| 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 | 34.5 | Very low | 30.4 | Very low | 236 Ų | 236 | 174.3 Ų | 174.3 | 100% | 1.163 | 88% | 0.876 | S | S | * | * | 0 | 116.3 | 0 | -139.8 | -173.5 | -111.9 | 0 | 0 | 105.6 | |||||
| 2 | T | 34.3 | Very low | 30.1 | Very low | 131 Ų | 131 | 166.1 Ų | 166.1 | 80% | 0.804 | 87% | 0.869 | S | S | * | * | trans | 66 | 134.5 | 165.4 | 12.7 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 3 | E | 30.2 | Very low | 29.8 | Very low | 180 Ų | 180 | 167.1 Ų | 167.1 | 84% | 0.841 | 87% | 0.866 | S | S | * | * | trans | 80 | 118.4 | 177.7 | -53.9 | -154.2 | 140 | 0 | 0 | 115 | ||||
| 4 | L | 29.7 | Very low | 29.7 | Very low | 169 Ų | 169 | 164 Ų | 164 | 89% | 0.885 | 86% | 0.862 | S | S | * | * | cis | -139.6 | 106.1 | 35.2 | -77.5 | 127.6 | 0 | 0 | 0 | 110.9 | ||||
| 5 | R | 34.8 | Very low | 29.9 | Very low | 241 Ų | 241 | 159.4 Ų | 159.4 | 91% | 0.909 | 85% | 0.845 | S | S | * | * | trans | -119.7 | 78.5 | 167.9 | -153.9 | -170.2 | -157.2 | 177.4 | 4.7 | 106.5 | ||||
| 6 | H | 31.8 | Very low | 29.6 | Very low | 186 Ų | 186 | 159.4 Ų | 159.4 | 86% | 0.861 | 85% | 0.845 | S | S | * | * | trans | -170.6 | 107.1 | 164.4 | -105.1 | -60.3 | 0 | 0 | 0 | 109.8 | ||||
| 7 | R | 28.8 | Very low | 29.2 | Very low | 261 Ų | 261 | 160.7 Ų | 160.7 | 99% | 0.985 | 85% | 0.845 | S | S | * | * | trans | -164.9 | 92.2 | 145.8 | -110.1 | 171.3 | 168 | -173 | -5.1 | 108.6 | ||||
| 8 | G | 28.3 | Very low | 28.8 | Very low | 71 Ų | 71 | 162.1 Ų | 162.1 | 73% | 0.732 | 85% | 0.846 | S | S | * | * | trans | -119.5 | 152.4 | 159.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 9 | A | 27.4 | Very low | 28.6 | Very low | 98 Ų | 98 | 163.4 Ų | 163.4 | 81% | 0.81 | 85% | 0.848 | S | S | * | * | trans | 102.9 | 132.2 | 164.6 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 10 | K | 26.4 | Very low | 28.7 | Very low | 189 Ų | 189 | 160.2 Ų | 160.2 | 82% | 0.822 | 84% | 0.838 | S | S | * | * | trans | 85.4 | 124.3 | 167.1 | -62.8 | -170.2 | 178.6 | -173.6 | 0 | 114.4 | ||||
| 11 | D | 28.6 | Very low | 28.3 | Very low | 155 Ų | 155 | 157.6 Ų | 157.6 | 83% | 0.829 | 83% | 0.833 | S | S | * | * | cis | -157.6 | 159.4 | 35.1 | -77 | -57.4 | 0 | 0 | 0 | 112.7 | ||||
| 12 | G | 26.1 | Very low | 27.8 | Very low | 76 Ų | 76 | 155 Ų | 155 | 78% | 0.784 | 82% | 0.818 | S | S | * | * | trans | 110 | 89.4 | 139.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 13 | E | 26.3 | Very low | 27.3 | Very low | 179 Ų | 179 | 155.5 Ų | 155.5 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | trans | -75.1 | 156.2 | 150 | -106 | -178.4 | 146.4 | 0 | 0 | 110.5 | ||||
| 14 | P | 29.2 | Very low | 27 | Very low | 124 Ų | 124 | 155.8 Ų | 155.8 | 81% | 0.805 | 81% | 0.814 | S | S | * | * | -139.1 | 167.6 | 98.2 | 33 | -15.8 | 0 | 0 | 0 | 115.2 | |||||
| 15 | P | 32.4 | Very low | 26.6 | Very low | 95 Ų | 95 | 151.3 Ų | 151.3 | 62% | 0.617 | 81% | 0.808 | S | S | * | * | trans | -110 | 174.5 | -158.9 | 40.7 | -31 | 0 | 0 | 0 | 114.4 | ||||
| 16 | L | 24.7 | Very low | 26 | Very low | 160 Ų | 160 | 145 Ų | 145 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | 138.8 | 128.5 | 160.1 | -78.8 | 152.7 | 0 | 0 | 0 | 108.4 | ||||
| 17 | E | 23.8 | Very low | 25.6 | Very low | 181 Ų | 181 | 143.9 Ų | 143.9 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | cis | -154.7 | 146.7 | 25.2 | -102 | 163 | 138.5 | 0 | 0 | 110.3 | ||||
| 18 | Q | 21.8 | Very low | 25.4 | Very low | 186 Ų | 186 | 137.3 Ų | 137.3 | 87% | 0.869 | 80% | 0.796 | S | S | * | * | trans | -93.6 | 146.6 | 161.8 | -76 | 172.3 | -34.1 | 0 | 0 | 109.3 | ||||
| 19 | Q | 24.5 | Very low | 25.3 | Very low | 186 Ų | 186 | 143.1 Ų | 143.1 | 87% | 0.869 | 80% | 0.804 | S | S | * | * | 170.7 | 163.7 | 126.8 | -100 | -169.6 | 3 | 0 | 0 | 114.1 | |||||
| 20 | P | 29.5 | Very low | 25.2 | Very low | 100 Ų | 100 | 146.5 Ų | 146.5 | 65% | 0.649 | 81% | 0.808 | S | S | * | * | -135.1 | -176.4 | -106.8 | 38.2 | -15.8 | 0 | 0 | 0 | 116.9 | |||||
| 21 | S | 22.2 | Very low | 25.1 | Very low | 105 Ų | 105 | 147.7 Ų | 147.7 | 73% | 0.734 | 81% | 0.813 | S | S | * | * | trans | 64.9 | 148.7 | 145.3 | 64.8 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 22 | E | 23.8 | Very low | 24.9 | Very low | 181 Ų | 181 | 144.3 Ų | 144.3 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | cis | -156.2 | 138.4 | 26.4 | -67.8 | 178.6 | 136.5 | 0 | 0 | 107.7 | ||||
| 23 | D | 22.4 | Very low | 25 | Very low | 142 Ų | 142 | 149 Ų | 149 | 76% | 0.759 | 81% | 0.813 | S | S | * | * | 75.2 | 136.3 | 85.7 | -152.1 | 22.2 | 0 | 0 | 0 | 118.5 | |||||
| 24 | K | 23.9 | Very low | 24.9 | Very low | 187 Ų | 187 | 150 Ų | 150 | 81% | 0.813 | 82% | 0.815 | S | S | * | * | trans | 89 | 114.3 | 161.7 | -57.4 | -173.9 | -179.5 | 168 | 0 | 122.4 | ||||
| 25 | G | 21.3 | Very low | 24.8 | Very low | 74 Ų | 74 | 151.4 Ų | 151.4 | 76% | 0.763 | 82% | 0.816 | S | S | * | * | 132.2 | 104.6 | 107.7 | 0 | 0 | 0 | 0 | 0 | 120 | |||||
| 26 | S | 22.5 | Very low | 24.4 | Very low | 110 Ų | 110 | 150.6 Ų | 150.6 | 77% | 0.769 | 83% | 0.825 | S | S | * | * | trans | 71 | 109.7 | 144.9 | 80.5 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 27 | D | 22.9 | Very low | 24.6 | Very low | 162 Ų | 162 | 149.3 Ų | 149.3 | 87% | 0.866 | 82% | 0.823 | S | S | * | * | 43.8 | 114.5 | 120.3 | -57.7 | -22.4 | 0 | 0 | 0 | 121 | |||||
| 28 | S | 25.3 | Very low | 24.7 | Very low | 123 Ų | 123 | 145 Ų | 145 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | -160.2 | 136.2 | 120.5 | 50 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 29 | E | 26.9 | Very low | 25 | Very low | 192 Ų | 192 | 145.7 Ų | 145.7 | 90% | 0.897 | 82% | 0.817 | S | S | * | * | trans | -64.4 | 130.4 | -173.8 | -63.2 | 172.1 | 110.9 | 0 | 0 | 113.3 | ||||
| 30 | L | 24.6 | Very low | 25.2 | Very low | 170 Ų | 170 | 145 Ų | 145 | 89% | 0.89 | 81% | 0.814 | S | S | * | * | trans | -151.9 | 93.6 | 153.9 | -105.6 | 142.8 | 0 | 0 | 0 | 108.3 | A32 | L30-A32 VanDerWaalsContact C-N 3.34Å; L30-A32 PolarHBondContact O-N 2.86Å | ||
| 31 | K | 24.6 | Very low | 25.1 | Very low | 213 Ų | 213 | 145.3 Ų | 145.3 | 93% | 0.926 | 82% | 0.818 | S | S | * | * | trans | -67 | 93.7 | 168.8 | -81.7 | 179.3 | 175.7 | 170.5 | 0 | 108.7 | ||||
| 32 | A | 25.3 | Very low | 25.3 | Very low | 84 Ų | 84 | 150.6 Ų | 150.6 | 69% | 0.694 | 83% | 0.827 | S | S | * | * | trans | -82.5 | 127.8 | 160.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | L30 K34 | L30-A32 VanDerWaalsContact C-N 3.34Å; L30-A32 PolarHBondContact O-N 2.86Å; A32-K34 PolarHBondContact O-N 3.36Å | ||
| 33 | D | 26.2 | Very low | 25.7 | Very low | 174 Ų | 174 | 147.8 Ų | 147.8 | 93% | 0.93 | 82% | 0.823 | S | S | * | * | trans | -52.8 | 98.6 | 170 | -87.3 | -36 | 0 | 0 | 0 | 109.7 | ||||
| 34 | K | 25.3 | Very low | 26.1 | Very low | 201 Ų | 201 | 148.6 Ų | 148.6 | 87% | 0.874 | 83% | 0.827 | S | S | * | * | trans | -86.9 | 106 | 163.9 | -100.2 | -177.9 | 173.9 | 178.1 | 0 | 107.4 | A32 G36 | A32-K34 PolarHBondContact O-N 3.36Å; K34-G36 PolarHBondContact O-N 2.87Å | ||
| 35 | D | 26.3 | Very low | 27.1 | Very low | 153 Ų | 153 | 142.7 Ų | 142.7 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -48.2 | 111.9 | 157.1 | -83 | -43 | 0 | 0 | 0 | 108.1 | V37 | D35-V37 PolarHBondContact O-N 2.74Š| ||
| 36 | G | 25 | Very low | 28.3 | Very low | 79 Ų | 79 | 142.9 Ų | 142.9 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | trans | -67 | 91.9 | 179 | 0 | 0 | 0 | 0 | 0 | 110.6 | K34 S38 | K34-G36 PolarHBondContact O-N 2.87Å; G36-S38 PolarHBondContact O-N 3.4Å | ||
| 37 | V | 28.4 | Very low | 29.6 | Very low | 132 Ų | 132 | 139.3 Ų | 139.3 | 80% | 0.8 | 78% | 0.784 | S | S | * | * | trans | -72 | 104.3 | 151.9 | 178.6 | 0 | 0 | 0 | 0 | 105.5 | D35 E39 | D35-V37 PolarHBondContact O-N 2.74Å; V37-E39 PolarHBondContact O-N 3.06Å | ||
| 38 | S | 26.6 | Very low | 31 | Very low | 91 Ų | 91 | 135 Ų | 135 | 64% | 0.636 | 77% | 0.765 | S | S | * | * | trans | -57.4 | 124.1 | 165.6 | 46 | 0 | 0 | 0 | 0 | 108.6 | G36 E40 | G36-S38 PolarHBondContact O-N 3.4Å; S38-E40 VanDerWaalsContact C-N 3.34Å; S38-E40 PolarHBondContact O-N 3.27Å | ||
| 39 | E | 28.5 | Very low | 32.1 | Very low | 201 Ų | 201 | 136.8 Ų | 136.8 | 94% | 0.939 | 76% | 0.76 | S | S | * | * | trans | -59.4 | 93.8 | 169.7 | -73.5 | -176 | 143.9 | 0 | 0 | 109.5 | V37 | V37-E39 PolarHBondContact O-N 3.06Š| ||
| 40 | E | 28.3 | Very low | 33.3 | Very low | 172 Ų | 172 | 129.3 Ų | 129.3 | 80% | 0.804 | 73% | 0.727 | S | S | * | * | trans | -90.5 | 126.2 | 160.4 | -80.1 | -175.3 | 164.9 | 0 | 0 | 108.5 | S38 K42 | S38-E40 VanDerWaalsContact C-N 3.34Å; S38-E40 PolarHBondContact O-N 3.27Å; E40-K42 PolarHBondContact O-N 3.38Å | ||
| 41 | S | 26 | Very low | 34.1 | Very low | 105 Ų | 105 | 126.9 Ų | 126.9 | 73% | 0.734 | 72% | 0.722 | S | S | * | * | trans | -35.7 | 125.4 | 171.8 | 50.9 | 0 | 0 | 0 | 0 | 112.5 | V43 | S41-V43 PolarHBondContact O-N 3.1Š| ||
| 42 | K | 28.1 | Very low | 35.1 | Very low | 216 Ų | 216 | 123 Ų | 123 | 94% | 0.939 | 72% | 0.716 | S | S | * | * | trans | -51.6 | 97.7 | 173 | -75.8 | 179.5 | 176 | 177.7 | 0 | 110.7 | E40 | E40-K42 PolarHBondContact O-N 3.38Š| ||
| 43 | V | 30.6 | Very low | 36 | Very low | 123 Ų | 123 | 122.4 Ų | 122.4 | 75% | 0.745 | 71% | 0.705 | S | S | * | * | trans | -87.1 | 120.6 | 154.9 | 178.8 | 0 | 0 | 0 | 0 | 105.7 | S41 S45 | S41-V43 PolarHBondContact O-N 3.1Å; V43-S45 VanDerWaalsContact C-N 3.25Å; V43-S45 PolarHBondContact O-N 2.93Å | ||
| 44 | D | 31.7 | Very low | 36.7 | Very low | 159 Ų | 159 | 118.8 Ų | 118.8 | 85% | 0.85 | 69% | 0.691 | S | S | * | * | trans | -65.8 | 81.2 | 178.9 | -169.7 | 23.1 | 0 | 0 | 0 | 110.2 | G46 | D44-G46 PolarHBondContact O-N 3.14Š| ||
| 45 | S | 44.5 | Very low | 37.8 | Very low | 62 Ų | 62 | 115.4 Ų | 115.4 | 43% | 0.434 | 68% | 0.682 | S | S | . | * | trans | -82.4 | 107.4 | 166.4 | 63.6 | 0 | 0 | 0 | 0 | 107 | V43 V47 | V43-S45 VanDerWaalsContact C-N 3.25Å; V43-S45 PolarHBondContact O-N 2.93Å; S45-V47 PolarHBondContact O-N 2.99Å | ||
| 46 | G | 47 | Very low | 39.1 | Very low | 78 Ų | 78 | 112.5 Ų | 112.5 | 80% | 0.804 | 67% | 0.667 | S | S | * | * | trans | -64.3 | 40.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 116 | D44 | D44-G46 PolarHBondContact O-N 3.14Š| ||
| 47 | V | 50.4 | Low | 40.7 | Very low | 35 Ų | 35 | 110 Ų | 110 | 21% | 0.212 | 64% | 0.635 | C | S | . | * | P | Polyproline II helix | trans | -101.6 | 116 | 174.2 | -176.7 | 0 | 0 | 0 | 0 | 107.9 | S45 V122 F370 | S45-V47 PolarHBondContact O-N 2.99Å; V47-V122 HydrophobicContact CG1-CG1 4.01Å; V47-F370 HydrophobicContact CG1-CD1 4.35Å |
| 48 | P | 51.9 | Low | 42.5 | Very low | 72 Ų | 72 | 106.8 Ų | 106.8 | 47% | 0.468 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -58.7 | 146.8 | 175.1 | -22 | 32.6 | 0 | 0 | 0 | 112.2 | V50 | P48-V50 PolarHBondContact O-N 3.17Š|
| 49 | E | 47.6 | Very low | 44.2 | Very low | 161 Ų | 161 | 110.6 Ų | 110.6 | 75% | 0.752 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 127.9 | 175.6 | -78.2 | 177.7 | 171 | 0 | 0 | 111.2 | K371 | E49-K371 HydrophobicContact CG-CD 4.09Å; E49-K371 IonicContact OE1-NZ 2.93Å |
| 50 | V | 52.1 | Low | 45.8 | Very low | 34 Ų | 34 | 106.9 Ų | 106.9 | 21% | 0.206 | 62% | 0.616 | C | S | . | * | P | Polyproline II helix | trans | -88.5 | 130.2 | 179.7 | -177.6 | 0 | 0 | 0 | 0 | 109.5 | P48 V122 I372 | P48-V50 PolarHBondContact O-N 3.17Å; V50-V122 HydrophobicContact CG2-CG2 3.86Å; V50-I372 HydrophobicContact CB-CG2 3.89Å; V50-I372 HydrophobicContact CG1-CG2 4.01Å; V50-I372 HydrophobicContact CG2-CG2 4.06Å |
| 51 | P | 42.5 | Very low | 47.3 | Very low | 119 Ų | 119 | 100.7 Ų | 100.7 | 77% | 0.773 | 59% | 0.588 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 134.6 | 176.3 | -20.2 | 31 | 0 | 0 | 0 | 112.3 | ||
| 52 | V | 45.2 | Very low | 49.1 | Very low | 133 Ų | 133 | 98 Ų | 98 | 81% | 0.806 | 57% | 0.566 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 125.7 | 176.7 | -178 | 0 | 0 | 0 | 0 | 109.7 | ||
| 53 | P | 43.5 | Very low | 51 | Low | 70 Ų | 70 | 95.9 Ų | 95.9 | 46% | 0.455 | 56% | 0.557 | S | S | . | * | P | Polyproline II helix | trans | -75.8 | 152.6 | 177 | 25.2 | -27.3 | 0 | 0 | 0 | 112.9 | N377 | P53-N377 VanDerWaalsContact CB-ND2 3.3Å; P53-N377 WeakPolarHBondContact CB-ND2 3.47Å; P53-N377 VanDerWaalsContact CG-ND2 3.27Å; P53-N377 WeakPolarHBondContact CG-ND2 3.38Å |
| 54 | P | 41.9 | Very low | 52.7 | Low | 99 Ų | 99 | 93.9 Ų | 93.9 | 64% | 0.643 | 55% | 0.553 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 158.2 | -174.8 | 26.7 | -33.5 | 0 | 0 | 0 | 114 | D56 N377 | P54-D56 PolarHBondContact O-N 2.69Å; P54-N377 PolarHBondContact O-ND2 2.81Å |
| 55 | D | 48.1 | Very low | 54.2 | Low | 129 Ų | 129 | 87 Ų | 87 | 69% | 0.69 | 52% | 0.516 | S | S | * | . | trans | -78.1 | 100.3 | -177.7 | -170.7 | -10 | 0 | 0 | 0 | 111.4 | T57 | D55-T57 VanDerWaalsContact C-N 3.27Å; D55-T57 PolarHBondContact O-N 3.19Å; D55-T57 PolarHBondContact OD1-N 2.9Å; D55-T57 PolarHBondContact OD1-OG1 2.94Å | ||
| 56 | D | 52.5 | Low | 55.2 | Low | 92 Ų | 92 | 88.7 Ų | 88.7 | 49% | 0.492 | 53% | 0.527 | S | S | . | . | trans | -84.8 | 32 | -175.7 | -70.1 | -37.3 | 0 | 0 | 0 | 114 | P54 P380 | P54-D56 PolarHBondContact O-N 2.69Å; D56-P380 VanDerWaalsContact O-CB 3.29Å; D56-P380 WeakPolarHBondContact O-CB 3.33Å | ||
| 57 | T | 59.2 | Low | 56.2 | Low | 26 Ų | 26 | 88.8 Ų | 88.8 | 16% | 0.16 | 53% | 0.528 | C | S | . | . | trans | -65.9 | 131.9 | 177 | 19.8 | 0 | 0 | 0 | 0 | 111.7 | D55 E59 N62 | D55-T57 VanDerWaalsContact C-N 3.27Å; D55-T57 PolarHBondContact O-N 3.19Å; D55-T57 PolarHBondContact OD1-N 2.9Å; D55-T57 PolarHBondContact OD1-OG1 2.94Å; T57-E59 PolarHBondContact O-N 2.87Å; T57-N62 PolarHBondContact O-ND2 3.17Å; T57-N62 PolarHBondContact OG1-ND2 3.38Å | ||
