 HydrophobicContact CB-CG1 4.39Å; W122-V177 HydrophobicContact CB-CG2 3.41Å; W122-V177 VanDerWaalsContact CB-CG2 3.41Å; W122-V177 HydrophobicContact CG-CG2 4.3Å |
| 123 | L | 95.6 | Very high | 92.1 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -58.5 | -47.2 | -176.7 | -176 | 68.5 | 0 | 0 | 0 | 111.7 | L60 R119 T126 Q127 Q174 V177 V178 W181 V256 | L60-L123 HydrophobicContact CD1-CD2 4.3Å; R119-L123 WeakPolarHBondContact O-CB 3.4Å; R119-L123 PolarHBondContact O-N 3.46Å; L123-T126 PolarHBondContact O-OG1 3.04Å; L123-Q127 WeakPolarHBondContact O-CB 3.39Å; L123-Q127 PolarHBondContact O-N 3.3Å; L123-Q174 HydrophobicContact CD1-CG 3.72Å; L123-V177 HydrophobicContact CB-CG1 3.8Å; L123-V177 HydrophobicContact CD1-CG1 4.48Å; L123-V178 HydrophobicContact CD1-CG2 3.63Å; L123-W181 HydrophobicContact CD2-CE3 3.69Å; L123-W181 HydrophobicContact CD2-CH2 4.06Å; L123-W181 HydrophobicContact CD2-CZ3 3.21Å; L123-V256 HydrophobicContact CD2-CG1 3.99Å |
| 124 | I | 96 | Very high | 92.7 | Very high | 14 Ų | 14 | 46.8 Ų | 46.8 | 7% | 0.072 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.2 | -50.8 | -174.6 | -60.3 | -58.3 | 0 | 0 | 0 | 110.6 | K120 W122 Y128 T253 V256 L257 | K120-I124 HydrophobicContact CB-CG1 4.14Å; K120-I124 HydrophobicContact CG-CG1 4.29Å; K120-I124 WeakPolarHBondContact O-CB 3.33Å; K120-I124 PolarHBondContact O-N 2.96Å; W122-I124 VanDerWaalsContact C-N 3.35Å; W122-I124 PolarHBondContact O-N 3.46Å; I124-Y128 HydrophobicContact CG2-CD2 3.69Å; I124-Y128 HydrophobicContact CG2-CE2 3.46Å; I124-Y128 VanDerWaalsContact CG2-CE2 3.46Å; I124-Y128 WeakPolarHBondContact O-CD2 3.29Å; I124-Y128 PolarHBondContact O-N 3.39Å; I124-Y128 VanDerWaalsContact O-N 3.09Å; I124-T253 HydrophobicContact CB-CG2 4.32Å; I124-T253 HydrophobicContact CD1-CG2 3.79Å; I124-T253 HydrophobicContact CG2-CG2 3.89Å; I124-V256 HydrophobicContact CD1-CB 4.25Å; I124-V256 HydrophobicContact CD1-CG1 4.03Å; I124-L257 HydrophobicContact CD1-CB 3.96Å; I124-L257 HydrophobicContact CG1-CB 4.49Å; I124-L257 HydrophobicContact CG1-CD1 4.28Å; I124-L257 HydrophobicContact CG2-CD1 4.42Å; I124-L257 HydrophobicContact CG2-CD2 4.49Å |
| 125 | P | 96.4 | Very high | 93.6 | Very high | 61 Ų | 61 | 45 Ų | 45 | 40% | 0.396 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -60.4 | -44.7 | 174.1 | -27 | 37.1 | 0 | 0 | 0 | 113.8 | S121 W122 Y128 L129 | S121-P125 WeakPolarHBondContact O-CD 3.44Å; S121-P125 WeakPolarHBondContact O-CG 3.26Å; W122-P125 WeakPolarHBondContact O-CD 3.36Å; P125-Y128 PolarHBondContact O-N 2.89Å; P125-L129 WeakPolarHBondContact O-CB 3.42Å; P125-L129 WeakPolarHBondContact O-CG 3.4Å; P125-L129 PolarHBondContact O-N 3.02Å |
| 126 | T | 96.6 | Very high | 94.2 | Very high | 6 Ų | 6 | 38.3 Ų | 38.3 | 4% | 0.037 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.2 | -41.9 | -177.2 | 56.1 | 0 | 0 | 0 | 0 | 111.6 | W122 L123 L129 I130 T173 | W122-T126 HydrophobicContact CE3-CG2 4.38Å; W122-T126 WeakPolarHBondContact O-CB 3.35Å; W122-T126 VanDerWaalsContact O-CG2 3.24Å; W122-T126 WeakPolarHBondContact O-CG2 3.37Å; W122-T126 PolarHBondContact O-N 2.61Å; W122-T126 PolarHBondContact O-OG1 2.92Å; L123-T126 PolarHBondContact O-OG1 3.04Å; T126-L129 PolarHBondContact O-N 3.24Å; T126-I130 VanDerWaalsContact O-CG1 3.23Å; T126-I130 WeakPolarHBondContact O-CG1 3.48Å; T126-I130 PolarHBondContact O-N 2.59Å; T126-T173 HydrophobicContact CG2-CG2 3.76Å |
| 127 | Q | 96.7 | Very high | 94.8 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.9 | -38 | 179.8 | -160.1 | 170.1 | -42.5 | 0 | 0 | 112.3 | L123 I130 G131 Q174 F249 S252 T253 | L123-Q127 WeakPolarHBondContact O-CB 3.39Å; L123-Q127 PolarHBondContact O-N 3.3Å; Q127-I130 PolarHBondContact O-N 3.09Å; Q127-G131 PolarHBondContact O-N 3.33Å; Q127-Q174 VanDerWaalsContact CD-NE2 3.28Å; Q127-Q174 VanDerWaalsContact CG-NE2 3.27Å; Q127-F249 HydrophobicContact CG-CD1 3.45Å; Q127-F249 VanDerWaalsContact CG-CD1 3.45Å; Q127-F249 HydrophobicContact CG-CE1 3.86Å; Q127-S252 PolarHBondContact NE2-OG 3.36Å; Q127-T253 HydrophobicContact CB-CG2 4.12Å; Q127-T253 WeakPolarHBondContact CB-OG1 3.44Å; Q127-T253 VanDerWaalsContact CD-OG1 3.31Å; Q127-T253 WeakPolarHBondContact CG-OG1 3.35Å; Q127-T253 PolarHBondContact NE2-OG1 3.1Å |
| 128 | Y | 98.1 | Very high | 95.2 | Very high | 64 Ų | 64 | 32.9 Ų | 32.9 | 25% | 0.251 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -64.6 | -39.8 | 169.3 | -79 | -49.6 | 0 | 0 | 0 | 112.6 | I124 P125 G131 L132 F250 T253 T254 | I124-Y128 HydrophobicContact CG2-CD2 3.69Å; I124-Y128 HydrophobicContact CG2-CE2 3.46Å; I124-Y128 VanDerWaalsContact CG2-CE2 3.46Å; I124-Y128 WeakPolarHBondContact O-CD2 3.29Å; I124-Y128 PolarHBondContact O-N 3.39Å; I124-Y128 VanDerWaalsContact O-N 3.09Å; P125-Y128 PolarHBondContact O-N 2.89Å; Y128-G131 PolarHBondContact O-N 3.26Å; Y128-L132 WeakPolarHBondContact O-CB 3.44Å; Y128-L132 PolarHBondContact O-N 2.98Å; Y128-F250 AromaticContact CD1-CD1 3.45Å; Y128-F250 HydrophobicContact CD1-CD1 3.45Å; Y128-F250 VanDerWaalsContact CD1-CD1 3.45Å; Y128-F250 AromaticContact CD1-CE1 3.76Å; Y128-F250 HydrophobicContact CD1-CE1 3.76Å; Y128-F250 AromaticContact CE1-CD1 3.73Å; Y128-F250 HydrophobicContact CE1-CD1 3.73Å; Y128-F250 HydrophobicContact CE1-CE1 4.41Å; Y128-T253 HydrophobicContact CD1-CG2 3.89Å; Y128-T253 HydrophobicContact CD2-CG2 3.59Å; Y128-T253 HydrophobicContact CE1-CG2 3.75Å; Y128-T253 HydrophobicContact CE2-CG2 3.46Å; Y128-T253 VanDerWaalsContact CE2-CG2 3.46Å; Y128-T253 HydrophobicContact CG-CG2 3.81Å; Y128-T254 PolarHBondContact OH-OG1 3.32Å |
| 129 | L | 97.6 | Very high | 95.3 | Very high | 84 Ų | 84 | 36.4 Ų | 36.4 | 44% | 0.44 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -64.4 | -40.2 | 175.9 | -75 | 170.9 | 0 | 0 | 0 | 111.5 | P125 T126 L132 F133 L170 | P125-L129 WeakPolarHBondContact O-CB 3.42Å; P125-L129 WeakPolarHBondContact O-CG 3.4Å; P125-L129 PolarHBondContact O-N 3.02Å; T126-L129 PolarHBondContact O-N 3.24Å; L129-L132 PolarHBondContact O-N 3.12Å; L129-F133 VanDerWaalsContact O-CB 3.25Å; L129-F133 WeakPolarHBondContact O-CB 3.25Å; L129-F133 PolarHBondContact O-N 2.91Å; L129-L170 HydrophobicContact CB-CD1 3.94Å; L129-L170 HydrophobicContact CB-CD2 4.07Å; L129-L170 HydrophobicContact CD1-CD2 3.99Å |
| 130 | I | 97.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.5 | -47.6 | 173.8 | -66.9 | 164 | 0 | 0 | 0 | 110.1 | P67 T126 Q127 L132 F133 M134 F167 L170 A171 Q174 F249 | P67-I130 HydrophobicContact CG-CG2 4.01Å; T126-I130 VanDerWaalsContact O-CG1 3.23Å; T126-I130 WeakPolarHBondContact O-CG1 3.48Å; T126-I130 PolarHBondContact O-N 2.59Å; Q127-I130 PolarHBondContact O-N 3.09Å; I130-L132 PolarHBondContact O-N 3.35Å; I130-F133 WeakPolarHBondContact O-CB 3.36Å; I130-F133 PolarHBondContact O-N 3.29Å; I130-M134 HydrophobicContact CG2-CE 4.07Å; I130-M134 HydrophobicContact CG2-SD 4.45Å; I130-M134 WeakPolarHBondContact O-CG 3.29Å; I130-M134 PolarHBondContact O-N 2.88Å; I130-F167 HydrophobicContact CG2-CE2 3.8Å; I130-L170 HydrophobicContact CD1-CB 4.32Å; I130-L170 HydrophobicContact CG1-CB 3.65Å; I130-A171 HydrophobicContact CD1-CB 4.38Å; I130-Q174 HydrophobicContact CD1-CB 4.03Å; I130-Q174 HydrophobicContact CD1-CG 4.4Å; I130-F249 HydrophobicContact CB-CD1 3.99Å; I130-F249 HydrophobicContact CB-CE1 3.86Å; I130-F249 HydrophobicContact CD1-CE1 4.17Å; I130-F249 HydrophobicContact CG2-CD1 3.73Å; I130-F249 HydrophobicContact CG2-CE1 3.34Å; I130-F249 HydrophobicContact CG2-CE2 4.36Å; I130-F249 HydrophobicContact CG2-CG 4.4Å; I130-F249 HydrophobicContact CG2-CZ 3.67Å |
| 131 | G | 97.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.1 | -42.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | Q127 Y128 F133 M134 L135 A246 | Q127-G131 PolarHBondContact O-N 3.33Å; Y128-G131 PolarHBondContact O-N 3.26Å; G131-F133 VanDerWaalsContact C-N 3.33Å; G131-F133 PolarHBondContact O-N 2.89Å; G131-M134 PolarHBondContact O-N 3.24Å; G131-L135 WeakPolarHBondContact O-CB 3.37Å; G131-L135 PolarHBondContact O-N 3.18Å; G131-A246 WeakPolarHBondContact O-CB 3.5Å |
| 132 | L | 97.3 | Very high | 94.2 | Very high | 95 Ų | 95 | 42.4 Ų | 42.4 | 50% | 0.497 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -64.3 | -39 | 174.6 | -177.5 | 63.2 | 0 | 0 | 0 | 111.7 | Y128 L129 I130 L135 F136 F250 | Y128-L132 WeakPolarHBondContact O-CB 3.44Å; Y128-L132 PolarHBondContact O-N 2.98Å; L129-L132 PolarHBondContact O-N 3.12Å; I130-L132 PolarHBondContact O-N 3.35Å; L132-L135 PolarHBondContact O-N 3.49Å; L132-F136 WeakPolarHBondContact O-CB 3.37Å; L132-F136 PolarHBondContact O-N 3.27Å; L132-F250 HydrophobicContact CB-CZ 4.26Å |
| 133 | F | 95.6 | Very high | 93.5 | Very high | 39 Ų | 39 | 43.3 Ų | 43.3 | 17% | 0.171 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.9 | -43.7 | 176.4 | -155.1 | -77.4 | 0 | 0 | 0 | 111.2 | L129 I130 G131 F136 L137 I163 A166 F167 L170 | L129-F133 VanDerWaalsContact O-CB 3.25Å; L129-F133 WeakPolarHBondContact O-CB 3.25Å; L129-F133 PolarHBondContact O-N 2.91Å; I130-F133 WeakPolarHBondContact O-CB 3.36Å; I130-F133 PolarHBondContact O-N 3.29Å; G131-F133 VanDerWaalsContact C-N 3.33Å; G131-F133 PolarHBondContact O-N 2.89Å; F133-F136 PolarHBondContact O-N 3Å; F133-L137 HydrophobicContact CD1-CD1 3.65Å; F133-L137 HydrophobicContact CD1-CG 3.8Å; F133-L137 HydrophobicContact CE1-CD1 3.72Å; F133-L137 HydrophobicContact CE1-CD2 4.17Å; F133-L137 HydrophobicContact CE1-CG 3.81Å; F133-L137 WeakPolarHBondContact O-CB 3.31Å; F133-L137 WeakPolarHBondContact O-CG 3.37Å; F133-L137 PolarHBondContact O-N 3.02Å; F133-I163 HydrophobicContact CE1-CG2 3.55Å; F133-I163 HydrophobicContact CZ-CB 4.36Å; F133-I163 HydrophobicContact CZ-CG2 3.6Å; F133-I163 WeakPolarHBondContact CZ-O 3.32Å; F133-A166 HydrophobicContact CE2-CB 4.07Å; F133-A166 HydrophobicContact CZ-CB 4.27Å; F133-F167 HydrophobicContact CB-CD2 4.1Å; F133-F167 HydrophobicContact CB-CE2 4.47Å; F133-F167 HydrophobicContact CD1-CB 3.87Å; F133-F167 AromaticContact CD1-CD2 3.54Å; F133-F167 HydrophobicContact CD1-CD2 3.54Å; F133-F167 HydrophobicContact CD1-CE2 4.3Å; F133-F167 AromaticContact CD1-CG 3.92Å; F133-F167 HydrophobicContact CD1-CG 3.92Å; F133-F167 HydrophobicContact CE1-CB 3.65Å; F133-F167 HydrophobicContact CE1-CD2 4.21Å; F133-F167 HydrophobicContact CE1-CG 4.14Å; F133-F167 AromaticContact CG-CD2 3.95Å; F133-F167 HydrophobicContact CG-CD2 3.95Å; F133-F167 HydrophobicContact CZ-CB 4.14Å; F133-L170 HydrophobicContact CD2-CD1 4.25Å |
| 134 | M | 95.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.7 | -42.3 | 173.5 | -72.7 | 178.9 | 171.6 | 0 | 0 | 111.8 | I66 P67 L70 I130 G131 L137 S138 F167 L242 W245 A246 F249 | I66-M134 HydrophobicContact CG2-CE 3.89Å; P67-M134 HydrophobicContact CG-CE 3.87Å; L70-M134 HydrophobicContact CD1-CE 4.26Å; I130-M134 HydrophobicContact CG2-CE 4.07Å; I130-M134 HydrophobicContact CG2-SD 4.45Å; I130-M134 WeakPolarHBondContact O-CG 3.29Å; I130-M134 PolarHBondContact O-N 2.88Å; G131-M134 PolarHBondContact O-N 3.24Å; M134-L137 PolarHBondContact O-N 3.36Å; M134-S138 WeakPolarHBondContact O-CB 3.48Å; M134-S138 PolarHBondContact O-N 3.35Å; M134-F167 HydrophobicContact CE-CE2 4.13Å; M134-F167 HydrophobicContact CE-CZ 3.6Å; M134-F167 HydrophobicContact CG-CE2 3.77Å; M134-F167 HydrophobicContact CG-CZ 3.8Å; M134-L242 HydrophobicContact CB-CD2 4.4Å; M134-L242 HydrophobicContact CG-CD2 4.26Å; M134-W245 HydrophobicContact CE-CB 4.25Å; M134-W245 HydrophobicContact SD-CB 3.66Å; M134-A246 HydrophobicContact CB-CB 3.81Å; M134-F249 HydrophobicContact CE-CD2 4.05Å; M134-F249 HydrophobicContact CE-CE2 3.55Å; M134-F249 HydrophobicContact CE-CZ 4.06Å; M134-F249 HydrophobicContact SD-CD2 3.81Å; M134-F249 HydrophobicContact SD-CE2 3.96Å; M134-F249 HydrophobicContact SD-CG 4.46Å |
| 135 | L | 96.6 | Very high | 91.6 | Very high | 65 Ų | 65 | 44.2 Ų | 44.2 | 34% | 0.34 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -63.2 | -42.4 | 176.3 | -177.2 | 60.9 | 0 | 0 | 0 | 111.7 | G131 L132 S138 S139 Y243 A246 F250 | G131-L135 WeakPolarHBondContact O-CB 3.37Å; G131-L135 PolarHBondContact O-N 3.18Å; L132-L135 PolarHBondContact O-N 3.49Å; L135-S138 WeakPolarHBondContact O-CB 3.16Å; L135-S138 PolarHBondContact O-N 2.93Å; L135-S139 PolarHBondContact O-N 2.85Å; L135-Y243 HydrophobicContact CD1-CD2 3.55Å; L135-Y243 HydrophobicContact CD1-CE2 3.68Å; L135-A246 HydrophobicContact CB-CB 3.96Å; L135-F250 HydrophobicContact CD2-CE2 4.4Å |
| 136 | F | 94.8 | Very high | 90.1 | Very high | 95 Ų | 95 | 42.2 Ų | 42.2 | 42% | 0.417 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.4 | -49.1 | 174.3 | 171.1 | -100.7 | 0 | 0 | 0 | 111.5 | L132 F133 S138 S139 K140 F144 | L132-F136 WeakPolarHBondContact O-CB 3.37Å; L132-F136 PolarHBondContact O-N 3.27Å; F133-F136 PolarHBondContact O-N 3Å; F136-S138 VanDerWaalsContact C-N 3.32Å; F136-S138 PolarHBondContact O-N 3.29Å; F136-S139 PolarHBondContact O-N 3.46Å; F136-S139 VanDerWaalsContact O-N 3.13Å; F136-S139 PolarHBondContact O-OG 2.99Å; F136-K140 HydrophobicContact CD2-CG 4.39Å; F136-K140 HydrophobicContact CE1-CG 4.49Å; F136-K140 HydrophobicContact CE2-CG 3.89Å; F136-K140 HydrophobicContact CZ-CG 3.95Å; F136-K140 PolarHBondContact O-N 3.14Å; F136-F144 HydrophobicContact CE1-CE2 4.32Å; F136-F144 HydrophobicContact CE1-CZ 4.47Å; F136-F144 HydrophobicContact CZ-CZ 4.44Å |
| 137 | L | 92.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.3 | -43.8 | 177.3 | -77.9 | 179.2 | 0 | 0 | 0 | 111.4 | F133 M134 S139 K140 V141 I163 F164 L242 | F133-L137 HydrophobicContact CD1-CD1 3.65Å; F133-L137 HydrophobicContact CD1-CG 3.8Å; F133-L137 HydrophobicContact CE1-CD1 3.72Å; F133-L137 HydrophobicContact CE1-CD2 4.17Å; F133-L137 HydrophobicContact CE1-CG 3.81Å; F133-L137 WeakPolarHBondContact O-CB 3.31Å; F133-L137 WeakPolarHBondContact O-CG 3.37Å; F133-L137 PolarHBondContact O-N 3.02Å; M134-L137 PolarHBondContact O-N 3.36Å; L137-S139 PolarHBondContact O-N 2.91Å; L137-S139 VanDerWaalsContact O-N 3.11Å; L137-K140 CarbonylContact O-C 3.38Å; L137-K140 PolarHBondContact O-N 2.68Å; L137-V141 WeakPolarHBondContact O-CA 3.34Å; L137-V141 WeakPolarHBondContact O-CB 3.45Å; L137-V141 WeakPolarHBondContact O-CG1 3.2Å; L137-V141 PolarHBondContact O-N 3.37Å; L137-I163 HydrophobicContact CD2-CG2 3.52Å; L137-I163 HydrophobicContact CG-CG2 4.47Å; L137-F164 HydrophobicContact CD1-CZ 4.36Å; L137-L242 HydrophobicContact CB-CD1 3.84Å; L137-L242 HydrophobicContact CB-CD2 4.48Å; L137-L242 HydrophobicContact CD1-CD2 4.46Å |
| 138 | S | 93.8 | Very high | 86.3 | Confident | 18 Ų | 18 | 54.6 Ų | 54.6 | 13% | 0.126 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -51.4 | -37.7 | 176.7 | 171.6 | 0 | 0 | 0 | 0 | 112.7 | M134 L135 F136 S239 Y243 | M134-S138 WeakPolarHBondContact O-CB 3.48Å; M134-S138 PolarHBondContact O-N 3.35Å; L135-S138 WeakPolarHBondContact O-CB 3.16Å; L135-S138 PolarHBondContact O-N 2.93Å; F136-S138 VanDerWaalsContact C-N 3.32Å; F136-S138 PolarHBondContact O-N 3.29Å; S138-S239 VanDerWaalsContact CB-O 3.3Å; S138-S239 WeakPolarHBondContact CB-O 3.47Å; S138-S239 VanDerWaalsContact O-CB 3.24Å; S138-S239 WeakPolarHBondContact O-CB 3.47Å; S138-S239 PolarHBondContact O-OG 2.83Å; S138-S239 PolarHBondContact OG-O 2.93Å; S138-Y243 WeakPolarHBondContact OG-CB 3.45Å |
| 139 | S | 91.4 | Very high | 84 | Confident | 84 Ų | 84 | 54.9 Ų | 54.9 | 59% | 0.587 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -83.4 | -14.4 | 179.4 | 71.8 | 0 | 0 | 0 | 0 | 115.4 | L135 F136 L137 | L135-S139 PolarHBondContact O-N 2.85Å; F136-S139 PolarHBondContact O-N 3.46Å; F136-S139 VanDerWaalsContact O-N 3.13Å; F136-S139 PolarHBondContact O-OG 2.99Å; L137-S139 PolarHBondContact O-N 2.91Å; L137-S139 VanDerWaalsContact O-N 3.11Å |
| 140 | K | 88.4 | Confident | 81.9 | Confident | 96 Ų | 96 | 52.7 Ų | 52.7 | 42% | 0.417 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -124.1 | -14.5 | -170.2 | -66.1 | -60.6 | -178.5 | -173.7 | 0 | 114.3 | F136 L137 D142 S143 F144 | F136-K140 HydrophobicContact CD2-CG 4.39Å; F136-K140 HydrophobicContact CE1-CG 4.49Å; F136-K140 HydrophobicContact CE2-CG 3.89Å; F136-K140 HydrophobicContact CZ-CG 3.95Å; F136-K140 PolarHBondContact O-N 3.14Å; L137-K140 CarbonylContact O-C 3.38Å; L137-K140 PolarHBondContact O-N 2.68Å; K140-D142 VanDerWaalsContact C-N 3.33Å; K140-D142 PolarHBondContact O-N 3.19Å; K140-S143 CarbonylContact O-C 3.5Å; K140-S143 WeakPolarHBondContact O-CA 2.97Å; K140-S143 WeakPolarHBondContact O-CB 3.4Å; K140-S143 PolarHBondContact O-N 2.98Å; K140-F144 HydrophobicContact CB-CD2 4.06Å; K140-F144 HydrophobicContact CB-CE1 4.35Å; K140-F144 HydrophobicContact CB-CE2 3.49Å; K140-F144 VanDerWaalsContact CB-CE2 3.49Å; K140-F144 HydrophobicContact CB-CZ 3.67Å; K140-F144 HydrophobicContact CG-CE2 4.46Å; K140-F144 HydrophobicContact CG-CZ 4.28Å; K140-F144 WeakPolarHBondContact O-CD2 3.34Å; K140-F144 WeakPolarHBondContact O-CG 3.42Å; K140-F144 PolarHBondContact O-N 3.45Å |
| 141 | V | 83.9 | Confident | 79.7 | Confident | 1 Ų | 1 | 62.1 Ų | 62.1 | 1% | 0.006 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.3 | -39.3 | -171.3 | 68.6 | 0 | 0 | 0 | 0 | 111.6 | L137 S143 F144 L145 L238 S239 L242 | L137-V141 WeakPolarHBondContact O-CA 3.34Å; L137-V141 WeakPolarHBondContact O-CB 3.45Å; L137-V141 WeakPolarHBondContact O-CG1 3.2Å; L137-V141 PolarHBondContact O-N 3.37Å; V141-S143 VanDerWaalsContact C-N 3.25Å; V141-S143 PolarHBondContact O-N 3.45Å; V141-F144 PolarHBondContact O-N 2.86Å; V141-L145 HydrophobicContact CG2-CD1 3.9Å; V141-L145 HydrophobicContact CG2-CG 4.11Å; V141-L145 WeakPolarHBondContact O-CB 3.11Å; V141-L145 WeakPolarHBondContact O-CG 3.47Å; V141-L145 PolarHBondContact O-N 3.39Å; V141-L238 HydrophobicContact CB-CD2 4.48Å; V141-L238 HydrophobicContact CG1-CD2 4.32Å; V141-L238 HydrophobicContact CG1-CG 4.14Å; V141-L238 HydrophobicContact CG2-CD2 3.41Å; V141-L238 VanDerWaalsContact CG2-CD2 3.41Å; V141-L238 HydrophobicContact CG2-CG 4.05Å; V141-S239 WeakPolarHBondContact CG1-OG 3.41Å; V141-L242 HydrophobicContact CB-CD1 4.31Å; V141-L242 HydrophobicContact CG1-CD1 4.08Å |
| 142 | D | 81 | Confident | 77.5 | Confident | 96 Ų | 96 | 69.8 Ų | 69.8 | 51% | 0.513 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60.5 | -38 | 175 | -60.1 | -35 | 0 | 0 | 0 | 111.3 | K140 G146 S239 | K140-D142 VanDerWaalsContact C-N 3.33Å; K140-D142 PolarHBondContact O-N 3.19Å; D142-G146 PolarHBondContact O-N 3.27Å; D142-S239 PolarHBondContact OD1-OG 2.85Å; D142-S239 VanDerWaalsContact OD1-OG 3.12Å; D142-S239 PolarHBondContact OD2-OG 3.04Å |
| 143 | S | 79.8 | Confident | 75.5 | Confident | 91 Ų | 91 | 68.1 Ų | 68.1 | 64% | 0.636 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -71.1 | -27.7 | 174.4 | 175.3 | 0 | 0 | 0 | 0 | 113.4 | K140 V141 | K140-S143 CarbonylContact O-C 3.5Å; K140-S143 WeakPolarHBondContact O-CA 2.97Å; K140-S143 WeakPolarHBondContact O-CB 3.4Å; K140-S143 PolarHBondContact O-N 2.98Å; V141-S143 VanDerWaalsContact C-N 3.25Å; V141-S143 PolarHBondContact O-N 3.45Å |
| 144 | F | 78.1 | Confident | 74.1 | Confident | 27 Ų | 27 | 71.1 Ų | 71.1 | 12% | 0.118 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -85.5 | -34.6 | 179.9 | -64.4 | -29.6 | 0 | 0 | 0 | 113 | F136 K140 V141 G146 K159 L160 I163 | F136-F144 HydrophobicContact CE1-CE2 4.32Å; F136-F144 HydrophobicContact CE1-CZ 4.47Å; F136-F144 HydrophobicContact CZ-CZ 4.44Å; K140-F144 HydrophobicContact CB-CD2 4.06Å; K140-F144 HydrophobicContact CB-CE1 4.35Å; K140-F144 HydrophobicContact CB-CE2 3.49Å; K140-F144 VanDerWaalsContact CB-CE2 3.49Å; K140-F144 HydrophobicContact CB-CZ 3.67Å; K140-F144 HydrophobicContact CG-CE2 4.46Å; K140-F144 HydrophobicContact CG-CZ 4.28Å; K140-F144 WeakPolarHBondContact O-CD2 3.34Å; K140-F144 WeakPolarHBondContact O-CG 3.42Å; K140-F144 PolarHBondContact O-N 3.45Å; V141-F144 PolarHBondContact O-N 2.86Å; F144-G146 VanDerWaalsContact C-N 3.26Å; F144-K159 HydrophobicContact CD1-CD 4.47Å; F144-K159 HydrophobicContact CE1-CD 4.27Å; F144-K159 VanDerWaalsContact CE1-CE 3.45Å; F144-L160 HydrophobicContact CB-CD1 4.39Å; F144-I163 HydrophobicContact CD2-CD1 4.05Å; F144-I163 HydrophobicContact CE2-CD1 3.54Å; F144-I163 HydrophobicContact CZ-CD1 3.83Å |
| 145 | L | 74.1 | Confident | 72.8 | Confident | 7 Ų | 7 | 72 Ų | 72 | 4% | 0.037 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -69.8 | -29.3 | 174.1 | -69.6 | 174.2 | 0 | 0 | 0 | 110.8 | V77 L78 R81 V141 L238 | V77-L145 HydrophobicContact CG1-CD1 4.35Å; L78-L145 HydrophobicContact CD2-CD2 3.55Å; L78-L145 HydrophobicContact CG-CD2 4.19Å; R81-L145 PolarHBondContact NH1-O 3Å; V141-L145 HydrophobicContact CG2-CD1 3.9Å; V141-L145 HydrophobicContact CG2-CG 4.11Å; V141-L145 WeakPolarHBondContact O-CB 3.11Å; V141-L145 WeakPolarHBondContact O-CG 3.47Å; V141-L145 PolarHBondContact O-N 3.39Å; L145-L238 HydrophobicContact CD1-CD2 3.77Å |
| 146 | G | 64.7 | Low | 71.9 | Confident | 19 Ų | 19 | 73.2 Ų | 73.2 | 20% | 0.196 | 43% | 0.426 | C | S | . | . | trans | 84.8 | 174.8 | -174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | R81 D142 F144 | R81-G146 VanDerWaalsContact NH1-C 3.35Å; R81-G146 PolarHBondContact NH1-O 3.42Å; D142-G146 PolarHBondContact O-N 3.27Å; F144-G146 VanDerWaalsContact C-N 3.26Å | ||