| 58 | P | 65.5 | Low | 57 | Low | 66 Ų | 66 | 90.5 Ų | 90.5 | 43% | 0.429 | 54% | 0.536 | S | S | . | . | trans | -58.2 | 125.4 | -174.4 | 2.6 | -7.5 | 0 | 0 | 0 | 111.9 | V60 L61 N62 | P58-V60 PolarHBondContact O-N 3.11Å; P58-V60 VanDerWaalsContact O-N 3.11Å; P58-L61 WeakPolarHBondContact O-CB 3.29Å; P58-L61 PolarHBondContact O-N 3Å; P58-N62 PolarHBondContact O-N 3.48Å | ||
| 59 | E | 62.4 | Low | 58.1 | Low | 170 Ų | 170 | 90.3 Ų | 90.3 | 79% | 0.794 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -56.3 | -32.8 | -174 | -67.4 | -176.4 | 163.2 | 0 | 0 | 113.2 | T57 L61 N62 K63 | T57-E59 PolarHBondContact O-N 2.87Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 3.04Å; E59-N62 PolarHBondContact O-N 3.35Å; E59-K63 WeakPolarHBondContact O-CB 3.47Å; E59-K63 PolarHBondContact O-N 3.44Å |
| 60 | V | 63 | Low | 59.1 | Low | 124 Ų | 124 | 87 Ų | 87 | 75% | 0.752 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -60.1 | -41 | 176.6 | -176.2 | 0 | 0 | 0 | 0 | 111.4 | P58 A64 | P58-V60 PolarHBondContact O-N 3.11Å; P58-V60 VanDerWaalsContact O-N 3.11Å; V60-A64 WeakPolarHBondContact O-CB 3.31Å; V60-A64 PolarHBondContact O-N 3.49Å; V60-A64 VanDerWaalsContact O-N 3.1Å |
| 61 | L | 60.4 | Low | 59.8 | Low | 41 Ų | 41 | 94.4 Ų | 94.4 | 22% | 0.215 | 56% | 0.555 | C | S | . | * | H | α-helix | trans | -74.4 | -36.9 | 179.7 | -165.8 | 65.9 | 0 | 0 | 0 | 111.1 | P58 E59 K63 A64 L65 V77 I80 | P58-L61 WeakPolarHBondContact O-CB 3.29Å; P58-L61 PolarHBondContact O-N 3Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 3.04Å; L61-K63 VanDerWaalsContact C-N 3.35Å; L61-A64 PolarHBondContact O-N 3.28Å; L61-L65 HydrophobicContact CD1-CD1 3.98Å; L61-L65 HydrophobicContact CG-CD1 3.92Å; L61-L65 WeakPolarHBondContact O-CB 3.37Å; L61-L65 PolarHBondContact O-N 3.23Å; L61-L65 VanDerWaalsContact O-N 3.14Å; L61-V77 HydrophobicContact CD2-CB 4.18Å; L61-V77 HydrophobicContact CD2-CG1 3.88Å; L61-V77 HydrophobicContact CD2-CG2 3.77Å; L61-V77 HydrophobicContact CG-CG2 4.16Å; L61-I80 HydrophobicContact CD1-CD1 3.99Å |
| 62 | N | 63.1 | Low | 61.4 | Low | 49 Ų | 49 | 95.7 Ų | 95.7 | 26% | 0.262 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.5 | -37.8 | 174.7 | -87.4 | -39.7 | 0 | 0 | 0 | 112.5 | T57 P58 E59 S66 K73 | T57-N62 PolarHBondContact O-ND2 3.17Å; T57-N62 PolarHBondContact OG1-ND2 3.38Å; P58-N62 PolarHBondContact O-N 3.48Å; E59-N62 PolarHBondContact O-N 3.35Å; N62-S66 PolarHBondContact O-N 2.95Å; N62-K73 WeakPolarHBondContact OD1-CE 3.19Å; N62-K73 PolarHBondContact OD1-NZ 3.12Å |
| 63 | K | 67.5 | Low | 62.8 | Low | 172 Ų | 172 | 92 Ų | 92 | 75% | 0.748 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -71.3 | -42.3 | 176.9 | -165.5 | 173.1 | -176.9 | 176.8 | 0 | 112.1 | E59 L61 L65 S66 | E59-K63 WeakPolarHBondContact O-CB 3.47Å; E59-K63 PolarHBondContact O-N 3.44Å; L61-K63 VanDerWaalsContact C-N 3.35Å; K63-L65 VanDerWaalsContact C-N 3.32Å; K63-L65 PolarHBondContact O-N 3.46Å; K63-S66 WeakPolarHBondContact O-CB 3.44Å; K63-S66 PolarHBondContact O-N 3.04Å; K63-S66 PolarHBondContact O-OG 3.2Å |
| 64 | A | 66.2 | Low | 64.2 | Low | 80 Ų | 80 | 93.2 Ų | 93.2 | 66% | 0.661 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.2 | -29.9 | 179 | 0 | 0 | 0 | 0 | 0 | 113.6 | V60 L61 | V60-A64 WeakPolarHBondContact O-CB 3.31Å; V60-A64 PolarHBondContact O-N 3.49Å; V60-A64 VanDerWaalsContact O-N 3.1Å; L61-A64 PolarHBondContact O-N 3.28Å |
| 65 | L | 64.3 | Low | 65.9 | Low | 16 Ų | 16 | 92.2 Ų | 92.2 | 8% | 0.084 | 50% | 0.504 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.2 | 15 | -177.3 | -65.1 | 165.4 | 0 | 0 | 0 | 113.6 | L61 K63 G67 L68 K73 W76 V77 | L61-L65 HydrophobicContact CD1-CD1 3.98Å; L61-L65 HydrophobicContact CG-CD1 3.92Å; L61-L65 WeakPolarHBondContact O-CB 3.37Å; L61-L65 PolarHBondContact O-N 3.23Å; L61-L65 VanDerWaalsContact O-N 3.14Å; K63-L65 VanDerWaalsContact C-N 3.32Å; K63-L65 PolarHBondContact O-N 3.46Å; L65-G67 PolarHBondContact O-N 2.99Å; L65-L68 HydrophobicContact CD2-CD1 3.66Å; L65-L68 PolarHBondContact O-N 2.99Å; L65-K73 HydrophobicContact CB-CD 4.35Å; L65-K73 HydrophobicContact CB-CG 3.96Å; L65-K73 HydrophobicContact CD1-CG 4.39Å; L65-W76 HydrophobicContact CD1-CB 4.21Å; L65-W76 HydrophobicContact CD2-CB 3.85Å; L65-W76 HydrophobicContact CD2-CG 4.22Å; L65-V77 HydrophobicContact CD1-CG2 3.58Å |
| 66 | S | 64.9 | Low | 67.4 | Low | 96 Ų | 96 | 92.4 Ų | 92.4 | 67% | 0.671 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -19.2 | -174.9 | 54.9 | 0 | 0 | 0 | 0 | 114.7 | N62 K63 | N62-S66 PolarHBondContact O-N 2.95Å; K63-S66 WeakPolarHBondContact O-CB 3.44Å; K63-S66 PolarHBondContact O-N 3.04Å; K63-S66 PolarHBondContact O-OG 3.2Å |
| 67 | G | 68.3 | Low | 68.4 | Low | 80 Ų | 80 | 88.8 Ų | 88.8 | 83% | 0.825 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.8 | -2.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 116 | L65 | L65-G67 PolarHBondContact O-N 2.99Š|
| 68 | L | 67 | Low | 69.2 | Low | 72 Ų | 72 | 93.5 Ų | 93.5 | 38% | 0.377 | 49% | 0.491 | S | S | . | . | S | Bend | trans | -99.1 | 147.5 | -178.1 | -80.1 | 127.5 | 0 | 0 | 0 | 111.8 | L65 W72 | L65-L68 HydrophobicContact CD2-CD1 3.66Å; L65-L68 PolarHBondContact O-N 2.99Å; L68-W72 HydrophobicContact CB-CB 4.26Å; L68-W72 HydrophobicContact CD2-CB 3.55Å; L68-W72 HydrophobicContact CD2-CG 4.29Å |
| 69 | S | 74.9 | Confident | 69.9 | Low | 68 Ų | 68 | 92.2 Ų | 92.2 | 48% | 0.476 | 49% | 0.49 | S | S | . | . | trans | -60.8 | 151.5 | 173.1 | 78.7 | 0 | 0 | 0 | 0 | 111.1 | R71 W72 K73 | S69-R71 PolarHBondContact O-N 3.46Å; S69-W72 PolarHBondContact O-N 3.33Å; S69-K73 PolarHBondContact O-N 3.5Å | ||
| 70 | S | 68.1 | Low | 70.8 | Confident | 91 Ų | 91 | 87.9 Ų | 87.9 | 64% | 0.636 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -51.6 | -33.6 | -174.1 | 58.9 | 0 | 0 | 0 | 0 | 113.7 | N74 | S70-N74 PolarHBondContact O-N 3.3Å; S70-N74 PolarHBondContact O-ND2 3.19Å |
| 71 | R | 67.6 | Low | 71.6 | Confident | 190 Ų | 190 | 84.5 Ų | 84.5 | 72% | 0.717 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64.7 | -49.3 | 174.5 | -75.9 | -172.6 | 150 | -159.2 | -7.1 | 112.9 | S69 N74 W75 | S69-R71 PolarHBondContact O-N 3.46Å; R71-N74 PolarHBondContact O-N 3.46Å; R71-W75 PolarHBondContact O-N 3.07Å; R71-W75 VanDerWaalsContact O-N 3.15Å |
| 72 | W | 75.9 | Confident | 72.5 | Confident | 146 Ų | 146 | 84.7 Ų | 84.7 | 55% | 0.553 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -74.1 | -32.8 | -179.1 | -73.5 | 103.8 | 0 | 0 | 0 | 112.5 | L68 S69 W75 W76 | L68-W72 HydrophobicContact CB-CB 4.26Å; L68-W72 HydrophobicContact CD2-CB 3.55Å; L68-W72 HydrophobicContact CD2-CG 4.29Å; S69-W72 PolarHBondContact O-N 3.33Å; W72-W75 WeakPolarHBondContact O-CB 3.47Å; W72-W75 PolarHBondContact O-N 3.16Å; W72-W76 VanDerWaalsContact O-CD1 3.31Å; W72-W76 PolarHBondContact O-N 3.39Å |
| 73 | K | 74.5 | Confident | 73.5 | Confident | 56 Ų | 56 | 88.2 Ų | 88.2 | 24% | 0.243 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -58.1 | -50 | 171.7 | -177.3 | 172.5 | 178.5 | -173.9 | 0 | 110.9 | N62 L65 S69 W75 W76 V77 | N62-K73 WeakPolarHBondContact OD1-CE 3.19Å; N62-K73 PolarHBondContact OD1-NZ 3.12Å; L65-K73 HydrophobicContact CB-CD 4.35Å; L65-K73 HydrophobicContact CB-CG 3.96Å; L65-K73 HydrophobicContact CD1-CG 4.39Å; S69-K73 PolarHBondContact O-N 3.5Å; K73-W75 VanDerWaalsContact C-N 3.32Å; K73-W75 PolarHBondContact O-N 3.42Å; K73-W76 PolarHBondContact O-N 3.33Å; K73-V77 HydrophobicContact CG-CG2 4.46Å; K73-V77 VanDerWaalsContact O-CG2 3.26Å; K73-V77 WeakPolarHBondContact O-CG2 3.14Å; K73-V77 PolarHBondContact O-N 3.48Å |
| 74 | N | 72.2 | Confident | 74.3 | Confident | 95 Ų | 95 | 82.6 Ų | 82.6 | 51% | 0.508 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.3 | -37.4 | 177.1 | -79.1 | -19.1 | 0 | 0 | 0 | 113.1 | S70 R71 R78 | S70-N74 PolarHBondContact O-N 3.3Å; S70-N74 PolarHBondContact O-ND2 3.19Å; R71-N74 PolarHBondContact O-N 3.46Å; N74-R78 WeakPolarHBondContact O-CB 3.46Å; N74-R78 WeakPolarHBondContact O-CD 3.1Å; N74-R78 WeakPolarHBondContact O-CG 3.35Å; N74-R78 PolarHBondContact O-N 3.08Å; N74-R78 VanDerWaalsContact O-N 3.11Å |
| 75 | W | 77.5 | Confident | 75.1 | Confident | 78 Ų | 78 | 82.6 Ų | 82.6 | 30% | 0.295 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60.6 | -50.2 | 175.1 | -176.7 | -87.3 | 0 | 0 | 0 | 111.8 | R71 W72 K73 R78 G79 Y246 F250 | R71-W75 PolarHBondContact O-N 3.07Å; R71-W75 VanDerWaalsContact O-N 3.15Å; W72-W75 WeakPolarHBondContact O-CB 3.47Å; W72-W75 PolarHBondContact O-N 3.16Å; K73-W75 VanDerWaalsContact C-N 3.32Å; K73-W75 PolarHBondContact O-N 3.42Å; W75-R78 PolarHBondContact O-N 3.19Å; W75-G79 PolarHBondContact O-N 3.44Å; W75-Y246 AromaticContact CE3-CE1 3.82Å; W75-Y246 HydrophobicContact CE3-CE1 3.82Å; W75-Y246 HydrophobicContact CH2-CE1 4.11Å; W75-Y246 HydrophobicContact CZ3-CD1 4.29Å; W75-Y246 AromaticContact CZ3-CE1 3.33Å; W75-Y246 HydrophobicContact CZ3-CE1 3.33Å; W75-Y246 AromaticContact CZ3-CZ 3.9Å; W75-F250 HydrophobicContact CZ3-CD1 4.25Å; W75-F250 HydrophobicContact CZ3-CG 4.26Å |
| 76 | W | 79.7 | Confident | 76.2 | Confident | 132 Ų | 132 | 85 Ų | 85 | 50% | 0.5 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -66.7 | -43.2 | -179.4 | -84.8 | 107.4 | 0 | 0 | 0 | 113.2 | L65 W72 K73 R78 G79 I80 | L65-W76 HydrophobicContact CD1-CB 4.21Å; L65-W76 HydrophobicContact CD2-CB 3.85Å; L65-W76 HydrophobicContact CD2-CG 4.22Å; W72-W76 VanDerWaalsContact O-CD1 3.31Å; W72-W76 PolarHBondContact O-N 3.39Å; K73-W76 PolarHBondContact O-N 3.33Å; W76-R78 VanDerWaalsContact C-N 3.32Å; W76-R78 PolarHBondContact O-N 3.39Å; W76-G79 PolarHBondContact O-N 2.82Å; W76-I80 HydrophobicContact CE3-CD1 4.41Å; W76-I80 HydrophobicContact CE3-CG1 4.47Å; W76-I80 WeakPolarHBondContact O-CG1 3.42Å; W76-I80 PolarHBondContact O-N 2.89Å |
| 77 | V | 75.1 | Confident | 77.3 | Confident | 17 Ų | 17 | 84.1 Ų | 84.1 | 10% | 0.103 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -58.2 | -46.5 | 176.1 | 172.2 | 0 | 0 | 0 | 0 | 110.6 | L61 L65 K73 L81 | L61-V77 HydrophobicContact CD2-CB 4.18Å; L61-V77 HydrophobicContact CD2-CG1 3.88Å; L61-V77 HydrophobicContact CD2-CG2 3.77Å; L61-V77 HydrophobicContact CG-CG2 4.16Å; L65-V77 HydrophobicContact CD1-CG2 3.58Å; K73-V77 HydrophobicContact CG-CG2 4.46Å; K73-V77 VanDerWaalsContact O-CG2 3.26Å; K73-V77 WeakPolarHBondContact O-CG2 3.14Å; K73-V77 PolarHBondContact O-N 3.48Å; V77-L81 PolarHBondContact O-N 3.14Å; V77-L81 VanDerWaalsContact O-N 3.14Å |
| 78 | R | 74.4 | Confident | 78.2 | Confident | 125 Ų | 125 | 85.9 Ų | 85.9 | 47% | 0.472 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -64.5 | -43.3 | 177.5 | -72.1 | 171.6 | -179.3 | -119.1 | -6.1 | 111.8 | N74 W75 W76 T82 | N74-R78 WeakPolarHBondContact O-CB 3.46Å; N74-R78 WeakPolarHBondContact O-CD 3.1Å; N74-R78 WeakPolarHBondContact O-CG 3.35Å; N74-R78 PolarHBondContact O-N 3.08Å; N74-R78 VanDerWaalsContact O-N 3.11Å; W75-R78 PolarHBondContact O-N 3.19Å; W76-R78 VanDerWaalsContact C-N 3.32Å; W76-R78 PolarHBondContact O-N 3.39Å; R78-T82 VanDerWaalsContact O-CB 3.24Å; R78-T82 WeakPolarHBondContact O-CB 3.25Å; R78-T82 PolarHBondContact O-N 3.43Å; R78-T82 PolarHBondContact O-OG1 2.85Å |
| 79 | G | 80.6 | Confident | 79.2 | Confident | 38 Ų | 38 | 84.3 Ų | 84.3 | 39% | 0.392 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.2 | -48.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | W75 W76 T82 L83 | W75-G79 PolarHBondContact O-N 3.44Å; W76-G79 PolarHBondContact O-N 2.82Å; G79-T82 PolarHBondContact O-N 2.92Å; G79-L83 PolarHBondContact O-N 3.46Å |
| 80 | I | 82.6 | Confident | 79.9 | Confident | 79 Ų | 79 | 87.6 Ų | 87.6 | 41% | 0.405 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.8 | -46.8 | -179.8 | -67.3 | 165.6 | 0 | 0 | 0 | 110.8 | L61 W76 T82 L83 A84 | L61-I80 HydrophobicContact CD1-CD1 3.99Å; W76-I80 HydrophobicContact CE3-CD1 4.41Å; W76-I80 HydrophobicContact CE3-CG1 4.47Å; W76-I80 WeakPolarHBondContact O-CG1 3.42Å; W76-I80 PolarHBondContact O-N 2.89Å; I80-T82 VanDerWaalsContact C-N 3.33Å; I80-T82 PolarHBondContact O-N 3.35Å; I80-L83 PolarHBondContact O-N 2.89Å; I80-A84 PolarHBondContact O-N 3.49Å |
| 81 | L | 78.4 | Confident | 81.1 | Confident | 53 Ų | 53 | 87.7 Ų | 87.7 | 28% | 0.277 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -67.7 | -36.1 | -180 | -160.4 | 75.8 | 0 | 0 | 0 | 112 | V77 L83 A84 M85 I379 H382 | V77-L81 PolarHBondContact O-N 3.14Å; V77-L81 VanDerWaalsContact O-N 3.14Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 3.48Å; L81-A84 PolarHBondContact O-N 2.83Å; L81-M85 HydrophobicContact CD2-SD 4.47Å; L81-M85 HydrophobicContact CG-SD 4.48Å; L81-M85 WeakPolarHBondContact O-CB 3.49Å; L81-M85 WeakPolarHBondContact O-CG 3.4Å; L81-M85 PolarHBondContact O-N 3.43Å; L81-I379 HydrophobicContact CD2-CG2 4Å; L81-H382 HydrophobicContact CD2-CB 4.16Å; L81-H382 WeakPolarHBondContact CD2-CE1 3.36Å; L81-H382 VanDerWaalsContact CD2-CG 3.4Å; L81-H382 WeakPolarHBondContact CD2-ND1 3.41Å |
| 82 | T | 78.9 | Confident | 82.1 | Confident | 45 Ų | 45 | 79.1 Ų | 79.1 | 28% | 0.276 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 174.9 | -58.3 | 0 | 0 | 0 | 0 | 110.8 | R78 G79 I80 A84 M85 I86 I243 | R78-T82 VanDerWaalsContact O-CB 3.24Å; R78-T82 WeakPolarHBondContact O-CB 3.25Å; R78-T82 PolarHBondContact O-N 3.43Å; R78-T82 PolarHBondContact O-OG1 2.85Å; G79-T82 PolarHBondContact O-N 2.92Å; I80-T82 VanDerWaalsContact C-N 3.33Å; I80-T82 PolarHBondContact O-N 3.35Å; T82-A84 PolarHBondContact O-N 3.17Å; T82-M85 PolarHBondContact O-N 2.8Å; T82-I86 HydrophobicContact CG2-CD1 3.8Å; T82-I86 HydrophobicContact CG2-CG1 4.41Å; T82-I86 WeakPolarHBondContact O-CB 3.39Å; T82-I86 VanDerWaalsContact O-CG1 3.25Å; T82-I86 WeakPolarHBondContact O-CG1 3.47Å; T82-I86 PolarHBondContact O-N 2.81Å; T82-I243 HydrophobicContact CG2-CD1 4.22Å |
| 83 | L | 85.1 | Confident | 82.9 | Confident | 124 Ų | 124 | 72.7 Ų | 72.7 | 65% | 0.649 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -63.1 | -42 | 176.2 | -173.3 | 68.4 | 0 | 0 | 0 | 111.9 | G79 I80 L81 I86 S87 | G79-L83 PolarHBondContact O-N 3.46Å; I80-L83 PolarHBondContact O-N 2.89Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 3.48Å; L83-I86 PolarHBondContact O-N 3.41Å; L83-S87 WeakPolarHBondContact O-CB 3.39Å; L83-S87 PolarHBondContact O-N 3.06Å |
| 84 | A | 84.8 | Confident | 83.6 | Confident | 53 Ų | 53 | 79 Ų | 79 | 44% | 0.438 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62 | -44.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | I80 L81 T82 S87 F88 | I80-A84 PolarHBondContact O-N 3.49Å; L81-A84 PolarHBondContact O-N 2.83Å; T82-A84 PolarHBondContact O-N 3.17Å; A84-S87 PolarHBondContact O-N 3.43Å; A84-F88 WeakPolarHBondContact O-CB 3.4Å; A84-F88 PolarHBondContact O-N 3.34Å |
| 85 | M | 83.3 | Confident | 84.5 | Confident | 81 Ų | 81 | 79.1 Ų | 79.1 | 40% | 0.399 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 176.2 | -76.2 | 175 | 41.2 | 0 | 0 | 112.5 | L81 T82 F88 F89 | L81-M85 HydrophobicContact CD2-SD 4.47Å; L81-M85 HydrophobicContact CG-SD 4.48Å; L81-M85 WeakPolarHBondContact O-CB 3.49Å; L81-M85 WeakPolarHBondContact O-CG 3.4Å; L81-M85 PolarHBondContact O-N 3.43Å; T82-M85 PolarHBondContact O-N 2.8Å; M85-F88 PolarHBondContact O-N 2.82Å; M85-F89 WeakPolarHBondContact O-CB 3.28Å; M85-F89 PolarHBondContact O-N 3.48Å |
| 86 | I | 85.7 | Confident | 85 | Confident | 65 Ų | 65 | 75.7 Ų | 75.7 | 33% | 0.333 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.1 | -45.4 | 176.5 | -71.4 | 169.5 | 0 | 0 | 0 | 110.3 | T82 L83 F88 F89 F90 | T82-I86 HydrophobicContact CG2-CD1 3.8Å; T82-I86 HydrophobicContact CG2-CG1 4.41Å; T82-I86 WeakPolarHBondContact O-CB 3.39Å; T82-I86 VanDerWaalsContact O-CG1 3.25Å; T82-I86 WeakPolarHBondContact O-CG1 3.47Å; T82-I86 PolarHBondContact O-N 2.81Å; L83-I86 PolarHBondContact O-N 3.41Å; I86-F88 VanDerWaalsContact C-N 3.29Å; I86-F88 PolarHBondContact O-N 3.01Å; I86-F89 WeakPolarHBondContact O-CB 3.36Å; I86-F89 PolarHBondContact O-N 2.83Å; I86-F89 VanDerWaalsContact O-N 3.16Å; I86-F90 HydrophobicContact CG2-CD2 3.69Å; I86-F90 HydrophobicContact CG2-CE2 3.43Å; I86-F90 VanDerWaalsContact CG2-CE2 3.43Å; I86-F90 VanDerWaalsContact O-CD2 3.22Å; I86-F90 WeakPolarHBondContact O-CD2 3.39Å; I86-F90 PolarHBondContact O-N 3.31Å |
| 87 | S | 88.5 | Confident | 85.5 | Confident | 79 Ų | 79 | 70 Ų | 70 | 55% | 0.552 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -59.8 | -41.4 | 176.1 | -173.7 | 0 | 0 | 0 | 0 | 111.7 | L83 A84 L91 | L83-S87 WeakPolarHBondContact O-CB 3.39Å; L83-S87 PolarHBondContact O-N 3.06Å; A84-S87 PolarHBondContact O-N 3.43Å; S87-L91 PolarHBondContact O-N 3.16Å; S87-L91 VanDerWaalsContact O-N 3.08Å |
| 88 | F | 87.7 | Confident | 86.1 | Confident | 116 Ų | 116 | 71.8 Ų | 71.8 | 51% | 0.509 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -66 | -38.7 | 175.9 | -177.6 | -113.7 | 0 | 0 | 0 | 112.1 | A84 M85 I86 L91 I92 | A84-F88 WeakPolarHBondContact O-CB 3.4Å; A84-F88 PolarHBondContact O-N 3.34Å; M85-F88 PolarHBondContact O-N 2.82Å; I86-F88 VanDerWaalsContact C-N 3.29Å; I86-F88 PolarHBondContact O-N 3.01Å; F88-L91 WeakPolarHBondContact O-CB 3.45Å; F88-L91 PolarHBondContact O-N 2.86Å; F88-I92 HydrophobicContact CD1-CD1 3.62Å; F88-I92 HydrophobicContact CD1-CG1 4.48Å; F88-I92 HydrophobicContact CE1-CD1 3.25Å; F88-I92 HydrophobicContact CE1-CG1 4.17Å; F88-I92 HydrophobicContact CE2-CD1 4.27Å; F88-I92 HydrophobicContact CE2-CG1 4.35Å; F88-I92 HydrophobicContact CG-CD1 4.29Å; F88-I92 HydrophobicContact CZ-CD1 3.61Å; F88-I92 HydrophobicContact CZ-CG1 4.09Å; F88-I92 WeakPolarHBondContact O-CG1 3.09Å; F88-I92 PolarHBondContact O-N 2.82Å |
| 89 | F | 87.8 | Confident | 86.9 | Confident | 40 Ų | 40 | 68.2 Ų | 68.2 | 18% | 0.175 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.7 | -45 | 176.3 | -176.3 | -119.4 | 0 | 0 | 0 | 112.2 | M85 I86 L91 I92 I93 F231 I232 I235 | M85-F89 WeakPolarHBondContact O-CB 3.28Å; M85-F89 PolarHBondContact O-N 3.48Å; I86-F89 WeakPolarHBondContact O-CB 3.36Å; I86-F89 PolarHBondContact O-N 2.83Å; I86-F89 VanDerWaalsContact O-N 3.16Å; F89-L91 VanDerWaalsContact C-N 3.33Å; F89-L91 PolarHBondContact O-N 2.7Å; F89-I92 PolarHBondContact O-N 3.06Å; F89-I93 HydrophobicContact CD1-CD1 3.77Å; F89-I93 HydrophobicContact CE1-CD1 3.47Å; F89-I93 VanDerWaalsContact CE1-CD1 3.47Å; F89-I93 HydrophobicContact CE2-CD1 4.25Å; F89-I93 HydrophobicContact CG-CD1 4.3Å; F89-I93 HydrophobicContact CZ-CD1 3.74Å; F89-I93 HydrophobicContact CZ-CG1 4.4Å; F89-I93 WeakPolarHBondContact O-CG1 3.35Å; F89-I93 PolarHBondContact O-N 2.63Å; F89-F231 HydrophobicContact CE2-CE1 4.15Å; F89-F231 HydrophobicContact CZ-CE1 4.37Å; F89-I232 HydrophobicContact CE1-CG2 4.47Å; F89-I235 HydrophobicContact CE2-CG2 4.49Å; F89-I235 HydrophobicContact CZ-CG2 4.16Å |
| 90 | F | 90.1 | Very high | 87.5 | Confident | 136 Ų | 136 | 66.6 Ų | 66.6 | 60% | 0.596 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -63.2 | -37.9 | 174.5 | -77.1 | -64.4 | 0 | 0 | 0 | 112.6 | I86 I93 Y94 | I86-F90 HydrophobicContact CG2-CD2 3.69Å; I86-F90 HydrophobicContact CG2-CE2 3.43Å; I86-F90 VanDerWaalsContact CG2-CE2 3.43Å; I86-F90 VanDerWaalsContact O-CD2 3.22Å; I86-F90 WeakPolarHBondContact O-CD2 3.39Å; I86-F90 PolarHBondContact O-N 3.31Å; F90-I93 PolarHBondContact O-N 3.44Å; F90-Y94 WeakPolarHBondContact O-CB 3.25Å; F90-Y94 PolarHBondContact O-N 3.24Å |
| 91 | L | 91.8 | Very high | 87.9 | Confident | 93 Ų | 93 | 63.6 Ų | 63.6 | 49% | 0.487 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.1 | -44.1 | 174.1 | 179.5 | 66.6 | 0 | 0 | 0 | 111.5 | S87 F88 F89 Y94 L95 | S87-L91 PolarHBondContact O-N 3.16Å; S87-L91 VanDerWaalsContact O-N 3.08Å; F88-L91 WeakPolarHBondContact O-CB 3.45Å; F88-L91 PolarHBondContact O-N 2.86Å; F89-L91 VanDerWaalsContact C-N 3.33Å; F89-L91 PolarHBondContact O-N 2.7Å; L91-Y94 WeakPolarHBondContact O-CB 3.3Å; L91-Y94 PolarHBondContact O-N 3Å; L91-L95 WeakPolarHBondContact O-CG 3.47Å; L91-L95 PolarHBondContact O-N 2.67Å; L91-L95 VanDerWaalsContact O-N 3.13Å |
| 92 | I | 90.6 | Very high | 88.6 | Confident | 11 Ų | 11 | 66.2 Ų | 66.2 | 6% | 0.056 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.5 | -43.5 | 177.6 | -66.3 | 163.9 | 0 | 0 | 0 | 110.9 | F88 F89 Y94 L95 G96 V99 L100 I103 | F88-I92 HydrophobicContact CD1-CD1 3.62Å; F88-I92 HydrophobicContact CD1-CG1 4.48Å; F88-I92 HydrophobicContact CE1-CD1 3.25Å; F88-I92 HydrophobicContact CE1-CG1 4.17Å; F88-I92 HydrophobicContact CE2-CD1 4.27Å; F88-I92 HydrophobicContact CE2-CG1 4.35Å; F88-I92 HydrophobicContact CG-CD1 4.29Å; F88-I92 HydrophobicContact CZ-CD1 3.61Å; F88-I92 HydrophobicContact CZ-CG1 4.09Å; F88-I92 WeakPolarHBondContact O-CG1 3.09Å; F88-I92 PolarHBondContact O-N 2.82Å; F89-I92 PolarHBondContact O-N 3.06Å; I92-Y94 VanDerWaalsContact C-N 3.27Å; I92-Y94 PolarHBondContact O-N 2.98Å; I92-L95 PolarHBondContact O-N 3.22Å; I92-L95 VanDerWaalsContact O-N 3.15Å; I92-G96 PolarHBondContact O-N 3.12Å; I92-V99 HydrophobicContact CG2-CG1 4.32Å; I92-L100 HydrophobicContact CG2-CD2 3.47Å; I92-L100 VanDerWaalsContact CG2-CD2 3.47Å; I92-L100 HydrophobicContact CG2-CG 3.92Å; I92-I103 HydrophobicContact CD1-CD1 4.25Å; I92-I103 HydrophobicContact CD1-CG1 4.24Å; I92-I103 HydrophobicContact CD1-CG2 4.33Å; I92-I103 HydrophobicContact CG1-CG1 4.47Å; I92-I103 HydrophobicContact CG2-CG1 4.07Å |
| 93 | I | 90.7 | Very high | 89.3 | Confident | 10 Ų | 10 | 66.8 Ų | 66.8 | 5% | 0.051 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -58.5 | -43.4 | 176.8 | -70.1 | 166.2 | 0 | 0 | 0 | 110.3 | F89 F90 L95 G96 I232 Y292 F293 | F89-I93 HydrophobicContact CD1-CD1 3.77Å; F89-I93 HydrophobicContact CE1-CD1 3.47Å; F89-I93 VanDerWaalsContact CE1-CD1 3.47Å; F89-I93 HydrophobicContact CE2-CD1 4.25Å; F89-I93 HydrophobicContact CG-CD1 4.3Å; F89-I93 HydrophobicContact CZ-CD1 3.74Å; F89-I93 HydrophobicContact CZ-CG1 4.4Å; F89-I93 WeakPolarHBondContact O-CG1 3.35Å; F89-I93 PolarHBondContact O-N 2.63Å; F90-I93 PolarHBondContact O-N 3.44Å; I93-L95 VanDerWaalsContact C-N 3.28Å; I93-L95 PolarHBondContact O-N 3.32Å; I93-G96 PolarHBondContact O-N 2.97Å; I93-G96 VanDerWaalsContact O-N 3.1Å; I93-I232 HydrophobicContact CD1-CD1 3.84Å; I93-I232 HydrophobicContact CD1-CG1 4.06Å; I93-I232 HydrophobicContact CD1-CG2 4.25Å; I93-I232 HydrophobicContact CG1-CD1 3.97Å; I93-I232 HydrophobicContact CG1-CG1 4.34Å; I93-I232 HydrophobicContact CG2-CD1 3.88Å; I93-Y292 PolarHBondContact O-OH 3.44Å; I93-F293 HydrophobicContact CG2-CE1 3.7Å; I93-F293 HydrophobicContact CG2-CZ 4.38Å |
| 94 | Y | 90.2 | Very high | 89.7 | Confident | 188 Ų | 188 | 61.6 Ų | 61.6 | 74% | 0.737 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -62 | -33.9 | 178 | 177.3 | -100.2 | 0 | 0 | 0 | 113.2 | F90 L91 I92 G96 | F90-Y94 WeakPolarHBondContact O-CB 3.25Å; F90-Y94 PolarHBondContact O-N 3.24Å; L91-Y94 WeakPolarHBondContact O-CB 3.3Å; L91-Y94 PolarHBondContact O-N 3Å; I92-Y94 VanDerWaalsContact C-N 3.27Å; I92-Y94 PolarHBondContact O-N 2.98Å; Y94-G96 PolarHBondContact O-N 2.87Å |
| 95 | L | 90.3 | Very high | 90.1 | Very high | 99 Ų | 99 | 60.5 Ų | 60.5 | 52% | 0.518 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -71.2 | -11.1 | 177 | -67.8 | 171.1 | 0 | 0 | 0 | 113.7 | L91 I92 I93 V99 | L91-L95 WeakPolarHBondContact O-CG 3.47Å; L91-L95 PolarHBondContact O-N 2.67Å; L91-L95 VanDerWaalsContact O-N 3.13Å; I92-L95 PolarHBondContact O-N 3.22Å; I92-L95 VanDerWaalsContact O-N 3.15Å; I93-L95 VanDerWaalsContact C-N 3.28Å; I93-L95 PolarHBondContact O-N 3.32Å; L95-V99 HydrophobicContact CB-CB 3.87Å; L95-V99 HydrophobicContact CB-CG1 3.98Å; L95-V99 HydrophobicContact CB-CG2 3.82Å; L95-V99 HydrophobicContact CD1-CG1 4.04Å |
| 96 | G | 89.7 | Confident | 90.6 | Very high | 6 Ų | 6 | 60 Ų | 60 | 6% | 0.062 | 30% | 0.304 | C | S | . | . | trans | 96 | 176.4 | 169.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | I92 I93 Y94 M98 V99 L100 Y292 | I92-G96 PolarHBondContact O-N 3.12Å; I93-G96 PolarHBondContact O-N 2.97Å; I93-G96 VanDerWaalsContact O-N 3.1Å; Y94-G96 PolarHBondContact O-N 2.87Å; G96-M98 VanDerWaalsContact C-N 3.31Å; G96-M98 PolarHBondContact O-N 3.47Å; G96-V99 PolarHBondContact O-N 2.9Å; G96-L100 PolarHBondContact O-N 3.41Å; G96-L100 VanDerWaalsContact O-N 3.13Å; G96-Y292 VanDerWaalsContact CA-OH 3.31Å; G96-Y292 WeakPolarHBondContact CA-OH 3.22Å | ||
| 97 | P | 89.1 | Confident | 91 | Very high | 13 Ų | 13 | 58.3 Ų | 58.3 | 8% | 0.084 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65 | -30.7 | -168.2 | 23.2 | -33.4 | 0 | 0 | 0 | 113.7 | L100 M101 M228 V297 V308 | P97-L100 WeakPolarHBondContact O-CB 3.47Å; P97-L100 PolarHBondContact O-N 3.04Å; P97-M101 PolarHBondContact O-N 2.71Å; P97-M228 HydrophobicContact CB-CG 4.42Å; P97-M228 HydrophobicContact CB-SD 4.1Å; P97-M228 HydrophobicContact CG-SD 4.45Å; P97-V297 HydrophobicContact CB-CG1 4.31Å; P97-V297 HydrophobicContact CB-CG2 3.66Å; P97-V297 HydrophobicContact CG-CG1 4.03Å; P97-V297 HydrophobicContact CG-CG2 3.87Å; P97-V308 HydrophobicContact CG-CG1 4.4Å |
| 98 | M | 88.3 | Confident | 91.3 | Very high | 54 Ų | 54 | 54.7 Ų | 54.7 | 27% | 0.266 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -69.2 | -39.5 | 177.7 | -67.4 | -52 | -65.3 | 0 | 0 | 112.5 | G96 L100 M101 M102 F155 F306 | G96-M98 VanDerWaalsContact C-N 3.31Å; G96-M98 PolarHBondContact O-N 3.47Å; M98-L100 VanDerWaalsContact C-N 3.33Å; M98-M101 HydrophobicContact CE-SD 4.2Å; M98-M101 PolarHBondContact O-N 3.04Å; M98-M102 WeakPolarHBondContact O-CG 3.29Å; M98-M102 PolarHBondContact O-N 3.37Å; M98-F155 HydrophobicContact CE-CZ 4.31Å; M98-F155 HydrophobicContact SD-CZ 4.39Å; M98-F306 HydrophobicContact CE-CE1 4.15Å; M98-F306 HydrophobicContact CE-CE2 3.96Å; M98-F306 HydrophobicContact CE-CZ 3.49Å; M98-F306 VanDerWaalsContact CE-CZ 3.49Å; M98-F306 HydrophobicContact CG-CD1 4.22Å; M98-F306 HydrophobicContact CG-CD2 3.52Å; M98-F306 HydrophobicContact CG-CE1 4.12Å; M98-F306 HydrophobicContact CG-CE2 3.46Å; M98-F306 VanDerWaalsContact CG-CE2 3.46Å; M98-F306 HydrophobicContact CG-CG 3.88Å; M98-F306 HydrophobicContact CG-CZ 3.72Å; M98-F306 HydrophobicContact SD-CD1 3.9Å; M98-F306 HydrophobicContact SD-CD2 4.12Å; M98-F306 HydrophobicContact SD-CE1 3.39Å; M98-F306 WeakPolarHBondContact SD-CE1 3.49Å; M98-F306 HydrophobicContact SD-CE2 3.7Å; M98-F306 HydrophobicContact SD-CG 4.19Å; M98-F306 HydrophobicContact SD-CZ 3.24Å; M98-F306 WeakPolarHBondContact SD-CZ 3.22Å |
| 99 | V | 91.7 | Very high | 91.7 | Very high | 50 Ų | 50 | 52.5 Ų | 52.5 | 30% | 0.303 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -68.1 | -39.3 | 175.5 | 179.5 | 0 | 0 | 0 | 0 | 109.9 | I92 L95 G96 M101 M102 I103 | I92-V99 HydrophobicContact CG2-CG1 4.32Å; L95-V99 HydrophobicContact CB-CB 3.87Å; L95-V99 HydrophobicContact CB-CG1 3.98Å; L95-V99 HydrophobicContact CB-CG2 3.82Å; L95-V99 HydrophobicContact CD1-CG1 4.04Å; G96-V99 PolarHBondContact O-N 2.9Å; V99-M101 PolarHBondContact O-N 3.39Å; V99-M102 PolarHBondContact O-N 2.69Å; V99-I103 HydrophobicContact CG1-CG1 4.28Å; V99-I103 WeakPolarHBondContact O-CB 3.47Å; V99-I103 VanDerWaalsContact O-CG1 3.26Å; V99-I103 WeakPolarHBondContact O-CG1 3.49Å; V99-I103 PolarHBondContact O-N 2.94Å |