| 147 | D | 58.7 | Low | 71.2 | Confident | 124 Ų | 124 | 69.7 Ų | 69.7 | 66% | 0.663 | 41% | 0.411 | S | S | * | . | trans | -87.7 | 135.5 | 176 | -152 | -9.7 | 0 | 0 | 0 | 109.9 | G149 A150 | D147-G149 PolarHBondContact O-N 3.17Å; D147-G149 VanDerWaalsContact O-N 3.12Å; D147-A150 HydrophobicContact CB-CB 4.19Å; D147-A150 PolarHBondContact O-N 3.5Å | ||
| 148 | E | 54.8 | Low | 70.9 | Confident | 141 Ų | 141 | 77.8 Ų | 77.8 | 66% | 0.659 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -24.1 | -176.4 | -68.3 | -168.8 | 161.8 | 0 | 0 | 112.8 | R81 | R81-E148 IonicContact NH2-OE1 3.87Å; R81-E148 PolarHBondContact NH2-OE1 2.77Å |
| 149 | G | 50.6 | Low | 70.7 | Confident | 70 Ų | 70 | 81.5 Ų | 81.5 | 72% | 0.722 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.4 | -5.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | D147 E151 | D147-G149 PolarHBondContact O-N 3.17Å; D147-G149 VanDerWaalsContact O-N 3.12Å; G149-E151 PolarHBondContact O-N 3.43Å |
| 150 | A | 52.4 | Low | 70.5 | Confident | 39 Ų | 39 | 77.7 Ų | 77.7 | 32% | 0.322 | 43% | 0.433 | S | S | . | . | trans | -92.2 | 95.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | D147 N152 S153 | D147-A150 HydrophobicContact CB-CB 4.19Å; D147-A150 PolarHBondContact O-N 3.5Å; A150-N152 PolarHBondContact O-N 3.02Å; A150-S153 WeakPolarHBondContact CB-OG 3.32Å; A150-S153 PolarHBondContact O-N 3.45Å | ||
| 151 | E | 51.6 | Low | 70.6 | Confident | 197 Ų | 197 | 74 Ų | 74 | 92% | 0.921 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50 | -24.4 | 177.6 | -70.6 | -173.1 | 160.9 | 0 | 0 | 114 | G149 | G149-E151 PolarHBondContact O-N 3.43Š|
| 152 | N | 50.7 | Low | 71 | Confident | 162 Ų | 162 | 76.4 Ų | 76.4 | 87% | 0.866 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.8 | 3.2 | 179.3 | -75.6 | -24.2 | 0 | 0 | 0 | 115.2 | A150 S154 | A150-N152 PolarHBondContact O-N 3.02Å; N152-S154 PolarHBondContact O-N 3.17Å |
| 153 | S | 56.6 | Low | 71.6 | Confident | 60 Ų | 60 | 73 Ų | 73 | 42% | 0.42 | 42% | 0.42 | S | S | . | . | trans | -98 | 69.7 | 177.2 | -64.4 | 0 | 0 | 0 | 0 | 110.8 | A150 P155 | A150-S153 WeakPolarHBondContact CB-OG 3.32Å; A150-S153 PolarHBondContact O-N 3.45Å; S153-P155 WeakPolarHBondContact O-CD 3.36Å | ||
| 154 | S | 64.4 | Low | 72.2 | Confident | 102 Ų | 102 | 68.9 Ų | 68.9 | 71% | 0.713 | 39% | 0.391 | S | S | * | . | trans | -63.2 | 123.5 | 168.4 | 59.8 | 0 | 0 | 0 | 0 | 109 | N152 D156 | N152-S154 PolarHBondContact O-N 3.17Å; S154-D156 PolarHBondContact O-N 3.34Å | ||
| 155 | P | 68.6 | Low | 73 | Confident | 19 Ų | 19 | 71.5 Ų | 71.5 | 12% | 0.123 | 40% | 0.403 | C | S | . | . | trans | -57.9 | 134.1 | 176.6 | 20.5 | -29.9 | 0 | 0 | 0 | 110 | L78 V83 S153 L157 | L78-P155 HydrophobicContact CD2-CB 4.36Å; L78-P155 HydrophobicContact CD2-CG 4.15Å; V83-P155 HydrophobicContact CG2-CG 4.2Å; S153-P155 WeakPolarHBondContact O-CD 3.36Å; P155-L157 VanDerWaalsContact C-N 3.27Å; P155-L157 PolarHBondContact O-N 3.14Å | ||
| 156 | D | 77.9 | Confident | 74 | Confident | 89 Ų | 89 | 73.1 Ų | 73.1 | 48% | 0.476 | 42% | 0.417 | S | S | . | . | trans | -72.5 | 88.2 | 174.6 | -176.8 | -12.8 | 0 | 0 | 0 | 108.9 | S154 F158 K159 L160 | S154-D156 PolarHBondContact O-N 3.34Å; D156-F158 VanDerWaalsContact C-N 3.28Å; D156-F158 PolarHBondContact O-N 3.04Å; D156-F158 PolarHBondContact OD1-N 3.44Å; D156-K159 HydrophobicContact CB-CB 3.98Å; D156-K159 PolarHBondContact O-N 3.45Å; D156-K159 PolarHBondContact OD1-N 3.43Å; D156-K159 WeakPolarHBondContact OD2-CB 3.31Å; D156-L160 PolarHBondContact O-N 3.22Å | ||
| 157 | L | 81.4 | Confident | 75.5 | Confident | 21 Ų | 21 | 72.2 Ų | 72.2 | 11% | 0.11 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -61.9 | -37.1 | -176.9 | -173.4 | 77.3 | 0 | 0 | 0 | 112 | Q87 A90 F91 P155 K159 L160 T161 | Q87-L157 VanDerWaalsContact CA-CD2 3.45Å; Q87-L157 HydrophobicContact CB-CD2 3.54Å; Q87-L157 HydrophobicContact CG-CD2 3.69Å; Q87-L157 WeakPolarHBondContact O-CD2 3.49Å; A90-L157 HydrophobicContact CB-CD2 3.97Å; F91-L157 HydrophobicContact CB-CD1 4.16Å; F91-L157 HydrophobicContact CD2-CD1 4.48Å; P155-L157 VanDerWaalsContact C-N 3.27Å; P155-L157 PolarHBondContact O-N 3.14Å; L157-K159 VanDerWaalsContact C-N 3.32Å; L157-K159 PolarHBondContact O-N 3.13Å; L157-L160 PolarHBondContact O-N 3.06Å; L157-T161 WeakPolarHBondContact O-CB 3.49Å; L157-T161 PolarHBondContact O-N 3Å; L157-T161 PolarHBondContact O-OG1 3.03Å |
| 158 | F | 86.5 | Confident | 77.2 | Confident | 171 Ų | 171 | 66.3 Ų | 66.3 | 75% | 0.75 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -62.8 | -45.1 | -179.7 | 178.1 | -98.4 | 0 | 0 | 0 | 110.3 | D156 T161 A162 | D156-F158 VanDerWaalsContact C-N 3.28Å; D156-F158 PolarHBondContact O-N 3.04Å; D156-F158 PolarHBondContact OD1-N 3.44Å; F158-T161 PolarHBondContact O-N 3.42Å; F158-A162 WeakPolarHBondContact O-CB 3.49Å; F158-A162 PolarHBondContact O-N 2.77Å |
| 159 | K | 88 | Confident | 79.2 | Confident | 95 Ų | 95 | 63.5 Ų | 63.5 | 41% | 0.413 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -62.1 | -43.5 | 174.6 | -173.6 | 176.6 | -175.6 | 177.1 | 0 | 111.9 | F144 D156 L157 A162 I163 | F144-K159 HydrophobicContact CD1-CD 4.47Å; F144-K159 HydrophobicContact CE1-CD 4.27Å; F144-K159 VanDerWaalsContact CE1-CE 3.45Å; D156-K159 HydrophobicContact CB-CB 3.98Å; D156-K159 PolarHBondContact O-N 3.45Å; D156-K159 PolarHBondContact OD1-N 3.43Å; D156-K159 WeakPolarHBondContact OD2-CB 3.31Å; L157-K159 VanDerWaalsContact C-N 3.32Å; L157-K159 PolarHBondContact O-N 3.13Å; K159-A162 PolarHBondContact O-N 3.4Å; K159-I163 HydrophobicContact CG-CD1 3.87Å; K159-I163 WeakPolarHBondContact O-CB 3.43Å; K159-I163 WeakPolarHBondContact O-CG1 3.34Å; K159-I163 PolarHBondContact O-N 3.4Å |
| 160 | L | 87.7 | Confident | 81.4 | Confident | 4 Ų | 4 | 61.5 Ų | 61.5 | 2% | 0.021 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -62.4 | -48 | 178 | -164.3 | 70.7 | 0 | 0 | 0 | 111.6 | I74 L78 F91 F144 D156 L157 A162 I163 F164 | I74-L160 HydrophobicContact CG2-CD2 3.63Å; I74-L160 HydrophobicContact CG2-CG 4.47Å; L78-L160 HydrophobicContact CD1-CD2 3.63Å; F91-L160 HydrophobicContact CD2-CD2 4.3Å; F91-L160 HydrophobicContact CD2-CG 4.4Å; F91-L160 HydrophobicContact CE2-CD2 4.09Å; F91-L160 HydrophobicContact CE2-CG 3.94Å; F144-L160 HydrophobicContact CB-CD1 4.39Å; D156-L160 PolarHBondContact O-N 3.22Å; L157-L160 PolarHBondContact O-N 3.06Å; L160-A162 PolarHBondContact O-N 3.32Å; L160-I163 PolarHBondContact O-N 2.84Å; L160-F164 HydrophobicContact CD1-CD2 3.94Å; L160-F164 HydrophobicContact CD1-CE2 3.7Å; L160-F164 HydrophobicContact CG-CD2 4.01Å; L160-F164 HydrophobicContact CG-CE2 4.19Å; L160-F164 WeakPolarHBondContact O-CD2 3.41Å; L160-F164 PolarHBondContact O-N 3.01Å |
| 161 | T | 91.3 | Very high | 83.5 | Confident | 20 Ų | 20 | 59.7 Ų | 59.7 | 12% | 0.123 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -59.4 | -44.8 | 175.9 | -59.9 | 0 | 0 | 0 | 0 | 111.1 | A90 F91 F93 L157 F158 I163 F164 F165 | A90-T161 WeakPolarHBondContact O-CG2 3.19Å; A90-T161 PolarHBondContact O-OG1 3.44Å; F91-T161 WeakPolarHBondContact CA-OG1 3.43Å; F93-T161 HydrophobicContact CB-CG2 4.22Å; L157-T161 WeakPolarHBondContact O-CB 3.49Å; L157-T161 PolarHBondContact O-N 3Å; L157-T161 PolarHBondContact O-OG1 3.03Å; F158-T161 PolarHBondContact O-N 3.42Å; T161-I163 PolarHBondContact O-N 2.83Å; T161-F164 PolarHBondContact O-N 3.45Å; T161-F165 WeakPolarHBondContact O-CB 3.4Å; T161-F165 PolarHBondContact O-N 3.47Å |
| 162 | A | 92.9 | Very high | 85.7 | Confident | 50 Ų | 50 | 50.3 Ų | 50.3 | 41% | 0.413 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -63.5 | -41.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | F158 K159 L160 A166 | F158-A162 WeakPolarHBondContact O-CB 3.49Å; F158-A162 PolarHBondContact O-N 2.77Å; K159-A162 PolarHBondContact O-N 3.4Å; L160-A162 PolarHBondContact O-N 3.32Å; A162-A166 PolarHBondContact O-N 3.13Å |
| 163 | I | 92.3 | Very high | 87.9 | Confident | 24 Ų | 24 | 42.8 Ų | 42.8 | 12% | 0.123 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64.1 | -51.4 | 176.6 | -73.2 | 171.8 | 0 | 0 | 0 | 110.3 | F133 L137 F144 K159 L160 T161 F165 A166 F167 | F133-I163 HydrophobicContact CE1-CG2 3.55Å; F133-I163 HydrophobicContact CZ-CB 4.36Å; F133-I163 HydrophobicContact CZ-CG2 3.6Å; F133-I163 WeakPolarHBondContact CZ-O 3.32Å; L137-I163 HydrophobicContact CD2-CG2 3.52Å; L137-I163 HydrophobicContact CG-CG2 4.47Å; F144-I163 HydrophobicContact CD2-CD1 4.05Å; F144-I163 HydrophobicContact CE2-CD1 3.54Å; F144-I163 HydrophobicContact CZ-CD1 3.83Å; K159-I163 HydrophobicContact CG-CD1 3.87Å; K159-I163 WeakPolarHBondContact O-CB 3.43Å; K159-I163 WeakPolarHBondContact O-CG1 3.34Å; K159-I163 PolarHBondContact O-N 3.4Å; L160-I163 PolarHBondContact O-N 2.84Å; T161-I163 PolarHBondContact O-N 2.83Å; I163-F165 VanDerWaalsContact C-N 3.3Å; I163-F165 PolarHBondContact O-N 2.89Å; I163-A166 PolarHBondContact O-N 2.85Å; I163-F167 PolarHBondContact O-N 3.15Å |
| 164 | F | 92.7 | Very high | 89.8 | Confident | 5 Ų | 5 | 40 Ų | 40 | 2% | 0.022 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -69.6 | -27.5 | 179.4 | -84.7 | -89.3 | 0 | 0 | 0 | 113 | T71 I74 F91 A94 L137 L160 T161 F167 N168 | T71-F164 HydrophobicContact CG2-CB 4.3Å; T71-F164 HydrophobicContact CG2-CD1 3.82Å; T71-F164 HydrophobicContact CG2-CG 4.41Å; T71-F164 WeakPolarHBondContact OG1-CD1 3.42Å; I74-F164 HydrophobicContact CD1-CE1 4.25Å; I74-F164 HydrophobicContact CD1-CE2 4.17Å; I74-F164 HydrophobicContact CD1-CZ 3.6Å; I74-F164 HydrophobicContact CG1-CD1 4.43Å; I74-F164 HydrophobicContact CG1-CE1 3.72Å; I74-F164 HydrophobicContact CG1-CE2 3.93Å; I74-F164 HydrophobicContact CG1-CZ 3.44Å; I74-F164 VanDerWaalsContact CG1-CZ 3.44Å; F91-F164 HydrophobicContact CE2-CB 3.85Å; F91-F164 AromaticContact CE2-CD2 3.9Å; F91-F164 HydrophobicContact CE2-CD2 3.9Å; F91-F164 AromaticContact CE2-CG 3.93Å; F91-F164 HydrophobicContact CE2-CG 3.93Å; F91-F164 HydrophobicContact CZ-CB 3.87Å; F91-F164 HydrophobicContact CZ-CD1 4.17Å; F91-F164 HydrophobicContact CZ-CD2 4.03Å; F91-F164 AromaticContact CZ-CG 3.74Å; F91-F164 HydrophobicContact CZ-CG 3.74Å; A94-F164 HydrophobicContact CB-CB 3.8Å; L137-F164 HydrophobicContact CD1-CZ 4.36Å; L160-F164 HydrophobicContact CD1-CD2 3.94Å; L160-F164 HydrophobicContact CD1-CE2 3.7Å; L160-F164 HydrophobicContact CG-CD2 4.01Å; L160-F164 HydrophobicContact CG-CE2 4.19Å; L160-F164 WeakPolarHBondContact O-CD2 3.41Å; L160-F164 PolarHBondContact O-N 3.01Å; T161-F164 PolarHBondContact O-N 3.45Å; F164-F167 HydrophobicContact CD1-CD1 4.02Å; F164-F167 HydrophobicContact CE1-CD1 4.23Å; F164-F167 PolarHBondContact O-N 3.32Å; F164-N168 WeakPolarHBondContact O-CB 3.2Å; F164-N168 PolarHBondContact O-N 3.1Å; F164-N168 PolarHBondContact O-ND2 3.24Å |
| 165 | F | 95.3 | Very high | 91.3 | Very high | 83 Ų | 83 | 35.2 Ų | 35.2 | 36% | 0.364 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -63 | -47.4 | 169.5 | -178.8 | -84 | 0 | 0 | 0 | 110.9 | F93 W96 P97 T161 I163 F167 N168 F169 | F93-F165 WeakPolarHBondContact O-CD2 3.23Å; W96-F165 HydrophobicContact CB-CE2 4.36Å; P97-F165 HydrophobicContact CG-CD1 4.43Å; P97-F165 HydrophobicContact CG-CD2 3.83Å; P97-F165 HydrophobicContact CG-CE1 4.3Å; P97-F165 HydrophobicContact CG-CE2 3.71Å; P97-F165 HydrophobicContact CG-CG 4.2Å; P97-F165 HydrophobicContact CG-CZ 3.95Å; T161-F165 WeakPolarHBondContact O-CB 3.4Å; T161-F165 PolarHBondContact O-N 3.47Å; I163-F165 VanDerWaalsContact C-N 3.3Å; I163-F165 PolarHBondContact O-N 2.89Å; F165-F167 VanDerWaalsContact C-N 3.32Å; F165-F167 PolarHBondContact O-N 2.94Å; F165-N168 PolarHBondContact O-N 3.04Å; F165-F169 VanDerWaalsContact O-CB 3.31Å; F165-F169 WeakPolarHBondContact O-CB 3.35Å; F165-F169 PolarHBondContact O-N 3.45Å |
| 166 | A | 95.7 | Very high | 92.6 | Very high | 41 Ų | 41 | 34.9 Ų | 34.9 | 34% | 0.339 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -63.1 | -40.1 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | F133 A162 I163 F169 L170 | F133-A166 HydrophobicContact CE2-CB 4.07Å; F133-A166 HydrophobicContact CZ-CB 4.27Å; A162-A166 PolarHBondContact O-N 3.13Å; I163-A166 PolarHBondContact O-N 2.85Å; A166-F169 WeakPolarHBondContact O-CB 3.38Å; A166-F169 PolarHBondContact O-N 3.26Å; A166-L170 WeakPolarHBondContact O-CG 3.45Å; A166-L170 PolarHBondContact O-N 2.92Å; A166-L170 VanDerWaalsContact O-N 3.13Å |
| 167 | F | 94.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.3 | -49.3 | 175.6 | -174 | -133.8 | 0 | 0 | 0 | 112.3 | P67 I130 F133 M134 I163 F164 F165 F169 L170 A171 | P67-F167 HydrophobicContact CB-CD1 4.24Å; P67-F167 HydrophobicContact CB-CE1 3.57Å; P67-F167 HydrophobicContact CB-CE2 4.26Å; P67-F167 HydrophobicContact CB-CZ 3.58Å; P67-F167 HydrophobicContact CG-CE1 4.35Å; P67-F167 HydrophobicContact CG-CE2 4.34Å; P67-F167 HydrophobicContact CG-CZ 3.86Å; I130-F167 HydrophobicContact CG2-CE2 3.8Å; F133-F167 HydrophobicContact CB-CD2 4.1Å; F133-F167 HydrophobicContact CB-CE2 4.47Å; F133-F167 HydrophobicContact CD1-CB 3.87Å; F133-F167 AromaticContact CD1-CD2 3.54Å; F133-F167 HydrophobicContact CD1-CD2 3.54Å; F133-F167 HydrophobicContact CD1-CE2 4.3Å; F133-F167 AromaticContact CD1-CG 3.92Å; F133-F167 HydrophobicContact CD1-CG 3.92Å; F133-F167 HydrophobicContact CE1-CB 3.65Å; F133-F167 HydrophobicContact CE1-CD2 4.21Å; F133-F167 HydrophobicContact CE1-CG 4.14Å; F133-F167 AromaticContact CG-CD2 3.95Å; F133-F167 HydrophobicContact CG-CD2 3.95Å; F133-F167 HydrophobicContact CZ-CB 4.14Å; M134-F167 HydrophobicContact CE-CE2 4.13Å; M134-F167 HydrophobicContact CE-CZ 3.6Å; M134-F167 HydrophobicContact CG-CE2 3.77Å; M134-F167 HydrophobicContact CG-CZ 3.8Å; I163-F167 PolarHBondContact O-N 3.15Å; F164-F167 HydrophobicContact CD1-CD1 4.02Å; F164-F167 HydrophobicContact CE1-CD1 4.23Å; F164-F167 PolarHBondContact O-N 3.32Å; F165-F167 VanDerWaalsContact C-N 3.32Å; F165-F167 PolarHBondContact O-N 2.94Å; F167-F169 VanDerWaalsContact C-N 3.32Å; F167-F169 PolarHBondContact O-N 3.09Å; F167-L170 PolarHBondContact O-N 3.35Å; F167-A171 PolarHBondContact O-N 2.71Å; F167-A171 VanDerWaalsContact O-N 3.09Å |
| 168 | N | 95.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -69.2 | -29.3 | 176.8 | -79.8 | -73.1 | 0 | 0 | 0 | 112.7 | T71 A94 P97 F98 F164 F165 L170 A171 A172 | T71-N168 VanDerWaalsContact CG2-ND2 3.29Å; T71-N168 WeakPolarHBondContact CG2-ND2 3.29Å; T71-N168 PolarHBondContact OG1-ND2 3.47Å; A94-N168 WeakPolarHBondContact O-CB 3.23Å; A94-N168 PolarHBondContact O-ND2 2.85Å; P97-N168 HydrophobicContact CB-CB 4.43Å; P97-N168 HydrophobicContact CG-CB 4.19Å; F98-N168 HydrophobicContact CD2-CB 4.27Å; F98-N168 HydrophobicContact CE2-CB 4.24Å; F164-N168 WeakPolarHBondContact O-CB 3.2Å; F164-N168 PolarHBondContact O-N 3.1Å; F164-N168 PolarHBondContact O-ND2 3.24Å; F165-N168 PolarHBondContact O-N 3.04Å; N168-L170 VanDerWaalsContact C-N 3.33Å; N168-A171 PolarHBondContact O-N 2.9Å; N168-A172 WeakPolarHBondContact O-CB 3.39Å; N168-A172 PolarHBondContact O-N 3.26Å |
| 169 | F | 96.9 | Very high | 94.5 | Very high | 81 Ų | 81 | 23.8 Ų | 23.8 | 36% | 0.355 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -62.6 | -41.4 | 172.9 | -179.8 | -93.6 | 0 | 0 | 0 | 111.9 | P97 W104 F165 A166 F167 T173 | P97-F169 HydrophobicContact CB-CB 4.07Å; P97-F169 HydrophobicContact CB-CD2 4.37Å; P97-F169 HydrophobicContact CG-CB 4.12Å; W104-F169 AromaticContact CD2-CE2 3.8Å; W104-F169 HydrophobicContact CD2-CE2 3.8Å; W104-F169 HydrophobicContact CD2-CZ 4.35Å; W104-F169 AromaticContact CE2-CE2 3.56Å; W104-F169 HydrophobicContact CE3-CE2 4.04Å; W104-F169 HydrophobicContact CG-CE2 4.39Å; W104-F169 AromaticContact CH2-CD2 3.77Å; W104-F169 HydrophobicContact CH2-CD2 3.77Å; W104-F169 AromaticContact CH2-CE2 3.81Å; W104-F169 HydrophobicContact CH2-CE2 3.81Å; W104-F169 AromaticContact CZ2-CD2 3.65Å; W104-F169 HydrophobicContact CZ2-CD2 3.65Å; W104-F169 AromaticContact CZ2-CE2 3.59Å; W104-F169 HydrophobicContact CZ2-CE2 3.59Å; W104-F169 HydrophobicContact CZ2-CZ 4.47Å; W104-F169 HydrophobicContact CZ3-CD2 4.35Å; W104-F169 HydrophobicContact CZ3-CE2 4.05Å; F165-F169 VanDerWaalsContact O-CB 3.31Å; F165-F169 WeakPolarHBondContact O-CB 3.35Å; F165-F169 PolarHBondContact O-N 3.45Å; A166-F169 WeakPolarHBondContact O-CB 3.38Å; A166-F169 PolarHBondContact O-N 3.26Å; F167-F169 VanDerWaalsContact C-N 3.32Å; F167-F169 PolarHBondContact O-N 3.09Å; F169-T173 WeakPolarHBondContact O-CB 3.16Å; F169-T173 PolarHBondContact O-N 3.22Å; F169-T173 PolarHBondContact O-OG1 2.95Å |
| 170 | L | 96.8 | Very high | 94.6 | Very high | 29 Ų | 29 | 19.7 Ų | 19.7 | 15% | 0.152 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -65.2 | -46 | 173.5 | -66.1 | 171.1 | 0 | 0 | 0 | 111.5 | L129 I130 F133 A166 F167 N168 T173 Q174 | L129-L170 HydrophobicContact CB-CD1 3.94Å; L129-L170 HydrophobicContact CB-CD2 4.07Å; L129-L170 HydrophobicContact CD1-CD2 3.99Å; I130-L170 HydrophobicContact CD1-CB 4.32Å; I130-L170 HydrophobicContact CG1-CB 3.65Å; F133-L170 HydrophobicContact CD2-CD1 4.25Å; A166-L170 WeakPolarHBondContact O-CG 3.45Å; A166-L170 PolarHBondContact O-N 2.92Å; A166-L170 VanDerWaalsContact O-N 3.13Å; F167-L170 PolarHBondContact O-N 3.35Å; N168-L170 VanDerWaalsContact C-N 3.33Å; L170-T173 WeakPolarHBondContact O-CB 2.93Å; L170-T173 PolarHBondContact O-N 3.29Å; L170-Q174 PolarHBondContact O-N 2.9Å |
| 171 | A | 96.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -62.5 | -42.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | P67 F98 I130 F167 N168 T173 Q174 D175 | P67-A171 HydrophobicContact CB-CB 3.82Å; P67-A171 HydrophobicContact CG-CB 4.07Å; F98-A171 HydrophobicContact CE2-CB 3.79Å; F98-A171 HydrophobicContact CZ-CB 3.68Å; I130-A171 HydrophobicContact CD1-CB 4.38Å; F167-A171 PolarHBondContact O-N 2.71Å; F167-A171 VanDerWaalsContact O-N 3.09Å; N168-A171 PolarHBondContact O-N 2.9Å; A171-T173 VanDerWaalsContact C-N 3.33Å; A171-T173 PolarHBondContact O-N 3.16Å; A171-Q174 WeakPolarHBondContact O-CB 3.48Å; A171-Q174 PolarHBondContact O-N 2.83Å; A171-D175 WeakPolarHBondContact O-CB 3.49Å; A171-D175 PolarHBondContact O-N 3.33Å |
| 172 | A | 96.7 | Very high | 94.9 | Very high | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -64.8 | -36.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | P97 F98 K101 W104 N168 D175 I176 | P97-A172 HydrophobicContact CB-CB 4.14Å; F98-A172 HydrophobicContact CD1-CB 4.26Å; F98-A172 HydrophobicContact CD2-CB 3.98Å; F98-A172 HydrophobicContact CE1-CB 4.39Å; F98-A172 HydrophobicContact CE2-CB 4.13Å; F98-A172 HydrophobicContact CG-CB 4.06Å; F98-A172 HydrophobicContact CZ-CB 4.34Å; K101-A172 HydrophobicContact CB-CB 4.22Å; W104-A172 HydrophobicContact CZ2-CB 3.97Å; N168-A172 WeakPolarHBondContact O-CB 3.39Å; N168-A172 PolarHBondContact O-N 3.26Å; A172-D175 WeakPolarHBondContact O-CB 3.45Å; A172-D175 PolarHBondContact O-N 3.12Å; A172-I176 VanDerWaalsContact O-CG1 3.32Å; A172-I176 WeakPolarHBondContact O-CG1 3.34Å; A172-I176 PolarHBondContact O-N 3.3Å; A172-I176 VanDerWaalsContact O-N 3.07Å |
| 173 | T | 97 | Very high | 94.7 | Very high | 5 Ų | 5 | 21.9 Ų | 21.9 | 3% | 0.031 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.8 | -40.7 | 173.6 | -56.3 | 0 | 0 | 0 | 0 | 111 | W104 V108 W122 T126 F169 L170 A171 D175 I176 V177 | W104-T173 PolarHBondContact NE1-OG1 3.21Å; V108-T173 HydrophobicContact CG2-CG2 3.9Å; W122-T173 HydrophobicContact CE3-CG2 4.2Å; T126-T173 HydrophobicContact CG2-CG2 3.76Å; F169-T173 WeakPolarHBondContact O-CB 3.16Å; F169-T173 PolarHBondContact O-N 3.22Å; F169-T173 PolarHBondContact O-OG1 2.95Å; L170-T173 WeakPolarHBondContact O-CB 2.93Å; L170-T173 PolarHBondContact O-N 3.29Å; A171-T173 VanDerWaalsContact C-N 3.33Å; A171-T173 PolarHBondContact O-N 3.16Å; T173-D175 VanDerWaalsContact C-N 3.31Å; T173-D175 PolarHBondContact O-N 2.93Å; T173-I176 PolarHBondContact O-N 3.33Å; T173-V177 VanDerWaalsContact O-CG2 3.28Å; T173-V177 WeakPolarHBondContact O-CG2 3.36Å; T173-V177 PolarHBondContact O-N 3.4Å |
| 174 | Q | 96.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.5 | -42.5 | 173.1 | -164.1 | -165.6 | 20 | 0 | 0 | 111.3 | Q64 L123 Q127 I130 L170 A171 V177 V178 | Q64-Q174 HydrophobicContact CG-CB 4.4Å; Q64-Q174 HydrophobicContact CG-CG 4.21Å; Q64-Q174 VanDerWaalsContact NE2-C 3.31Å; Q64-Q174 PolarHBondContact NE2-O 3.36Å; L123-Q174 HydrophobicContact CD1-CG 3.72Å; Q127-Q174 VanDerWaalsContact CD-NE2 3.28Å; Q127-Q174 VanDerWaalsContact CG-NE2 3.27Å; I130-Q174 HydrophobicContact CD1-CB 4.03Å; I130-Q174 HydrophobicContact CD1-CG 4.4Å; L170-Q174 PolarHBondContact O-N 2.9Å; A171-Q174 WeakPolarHBondContact O-CB 3.48Å; A171-Q174 PolarHBondContact O-N 2.83Å; Q174-V177 WeakPolarHBondContact O-CB 3.42Å; Q174-V177 PolarHBondContact O-N 2.96Å; Q174-V177 VanDerWaalsContact O-N 3.13Å; Q174-V178 WeakPolarHBondContact O-CG2 3.37Å; Q174-V178 PolarHBondContact O-N 3.44Å |