| 100 | L | 92.1 | Very high | 91.9 | Very high | 3 Ų | 3 | 56 Ų | 56 | 2% | 0.016 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -57.3 | -46.9 | 172 | -77.6 | 167.1 | 0 | 0 | 0 | 112.2 | I92 G96 P97 M98 M102 I103 V104 L224 M228 F231 | I92-L100 HydrophobicContact CG2-CD2 3.47Å; I92-L100 VanDerWaalsContact CG2-CD2 3.47Å; I92-L100 HydrophobicContact CG2-CG 3.92Å; G96-L100 PolarHBondContact O-N 3.41Å; G96-L100 VanDerWaalsContact O-N 3.13Å; P97-L100 WeakPolarHBondContact O-CB 3.47Å; P97-L100 PolarHBondContact O-N 3.04Å; M98-L100 VanDerWaalsContact C-N 3.33Å; L100-M102 PolarHBondContact O-N 3.32Å; L100-I103 PolarHBondContact O-N 3.22Å; L100-V104 WeakPolarHBondContact O-CG2 3.45Å; L100-V104 PolarHBondContact O-N 2.83Å; L100-L224 HydrophobicContact CB-CD1 4.22Å; L100-L224 HydrophobicContact CB-CD2 3.88Å; L100-L224 HydrophobicContact CD1-CD1 3.89Å; L100-M228 HydrophobicContact CD1-SD 4.03Å; L100-F231 HydrophobicContact CD2-CD1 4.43Å; L100-F231 HydrophobicContact CD2-CE1 3.62Å; L100-F231 HydrophobicContact CD2-CZ 4.06Å |
| 101 | M | 92.1 | Very high | 92.1 | Very high | 17 Ų | 17 | 49.5 Ų | 49.5 | 8% | 0.084 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -57.9 | -48.2 | 175.2 | 179.8 | -170.2 | 173 | 0 | 0 | 111.6 | P97 M98 V99 I103 V104 L105 I221 L224 F225 | P97-M101 PolarHBondContact O-N 2.71Å; M98-M101 HydrophobicContact CE-SD 4.2Å; M98-M101 PolarHBondContact O-N 3.04Å; V99-M101 PolarHBondContact O-N 3.39Å; M101-I103 VanDerWaalsContact C-N 3.34Å; M101-I103 PolarHBondContact O-N 3.11Å; M101-V104 PolarHBondContact O-N 3.35Å; M101-L105 HydrophobicContact CE-CD1 4.19Å; M101-L105 HydrophobicContact CG-CD1 4.43Å; M101-L105 WeakPolarHBondContact O-CG 3.28Å; M101-L105 PolarHBondContact O-N 3.46Å; M101-I221 HydrophobicContact CG-CD1 3.86Å; M101-I221 HydrophobicContact CG-CG1 4.14Å; M101-I221 HydrophobicContact CG-CG2 4.23Å; M101-L224 HydrophobicContact CB-CD2 4.34Å; M101-F225 HydrophobicContact SD-CE2 4.35Å; M101-F225 HydrophobicContact SD-CZ 3.69Å |
| 102 | M | 92.5 | Very high | 92.2 | Very high | 108 Ų | 108 | 45.1 Ų | 45.1 | 53% | 0.532 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.7 | -40.2 | 178.9 | -69.8 | -57.5 | -64.2 | 0 | 0 | 112.1 | M98 V99 L100 L105 C106 | M98-M102 WeakPolarHBondContact O-CG 3.29Å; M98-M102 PolarHBondContact O-N 3.37Å; V99-M102 PolarHBondContact O-N 2.69Å; L100-M102 PolarHBondContact O-N 3.32Å; M102-L105 PolarHBondContact O-N 3.24Å; M102-L105 HydrophobicContact SD-CD1 4.24Å; M102-C106 PolarHBondContact O-N 3.39Å; M102-C106 PolarHBondContact O-SG 3.18Å |
| 103 | I | 92.9 | Very high | 92.3 | Very high | 56 Ų | 56 | 48.5 Ų | 48.5 | 29% | 0.287 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -63 | -44.1 | 175.5 | -71.1 | -72.8 | 0 | 0 | 0 | 110.7 | I92 V99 L100 M101 L105 C106 V107 | I92-I103 HydrophobicContact CD1-CD1 4.25Å; I92-I103 HydrophobicContact CD1-CG1 4.24Å; I92-I103 HydrophobicContact CD1-CG2 4.33Å; I92-I103 HydrophobicContact CG1-CG1 4.47Å; I92-I103 HydrophobicContact CG2-CG1 4.07Å; V99-I103 HydrophobicContact CG1-CG1 4.28Å; V99-I103 WeakPolarHBondContact O-CB 3.47Å; V99-I103 VanDerWaalsContact O-CG1 3.26Å; V99-I103 WeakPolarHBondContact O-CG1 3.49Å; V99-I103 PolarHBondContact O-N 2.94Å; L100-I103 PolarHBondContact O-N 3.22Å; M101-I103 VanDerWaalsContact C-N 3.34Å; M101-I103 PolarHBondContact O-N 3.11Å; I103-L105 VanDerWaalsContact C-N 3.31Å; I103-L105 PolarHBondContact O-N 2.82Å; I103-C106 PolarHBondContact O-N 3.07Å; I103-V107 HydrophobicContact CG2-CG2 4.3Å; I103-V107 WeakPolarHBondContact O-CB 3.21Å; I103-V107 WeakPolarHBondContact O-CG2 3.24Å; I103-V107 PolarHBondContact O-N 3.09Å |
| 104 | V | 93.6 | Very high | 92.3 | Very high | 15 Ų | 15 | 48.3 Ų | 48.3 | 9% | 0.091 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60 | -42.7 | 176.7 | 171.6 | 0 | 0 | 0 | 0 | 111 | L100 M101 V107 Q108 I220 I221 F231 | L100-V104 WeakPolarHBondContact O-CG2 3.45Å; L100-V104 PolarHBondContact O-N 2.83Å; M101-V104 PolarHBondContact O-N 3.35Å; V104-V107 PolarHBondContact O-N 3Å; V104-Q108 WeakPolarHBondContact O-CB 3.48Å; V104-Q108 PolarHBondContact O-N 3.3Å; V104-I220 HydrophobicContact CG1-CB 4.3Å; V104-I220 HydrophobicContact CG1-CG2 3.96Å; V104-I220 HydrophobicContact CG2-CG2 3.8Å; V104-I221 HydrophobicContact CB-CD1 4.22Å; V104-I221 HydrophobicContact CB-CG1 4.22Å; V104-I221 HydrophobicContact CG1-CD1 3.87Å; V104-I221 HydrophobicContact CG1-CG1 3.9Å; V104-F231 HydrophobicContact CG2-CE2 3.99Å; V104-F231 HydrophobicContact CG2-CZ 4.37Å |
| 105 | L | 93.8 | Very high | 92.3 | Very high | 30 Ų | 30 | 40 Ų | 40 | 16% | 0.157 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.6 | -42.3 | 174.7 | -69.3 | 173.3 | 0 | 0 | 0 | 112.3 | M101 M102 I103 Q108 I109 Y147 I221 | M101-L105 HydrophobicContact CE-CD1 4.19Å; M101-L105 HydrophobicContact CG-CD1 4.43Å; M101-L105 WeakPolarHBondContact O-CG 3.28Å; M101-L105 PolarHBondContact O-N 3.46Å; M102-L105 PolarHBondContact O-N 3.24Å; M102-L105 HydrophobicContact SD-CD1 4.24Å; I103-L105 VanDerWaalsContact C-N 3.31Å; I103-L105 PolarHBondContact O-N 2.82Å; L105-Q108 WeakPolarHBondContact O-CB 3.28Å; L105-Q108 PolarHBondContact O-N 3.45Å; L105-I109 WeakPolarHBondContact O-CG1 3.47Å; L105-I109 PolarHBondContact O-N 3.5Å; L105-Y147 HydrophobicContact CD2-CD1 4.29Å; L105-Y147 HydrophobicContact CD2-CD2 3.97Å; L105-Y147 HydrophobicContact CD2-CE1 3.76Å; L105-Y147 HydrophobicContact CD2-CE2 3.38Å; L105-Y147 HydrophobicContact CD2-CG 4.39Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.35Å; L105-I221 HydrophobicContact CD2-CD1 4.08Å; L105-I221 HydrophobicContact CG-CD1 4.09Å |
| 106 | C | 94.2 | Very high | 92.3 | Very high | 71 Ų | 71 | 35.8 Ų | 35.8 | 48% | 0.48 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -63.7 | -44.5 | 176.2 | -71.3 | 0 | 0 | 0 | 0 | 111.9 | M102 I103 Q108 I109 K110 | M102-C106 PolarHBondContact O-N 3.39Å; M102-C106 PolarHBondContact O-SG 3.18Å; I103-C106 PolarHBondContact O-N 3.07Å; C106-Q108 VanDerWaalsContact C-N 3.35Å; C106-I109 PolarHBondContact O-N 3.18Å; C106-K110 WeakPolarHBondContact O-CG 3.47Å; C106-K110 PolarHBondContact O-N 2.84Å |
| 107 | V | 93.1 | Very high | 92.3 | Very high | 29 Ų | 29 | 37.7 Ų | 37.7 | 18% | 0.176 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.1 | -45.8 | 175.3 | 166.7 | 0 | 0 | 0 | 0 | 110.3 | I103 V104 I109 K110 C111 I385 F389 | I103-V107 HydrophobicContact CG2-CG2 4.3Å; I103-V107 WeakPolarHBondContact O-CB 3.21Å; I103-V107 WeakPolarHBondContact O-CG2 3.24Å; I103-V107 PolarHBondContact O-N 3.09Å; V104-V107 PolarHBondContact O-N 3Å; V107-I109 PolarHBondContact O-N 3Å; V107-K110 PolarHBondContact O-N 3.06Å; V107-C111 WeakPolarHBondContact O-CB 3.37Å; V107-C111 PolarHBondContact O-N 3.29Å; V107-C111 PolarHBondContact O-SG 3.05Å; V107-C111 VanDerWaalsContact O-SG 3.4Å; V107-I385 HydrophobicContact CG1-CG2 3.89Å; V107-F389 HydrophobicContact CG1-CD1 4.32Å; V107-F389 HydrophobicContact CG1-CD2 3.68Å; V107-F389 HydrophobicContact CG1-CE1 4.19Å; V107-F389 HydrophobicContact CG1-CE2 3.53Å; V107-F389 HydrophobicContact CG1-CG 4.09Å; V107-F389 HydrophobicContact CG1-CZ 3.8Å; V107-F389 HydrophobicContact CG2-CE2 4.14Å; V107-F389 HydrophobicContact CG2-CZ 4.13Å |
| 108 | Q | 95.1 | Very high | 92.1 | Very high | 4 Ų | 4 | 37.6 Ų | 37.6 | 2% | 0.019 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -56.3 | -50.9 | 176 | 178.5 | -153.2 | -38.3 | 0 | 0 | 111.8 | V104 L105 C106 K110 C111 F112 N143 Y147 V213 S217 | V104-Q108 WeakPolarHBondContact O-CB 3.48Å; V104-Q108 PolarHBondContact O-N 3.3Å; L105-Q108 WeakPolarHBondContact O-CB 3.28Å; L105-Q108 PolarHBondContact O-N 3.45Å; C106-Q108 VanDerWaalsContact C-N 3.35Å; Q108-K110 VanDerWaalsContact C-N 3.28Å; Q108-K110 PolarHBondContact O-N 3.15Å; Q108-C111 PolarHBondContact O-N 2.89Å; Q108-F112 WeakPolarHBondContact O-CB 3.06Å; Q108-F112 PolarHBondContact O-N 3.31Å; Q108-N143 PolarHBondContact NE2-ND2 2.97Å; Q108-N143 PolarHBondContact NE2-OD1 2.92Å; Q108-Y147 PolarHBondContact OE1-OH 3.33Å; Q108-V213 HydrophobicContact CB-CG1 4.35Å; Q108-V213 HydrophobicContact CG-CG1 3.62Å; Q108-V213 WeakPolarHBondContact O-CG1 3.26Å; Q108-S217 WeakPolarHBondContact CG-OG 3.22Å; Q108-S217 PolarHBondContact OE1-OG 2.78Å |
| 109 | I | 95.1 | Very high | 91.9 | Very high | 70 Ų | 70 | 35 Ų | 35 | 36% | 0.359 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -59.6 | -41.6 | 179.3 | -70.1 | 166.9 | 0 | 0 | 0 | 110.6 | L105 C106 V107 H113 W136 L139 | L105-I109 WeakPolarHBondContact O-CG1 3.47Å; L105-I109 PolarHBondContact O-N 3.5Å; C106-I109 PolarHBondContact O-N 3.18Å; V107-I109 PolarHBondContact O-N 3Å; I109-H113 WeakPolarHBondContact O-CB 3.45Å; I109-H113 PolarHBondContact O-N 3.03Å; I109-W136 HydrophobicContact CG2-CH2 3.89Å; I109-W136 HydrophobicContact CG2-CZ3 3.88Å; I109-L139 HydrophobicContact CG1-CD2 4.46Å |
| 110 | K | 93.5 | Very high | 91.5 | Very high | 112 Ų | 112 | 36.8 Ų | 36.8 | 49% | 0.487 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -67.7 | -45.4 | 178.1 | -71.5 | -65.9 | -174.2 | 178 | 0 | 112.5 | C106 V107 Q108 F112 H113 E114 I385 | C106-K110 WeakPolarHBondContact O-CG 3.47Å; C106-K110 PolarHBondContact O-N 2.84Å; V107-K110 PolarHBondContact O-N 3.06Å; Q108-K110 VanDerWaalsContact C-N 3.28Å; Q108-K110 PolarHBondContact O-N 3.15Å; K110-F112 VanDerWaalsContact C-N 3.33Å; K110-F112 PolarHBondContact O-N 3.01Å; K110-H113 WeakPolarHBondContact O-CB 3.29Å; K110-H113 PolarHBondContact O-N 2.92Å; K110-E114 WeakPolarHBondContact O-CG 3.14Å; K110-E114 PolarHBondContact O-N 2.99Å; K110-I385 HydrophobicContact CB-CD1 3.69Å; K110-I385 HydrophobicContact CG-CD1 4.03Å |
| 111 | C | 93.3 | Very high | 91 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -58 | -44.5 | 174.3 | -77.4 | 0 | 0 | 0 | 0 | 112.2 | V107 Q108 E114 I115 V213 M386 Y393 | V107-C111 WeakPolarHBondContact O-CB 3.37Å; V107-C111 PolarHBondContact O-N 3.29Å; V107-C111 PolarHBondContact O-SG 3.05Å; V107-C111 VanDerWaalsContact O-SG 3.4Å; Q108-C111 PolarHBondContact O-N 2.89Å; C111-E114 PolarHBondContact O-N 3.3Å; C111-I115 PolarHBondContact O-N 3.02Å; C111-I115 VanDerWaalsContact O-N 3.11Å; C111-V213 HydrophobicContact CB-CG1 4.05Å; C111-M386 HydrophobicContact CB-CE 3.73Å; C111-Y393 WeakPolarHBondContact CB-OH 3.25Å; C111-Y393 PolarHBondContact SG-OH 3.28Å |
| 112 | F | 94.6 | Very high | 90.4 | Very high | 1 Ų | 1 | 40 Ų | 40 | 0% | 0.004 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.8 | -46.3 | 175.6 | 178.1 | -97.4 | 0 | 0 | 0 | 111.2 | Q108 K110 E114 I115 I116 S135 L139 T206 T209 L210 V213 | Q108-F112 WeakPolarHBondContact O-CB 3.06Å; Q108-F112 PolarHBondContact O-N 3.31Å; K110-F112 VanDerWaalsContact C-N 3.33Å; K110-F112 PolarHBondContact O-N 3.01Å; F112-E114 PolarHBondContact O-N 3.06Å; F112-I115 PolarHBondContact O-N 3.45Å; F112-I116 HydrophobicContact CD1-CG1 4.03Å; F112-I116 HydrophobicContact CD2-CG1 4.11Å; F112-I116 HydrophobicContact CE1-CD1 4.48Å; F112-I116 HydrophobicContact CE1-CG1 3.68Å; F112-I116 HydrophobicContact CE2-CD1 3.9Å; F112-I116 HydrophobicContact CE2-CG1 3.71Å; F112-I116 HydrophobicContact CG-CG1 4.26Å; F112-I116 HydrophobicContact CZ-CD1 3.84Å; F112-I116 HydrophobicContact CZ-CG1 3.51Å; F112-I116 WeakPolarHBondContact O-CB 3.07Å; F112-I116 VanDerWaalsContact O-CG1 3.26Å; F112-I116 WeakPolarHBondContact O-CG1 3.3Å; F112-I116 PolarHBondContact O-N 3.41Å; F112-S135 WeakPolarHBondContact CZ-O 3.46Å; F112-L139 HydrophobicContact CB-CD1 4.28Å; F112-L139 HydrophobicContact CD1-CB 4.34Å; F112-L139 HydrophobicContact CD1-CD1 4.02Å; F112-L139 HydrophobicContact CD1-CD2 3.66Å; F112-L139 HydrophobicContact CD1-CG 4.21Å; F112-L139 HydrophobicContact CD2-CD1 3.98Å; F112-L139 HydrophobicContact CE1-CB 3.87Å; F112-L139 HydrophobicContact CE1-CD1 4.32Å; F112-L139 HydrophobicContact CE1-CD2 3.96Å; F112-L139 HydrophobicContact CE1-CG 4.26Å; F112-L139 HydrophobicContact CE2-CD1 4.33Å; F112-L139 HydrophobicContact CG-CD1 3.82Å; F112-L139 HydrophobicContact CG-CD2 4.23Å; F112-L139 HydrophobicContact CZ-CB 4.02Å; F112-L139 HydrophobicContact CZ-CD1 4.46Å; F112-T206 HydrophobicContact CZ-CG2 4.34Å; F112-T209 HydrophobicContact CD2-CG2 3.64Å; F112-T209 HydrophobicContact CE2-CG2 4.08Å; F112-L210 HydrophobicContact CD2-CD2 3.93Å; F112-L210 HydrophobicContact CE2-CD2 3.45Å; F112-L210 VanDerWaalsContact CE2-CD2 3.45Å; F112-L210 HydrophobicContact CE2-CG 3.79Å; F112-L210 HydrophobicContact CZ-CD2 4.07Å; F112-V213 HydrophobicContact CB-CG1 4.28Å |
| 113 | H | 92.3 | Very high | 89.5 | Confident | 82 Ų | 82 | 37.7 Ų | 37.7 | 38% | 0.38 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -59.6 | -44.9 | 177 | 175.1 | -99.2 | 0 | 0 | 0 | 112.4 | I109 K110 T117 W136 | I109-H113 WeakPolarHBondContact O-CB 3.45Å; I109-H113 PolarHBondContact O-N 3.03Å; K110-H113 WeakPolarHBondContact O-CB 3.29Å; K110-H113 PolarHBondContact O-N 2.92Å; H113-T117 VanDerWaalsContact O-CB 3.22Å; H113-T117 WeakPolarHBondContact O-CB 3.38Å; H113-T117 PolarHBondContact O-N 3.48Å; H113-T117 PolarHBondContact O-OG1 2.95Å; H113-W136 HydrophobicContact CB-CH2 4.28Å; H113-W136 HydrophobicContact CB-CZ2 4.25Å; H113-W136 AromaticContact CD2-CZ2 3.79Å |
| 114 | E | 91.5 | Very high | 88.3 | Confident | 7 Ų | 7 | 40 Ų | 40 | 3% | 0.033 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -58.6 | -49.6 | 177.1 | -70.1 | 179.4 | 179.1 | 0 | 0 | 111.6 | K110 C111 F112 T117 I118 A376 T378 I385 M386 | K110-E114 WeakPolarHBondContact O-CG 3.14Å; K110-E114 PolarHBondContact O-N 2.99Å; C111-E114 PolarHBondContact O-N 3.3Å; F112-E114 PolarHBondContact O-N 3.06Å; E114-T117 PolarHBondContact O-N 3.45Å; E114-I118 WeakPolarHBondContact O-CG1 3.38Å; E114-I118 PolarHBondContact O-N 3.33Å; E114-I118 VanDerWaalsContact O-N 3.11Å; E114-A376 HydrophobicContact CB-CB 4.38Å; E114-A376 HydrophobicContact CG-CB 3.69Å; E114-T378 WeakPolarHBondContact OE1-CB 3.48Å; E114-T378 PolarHBondContact OE1-OG1 2.78Å; E114-I385 PolarHBondContact OE1-N 2.85Å; E114-I385 PolarHBondContact OE2-N 3.13Å; E114-M386 WeakPolarHBondContact OE2-CB 3.24Å; E114-M386 PolarHBondContact OE2-N 3.03Å |
| 115 | I | 89.9 | Confident | 86.7 | Confident | 14 Ų | 14 | 43.4 Ų | 43.4 | 7% | 0.072 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -65.5 | -44.1 | 179.8 | -69.4 | -179.7 | 0 | 0 | 0 | 112.5 | C111 F112 T117 I118 G119 W205 T209 V213 F375 M386 | C111-I115 PolarHBondContact O-N 3.02Å; C111-I115 VanDerWaalsContact O-N 3.11Å; F112-I115 PolarHBondContact O-N 3.45Å; I115-T117 VanDerWaalsContact C-N 3.27Å; I115-T117 PolarHBondContact O-N 3.29Å; I115-I118 PolarHBondContact O-N 3.32Å; I115-G119 PolarHBondContact O-N 2.85Å; I115-G119 VanDerWaalsContact O-N 3.12Å; I115-W205 HydrophobicContact CG2-CZ2 3.94Å; I115-W205 PolarHBondContact O-NE1 3.47Å; I115-T209 HydrophobicContact CB-CG2 3.79Å; I115-T209 HydrophobicContact CD1-CG2 4.08Å; I115-T209 HydrophobicContact CG2-CG2 3.57Å; I115-T209 VanDerWaalsContact CG2-OG1 3.27Å; I115-T209 WeakPolarHBondContact CG2-OG1 3.32Å; I115-V213 HydrophobicContact CD1-CG2 4.27Å; I115-F375 HydrophobicContact CG1-CD1 4.11Å; I115-F375 HydrophobicContact CG1-CE1 4.18Å; I115-M386 HydrophobicContact CD1-CE 3.13Å; I115-M386 HydrophobicContact CD1-CG 4.31Å; I115-M386 HydrophobicContact CD1-SD 4.34Å; I115-M386 HydrophobicContact CG1-CE 3.93Å; I115-M386 HydrophobicContact CG1-CG 4.44Å |
| 116 | I | 90.8 | Very high | 85.2 | Confident | 9 Ų | 9 | 47.4 Ų | 47.4 | 5% | 0.046 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.2 | -35.7 | 179.2 | -66.7 | -65.1 | 0 | 0 | 0 | 110.9 | F112 G119 Y120 F131 T206 | F112-I116 HydrophobicContact CD1-CG1 4.03Å; F112-I116 HydrophobicContact CD2-CG1 4.11Å; F112-I116 HydrophobicContact CE1-CD1 4.48Å; F112-I116 HydrophobicContact CE1-CG1 3.68Å; F112-I116 HydrophobicContact CE2-CD1 3.9Å; F112-I116 HydrophobicContact CE2-CG1 3.71Å; F112-I116 HydrophobicContact CG-CG1 4.26Å; F112-I116 HydrophobicContact CZ-CD1 3.84Å; F112-I116 HydrophobicContact CZ-CG1 3.51Å; F112-I116 WeakPolarHBondContact O-CB 3.07Å; F112-I116 VanDerWaalsContact O-CG1 3.26Å; F112-I116 WeakPolarHBondContact O-CG1 3.3Å; F112-I116 PolarHBondContact O-N 3.41Å; I116-G119 PolarHBondContact O-N 3.46Å; I116-Y120 WeakPolarHBondContact O-CB 3.13Å; I116-Y120 PolarHBondContact O-N 3.48Å; I116-F131 HydrophobicContact CG2-CE1 4.45Å; I116-T206 HydrophobicContact CD1-CG2 4.4Å |
| 117 | T | 88.3 | Confident | 83.9 | Confident | 46 Ų | 46 | 51.2 Ų | 51.2 | 28% | 0.282 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -66.6 | -39.2 | 178 | -59.5 | 0 | 0 | 0 | 0 | 111.4 | H113 E114 I115 Y120 N121 | H113-T117 VanDerWaalsContact O-CB 3.22Å; H113-T117 WeakPolarHBondContact O-CB 3.38Å; H113-T117 PolarHBondContact O-N 3.48Å; H113-T117 PolarHBondContact O-OG1 2.95Å; E114-T117 PolarHBondContact O-N 3.45Å; I115-T117 VanDerWaalsContact C-N 3.27Å; I115-T117 PolarHBondContact O-N 3.29Å; T117-Y120 PolarHBondContact O-N 2.81Å; T117-N121 WeakPolarHBondContact O-CB 3.42Å; T117-N121 PolarHBondContact O-N 3.43Å; T117-N121 PolarHBondContact O-ND2 3.46Å; T117-N121 PolarHBondContact O-OD1 3.18Å |
| 118 | I | 85.9 | Confident | 82.7 | Confident | 12 Ų | 12 | 51 Ų | 51 | 6% | 0.062 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61 | -49.2 | 172.9 | -65.9 | 161.5 | 0 | 0 | 0 | 110.5 | E114 I115 Y120 N121 V122 I372 F375 | E114-I118 WeakPolarHBondContact O-CG1 3.38Å; E114-I118 PolarHBondContact O-N 3.33Å; E114-I118 VanDerWaalsContact O-N 3.11Å; I115-I118 PolarHBondContact O-N 3.32Å; I118-Y120 VanDerWaalsContact C-N 3.28Å; I118-Y120 PolarHBondContact O-N 3.23Å; I118-N121 PolarHBondContact O-N 3.09Å; I118-V122 HydrophobicContact CG2-CG2 4.21Å; I118-V122 VanDerWaalsContact O-CG2 3.28Å; I118-V122 WeakPolarHBondContact O-CG2 3.32Å; I118-V122 PolarHBondContact O-N 2.89Å; I118-I372 HydrophobicContact CD1-CD1 3.76Å; I118-I372 HydrophobicContact CG1-CD1 4.2Å; I118-I372 HydrophobicContact CG2-CD1 3.89Å; I118-F375 HydrophobicContact CD1-CB 3.97Å; I118-F375 HydrophobicContact CD1-CD1 3.39Å; I118-F375 HydrophobicContact CD1-CE1 4.3Å; I118-F375 HydrophobicContact CD1-CG 4.08Å; I118-F375 WeakPolarHBondContact CD1-O 3.41Å |
| 119 | G | 83.6 | Confident | 81.4 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -54.6 | -48.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | I115 I116 N121 V122 Y123 | I115-G119 PolarHBondContact O-N 2.85Å; I115-G119 VanDerWaalsContact O-N 3.12Å; I116-G119 PolarHBondContact O-N 3.46Å; G119-N121 PolarHBondContact O-N 3.29Å; G119-V122 PolarHBondContact O-N 2.92Å; G119-Y123 WeakPolarHBondContact O-CD2 3.32Å; G119-Y123 PolarHBondContact O-N 3.29Å |
| 120 | Y | 82.8 | Confident | 80.4 | Confident | 87 Ų | 87 | 59.5 Ų | 59.5 | 34% | 0.341 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -59 | -46.2 | 176.7 | -178.8 | -102.8 | 0 | 0 | 0 | 113.1 | I116 T117 I118 V122 Y123 H124 F131 | I116-Y120 WeakPolarHBondContact O-CB 3.13Å; I116-Y120 PolarHBondContact O-N 3.48Å; T117-Y120 PolarHBondContact O-N 2.81Å; I118-Y120 VanDerWaalsContact C-N 3.28Å; I118-Y120 PolarHBondContact O-N 3.23Å; Y120-V122 PolarHBondContact O-N 3.19Å; Y120-Y123 CarbonylContact O-C 3.57Å; Y120-Y123 PolarHBondContact O-N 3.1Å; Y120-H124 AromaticContact CE1-CE1 3.95Å; Y120-H124 AromaticContact CE1-ND1 3.33Å; Y120-H124 VanDerWaalsContact CE1-ND1 3.33Å; Y120-H124 WeakPolarHBondContact CE1-ND1 3.34Å; Y120-H124 AromaticContact CZ-ND1 3.4Å; Y120-H124 VanDerWaalsContact O-CA 3.32Å; Y120-H124 WeakPolarHBondContact O-CA 3.22Å; Y120-H124 WeakPolarHBondContact O-CB 3.48Å; Y120-H124 PolarHBondContact O-N 3.04Å; Y120-H124 PolarHBondContact OH-CE1 2.97Å; Y120-H124 PolarHBondContact OH-ND1 3.01Å; Y120-F131 HydrophobicContact CD2-CD1 4.28Å |
| 121 | N | 82.4 | Confident | 79.8 | Confident | 82 Ų | 82 | 55.2 Ų | 55.2 | 44% | 0.439 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -65.7 | -38.7 | -178.5 | -70.7 | -11.9 | 0 | 0 | 0 | 112.4 | T117 I118 G119 Y123 H124 | T117-N121 WeakPolarHBondContact O-CB 3.42Å; T117-N121 PolarHBondContact O-N 3.43Å; T117-N121 PolarHBondContact O-ND2 3.46Å; T117-N121 PolarHBondContact O-OD1 3.18Å; I118-N121 PolarHBondContact O-N 3.09Å; G119-N121 PolarHBondContact O-N 3.29Å; N121-Y123 PolarHBondContact O-N 3.06Å; N121-H124 WeakPolarHBondContact O-CB 3.39Å; N121-H124 PolarHBondContact O-N 3.13Å |
| 122 | V | 78.7 | Confident | 79.4 | Confident | 5 Ų | 5 | 63.7 Ų | 63.7 | 3% | 0.03 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.2 | -31.1 | 177.8 | 170 | 0 | 0 | 0 | 0 | 111.8 | V47 V50 I118 G119 Y120 F370 | V47-V122 HydrophobicContact CG1-CG1 4.01Å; V50-V122 HydrophobicContact CG2-CG2 3.86Å; I118-V122 HydrophobicContact CG2-CG2 4.21Å; I118-V122 VanDerWaalsContact O-CG2 3.28Å; I118-V122 WeakPolarHBondContact O-CG2 3.32Å; I118-V122 PolarHBondContact O-N 2.89Å; G119-V122 PolarHBondContact O-N 2.92Å; Y120-V122 PolarHBondContact O-N 3.19Å; V122-F370 HydrophobicContact CG1-CD1 4.33Å; V122-F370 HydrophobicContact CG2-CD1 4.13Å |
| 123 | Y | 74.1 | Confident | 79.2 | Confident | 59 Ų | 59 | 67.4 Ų | 67.4 | 23% | 0.231 | 32% | 0.323 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -114 | 17.4 | -176.1 | -61.3 | -67.9 | 0 | 0 | 0 | 113.3 | G119 Y120 N121 S125 Y126 L198 M202 | G119-Y123 WeakPolarHBondContact O-CD2 3.32Å; G119-Y123 PolarHBondContact O-N 3.29Å; Y120-Y123 CarbonylContact O-C 3.57Å; Y120-Y123 PolarHBondContact O-N 3.1Å; N121-Y123 PolarHBondContact O-N 3.06Å; Y123-S125 PolarHBondContact O-N 3.22Å; Y123-Y126 PolarHBondContact O-N 2.89Å; Y123-L198 HydrophobicContact CD1-CD1 3.23Å; Y123-L198 HydrophobicContact CD2-CD1 4.12Å; Y123-L198 HydrophobicContact CE1-CD1 3.73Å; Y123-L198 HydrophobicContact CG-CD1 3.46Å; Y123-L198 VanDerWaalsContact CG-CD1 3.46Å; Y123-M202 HydrophobicContact CD2-CE 3.37Å; Y123-M202 HydrophobicContact CD2-SD 3.65Å; Y123-M202 HydrophobicContact CE2-CE 4.44Å; Y123-M202 HydrophobicContact CE2-SD 4.21Å; Y123-M202 HydrophobicContact CG-CE 3.71Å; Y123-M202 HydrophobicContact CG-SD 4.45Å |
| 124 | H | 68 | Low | 79.3 | Confident | 104 Ų | 104 | 64.3 Ų | 64.3 | 48% | 0.481 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -21 | -174 | -174.8 | 62.7 | 0 | 0 | 0 | 113.4 | Y120 N121 Y126 | Y120-H124 AromaticContact CE1-CE1 3.95Å; Y120-H124 AromaticContact CE1-ND1 3.33Å; Y120-H124 VanDerWaalsContact CE1-ND1 3.33Å; Y120-H124 WeakPolarHBondContact CE1-ND1 3.34Å; Y120-H124 AromaticContact CZ-ND1 3.4Å; Y120-H124 VanDerWaalsContact O-CA 3.32Å; Y120-H124 WeakPolarHBondContact O-CA 3.22Å; Y120-H124 WeakPolarHBondContact O-CB 3.48Å; Y120-H124 PolarHBondContact O-N 3.04Å; Y120-H124 PolarHBondContact OH-CE1 2.97Å; Y120-H124 PolarHBondContact OH-ND1 3.01Å; N121-H124 WeakPolarHBondContact O-CB 3.39Å; N121-H124 PolarHBondContact O-N 3.13Å; H124-Y126 PolarHBondContact O-N 2.9Å |
| 125 | S | 59.8 | Low | 79.4 | Confident | 88 Ų | 88 | 64 Ų | 64 | 62% | 0.615 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -10 | 178.6 | 56.7 | 0 | 0 | 0 | 0 | 114.7 | Y123 | Y123-S125 PolarHBondContact O-N 3.22Š|
| 126 | Y | 62.9 | Low | 79.6 | Confident | 113 Ų | 113 | 67.8 Ų | 67.8 | 44% | 0.443 | 32% | 0.322 | S | S | . | . | S | Bend | trans | -119.3 | 104.7 | 178.7 | -54.7 | -82.1 | 0 | 0 | 0 | 108.3 | Y123 H124 L128 H195 L198 | Y123-Y126 PolarHBondContact O-N 2.89Å; H124-Y126 PolarHBondContact O-N 2.9Å; Y126-L128 PolarHBondContact O-N 3.39Å; Y126-H195 AromaticContact CD1-CD2 3.44Å; Y126-H195 VanDerWaalsContact CD1-CD2 3.44Å; Y126-H195 WeakPolarHBondContact CD1-CD2 3.14Å; Y126-H195 AromaticContact CD1-NE2 3.47Å; Y126-H195 WeakPolarHBondContact CD1-NE2 3.29Å; Y126-L198 HydrophobicContact CD1-CD2 4.48Å; Y126-L198 HydrophobicContact CD2-CD2 3.28Å; Y126-L198 HydrophobicContact CE2-CD2 4.06Å; Y126-L198 HydrophobicContact CG-CD2 3.52Å |
| 127 | D | 65.3 | Low | 79.9 | Confident | 152 Ų | 152 | 69.9 Ų | 69.9 | 81% | 0.813 | 33% | 0.329 | S | S | * | . | trans | -61.6 | 78.9 | 174.3 | -81 | -43.4 | 0 | 0 | 0 | 110.8 | P129 | D127-P129 WeakPolarHBondContact O-CD 3.43Š| ||
| 128 | L | 69.4 | Low | 80.3 | Confident | 25 Ų | 25 | 67.8 Ų | 67.8 | 13% | 0.131 | 32% | 0.316 | C | S | . | . | trans | -84.8 | 113.8 | 179.4 | -73.5 | 172 | 0 | 0 | 0 | 109.1 | Y126 H195 L198 Q199 | Y126-L128 PolarHBondContact O-N 3.39Å; L128-H195 HydrophobicContact CD2-CB 3.99Å; L128-L198 HydrophobicContact CD1-CD2 3.65Å; L128-L198 HydrophobicContact CD1-CG 3.83Å; L128-L198 HydrophobicContact CG-CD2 4.42Å; L128-Q199 HydrophobicContact CD1-CG 4.38Å; L128-Q199 HydrophobicContact CD2-CG 3.71Å | ||
| 129 | P | 67.1 | Low | 80.9 | Confident | 67 Ų | 67 | 67.5 Ų | 67.5 | 44% | 0.435 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | 147.1 | 178.6 | 31.3 | -35.8 | 0 | 0 | 0 | 110 | D127 F131 | D127-P129 WeakPolarHBondContact O-CD 3.43Å; P129-F131 PolarHBondContact O-N 3.21Å |
| 130 | W | 75.1 | Confident | 81.5 | Confident | 185 Ų | 185 | 72.7 Ų | 72.7 | 70% | 0.701 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67 | -5.9 | 172.2 | -59.2 | 95.6 | 0 | 0 | 0 | 118.8 | R132 T133 L134 | W130-R132 VanDerWaalsContact C-N 3.34Å; W130-R132 PolarHBondContact O-N 3.25Å; W130-T133 HydrophobicContact CE3-CG2 4.02Å; W130-T133 HydrophobicContact CZ3-CG2 4.18Å; W130-T133 PolarHBondContact O-N 2.95Å; W130-L134 WeakPolarHBondContact O-CB 3.47Å; W130-L134 PolarHBondContact O-N 2.89Å |
| 131 | F | 80.5 | Confident | 82.1 | Confident | 22 Ų | 22 | 68.8 Ų | 68.8 | 10% | 0.096 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -55.2 | -45.8 | -176.1 | 172.9 | -113.8 | 0 | 0 | 0 | 113.7 | I116 Y120 P129 L134 S135 M202 | I116-F131 HydrophobicContact CG2-CE1 4.45Å; Y120-F131 HydrophobicContact CD2-CD1 4.28Å; P129-F131 PolarHBondContact O-N 3.21Å; F131-L134 PolarHBondContact O-N 2.88Å; F131-S135 WeakPolarHBondContact CE2-OG 3.41Å; F131-S135 WeakPolarHBondContact O-CB 3.33Å; F131-S135 PolarHBondContact O-N 3.14Å; F131-S135 PolarHBondContact O-OG 3.28Å; F131-M202 HydrophobicContact CD1-CE 4.35Å; F131-M202 HydrophobicContact CD2-CB 3.91Å; F131-M202 HydrophobicContact CE1-CE 3.98Å; F131-M202 HydrophobicContact CE1-SD 3.88Å; F131-M202 HydrophobicContact CE2-CB 3.47Å; F131-M202 VanDerWaalsContact CE2-CB 3.47Å; F131-M202 HydrophobicContact CE2-CG 4.18Å; F131-M202 HydrophobicContact CE2-SD 4.24Å; F131-M202 HydrophobicContact CZ-CB 3.89Å; F131-M202 HydrophobicContact CZ-CE 4.35Å; F131-M202 HydrophobicContact CZ-CG 4.19Å; F131-M202 HydrophobicContact CZ-SD 3.65Å |
| 132 | R | 85.4 | Confident | 82.8 | Confident | 177 Ų | 177 | 66.1 Ų | 66.1 | 67% | 0.668 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -63.1 | -49 | 178.9 | -170.7 | 174.3 | 69.5 | -175.7 | 0 | 111.1 | W130 L134 S135 W136 | W130-R132 VanDerWaalsContact C-N 3.34Å; W130-R132 PolarHBondContact O-N 3.25Å; R132-L134 VanDerWaalsContact C-N 3.31Å; R132-L134 PolarHBondContact O-N 2.95Å; R132-S135 PolarHBondContact O-N 2.98Å; R132-W136 PolarHBondContact O-N 2.84Å |
| 133 | T | 90.4 | Very high | 83.6 | Confident | 79 Ų | 79 | 67.2 Ų | 67.2 | 49% | 0.485 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.4 | -43.7 | 179.6 | -49.9 | 0 | 0 | 0 | 0 | 111.4 | W130 W136 Y137 | W130-T133 HydrophobicContact CE3-CG2 4.02Å; W130-T133 HydrophobicContact CZ3-CG2 4.18Å; W130-T133 PolarHBondContact O-N 2.95Å; T133-W136 PolarHBondContact O-N 3.24Å; T133-Y137 WeakPolarHBondContact O-CB 3.3Å; T133-Y137 PolarHBondContact O-N 3.1Å |