| 175 | D | 96.6 | Very high | 94.2 | Very high | 3 Ų | 3 | 23.3 Ų | 23.3 | 2% | 0.016 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -59.3 | -48.2 | 178.5 | -171.5 | 52.6 | 0 | 0 | 0 | 112 | Q64 F98 K101 A171 A172 T173 V177 V178 D179 | Q64-D175 VanDerWaalsContact NE2-CA 3.28Å; Q64-D175 PolarHBondContact OE1-OD1 3.3Å; F98-D175 HydrophobicContact CE1-CB 4.02Å; K101-D175 IonicContact NZ-OD2 2.71Å; K101-D175 PolarHBondContact NZ-OD2 3.24Å; A171-D175 WeakPolarHBondContact O-CB 3.49Å; A171-D175 PolarHBondContact O-N 3.33Å; A172-D175 WeakPolarHBondContact O-CB 3.45Å; A172-D175 PolarHBondContact O-N 3.12Å; T173-D175 VanDerWaalsContact C-N 3.31Å; T173-D175 PolarHBondContact O-N 2.93Å; D175-V177 PolarHBondContact O-N 3.25Å; D175-V178 PolarHBondContact O-N 3.47Å; D175-D179 WeakPolarHBondContact O-CB 3.32Å; D175-D179 VanDerWaalsContact O-CG 3.27Å; D175-D179 PolarHBondContact O-N 3.11Å |
| 176 | I | 95.5 | Very high | 93.8 | Very high | 11 Ų | 11 | 19.8 Ų | 19.8 | 6% | 0.056 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -52.1 | -45.1 | 171.9 | -63.8 | 161.2 | 0 | 0 | 0 | 111.4 | K101 W104 A105 V108 A172 T173 G180 | K101-I176 HydrophobicContact CB-CD1 3.85Å; K101-I176 HydrophobicContact CB-CG1 3.96Å; K101-I176 HydrophobicContact CD-CG1 4.07Å; K101-I176 HydrophobicContact CG-CG1 4.16Å; K101-I176 WeakPolarHBondContact O-CD1 3.44Å; W104-I176 HydrophobicContact CG-CD1 4.47Å; A105-I176 HydrophobicContact CB-CD1 3.95Å; A105-I176 HydrophobicContact CB-CG1 4.11Å; A105-I176 HydrophobicContact CB-CG2 3.75Å; V108-I176 HydrophobicContact CB-CG2 4.17Å; V108-I176 HydrophobicContact CG1-CG2 4.04Å; V108-I176 HydrophobicContact CG2-CD1 4.46Å; A172-I176 VanDerWaalsContact O-CG1 3.32Å; A172-I176 WeakPolarHBondContact O-CG1 3.34Å; A172-I176 PolarHBondContact O-N 3.3Å; A172-I176 VanDerWaalsContact O-N 3.07Å; T173-I176 PolarHBondContact O-N 3.33Å; I176-G180 PolarHBondContact O-N 3.18Å |
| 177 | V | 95.3 | Very high | 93.4 | Very high | 1 Ų | 1 | 18.5 Ų | 18.5 | 1% | 0.006 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -68.3 | -43.6 | -176.2 | 179.3 | 0 | 0 | 0 | 0 | 111.2 | V108 R119 W122 L123 T173 Q174 D175 G180 W181 | V108-V177 HydrophobicContact CG1-CG2 3.5Å; R119-V177 HydrophobicContact CB-CG1 4.15Å; R119-V177 VanDerWaalsContact O-CG1 3.26Å; R119-V177 WeakPolarHBondContact O-CG1 3.34Å; W122-V177 HydrophobicContact CB-CG1 4.39Å; W122-V177 HydrophobicContact CB-CG2 3.41Å; W122-V177 VanDerWaalsContact CB-CG2 3.41Å; W122-V177 HydrophobicContact CG-CG2 4.3Å; L123-V177 HydrophobicContact CB-CG1 3.8Å; L123-V177 HydrophobicContact CD1-CG1 4.48Å; T173-V177 VanDerWaalsContact O-CG2 3.28Å; T173-V177 WeakPolarHBondContact O-CG2 3.36Å; T173-V177 PolarHBondContact O-N 3.4Å; Q174-V177 WeakPolarHBondContact O-CB 3.42Å; Q174-V177 PolarHBondContact O-N 2.96Å; Q174-V177 VanDerWaalsContact O-N 3.13Å; D175-V177 PolarHBondContact O-N 3.25Å; V177-G180 PolarHBondContact O-N 2.96Å; V177-W181 WeakPolarHBondContact O-CB 3.45Å; V177-W181 PolarHBondContact O-N 3.09Å |
| 178 | V | 95.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -71 | -38.8 | -179.5 | 179.4 | 0 | 0 | 0 | 0 | 110.9 | L57 L60 Y61 Q64 L123 Q174 D175 G180 W181 A182 | L57-V178 HydrophobicContact CD2-CG1 3.98Å; L60-V178 HydrophobicContact CB-CG1 3.96Å; L60-V178 HydrophobicContact CB-CG2 4.09Å; L60-V178 HydrophobicContact CD1-CG1 4.4Å; L60-V178 HydrophobicContact CD1-CG2 4.27Å; Y61-V178 HydrophobicContact CD1-CG1 4.02Å; Y61-V178 HydrophobicContact CD2-CG1 4.27Å; Y61-V178 HydrophobicContact CE1-CB 4.14Å; Y61-V178 HydrophobicContact CE1-CG1 3.62Å; Y61-V178 HydrophobicContact CE2-CG1 3.95Å; Y61-V178 HydrophobicContact CG-CG1 4.3Å; Q64-V178 VanDerWaalsContact NE2-CB 3.32Å; L123-V178 HydrophobicContact CD1-CG2 3.63Å; Q174-V178 WeakPolarHBondContact O-CG2 3.37Å; Q174-V178 PolarHBondContact O-N 3.44Å; D175-V178 PolarHBondContact O-N 3.47Å; V178-G180 VanDerWaalsContact C-N 3.33Å; V178-G180 PolarHBondContact O-N 3.31Å; V178-W181 CarbonylContact O-C 3.52Å; V178-W181 PolarHBondContact O-N 3.04Å; V178-W181 VanDerWaalsContact O-N 3.07Å; V178-A182 WeakPolarHBondContact O-CB 3.28Å; V178-A182 PolarHBondContact O-N 2.93Å |
| 179 | D | 94.5 | Very high | 92.2 | Very high | 47 Ų | 47 | 26.1 Ų | 26.1 | 25% | 0.251 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -56.6 | -48.3 | 170.5 | -73.8 | -17.4 | 0 | 0 | 0 | 111.1 | Y61 K101 D175 W181 A182 | Y61-D179 VanDerWaalsContact CE1-OD1 3.24Å; Y61-D179 WeakPolarHBondContact CE1-OD1 3.45Å; Y61-D179 WeakPolarHBondContact OH-CA 3.48Å; Y61-D179 PolarHBondContact OH-OD1 3.49Å; K101-D179 IonicContact NZ-OD2 3.75Å; K101-D179 PolarHBondContact NZ-OD2 3.3Å; D175-D179 WeakPolarHBondContact O-CB 3.32Å; D175-D179 VanDerWaalsContact O-CG 3.27Å; D175-D179 PolarHBondContact O-N 3.11Å; D179-W181 VanDerWaalsContact C-N 3.28Å; D179-W181 PolarHBondContact O-N 2.77Å; D179-A182 PolarHBondContact O-N 3.46Å |
| 180 | G | 91.4 | Very high | 91.6 | Very high | 9 Ų | 9 | 23 Ų | 23 | 9% | 0.093 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -65.4 | -29.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | R119 I176 V177 V178 | R119-G180 PolarHBondContact NE-O 2.77Å; R119-G180 PolarHBondContact NH2-O 3.21Å; R119-G180 VanDerWaalsContact NH2-O 3.11Å; I176-G180 PolarHBondContact O-N 3.18Å; V177-G180 PolarHBondContact O-N 2.96Å; V178-G180 VanDerWaalsContact C-N 3.33Å; V178-G180 PolarHBondContact O-N 3.31Å |
| 181 | W | 92.1 | Very high | 91.1 | Very high | 7 Ų | 7 | 24 Ų | 24 | 3% | 0.027 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -77.7 | -37.9 | 178.4 | -156.9 | 13 | 0 | 0 | 0 | 111.7 | L60 R119 L123 V177 V178 D179 L183 T184 M185 V256 K260 E262 | L60-W181 HydrophobicContact CD1-CE3 3.89Å; L60-W181 HydrophobicContact CD1-CZ3 3.74Å; R119-W181 HydrophobicContact CB-CB 4.19Å; R119-W181 HydrophobicContact CB-CD2 4.08Å; R119-W181 HydrophobicContact CB-CG 3.84Å; R119-W181 HydrophobicContact CG-CB 3.93Å; R119-W181 HydrophobicContact CG-CG 3.81Å; L123-W181 HydrophobicContact CD2-CE3 3.69Å; L123-W181 HydrophobicContact CD2-CH2 4.06Å; L123-W181 HydrophobicContact CD2-CZ3 3.21Å; V177-W181 WeakPolarHBondContact O-CB 3.45Å; V177-W181 PolarHBondContact O-N 3.09Å; V178-W181 CarbonylContact O-C 3.52Å; V178-W181 PolarHBondContact O-N 3.04Å; V178-W181 VanDerWaalsContact O-N 3.07Å; D179-W181 VanDerWaalsContact C-N 3.28Å; D179-W181 PolarHBondContact O-N 2.77Å; W181-L183 VanDerWaalsContact C-N 3.26Å; W181-L183 PolarHBondContact O-N 3.29Å; W181-T184 CarbonylContact O-C 3.6Å; W181-T184 PolarHBondContact O-N 3.34Å; W181-T184 PolarHBondContact O-OG1 2.87Å; W181-M185 HydrophobicContact CD2-CE 3.23Å; W181-M185 HydrophobicContact CE3-CE 3.5Å; W181-M185 HydrophobicContact CG-CE 3.7Å; W181-M185 HydrophobicContact CH2-CE 4.1Å; W181-M185 HydrophobicContact CZ2-CE 3.86Å; W181-M185 HydrophobicContact CZ3-CE 3.9Å; W181-M185 VanDerWaalsContact O-CB 3.32Å; W181-M185 WeakPolarHBondContact O-CB 3.28Å; W181-M185 PolarHBondContact O-N 3.37Å; W181-V256 HydrophobicContact CH2-CG1 3.76Å; W181-V256 HydrophobicContact CZ3-CG1 3.99Å; W181-K260 HydrophobicContact CH2-CB 4.13Å; W181-K260 HydrophobicContact CH2-CG 3.43Å; W181-K260 VanDerWaalsContact CH2-CG 3.43Å; W181-K260 HydrophobicContact CZ2-CB 4.43Å; W181-K260 HydrophobicContact CZ2-CD 4.37Å; W181-K260 HydrophobicContact CZ2-CG 3.39Å; W181-E262 HydrophobicContact CZ2-CG 4.31Å |
| 182 | A | 92.5 | Very high | 90.5 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -54.7 | -42.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L57 V178 D179 T184 M185 L186 A194 | L57-A182 HydrophobicContact CD1-CB 3.89Å; L57-A182 HydrophobicContact CD2-CB 3.84Å; V178-A182 WeakPolarHBondContact O-CB 3.28Å; V178-A182 PolarHBondContact O-N 2.93Å; D179-A182 PolarHBondContact O-N 3.46Å; A182-T184 PolarHBondContact O-N 3.15Å; A182-M185 PolarHBondContact O-N 3.25Å; A182-L186 WeakPolarHBondContact O-CG 3.27Å; A182-L186 PolarHBondContact O-N 2.88Å; A182-A194 HydrophobicContact CB-CB 3.82Å |
| 183 | L | 89 | Confident | 90 | Very high | 114 Ų | 114 | 29 Ų | 29 | 60% | 0.597 | 17% | 0.168 | S | C | * | . | H | α-helix | trans | -64.2 | -21.7 | 177.8 | -62 | -179.7 | 0 | 0 | 0 | 114.3 | W181 V191 | W181-L183 VanDerWaalsContact C-N 3.26Å; W181-L183 PolarHBondContact O-N 3.29Å; L183-V191 HydrophobicContact CD2-CG2 3.68Å |
| 184 | T | 87.6 | Confident | 89.7 | Confident | 46 Ų | 46 | 29.4 Ų | 29.4 | 28% | 0.282 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -107.2 | -20.9 | -178.3 | 60.1 | 0 | 0 | 0 | 0 | 113.3 | W181 A182 | W181-T184 CarbonylContact O-C 3.6Å; W181-T184 PolarHBondContact O-N 3.34Å; W181-T184 PolarHBondContact O-OG1 2.87Å; A182-T184 PolarHBondContact O-N 3.15Å |
| 185 | M | 86.7 | Confident | 89.4 | Confident | 12 Ų | 12 | 33.1 Ų | 33.1 | 6% | 0.059 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -87.2 | -33.1 | -177.7 | -161.4 | -170.5 | -60.8 | 0 | 0 | 112 | N53 L56 L57 W181 A182 | N53-M185 HydrophobicContact CB-CG 3.66Å; N53-M185 HydrophobicContact CB-SD 3.6Å; N53-M185 VanDerWaalsContact CG-CG 3.47Å; N53-M185 PolarHBondContact ND2-O 2.85Å; N53-M185 WeakPolarHBondContact OD1-CG 3.41Å; L56-M185 HydrophobicContact CD2-CE 4Å; L56-M185 HydrophobicContact CD2-SD 4.07Å; L57-M185 HydrophobicContact CD1-SD 4.48Å; L57-M185 HydrophobicContact CD2-CE 4.1Å; L57-M185 HydrophobicContact CD2-SD 4.4Å; L57-M185 HydrophobicContact CG-CE 4.42Å; L57-M185 HydrophobicContact CG-SD 4.08Å; W181-M185 HydrophobicContact CD2-CE 3.23Å; W181-M185 HydrophobicContact CE3-CE 3.5Å; W181-M185 HydrophobicContact CG-CE 3.7Å; W181-M185 HydrophobicContact CH2-CE 4.1Å; W181-M185 HydrophobicContact CZ2-CE 3.86Å; W181-M185 HydrophobicContact CZ3-CE 3.9Å; W181-M185 VanDerWaalsContact O-CB 3.32Å; W181-M185 WeakPolarHBondContact O-CB 3.28Å; W181-M185 PolarHBondContact O-N 3.37Å; A182-M185 PolarHBondContact O-N 3.25Å |
| 186 | L | 87.9 | Confident | 89 | Confident | 10 Ų | 10 | 33.7 Ų | 33.7 | 5% | 0.052 | 20% | 0.201 | C | C | . | . | S | Bend | trans | -86.3 | 148.4 | 178.3 | -62.5 | 174.5 | 0 | 0 | 0 | 111.1 | D50 N53 I54 L57 A182 A194 | D50-L186 HydrophobicContact CB-CD2 4.41Å; N53-L186 HydrophobicContact CB-CD2 4.34Å; I54-L186 HydrophobicContact CD1-CD2 4.44Å; I54-L186 HydrophobicContact CG1-CD2 3.57Å; L57-L186 HydrophobicContact CD1-CD1 3.89Å; L57-L186 HydrophobicContact CD1-CD2 3.9Å; L57-L186 HydrophobicContact CD1-CG 3.74Å; A182-L186 WeakPolarHBondContact O-CG 3.27Å; A182-L186 PolarHBondContact O-N 2.88Å; L186-A194 HydrophobicContact CD1-CB 4.06Å |
| 187 | S | 85.7 | Confident | 88.9 | Confident | 14 Ų | 14 | 33.4 Ų | 33.4 | 10% | 0.098 | 20% | 0.2 | C | C | . | . | trans | -63.5 | 154.7 | 172.8 | 88.4 | 0 | 0 | 0 | 0 | 110.8 | T45 D50 E189 N190 V191 | T45-S187 WeakPolarHBondContact OG1-CB 3.33Å; T45-S187 PolarHBondContact OG1-OG 3.48Å; D50-S187 WeakPolarHBondContact OD2-CB 3.42Å; D50-S187 PolarHBondContact OD2-N 3.3Å; D50-S187 PolarHBondContact OD2-OG 3.2Å; S187-E189 PolarHBondContact O-N 3.3Å; S187-E189 PolarHBondContact OG-N 3Å; S187-N190 CarbonylContact O-C 3.26Å; S187-N190 PolarHBondContact O-N 2.99Å; S187-N190 PolarHBondContact OG-N 3.09Å; S187-N190 PolarHBondContact OG-ND2 3.41Å; S187-V191 PolarHBondContact O-N 2.85Å | ||
| 188 | P | 82.4 | Confident | 88.8 | Confident | 101 Ų | 101 | 34.9 Ų | 34.9 | 66% | 0.656 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | -20.9 | 179.1 | -26 | 34.9 | 0 | 0 | 0 | 114.7 | ||
| 189 | E | 82.2 | Confident | 88.6 | Confident | 58 Ų | 58 | 37.6 Ų | 37.6 | 27% | 0.271 | 22% | 0.224 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -82.8 | -31 | 177.4 | -61 | 177.4 | 157.2 | 0 | 0 | 111.8 | R42 S43 K44 T45 S187 | R42-E189 WeakPolarHBondContact CB-OE1 3.33Å; R42-E189 HydrophobicContact CG-CG 4.37Å; R42-E189 WeakPolarHBondContact CG-OE1 3.17Å; S43-E189 VanDerWaalsContact O-OE1 3.08Å; K44-E189 WeakPolarHBondContact CA-OE2 3.49Å; T45-E189 PolarHBondContact N-OE2 3.17Å; T45-E189 PolarHBondContact OG1-OE2 3.36Å; S187-E189 PolarHBondContact O-N 3.3Å; S187-E189 PolarHBondContact OG-N 3Å |
| 190 | N | 85.1 | Confident | 88.5 | Confident | 15 Ų | 15 | 36 Ų | 36 | 8% | 0.08 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | -1.7 | -176.9 | -64.9 | -37.3 | 0 | 0 | 0 | 113.1 | D50 S187 G192 Y193 | D50-N190 WeakPolarHBondContact OD2-CB 3.22Å; D50-N190 PolarHBondContact OD2-ND2 3.39Å; S187-N190 CarbonylContact O-C 3.26Å; S187-N190 PolarHBondContact O-N 2.99Å; S187-N190 PolarHBondContact OG-N 3.09Å; S187-N190 PolarHBondContact OG-ND2 3.41Å; N190-G192 PolarHBondContact O-N 3.47Å; N190-G192 VanDerWaalsContact O-N 3.08Å; N190-Y193 HydrophobicContact CB-CD2 3.96Å; N190-Y193 WeakPolarHBondContact O-CB 3.25Å; N190-Y193 WeakPolarHBondContact O-CD2 3.41Å; N190-Y193 PolarHBondContact O-N 3.28Å |
| 191 | V | 85.7 | Confident | 88.7 | Confident | 51 Ų | 51 | 35.6 Ų | 35.6 | 31% | 0.309 | 21% | 0.212 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | -26.8 | -179.4 | 74.9 | 0 | 0 | 0 | 0 | 113 | L183 S187 Y193 A194 | L183-V191 HydrophobicContact CD2-CG2 3.68Å; S187-V191 PolarHBondContact O-N 2.85Å; V191-Y193 PolarHBondContact O-N 3.07Å; V191-A194 WeakPolarHBondContact O-CB 3.27Å; V191-A194 PolarHBondContact O-N 3.15Å |
| 192 | G | 84.4 | Confident | 88.8 | Confident | 36 Ų | 36 | 37.6 Ų | 37.6 | 37% | 0.371 | 22% | 0.222 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -21.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114 | N190 A194 S195 | N190-G192 PolarHBondContact O-N 3.47Å; N190-G192 VanDerWaalsContact O-N 3.08Å; G192-A194 VanDerWaalsContact C-N 3.25Å; G192-A194 PolarHBondContact O-N 3.08Å; G192-S195 PolarHBondContact O-OG 3.2Å |
| 193 | Y | 87.3 | Confident | 88.8 | Confident | 70 Ų | 70 | 38.9 Ų | 38.9 | 28% | 0.275 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -76.5 | -8.7 | 173.4 | -67.4 | -68.3 | 0 | 0 | 0 | 113.3 | L47 N190 V191 S195 T196 C197 | L47-Y193 HydrophobicContact CD1-CE2 4.02Å; N190-Y193 HydrophobicContact CB-CD2 3.96Å; N190-Y193 WeakPolarHBondContact O-CB 3.25Å; N190-Y193 WeakPolarHBondContact O-CD2 3.41Å; N190-Y193 PolarHBondContact O-N 3.28Å; V191-Y193 PolarHBondContact O-N 3.07Å; Y193-S195 VanDerWaalsContact C-N 3.33Å; Y193-S195 PolarHBondContact O-N 2.95Å; Y193-T196 WeakPolarHBondContact O-CB 3.27Å; Y193-T196 PolarHBondContact O-N 3.39Å; Y193-T196 VanDerWaalsContact O-N 3.14Å; Y193-C197 PolarHBondContact O-N 2.83Å; Y193-C197 PolarHBondContact O-SG 3.16Å |
| 194 | A | 89.7 | Confident | 89 | Confident | 12 Ų | 12 | 34.7 Ų | 34.7 | 10% | 0.099 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -56.1 | -47.3 | 179 | 0 | 0 | 0 | 0 | 0 | 111.7 | A182 L186 V191 G192 T196 C197 N198 | A182-A194 HydrophobicContact CB-CB 3.82Å; L186-A194 HydrophobicContact CD1-CB 4.06Å; V191-A194 WeakPolarHBondContact O-CB 3.27Å; V191-A194 PolarHBondContact O-N 3.15Å; G192-A194 VanDerWaalsContact C-N 3.25Å; G192-A194 PolarHBondContact O-N 3.08Å; A194-T196 PolarHBondContact O-N 3.45Å; A194-C197 PolarHBondContact O-N 2.59Å; A194-N198 PolarHBondContact O-N 2.75Å |
| 195 | S | 89.4 | Confident | 89.3 | Confident | 79 Ų | 79 | 32.5 Ų | 32.5 | 55% | 0.552 | 20% | 0.198 | S | C | * | . | H | α-helix | trans | -65.4 | -37.8 | 176.7 | 54.4 | 0 | 0 | 0 | 0 | 112.3 | G192 Y193 N198 V199 | G192-S195 PolarHBondContact O-OG 3.2Å; Y193-S195 VanDerWaalsContact C-N 3.33Å; Y193-S195 PolarHBondContact O-N 2.95Å; S195-N198 PolarHBondContact O-N 3.27Å; S195-V199 WeakPolarHBondContact O-CG2 2.87Å; S195-V199 PolarHBondContact O-N 3.48Å |
| 196 | T | 89.8 | Confident | 89.7 | Confident | 14 Ų | 14 | 36.4 Ų | 36.4 | 9% | 0.086 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.7 | -43 | 175.5 | -53.3 | 0 | 0 | 0 | 0 | 111.2 | Y193 A194 N198 V199 V200 P340 L341 | Y193-T196 WeakPolarHBondContact O-CB 3.27Å; Y193-T196 PolarHBondContact O-N 3.39Å; Y193-T196 VanDerWaalsContact O-N 3.14Å; A194-T196 PolarHBondContact O-N 3.45Å; T196-N198 VanDerWaalsContact C-N 3.32Å; T196-N198 PolarHBondContact O-N 3.49Å; T196-V199 PolarHBondContact O-N 2.9Å; T196-V200 HydrophobicContact CG2-CG2 4.17Å; T196-V200 VanDerWaalsContact O-CB 3.28Å; T196-V200 WeakPolarHBondContact O-CB 3.48Å; T196-V200 WeakPolarHBondContact O-CG2 3.41Å; T196-V200 PolarHBondContact O-N 2.97Å; T196-P340 HydrophobicContact CG2-CB 4.47Å; T196-L341 HydrophobicContact CG2-CD2 3.8Å |
| 197 | C | 92.1 | Very high | 89.8 | Confident | 6 Ų | 6 | 38 Ų | 38 | 4% | 0.041 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.3 | -41.3 | 176.9 | -63.6 | 0 | 0 | 0 | 0 | 111.6 | L57 V58 Y61 Y193 A194 G201 | L57-C197 HydrophobicContact CB-CB 4.27Å; V58-C197 HydrophobicContact CG2-CB 3.89Å; Y61-C197 VanDerWaalsContact CD2-C 3.45Å; Y61-C197 HydrophobicContact CD2-CB 3.98Å; Y61-C197 WeakPolarHBondContact CD2-O 3.34Å; Y61-C197 HydrophobicContact CE2-CB 3.98Å; Y193-C197 PolarHBondContact O-N 2.83Å; Y193-C197 PolarHBondContact O-SG 3.16Å; A194-C197 PolarHBondContact O-N 2.59Å; C197-G201 PolarHBondContact O-N 3.15Å |
| 198 | N | 93.5 | Very high | 90.2 | Very high | 31 Ų | 31 | 39.8 Ų | 39.8 | 17% | 0.166 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.1 | -55.7 | 176 | 175.3 | -95 | 0 | 0 | 0 | 111.4 | Y61 A194 S195 T196 V200 G201 Q202 | Y61-N198 HydrophobicContact CD1-CB 4.03Å; Y61-N198 VanDerWaalsContact CD1-ND2 3.27Å; Y61-N198 WeakPolarHBondContact CD1-ND2 3.46Å; Y61-N198 VanDerWaalsContact CD2-CA 3.47Å; Y61-N198 HydrophobicContact CD2-CB 4.23Å; Y61-N198 HydrophobicContact CE1-CB 3.77Å; Y61-N198 WeakPolarHBondContact CE1-ND2 3.37Å; Y61-N198 HydrophobicContact CE2-CB 3.92Å; Y61-N198 HydrophobicContact CG-CB 4.3Å; A194-N198 PolarHBondContact O-N 2.75Å; S195-N198 PolarHBondContact O-N 3.27Å; T196-N198 VanDerWaalsContact C-N 3.32Å; T196-N198 PolarHBondContact O-N 3.49Å; N198-V200 PolarHBondContact O-N 3.46Å; N198-G201 PolarHBondContact O-N 2.78Å; N198-Q202 WeakPolarHBondContact O-CB 3.47Å; N198-Q202 PolarHBondContact O-N 3.41Å |
| 199 | V | 91.8 | Very high | 90.7 | Very high | 57 Ų | 57 | 35 Ų | 35 | 35% | 0.345 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.6 | -50.5 | -178.5 | 175.8 | 0 | 0 | 0 | 0 | 111 | S195 T196 G201 T203 P340 | S195-V199 WeakPolarHBondContact O-CG2 2.87Å; S195-V199 PolarHBondContact O-N 3.48Å; T196-V199 PolarHBondContact O-N 2.9Å; V199-G201 PolarHBondContact O-N 3.11Å; V199-T203 WeakPolarHBondContact O-CB 3.48Å; V199-T203 PolarHBondContact O-N 3.17Å; V199-T203 PolarHBondContact O-OG1 3.21Å; V199-P340 HydrophobicContact CG1-CB 4.22Å; V199-P340 HydrophobicContact CG1-CG 3.64Å |
| 200 | V | 92.1 | Very high | 91 | Very high | 15 Ų | 15 | 32.7 Ų | 32.7 | 9% | 0.091 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.1 | -49.9 | -178.7 | 167.3 | 0 | 0 | 0 | 0 | 111.4 | V58 T196 N198 A204 V337 L341 | V58-V200 HydrophobicContact CG1-CG1 4.17Å; T196-V200 HydrophobicContact CG2-CG2 4.17Å; T196-V200 VanDerWaalsContact O-CB 3.28Å; T196-V200 WeakPolarHBondContact O-CB 3.48Å; T196-V200 WeakPolarHBondContact O-CG2 3.41Å; T196-V200 PolarHBondContact O-N 2.97Å; N198-V200 PolarHBondContact O-N 3.46Å; V200-A204 VanDerWaalsContact O-CB 3.25Å; V200-A204 WeakPolarHBondContact O-CB 3.26Å; V200-A204 PolarHBondContact O-N 3.08Å; V200-A204 VanDerWaalsContact O-N 3.09Å; V200-V337 HydrophobicContact CG1-CG1 4.07Å; V200-L341 HydrophobicContact CG2-CD1 4.34Å; V200-L341 HydrophobicContact CG2-CD2 3.85Å; V200-L341 HydrophobicContact CG2-CG 3.79Å |
| 201 | G | 95 | Very high | 91.1 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.3 | -54.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | V58 L62 C197 N198 V199 T203 A204 G205 | V58-G201 WeakPolarHBondContact O-CA 3.36Å; L62-G201 WeakPolarHBondContact CA-O 3.49Å; C197-G201 PolarHBondContact O-N 3.15Å; N198-G201 PolarHBondContact O-N 2.78Å; V199-G201 PolarHBondContact O-N 3.11Å; G201-T203 PolarHBondContact O-N 2.98Å; G201-A204 PolarHBondContact O-N 3.3Å; G201-G205 PolarHBondContact O-N 2.69Å |
| 202 | Q | 94.9 | Very high | 91.3 | Very high | 49 Ų | 49 | 32 Ų | 32 | 23% | 0.229 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63.6 | -40.6 | -175.8 | -168.4 | 179.7 | 91.6 | 0 | 0 | 112 | Y61 L68 N198 G205 Y206 | Y61-Q202 WeakPolarHBondContact O-CA 3.42Å; L68-Q202 HydrophobicContact CD1-CG 3.78Å; N198-Q202 WeakPolarHBondContact O-CB 3.47Å; N198-Q202 PolarHBondContact O-N 3.41Å; Q202-G205 PolarHBondContact O-N 3.16Å; Q202-Y206 VanDerWaalsContact O-CB 3.27Å; Q202-Y206 WeakPolarHBondContact O-CB 3.48Å; Q202-Y206 PolarHBondContact O-N 2.89Å |
| 203 | T | 92.4 | Very high | 91.6 | Very high | 27 Ų | 27 | 30.4 Ų | 30.4 | 17% | 0.166 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.1 | -43.5 | 174.8 | -63.4 | 0 | 0 | 0 | 0 | 111.5 | V199 G201 G205 Y206 F207 V333 E336 V337 | V199-T203 WeakPolarHBondContact O-CB 3.48Å; V199-T203 PolarHBondContact O-N 3.17Å; V199-T203 PolarHBondContact O-OG1 3.21Å; G201-T203 PolarHBondContact O-N 2.98Å; T203-G205 VanDerWaalsContact C-N 3.35Å; T203-G205 PolarHBondContact O-N 2.86Å; T203-Y206 PolarHBondContact O-N 2.6Å; T203-F207 WeakPolarHBondContact O-CB 3.29Å; T203-F207 PolarHBondContact O-N 3.1Å; T203-V333 HydrophobicContact CG2-CG1 4.36Å; T203-E336 HydrophobicContact CG2-CB 4.04Å; T203-V337 HydrophobicContact CG2-CG2 3.8Å |