| 134 | L | 92.4 | Very high | 84.5 | Confident | 18 Ų | 18 | 66.4 Ų | 66.4 | 9% | 0.094 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.3 | -38.1 | 178.9 | -173.8 | 67.5 | 0 | 0 | 0 | 112 | W130 F131 R132 Y137 F138 M186 F187 | W130-L134 WeakPolarHBondContact O-CB 3.47Å; W130-L134 PolarHBondContact O-N 2.89Å; F131-L134 PolarHBondContact O-N 2.88Å; R132-L134 VanDerWaalsContact C-N 3.31Å; R132-L134 PolarHBondContact O-N 2.95Å; L134-Y137 WeakPolarHBondContact O-CB 3.49Å; L134-Y137 PolarHBondContact O-N 3.32Å; L134-F138 HydrophobicContact CD1-CD2 4.27Å; L134-F138 HydrophobicContact CD1-CE2 3.75Å; L134-F138 HydrophobicContact CD1-CZ 4.39Å; L134-F138 HydrophobicContact CD2-CE2 4.11Å; L134-F138 HydrophobicContact CG-CD2 3.98Å; L134-F138 HydrophobicContact CG-CE2 3.64Å; L134-F138 WeakPolarHBondContact O-CD2 3.37Å; L134-F138 PolarHBondContact O-N 3.19Å; L134-M186 HydrophobicContact CD1-CB 4.09Å; L134-F187 HydrophobicContact CD2-CB 3.76Å; L134-F187 HydrophobicContact CD2-CD2 3.71Å; L134-F187 HydrophobicContact CD2-CG 4.2Å |
| 135 | S | 93.8 | Very high | 85.8 | Confident | 1 Ų | 1 | 65.1 Ų | 65.1 | 1% | 0.007 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.4 | -41.7 | 175.9 | -62.1 | 0 | 0 | 0 | 0 | 112.3 | F112 F131 R132 Y137 F138 L139 T206 | F112-S135 WeakPolarHBondContact CZ-O 3.46Å; F131-S135 WeakPolarHBondContact CE2-OG 3.41Å; F131-S135 WeakPolarHBondContact O-CB 3.33Å; F131-S135 PolarHBondContact O-N 3.14Å; F131-S135 PolarHBondContact O-OG 3.28Å; R132-S135 PolarHBondContact O-N 2.98Å; S135-Y137 VanDerWaalsContact C-N 3.34Å; S135-F138 PolarHBondContact O-N 3.48Å; S135-L139 PolarHBondContact O-N 3.33Å; S135-T206 PolarHBondContact OG-OG1 3.47Å |
| 136 | W | 95.3 | Very high | 87.4 | Confident | 93 Ų | 93 | 63 Ų | 63 | 35% | 0.352 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -65.9 | -35.8 | 172.7 | -77.3 | 109.2 | 0 | 0 | 0 | 112.9 | I109 H113 R132 T133 L139 L140 | I109-W136 HydrophobicContact CG2-CH2 3.89Å; I109-W136 HydrophobicContact CG2-CZ3 3.88Å; H113-W136 HydrophobicContact CB-CH2 4.28Å; H113-W136 HydrophobicContact CB-CZ2 4.25Å; H113-W136 AromaticContact CD2-CZ2 3.79Å; R132-W136 PolarHBondContact O-N 2.84Å; T133-W136 PolarHBondContact O-N 3.24Å; W136-L139 HydrophobicContact CE3-CD2 3.55Å; W136-L139 HydrophobicContact CZ3-CD2 3.46Å; W136-L139 VanDerWaalsContact CZ3-CD2 3.46Å; W136-L139 WeakPolarHBondContact O-CB 3.18Å; W136-L139 PolarHBondContact O-N 3.01Å; W136-L140 PolarHBondContact O-N 3.43Å |
| 137 | Y | 96.7 | Very high | 88.7 | Confident | 52 Ų | 52 | 58.6 Ų | 58.6 | 20% | 0.204 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.4 | -50.1 | 173.4 | 179.2 | -92.2 | 0 | 0 | 0 | 111.2 | T133 L134 S135 L139 L140 C141 L179 M186 | T133-Y137 WeakPolarHBondContact O-CB 3.3Å; T133-Y137 PolarHBondContact O-N 3.1Å; L134-Y137 WeakPolarHBondContact O-CB 3.49Å; L134-Y137 PolarHBondContact O-N 3.32Å; S135-Y137 VanDerWaalsContact C-N 3.34Å; Y137-L139 VanDerWaalsContact C-N 3.29Å; Y137-L139 PolarHBondContact O-N 3.31Å; Y137-L140 WeakPolarHBondContact O-CB 3.48Å; Y137-L140 PolarHBondContact O-N 3.09Å; Y137-L140 VanDerWaalsContact O-N 3.1Å; Y137-C141 WeakPolarHBondContact CE1-SG 3.13Å; Y137-C141 VanDerWaalsContact CZ-SG 3.58Å; Y137-C141 PolarHBondContact O-N 3.39Å; Y137-C141 PolarHBondContact O-SG 3.12Å; Y137-L179 WeakPolarHBondContact CE1-O 3.43Å; Y137-L179 PolarHBondContact OH-O 3.5Å; Y137-M186 HydrophobicContact CD1-CE 4.14Å; Y137-M186 HydrophobicContact CD2-CE 4.04Å; Y137-M186 HydrophobicContact CE1-CE 3.8Å; Y137-M186 HydrophobicContact CE2-CE 3.68Å; Y137-M186 HydrophobicContact CG-CE 4.25Å |
| 138 | F | 97.3 | Very high | 89.8 | Confident | 2 Ų | 2 | 52.1 Ų | 52.1 | 1% | 0.009 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.9 | -35.2 | 176.8 | -76.4 | -63.3 | 0 | 0 | 0 | 112.7 | L134 S135 L140 C141 V142 Y180 F203 T206 L210 | L134-F138 HydrophobicContact CD1-CD2 4.27Å; L134-F138 HydrophobicContact CD1-CE2 3.75Å; L134-F138 HydrophobicContact CD1-CZ 4.39Å; L134-F138 HydrophobicContact CD2-CE2 4.11Å; L134-F138 HydrophobicContact CG-CD2 3.98Å; L134-F138 HydrophobicContact CG-CE2 3.64Å; L134-F138 WeakPolarHBondContact O-CD2 3.37Å; L134-F138 PolarHBondContact O-N 3.19Å; S135-F138 PolarHBondContact O-N 3.48Å; F138-L140 VanDerWaalsContact C-N 3.35Å; F138-L140 PolarHBondContact O-N 3.22Å; F138-C141 PolarHBondContact O-N 3.49Å; F138-V142 WeakPolarHBondContact O-CB 3.34Å; F138-V142 WeakPolarHBondContact O-CG2 3.15Å; F138-V142 PolarHBondContact O-N 3.45Å; F138-Y180 HydrophobicContact CD1-CD2 4.16Å; F138-Y180 HydrophobicContact CD1-CE2 4.18Å; F138-Y180 HydrophobicContact CE1-CD2 4.02Å; F138-Y180 AromaticContact CE1-CE2 3.93Å; F138-Y180 HydrophobicContact CE1-CE2 3.93Å; F138-F203 HydrophobicContact CE2-CD2 4.28Å; F138-F203 AromaticContact CE2-CE2 3.79Å; F138-F203 HydrophobicContact CE2-CE2 3.79Å; F138-F203 AromaticContact CZ-CE2 3.73Å; F138-F203 HydrophobicContact CZ-CE2 3.73Å; F138-F203 HydrophobicContact CZ-CZ 4.44Å; F138-T206 HydrophobicContact CB-CG2 4.37Å; F138-L210 HydrophobicContact CB-CD1 3.6Å |
| 139 | L | 96.9 | Very high | 90.5 | Very high | 7 Ų | 7 | 53.7 Ų | 53.7 | 4% | 0.037 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -57.1 | -49.3 | 171.4 | -177.3 | 71 | 0 | 0 | 0 | 110.9 | I109 F112 S135 W136 Y137 C141 V142 N143 L210 V214 | I109-L139 HydrophobicContact CG1-CD2 4.46Å; F112-L139 HydrophobicContact CB-CD1 4.28Å; F112-L139 HydrophobicContact CD1-CB 4.34Å; F112-L139 HydrophobicContact CD1-CD1 4.02Å; F112-L139 HydrophobicContact CD1-CD2 3.66Å; F112-L139 HydrophobicContact CD1-CG 4.21Å; F112-L139 HydrophobicContact CD2-CD1 3.98Å; F112-L139 HydrophobicContact CE1-CB 3.87Å; F112-L139 HydrophobicContact CE1-CD1 4.32Å; F112-L139 HydrophobicContact CE1-CD2 3.96Å; F112-L139 HydrophobicContact CE1-CG 4.26Å; F112-L139 HydrophobicContact CE2-CD1 4.33Å; F112-L139 HydrophobicContact CG-CD1 3.82Å; F112-L139 HydrophobicContact CG-CD2 4.23Å; F112-L139 HydrophobicContact CZ-CB 4.02Å; F112-L139 HydrophobicContact CZ-CD1 4.46Å; S135-L139 PolarHBondContact O-N 3.33Å; W136-L139 HydrophobicContact CE3-CD2 3.55Å; W136-L139 HydrophobicContact CZ3-CD2 3.46Å; W136-L139 VanDerWaalsContact CZ3-CD2 3.46Å; W136-L139 WeakPolarHBondContact O-CB 3.18Å; W136-L139 PolarHBondContact O-N 3.01Å; Y137-L139 VanDerWaalsContact C-N 3.29Å; Y137-L139 PolarHBondContact O-N 3.31Å; L139-C141 PolarHBondContact O-N 3.18Å; L139-V142 PolarHBondContact O-N 3.43Å; L139-N143 VanDerWaalsContact CD1-ND2 3.3Å; L139-N143 WeakPolarHBondContact CD1-ND2 3.47Å; L139-N143 WeakPolarHBondContact CG-ND2 3.31Å; L139-N143 WeakPolarHBondContact O-CB 3.27Å; L139-N143 PolarHBondContact O-N 3.3Å; L139-N143 PolarHBondContact O-ND2 3.11Å; L139-L210 HydrophobicContact CB-CD2 4.06Å; L139-L210 HydrophobicContact CD1-CD2 3.62Å; L139-L210 HydrophobicContact CG-CD2 4.47Å; L139-V214 HydrophobicContact CD1-CG2 3.84Å |
| 140 | L | 96.3 | Very high | 91.3 | Very high | 108 Ų | 108 | 50.5 Ų | 50.5 | 57% | 0.565 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -60.2 | -45.4 | 177.5 | -175.3 | 153.5 | 0 | 0 | 0 | 111.4 | W136 Y137 F138 V142 N143 Y144 | W136-L140 PolarHBondContact O-N 3.43Å; Y137-L140 WeakPolarHBondContact O-CB 3.48Å; Y137-L140 PolarHBondContact O-N 3.09Å; Y137-L140 VanDerWaalsContact O-N 3.1Å; F138-L140 VanDerWaalsContact C-N 3.35Å; F138-L140 PolarHBondContact O-N 3.22Å; L140-V142 PolarHBondContact O-N 3.32Å; L140-N143 PolarHBondContact O-N 3.39Å; L140-Y144 WeakPolarHBondContact O-CB 3.33Å; L140-Y144 PolarHBondContact O-N 2.9Å |
| 141 | C | 96.5 | Very high | 91.6 | Very high | 5 Ų | 5 | 44.2 Ų | 44.2 | 3% | 0.034 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.1 | -46.7 | 179.3 | -62.5 | 0 | 0 | 0 | 0 | 112.7 | Y137 F138 L139 Y144 F145 L179 | Y137-C141 WeakPolarHBondContact CE1-SG 3.13Å; Y137-C141 VanDerWaalsContact CZ-SG 3.58Å; Y137-C141 PolarHBondContact O-N 3.39Å; Y137-C141 PolarHBondContact O-SG 3.12Å; F138-C141 PolarHBondContact O-N 3.49Å; L139-C141 PolarHBondContact O-N 3.18Å; C141-Y144 PolarHBondContact O-N 2.64Å; C141-F145 PolarHBondContact O-N 3.43Å; C141-L179 HydrophobicContact CB-CB 4.5Å |
| 142 | V | 96.3 | Very high | 91.6 | Very high | 26 Ų | 26 | 44.6 Ų | 44.6 | 16% | 0.158 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -71.3 | -38.4 | -178.2 | 177.3 | 0 | 0 | 0 | 0 | 111 | F138 L139 L140 F145 F146 L210 V214 | F138-V142 WeakPolarHBondContact O-CB 3.34Å; F138-V142 WeakPolarHBondContact O-CG2 3.15Å; F138-V142 PolarHBondContact O-N 3.45Å; L139-V142 PolarHBondContact O-N 3.43Å; L140-V142 PolarHBondContact O-N 3.32Å; V142-F145 PolarHBondContact O-N 2.97Å; V142-F146 HydrophobicContact CG1-CD2 3.6Å; V142-F146 HydrophobicContact CG1-CE2 3.64Å; V142-F146 WeakPolarHBondContact O-CD2 3.32Å; V142-F146 PolarHBondContact O-N 3Å; V142-L210 HydrophobicContact CB-CD2 4.5Å; V142-L210 HydrophobicContact CG2-CD1 4.03Å; V142-V214 HydrophobicContact CG1-CB 3.97Å; V142-V214 HydrophobicContact CG1-CG1 3.81Å; V142-V214 HydrophobicContact CG1-CG2 4.23Å |
| 143 | N | 95.6 | Very high | 91.3 | Very high | 28 Ų | 28 | 40.4 Ų | 40.4 | 15% | 0.15 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.4 | -45.8 | 172.5 | -85.1 | -92 | 0 | 0 | 0 | 111.3 | Q108 L139 L140 F145 F146 Y147 | Q108-N143 PolarHBondContact NE2-ND2 2.97Å; Q108-N143 PolarHBondContact NE2-OD1 2.92Å; L139-N143 VanDerWaalsContact CD1-ND2 3.3Å; L139-N143 WeakPolarHBondContact CD1-ND2 3.47Å; L139-N143 WeakPolarHBondContact CG-ND2 3.31Å; L139-N143 WeakPolarHBondContact O-CB 3.27Å; L139-N143 PolarHBondContact O-N 3.3Å; L139-N143 PolarHBondContact O-ND2 3.11Å; L140-N143 PolarHBondContact O-N 3.39Å; N143-F145 VanDerWaalsContact C-N 3.33Å; N143-F145 PolarHBondContact O-N 2.95Å; N143-F146 PolarHBondContact O-N 3.26Å; N143-Y147 HydrophobicContact CB-CD2 4.03Å; N143-Y147 HydrophobicContact CB-CE2 4.47Å; N143-Y147 VanDerWaalsContact O-CB 3.3Å; N143-Y147 WeakPolarHBondContact O-CB 3.38Å; N143-Y147 VanDerWaalsContact O-CD2 3.3Å; N143-Y147 WeakPolarHBondContact O-CD2 3.34Å; N143-Y147 PolarHBondContact O-N 3.43Å; N143-Y147 WeakPolarHBondContact OD1-CD2 3.46Å; N143-Y147 WeakPolarHBondContact OD1-CE2 3.45Å |
| 144 | Y | 94.6 | Very high | 90.7 | Very high | 43 Ų | 43 | 39.1 Ų | 39.1 | 17% | 0.169 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -55.8 | -50.7 | 176.1 | 176.4 | -101.2 | 0 | 0 | 0 | 110.3 | L140 C141 G148 L168 H172 I175 S176 L179 | L140-Y144 WeakPolarHBondContact O-CB 3.33Å; L140-Y144 PolarHBondContact O-N 2.9Å; C141-Y144 PolarHBondContact O-N 2.64Å; Y144-G148 VanDerWaalsContact O-CA 3.32Å; Y144-G148 WeakPolarHBondContact O-CA 3.44Å; Y144-G148 PolarHBondContact O-N 2.89Å; Y144-L168 HydrophobicContact CE2-CD1 3.76Å; Y144-L168 HydrophobicContact CE2-CD2 3.97Å; Y144-L168 HydrophobicContact CE2-CG 3.84Å; Y144-L168 WeakPolarHBondContact OH-CD1 3.22Å; Y144-L168 VanDerWaalsContact OH-CG 3.29Å; Y144-L168 WeakPolarHBondContact OH-CG 3.45Å; Y144-L168 PolarHBondContact OH-O 2.92Å; Y144-H172 AromaticContact CD1-CE1 3.84Å; Y144-H172 AromaticContact CE1-CE1 3.58Å; Y144-H172 AromaticContact CE1-ND1 3.34Å; Y144-H172 VanDerWaalsContact CE1-ND1 3.34Å; Y144-H172 WeakPolarHBondContact CE1-ND1 3.38Å; Y144-H172 AromaticContact CZ-CE1 3.91Å; Y144-H172 AromaticContact CZ-ND1 3.36Å; Y144-H172 PolarHBondContact O-CE1 3.33Å; Y144-H172 PolarHBondContact OH-ND1 3.3Å; Y144-I175 HydrophobicContact CE1-CB 4.1Å; Y144-I175 HydrophobicContact CE1-CG2 3.69Å; Y144-S176 VanDerWaalsContact CD1-OG 3.26Å; Y144-S176 WeakPolarHBondContact CD1-OG 3.47Å; Y144-S176 VanDerWaalsContact CE1-OG 3.22Å; Y144-S176 WeakPolarHBondContact CE1-OG 3.4Å; Y144-L179 HydrophobicContact CD1-CD1 3.95Å; Y144-L179 HydrophobicContact CE1-CD1 4.33Å; Y144-L179 HydrophobicContact CG-CD1 4.4Å |
| 145 | F | 94.9 | Very high | 90 | Very high | 77 Ų | 77 | 39 Ų | 39 | 34% | 0.338 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -55 | -56.5 | 179.3 | 178.7 | -103.6 | 0 | 0 | 0 | 113.1 | C141 V142 N143 H172 | C141-F145 PolarHBondContact O-N 3.43Å; V142-F145 PolarHBondContact O-N 2.97Å; N143-F145 VanDerWaalsContact C-N 3.33Å; N143-F145 PolarHBondContact O-N 2.95Å; F145-H172 PolarHBondContact O-NE2 3Å |
| 146 | F | 93.3 | Very high | 89.2 | Confident | 44 Ų | 44 | 44 Ų | 44 | 19% | 0.193 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -70.6 | -48.9 | -175.8 | -79.9 | -70.9 | 0 | 0 | 0 | 112.8 | V142 N143 T150 V214 H218 | V142-F146 HydrophobicContact CG1-CD2 3.6Å; V142-F146 HydrophobicContact CG1-CE2 3.64Å; V142-F146 WeakPolarHBondContact O-CD2 3.32Å; V142-F146 PolarHBondContact O-N 3Å; N143-F146 PolarHBondContact O-N 3.26Å; F146-T150 PolarHBondContact O-N 2.89Å; F146-T150 PolarHBondContact O-OG1 3.3Å; F146-V214 HydrophobicContact CD2-CG1 4.07Å; F146-H218 HydrophobicContact CB-CB 4.24Å; F146-H218 HydrophobicContact CD1-CB 4.35Å; F146-H218 AromaticContact CD1-CD2 3.64Å; F146-H218 AromaticContact CD1-CG 3.8Å; F146-H218 AromaticContact CD1-NE2 3.79Å; F146-H218 HydrophobicContact CG-CB 4.39Å; F146-H218 PolarHBondContact O-CE1 3.35Å |
| 147 | Y | 90.4 | Very high | 88.1 | Confident | 19 Ų | 19 | 42.2 Ų | 42.2 | 8% | 0.075 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -77.6 | -25 | -176.2 | -66.2 | -66.1 | 0 | 0 | 0 | 113 | L105 Q108 N143 T150 V151 V214 S217 H218 I221 | L105-Y147 HydrophobicContact CD2-CD1 4.29Å; L105-Y147 HydrophobicContact CD2-CD2 3.97Å; L105-Y147 HydrophobicContact CD2-CE1 3.76Å; L105-Y147 HydrophobicContact CD2-CE2 3.38Å; L105-Y147 HydrophobicContact CD2-CG 4.39Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.35Å; Q108-Y147 PolarHBondContact OE1-OH 3.33Å; N143-Y147 HydrophobicContact CB-CD2 4.03Å; N143-Y147 HydrophobicContact CB-CE2 4.47Å; N143-Y147 VanDerWaalsContact O-CB 3.3Å; N143-Y147 WeakPolarHBondContact O-CB 3.38Å; N143-Y147 VanDerWaalsContact O-CD2 3.3Å; N143-Y147 WeakPolarHBondContact O-CD2 3.34Å; N143-Y147 PolarHBondContact O-N 3.43Å; N143-Y147 WeakPolarHBondContact OD1-CD2 3.46Å; N143-Y147 WeakPolarHBondContact OD1-CE2 3.45Å; Y147-T150 PolarHBondContact O-N 3.48Å; Y147-V151 WeakPolarHBondContact O-CB 3.38Å; Y147-V151 WeakPolarHBondContact O-CG2 3.25Å; Y147-V151 PolarHBondContact O-N 3.3Å; Y147-V214 HydrophobicContact CE2-CG1 4.4Å; Y147-S217 WeakPolarHBondContact OH-CB 3.35Å; Y147-S217 PolarHBondContact OH-OG 3.4Å; Y147-H218 HydrophobicContact CE1-CB 4.49Å; Y147-H218 PolarHBondContact OH-N 3.48Å; Y147-I221 HydrophobicContact CD1-CD1 4.38Å; Y147-I221 HydrophobicContact CE1-CB 4.46Å; Y147-I221 HydrophobicContact CE1-CD1 3.38Å; Y147-I221 HydrophobicContact CE1-CG1 4.47Å |