| 204 | A | 92.7 | Very high | 91.6 | Very high | 25 Ų | 25 | 28.5 Ų | 28.5 | 21% | 0.207 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.6 | -42.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | L62 V200 G201 F207 L208 | L62-A204 HydrophobicContact CD1-CB 4.3Å; V200-A204 VanDerWaalsContact O-CB 3.25Å; V200-A204 WeakPolarHBondContact O-CB 3.26Å; V200-A204 PolarHBondContact O-N 3.08Å; V200-A204 VanDerWaalsContact O-N 3.09Å; G201-A204 PolarHBondContact O-N 3.3Å; A204-F207 PolarHBondContact O-N 2.98Å; A204-L208 WeakPolarHBondContact O-CG 3.38Å; A204-L208 PolarHBondContact O-N 2.87Å |
| 205 | G | 95.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.1 | -45 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L62 G65 I66 G201 Q202 T203 F207 L208 G209 | L62-G205 VanDerWaalsContact O-CA 3.28Å; L62-G205 WeakPolarHBondContact O-CA 3.14Å; G65-G205 CarbonylContact C-O 3.6Å; G65-G205 CarbonylContact O-C 3.59Å; I66-G205 WeakPolarHBondContact CD1-O 3.12Å; G201-G205 PolarHBondContact O-N 2.69Å; Q202-G205 PolarHBondContact O-N 3.16Å; T203-G205 VanDerWaalsContact C-N 3.35Å; T203-G205 PolarHBondContact O-N 2.86Å; G205-F207 VanDerWaalsContact C-N 3.28Å; G205-F207 PolarHBondContact O-N 3.13Å; G205-L208 PolarHBondContact O-N 2.95Å; G205-G209 PolarHBondContact O-N 3.17Å |
| 206 | Y | 93.5 | Very high | 91.4 | Very high | 95 Ų | 95 | 26.7 Ų | 26.7 | 37% | 0.373 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -58.3 | -44 | 177 | 179 | -90 | 0 | 0 | 0 | 111.1 | G65 L68 G69 A72 Q202 T203 G209 N210 | G65-Y206 VanDerWaalsContact O-CA 3.28Å; G65-Y206 WeakPolarHBondContact O-CA 3.4Å; G65-Y206 PolarHBondContact O-N 3.21Å; L68-Y206 HydrophobicContact CB-CD2 4.14Å; G69-Y206 WeakPolarHBondContact CA-O 3.48Å; A72-Y206 HydrophobicContact CB-CE2 3.58Å; A72-Y206 WeakPolarHBondContact CB-OH 3.45Å; Q202-Y206 VanDerWaalsContact O-CB 3.27Å; Q202-Y206 WeakPolarHBondContact O-CB 3.48Å; Q202-Y206 PolarHBondContact O-N 2.89Å; T203-Y206 PolarHBondContact O-N 2.6Å; Y206-G209 PolarHBondContact O-N 2.71Å; Y206-N210 HydrophobicContact CE1-CB 4.25Å; Y206-N210 WeakPolarHBondContact O-CB 3.24Å; Y206-N210 PolarHBondContact O-N 2.86Å; Y206-N210 PolarHBondContact OH-ND2 2.93Å; Y206-N210 VanDerWaalsContact OH-ND2 3.12Å |
| 207 | F | 91.5 | Very high | 91.3 | Very high | 43 Ų | 43 | 28.8 Ų | 28.8 | 19% | 0.189 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.7 | -44.9 | 175.8 | 177.9 | -108.4 | 0 | 0 | 0 | 112.9 | T203 A204 G205 N210 V211 V212 V330 V333 | T203-F207 WeakPolarHBondContact O-CB 3.29Å; T203-F207 PolarHBondContact O-N 3.1Å; A204-F207 PolarHBondContact O-N 2.98Å; G205-F207 VanDerWaalsContact C-N 3.28Å; G205-F207 PolarHBondContact O-N 3.13Å; F207-N210 PolarHBondContact O-N 2.91Å; F207-V211 HydrophobicContact CD2-CB 3.62Å; F207-V211 HydrophobicContact CD2-CG1 4.19Å; F207-V211 HydrophobicContact CD2-CG2 3.79Å; F207-V211 HydrophobicContact CE2-CB 3.58Å; F207-V211 HydrophobicContact CE2-CG1 3.62Å; F207-V211 HydrophobicContact CE2-CG2 4.03Å; F207-V211 HydrophobicContact CZ-CB 4.44Å; F207-V211 HydrophobicContact CZ-CG1 4.31Å; F207-V211 PolarHBondContact O-N 3.48Å; F207-V212 HydrophobicContact CD1-CG2 3.68Å; F207-V212 HydrophobicContact CE1-CG2 3.34Å; F207-V212 HydrophobicContact CG-CG2 4.45Å; F207-V212 HydrophobicContact CZ-CG2 3.88Å; F207-V212 PolarHBondContact O-N 2.84Å; F207-V330 HydrophobicContact CE2-CG2 4.48Å; F207-V333 HydrophobicContact CB-CG1 3.65Å; F207-V333 HydrophobicContact CB-CG2 4.28Å; F207-V333 HydrophobicContact CD1-CG1 4.17Å; F207-V333 HydrophobicContact CD2-CB 3.7Å; F207-V333 HydrophobicContact CD2-CG1 3.65Å; F207-V333 HydrophobicContact CD2-CG2 3.34Å; F207-V333 HydrophobicContact CE2-CB 4.04Å; F207-V333 HydrophobicContact CE2-CG1 4.27Å; F207-V333 HydrophobicContact CE2-CG2 3.91Å; F207-V333 HydrophobicContact CG-CB 4.17Å; F207-V333 HydrophobicContact CG-CG1 3.57Å; F207-V333 HydrophobicContact CG-CG2 4.1Å |
| 208 | L | 92.9 | Very high | 90.9 | Very high | 51 Ų | 51 | 29.7 Ų | 29.7 | 27% | 0.267 | 16% | 0.159 | S | C | . | . | I | π-helix | trans | -61.6 | -47.6 | 176.3 | -74.8 | 171.3 | 0 | 0 | 0 | 111.2 | L62 I66 A204 G205 N210 V212 F213 Y241 W245 | L62-L208 HydrophobicContact CD1-CD1 4.12Å; L62-L208 HydrophobicContact CD2-CD1 4.08Å; L62-L208 HydrophobicContact CG-CD1 4.26Å; I66-L208 HydrophobicContact CD1-CB 3.42Å; I66-L208 VanDerWaalsContact CD1-CB 3.42Å; I66-L208 HydrophobicContact CD1-CD1 4.21Å; I66-L208 HydrophobicContact CD1-CG 4.48Å; A204-L208 WeakPolarHBondContact O-CG 3.38Å; A204-L208 PolarHBondContact O-N 2.87Å; G205-L208 PolarHBondContact O-N 2.95Å; L208-N210 VanDerWaalsContact C-N 3.33Å; L208-N210 PolarHBondContact O-N 2.88Å; L208-V212 HydrophobicContact CD2-CB 4.44Å; L208-V212 HydrophobicContact CD2-CG1 4.45Å; L208-V212 HydrophobicContact CD2-CG2 4.18Å; L208-F213 PolarHBondContact O-N 3.47Å; L208-Y241 PolarHBondContact O-OH 3.18Å; L208-W245 HydrophobicContact CB-CZ2 4.33Å; L208-W245 HydrophobicContact CD1-CH2 4.2Å; L208-W245 HydrophobicContact CD1-CZ2 4.34Å |
| 209 | G | 92.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -72.3 | -21.5 | -179 | 0 | 0 | 0 | 0 | 0 | 114.6 | G69 L70 G205 Y206 F213 | G69-G209 CarbonylContact C-O 3.55Å; G69-G209 VanDerWaalsContact C-O 3.26Å; L70-G209 WeakPolarHBondContact CA-O 3.49Å; L70-G209 WeakPolarHBondContact CD2-O 3.42Å; L70-G209 PolarHBondContact N-O 3.22Å; G205-G209 PolarHBondContact O-N 3.17Å; Y206-G209 PolarHBondContact O-N 2.71Å; G209-F213 WeakPolarHBondContact O-CB 3.22Å |
| 210 | N | 90 | Very high | 90.1 | Very high | 11 Ų | 11 | 34.9 Ų | 34.9 | 6% | 0.059 | 18% | 0.177 | C | C | . | . | I | π-helix | trans | -108 | -79.5 | -178.2 | -168.3 | -25.4 | 0 | 0 | 0 | 112 | G69 A72 Y206 F207 L208 F213 L214 | G69-N210 WeakPolarHBondContact O-CB 3.38Å; A72-N210 WeakPolarHBondContact CB-ND2 3.28Å; Y206-N210 HydrophobicContact CE1-CB 4.25Å; Y206-N210 WeakPolarHBondContact O-CB 3.24Å; Y206-N210 PolarHBondContact O-N 2.86Å; Y206-N210 PolarHBondContact OH-ND2 2.93Å; Y206-N210 VanDerWaalsContact OH-ND2 3.12Å; F207-N210 PolarHBondContact O-N 2.91Å; L208-N210 VanDerWaalsContact C-N 3.33Å; L208-N210 PolarHBondContact O-N 2.88Å; N210-F213 PolarHBondContact O-N 3.48Å; N210-L214 WeakPolarHBondContact O-CB 3.23Å; N210-L214 WeakPolarHBondContact O-CG 3.09Å; N210-L214 PolarHBondContact O-N 2.98Å; N210-L214 VanDerWaalsContact OD1-CD1 3.26Å; N210-L214 WeakPolarHBondContact OD1-CD1 3.46Å |
| 211 | V | 87.1 | Confident | 89.8 | Confident | 14 Ų | 14 | 36 Ų | 36 | 9% | 0.085 | 18% | 0.181 | C | C | . | . | I | π-helix | trans | -66.1 | -46.9 | -169.8 | -179 | 0 | 0 | 0 | 0 | 111.6 | F207 L214 A215 A326 A329 V330 | F207-V211 HydrophobicContact CD2-CB 3.62Å; F207-V211 HydrophobicContact CD2-CG1 4.19Å; F207-V211 HydrophobicContact CD2-CG2 3.79Å; F207-V211 HydrophobicContact CE2-CB 3.58Å; F207-V211 HydrophobicContact CE2-CG1 3.62Å; F207-V211 HydrophobicContact CE2-CG2 4.03Å; F207-V211 HydrophobicContact CZ-CB 4.44Å; F207-V211 HydrophobicContact CZ-CG1 4.31Å; F207-V211 PolarHBondContact O-N 3.48Å; V211-L214 PolarHBondContact O-N 2.97Å; V211-A215 WeakPolarHBondContact O-CB 3.49Å; V211-A215 PolarHBondContact O-N 3.45Å; V211-A326 HydrophobicContact CG1-CB 4.28Å; V211-A329 HydrophobicContact CG2-CB 3.95Å; V211-V330 HydrophobicContact CG1-CG2 3.94Å |
| 212 | V | 89.3 | Confident | 89.3 | Confident | 38 Ų | 38 | 36 Ų | 36 | 23% | 0.23 | 18% | 0.181 | C | C | . | . | I | π-helix | trans | -66.3 | -42.2 | 179.4 | 176.4 | 0 | 0 | 0 | 0 | 110.4 | F207 L208 A215 L216 | F207-V212 HydrophobicContact CD1-CG2 3.68Å; F207-V212 HydrophobicContact CE1-CG2 3.34Å; F207-V212 HydrophobicContact CG-CG2 4.45Å; F207-V212 HydrophobicContact CZ-CG2 3.88Å; F207-V212 PolarHBondContact O-N 2.84Å; L208-V212 HydrophobicContact CD2-CB 4.44Å; L208-V212 HydrophobicContact CD2-CG1 4.45Å; L208-V212 HydrophobicContact CD2-CG2 4.18Å; V212-A215 PolarHBondContact O-N 3.47Å; V212-L216 HydrophobicContact CG1-CD1 3.74Å; V212-L216 HydrophobicContact CG1-CG 4.27Å; V212-L216 WeakPolarHBondContact O-CB 3.43Å; V212-L216 VanDerWaalsContact O-CG 3.23Å; V212-L216 WeakPolarHBondContact O-CG 3.42Å; V212-L216 PolarHBondContact O-N 2.97Å |
| 213 | F | 90.9 | Very high | 88.9 | Confident | 1 Ų | 1 | 35.8 Ų | 35.8 | 0% | 0.004 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -56 | -54.4 | 173.6 | 163.7 | -109.2 | 0 | 0 | 0 | 111.9 | L70 S73 V77 L208 G209 N210 A215 L216 E217 L238 Y241 | L70-F213 HydrophobicContact CD2-CB 4.47Å; L70-F213 HydrophobicContact CD2-CD1 4.25Å; L70-F213 HydrophobicContact CD2-CD2 4.41Å; L70-F213 HydrophobicContact CD2-CG 4.07Å; S73-F213 WeakPolarHBondContact OG-CD1 3.18Å; S73-F213 WeakPolarHBondContact OG-CE1 3.27Å; V77-F213 HydrophobicContact CG2-CE1 4.15Å; L208-F213 PolarHBondContact O-N 3.47Å; G209-F213 WeakPolarHBondContact O-CB 3.22Å; N210-F213 PolarHBondContact O-N 3.48Å; F213-A215 VanDerWaalsContact C-N 3.3Å; F213-A215 PolarHBondContact O-N 2.96Å; F213-L216 PolarHBondContact O-N 3.42Å; F213-L216 VanDerWaalsContact O-N 3.11Å; F213-E217 HydrophobicContact CD2-CB 4.48Å; F213-E217 HydrophobicContact CE2-CB 3.91Å; F213-E217 HydrophobicContact CE2-CG 4.12Å; F213-E217 HydrophobicContact CZ-CB 4.06Å; F213-E217 HydrophobicContact CZ-CG 4.02Å; F213-E217 WeakPolarHBondContact O-CB 3.35Å; F213-E217 PolarHBondContact O-N 2.9Å; F213-L238 HydrophobicContact CE1-CD1 4.13Å; F213-L238 HydrophobicContact CE2-CB 4.04Å; F213-L238 HydrophobicContact CE2-CD1 3.72Å; F213-L238 HydrophobicContact CE2-CG 4.45Å; F213-L238 HydrophobicContact CZ-CB 3.87Å; F213-L238 HydrophobicContact CZ-CD1 3.49Å; F213-L238 VanDerWaalsContact CZ-CD1 3.49Å; F213-L238 HydrophobicContact CZ-CG 4.13Å; F213-Y241 HydrophobicContact CB-CD1 4.22Å; F213-Y241 HydrophobicContact CB-CE1 3.8Å; F213-Y241 HydrophobicContact CB-CE2 4.46Å; F213-Y241 AromaticContact CD2-CD1 3.6Å; F213-Y241 HydrophobicContact CD2-CD1 3.6Å; F213-Y241 HydrophobicContact CD2-CD2 4.14Å; F213-Y241 HydrophobicContact CD2-CE1 4.08Å; F213-Y241 AromaticContact CD2-CG 3.64Å; F213-Y241 HydrophobicContact CD2-CG 3.64Å; F213-Y241 HydrophobicContact CE2-CD1 4.44Å; F213-Y241 HydrophobicContact CE2-CG 4.34Å; F213-Y241 HydrophobicContact CG-CD1 4.15Å; F213-Y241 HydrophobicContact CG-CE1 4.23Å |
| 214 | L | 86.7 | Confident | 88.6 | Confident | 30 Ų | 30 | 42.3 Ų | 42.3 | 16% | 0.157 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60 | -39 | -179.5 | -73.3 | 170.8 | 0 | 0 | 0 | 112.5 | L76 V77 N210 V211 E217 S218 | L76-L214 HydrophobicContact CB-CD1 4.31Å; L76-L214 HydrophobicContact CB-CD2 4.47Å; L76-L214 HydrophobicContact CD1-CD1 3.57Å; V77-L214 HydrophobicContact CG2-CD2 3.87Å; N210-L214 WeakPolarHBondContact O-CB 3.23Å; N210-L214 WeakPolarHBondContact O-CG 3.09Å; N210-L214 PolarHBondContact O-N 2.98Å; N210-L214 VanDerWaalsContact OD1-CD1 3.26Å; N210-L214 WeakPolarHBondContact OD1-CD1 3.46Å; V211-L214 PolarHBondContact O-N 2.97Å; L214-E217 PolarHBondContact O-N 3.35Å; L214-S218 WeakPolarHBondContact O-CB 3.18Å; L214-S218 PolarHBondContact O-N 3.32Å |
| 215 | A | 86.6 | Confident | 88.2 | Confident | 17 Ų | 17 | 46.6 Ų | 46.6 | 14% | 0.14 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -64.5 | -41.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | V211 V212 F213 F221 | V211-A215 WeakPolarHBondContact O-CB 3.49Å; V211-A215 PolarHBondContact O-N 3.45Å; V212-A215 PolarHBondContact O-N 3.47Å; F213-A215 VanDerWaalsContact C-N 3.3Å; F213-A215 PolarHBondContact O-N 2.96Å; A215-F221 HydrophobicContact CB-CD1 3.94Å; A215-F221 HydrophobicContact CB-CD2 4.16Å; A215-F221 HydrophobicContact CB-CE1 3.86Å; A215-F221 HydrophobicContact CB-CE2 4.05Å; A215-F221 HydrophobicContact CB-CG 4.1Å; A215-F221 HydrophobicContact CB-CZ 3.92Å; A215-F221 WeakPolarHBondContact O-CB 3.36Å; A215-F221 WeakPolarHBondContact O-CD1 3.46Å; A215-F221 WeakPolarHBondContact O-CG 3.26Å |
| 216 | L | 89.4 | Confident | 87.7 | Confident | 37 Ų | 37 | 50.8 Ų | 50.8 | 19% | 0.194 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -75.6 | -24.9 | 179 | -67.3 | 175 | 0 | 0 | 0 | 113.3 | V212 F213 C222 L226 G234 M235 F236 Y241 | V212-L216 HydrophobicContact CG1-CD1 3.74Å; V212-L216 HydrophobicContact CG1-CG 4.27Å; V212-L216 WeakPolarHBondContact O-CB 3.43Å; V212-L216 VanDerWaalsContact O-CG 3.23Å; V212-L216 WeakPolarHBondContact O-CG 3.42Å; V212-L216 PolarHBondContact O-N 2.97Å; F213-L216 PolarHBondContact O-N 3.42Å; F213-L216 VanDerWaalsContact O-N 3.11Å; L216-C222 PolarHBondContact O-SG 3.39Å; L216-C222 VanDerWaalsContact O-SG 3.39Å; L216-L226 HydrophobicContact CD2-CD1 3.82Å; L216-G234 CarbonylContact O-C 3.59Å; L216-G234 WeakPolarHBondContact O-CA 3.16Å; L216-M235 HydrophobicContact CD2-CB 4.36Å; L216-M235 PolarHBondContact O-N 3.05Å; L216-F236 HydrophobicContact CB-CD2 4.21Å; L216-F236 HydrophobicContact CD1-CD2 4.04Å; L216-F236 HydrophobicContact CD1-CE2 4.32Å; L216-F236 PolarHBondContact O-N 3.47Å; L216-Y241 HydrophobicContact CD1-CE2 4.26Å |
| 217 | E | 86.4 | Confident | 87.2 | Confident | 58 Ų | 58 | 48.2 Ų | 48.2 | 27% | 0.271 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -83.8 | -31.6 | 177.2 | -168.8 | -118.4 | 170.2 | 0 | 0 | 112.3 | F213 L214 K219 G234 F236 | F213-E217 HydrophobicContact CD2-CB 4.48Å; F213-E217 HydrophobicContact CE2-CB 3.91Å; F213-E217 HydrophobicContact CE2-CG 4.12Å; F213-E217 HydrophobicContact CZ-CB 4.06Å; F213-E217 HydrophobicContact CZ-CG 4.02Å; F213-E217 WeakPolarHBondContact O-CB 3.35Å; F213-E217 PolarHBondContact O-N 2.9Å; L214-E217 PolarHBondContact O-N 3.35Å; E217-K219 PolarHBondContact O-N 2.83Å; E217-G234 WeakPolarHBondContact O-CA 3.43Å; E217-G234 PolarHBondContact O-N 2.85Å; E217-F236 WeakPolarHBondContact CA-O 3.33Å |
| 218 | S | 84.6 | Confident | 86.8 | Confident | 25 Ų | 25 | 52.4 Ų | 52.4 | 18% | 0.175 | 26% | 0.261 | C | S | . | . | trans | -66.5 | 123.7 | 176.7 | 169.7 | 0 | 0 | 0 | 0 | 112.2 | L214 E220 F221 C222 | L214-S218 WeakPolarHBondContact O-CB 3.18Å; L214-S218 PolarHBondContact O-N 3.32Å; S218-E220 PolarHBondContact OG-N 3.24Å; S218-E220 PolarHBondContact OG-OE2 2.88Å; S218-E220 VanDerWaalsContact OG-OE2 3.05Å; S218-F221 PolarHBondContact OG-N 2.82Å; S218-F221 VanDerWaalsContact OG-N 3.11Å; S218-C222 WeakPolarHBondContact O-CB 3.19Å; S218-C222 PolarHBondContact O-N 3.41Å; S218-C222 VanDerWaalsContact O-N 3.08Å; S218-C222 PolarHBondContact O-SG 2.87Å | ||
| 219 | K | 85.2 | Confident | 86.4 | Confident | 91 Ų | 91 | 57.4 Ų | 57.4 | 40% | 0.396 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.7 | -39.6 | 172.7 | 64.7 | -175.8 | 180 | -174.3 | 0 | 111.6 | E217 C222 N223 | E217-K219 PolarHBondContact O-N 2.83Å; K219-C222 PolarHBondContact O-N 3.33Å; K219-N223 VanDerWaalsContact O-CB 3.25Å; K219-N223 WeakPolarHBondContact O-CB 3.42Å; K219-N223 PolarHBondContact O-N 3.08Å; K219-N223 PolarHBondContact O-ND2 2.64Å |
| 220 | E | 84 | Confident | 86 | Confident | 105 Ų | 105 | 62.4 Ų | 62.4 | 49% | 0.491 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.2 | -48.6 | 180 | -63.4 | 74.9 | -163.8 | 0 | 0 | 110.6 | S218 N223 R224 | S218-E220 PolarHBondContact OG-N 3.24Å; S218-E220 PolarHBondContact OG-OE2 2.88Å; S218-E220 VanDerWaalsContact OG-OE2 3.05Å; E220-N223 PolarHBondContact O-N 3.03Å; E220-R224 WeakPolarHBondContact O-CB 3.29Å; E220-R224 PolarHBondContact O-N 3.11Å |
| 221 | F | 84 | Confident | 85.9 | Confident | 38 Ų | 38 | 66.4 Ų | 66.4 | 17% | 0.167 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.3 | -49.4 | 177.1 | -177.8 | -83.6 | 0 | 0 | 0 | 111.2 | A215 S218 N223 R224 Y225 L226 F327 | A215-F221 HydrophobicContact CB-CD1 3.94Å; A215-F221 HydrophobicContact CB-CD2 4.16Å; A215-F221 HydrophobicContact CB-CE1 3.86Å; A215-F221 HydrophobicContact CB-CE2 4.05Å; A215-F221 HydrophobicContact CB-CG 4.1Å; A215-F221 HydrophobicContact CB-CZ 3.92Å; A215-F221 WeakPolarHBondContact O-CB 3.36Å; A215-F221 WeakPolarHBondContact O-CD1 3.46Å; A215-F221 WeakPolarHBondContact O-CG 3.26Å; S218-F221 PolarHBondContact OG-N 2.82Å; S218-F221 VanDerWaalsContact OG-N 3.11Å; F221-N223 PolarHBondContact O-N 3.21Å; F221-R224 PolarHBondContact O-N 3.16Å; F221-Y225 AromaticContact CD2-CD2 3.81Å; F221-Y225 HydrophobicContact CD2-CD2 3.81Å; F221-Y225 HydrophobicContact CD2-CE2 4.22Å; F221-Y225 AromaticContact CE2-CD2 3.87Å; F221-Y225 HydrophobicContact CE2-CD2 3.87Å; F221-Y225 HydrophobicContact CE2-CE2 4.33Å; F221-Y225 HydrophobicContact CE2-CG 4.5Å; F221-Y225 HydrophobicContact CG-CD2 4.19Å; F221-Y225 HydrophobicContact CZ-CD2 4.26Å; F221-Y225 PolarHBondContact O-N 3.07Å; F221-L226 HydrophobicContact CD1-CD1 4.34Å; F221-L226 HydrophobicContact CE1-CD1 4.03Å; F221-L226 HydrophobicContact CE1-CG 4.18Å; F221-F327 HydrophobicContact CD2-CE2 4.2Å; F221-F327 AromaticContact CD2-CZ 3.78Å; F221-F327 HydrophobicContact CD2-CZ 3.78Å; F221-F327 AromaticContact CE2-CE1 3.85Å; F221-F327 HydrophobicContact CE2-CE1 3.85Å; F221-F327 HydrophobicContact CE2-CE2 4.22Å; F221-F327 AromaticContact CE2-CZ 3.39Å; F221-F327 HydrophobicContact CE2-CZ 3.39Å |
| 222 | C | 85.1 | Confident | 85.7 | Confident | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 37% | 0.371 | C | S | . | . | I | π-helix | trans | -61.5 | -43.3 | -178.7 | -71.5 | 0 | 0 | 0 | 0 | 112 | L216 S218 K219 R224 L226 R227 M235 | L216-C222 PolarHBondContact O-SG 3.39Å; L216-C222 VanDerWaalsContact O-SG 3.39Å; S218-C222 WeakPolarHBondContact O-CB 3.19Å; S218-C222 PolarHBondContact O-N 3.41Å; S218-C222 VanDerWaalsContact O-N 3.08Å; S218-C222 PolarHBondContact O-SG 2.87Å; K219-C222 PolarHBondContact O-N 3.33Å; C222-R224 VanDerWaalsContact C-N 3.31Å; C222-R224 PolarHBondContact O-N 3.23Å; C222-L226 CarbonylContact O-C 3.51Å; C222-L226 WeakPolarHBondContact O-CA 3.15Å; C222-L226 PolarHBondContact O-N 3.04Å; C222-R227 WeakPolarHBondContact O-CB 3.27Å; C222-R227 PolarHBondContact O-N 2.89Å; C222-M235 PolarHBondContact SG-N 3.15Å; C222-M235 VanDerWaalsContact SG-N 3.35Å |
| 223 | N | 87.3 | Confident | 85.4 | Confident | 45 Ų | 45 | 77.4 Ų | 77.4 | 24% | 0.241 | 38% | 0.384 | C | S | . | . | I | π-helix | trans | -69.3 | -28.6 | 178.7 | -68.4 | -19.1 | 0 | 0 | 0 | 112.8 | K219 E220 F221 R227 L231 | K219-N223 VanDerWaalsContact O-CB 3.25Å; K219-N223 WeakPolarHBondContact O-CB 3.42Å; K219-N223 PolarHBondContact O-N 3.08Å; K219-N223 PolarHBondContact O-ND2 2.64Å; E220-N223 PolarHBondContact O-N 3.03Å; F221-N223 PolarHBondContact O-N 3.21Å; N223-R227 PolarHBondContact OD1-NH1 3.07Å; N223-L231 PolarHBondContact ND2-O 3.05Å; N223-L231 PolarHBondContact OD1-N 3.48Å; N223-L231 PolarHBondContact OD1-O 3.23Å |
| 224 | R | 85.3 | Confident | 85.1 | Confident | 165 Ų | 165 | 77.9 Ų | 77.9 | 62% | 0.623 | 39% | 0.388 | S | S | * | . | I | π-helix | trans | -83.5 | -37 | -179.6 | -173.8 | 172.6 | 179.6 | -176.9 | 1.7 | 113.6 | E220 F221 C222 | E220-R224 WeakPolarHBondContact O-CB 3.29Å; E220-R224 PolarHBondContact O-N 3.11Å; F221-R224 PolarHBondContact O-N 3.16Å; C222-R224 VanDerWaalsContact C-N 3.31Å; C222-R224 PolarHBondContact O-N 3.23Å |
| 225 | Y | 84.4 | Confident | 85 | Confident | 115 Ų | 115 | 79.7 Ų | 79.7 | 45% | 0.451 | 40% | 0.397 | S | S | . | . | I | π-helix | trans | -119.3 | -27.5 | -168.6 | -65.9 | -76.1 | 0 | 0 | 0 | 115.4 | F221 F327 | F221-Y225 AromaticContact CD2-CD2 3.81Å; F221-Y225 HydrophobicContact CD2-CD2 3.81Å; F221-Y225 HydrophobicContact CD2-CE2 4.22Å; F221-Y225 AromaticContact CE2-CD2 3.87Å; F221-Y225 HydrophobicContact CE2-CD2 3.87Å; F221-Y225 HydrophobicContact CE2-CE2 4.33Å; F221-Y225 HydrophobicContact CE2-CG 4.5Å; F221-Y225 HydrophobicContact CG-CD2 4.19Å; F221-Y225 HydrophobicContact CZ-CD2 4.26Å; F221-Y225 PolarHBondContact O-N 3.07Å; Y225-F327 HydrophobicContact CD2-CZ 4.11Å; Y225-F327 AromaticContact CE2-CE2 3.92Å; Y225-F327 HydrophobicContact CE2-CE2 3.92Å; Y225-F327 AromaticContact CE2-CZ 3.41Å; Y225-F327 HydrophobicContact CE2-CZ 3.41Å; Y225-F327 VanDerWaalsContact CE2-CZ 3.41Å; Y225-F327 AromaticContact CZ-CZ 3.65Å |
| 226 | L | 84 | Confident | 85.1 | Confident | 88 Ų | 88 | 83.3 Ų | 83.3 | 46% | 0.461 | 41% | 0.41 | S | S | . | . | I | π-helix | trans | -112.2 | -28.9 | -171 | -63.4 | 178.3 | 0 | 0 | 0 | 113.7 | L216 F221 C222 M235 | L216-L226 HydrophobicContact CD2-CD1 3.82Å; F221-L226 HydrophobicContact CD1-CD1 4.34Å; F221-L226 HydrophobicContact CE1-CD1 4.03Å; F221-L226 HydrophobicContact CE1-CG 4.18Å; C222-L226 CarbonylContact O-C 3.51Å; C222-L226 WeakPolarHBondContact O-CA 3.15Å; C222-L226 PolarHBondContact O-N 3.04Å; L226-M235 HydrophobicContact CB-CE 4.28Å; L226-M235 HydrophobicContact CD1-CE 4.44Å |
| 227 | R | 83.7 | Confident | 85.1 | Confident | 40 Ų | 40 | 84 Ų | 84 | 15% | 0.151 | 42% | 0.416 | C | S | . | . | trans | -106.8 | 148.6 | -175.8 | -65.4 | -170.7 | -176.8 | 133.7 | -3.9 | 112.6 | C222 N223 L231 R233 G234 | C222-R227 WeakPolarHBondContact O-CB 3.27Å; C222-R227 PolarHBondContact O-N 2.89Å; N223-R227 PolarHBondContact OD1-NH1 3.07Å; R227-L231 PolarHBondContact NH1-O 3.36Å; R227-R233 PolarHBondContact NH1-O 3.35Å; R227-R233 PolarHBondContact NH2-O 2.9Å; R227-G234 PolarHBondContact NH2-O 3.32Å | ||
| 228 | S | 82.9 | Confident | 85.2 | Confident | 132 Ų | 132 | 81.7 Ų | 81.7 | 92% | 0.923 | 41% | 0.405 | S | S | * | . | S | Bend | trans | -89.7 | -33.4 | 170.4 | -51.7 | 0 | 0 | 0 | 0 | 112.5 | ||
| 229 | E | 85.6 | Confident | 85.6 | Confident | 155 Ų | 155 | 81 Ų | 81 | 72% | 0.724 | 40% | 0.4 | S | S | * | . | S | Bend | trans | -111.9 | 131.8 | 174.8 | -66.9 | -175 | 172.6 | 0 | 0 | 110.3 | ||
| 230 | P | 84.5 | Confident | 85.9 | Confident | 106 Ų | 106 | 80.4 Ų | 80.4 | 69% | 0.688 | 40% | 0.399 | S | S | * | . | trans | -71.4 | 133.4 | -177 | 28.8 | -33.5 | 0 | 0 | 0 | 111.4 | ||||
| 231 | L | 87.1 | Confident | 86.5 | Confident | 94 Ų | 94 | 76 Ų | 76 | 49% | 0.492 | 38% | 0.378 | S | S | . | . | trans | -129.1 | 153.2 | 173.7 | -67.1 | 169.4 | 0 | 0 | 0 | 110.5 | N223 R227 R233 | N223-L231 PolarHBondContact ND2-O 3.05Å; N223-L231 PolarHBondContact OD1-N 3.48Å; N223-L231 PolarHBondContact OD1-O 3.23Å; R227-L231 PolarHBondContact NH1-O 3.36Å; L231-R233 PolarHBondContact O-N 3.08Å; L231-R233 VanDerWaalsContact O-N 3.14Å | ||
| 232 | D | 83.9 | Confident | 87 | Confident | 152 Ų | 152 | 74.4 Ų | 74.4 | 81% | 0.813 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -80.3 | 14.1 | -175.1 | -68.8 | -33.5 | 0 | 0 | 0 | 115.2 | ||
| 233 | R | 82.7 | Confident | 87.5 | Confident | 132 Ų | 132 | 80.1 Ų | 80.1 | 50% | 0.498 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -132.5 | 156.9 | -178.3 | 59 | 176.2 | -108.6 | 173.3 | 1.3 | 112.3 | R227 L231 E240 | R227-R233 PolarHBondContact NH1-O 3.35Å; R227-R233 PolarHBondContact NH2-O 2.9Å; L231-R233 PolarHBondContact O-N 3.08Å; L231-R233 VanDerWaalsContact O-N 3.14Å; R233-E240 IonicContact NH2-OE1 3.35Å |
| 234 | G | 83.5 | Confident | 88 | Confident | 10 Ų | 10 | 83.2 Ų | 83.2 | 10% | 0.103 | 41% | 0.405 | C | S | . | . | trans | -59.8 | 171.2 | 164.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L216 E217 R227 F236 | L216-G234 CarbonylContact O-C 3.59Å; L216-G234 WeakPolarHBondContact O-CA 3.16Å; E217-G234 WeakPolarHBondContact O-CA 3.43Å; E217-G234 PolarHBondContact O-N 2.85Å; R227-G234 PolarHBondContact NH2-O 3.32Å; G234-F236 VanDerWaalsContact C-N 3.31Å | ||
| 235 | M | 85.1 | Confident | 88.6 | Confident | 68 Ų | 68 | 76.3 Ų | 76.3 | 34% | 0.335 | 38% | 0.379 | S | S | . | . | S | Bend | trans | -61.9 | -45.2 | 169.1 | -172.6 | 66.8 | 74.3 | 0 | 0 | 110.2 | L216 C222 L226 | L216-M235 HydrophobicContact CD2-CB 4.36Å; L216-M235 PolarHBondContact O-N 3.05Å; C222-M235 PolarHBondContact SG-N 3.15Å; C222-M235 VanDerWaalsContact SG-N 3.35Å; L226-M235 HydrophobicContact CB-CE 4.28Å; L226-M235 HydrophobicContact CD1-CE 4.44Å |
| 236 | F | 88.5 | Confident | 89.2 | Confident | 93 Ų | 93 | 70.9 Ų | 70.9 | 41% | 0.408 | 36% | 0.358 | S | S | . | . | S | Bend | trans | -129.6 | 135.4 | 176.9 | -58.9 | -70 | 0 | 0 | 0 | 109.9 | L216 E217 G234 E240 | L216-F236 HydrophobicContact CB-CD2 4.21Å; L216-F236 HydrophobicContact CD1-CD2 4.04Å; L216-F236 HydrophobicContact CD1-CE2 4.32Å; L216-F236 PolarHBondContact O-N 3.47Å; E217-F236 WeakPolarHBondContact CA-O 3.33Å; G234-F236 VanDerWaalsContact C-N 3.31Å; F236-E240 WeakPolarHBondContact CA-OE2 3.43Å |
| 237 | T | 88.9 | Confident | 89.9 | Confident | 53 Ų | 53 | 69.9 Ų | 69.9 | 33% | 0.325 | 35% | 0.352 | S | S | . | . | trans | -73.7 | 160.4 | 165.5 | 58.6 | 0 | 0 | 0 | 0 | 110.4 | S239 E240 Y241 | T237-S239 PolarHBondContact O-N 3.36Å; T237-E240 PolarHBondContact N-OE2 2.97Å; T237-E240 PolarHBondContact O-N 3.23Å; T237-E240 WeakPolarHBondContact OG1-CB 3.42Å; T237-E240 VanDerWaalsContact OG1-CG 3.23Å; T237-E240 WeakPolarHBondContact OG1-CG 3.18Å; T237-E240 PolarHBondContact OG1-N 3.15Å; T237-E240 PolarHBondContact OG1-OE2 2.87Å; T237-Y241 WeakPolarHBondContact O-CB 3.45Å; T237-Y241 PolarHBondContact O-N 3.23Å | ||
| 238 | L | 89.1 | Confident | 90.5 | Very high | 8 Ų | 8 | 69.4 Ų | 69.4 | 4% | 0.042 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -55 | -40.3 | 172.8 | 178.2 | 56.4 | 0 | 0 | 0 | 112 | L70 I74 V141 L145 F213 Y241 L242 | L70-L238 HydrophobicContact CD2-CD1 4.3Å; I74-L238 HydrophobicContact CD1-CD2 4.11Å; V141-L238 HydrophobicContact CB-CD2 4.48Å; V141-L238 HydrophobicContact CG1-CD2 4.32Å; V141-L238 HydrophobicContact CG1-CG 4.14Å; V141-L238 HydrophobicContact CG2-CD2 3.41Å; V141-L238 VanDerWaalsContact CG2-CD2 3.41Å; V141-L238 HydrophobicContact CG2-CG 4.05Å; L145-L238 HydrophobicContact CD1-CD2 3.77Å; F213-L238 HydrophobicContact CE1-CD1 4.13Å; F213-L238 HydrophobicContact CE2-CB 4.04Å; F213-L238 HydrophobicContact CE2-CD1 3.72Å; F213-L238 HydrophobicContact CE2-CG 4.45Å; F213-L238 HydrophobicContact CZ-CB 3.87Å; F213-L238 HydrophobicContact CZ-CD1 3.49Å; F213-L238 VanDerWaalsContact CZ-CD1 3.49Å; F213-L238 HydrophobicContact CZ-CG 4.13Å; L238-Y241 PolarHBondContact O-N 2.97Å; L238-L242 HydrophobicContact CD1-CD1 3.89Å; L238-L242 HydrophobicContact CD1-CG 4.02Å; L238-L242 HydrophobicContact CG-CD1 3.9Å; L238-L242 HydrophobicContact CG-CG 4.49Å; L238-L242 WeakPolarHBondContact O-CB 3.04Å; L238-L242 WeakPolarHBondContact O-CD1 3.18Å; L238-L242 VanDerWaalsContact O-CG 3.31Å; L238-L242 WeakPolarHBondContact O-CG 3.35Å; L238-L242 PolarHBondContact O-N 2.81Å |
| 239 | S | 92 | Very high | 91.2 | Very high | 11 Ų | 11 | 63.1 Ų | 63.1 | 8% | 0.077 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -58.7 | -49.3 | 175.2 | -61.8 | 0 | 0 | 0 | 0 | 112.3 | S138 V141 D142 T237 Y243 | S138-S239 VanDerWaalsContact CB-O 3.3Å; S138-S239 WeakPolarHBondContact CB-O 3.47Å; S138-S239 VanDerWaalsContact O-CB 3.24Å; S138-S239 WeakPolarHBondContact O-CB 3.47Å; S138-S239 PolarHBondContact O-OG 2.83Å; S138-S239 PolarHBondContact OG-O 2.93Å; V141-S239 WeakPolarHBondContact CG1-OG 3.41Å; D142-S239 PolarHBondContact OD1-OG 2.85Å; D142-S239 VanDerWaalsContact OD1-OG 3.12Å; D142-S239 PolarHBondContact OD2-OG 3.04Å; T237-S239 PolarHBondContact O-N 3.36Å; S239-Y243 WeakPolarHBondContact O-CB 3.28Å; S239-Y243 PolarHBondContact O-N 3.07Å |
| 240 | E | 93.6 | Very high | 91.8 | Very high | 78 Ų | 78 | 59 Ų | 59 | 36% | 0.364 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -65.4 | -38.8 | 177.2 | -71.4 | 164.5 | 150 | 0 | 0 | 112 | R233 F236 T237 Y243 F244 | R233-E240 IonicContact NH2-OE1 3.35Å; F236-E240 WeakPolarHBondContact CA-OE2 3.43Å; T237-E240 PolarHBondContact N-OE2 2.97Å; T237-E240 PolarHBondContact O-N 3.23Å; T237-E240 WeakPolarHBondContact OG1-CB 3.42Å; T237-E240 VanDerWaalsContact OG1-CG 3.23Å; T237-E240 WeakPolarHBondContact OG1-CG 3.18Å; T237-E240 PolarHBondContact OG1-N 3.15Å; T237-E240 PolarHBondContact OG1-OE2 2.87Å; E240-Y243 WeakPolarHBondContact O-CB 3.35Å; E240-Y243 PolarHBondContact O-N 2.84Å; E240-F244 PolarHBondContact O-N 3.39Å |
| 241 | Y | 94.7 | Very high | 92.5 | Very high | 13 Ų | 13 | 58.5 Ų | 58.5 | 5% | 0.051 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -68.2 | -41.9 | -179.4 | -163.7 | -95.1 | 0 | 0 | 0 | 112.1 | L70 L208 F213 L216 T237 L238 Y243 F244 W245 | L70-Y241 HydrophobicContact CD2-CD1 3.79Å; L70-Y241 HydrophobicContact CD2-CE1 3.9Å; L208-Y241 PolarHBondContact O-OH 3.18Å; F213-Y241 HydrophobicContact CB-CD1 4.22Å; F213-Y241 HydrophobicContact CB-CE1 3.8Å; F213-Y241 HydrophobicContact CB-CE2 4.46Å; F213-Y241 AromaticContact CD2-CD1 3.6Å; F213-Y241 HydrophobicContact CD2-CD1 3.6Å; F213-Y241 HydrophobicContact CD2-CD2 4.14Å; F213-Y241 HydrophobicContact CD2-CE1 4.08Å; F213-Y241 AromaticContact CD2-CG 3.64Å; F213-Y241 HydrophobicContact CD2-CG 3.64Å; F213-Y241 HydrophobicContact CE2-CD1 4.44Å; F213-Y241 HydrophobicContact CE2-CG 4.34Å; F213-Y241 HydrophobicContact CG-CD1 4.15Å; F213-Y241 HydrophobicContact CG-CE1 4.23Å; L216-Y241 HydrophobicContact CD1-CE2 4.26Å; T237-Y241 WeakPolarHBondContact O-CB 3.45Å; T237-Y241 PolarHBondContact O-N 3.23Å; L238-Y241 PolarHBondContact O-N 2.97Å; Y241-Y243 VanDerWaalsContact C-N 3.34Å; Y241-F244 PolarHBondContact O-N 2.71Å; Y241-W245 AromaticContact CD1-CD1 3.59Å; Y241-W245 AromaticContact CD1-NE1 3.84Å; Y241-W245 AromaticContact CE1-CD1 3.25Å; Y241-W245 AromaticContact CE1-NE1 3.04Å; Y241-W245 AromaticContact CE2-NE1 3.95Å; Y241-W245 AromaticContact CZ-CD1 3.76Å; Y241-W245 AromaticContact CZ-NE1 3.09Å; Y241-W245 VanDerWaalsContact O-CD1 3.32Å; Y241-W245 PolarHBondContact O-N 2.59Å; Y241-W245 VanDerWaalsContact O-N 3.12Å; Y241-W245 PolarHBondContact OH-NE1 2.95Å |
| 242 | L | 95 | Very high | 92.9 | Very high | 4 Ų | 4 | 54.2 Ų | 54.2 | 2% | 0.021 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.5 | -40.8 | 172 | -76.7 | 164.3 | 0 | 0 | 0 | 111.9 | L70 M134 L137 V141 L238 W245 A246 | L70-L242 HydrophobicContact CD1-CD2 3.89Å; M134-L242 HydrophobicContact CB-CD2 4.4Å; M134-L242 HydrophobicContact CG-CD2 4.26Å; L137-L242 HydrophobicContact CB-CD1 3.84Å; L137-L242 HydrophobicContact CB-CD2 4.48Å; L137-L242 HydrophobicContact CD1-CD2 4.46Å; V141-L242 HydrophobicContact CB-CD1 4.31Å; V141-L242 HydrophobicContact CG1-CD1 4.08Å; L238-L242 HydrophobicContact CD1-CD1 3.89Å; L238-L242 HydrophobicContact CD1-CG 4.02Å; L238-L242 HydrophobicContact CG-CD1 3.9Å; L238-L242 HydrophobicContact CG-CG 4.49Å; L238-L242 WeakPolarHBondContact O-CB 3.04Å; L238-L242 WeakPolarHBondContact O-CD1 3.18Å; L238-L242 VanDerWaalsContact O-CG 3.31Å; L238-L242 WeakPolarHBondContact O-CG 3.35Å; L238-L242 PolarHBondContact O-N 2.81Å; L242-W245 PolarHBondContact O-N 3.38Å; L242-A246 WeakPolarHBondContact O-CB 3.21Å; L242-A246 PolarHBondContact O-N 3.27Å |
| 243 | Y | 96.6 | Very high | 93.5 | Very high | 121 Ų | 121 | 47 Ų | 47 | 48% | 0.475 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -61.8 | -45.1 | 176.7 | -177.2 | -105.6 | 0 | 0 | 0 | 111.8 | L135 S138 S239 E240 Y241 W245 A246 I247 | L135-Y243 HydrophobicContact CD1-CD2 3.55Å; L135-Y243 HydrophobicContact CD1-CE2 3.68Å; S138-Y243 WeakPolarHBondContact OG-CB 3.45Å; S239-Y243 WeakPolarHBondContact O-CB 3.28Å; S239-Y243 PolarHBondContact O-N 3.07Å; E240-Y243 WeakPolarHBondContact O-CB 3.35Å; E240-Y243 PolarHBondContact O-N 2.84Å; Y241-Y243 VanDerWaalsContact C-N 3.34Å; Y243-W245 PolarHBondContact O-N 2.82Å; Y243-A246 WeakPolarHBondContact O-CB 2.88Å; Y243-A246 PolarHBondContact O-N 3.42Å; Y243-I247 HydrophobicContact CD1-CD1 3.9Å; Y243-I247 HydrophobicContact CE1-CD1 3.34Å; Y243-I247 HydrophobicContact CE1-CG1 4.36Å; Y243-I247 HydrophobicContact CE2-CD1 4.4Å; Y243-I247 PolarHBondContact O-N 3.46Å; Y243-I247 VanDerWaalsContact O-N 3.11Å |
| 244 | F | 97.2 | Very high | 94.2 | Very high | 110 Ų | 110 | 43.3 Ų | 43.3 | 48% | 0.482 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -56.4 | -51.4 | 175.7 | 169.1 | -100.1 | 0 | 0 | 0 | 111.4 | E240 Y241 A246 I247 V248 | E240-F244 PolarHBondContact O-N 3.39Å; Y241-F244 PolarHBondContact O-N 2.71Å; F244-A246 VanDerWaalsContact C-N 3.35Å; F244-A246 PolarHBondContact O-N 3.03Å; F244-I247 PolarHBondContact O-N 3.3Å; F244-V248 HydrophobicContact CD1-CG2 4.47Å; F244-V248 HydrophobicContact CE1-CG2 4.01Å; F244-V248 HydrophobicContact CE2-CG2 4.13Å; F244-V248 HydrophobicContact CZ-CG2 3.83Å; F244-V248 WeakPolarHBondContact O-CG2 3.34Å; F244-V248 PolarHBondContact O-N 3.03Å |
| 245 | W | 97.1 | Very high | 94.8 | Very high | 19 Ų | 19 | 47 Ų | 47 | 7% | 0.072 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.1 | -34.7 | 179.3 | -77.2 | 110.4 | 0 | 0 | 0 | 112.8 | L62 L63 I66 M134 L208 Y241 L242 Y243 I247 V248 F249 | L62-W245 HydrophobicContact CD2-CH2 4.2Å; L62-W245 HydrophobicContact CD2-CZ3 4.4Å; L63-W245 HydrophobicContact CD2-CE3 4.36Å; L63-W245 HydrophobicContact CD2-CZ3 4Å; I66-W245 HydrophobicContact CB-CD2 4.47Å; I66-W245 HydrophobicContact CD1-CD2 4.13Å; I66-W245 HydrophobicContact CD1-CE3 4.29Å; I66-W245 HydrophobicContact CD1-CH2 3.45Å; I66-W245 VanDerWaalsContact CD1-CH2 3.45Å; I66-W245 HydrophobicContact CD1-CZ2 3.24Å; I66-W245 HydrophobicContact CD1-CZ3 3.98Å; I66-W245 HydrophobicContact CG1-CD2 4.06Å; I66-W245 HydrophobicContact CG1-CE3 3.9Å; I66-W245 HydrophobicContact CG1-CH2 3.78Å; I66-W245 HydrophobicContact CG1-CZ2 3.94Å; I66-W245 HydrophobicContact CG1-CZ3 3.76Å; I66-W245 HydrophobicContact CG2-CB 4.29Å; I66-W245 HydrophobicContact CG2-CD2 3.71Å; I66-W245 HydrophobicContact CG2-CE3 4.21Å; I66-W245 HydrophobicContact CG2-CG 3.72Å; M134-W245 HydrophobicContact CE-CB 4.25Å; M134-W245 HydrophobicContact SD-CB 3.66Å; L208-W245 HydrophobicContact CB-CZ2 4.33Å; L208-W245 HydrophobicContact CD1-CH2 4.2Å; L208-W245 HydrophobicContact CD1-CZ2 4.34Å; Y241-W245 AromaticContact CD1-CD1 3.59Å; Y241-W245 AromaticContact CD1-NE1 3.84Å; Y241-W245 AromaticContact CE1-CD1 3.25Å; Y241-W245 AromaticContact CE1-NE1 3.04Å; Y241-W245 AromaticContact CE2-NE1 3.95Å; Y241-W245 AromaticContact CZ-CD1 3.76Å; Y241-W245 AromaticContact CZ-NE1 3.09Å; Y241-W245 VanDerWaalsContact O-CD1 3.32Å; Y241-W245 PolarHBondContact O-N 2.59Å; Y241-W245 VanDerWaalsContact O-N 3.12Å; Y241-W245 PolarHBondContact OH-NE1 2.95Å; L242-W245 PolarHBondContact O-N 3.38Å; Y243-W245 PolarHBondContact O-N 2.82Å; W245-I247 VanDerWaalsContact C-N 3.31Å; W245-I247 PolarHBondContact O-N 3.48Å; W245-V248 HydrophobicContact CE3-CB 3.99Å; W245-V248 HydrophobicContact CE3-CG1 3.93Å; W245-V248 HydrophobicContact CE3-CG2 4.38Å; W245-V248 HydrophobicContact CZ3-CB 4.4Å; W245-V248 HydrophobicContact CZ3-CG1 3.88Å; W245-V248 PolarHBondContact O-N 3.46Å; W245-V248 VanDerWaalsContact O-N 3.16Å; W245-F249 WeakPolarHBondContact O-CB 3.19Å; W245-F249 VanDerWaalsContact O-CD2 3.29Å; W245-F249 WeakPolarHBondContact O-CD2 3.16Å; W245-F249 PolarHBondContact O-N 2.84Å |
| 246 | A | 97.6 | Very high | 95.2 | Very high | 1 Ų | 1 | 44.1 Ų | 44.1 | 1% | 0.008 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -54.8 | -48.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | G131 M134 L135 L242 Y243 F244 V248 F249 F250 | G131-A246 WeakPolarHBondContact O-CB 3.5Å; M134-A246 HydrophobicContact CB-CB 3.81Å; L135-A246 HydrophobicContact CB-CB 3.96Å; L242-A246 WeakPolarHBondContact O-CB 3.21Å; L242-A246 PolarHBondContact O-N 3.27Å; Y243-A246 WeakPolarHBondContact O-CB 2.88Å; Y243-A246 PolarHBondContact O-N 3.42Å; F244-A246 VanDerWaalsContact C-N 3.35Å; F244-A246 PolarHBondContact O-N 3.03Å; A246-V248 PolarHBondContact O-N 3.47Å; A246-F249 WeakPolarHBondContact O-CB 3.07Å; A246-F249 PolarHBondContact O-N 3.35Å; A246-F250 WeakPolarHBondContact O-CD2 3.28Å; A246-F250 PolarHBondContact O-N 3.14Å |
| 247 | I | 98 | Very high | 95.5 | Very high | 68 Ų | 68 | 42.5 Ų | 42.5 | 35% | 0.349 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -60.5 | -46.7 | 176.3 | -67 | 171.7 | 0 | 0 | 0 | 111 | Y243 F244 W245 F249 F250 I251 | Y243-I247 HydrophobicContact CD1-CD1 3.9Å; Y243-I247 HydrophobicContact CE1-CD1 3.34Å; Y243-I247 HydrophobicContact CE1-CG1 4.36Å; Y243-I247 HydrophobicContact CE2-CD1 4.4Å; Y243-I247 PolarHBondContact O-N 3.46Å; Y243-I247 VanDerWaalsContact O-N 3.11Å; F244-I247 PolarHBondContact O-N 3.3Å; W245-I247 VanDerWaalsContact C-N 3.31Å; W245-I247 PolarHBondContact O-N 3.48Å; I247-F249 VanDerWaalsContact C-N 3.27Å; I247-F249 PolarHBondContact O-N 3.46Å; I247-F250 PolarHBondContact O-N 3.05Å; I247-F250 VanDerWaalsContact O-N 3.15Å; I247-I251 HydrophobicContact CG2-CD1 3.59Å; I247-I251 HydrophobicContact CG2-CG1 4.18Å; I247-I251 WeakPolarHBondContact O-CG1 3.42Å; I247-I251 PolarHBondContact O-N 3.16Å |
| 248 | V | 97.8 | Very high | 95.6 | Very high | 30 Ų | 30 | 45.9 Ų | 45.9 | 18% | 0.182 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.8 | -40.5 | 177.9 | 174.2 | 0 | 0 | 0 | 0 | 111 | L63 F244 W245 A246 S252 | L63-V248 HydrophobicContact CD2-CG1 3.94Å; F244-V248 HydrophobicContact CD1-CG2 4.47Å; F244-V248 HydrophobicContact CE1-CG2 4.01Å; F244-V248 HydrophobicContact CE2-CG2 4.13Å; F244-V248 HydrophobicContact CZ-CG2 3.83Å; F244-V248 WeakPolarHBondContact O-CG2 3.34Å; F244-V248 PolarHBondContact O-N 3.03Å; W245-V248 HydrophobicContact CE3-CB 3.99Å; W245-V248 HydrophobicContact CE3-CG1 3.93Å; W245-V248 HydrophobicContact CE3-CG2 4.38Å; W245-V248 HydrophobicContact CZ3-CB 4.4Å; W245-V248 HydrophobicContact CZ3-CG1 3.88Å; W245-V248 PolarHBondContact O-N 3.46Å; W245-V248 VanDerWaalsContact O-N 3.16Å; A246-V248 PolarHBondContact O-N 3.47Å; V248-S252 WeakPolarHBondContact O-CB 3.11Å; V248-S252 PolarHBondContact O-N 2.85Å; V248-S252 PolarHBondContact O-OG 3.04Å |
| 249 | F | 97.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63 | -45.9 | 174.4 | -93.4 | -100.6 | 0 | 0 | 0 | 111.9 | L63 P67 Q127 I130 M134 W245 A246 I247 S252 T253 | L63-F249 HydrophobicContact CB-CE1 4.26Å; L63-F249 HydrophobicContact CB-CE2 4.22Å; L63-F249 HydrophobicContact CB-CZ 3.83Å; L63-F249 HydrophobicContact CD2-CD2 4.27Å; L63-F249 HydrophobicContact CD2-CE2 4.04Å; L63-F249 HydrophobicContact CD2-CZ 4.49Å; L63-F249 WeakPolarHBondContact O-CZ 3.46Å; P67-F249 HydrophobicContact CG-CZ 4.19Å; Q127-F249 HydrophobicContact CG-CD1 3.45Å; Q127-F249 VanDerWaalsContact CG-CD1 3.45Å; Q127-F249 HydrophobicContact CG-CE1 3.86Å; I130-F249 HydrophobicContact CB-CD1 3.99Å; I130-F249 HydrophobicContact CB-CE1 3.86Å; I130-F249 HydrophobicContact CD1-CE1 4.17Å; I130-F249 HydrophobicContact CG2-CD1 3.73Å; I130-F249 HydrophobicContact CG2-CE1 3.34Å; I130-F249 HydrophobicContact CG2-CE2 4.36Å; I130-F249 HydrophobicContact CG2-CG 4.4Å; I130-F249 HydrophobicContact CG2-CZ 3.67Å; M134-F249 HydrophobicContact CE-CD2 4.05Å; M134-F249 HydrophobicContact CE-CE2 3.55Å; M134-F249 HydrophobicContact CE-CZ 4.06Å; M134-F249 HydrophobicContact SD-CD2 3.81Å; M134-F249 HydrophobicContact SD-CE2 3.96Å; M134-F249 HydrophobicContact SD-CG 4.46Å; W245-F249 WeakPolarHBondContact O-CB 3.19Å; W245-F249 VanDerWaalsContact O-CD2 3.29Å; W245-F249 WeakPolarHBondContact O-CD2 3.16Å; W245-F249 PolarHBondContact O-N 2.84Å; A246-F249 WeakPolarHBondContact O-CB 3.07Å; A246-F249 PolarHBondContact O-N 3.35Å; I247-F249 VanDerWaalsContact C-N 3.27Å; I247-F249 PolarHBondContact O-N 3.46Å; F249-S252 WeakPolarHBondContact CA-OG 3.44Å; F249-S252 PolarHBondContact O-OG 3.47Å; F249-T253 VanDerWaalsContact O-CB 3.25Å; F249-T253 WeakPolarHBondContact O-CB 3.4Å; F249-T253 PolarHBondContact O-N 2.94Å; F249-T253 PolarHBondContact O-OG1 2.88Å |
| 250 | F | 98.1 | Very high | 95.5 | Very high | 67 Ų | 67 | 55 Ų | 55 | 29% | 0.294 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -61.4 | -47.4 | 176.4 | -78 | -68.5 | 0 | 0 | 0 | 112.3 | Y128 L132 L135 A246 I247 T254 | Y128-F250 AromaticContact CD1-CD1 3.45Å; Y128-F250 HydrophobicContact CD1-CD1 3.45Å; Y128-F250 VanDerWaalsContact CD1-CD1 3.45Å; Y128-F250 AromaticContact CD1-CE1 3.76Å; Y128-F250 HydrophobicContact CD1-CE1 3.76Å; Y128-F250 AromaticContact CE1-CD1 3.73Å; Y128-F250 HydrophobicContact CE1-CD1 3.73Å; Y128-F250 HydrophobicContact CE1-CE1 4.41Å; L132-F250 HydrophobicContact CB-CZ 4.26Å; L135-F250 HydrophobicContact CD2-CE2 4.4Å; A246-F250 WeakPolarHBondContact O-CD2 3.28Å; A246-F250 PolarHBondContact O-N 3.14Å; I247-F250 PolarHBondContact O-N 3.05Å; I247-F250 VanDerWaalsContact O-N 3.15Å; F250-T254 WeakPolarHBondContact O-CB 3.45Å; F250-T254 PolarHBondContact O-N 2.83Å; F250-T254 PolarHBondContact O-OG1 3.22Å |
| 251 | I | 98 | Very high | 95.1 | Very high | 97 Ų | 97 | 54.6 Ų | 54.6 | 50% | 0.497 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -63.5 | -53.1 | 179.9 | -66.6 | 173.5 | 0 | 0 | 0 | 110 | I247 T253 T254 L255 | I247-I251 HydrophobicContact CG2-CD1 3.59Å; I247-I251 HydrophobicContact CG2-CG1 4.18Å; I247-I251 WeakPolarHBondContact O-CG1 3.42Å; I247-I251 PolarHBondContact O-N 3.16Å; I251-T253 VanDerWaalsContact C-N 3.32Å; I251-T253 PolarHBondContact O-N 3.35Å; I251-T254 WeakPolarHBondContact O-CB 3.47Å; I251-T254 PolarHBondContact O-N 2.89Å; I251-T254 VanDerWaalsContact O-N 3.14Å; I251-L255 HydrophobicContact CG2-CD1 3.94Å; I251-L255 HydrophobicContact CG2-CG 4.27Å; I251-L255 WeakPolarHBondContact O-CG 3.46Å; I251-L255 PolarHBondContact O-N 3.37Å |
| 252 | S | 96.6 | Very high | 94.4 | Very high | 4 Ų | 4 | 55.6 Ų | 55.6 | 3% | 0.028 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -58.3 | -43 | -179.8 | 55.7 | 0 | 0 | 0 | 0 | 112.2 | L63 Q127 V248 F249 T254 L255 V256 | L63-S252 WeakPolarHBondContact CD1-OG 3.38Å; Q127-S252 PolarHBondContact NE2-OG 3.36Å; V248-S252 WeakPolarHBondContact O-CB 3.11Å; V248-S252 PolarHBondContact O-N 2.85Å; V248-S252 PolarHBondContact O-OG 3.04Å; F249-S252 WeakPolarHBondContact CA-OG 3.44Å; F249-S252 PolarHBondContact O-OG 3.47Å; S252-T254 VanDerWaalsContact C-N 3.33Å; S252-T254 PolarHBondContact O-N 2.85Å; S252-L255 PolarHBondContact O-N 2.93Å; S252-V256 VanDerWaalsContact O-CG2 3.31Å; S252-V256 WeakPolarHBondContact O-CG2 3.09Å; S252-V256 PolarHBondContact O-N 2.82Å |