| 148 | G | 87.2 | Confident | 87.1 | Confident | 16 Ų | 16 | 42.5 Ų | 42.5 | 17% | 0.165 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64.4 | -38.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y144 T152 | Y144-G148 VanDerWaalsContact O-CA 3.32Å; Y144-G148 WeakPolarHBondContact O-CA 3.44Å; Y144-G148 PolarHBondContact O-N 2.89Å; G148-T152 WeakPolarHBondContact O-CB 3.37Å; G148-T152 PolarHBondContact O-N 3.43Å; G148-T152 PolarHBondContact O-OG1 2.91Å |
| 149 | E | 83.8 | Confident | 86.2 | Confident | 58 Ų | 58 | 42.6 Ų | 42.6 | 27% | 0.271 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -67.6 | -48.2 | 172.3 | -69.6 | -162.9 | 151.3 | 0 | 0 | 110.9 | V151 T152 D153 R173 | E149-V151 VanDerWaalsContact C-N 3.33Å; E149-V151 PolarHBondContact O-N 3.45Å; E149-T152 PolarHBondContact O-N 3.35Å; E149-T152 VanDerWaalsContact O-N 3.13Å; E149-D153 WeakPolarHBondContact O-CB 3.5Å; E149-D153 PolarHBondContact O-N 3.48Å; E149-R173 IonicContact OE1-CZ 3.98Å; E149-R173 IonicContact OE1-NE 2.68Å; E149-R173 PolarHBondContact OE1-NE 3.38Å; E149-R173 VanDerWaalsContact OE1-NE 3.14Å; E149-R173 IonicContact OE1-NH2 2.63Å; E149-R173 PolarHBondContact OE1-NH2 3.47Å |
| 150 | T | 84.4 | Confident | 85.3 | Confident | 1 Ų | 1 | 46 Ų | 46 | 1% | 0.006 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -57 | -45.1 | 176 | -54.6 | 0 | 0 | 0 | 0 | 112.1 | F146 Y147 T152 D153 Y154 H218 I221 H222 F225 | F146-T150 PolarHBondContact O-N 2.89Å; F146-T150 PolarHBondContact O-OG1 3.3Å; Y147-T150 PolarHBondContact O-N 3.48Å; T150-T152 VanDerWaalsContact C-N 3.33Å; T150-T152 PolarHBondContact O-N 2.68Å; T150-D153 PolarHBondContact O-N 3.1Å; T150-Y154 HydrophobicContact CG2-CD2 3.65Å; T150-Y154 HydrophobicContact CG2-CE2 3.94Å; T150-Y154 WeakPolarHBondContact O-CD2 3.36Å; T150-Y154 PolarHBondContact O-N 3.39Å; T150-H218 PolarHBondContact OG1-CE1 2.89Å; T150-H218 PolarHBondContact OG1-ND1 3.26Å; T150-I221 HydrophobicContact CG2-CG2 4.33Å; T150-H222 PolarHBondContact OG1-NE2 2.78Å; T150-F225 HydrophobicContact CG2-CD2 4.05Å; T150-F225 HydrophobicContact CG2-CE2 3.78Å |
| 151 | V | 82.5 | Confident | 84.5 | Confident | 52 Ų | 52 | 48.7 Ų | 48.7 | 32% | 0.315 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.6 | -43.8 | 178.2 | 169.1 | 0 | 0 | 0 | 0 | 110 | Y147 E149 D153 F155 V159 | Y147-V151 WeakPolarHBondContact O-CB 3.38Å; Y147-V151 WeakPolarHBondContact O-CG2 3.25Å; Y147-V151 PolarHBondContact O-N 3.3Å; E149-V151 VanDerWaalsContact C-N 3.33Å; E149-V151 PolarHBondContact O-N 3.45Å; V151-D153 VanDerWaalsContact C-N 3.3Å; V151-D153 PolarHBondContact O-N 3.4Å; V151-F155 HydrophobicContact CB-CD2 4.38Å; V151-F155 HydrophobicContact CG1-CB 4.21Å; V151-F155 HydrophobicContact CG1-CD2 4.29Å; V151-F155 HydrophobicContact CG1-CG 4.41Å; V151-F155 VanDerWaalsContact O-CA 3.25Å; V151-F155 WeakPolarHBondContact O-CA 3.47Å; V151-F155 WeakPolarHBondContact O-CB 3.45Å; V151-F155 WeakPolarHBondContact O-CD2 3.46Å; V151-F155 PolarHBondContact O-N 3.03Å; V151-V159 HydrophobicContact CG1-CG2 3.95Å |
| 152 | T | 80.6 | Confident | 83.8 | Confident | 31 Ų | 31 | 52.8 Ų | 52.8 | 19% | 0.19 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.4 | -37 | 178.7 | -61.6 | 0 | 0 | 0 | 0 | 112 | G148 E149 T150 F156 S169 | G148-T152 WeakPolarHBondContact O-CB 3.37Å; G148-T152 PolarHBondContact O-N 3.43Å; G148-T152 PolarHBondContact O-OG1 2.91Å; E149-T152 PolarHBondContact O-N 3.35Å; E149-T152 VanDerWaalsContact O-N 3.13Å; T150-T152 VanDerWaalsContact C-N 3.33Å; T150-T152 PolarHBondContact O-N 2.68Å; T152-F156 WeakPolarHBondContact O-CA 3.26Å; T152-F156 WeakPolarHBondContact O-CB 3.35Å; T152-F156 PolarHBondContact O-N 3.15Å; T152-S169 WeakPolarHBondContact CG2-OG 3.49Å; T152-S169 PolarHBondContact OG1-OG 3.33Å |
| 153 | D | 77.8 | Confident | 83.2 | Confident | 88 Ų | 88 | 56.3 Ų | 56.3 | 47% | 0.471 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -72.3 | -45.2 | -178.8 | -95.3 | 32.7 | 0 | 0 | 0 | 113.3 | E149 T150 V151 K414 | E149-D153 WeakPolarHBondContact O-CB 3.5Å; E149-D153 PolarHBondContact O-N 3.48Å; T150-D153 PolarHBondContact O-N 3.1Å; V151-D153 VanDerWaalsContact C-N 3.3Å; V151-D153 PolarHBondContact O-N 3.4Å; D153-K414 IonicContact OD2-NZ 3.64Å; D153-K414 PolarHBondContact OD2-NZ 3.48Å |
| 154 | Y | 77.4 | Confident | 82.7 | Confident | 53 Ų | 53 | 59.2 Ų | 59.2 | 21% | 0.208 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -92.3 | -19.3 | -177.2 | -69.2 | -82.8 | 0 | 0 | 0 | 113.4 | T150 H222 F225 E226 | T150-Y154 HydrophobicContact CG2-CD2 3.65Å; T150-Y154 HydrophobicContact CG2-CE2 3.94Å; T150-Y154 WeakPolarHBondContact O-CD2 3.36Å; T150-Y154 PolarHBondContact O-N 3.39Å; Y154-H222 AromaticContact CE2-CE1 3.6Å; Y154-H222 AromaticContact CE2-ND1 3.62Å; Y154-H222 AromaticContact CZ-ND1 3.91Å; Y154-H222 PolarHBondContact OH-ND1 3.11Å; Y154-F225 HydrophobicContact CD1-CB 3.94Å; Y154-F225 HydrophobicContact CD1-CD2 4.34Å; Y154-F225 HydrophobicContact CD1-CG 4.23Å; Y154-F225 AromaticContact CD2-CD2 3.72Å; Y154-F225 HydrophobicContact CD2-CD2 3.72Å; Y154-F225 HydrophobicContact CD2-CE2 4.24Å; Y154-F225 HydrophobicContact CD2-CG 4.4Å; Y154-F225 HydrophobicContact CE1-CB 3.47Å; Y154-F225 VanDerWaalsContact CE1-CB 3.47Å; Y154-F225 HydrophobicContact CE1-CD2 4.4Å; Y154-F225 HydrophobicContact CE1-CG 4.21Å; Y154-F225 HydrophobicContact CE2-CB 4.14Å; Y154-F225 AromaticContact CE2-CD2 3.77Å; Y154-F225 HydrophobicContact CE2-CD2 3.77Å; Y154-F225 HydrophobicContact CE2-CG 4.37Å; Y154-F225 HydrophobicContact CG-CB 4.46Å; Y154-F225 HydrophobicContact CG-CD2 4.02Å; Y154-F225 HydrophobicContact CG-CG 4.34Å; Y154-E226 PolarHBondContact OH-OE1 3.11Å; Y154-E226 VanDerWaalsContact OH-OE1 3.04Å |
| 155 | F | 78.5 | Confident | 82.2 | Confident | 16 Ų | 16 | 60.5 Ų | 60.5 | 7% | 0.07 | 30% | 0.298 | C | S | . | . | trans | -122.4 | 29.4 | -174.5 | -54.8 | -104.8 | 0 | 0 | 0 | 112.9 | M98 V151 T157 L158 V159 F225 F306 | M98-F155 HydrophobicContact CE-CZ 4.31Å; M98-F155 HydrophobicContact SD-CZ 4.39Å; V151-F155 HydrophobicContact CB-CD2 4.38Å; V151-F155 HydrophobicContact CG1-CB 4.21Å; V151-F155 HydrophobicContact CG1-CD2 4.29Å; V151-F155 HydrophobicContact CG1-CG 4.41Å; V151-F155 VanDerWaalsContact O-CA 3.25Å; V151-F155 WeakPolarHBondContact O-CA 3.47Å; V151-F155 WeakPolarHBondContact O-CB 3.45Å; V151-F155 WeakPolarHBondContact O-CD2 3.46Å; V151-F155 PolarHBondContact O-N 3.03Å; F155-T157 VanDerWaalsContact C-N 3.25Å; F155-T157 PolarHBondContact O-N 3.04Å; F155-T157 VanDerWaalsContact O-N 3.15Å; F155-L158 HydrophobicContact CB-CB 4.25Å; F155-L158 HydrophobicContact CB-CD2 4.48Å; F155-L158 HydrophobicContact CD1-CD2 4Å; F155-L158 PolarHBondContact O-N 2.81Å; F155-L158 VanDerWaalsContact O-N 3.11Å; F155-V159 HydrophobicContact CB-CG2 4.4Å; F155-V159 WeakPolarHBondContact O-CG2 3.32Å; F155-V159 PolarHBondContact O-N 3.42Å; F155-F225 HydrophobicContact CE2-CZ 4.15Å; F155-F225 HydrophobicContact CZ-CZ 4.34Å; F155-F306 HydrophobicContact CD1-CE1 4.17Å; F155-F306 HydrophobicContact CD1-CZ 4.38Å; F155-F306 HydrophobicContact CE1-CD1 4.47Å; F155-F306 AromaticContact CE1-CE1 3.18Å; F155-F306 HydrophobicContact CE1-CE1 3.18Å; F155-F306 AromaticContact CE1-CZ 3.35Å; F155-F306 HydrophobicContact CE1-CZ 3.35Å; F155-F306 AromaticContact CZ-CE1 3.57Å; F155-F306 HydrophobicContact CZ-CE1 3.57Å; F155-F306 AromaticContact CZ-CZ 3.93Å; F155-F306 HydrophobicContact CZ-CZ 3.93Å | ||
| 156 | F | 76 | Confident | 81.7 | Confident | 104 Ų | 104 | 61.1 Ų | 61.1 | 46% | 0.456 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -49.3 | -46.2 | -175.6 | -179.4 | -100.8 | 0 | 0 | 0 | 112.9 | T152 V159 Q160 | T152-F156 WeakPolarHBondContact O-CA 3.26Å; T152-F156 WeakPolarHBondContact O-CB 3.35Å; T152-F156 PolarHBondContact O-N 3.15Å; F156-V159 PolarHBondContact O-N 3.07Å; F156-Q160 HydrophobicContact CD1-CG 4.21Å; F156-Q160 HydrophobicContact CD2-CG 4.39Å; F156-Q160 HydrophobicContact CE1-CG 3.8Å; F156-Q160 HydrophobicContact CE2-CG 4.01Å; F156-Q160 HydrophobicContact CG-CG 4.49Å; F156-Q160 HydrophobicContact CZ-CG 3.69Å; F156-Q160 VanDerWaalsContact O-CG 3.28Å; F156-Q160 WeakPolarHBondContact O-CG 3.41Å; F156-Q160 PolarHBondContact O-N 2.87Å |
| 157 | T | 72.8 | Confident | 81.3 | Confident | 57 Ų | 57 | 63.5 Ų | 63.5 | 35% | 0.35 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -66.4 | -41.8 | -177.8 | 55.3 | 0 | 0 | 0 | 0 | 112.7 | F155 Q160 R161 N301 | F155-T157 VanDerWaalsContact C-N 3.25Å; F155-T157 PolarHBondContact O-N 3.04Å; F155-T157 VanDerWaalsContact O-N 3.15Å; T157-Q160 PolarHBondContact O-N 3.06Å; T157-R161 PolarHBondContact O-N 3.36Å; T157-N301 WeakPolarHBondContact CB-OD1 3.39Å; T157-N301 PolarHBondContact OG1-OD1 2.92Å |
| 158 | L | 75.1 | Confident | 81.2 | Confident | 57 Ų | 57 | 66 Ų | 66 | 30% | 0.298 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.2 | -43.2 | 175.3 | -178.8 | 66.9 | 0 | 0 | 0 | 111 | F155 R161 F299 | F155-L158 HydrophobicContact CB-CB 4.25Å; F155-L158 HydrophobicContact CB-CD2 4.48Å; F155-L158 HydrophobicContact CD1-CD2 4Å; F155-L158 PolarHBondContact O-N 2.81Å; F155-L158 VanDerWaalsContact O-N 3.11Å; L158-R161 PolarHBondContact O-N 3.15Å; L158-F299 HydrophobicContact CB-CE1 4.26Å; L158-F299 HydrophobicContact CD1-CE1 4.48Å; L158-F299 HydrophobicContact CD1-CZ 4.17Å |
| 159 | V | 80.1 | Confident | 81.2 | Confident | 4 Ų | 4 | 66.5 Ų | 66.5 | 2% | 0.024 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -66.6 | -36.8 | 179.7 | 171.2 | 0 | 0 | 0 | 0 | 111.9 | V151 F155 F156 R161 L165 R166 | V151-V159 HydrophobicContact CG1-CG2 3.95Å; F155-V159 HydrophobicContact CB-CG2 4.4Å; F155-V159 WeakPolarHBondContact O-CG2 3.32Å; F155-V159 PolarHBondContact O-N 3.42Å; F156-V159 PolarHBondContact O-N 3.07Å; V159-R161 VanDerWaalsContact C-N 3.32Å; V159-L165 HydrophobicContact CG1-CB 4.32Å; V159-R166 PolarHBondContact O-N 3.36Å |
| 160 | Q | 77.7 | Confident | 81.4 | Confident | 80 Ų | 80 | 71 Ų | 71 | 37% | 0.374 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -72.2 | -25.2 | 178 | -70.7 | -63.6 | -27.3 | 0 | 0 | 113.4 | F156 T157 | F156-Q160 HydrophobicContact CD1-CG 4.21Å; F156-Q160 HydrophobicContact CD2-CG 4.39Å; F156-Q160 HydrophobicContact CE1-CG 3.8Å; F156-Q160 HydrophobicContact CE2-CG 4.01Å; F156-Q160 HydrophobicContact CG-CG 4.49Å; F156-Q160 HydrophobicContact CZ-CG 3.69Å; F156-Q160 VanDerWaalsContact O-CG 3.28Å; F156-Q160 WeakPolarHBondContact O-CG 3.41Å; F156-Q160 PolarHBondContact O-N 2.87Å; T157-Q160 PolarHBondContact O-N 3.06Å |
| 161 | R | 79.1 | Confident | 81.7 | Confident | 164 Ų | 164 | 76.6 Ų | 76.6 | 62% | 0.619 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -73 | -38.1 | -179.7 | -175.1 | 178.2 | 176.2 | 157.9 | 3.8 | 112.6 | T157 L158 V159 | T157-R161 PolarHBondContact O-N 3.36Å; L158-R161 PolarHBondContact O-N 3.15Å; V159-R161 VanDerWaalsContact C-N 3.32Å |
| 162 | E | 81.8 | Confident | 82.1 | Confident | 90 Ų | 90 | 74.7 Ų | 74.7 | 42% | 0.421 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -95.9 | 113 | -176.3 | -66 | -63.2 | 153.1 | 0 | 0 | 111 | P164 L165 R166 | E162-P164 VanDerWaalsContact C-CD 3.45Å; E162-L165 HydrophobicContact CB-CB 4.03Å; E162-L165 HydrophobicContact CB-CD1 3.85Å; E162-L165 HydrophobicContact CB-CG 4Å; E162-L165 HydrophobicContact CG-CD1 4.12Å; E162-L165 PolarHBondContact O-N 2.98Å; E162-L165 VanDerWaalsContact O-N 3.09Å; E162-R166 PolarHBondContact O-N 3.27Å |
| 163 | E | 84.1 | Confident | 82.7 | Confident | 101 Ų | 101 | 82 Ų | 82 | 47% | 0.472 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -44 | -49.9 | 176.5 | -75.5 | -67.1 | 151.8 | 0 | 0 | 114.8 | L165 R166 I167 | E163-L165 PolarHBondContact O-N 3.46Å; E163-R166 PolarHBondContact O-N 2.91Å; E163-R166 IonicContact OE1-CZ 2.91Å; E163-R166 IonicContact OE1-NH1 2.7Å; E163-R166 PolarHBondContact OE1-NH1 3.43Å; E163-R166 IonicContact OE1-NH2 2.88Å; E163-R166 PolarHBondContact OE1-NH2 3.03Å; E163-R166 IonicContact OE2-CZ 3.55Å; E163-R166 IonicContact OE2-NE 3.52Å; E163-R166 IonicContact OE2-NH1 3.5Å; E163-R166 IonicContact OE2-NH2 3.98Å; E163-R166 PolarHBondContact OE2-NH2 3.48Å; E163-I167 PolarHBondContact O-N 3.35Å |
| 164 | P | 85.5 | Confident | 83.5 | Confident | 89 Ų | 89 | 84.6 Ų | 84.6 | 58% | 0.578 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -67 | -38 | -179.2 | 26.1 | -34.6 | 0 | 0 | 0 | 112.9 | E162 I167 L168 | E162-P164 VanDerWaalsContact C-CD 3.45Å; P164-I167 PolarHBondContact O-N 2.88Å; P164-L168 WeakPolarHBondContact O-CB 3.35Å; P164-L168 PolarHBondContact O-N 2.97Å; P164-L168 VanDerWaalsContact O-N 3.16Å |
| 165 | L | 83.8 | Confident | 84.4 | Confident | 70 Ų | 70 | 84.4 Ų | 84.4 | 37% | 0.366 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -70.1 | -35.2 | 178.9 | -65.8 | 179.2 | 0 | 0 | 0 | 111.2 | V159 E162 E163 I167 L168 S169 | V159-L165 HydrophobicContact CG1-CB 4.32Å; E162-L165 HydrophobicContact CB-CB 4.03Å; E162-L165 HydrophobicContact CB-CD1 3.85Å; E162-L165 HydrophobicContact CB-CG 4Å; E162-L165 HydrophobicContact CG-CD1 4.12Å; E162-L165 PolarHBondContact O-N 2.98Å; E162-L165 VanDerWaalsContact O-N 3.09Å; E163-L165 PolarHBondContact O-N 3.46Å; L165-I167 PolarHBondContact O-N 3.32Å; L165-L168 PolarHBondContact O-N 3.31Å; L165-S169 VanDerWaalsContact O-CB 3.31Å; L165-S169 WeakPolarHBondContact O-CB 3.33Å; L165-S169 PolarHBondContact O-N 3.48Å |