| 253 | T | 96.5 | Very high | 93.3 | Very high | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.2 | -43.4 | 177.4 | -52.5 | 0 | 0 | 0 | 0 | 111.2 | I124 Q127 Y128 F249 I251 V256 L257 | I124-T253 HydrophobicContact CB-CG2 4.32Å; I124-T253 HydrophobicContact CD1-CG2 3.79Å; I124-T253 HydrophobicContact CG2-CG2 3.89Å; Q127-T253 HydrophobicContact CB-CG2 4.12Å; Q127-T253 WeakPolarHBondContact CB-OG1 3.44Å; Q127-T253 VanDerWaalsContact CD-OG1 3.31Å; Q127-T253 WeakPolarHBondContact CG-OG1 3.35Å; Q127-T253 PolarHBondContact NE2-OG1 3.1Å; Y128-T253 HydrophobicContact CD1-CG2 3.89Å; Y128-T253 HydrophobicContact CD2-CG2 3.59Å; Y128-T253 HydrophobicContact CE1-CG2 3.75Å; Y128-T253 HydrophobicContact CE2-CG2 3.46Å; Y128-T253 VanDerWaalsContact CE2-CG2 3.46Å; Y128-T253 HydrophobicContact CG-CG2 3.81Å; F249-T253 VanDerWaalsContact O-CB 3.25Å; F249-T253 WeakPolarHBondContact O-CB 3.4Å; F249-T253 PolarHBondContact O-N 2.94Å; F249-T253 PolarHBondContact O-OG1 2.88Å; I251-T253 VanDerWaalsContact C-N 3.32Å; I251-T253 PolarHBondContact O-N 3.35Å; T253-V256 PolarHBondContact O-N 3.5Å; T253-L257 WeakPolarHBondContact O-CB 3.32Å; T253-L257 PolarHBondContact O-N 3.18Å |
| 254 | T | 96.5 | Very high | 91.4 | Very high | 54 Ų | 54 | 59.1 Ų | 59.1 | 33% | 0.331 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.5 | -43.1 | 177.6 | -53.4 | 0 | 0 | 0 | 0 | 111.1 | Y128 F250 I251 S252 L257 L258 | Y128-T254 PolarHBondContact OH-OG1 3.32Å; F250-T254 WeakPolarHBondContact O-CB 3.45Å; F250-T254 PolarHBondContact O-N 2.83Å; F250-T254 PolarHBondContact O-OG1 3.22Å; I251-T254 WeakPolarHBondContact O-CB 3.47Å; I251-T254 PolarHBondContact O-N 2.89Å; I251-T254 VanDerWaalsContact O-N 3.14Å; S252-T254 VanDerWaalsContact C-N 3.33Å; S252-T254 PolarHBondContact O-N 2.85Å; T254-L257 WeakPolarHBondContact O-CB 3.21Å; T254-L257 PolarHBondContact O-N 3.33Å; T254-L258 HydrophobicContact CG2-CD1 3.96Å; T254-L258 HydrophobicContact CG2-CG 4.39Å; T254-L258 VanDerWaalsContact O-CG 3.29Å; T254-L258 WeakPolarHBondContact O-CG 3.37Å; T254-L258 PolarHBondContact O-N 2.63Å |
| 255 | L | 96.1 | Very high | 89.4 | Confident | 87 Ų | 87 | 55.7 Ų | 55.7 | 46% | 0.455 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62 | -44.5 | 176.5 | -67.4 | 175.8 | 0 | 0 | 0 | 111.6 | I251 S252 L257 L258 F259 | I251-L255 HydrophobicContact CG2-CD1 3.94Å; I251-L255 HydrophobicContact CG2-CG 4.27Å; I251-L255 WeakPolarHBondContact O-CG 3.46Å; I251-L255 PolarHBondContact O-N 3.37Å; S252-L255 PolarHBondContact O-N 2.93Å; L255-L257 VanDerWaalsContact C-N 3.33Å; L255-L257 PolarHBondContact O-N 2.91Å; L255-L258 PolarHBondContact O-N 3.23Å; L255-F259 HydrophobicContact CB-CD2 4.34Å; L255-F259 HydrophobicContact CD2-CD2 3.97Å; L255-F259 HydrophobicContact CD2-CE2 3.63Å; L255-F259 WeakPolarHBondContact O-CB 3.45Å; L255-F259 WeakPolarHBondContact O-CD2 3.34Å; L255-F259 PolarHBondContact O-N 3.48Å |
| 256 | V | 94.6 | Very high | 87.1 | Confident | 8 Ų | 8 | 62.5 Ų | 62.5 | 5% | 0.048 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.9 | -41.6 | 176.6 | 175 | 0 | 0 | 0 | 0 | 111.1 | L56 L60 L123 I124 W181 S252 T253 L258 K260 | L56-V256 HydrophobicContact CD1-CG2 4.07Å; L60-V256 HydrophobicContact CD2-CG2 4.24Å; L123-V256 HydrophobicContact CD2-CG1 3.99Å; I124-V256 HydrophobicContact CD1-CB 4.25Å; I124-V256 HydrophobicContact CD1-CG1 4.03Å; W181-V256 HydrophobicContact CH2-CG1 3.76Å; W181-V256 HydrophobicContact CZ3-CG1 3.99Å; S252-V256 VanDerWaalsContact O-CG2 3.31Å; S252-V256 WeakPolarHBondContact O-CG2 3.09Å; S252-V256 PolarHBondContact O-N 2.82Å; T253-V256 PolarHBondContact O-N 3.5Å; V256-L258 VanDerWaalsContact C-N 3.33Å; V256-L258 PolarHBondContact O-N 3.13Å; V256-K260 HydrophobicContact CG1-CB 4.29Å; V256-K260 WeakPolarHBondContact O-CB 3.11Å; V256-K260 PolarHBondContact O-N 2.59Å; V256-K260 VanDerWaalsContact O-N 3.11Å |
| 257 | L | 93.2 | Very high | 84.8 | Confident | 59 Ų | 59 | 66.5 Ų | 66.5 | 31% | 0.309 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -60.5 | -41.9 | 177.4 | 178.1 | 62 | 0 | 0 | 0 | 112.2 | I124 T253 T254 L255 | I124-L257 HydrophobicContact CD1-CB 3.96Å; I124-L257 HydrophobicContact CG1-CB 4.49Å; I124-L257 HydrophobicContact CG1-CD1 4.28Å; I124-L257 HydrophobicContact CG2-CD1 4.42Å; I124-L257 HydrophobicContact CG2-CD2 4.49Å; T253-L257 WeakPolarHBondContact O-CB 3.32Å; T253-L257 PolarHBondContact O-N 3.18Å; T254-L257 WeakPolarHBondContact O-CB 3.21Å; T254-L257 PolarHBondContact O-N 3.33Å; L255-L257 VanDerWaalsContact C-N 3.33Å; L255-L257 PolarHBondContact O-N 2.91Å |
| 258 | L | 92.6 | Very high | 82.8 | Confident | 125 Ų | 125 | 67.3 Ų | 67.3 | 65% | 0.654 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -82.8 | -43 | -175.4 | -66 | 177.4 | 0 | 0 | 0 | 113.3 | T254 L255 V256 | T254-L258 HydrophobicContact CG2-CD1 3.96Å; T254-L258 HydrophobicContact CG2-CG 4.39Å; T254-L258 VanDerWaalsContact O-CG 3.29Å; T254-L258 WeakPolarHBondContact O-CG 3.37Å; T254-L258 PolarHBondContact O-N 2.63Å; L255-L258 PolarHBondContact O-N 3.23Å; V256-L258 VanDerWaalsContact C-N 3.33Å; V256-L258 PolarHBondContact O-N 3.13Å |
| 259 | F | 90.7 | Very high | 80.8 | Confident | 167 Ų | 167 | 67.3 Ų | 67.3 | 73% | 0.732 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -98.4 | -22.2 | -169 | -67.2 | -71.4 | 0 | 0 | 0 | 114.1 | L255 | L255-F259 HydrophobicContact CB-CD2 4.34Å; L255-F259 HydrophobicContact CD2-CD2 3.97Å; L255-F259 HydrophobicContact CD2-CE2 3.63Å; L255-F259 WeakPolarHBondContact O-CB 3.45Å; L255-F259 WeakPolarHBondContact O-CD2 3.34Å; L255-F259 PolarHBondContact O-N 3.48Å |
| 260 | K | 88.3 | Confident | 78.8 | Confident | 42 Ų | 42 | 73.7 Ų | 73.7 | 18% | 0.183 | 41% | 0.411 | C | S | . | . | trans | -100.3 | 106.3 | -176.4 | -168 | 61.2 | 177 | 177.4 | 0 | 112 | N53 L56 K120 W181 V256 | N53-K260 PolarHBondContact OD1-NZ 3.34Å; L56-K260 HydrophobicContact CD2-CD 3.92Å; L56-K260 HydrophobicContact CD2-CG 4.02Å; K120-K260 PolarHBondContact NZ-O 3.2Å; W181-K260 HydrophobicContact CH2-CB 4.13Å; W181-K260 HydrophobicContact CH2-CG 3.43Å; W181-K260 VanDerWaalsContact CH2-CG 3.43Å; W181-K260 HydrophobicContact CZ2-CB 4.43Å; W181-K260 HydrophobicContact CZ2-CD 4.37Å; W181-K260 HydrophobicContact CZ2-CG 3.39Å; V256-K260 HydrophobicContact CG1-CB 4.29Å; V256-K260 WeakPolarHBondContact O-CB 3.11Å; V256-K260 PolarHBondContact O-N 2.59Å; V256-K260 VanDerWaalsContact O-N 3.11Å | ||
| 261 | A | 84 | Confident | 77.1 | Confident | 71 Ų | 71 | 72.6 Ų | 72.6 | 59% | 0.587 | 41% | 0.408 | S | S | * | . | P | Polyproline II helix | trans | -76.9 | 146.6 | 165.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 262 | E | 81.1 | Confident | 75.7 | Confident | 33 Ų | 33 | 75.2 Ų | 75.2 | 15% | 0.154 | 41% | 0.411 | C | S | . | . | P | Polyproline II helix | trans | -93.7 | 136.1 | 167.6 | -86.7 | 179.1 | -121.8 | 0 | 0 | 109 | G117 R118 R119 K120 W181 G264 | G117-E262 WeakPolarHBondContact CA-OE2 3.49Å; R118-E262 PolarHBondContact N-OE2 2.91Å; R119-E262 PolarHBondContact N-OE1 2.94Å; R119-E262 PolarHBondContact N-OE2 3.22Å; R119-E262 VanDerWaalsContact N-OE2 3.15Å; K120-E262 WeakPolarHBondContact CA-OE1 3.25Å; K120-E262 WeakPolarHBondContact CB-OE1 3.2Å; K120-E262 WeakPolarHBondContact CE-OE1 3.49Å; K120-E262 HydrophobicContact CG-CG 4.48Å; K120-E262 WeakPolarHBondContact CG-OE1 3.37Å; K120-E262 PolarHBondContact N-OE1 2.83Å; W181-E262 HydrophobicContact CZ2-CG 4.31Å; E262-G264 PolarHBondContact O-N 2.83Å |
| 263 | N | 70.2 | Confident | 75.2 | Confident | 132 Ų | 132 | 77.2 Ų | 77.2 | 71% | 0.706 | 43% | 0.426 | S | S | * | . | P | Polyproline II helix | trans | -66.5 | 131.2 | 171.2 | -65.7 | -23 | 0 | 0 | 0 | 108 | E265 | N263-E265 PolarHBondContact O-N 3.17Š|
| 264 | G | 58 | Low | 74.9 | Confident | 67 Ų | 67 | 79.7 Ų | 79.7 | 69% | 0.691 | 44% | 0.44 | S | S | * | . | trans | -55.2 | 102.6 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | E262 H266 | E262-G264 PolarHBondContact O-N 2.83Å; G264-H266 PolarHBondContact O-N 3.14Å | ||
| 265 | E | 55.3 | Low | 74.6 | Confident | 38 Ų | 38 | 81.1 Ų | 81.1 | 18% | 0.178 | 45% | 0.452 | C | S | . | . | trans | -78.4 | 67.3 | -179.4 | -68.4 | -172.9 | 150.6 | 0 | 0 | 111.1 | R118 N263 A267 F268 | R118-E265 WeakPolarHBondContact CB-OE2 3.05Å; R118-E265 WeakPolarHBondContact CD-OE2 3.06Å; R118-E265 IonicContact CZ-OE1 2.59Å; R118-E265 IonicContact CZ-OE2 3.89Å; R118-E265 IonicContact NE-OE1 3.34Å; R118-E265 PolarHBondContact NE-OE1 3.21Å; R118-E265 IonicContact NE-OE2 2.72Å; R118-E265 PolarHBondContact NE-OE2 2.92Å; R118-E265 IonicContact NH2-OE1 3.46Å; R118-E265 PolarHBondContact NH2-OE1 3.14Å; R118-E265 IonicContact NH2-OE2 3.88Å; R118-E265 PolarHBondContact NH2-OE2 3Å; N263-E265 PolarHBondContact O-N 3.17Å; E265-A267 PolarHBondContact O-N 2.96Å; E265-F268 HydrophobicContact CB-CD2 4.38Å; E265-F268 HydrophobicContact CG-CD2 4.43Å | ||
| 266 | H | 47.5 | Very low | 74.4 | Confident | 163 Ų | 163 | 82.8 Ų | 82.8 | 76% | 0.755 | 46% | 0.456 | S | S | * | . | G | 310 helix | trans | -68.1 | -23.3 | 169.6 | -71 | -66.3 | 0 | 0 | 0 | 112.1 | G264 F268 | G264-H266 PolarHBondContact O-N 3.14Å; H266-F268 PolarHBondContact O-N 3.14Å |
| 267 | A | 50.6 | Low | 74.2 | Confident | 85 Ų | 85 | 82.7 Ų | 82.7 | 70% | 0.702 | 46% | 0.456 | S | S | * | . | G | 310 helix | trans | -73.5 | -19.8 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | E265 | E265-A267 PolarHBondContact O-N 2.96Š|
| 268 | F | 55.5 | Low | 74.2 | Confident | 85 Ų | 85 | 83.6 Ų | 83.6 | 37% | 0.373 | 46% | 0.456 | S | S | . | . | G | 310 helix | trans | -110.3 | 13.4 | -175 | -64.4 | -75.5 | 0 | 0 | 0 | 114 | E265 H266 D270 M271 | E265-F268 HydrophobicContact CB-CD2 4.38Å; E265-F268 HydrophobicContact CG-CD2 4.43Å; H266-F268 PolarHBondContact O-N 3.14Å; F268-D270 PolarHBondContact O-N 3.39Å; F268-M271 HydrophobicContact CD1-SD 4.36Å; F268-M271 PolarHBondContact O-N 3.26Å |
| 269 | A | 55.6 | Low | 74.3 | Confident | 30 Ų | 30 | 86.7 Ų | 86.7 | 25% | 0.248 | 46% | 0.458 | C | S | . | . | G | 310 helix | trans | -55 | -22.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | R272 | A269-R272 PolarHBondContact O-NE 3.37Å; A269-R272 VanDerWaalsContact O-NE 3.08Å |
| 270 | D | 55.2 | Low | 74.3 | Confident | 133 Ų | 133 | 83 Ų | 83 | 71% | 0.711 | 44% | 0.444 | S | S | * | . | G | 310 helix | trans | -75 | -20 | 178.6 | -75.1 | -24.1 | 0 | 0 | 0 | 114.7 | F268 R272 | F268-D270 PolarHBondContact O-N 3.39Å; D270-R272 PolarHBondContact O-N 3.39Å |
| 271 | M | 62.5 | Low | 74.5 | Confident | 44 Ų | 44 | 82.5 Ų | 82.5 | 22% | 0.217 | 44% | 0.443 | C | S | . | . | G | 310 helix | trans | -79.3 | 4.1 | 179 | -98.6 | -179 | 165.5 | 0 | 0 | 114 | S110 F268 S273 T277 | S110-M271 WeakPolarHBondContact CA-O 3.25Å; S110-M271 WeakPolarHBondContact CB-O 3.42Å; F268-M271 HydrophobicContact CD1-SD 4.36Å; F268-M271 PolarHBondContact O-N 3.26Å; M271-S273 PolarHBondContact O-N 3.11Å; M271-S273 VanDerWaalsContact O-N 3.1Å; M271-T277 HydrophobicContact CE-CG2 4.37Å; M271-T277 PolarHBondContact O-OG1 2.69Å |
| 272 | R | 70.1 | Confident | 75 | Confident | 152 Ų | 152 | 83.7 Ų | 83.7 | 57% | 0.574 | 44% | 0.439 | S | S | * | . | G | 310 helix | trans | -64.6 | -14.2 | -179.5 | -78.2 | -170.3 | -89.1 | -170.7 | -8 | 115.1 | F112 A269 D270 | F112-R272 HydrophobicContact CE1-CG 4.49Å; A269-R272 PolarHBondContact O-NE 3.37Å; A269-R272 VanDerWaalsContact O-NE 3.08Å; D270-R272 PolarHBondContact O-N 3.39Å |
| 273 | S | 85.5 | Confident | 75.6 | Confident | 47 Ų | 47 | 85.3 Ų | 85.3 | 33% | 0.329 | 45% | 0.454 | S | S | . | . | trans | -93.1 | 107.5 | 175.4 | -176 | 0 | 0 | 0 | 0 | 110 | M271 S275 K276 T277 | M271-S273 PolarHBondContact O-N 3.11Å; M271-S273 VanDerWaalsContact O-N 3.1Å; S273-S275 PolarHBondContact O-N 2.88Å; S273-S275 VanDerWaalsContact O-N 3.14Å; S273-K276 WeakPolarHBondContact O-CA 3.24Å; S273-K276 WeakPolarHBondContact O-CB 3.48Å; S273-K276 PolarHBondContact O-N 2.71Å; S273-T277 PolarHBondContact O-N 3.22Å; S273-T277 VanDerWaalsContact O-N 3.08Å; S273-T277 PolarHBondContact O-OG1 3.28Å | ||
| 274 | V | 89.7 | Confident | 76.7 | Confident | 51 Ų | 51 | 83.4 Ų | 83.4 | 31% | 0.309 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -45.1 | -45.8 | 173.3 | -179.2 | 0 | 0 | 0 | 0 | 110.9 | V107 S110 V111 K276 T277 Y278 | V107-V274 HydrophobicContact CG2-CG1 4.14Å; S110-V274 WeakPolarHBondContact OG-CA 3.42Å; S110-V274 VanDerWaalsContact OG-CG2 3.26Å; S110-V274 WeakPolarHBondContact OG-CG2 3.25Å; V111-V274 HydrophobicContact CG2-CG2 3.93Å; V274-K276 PolarHBondContact O-N 2.9Å; V274-T277 PolarHBondContact O-N 3.19Å; V274-Y278 HydrophobicContact CG1-CD2 3.64Å; V274-Y278 HydrophobicContact CG1-CE2 3.5Å; V274-Y278 VanDerWaalsContact O-CD2 3.26Å; V274-Y278 WeakPolarHBondContact O-CD2 3.32Å; V274-Y278 PolarHBondContact O-N 3.41Å |
| 275 | S | 91 | Very high | 78.3 | Confident | 84 Ų | 84 | 83 Ų | 83 | 59% | 0.587 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61.5 | -39.6 | 178.7 | -178.2 | 0 | 0 | 0 | 0 | 113.4 | S273 R279 | S273-S275 PolarHBondContact O-N 2.88Å; S273-S275 VanDerWaalsContact O-N 3.14Å; S275-R279 WeakPolarHBondContact O-CB 3.49Å; S275-R279 PolarHBondContact O-N 2.72Å |
| 276 | K | 90.5 | Very high | 80.2 | Confident | 122 Ų | 122 | 85.6 Ų | 85.6 | 53% | 0.53 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -67 | -41.9 | 176.1 | -68.8 | -176.3 | -176.3 | 178.6 | 0 | 111.2 | S273 V274 R279 Q280 | S273-K276 WeakPolarHBondContact O-CA 3.24Å; S273-K276 WeakPolarHBondContact O-CB 3.48Å; S273-K276 PolarHBondContact O-N 2.71Å; V274-K276 PolarHBondContact O-N 2.9Å; K276-R279 PolarHBondContact O-N 2.83Å; K276-Q280 WeakPolarHBondContact O-CG 3.4Å; K276-Q280 PolarHBondContact O-N 3.42Å |
| 277 | T | 90.8 | Very high | 82.5 | Confident | 7 Ų | 7 | 82.2 Ų | 82.2 | 4% | 0.043 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -64.6 | -41.8 | 178.2 | -48.5 | 0 | 0 | 0 | 0 | 111.2 | P106 D109 M271 S273 V274 Q280 L281 | P106-T277 HydrophobicContact CB-CG2 3.75Å; D109-T277 HydrophobicContact CB-CG2 4.32Å; M271-T277 HydrophobicContact CE-CG2 4.37Å; M271-T277 PolarHBondContact O-OG1 2.69Å; S273-T277 PolarHBondContact O-N 3.22Å; S273-T277 VanDerWaalsContact O-N 3.08Å; S273-T277 PolarHBondContact O-OG1 3.28Å; V274-T277 PolarHBondContact O-N 3.19Å; T277-Q280 PolarHBondContact O-N 3.39Å; T277-L281 PolarHBondContact O-N 3.03Å |
| 278 | Y | 94.3 | Very high | 84.7 | Confident | 78 Ų | 78 | 86.9 Ų | 86.9 | 31% | 0.306 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61.9 | -43.3 | 171.2 | -86.6 | -72.9 | 0 | 0 | 0 | 112.5 | L103 P106 V107 V274 Q280 L281 L282 | L103-Y278 WeakPolarHBondContact O-CE1 3.07Å; L103-Y278 PolarHBondContact O-OH 2.99Å; P106-Y278 HydrophobicContact CB-CD1 4.08Å; P106-Y278 HydrophobicContact CB-CD2 3.89Å; P106-Y278 HydrophobicContact CB-CE1 4.03Å; P106-Y278 HydrophobicContact CB-CE2 3.85Å; P106-Y278 HydrophobicContact CB-CG 4Å; P106-Y278 HydrophobicContact CG-CD1 3.81Å; P106-Y278 HydrophobicContact CG-CE1 3.72Å; P106-Y278 HydrophobicContact CG-CE2 4.45Å; P106-Y278 HydrophobicContact CG-CG 4.21Å; V107-Y278 HydrophobicContact CG2-CE2 4.03Å; V274-Y278 HydrophobicContact CG1-CD2 3.64Å; V274-Y278 HydrophobicContact CG1-CE2 3.5Å; V274-Y278 VanDerWaalsContact O-CD2 3.26Å; V274-Y278 WeakPolarHBondContact O-CD2 3.32Å; V274-Y278 PolarHBondContact O-N 3.41Å; Y278-Q280 VanDerWaalsContact C-N 3.28Å; Y278-Q280 PolarHBondContact O-N 3.44Å; Y278-L281 PolarHBondContact O-N 3.24Å; Y278-L282 WeakPolarHBondContact O-CB 3.37Å; Y278-L282 VanDerWaalsContact O-CG 3.3Å; Y278-L282 WeakPolarHBondContact O-CG 3.39Å; Y278-L282 PolarHBondContact O-N 3.33Å |
| 279 | R | 93.4 | Very high | 86.6 | Confident | 189 Ų | 189 | 87.6 Ų | 87.6 | 71% | 0.713 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -61.1 | -38.9 | 176.7 | -177.2 | 179 | -76.8 | -91.8 | 2.5 | 111.5 | S275 K276 S283 | S275-R279 WeakPolarHBondContact O-CB 3.49Å; S275-R279 PolarHBondContact O-N 2.72Å; K276-R279 PolarHBondContact O-N 2.83Å; R279-S283 WeakPolarHBondContact O-CB 3.41Å; R279-S283 PolarHBondContact O-N 2.93Å |
| 280 | Q | 90.9 | Very high | 88.4 | Confident | 90 Ų | 90 | 88.2 Ų | 88.2 | 42% | 0.421 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.4 | -47.5 | 174.3 | -74.6 | 175.7 | -17 | 0 | 0 | 111.5 | K276 T277 Y278 L282 S283 I284 | K276-Q280 WeakPolarHBondContact O-CG 3.4Å; K276-Q280 PolarHBondContact O-N 3.42Å; T277-Q280 PolarHBondContact O-N 3.39Å; Y278-Q280 VanDerWaalsContact C-N 3.28Å; Y278-Q280 PolarHBondContact O-N 3.44Å; Q280-L282 VanDerWaalsContact C-N 3.34Å; Q280-L282 PolarHBondContact O-N 2.91Å; Q280-S283 WeakPolarHBondContact CA-OG 3.44Å; Q280-S283 PolarHBondContact O-N 2.91Å; Q280-S283 VanDerWaalsContact O-N 3.1Å; Q280-S283 PolarHBondContact O-OG 3.08Å; Q280-I284 WeakPolarHBondContact O-CG1 3.36Å; Q280-I284 PolarHBondContact O-N 2.88Å |
| 281 | L | 92.7 | Very high | 90.4 | Very high | 32 Ų | 32 | 85.7 Ų | 85.7 | 17% | 0.168 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -56.9 | -48.3 | 175.7 | 173.5 | 62.3 | 0 | 0 | 0 | 111.4 | L102 P106 T277 Y278 S283 I284 M285 | L102-L281 HydrophobicContact CD1-CD1 3.65Å; L102-L281 HydrophobicContact CD1-CD2 4.2Å; L102-L281 HydrophobicContact CD2-CD1 4.48Å; L102-L281 HydrophobicContact CG-CD1 4.18Å; L102-L281 HydrophobicContact CG-CD2 4.07Å; P106-L281 HydrophobicContact CG-CB 4.35Å; P106-L281 HydrophobicContact CG-CD2 3.5Å; T277-L281 PolarHBondContact O-N 3.03Å; Y278-L281 PolarHBondContact O-N 3.24Å; L281-S283 VanDerWaalsContact C-N 3.3Å; L281-S283 PolarHBondContact O-N 2.89Å; L281-I284 PolarHBondContact O-N 3.28Å; L281-I284 VanDerWaalsContact O-N 3.16Å; L281-M285 HydrophobicContact CD1-CG 4.24Å; L281-M285 HydrophobicContact CD1-SD 4.41Å; L281-M285 HydrophobicContact CG-CE 4.19Å; L281-M285 HydrophobicContact CG-SD 4.42Å; L281-M285 WeakPolarHBondContact O-CG 3.33Å; L281-M285 PolarHBondContact O-N 2.8Å |
| 282 | L | 93.9 | Very high | 92 | Very high | 96 Ų | 96 | 86.2 Ų | 86.2 | 50% | 0.503 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -58.3 | -42.5 | 175.5 | -71.7 | 172 | 0 | 0 | 0 | 111.4 | Y278 Q280 I284 M285 C286 | Y278-L282 WeakPolarHBondContact O-CB 3.37Å; Y278-L282 VanDerWaalsContact O-CG 3.3Å; Y278-L282 WeakPolarHBondContact O-CG 3.39Å; Y278-L282 PolarHBondContact O-N 3.33Å; Q280-L282 VanDerWaalsContact C-N 3.34Å; Q280-L282 PolarHBondContact O-N 2.91Å; L282-I284 VanDerWaalsContact C-N 3.3Å; L282-I284 PolarHBondContact O-N 3.43Å; L282-M285 HydrophobicContact CD2-CE 3.45Å; L282-M285 VanDerWaalsContact CD2-CE 3.45Å; L282-M285 HydrophobicContact CG-CE 4.31Å; L282-M285 PolarHBondContact O-N 2.92Å; L282-C286 PolarHBondContact O-N 3.15Å; L282-C286 PolarHBondContact O-SG 2.9Å |
| 283 | S | 94 | Very high | 93.1 | Very high | 67 Ų | 67 | 83.2 Ų | 83.2 | 47% | 0.469 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.6 | -35.8 | 177.8 | 74 | 0 | 0 | 0 | 0 | 113.1 | R279 Q280 L281 C286 | R279-S283 WeakPolarHBondContact O-CB 3.41Å; R279-S283 PolarHBondContact O-N 2.93Å; Q280-S283 WeakPolarHBondContact CA-OG 3.44Å; Q280-S283 PolarHBondContact O-N 2.91Å; Q280-S283 VanDerWaalsContact O-N 3.1Å; Q280-S283 PolarHBondContact O-OG 3.08Å; L281-S283 VanDerWaalsContact C-N 3.3Å; L281-S283 PolarHBondContact O-N 2.89Å; S283-C286 PolarHBondContact O-N 3.03Å |
| 284 | I | 93 | Very high | 93.5 | Very high | 92 Ų | 92 | 84.2 Ų | 84.2 | 47% | 0.472 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -71.1 | -43.6 | 176.1 | -65.3 | 166.8 | 0 | 0 | 0 | 110.3 | Q280 L281 L282 C286 L287 V290 | Q280-I284 WeakPolarHBondContact O-CG1 3.36Å; Q280-I284 PolarHBondContact O-N 2.88Å; L281-I284 PolarHBondContact O-N 3.28Å; L281-I284 VanDerWaalsContact O-N 3.16Å; L282-I284 VanDerWaalsContact C-N 3.3Å; L282-I284 PolarHBondContact O-N 3.43Å; I284-C286 PolarHBondContact O-N 3.32Å; I284-L287 HydrophobicContact CG2-CD1 4.42Å; I284-L287 WeakPolarHBondContact O-CB 3.15Å; I284-L287 WeakPolarHBondContact O-CG 3.26Å; I284-L287 PolarHBondContact O-N 3.42Å; I284-L287 VanDerWaalsContact O-N 3.08Å; I284-V290 HydrophobicContact CG2-CG2 4.47Å |
| 285 | M | 92.5 | Very high | 93.7 | Very high | 58 Ų | 58 | 85.2 Ų | 85.2 | 29% | 0.286 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -62.9 | -25.2 | 176.9 | -68.7 | -168.3 | -56.7 | 0 | 0 | 112.9 | L102 L281 L282 L287 I291 | L102-M285 HydrophobicContact CD2-SD 3.78Å; L281-M285 HydrophobicContact CD1-CG 4.24Å; L281-M285 HydrophobicContact CD1-SD 4.41Å; L281-M285 HydrophobicContact CG-CE 4.19Å; L281-M285 HydrophobicContact CG-SD 4.42Å; L281-M285 WeakPolarHBondContact O-CG 3.33Å; L281-M285 PolarHBondContact O-N 2.8Å; L282-M285 HydrophobicContact CD2-CE 3.45Å; L282-M285 VanDerWaalsContact CD2-CE 3.45Å; L282-M285 HydrophobicContact CG-CE 4.31Å; L282-M285 PolarHBondContact O-N 2.92Å; M285-L287 VanDerWaalsContact C-N 3.32Å; M285-I291 WeakPolarHBondContact O-CG1 3.48Å |
| 286 | C | 94.6 | Very high | 93.8 | Very high | 93 Ų | 93 | 85.1 Ų | 85.1 | 63% | 0.628 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.2 | -3.2 | 176 | -69.4 | 0 | 0 | 0 | 0 | 114.4 | L282 S283 I284 | L282-C286 PolarHBondContact O-N 3.15Å; L282-C286 PolarHBondContact O-SG 2.9Å; S283-C286 PolarHBondContact O-N 3.03Å; I284-C286 PolarHBondContact O-N 3.32Å |
| 287 | L | 96.2 | Very high | 93.8 | Very high | 92 Ų | 92 | 87.4 Ų | 87.4 | 48% | 0.482 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -69.9 | 131.6 | 177.2 | -65 | 173.9 | 0 | 0 | 0 | 110.5 | I284 M285 P289 V290 I291 | I284-L287 HydrophobicContact CG2-CD1 4.42Å; I284-L287 WeakPolarHBondContact O-CB 3.15Å; I284-L287 WeakPolarHBondContact O-CG 3.26Å; I284-L287 PolarHBondContact O-N 3.42Å; I284-L287 VanDerWaalsContact O-N 3.08Å; M285-L287 VanDerWaalsContact C-N 3.32Å; L287-P289 VanDerWaalsContact C-CD 3.5Å; L287-V290 HydrophobicContact CB-CB 4.19Å; L287-V290 HydrophobicContact CB-CG2 3.92Å; L287-V290 HydrophobicContact CD1-CG2 4.35Å; L287-V290 WeakPolarHBondContact O-CA 3.47Å; L287-V290 WeakPolarHBondContact O-CB 3.37Å; L287-V290 PolarHBondContact O-N 2.98Å; L287-I291 WeakPolarHBondContact O-CG1 3.37Å; L287-I291 PolarHBondContact O-N 3.06Å |
| 288 | K | 96.1 | Very high | 93.7 | Very high | 183 Ų | 183 | 93 Ų | 93 | 80% | 0.796 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -50.4 | -45.2 | -178.3 | -62.2 | -179.6 | -179.2 | 176.1 | 0 | 113.7 | V290 I291 A292 | K288-V290 VanDerWaalsContact C-N 3.33Å; K288-V290 PolarHBondContact O-N 2.84Å; K288-I291 PolarHBondContact O-N 3.38Å; K288-A292 WeakPolarHBondContact O-CB 3.3Å; K288-A292 PolarHBondContact O-N 3.14Å |
| 289 | P | 95.9 | Very high | 93.6 | Very high | 100 Ų | 100 | 93.4 Ų | 93.4 | 65% | 0.649 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.6 | -35.7 | 177 | -22 | 35.1 | 0 | 0 | 0 | 113.1 | L287 A292 L293 | L287-P289 VanDerWaalsContact C-CD 3.5Å; P289-A292 PolarHBondContact O-N 3.41Å; P289-L293 VanDerWaalsContact O-CB 3.31Å; P289-L293 WeakPolarHBondContact O-CB 3.28Å; P289-L293 PolarHBondContact O-N 2.92Å |
| 290 | V | 94.5 | Very high | 93.4 | Very high | 42 Ų | 42 | 87 Ų | 87 | 26% | 0.255 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.7 | -43.4 | 178.2 | 177.7 | 0 | 0 | 0 | 0 | 110.3 | I284 L287 K288 A292 L293 I294 | I284-V290 HydrophobicContact CG2-CG2 4.47Å; L287-V290 HydrophobicContact CB-CB 4.19Å; L287-V290 HydrophobicContact CB-CG2 3.92Å; L287-V290 HydrophobicContact CD1-CG2 4.35Å; L287-V290 WeakPolarHBondContact O-CA 3.47Å; L287-V290 WeakPolarHBondContact O-CB 3.37Å; L287-V290 PolarHBondContact O-N 2.98Å; K288-V290 VanDerWaalsContact C-N 3.33Å; K288-V290 PolarHBondContact O-N 2.84Å; V290-A292 VanDerWaalsContact C-N 3.35Å; V290-A292 PolarHBondContact O-N 3.19Å; V290-L293 PolarHBondContact O-N 2.89Å; V290-I294 HydrophobicContact CG1-CD1 3.85Å; V290-I294 HydrophobicContact CG1-CG1 4.38Å; V290-I294 WeakPolarHBondContact O-CB 3.03Å; V290-I294 VanDerWaalsContact O-CG1 3.24Å; V290-I294 WeakPolarHBondContact O-CG1 3.46Å; V290-I294 PolarHBondContact O-N 3.08Å |
| 291 | I | 95.8 | Very high | 93.1 | Very high | 80 Ų | 80 | 89 Ų | 89 | 41% | 0.41 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.5 | -46.9 | 174.2 | -63.5 | 171.4 | 0 | 0 | 0 | 110.5 | M285 L287 K288 L293 I294 C295 | M285-I291 WeakPolarHBondContact O-CG1 3.48Å; L287-I291 WeakPolarHBondContact O-CG1 3.37Å; L287-I291 PolarHBondContact O-N 3.06Å; K288-I291 PolarHBondContact O-N 3.38Å; I291-L293 VanDerWaalsContact C-N 3.31Å; I291-L293 PolarHBondContact O-N 3.1Å; I291-I294 PolarHBondContact O-N 3.24Å; I291-C295 PolarHBondContact O-N 3.02Å; I291-C295 PolarHBondContact O-SG 3.08Å; I291-C295 VanDerWaalsContact O-SG 3.37Å |
| 292 | A | 96.1 | Very high | 92.9 | Very high | 55 Ų | 55 | 93.2 Ų | 93.2 | 46% | 0.455 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.9 | -44.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | K288 P289 V290 C295 V296 | K288-A292 WeakPolarHBondContact O-CB 3.3Å; K288-A292 PolarHBondContact O-N 3.14Å; P289-A292 PolarHBondContact O-N 3.41Å; V290-A292 VanDerWaalsContact C-N 3.35Å; V290-A292 PolarHBondContact O-N 3.19Å; A292-C295 PolarHBondContact O-N 2.89Å; A292-V296 WeakPolarHBondContact O-CG2 3.38Å; A292-V296 PolarHBondContact O-N 3.42Å |
| 293 | L | 94.2 | Very high | 92.5 | Very high | 89 Ų | 89 | 92.9 Ų | 92.9 | 47% | 0.466 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.7 | -40.8 | 177.7 | -170.8 | 64.6 | 0 | 0 | 0 | 112.3 | P289 V290 I291 V296 Y297 | P289-L293 VanDerWaalsContact O-CB 3.31Å; P289-L293 WeakPolarHBondContact O-CB 3.28Å; P289-L293 PolarHBondContact O-N 2.92Å; V290-L293 PolarHBondContact O-N 2.89Å; I291-L293 VanDerWaalsContact C-N 3.31Å; I291-L293 PolarHBondContact O-N 3.1Å; L293-V296 PolarHBondContact O-N 3.32Å; L293-Y297 HydrophobicContact CD1-CD2 3.83Å; L293-Y297 HydrophobicContact CD1-CE2 3.3Å; L293-Y297 HydrophobicContact CD2-CD2 4.43Å; L293-Y297 HydrophobicContact CD2-CE2 3.85Å; L293-Y297 HydrophobicContact CG-CD2 3.64Å; L293-Y297 HydrophobicContact CG-CE2 3.37Å; L293-Y297 VanDerWaalsContact O-CD2 3.27Å; L293-Y297 WeakPolarHBondContact O-CD2 3.41Å; L293-Y297 PolarHBondContact O-N 3.33Å |
| 294 | I | 93.1 | Very high | 92.2 | Very high | 69 Ų | 69 | 95.2 Ų | 95.2 | 35% | 0.354 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.7 | -48 | 173.7 | -71.1 | 165.6 | 0 | 0 | 0 | 110.4 | V290 I291 V296 Y297 L298 | V290-I294 HydrophobicContact CG1-CD1 3.85Å; V290-I294 HydrophobicContact CG1-CG1 4.38Å; V290-I294 WeakPolarHBondContact O-CB 3.03Å; V290-I294 VanDerWaalsContact O-CG1 3.24Å; V290-I294 WeakPolarHBondContact O-CG1 3.46Å; V290-I294 PolarHBondContact O-N 3.08Å; I291-I294 PolarHBondContact O-N 3.24Å; I294-V296 VanDerWaalsContact C-N 3.31Å; I294-V296 PolarHBondContact O-N 2.99Å; I294-Y297 PolarHBondContact O-N 3.3Å; I294-L298 HydrophobicContact CG2-CD1 3.65Å; I294-L298 HydrophobicContact CG2-CG 4.22Å; I294-L298 WeakPolarHBondContact O-CB 3.3Å; I294-L298 VanDerWaalsContact O-CG 3.31Å; I294-L298 WeakPolarHBondContact O-CG 3.44Å; I294-L298 PolarHBondContact O-N 3.28Å |
| 295 | C | 94.3 | Very high | 91.7 | Very high | 71 Ų | 71 | 93.8 Ų | 93.8 | 48% | 0.48 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.5 | -42.3 | 178 | -71.3 | 0 | 0 | 0 | 0 | 111.8 | I291 A292 T299 | I291-C295 PolarHBondContact O-N 3.02Å; I291-C295 PolarHBondContact O-SG 3.08Å; I291-C295 VanDerWaalsContact O-SG 3.37Å; A292-C295 PolarHBondContact O-N 2.89Å; C295-T299 WeakPolarHBondContact O-CB 3.17Å; C295-T299 WeakPolarHBondContact O-CG2 3.48Å; C295-T299 PolarHBondContact O-N 3.2Å; C295-T299 PolarHBondContact O-OG1 3.29Å |
| 296 | V | 93.7 | Very high | 91.3 | Very high | 83 Ų | 83 | 94 Ų | 94 | 50% | 0.503 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.9 | -50.8 | 176.9 | 171.8 | 0 | 0 | 0 | 0 | 110.5 | A292 L293 I294 L298 T299 A300 | A292-V296 WeakPolarHBondContact O-CG2 3.38Å; A292-V296 PolarHBondContact O-N 3.42Å; L293-V296 PolarHBondContact O-N 3.32Å; I294-V296 VanDerWaalsContact C-N 3.31Å; I294-V296 PolarHBondContact O-N 2.99Å; V296-L298 VanDerWaalsContact C-N 3.34Å; V296-L298 PolarHBondContact O-N 2.91Å; V296-T299 PolarHBondContact O-N 3.23Å; V296-T299 PolarHBondContact O-OG1 3.13Å; V296-A300 WeakPolarHBondContact O-CB 3.17Å; V296-A300 PolarHBondContact O-N 3.4Å |
| 297 | Y | 89.3 | Confident | 90.9 | Very high | 169 Ų | 169 | 91.9 Ų | 91.9 | 66% | 0.663 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.4 | -34.7 | -178 | -78.1 | -53.2 | 0 | 0 | 0 | 113.4 | L293 I294 | L293-Y297 HydrophobicContact CD1-CD2 3.83Å; L293-Y297 HydrophobicContact CD1-CE2 3.3Å; L293-Y297 HydrophobicContact CD2-CD2 4.43Å; L293-Y297 HydrophobicContact CD2-CE2 3.85Å; L293-Y297 HydrophobicContact CG-CD2 3.64Å; L293-Y297 HydrophobicContact CG-CE2 3.37Å; L293-Y297 VanDerWaalsContact O-CD2 3.27Å; L293-Y297 WeakPolarHBondContact O-CD2 3.41Å; L293-Y297 PolarHBondContact O-N 3.33Å; I294-Y297 PolarHBondContact O-N 3.3Å |
| 298 | L | 89.4 | Confident | 90.2 | Very high | 125 Ų | 125 | 92.4 Ų | 92.4 | 65% | 0.654 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -71.2 | -28.4 | 177 | -72.7 | 176.6 | 0 | 0 | 0 | 113.1 | I294 V296 I302 | I294-L298 HydrophobicContact CG2-CD1 3.65Å; I294-L298 HydrophobicContact CG2-CG 4.22Å; I294-L298 WeakPolarHBondContact O-CB 3.3Å; I294-L298 VanDerWaalsContact O-CG 3.31Å; I294-L298 WeakPolarHBondContact O-CG 3.44Å; I294-L298 PolarHBondContact O-N 3.28Å; V296-L298 VanDerWaalsContact C-N 3.34Å; V296-L298 PolarHBondContact O-N 2.91Å; L298-I302 WeakPolarHBondContact O-CD1 3.38Å; L298-I302 WeakPolarHBondContact O-CG1 3.34Å |
| 299 | T | 91.7 | Very high | 89.3 | Confident | 87 Ų | 87 | 86.1 Ų | 86.1 | 53% | 0.534 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -101.5 | -32.8 | -174.8 | 58.2 | 0 | 0 | 0 | 0 | 114 | C295 V296 K301 I302 | C295-T299 WeakPolarHBondContact O-CB 3.17Å; C295-T299 WeakPolarHBondContact O-CG2 3.48Å; C295-T299 PolarHBondContact O-N 3.2Å; C295-T299 PolarHBondContact O-OG1 3.29Å; V296-T299 PolarHBondContact O-N 3.23Å; V296-T299 PolarHBondContact O-OG1 3.13Å; T299-K301 PolarHBondContact O-N 3.38Å; T299-K301 VanDerWaalsContact O-N 3.13Å; T299-I302 HydrophobicContact CG2-CD1 4.42Å; T299-I302 PolarHBondContact O-N 2.84Å; T299-I302 VanDerWaalsContact O-N 3.14Å |
| 300 | A | 88.7 | Confident | 88.5 | Confident | 54 Ų | 54 | 85.6 Ų | 85.6 | 45% | 0.446 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.2 | -28.8 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | V296 | V296-A300 WeakPolarHBondContact O-CB 3.17Å; V296-A300 PolarHBondContact O-N 3.4Å |
| 301 | K | 85.6 | Confident | 88.1 | Confident | 133 Ų | 133 | 87.1 Ų | 87.1 | 58% | 0.578 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.7 | -6 | -178.5 | -74 | -67.2 | -164.5 | 167.3 | 0 | 114.6 | T299 A303 F304 A305 D308 | T299-K301 PolarHBondContact O-N 3.38Å; T299-K301 VanDerWaalsContact O-N 3.13Å; K301-A303 VanDerWaalsContact C-N 3.33Å; K301-A303 PolarHBondContact O-N 3.44Å; K301-F304 PolarHBondContact O-N 2.9Å; K301-F304 VanDerWaalsContact O-N 3.14Å; K301-A305 PolarHBondContact O-N 3.25Å; K301-A305 VanDerWaalsContact O-N 3.08Å; K301-D308 IonicContact NZ-OD2 3.46Å |
| 302 | I | 87.3 | Confident | 87.2 | Confident | 120 Ų | 120 | 85.1 Ų | 85.1 | 62% | 0.615 | 51% | 0.514 | S | S | * | . | G | 310 helix | trans | -61.5 | -43.2 | -178.5 | -63.3 | 177.6 | 0 | 0 | 0 | 111 | L298 T299 F304 A305 | L298-I302 WeakPolarHBondContact O-CD1 3.38Å; L298-I302 WeakPolarHBondContact O-CG1 3.34Å; T299-I302 HydrophobicContact CG2-CD1 4.42Å; T299-I302 PolarHBondContact O-N 2.84Å; T299-I302 VanDerWaalsContact O-N 3.14Å; I302-F304 PolarHBondContact O-N 3.45Å; I302-A305 PolarHBondContact O-N 2.81Å |
| 303 | A | 85.8 | Confident | 86.3 | Confident | 89 Ų | 89 | 83.7 Ų | 83.7 | 74% | 0.736 | 50% | 0.499 | S | S | * | . | G | 310 helix | trans | -65.4 | -23.5 | -180 | 0 | 0 | 0 | 0 | 0 | 113.5 | K301 | K301-A303 VanDerWaalsContact C-N 3.33Å; K301-A303 PolarHBondContact O-N 3.44Å |
| 304 | F | 87.7 | Confident | 85.8 | Confident | 115 Ų | 115 | 83.2 Ų | 83.2 | 50% | 0.504 | 49% | 0.493 | S | S | . | . | G | 310 helix | trans | -100.7 | -9.5 | -177.3 | -60.7 | -80 | 0 | 0 | 0 | 113.2 | K301 I302 A306 A307 D308 | K301-F304 PolarHBondContact O-N 2.9Å; K301-F304 VanDerWaalsContact O-N 3.14Å; I302-F304 PolarHBondContact O-N 3.45Å; F304-A306 VanDerWaalsContact C-N 3.32Å; F304-A306 PolarHBondContact O-N 2.62Å; F304-A307 PolarHBondContact O-N 2.89Å; F304-D308 WeakPolarHBondContact O-CB 3.37Å; F304-D308 PolarHBondContact O-N 2.89Å |
| 305 | A | 83.7 | Confident | 85.4 | Confident | 62 Ų | 62 | 82.9 Ų | 82.9 | 51% | 0.512 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -57.5 | -40.5 | -172.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | K301 I302 G309 | K301-A305 PolarHBondContact O-N 3.25Å; K301-A305 VanDerWaalsContact O-N 3.08Å; I302-A305 PolarHBondContact O-N 2.81Å; A305-G309 PolarHBondContact O-N 3.21Å |
| 306 | A | 83 | Confident | 84.6 | Confident | 64 Ų | 64 | 80.8 Ų | 80.8 | 53% | 0.529 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -69.5 | -40.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | F304 I310 | F304-A306 VanDerWaalsContact C-N 3.32Å; F304-A306 PolarHBondContact O-N 2.62Å; A306-I310 HydrophobicContact CB-CD1 4.35Å; A306-I310 VanDerWaalsContact O-CB 3.23Å; A306-I310 WeakPolarHBondContact O-CB 3.37Å; A306-I310 VanDerWaalsContact O-CG1 3.27Å; A306-I310 WeakPolarHBondContact O-CG1 3.04Å; A306-I310 PolarHBondContact O-N 2.94Å; A306-I310 VanDerWaalsContact O-N 3.16Å |
| 307 | A | 86.1 | Confident | 83.9 | Confident | 47 Ų | 47 | 82 Ų | 82 | 39% | 0.388 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.6 | -51.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | F304 G309 T311 | F304-A307 PolarHBondContact O-N 2.89Å; A307-G309 VanDerWaalsContact C-N 3.34Å; A307-G309 PolarHBondContact O-N 2.94Å; A307-T311 WeakPolarHBondContact O-CB 3.41Å; A307-T311 PolarHBondContact O-N 2.85Å; A307-T311 VanDerWaalsContact O-N 3.1Å; A307-T311 PolarHBondContact O-OG1 2.99Å |
| 308 | D | 82.2 | Confident | 83.7 | Confident | 104 Ų | 104 | 80.1 Ų | 80.1 | 56% | 0.556 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -63.7 | -38.9 | -177.7 | -69.2 | -6.7 | 0 | 0 | 0 | 111.5 | K301 F304 | K301-D308 IonicContact NZ-OD2 3.46Å; F304-D308 WeakPolarHBondContact O-CB 3.37Å; F304-D308 PolarHBondContact O-N 2.89Å |
| 309 | G | 77.4 | Confident | 83.3 | Confident | 51 Ų | 51 | 77.1 Ų | 77.1 | 53% | 0.526 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -82.6 | -24.2 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | A305 A307 | A305-G309 PolarHBondContact O-N 3.21Å; A307-G309 VanDerWaalsContact C-N 3.34Å; A307-G309 PolarHBondContact O-N 2.94Å |
| 310 | I | 79.8 | Confident | 82.8 | Confident | 88 Ų | 88 | 75 Ų | 75 | 45% | 0.451 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -112.8 | -30.1 | -169.8 | -54.2 | 171.1 | 0 | 0 | 0 | 112.4 | A306 G312 L313 K314 | A306-I310 HydrophobicContact CB-CD1 4.35Å; A306-I310 VanDerWaalsContact O-CB 3.23Å; A306-I310 WeakPolarHBondContact O-CB 3.37Å; A306-I310 VanDerWaalsContact O-CG1 3.27Å; A306-I310 WeakPolarHBondContact O-CG1 3.04Å; A306-I310 PolarHBondContact O-N 2.94Å; A306-I310 VanDerWaalsContact O-N 3.16Å; I310-G312 PolarHBondContact O-N 3.25Å; I310-L313 PolarHBondContact O-N 3.39Å; I310-L313 VanDerWaalsContact O-N 3.12Å; I310-K314 HydrophobicContact CG2-CB 4.36Å; I310-K314 PolarHBondContact O-N 2.94Å |
| 311 | T | 84.4 | Confident | 82 | Confident | 75 Ų | 75 | 75 Ų | 75 | 46% | 0.46 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -55.7 | -48.9 | -170.8 | -61.2 | 0 | 0 | 0 | 0 | 112.6 | A307 L313 K314 L315 | A307-T311 WeakPolarHBondContact O-CB 3.41Å; A307-T311 PolarHBondContact O-N 2.85Å; A307-T311 VanDerWaalsContact O-N 3.1Å; A307-T311 PolarHBondContact O-OG1 2.99Å; T311-L313 VanDerWaalsContact C-N 3.32Å; T311-L313 PolarHBondContact O-N 3.1Å; T311-K314 PolarHBondContact O-N 3.38Å; T311-L315 HydrophobicContact CG2-CD1 3.95Å; T311-L315 HydrophobicContact CG2-CG 4.35Å; T311-L315 VanDerWaalsContact O-CG 3.32Å; T311-L315 WeakPolarHBondContact O-CG 3.49Å; T311-L315 PolarHBondContact O-N 2.63Å |
| 312 | G | 77.8 | Confident | 81.2 | Confident | 37 Ų | 37 | 71.4 Ų | 71.4 | 38% | 0.381 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -59.1 | -43 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | I310 I316 | I310-G312 PolarHBondContact O-N 3.25Å; G312-I316 WeakPolarHBondContact O-CG1 3.35Å; G312-I316 PolarHBondContact O-N 3.16Å |
| 313 | L | 77.4 | Confident | 80.3 | Confident | 25 Ų | 25 | 67.5 Ų | 67.5 | 13% | 0.131 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -70.7 | -38 | 179.6 | -57.4 | 174.9 | 0 | 0 | 0 | 112.3 | Y85 I310 T311 I316 E317 | Y85-L313 HydrophobicContact CD1-CB 4.49Å; Y85-L313 HydrophobicContact CD1-CD1 3.73Å; Y85-L313 HydrophobicContact CE1-CB 3.54Å; Y85-L313 HydrophobicContact CE1-CD1 3.6Å; Y85-L313 HydrophobicContact CE1-CG 4.2Å; I310-L313 PolarHBondContact O-N 3.39Å; I310-L313 VanDerWaalsContact O-N 3.12Å; T311-L313 VanDerWaalsContact C-N 3.32Å; T311-L313 PolarHBondContact O-N 3.1Å; L313-I316 PolarHBondContact O-N 3.41Å; L313-E317 PolarHBondContact O-N 3.27Å |
| 314 | K | 83.7 | Confident | 79.7 | Confident | 80 Ų | 80 | 68 Ų | 68 | 35% | 0.348 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -69.6 | -35.2 | 179.2 | -165.8 | 70.8 | -158.7 | 170.8 | 0 | 112.3 | I310 T311 I316 E317 L318 | I310-K314 HydrophobicContact CG2-CB 4.36Å; I310-K314 PolarHBondContact O-N 2.94Å; T311-K314 PolarHBondContact O-N 3.38Å; K314-I316 VanDerWaalsContact C-N 3.31Å; K314-I316 PolarHBondContact O-N 3.38Å; K314-E317 WeakPolarHBondContact CD-OE2 3.46Å; K314-E317 IonicContact NZ-OE1 3.37Å; K314-E317 PolarHBondContact NZ-OE1 3.26Å; K314-E317 IonicContact NZ-OE2 3.69Å; K314-E317 PolarHBondContact NZ-OE2 3.37Å; K314-E317 PolarHBondContact O-N 2.92Å; K314-L318 HydrophobicContact CG-CD1 4.22Å; K314-L318 WeakPolarHBondContact O-CB 3.26Å; K314-L318 VanDerWaalsContact O-CG 3.25Å; K314-L318 WeakPolarHBondContact O-CG 3.44Å; K314-L318 PolarHBondContact O-N 2.71Å |
| 315 | L | 83.9 | Confident | 78.9 | Confident | 62 Ų | 62 | 64.2 Ų | 64.2 | 33% | 0.325 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.7 | -42.6 | 172.8 | -72.3 | 171.5 | 0 | 0 | 0 | 111 | T311 L318 G319 V320 L325 | T311-L315 HydrophobicContact CG2-CD1 3.95Å; T311-L315 HydrophobicContact CG2-CG 4.35Å; T311-L315 VanDerWaalsContact O-CG 3.32Å; T311-L315 WeakPolarHBondContact O-CG 3.49Å; T311-L315 PolarHBondContact O-N 2.63Å; L315-L318 CarbonylContact O-C 3.58Å; L315-L318 PolarHBondContact O-N 3.42Å; L315-G319 PolarHBondContact O-N 2.91Å; L315-V320 HydrophobicContact CB-CB 4.2Å; L315-V320 HydrophobicContact CB-CG2 4.06Å; L315-V320 HydrophobicContact CD2-CG2 4.2Å; L315-V320 VanDerWaalsContact O-CB 3.29Å; L315-V320 WeakPolarHBondContact O-CB 3.49Å; L315-V320 WeakPolarHBondContact O-CG2 3.31Å; L315-V320 PolarHBondContact O-N 2.84Å; L315-L325 HydrophobicContact CB-CD1 4.16Å; L315-L325 HydrophobicContact CB-CD2 4.08Å; L315-L325 HydrophobicContact CD1-CD2 3.65Å; L315-L325 HydrophobicContact CG-CD2 4.5Å |
| 316 | I | 77.8 | Confident | 78.1 | Confident | 26 Ų | 26 | 62.3 Ų | 62.3 | 13% | 0.133 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -66.9 | -41.5 | 176.7 | -58.9 | 166.1 | 0 | 0 | 0 | 111.1 | L76 G312 L313 K314 L318 G319 K322 L325 | L76-I316 HydrophobicContact CD2-CD1 3.99Å; G312-I316 WeakPolarHBondContact O-CG1 3.35Å; G312-I316 PolarHBondContact O-N 3.16Å; L313-I316 PolarHBondContact O-N 3.41Å; K314-I316 VanDerWaalsContact C-N 3.31Å; K314-I316 PolarHBondContact O-N 3.38Å; I316-L318 VanDerWaalsContact C-N 3.25Å; I316-L318 PolarHBondContact O-N 3.02Å; I316-G319 PolarHBondContact O-N 3.41Å; I316-K322 HydrophobicContact CD1-CG 4.17Å; I316-K322 HydrophobicContact CG1-CG 4.44Å; I316-K322 HydrophobicContact CG2-CG 4.29Å; I316-L325 HydrophobicContact CD1-CD1 3.72Å; I316-L325 HydrophobicContact CG1-CD1 3.26Å |
| 317 | E | 79.7 | Confident | 77.6 | Confident | 109 Ų | 109 | 62.5 Ų | 62.5 | 51% | 0.509 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.3 | -32.8 | 175.2 | -164 | -168.3 | 143.8 | 0 | 0 | 112.4 | Y85 L313 K314 G319 | Y85-E317 PolarHBondContact OH-OE2 3.42Å; L313-E317 PolarHBondContact O-N 3.27Å; K314-E317 WeakPolarHBondContact CD-OE2 3.46Å; K314-E317 IonicContact NZ-OE1 3.37Å; K314-E317 PolarHBondContact NZ-OE1 3.26Å; K314-E317 IonicContact NZ-OE2 3.69Å; K314-E317 PolarHBondContact NZ-OE2 3.37Å; K314-E317 PolarHBondContact O-N 2.92Å; E317-G319 PolarHBondContact O-N 3.29Å |
| 318 | L | 85.4 | Confident | 77 | Confident | 130 Ų | 130 | 65.6 Ų | 65.6 | 68% | 0.681 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80 | 3.6 | 174.9 | -69.5 | 172.2 | 0 | 0 | 0 | 113.5 | K314 L315 I316 | K314-L318 HydrophobicContact CG-CD1 4.22Å; K314-L318 WeakPolarHBondContact O-CB 3.26Å; K314-L318 VanDerWaalsContact O-CG 3.25Å; K314-L318 WeakPolarHBondContact O-CG 3.44Å; K314-L318 PolarHBondContact O-N 2.71Å; L315-L318 CarbonylContact O-C 3.58Å; L315-L318 PolarHBondContact O-N 3.42Å; I316-L318 VanDerWaalsContact C-N 3.25Å; I316-L318 PolarHBondContact O-N 3.02Å |
| 319 | G | 80.8 | Confident | 76.3 | Confident | 61 Ų | 61 | 62 Ų | 62 | 63% | 0.629 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 95.3 | 9.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | L315 I316 E317 P321 | L315-G319 PolarHBondContact O-N 2.91Å; I316-G319 PolarHBondContact O-N 3.41Å; E317-G319 PolarHBondContact O-N 3.29Å; G319-P321 WeakPolarHBondContact O-CD 3.4Å |
| 320 | V | 79.9 | Confident | 76.3 | Confident | 43 Ų | 43 | 62.5 Ų | 62.5 | 26% | 0.261 | 35% | 0.354 | S | S | . | . | trans | -68.8 | 123.2 | 171 | -177 | 0 | 0 | 0 | 0 | 108.9 | L315 E324 L325 | L315-V320 HydrophobicContact CB-CB 4.2Å; L315-V320 HydrophobicContact CB-CG2 4.06Å; L315-V320 HydrophobicContact CD2-CG2 4.2Å; L315-V320 VanDerWaalsContact O-CB 3.29Å; L315-V320 WeakPolarHBondContact O-CB 3.49Å; L315-V320 WeakPolarHBondContact O-CG2 3.31Å; L315-V320 PolarHBondContact O-N 2.84Å; V320-E324 HydrophobicContact CG1-CB 4.23Å; V320-L325 HydrophobicContact CG1-CD1 4.5Å; V320-L325 HydrophobicContact CG1-CD2 3.95Å; V320-L325 HydrophobicContact CG1-CG 3.84Å | ||
| 321 | P | 73.6 | Confident | 76.1 | Confident | 53 Ų | 53 | 61.9 Ų | 61.9 | 34% | 0.344 | 36% | 0.356 | S | S | . | . | trans | -58.6 | 142.8 | 177 | -22.2 | 33 | 0 | 0 | 0 | 112 | G319 D323 E324 L325 | G319-P321 WeakPolarHBondContact O-CD 3.4Å; P321-D323 VanDerWaalsContact C-N 3.26Å; P321-D323 WeakPolarHBondContact CB-OD1 3.44Å; P321-D323 PolarHBondContact O-N 3.48Å; P321-E324 HydrophobicContact CB-CB 4.38Å; P321-E324 HydrophobicContact CB-CG 4.12Å; P321-E324 HydrophobicContact CG-CG 4.14Å; P321-E324 PolarHBondContact O-N 3.17Å; P321-E324 VanDerWaalsContact O-N 3.15Å; P321-L325 PolarHBondContact O-N 3.37Å | ||
| 322 | K | 68.8 | Low | 75.9 | Confident | 58 Ų | 58 | 62.4 Ų | 62.4 | 25% | 0.252 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.8 | -36.3 | -179.1 | -63.5 | -175.3 | -176.3 | 176.7 | 0 | 112.3 | L76 N80 I316 L325 A326 | L76-K322 PolarHBondContact O-NZ 2.98Å; N80-K322 PolarHBondContact ND2-NZ 2.88Å; N80-K322 VanDerWaalsContact OD1-CE 3.25Å; N80-K322 WeakPolarHBondContact OD1-CE 3.31Å; N80-K322 PolarHBondContact OD1-NZ 3.44Å; I316-K322 HydrophobicContact CD1-CG 4.17Å; I316-K322 HydrophobicContact CG1-CG 4.44Å; I316-K322 HydrophobicContact CG2-CG 4.29Å; K322-L325 PolarHBondContact O-N 3.24Å; K322-A326 PolarHBondContact O-N 2.95Å |
| 323 | D | 68.2 | Low | 75.8 | Confident | 38 Ų | 38 | 61.3 Ų | 61.3 | 20% | 0.203 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.7 | -38.7 | 176.6 | 58.3 | -53 | 0 | 0 | 0 | 111.3 | P321 L325 A326 F327 | P321-D323 VanDerWaalsContact C-N 3.26Å; P321-D323 WeakPolarHBondContact CB-OD1 3.44Å; P321-D323 PolarHBondContact O-N 3.48Å; D323-L325 PolarHBondContact O-N 3.16Å; D323-A326 WeakPolarHBondContact O-CB 3.14Å; D323-A326 PolarHBondContact O-N 3.46Å; D323-F327 HydrophobicContact CB-CE2 4.33Å; D323-F327 WeakPolarHBondContact O-CD2 3.19Å; D323-F327 WeakPolarHBondContact O-CG 3.37Å; D323-F327 PolarHBondContact O-N 3.48Å |
| 324 | E | 72.5 | Confident | 75.9 | Confident | 101 Ų | 101 | 63.2 Ų | 63.2 | 47% | 0.472 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63.7 | -40.1 | 174.4 | -70.7 | -169.6 | 178.6 | 0 | 0 | 112.9 | V320 P321 F327 L328 | V320-E324 HydrophobicContact CG1-CB 4.23Å; P321-E324 HydrophobicContact CB-CB 4.38Å; P321-E324 HydrophobicContact CB-CG 4.12Å; P321-E324 HydrophobicContact CG-CG 4.14Å; P321-E324 PolarHBondContact O-N 3.17Å; P321-E324 VanDerWaalsContact O-N 3.15Å; E324-F327 WeakPolarHBondContact O-CB 3.48Å; E324-F327 PolarHBondContact O-N 3.08Å; E324-L328 PolarHBondContact O-N 2.93Å; E324-L328 VanDerWaalsContact O-N 3.14Å |
| 325 | L | 71.3 | Confident | 76 | Confident | 34 Ų | 34 | 64.5 Ų | 64.5 | 18% | 0.178 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -65.7 | -41.2 | 173.7 | -69.1 | 176.1 | 0 | 0 | 0 | 112 | L315 I316 V320 P321 K322 D323 F327 L328 A329 | L315-L325 HydrophobicContact CB-CD1 4.16Å; L315-L325 HydrophobicContact CB-CD2 4.08Å; L315-L325 HydrophobicContact CD1-CD2 3.65Å; L315-L325 HydrophobicContact CG-CD2 4.5Å; I316-L325 HydrophobicContact CD1-CD1 3.72Å; I316-L325 HydrophobicContact CG1-CD1 3.26Å; V320-L325 HydrophobicContact CG1-CD1 4.5Å; V320-L325 HydrophobicContact CG1-CD2 3.95Å; V320-L325 HydrophobicContact CG1-CG 3.84Å; P321-L325 PolarHBondContact O-N 3.37Å; K322-L325 PolarHBondContact O-N 3.24Å; D323-L325 PolarHBondContact O-N 3.16Å; L325-F327 VanDerWaalsContact C-N 3.27Å; L325-F327 PolarHBondContact O-N 2.67Å; L325-L328 HydrophobicContact CD2-CD1 4.2Å; L325-L328 WeakPolarHBondContact O-CB 3.27Å; L325-L328 PolarHBondContact O-N 2.78Å; L325-L328 VanDerWaalsContact O-N 3.17Å; L325-A329 PolarHBondContact O-N 3.24Å |
| 326 | A | 67.5 | Low | 75.8 | Confident | 22 Ų | 22 | 66.1 Ų | 66.1 | 18% | 0.182 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -60.4 | -39 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | V211 K322 D323 L328 A329 V330 | V211-A326 HydrophobicContact CG1-CB 4.28Å; K322-A326 PolarHBondContact O-N 2.95Å; D323-A326 WeakPolarHBondContact O-CB 3.14Å; D323-A326 PolarHBondContact O-N 3.46Å; A326-L328 VanDerWaalsContact C-N 3.28Å; A326-L328 PolarHBondContact O-N 3.45Å; A326-A329 WeakPolarHBondContact O-CB 3.47Å; A326-A329 PolarHBondContact O-N 3.24Å; A326-V330 WeakPolarHBondContact O-CG2 3.4Å; A326-V330 PolarHBondContact O-N 2.66Å; A326-V330 VanDerWaalsContact O-N 3.17Å |
| 327 | F | 71.5 | Confident | 76 | Confident | 69 Ų | 69 | 66.2 Ų | 66.2 | 30% | 0.303 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.2 | -30.5 | 175 | -80.5 | -63.2 | 0 | 0 | 0 | 113.6 | F221 Y225 D323 E324 L325 A329 V330 P331 | F221-F327 HydrophobicContact CD2-CE2 4.2Å; F221-F327 AromaticContact CD2-CZ 3.78Å; F221-F327 HydrophobicContact CD2-CZ 3.78Å; F221-F327 AromaticContact CE2-CE1 3.85Å; F221-F327 HydrophobicContact CE2-CE1 3.85Å; F221-F327 HydrophobicContact CE2-CE2 4.22Å; F221-F327 AromaticContact CE2-CZ 3.39Å; F221-F327 HydrophobicContact CE2-CZ 3.39Å; Y225-F327 HydrophobicContact CD2-CZ 4.11Å; Y225-F327 AromaticContact CE2-CE2 3.92Å; Y225-F327 HydrophobicContact CE2-CE2 3.92Å; Y225-F327 AromaticContact CE2-CZ 3.41Å; Y225-F327 HydrophobicContact CE2-CZ 3.41Å; Y225-F327 VanDerWaalsContact CE2-CZ 3.41Å; Y225-F327 AromaticContact CZ-CZ 3.65Å; D323-F327 HydrophobicContact CB-CE2 4.33Å; D323-F327 WeakPolarHBondContact O-CD2 3.19Å; D323-F327 WeakPolarHBondContact O-CG 3.37Å; D323-F327 PolarHBondContact O-N 3.48Å; E324-F327 WeakPolarHBondContact O-CB 3.48Å; E324-F327 PolarHBondContact O-N 3.08Å; L325-F327 VanDerWaalsContact C-N 3.27Å; L325-F327 PolarHBondContact O-N 2.67Å; F327-A329 VanDerWaalsContact C-N 3.31Å; F327-V330 PolarHBondContact O-N 2.66Å; F327-P331 WeakPolarHBondContact O-CD 3.18Å |
| 328 | L | 73 | Confident | 76.2 | Confident | 111 Ų | 111 | 65.2 Ų | 65.2 | 58% | 0.581 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -67.3 | -33 | 172.4 | -67.4 | 174.1 | 0 | 0 | 0 | 112.1 | E324 L325 A326 P331 I332 | E324-L328 PolarHBondContact O-N 2.93Å; E324-L328 VanDerWaalsContact O-N 3.14Å; L325-L328 HydrophobicContact CD2-CD1 4.2Å; L325-L328 WeakPolarHBondContact O-CB 3.27Å; L325-L328 PolarHBondContact O-N 2.78Å; L325-L328 VanDerWaalsContact O-N 3.17Å; A326-L328 VanDerWaalsContact C-N 3.28Å; A326-L328 PolarHBondContact O-N 3.45Å; L328-P331 WeakPolarHBondContact O-CD 3.43Å; L328-I332 VanDerWaalsContact O-CD1 3.27Å; L328-I332 WeakPolarHBondContact O-CD1 3.41Å; L328-I332 WeakPolarHBondContact O-CG1 3.43Å |
| 329 | A | 69.1 | Low | 76.2 | Confident | 29 Ų | 29 | 63.5 Ų | 63.5 | 24% | 0.24 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -74.5 | -29.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | V211 L325 A326 F327 I332 V333 | V211-A329 HydrophobicContact CG2-CB 3.95Å; L325-A329 PolarHBondContact O-N 3.24Å; A326-A329 WeakPolarHBondContact O-CB 3.47Å; A326-A329 PolarHBondContact O-N 3.24Å; F327-A329 VanDerWaalsContact C-N 3.31Å; A329-I332 PolarHBondContact O-N 2.97Å; A329-I332 VanDerWaalsContact O-N 3.17Å; A329-V333 VanDerWaalsContact O-CG2 3.27Å; A329-V333 WeakPolarHBondContact O-CG2 3.45Å; A329-V333 PolarHBondContact O-N 3.46Å |
| 330 | V | 76.2 | Confident | 76.2 | Confident | 61 Ų | 61 | 61.9 Ų | 61.9 | 37% | 0.37 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -55.5 | -47.4 | -178.5 | 173.6 | 0 | 0 | 0 | 0 | 114 | F207 V211 A326 F327 P334 | F207-V330 HydrophobicContact CE2-CG2 4.48Å; V211-V330 HydrophobicContact CG1-CG2 3.94Å; A326-V330 WeakPolarHBondContact O-CG2 3.4Å; A326-V330 PolarHBondContact O-N 2.66Å; A326-V330 VanDerWaalsContact O-N 3.17Å; F327-V330 PolarHBondContact O-N 2.66Å; V330-P334 WeakPolarHBondContact O-CD 3.48Å; V330-P334 WeakPolarHBondContact O-CG 3.24Å |
| 331 | P | 76.1 | Confident | 76.3 | Confident | 76 Ų | 76 | 63.8 Ų | 63.8 | 49% | 0.494 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -76.7 | -26.7 | 175.6 | 28.4 | -34.1 | 0 | 0 | 0 | 113.3 | F327 L328 I335 | F327-P331 WeakPolarHBondContact O-CD 3.18Å; L328-P331 WeakPolarHBondContact O-CD 3.43Å; P331-I335 WeakPolarHBondContact O-CD1 3.3Å; P331-I335 WeakPolarHBondContact O-CG1 3.43Å |
| 332 | I | 79.6 | Confident | 76.6 | Confident | 85 Ų | 85 | 67 Ų | 67 | 44% | 0.436 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68.8 | -41.9 | -179.5 | -67.1 | 173.1 | 0 | 0 | 0 | 110.6 | L328 A329 I335 E336 | L328-I332 VanDerWaalsContact O-CD1 3.27Å; L328-I332 WeakPolarHBondContact O-CD1 3.41Å; L328-I332 WeakPolarHBondContact O-CG1 3.43Å; A329-I332 PolarHBondContact O-N 2.97Å; A329-I332 VanDerWaalsContact O-N 3.17Å; I332-I335 WeakPolarHBondContact O-CA 3.36Å; I332-I335 WeakPolarHBondContact O-CB 3.36Å; I332-I335 PolarHBondContact O-N 3.28Å; I332-I335 VanDerWaalsContact O-N 3.07Å; I332-E336 HydrophobicContact CG2-CG 4.01Å; I332-E336 WeakPolarHBondContact CG2-OE1 3.31Å; I332-E336 PolarHBondContact O-N 3.15Å |
| 333 | V | 76.1 | Confident | 77.1 | Confident | 15 Ų | 15 | 68.1 Ų | 68.1 | 9% | 0.091 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -61.7 | -48.4 | -175 | 169.2 | 0 | 0 | 0 | 0 | 113.6 | T203 F207 A329 I335 E336 V337 | T203-V333 HydrophobicContact CG2-CG1 4.36Å; F207-V333 HydrophobicContact CB-CG1 3.65Å; F207-V333 HydrophobicContact CB-CG2 4.28Å; F207-V333 HydrophobicContact CD1-CG1 4.17Å; F207-V333 HydrophobicContact CD2-CB 3.7Å; F207-V333 HydrophobicContact CD2-CG1 3.65Å; F207-V333 HydrophobicContact CD2-CG2 3.34Å; F207-V333 HydrophobicContact CE2-CB 4.04Å; F207-V333 HydrophobicContact CE2-CG1 4.27Å; F207-V333 HydrophobicContact CE2-CG2 3.91Å; F207-V333 HydrophobicContact CG-CB 4.17Å; F207-V333 HydrophobicContact CG-CG1 3.57Å; F207-V333 HydrophobicContact CG-CG2 4.1Å; A329-V333 VanDerWaalsContact O-CG2 3.27Å; A329-V333 WeakPolarHBondContact O-CG2 3.45Å; A329-V333 PolarHBondContact O-N 3.46Å; V333-I335 PolarHBondContact O-N 3.33Å; V333-E336 CarbonylContact O-C 3.59Å; V333-E336 PolarHBondContact O-N 3.04Å; V333-E336 VanDerWaalsContact O-N 3.08Å; V333-V337 HydrophobicContact CG1-CG2 4.23Å; V333-V337 WeakPolarHBondContact O-CG2 3.36Å; V333-V337 PolarHBondContact O-N 3.32Å |
| 334 | P | 79.3 | Confident | 77.2 | Confident | 64 Ų | 64 | 66.4 Ų | 66.4 | 42% | 0.416 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -56.4 | -36.1 | 174 | -26.8 | 34.2 | 0 | 0 | 0 | 112.4 | V330 V337 L338 | V330-P334 WeakPolarHBondContact O-CD 3.48Å; V330-P334 WeakPolarHBondContact O-CG 3.24Å; P334-V337 PolarHBondContact O-N 3.16Å; P334-L338 WeakPolarHBondContact O-CB 3.4Å; P334-L338 WeakPolarHBondContact O-CG 3.22Å; P334-L338 PolarHBondContact O-N 2.99Å |
| 335 | I | 85.2 | Confident | 77.1 | Confident | 108 Ų | 108 | 68.4 Ų | 68.4 | 55% | 0.554 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -65.9 | -46.6 | 175.3 | -61.8 | 169.7 | 0 | 0 | 0 | 109.8 | P331 I332 V333 V337 L338 L339 | P331-I335 WeakPolarHBondContact O-CD1 3.3Å; P331-I335 WeakPolarHBondContact O-CG1 3.43Å; I332-I335 WeakPolarHBondContact O-CA 3.36Å; I332-I335 WeakPolarHBondContact O-CB 3.36Å; I332-I335 PolarHBondContact O-N 3.28Å; I332-I335 VanDerWaalsContact O-N 3.07Å; V333-I335 PolarHBondContact O-N 3.33Å; I335-V337 VanDerWaalsContact C-N 3.26Å; I335-V337 PolarHBondContact O-N 2.85Å; I335-L338 PolarHBondContact O-N 3.29Å; I335-L339 WeakPolarHBondContact O-CB 3.34Å; I335-L339 PolarHBondContact O-N 3.15Å |
| 336 | E | 81.4 | Confident | 77 | Confident | 96 Ų | 96 | 76 Ų | 76 | 45% | 0.449 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.3 | -30.4 | 176.5 | -70.8 | -178.1 | 173.8 | 0 | 0 | 113.4 | T203 I332 V333 P340 | T203-E336 HydrophobicContact CG2-CB 4.04Å; I332-E336 HydrophobicContact CG2-CG 4.01Å; I332-E336 WeakPolarHBondContact CG2-OE1 3.31Å; I332-E336 PolarHBondContact O-N 3.15Å; V333-E336 CarbonylContact O-C 3.59Å; V333-E336 PolarHBondContact O-N 3.04Å; V333-E336 VanDerWaalsContact O-N 3.08Å; E336-P340 WeakPolarHBondContact O-CD 3.46Å; E336-P340 WeakPolarHBondContact O-CG 3.43Å |
| 337 | V | 81.3 | Confident | 77.1 | Confident | 28 Ų | 28 | 78 Ų | 78 | 17% | 0.17 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -80.1 | -40.9 | 176.4 | 173.4 | 0 | 0 | 0 | 0 | 111.4 | V200 T203 V333 P334 I335 | V200-V337 HydrophobicContact CG1-CG1 4.07Å; T203-V337 HydrophobicContact CG2-CG2 3.8Å; V333-V337 HydrophobicContact CG1-CG2 4.23Å; V333-V337 WeakPolarHBondContact O-CG2 3.36Å; V333-V337 PolarHBondContact O-N 3.32Å; P334-V337 PolarHBondContact O-N 3.16Å; I335-V337 VanDerWaalsContact C-N 3.26Å; I335-V337 PolarHBondContact O-N 2.85Å |
| 338 | L | 84.2 | Confident | 76.6 | Confident | 87 Ų | 87 | 76.4 Ų | 76.4 | 46% | 0.455 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -78 | -38.7 | -177.3 | -71.6 | 173.8 | 0 | 0 | 0 | 112.7 | P334 I335 L341 F342 | P334-L338 WeakPolarHBondContact O-CB 3.4Å; P334-L338 WeakPolarHBondContact O-CG 3.22Å; P334-L338 PolarHBondContact O-N 2.99Å; I335-L338 PolarHBondContact O-N 3.29Å; L338-L341 HydrophobicContact CD2-CD1 4.47Å; L338-L341 WeakPolarHBondContact O-CB 3.48Å; L338-L341 PolarHBondContact O-N 3.14Å; L338-F342 HydrophobicContact CB-CD2 4.32Å; L338-F342 HydrophobicContact CB-CE2 4.13Å; L338-F342 WeakPolarHBondContact O-CD2 3.02Å; L338-F342 PolarHBondContact O-N 3.19Å; L338-F342 VanDerWaalsContact O-N 3.1Å |
| 339 | L | 85.1 | Confident | 75.9 | Confident | 94 Ų | 94 | 73.4 Ų | 73.4 | 49% | 0.492 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -58.2 | -46.3 | -174.1 | -177.8 | 70.9 | 0 | 0 | 0 | 112.5 | I335 L341 F342 I343 | I335-L339 WeakPolarHBondContact O-CB 3.34Å; I335-L339 PolarHBondContact O-N 3.15Å; L339-L341 VanDerWaalsContact C-N 3.3Å; L339-L341 PolarHBondContact O-N 3.26Å; L339-F342 PolarHBondContact O-N 3.39Å; L339-I343 HydrophobicContact CD1-CD1 3.92Å; L339-I343 HydrophobicContact CD1-CG1 4.25Å; L339-I343 HydrophobicContact CD2-CD1 4.29Å; L339-I343 HydrophobicContact CG-CD1 3.72Å; L339-I343 HydrophobicContact CG-CG1 4.36Å; L339-I343 WeakPolarHBondContact O-CG1 3.4Å; L339-I343 PolarHBondContact O-N 2.85Å |
| 340 | P | 80.4 | Confident | 75.3 | Confident | 28 Ų | 28 | 77.9 Ų | 77.9 | 18% | 0.182 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -62.7 | -31.4 | 174.2 | -23.1 | 34.6 | 0 | 0 | 0 | 113.8 | T196 V199 E336 F342 G344 | T196-P340 HydrophobicContact CG2-CB 4.47Å; V199-P340 HydrophobicContact CG1-CB 4.22Å; V199-P340 HydrophobicContact CG1-CG 3.64Å; E336-P340 WeakPolarHBondContact O-CD 3.46Å; E336-P340 WeakPolarHBondContact O-CG 3.43Å; P340-F342 VanDerWaalsContact C-N 3.34Å; P340-G344 WeakPolarHBondContact O-CA 3.49Å; P340-G344 PolarHBondContact O-N 3.44Å |
| 341 | L | 81.1 | Confident | 74.2 | Confident | 82 Ų | 82 | 83 Ų | 83 | 43% | 0.429 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -68.3 | -35.1 | 175.9 | -67.4 | 171.1 | 0 | 0 | 0 | 111.7 | T196 V200 L338 L339 | T196-L341 HydrophobicContact CG2-CD2 3.8Å; V200-L341 HydrophobicContact CG2-CD1 4.34Å; V200-L341 HydrophobicContact CG2-CD2 3.85Å; V200-L341 HydrophobicContact CG2-CG 3.79Å; L338-L341 HydrophobicContact CD2-CD1 4.47Å; L338-L341 WeakPolarHBondContact O-CB 3.48Å; L338-L341 PolarHBondContact O-N 3.14Å; L339-L341 VanDerWaalsContact C-N 3.3Å; L339-L341 PolarHBondContact O-N 3.26Å |
| 342 | F | 81.7 | Confident | 72.9 | Confident | 122 Ų | 122 | 83.3 Ų | 83.3 | 54% | 0.535 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -75.7 | -48.2 | 174.9 | -74.1 | -71.8 | 0 | 0 | 0 | 112 | L338 L339 P340 G344 K345 Y346 | L338-F342 HydrophobicContact CB-CD2 4.32Å; L338-F342 HydrophobicContact CB-CE2 4.13Å; L338-F342 WeakPolarHBondContact O-CD2 3.02Å; L338-F342 PolarHBondContact O-N 3.19Å; L338-F342 VanDerWaalsContact O-N 3.1Å; L339-F342 PolarHBondContact O-N 3.39Å; P340-F342 VanDerWaalsContact C-N 3.34Å; F342-G344 VanDerWaalsContact C-N 3.29Å; F342-G344 PolarHBondContact O-N 3.09Å; F342-K345 PolarHBondContact O-N 2.96Å; F342-Y346 WeakPolarHBondContact O-CD2 2.96Å |
| 343 | I | 78.3 | Confident | 71.5 | Confident | 80 Ų | 80 | 86.7 Ų | 86.7 | 41% | 0.41 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.1 | -37.2 | 178.7 | -67.6 | 176.3 | 0 | 0 | 0 | 111 | L339 K345 Y346 T347 | L339-I343 HydrophobicContact CD1-CD1 3.92Å; L339-I343 HydrophobicContact CD1-CG1 4.25Å; L339-I343 HydrophobicContact CD2-CD1 4.29Å; L339-I343 HydrophobicContact CG-CD1 3.72Å; L339-I343 HydrophobicContact CG-CG1 4.36Å; L339-I343 WeakPolarHBondContact O-CG1 3.4Å; L339-I343 PolarHBondContact O-N 2.85Å; I343-K345 PolarHBondContact O-N 3.43Å; I343-Y346 WeakPolarHBondContact O-CA 3.17Å; I343-Y346 PolarHBondContact O-N 3.22Å; I343-T347 HydrophobicContact CG2-CG2 3.53Å; I343-T347 PolarHBondContact O-N 3.35Å; I343-T347 PolarHBondContact O-OG1 2.72Å |
| 344 | G | 69.6 | Low | 69.9 | Low | 2 Ų | 2 | 94.3 Ų | 94.3 | 2% | 0.021 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -52.8 | -30.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | P340 F342 Y346 T347 A348 | P340-G344 WeakPolarHBondContact O-CA 3.49Å; P340-G344 PolarHBondContact O-N 3.44Å; F342-G344 VanDerWaalsContact C-N 3.29Å; F342-G344 PolarHBondContact O-N 3.09Å; G344-Y346 VanDerWaalsContact C-N 3.29Å; G344-Y346 PolarHBondContact O-N 2.85Å; G344-T347 WeakPolarHBondContact CA-OG1 3.17Å; G344-A348 WeakPolarHBondContact O-CB 3.45Å; G344-A348 PolarHBondContact O-N 3Å |
| 345 | K | 71.1 | Confident | 69.4 | Low | 143 Ų | 143 | 95.8 Ų | 95.8 | 62% | 0.622 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -68.2 | -26.8 | 176 | -64.5 | 179.5 | -179.9 | 175.8 | 0 | 113.8 | F342 I343 | F342-K345 PolarHBondContact O-N 2.96Å; I343-K345 PolarHBondContact O-N 3.43Å |
| 346 | Y | 69.4 | Low | 68.6 | Low | 195 Ų | 195 | 95.2 Ų | 95.2 | 77% | 0.765 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -98.1 | -27.9 | -179.1 | -59.7 | -78.8 | 0 | 0 | 0 | 112 | F342 I343 G344 | F342-Y346 WeakPolarHBondContact O-CD2 2.96Å; I343-Y346 WeakPolarHBondContact O-CA 3.17Å; I343-Y346 PolarHBondContact O-N 3.22Å; G344-Y346 VanDerWaalsContact C-N 3.29Å; G344-Y346 PolarHBondContact O-N 2.85Å |
| 347 | T | 68.6 | Low | 67.8 | Low | 62 Ų | 62 | 95.1 Ų | 95.1 | 38% | 0.38 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -91.8 | -22.7 | 178.7 | 58.5 | 0 | 0 | 0 | 0 | 113.2 | I343 G344 P352 | I343-T347 HydrophobicContact CG2-CG2 3.53Å; I343-T347 PolarHBondContact O-N 3.35Å; I343-T347 PolarHBondContact O-OG1 2.72Å; G344-T347 WeakPolarHBondContact CA-OG1 3.17Å; T347-P352 WeakPolarHBondContact O-CB 3.42Å |
| 348 | A | 61.4 | Low | 67.1 | Low | 37 Ų | 37 | 99.1 Ų | 99.1 | 31% | 0.306 | 52% | 0.518 | S | S | . | . | S | Bend | trans | -89.5 | 113.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | G344 | G344-A348 WeakPolarHBondContact O-CB 3.45Å; G344-A348 PolarHBondContact O-N 3Å |
| 349 | G | 59.6 | Low | 66 | Low | 47 Ų | 47 | 99.8 Ų | 99.8 | 49% | 0.485 | 52% | 0.522 | S | S | . | . | S | Bend | trans | 174.7 | 176.5 | -180 | 0 | 0 | 0 | 0 | 0 | 112.3 | R351 | G349-R351 PolarHBondContact O-N 2.72Å; G349-R351 VanDerWaalsContact O-N 3.16Å |
| 350 | P | 55.8 | Low | 64.7 | Low | 124 Ų | 124 | 100.2 Ų | 100.2 | 81% | 0.805 | 52% | 0.524 | S | S | * | . | S | Bend | trans | -64.5 | -15.4 | 177.5 | 26.4 | -33.1 | 0 | 0 | 0 | 113.4 | ||
| 351 | R | 53.6 | Low | 63.6 | Low | 169 Ų | 169 | 105.4 Ų | 105.4 | 64% | 0.638 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -137.6 | 82.8 | -180 | -67.2 | 169.8 | 169 | -161.4 | 2.2 | 109.4 | G349 L353 D354 | G349-R351 PolarHBondContact O-N 2.72Å; G349-R351 VanDerWaalsContact O-N 3.16Å; R351-L353 PolarHBondContact O-N 3.33Å; R351-D354 HydrophobicContact CB-CB 3.77Å; R351-D354 WeakPolarHBondContact CB-OD2 3.25Å; R351-D354 WeakPolarHBondContact CD-OD2 3.37Å; R351-D354 HydrophobicContact CG-CB 4.33Å; R351-D354 WeakPolarHBondContact CG-OD2 3.4Å; R351-D354 IonicContact CZ-OD2 2.96Å; R351-D354 IonicContact NE-OD2 2.72Å; R351-D354 PolarHBondContact NE-OD2 2.86Å; R351-D354 IonicContact NH1-OD2 3.43Å |
| 352 | P | 47.3 | Very low | 62.2 | Low | 82 Ų | 82 | 107.2 Ų | 107.2 | 53% | 0.532 | 56% | 0.557 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64 | 117.5 | 170.1 | 25.8 | -30.3 | 0 | 0 | 0 | 108 | T347 | T347-P352 WeakPolarHBondContact O-CB 3.42Š|
| 353 | L | 50.7 | Low | 60.6 | Low | 156 Ų | 156 | 105.9 Ų | 105.9 | 82% | 0.817 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 79.8 | 13.5 | 175.4 | -47 | 165.9 | 0 | 0 | 0 | 117.9 | R351 | R351-L353 PolarHBondContact O-N 3.33Š|
| 354 | D | 42.1 | Very low | 59 | Low | 174 Ų | 174 | 108.3 Ų | 108.3 | 93% | 0.93 | 57% | 0.573 | S | S | * | * | trans | -87.9 | 0 | 158.7 | -67.2 | -21.2 | 0 | 0 | 0 | 109.7 | R351 | R351-D354 HydrophobicContact CB-CB 3.77Å; R351-D354 WeakPolarHBondContact CB-OD2 3.25Å; R351-D354 WeakPolarHBondContact CD-OD2 3.37Å; R351-D354 HydrophobicContact CG-CB 4.33Å; R351-D354 WeakPolarHBondContact CG-OD2 3.4Å; R351-D354 IonicContact CZ-OD2 2.96Å; R351-D354 IonicContact NE-OD2 2.72Å; R351-D354 PolarHBondContact NE-OD2 2.86Å; R351-D354 IonicContact NH1-OD2 3.43Å |
Retrieved 354 of 354 residues in 472 ms
(Link to these results)