| 166 | R | 83.1 | Confident | 85.2 | Confident | 89 Ų | 89 | 84.1 Ų | 84.1 | 34% | 0.336 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.9 | -43 | 176.3 | -168.5 | 175.3 | 71.2 | -155.6 | 5.6 | 112.1 | V159 E162 E163 K170 | V159-R166 PolarHBondContact O-N 3.36Å; E162-R166 PolarHBondContact O-N 3.27Å; E163-R166 PolarHBondContact O-N 2.91Å; E163-R166 IonicContact OE1-CZ 2.91Å; E163-R166 IonicContact OE1-NH1 2.7Å; E163-R166 PolarHBondContact OE1-NH1 3.43Å; E163-R166 IonicContact OE1-NH2 2.88Å; E163-R166 PolarHBondContact OE1-NH2 3.03Å; E163-R166 IonicContact OE2-CZ 3.55Å; E163-R166 IonicContact OE2-NE 3.52Å; E163-R166 IonicContact OE2-NH1 3.5Å; E163-R166 IonicContact OE2-NH2 3.98Å; E163-R166 PolarHBondContact OE2-NH2 3.48Å; R166-K170 WeakPolarHBondContact O-CB 3.19Å; R166-K170 PolarHBondContact O-N 3.22Å |
| 167 | I | 86.7 | Confident | 86.2 | Confident | 95 Ų | 95 | 85.4 Ų | 85.4 | 49% | 0.487 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -65.1 | -46 | 176.2 | -64.7 | 170.7 | 0 | 0 | 0 | 110.2 | E163 P164 L165 S169 K170 Y171 | E163-I167 PolarHBondContact O-N 3.35Å; P164-I167 PolarHBondContact O-N 2.88Å; L165-I167 PolarHBondContact O-N 3.32Å; I167-S169 PolarHBondContact O-N 3.1Å; I167-K170 PolarHBondContact O-N 3.47Å; I167-Y171 HydrophobicContact CG2-CD2 4.06Å; I167-Y171 HydrophobicContact CG2-CE2 4.46Å; I167-Y171 WeakPolarHBondContact O-CD2 3.19Å; I167-Y171 PolarHBondContact O-N 3.22Å; I167-Y171 VanDerWaalsContact O-N 3.09Å |
| 168 | L | 88.1 | Confident | 87.4 | Confident | 72 Ų | 72 | 84.4 Ų | 84.4 | 38% | 0.377 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60 | -45.5 | -179.7 | -166.2 | 69.1 | 0 | 0 | 0 | 111.8 | Y144 P164 L165 H172 I175 | Y144-L168 HydrophobicContact CE2-CD1 3.76Å; Y144-L168 HydrophobicContact CE2-CD2 3.97Å; Y144-L168 HydrophobicContact CE2-CG 3.84Å; Y144-L168 WeakPolarHBondContact OH-CD1 3.22Å; Y144-L168 VanDerWaalsContact OH-CG 3.29Å; Y144-L168 WeakPolarHBondContact OH-CG 3.45Å; Y144-L168 PolarHBondContact OH-O 2.92Å; P164-L168 WeakPolarHBondContact O-CB 3.35Å; P164-L168 PolarHBondContact O-N 2.97Å; P164-L168 VanDerWaalsContact O-N 3.16Å; L165-L168 PolarHBondContact O-N 3.31Å; L168-H172 WeakPolarHBondContact O-CA 3.24Å; L168-H172 WeakPolarHBondContact O-CB 3.25Å; L168-H172 PolarHBondContact O-N 3.39Å; L168-I175 HydrophobicContact CD1-CD1 4.02Å |
| 169 | S | 87.3 | Confident | 88.4 | Confident | 25 Ų | 25 | 84 Ų | 84 | 18% | 0.175 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -67.1 | -44.8 | 176.9 | 177.3 | 0 | 0 | 0 | 0 | 112.3 | T152 L165 I167 Y171 H172 | T152-S169 WeakPolarHBondContact CG2-OG 3.49Å; T152-S169 PolarHBondContact OG1-OG 3.33Å; L165-S169 VanDerWaalsContact O-CB 3.31Å; L165-S169 WeakPolarHBondContact O-CB 3.33Å; L165-S169 PolarHBondContact O-N 3.48Å; I167-S169 PolarHBondContact O-N 3.1Å; S169-Y171 VanDerWaalsContact C-N 3.34Å; S169-Y171 PolarHBondContact O-N 2.93Å; S169-H172 WeakPolarHBondContact O-CB 3.27Å; S169-H172 PolarHBondContact O-N 3.43Å |
| 170 | K | 86.5 | Confident | 89.2 | Confident | 154 Ų | 154 | 88.2 Ų | 88.2 | 67% | 0.67 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -59.8 | -41.9 | 179.7 | -177.4 | 179.6 | -179.7 | -174.5 | 0 | 112.8 | R166 I167 | R166-K170 WeakPolarHBondContact O-CB 3.19Å; R166-K170 PolarHBondContact O-N 3.22Å; I167-K170 PolarHBondContact O-N 3.47Å |
| 171 | Y | 90.9 | Very high | 90.2 | Very high | 117 Ų | 117 | 88.2 Ų | 88.2 | 46% | 0.459 | 41% | 0.408 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101 | 16.6 | -179.8 | -61.6 | -74 | 0 | 0 | 0 | 112.8 | I167 S169 R173 F174 I175 | I167-Y171 HydrophobicContact CG2-CD2 4.06Å; I167-Y171 HydrophobicContact CG2-CE2 4.46Å; I167-Y171 WeakPolarHBondContact O-CD2 3.19Å; I167-Y171 PolarHBondContact O-N 3.22Å; I167-Y171 VanDerWaalsContact O-N 3.09Å; S169-Y171 VanDerWaalsContact C-N 3.34Å; S169-Y171 PolarHBondContact O-N 2.93Å; Y171-R173 PolarHBondContact O-N 2.79Å; Y171-F174 PolarHBondContact O-N 3.48Å; Y171-F174 VanDerWaalsContact O-N 3.07Å; Y171-I175 WeakPolarHBondContact O-CG1 3.47Å; Y171-I175 PolarHBondContact O-N 2.92Å |
| 172 | H | 92.2 | Very high | 91 | Very high | 12 Ų | 12 | 83.8 Ų | 83.8 | 6% | 0.056 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -49.8 | -52.3 | -170.9 | 177.6 | 53 | 0 | 0 | 0 | 113.8 | Y144 F145 L168 S169 F174 I175 S176 | Y144-H172 AromaticContact CD1-CE1 3.84Å; Y144-H172 AromaticContact CE1-CE1 3.58Å; Y144-H172 AromaticContact CE1-ND1 3.34Å; Y144-H172 VanDerWaalsContact CE1-ND1 3.34Å; Y144-H172 WeakPolarHBondContact CE1-ND1 3.38Å; Y144-H172 AromaticContact CZ-CE1 3.91Å; Y144-H172 AromaticContact CZ-ND1 3.36Å; Y144-H172 PolarHBondContact O-CE1 3.33Å; Y144-H172 PolarHBondContact OH-ND1 3.3Å; F145-H172 PolarHBondContact O-NE2 3Å; L168-H172 WeakPolarHBondContact O-CA 3.24Å; L168-H172 WeakPolarHBondContact O-CB 3.25Å; L168-H172 PolarHBondContact O-N 3.39Å; S169-H172 WeakPolarHBondContact O-CB 3.27Å; S169-H172 PolarHBondContact O-N 3.43Å; H172-F174 PolarHBondContact O-N 3.4Å; H172-I175 PolarHBondContact O-N 2.86Å; H172-S176 PolarHBondContact CE1-OG 2.79Å; H172-S176 WeakPolarHBondContact O-CB 3.31Å; H172-S176 PolarHBondContact O-N 3.41Å; H172-S176 PolarHBondContact O-OG 2.92Å |
| 173 | R | 92.7 | Very high | 91.7 | Very high | 184 Ų | 184 | 79.5 Ų | 79.5 | 69% | 0.694 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -64.5 | -40.1 | -178.7 | -68.3 | -177 | 174.5 | 170.8 | 0.3 | 112.5 | E149 Y171 F177 | E149-R173 IonicContact OE1-CZ 3.98Å; E149-R173 IonicContact OE1-NE 2.68Å; E149-R173 PolarHBondContact OE1-NE 3.38Å; E149-R173 VanDerWaalsContact OE1-NE 3.14Å; E149-R173 IonicContact OE1-NH2 2.63Å; E149-R173 PolarHBondContact OE1-NH2 3.47Å; Y171-R173 PolarHBondContact O-N 2.79Å; R173-F177 WeakPolarHBondContact O-CB 3.43Å; R173-F177 PolarHBondContact O-N 3.01Å |
| 174 | F | 95.3 | Very high | 92.3 | Very high | 144 Ų | 144 | 78.9 Ų | 78.9 | 63% | 0.632 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -69.3 | -44.4 | 178.8 | -177.2 | -99.2 | 0 | 0 | 0 | 111.5 | Y171 H172 S176 F177 A178 | Y171-F174 PolarHBondContact O-N 3.48Å; Y171-F174 VanDerWaalsContact O-N 3.07Å; H172-F174 PolarHBondContact O-N 3.4Å; F174-S176 VanDerWaalsContact C-N 3.34Å; F174-S176 PolarHBondContact O-N 3.27Å; F174-F177 PolarHBondContact O-N 3.29Å; F174-A178 WeakPolarHBondContact O-CB 3.44Å; F174-A178 PolarHBondContact O-N 3.15Å |
| 175 | I | 95.3 | Very high | 92.8 | Very high | 49 Ų | 49 | 77.6 Ų | 77.6 | 25% | 0.251 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61 | -45 | 175.5 | -66 | 170 | 0 | 0 | 0 | 110.1 | Y144 L168 Y171 H172 F177 A178 L179 | Y144-I175 HydrophobicContact CE1-CB 4.1Å; Y144-I175 HydrophobicContact CE1-CG2 3.69Å; L168-I175 HydrophobicContact CD1-CD1 4.02Å; Y171-I175 WeakPolarHBondContact O-CG1 3.47Å; Y171-I175 PolarHBondContact O-N 2.92Å; H172-I175 PolarHBondContact O-N 2.86Å; I175-F177 VanDerWaalsContact C-N 3.34Å; I175-F177 PolarHBondContact O-N 2.97Å; I175-A178 PolarHBondContact O-N 2.99Å; I175-L179 HydrophobicContact CG2-CD1 3.93Å; I175-L179 HydrophobicContact CG2-CG 4.26Å; I175-L179 WeakPolarHBondContact O-CB 3.44Å; I175-L179 VanDerWaalsContact O-CG 3.3Å; I175-L179 WeakPolarHBondContact O-CG 3.4Å; I175-L179 PolarHBondContact O-N 2.95Å |
| 176 | S | 95.8 | Very high | 93.3 | Very high | 10 Ų | 10 | 78.1 Ų | 78.1 | 7% | 0.07 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -59 | -45.2 | 177 | -61.5 | 0 | 0 | 0 | 0 | 111.9 | Y144 H172 F174 L179 Y180 | Y144-S176 VanDerWaalsContact CD1-OG 3.26Å; Y144-S176 WeakPolarHBondContact CD1-OG 3.47Å; Y144-S176 VanDerWaalsContact CE1-OG 3.22Å; Y144-S176 WeakPolarHBondContact CE1-OG 3.4Å; H172-S176 PolarHBondContact CE1-OG 2.79Å; H172-S176 WeakPolarHBondContact O-CB 3.31Å; H172-S176 PolarHBondContact O-N 3.41Å; H172-S176 PolarHBondContact O-OG 2.92Å; F174-S176 VanDerWaalsContact C-N 3.34Å; F174-S176 PolarHBondContact O-N 3.27Å; S176-L179 PolarHBondContact O-N 3.43Å; S176-Y180 PolarHBondContact O-N 2.71Å |
| 177 | F | 96.7 | Very high | 93.8 | Very high | 131 Ų | 131 | 74.3 Ų | 74.3 | 58% | 0.575 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -62.1 | -45.3 | 176 | 176.7 | -103.6 | 0 | 0 | 0 | 111.9 | R173 F174 I175 Y180 L181 | R173-F177 WeakPolarHBondContact O-CB 3.43Å; R173-F177 PolarHBondContact O-N 3.01Å; F174-F177 PolarHBondContact O-N 3.29Å; I175-F177 VanDerWaalsContact C-N 3.34Å; I175-F177 PolarHBondContact O-N 2.97Å; F177-Y180 PolarHBondContact O-N 3.43Å; F177-L181 HydrophobicContact CE1-CD2 4.31Å; F177-L181 WeakPolarHBondContact O-CB 3.24Å; F177-L181 PolarHBondContact O-N 2.83Å |
| 178 | A | 97.6 | Very high | 94.2 | Very high | 36 Ų | 36 | 73 Ų | 73 | 30% | 0.298 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.7 | -41.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F174 I175 L181 T182 | F174-A178 WeakPolarHBondContact O-CB 3.44Å; F174-A178 PolarHBondContact O-N 3.15Å; I175-A178 PolarHBondContact O-N 2.99Å; A178-L181 PolarHBondContact O-N 3.1Å; A178-T182 WeakPolarHBondContact O-CB 3.32Å; A178-T182 PolarHBondContact O-N 3.42Å; A178-T182 PolarHBondContact O-OG1 3.45Å |
| 179 | L | 97.2 | Very high | 94.4 | Very high | 47 Ų | 47 | 76.8 Ų | 76.8 | 25% | 0.246 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -61.6 | -49.4 | 174.7 | -73.4 | 173.5 | 0 | 0 | 0 | 111 | Y137 C141 Y144 I175 S176 L181 T182 G183 | Y137-L179 WeakPolarHBondContact CE1-O 3.43Å; Y137-L179 PolarHBondContact OH-O 3.5Å; C141-L179 HydrophobicContact CB-CB 4.5Å; Y144-L179 HydrophobicContact CD1-CD1 3.95Å; Y144-L179 HydrophobicContact CE1-CD1 4.33Å; Y144-L179 HydrophobicContact CG-CD1 4.4Å; I175-L179 HydrophobicContact CG2-CD1 3.93Å; I175-L179 HydrophobicContact CG2-CG 4.26Å; I175-L179 WeakPolarHBondContact O-CB 3.44Å; I175-L179 VanDerWaalsContact O-CG 3.3Å; I175-L179 WeakPolarHBondContact O-CG 3.4Å; I175-L179 PolarHBondContact O-N 2.95Å; S176-L179 PolarHBondContact O-N 3.43Å; L179-L181 PolarHBondContact O-N 3.23Å; L179-T182 PolarHBondContact O-N 2.95Å; L179-G183 PolarHBondContact O-N 3.14Å |
| 180 | Y | 97 | Very high | 94.5 | Very high | 94 Ų | 94 | 76.8 Ų | 76.8 | 37% | 0.369 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.9 | -45.2 | 177.3 | -176.8 | -92.4 | 0 | 0 | 0 | 112.1 | F138 S176 F177 T182 G183 F184 H207 | F138-Y180 HydrophobicContact CD1-CD2 4.16Å; F138-Y180 HydrophobicContact CD1-CE2 4.18Å; F138-Y180 HydrophobicContact CE1-CD2 4.02Å; F138-Y180 AromaticContact CE1-CE2 3.93Å; F138-Y180 HydrophobicContact CE1-CE2 3.93Å; S176-Y180 PolarHBondContact O-N 2.71Å; F177-Y180 PolarHBondContact O-N 3.43Å; Y180-T182 VanDerWaalsContact C-N 3.3Å; Y180-T182 PolarHBondContact O-N 2.89Å; Y180-G183 PolarHBondContact O-N 2.91Å; Y180-F184 PolarHBondContact O-N 3.22Å; Y180-H207 AromaticContact CE2-NE2 3.61Å; Y180-H207 AromaticContact CZ-NE2 3.89Å; Y180-H207 PolarHBondContact OH-NE2 2.89Å |
| 181 | L | 97.4 | Very high | 94.7 | Very high | 80 Ų | 80 | 72 Ų | 72 | 42% | 0.419 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61.8 | -38.7 | 177.8 | -175.9 | 62.1 | 0 | 0 | 0 | 111.9 | F177 A178 L179 F184 C185 | F177-L181 HydrophobicContact CE1-CD2 4.31Å; F177-L181 WeakPolarHBondContact O-CB 3.24Å; F177-L181 PolarHBondContact O-N 2.83Å; A178-L181 PolarHBondContact O-N 3.1Å; L179-L181 PolarHBondContact O-N 3.23Å; L181-F184 PolarHBondContact O-N 2.75Å; L181-C185 PolarHBondContact O-N 3.27Å; L181-C185 PolarHBondContact O-SG 3.49Å |
| 182 | T | 97.2 | Very high | 94.6 | Very high | 70 Ų | 70 | 69.2 Ų | 69.2 | 43% | 0.429 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.3 | -44.7 | 175.6 | -54 | 0 | 0 | 0 | 0 | 110.7 | A178 L179 Y180 F184 C185 M186 | A178-T182 WeakPolarHBondContact O-CB 3.32Å; A178-T182 PolarHBondContact O-N 3.42Å; A178-T182 PolarHBondContact O-OG1 3.45Å; L179-T182 PolarHBondContact O-N 2.95Å; Y180-T182 VanDerWaalsContact C-N 3.3Å; Y180-T182 PolarHBondContact O-N 2.89Å; T182-F184 VanDerWaalsContact C-N 3.34Å; T182-F184 PolarHBondContact O-N 3.14Å; T182-C185 PolarHBondContact O-N 3Å; T182-M186 HydrophobicContact CG2-CE 3.67Å; T182-M186 WeakPolarHBondContact O-CB 3.25Å; T182-M186 WeakPolarHBondContact O-CG 3.45Å; T182-M186 PolarHBondContact O-N 3.48Å |
| 183 | G | 95.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 76.5 Ų | 76.5 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -59.4 | -42.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113 | L179 Y180 M186 F187 | L179-G183 PolarHBondContact O-N 3.14Å; Y180-G183 PolarHBondContact O-N 2.91Å; G183-M186 PolarHBondContact O-N 3.27Å; G183-F187 PolarHBondContact O-N 3.39Å |
| 184 | F | 96.1 | Very high | 94 | Very high | 89 Ų | 89 | 77.3 Ų | 77.3 | 39% | 0.39 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.8 | -46 | 175.9 | -177.8 | -97 | 0 | 0 | 0 | 112 | Y180 L181 T182 M186 F187 V188 F203 | Y180-F184 PolarHBondContact O-N 3.22Å; L181-F184 PolarHBondContact O-N 2.75Å; T182-F184 VanDerWaalsContact C-N 3.34Å; T182-F184 PolarHBondContact O-N 3.14Å; F184-M186 VanDerWaalsContact C-N 3.35Å; F184-M186 PolarHBondContact O-N 2.86Å; F184-F187 WeakPolarHBondContact O-CB 3.48Å; F184-F187 PolarHBondContact O-N 3.31Å; F184-V188 HydrophobicContact CD1-CG2 4.36Å; F184-V188 HydrophobicContact CE1-CG2 3.97Å; F184-V188 HydrophobicContact CZ-CG2 4.14Å; F184-V188 WeakPolarHBondContact O-CG2 3.5Å; F184-V188 PolarHBondContact O-N 3.39Å; F184-F203 HydrophobicContact CD2-CZ 4.12Å |
| 185 | C | 96.3 | Very high | 93.5 | Very high | 61 Ų | 61 | 73.2 Ų | 73.2 | 41% | 0.412 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -60.7 | -43.6 | 174.1 | -70.1 | 0 | 0 | 0 | 0 | 111.5 | L181 T182 F187 V188 L189 | L181-C185 PolarHBondContact O-N 3.27Å; L181-C185 PolarHBondContact O-SG 3.49Å; T182-C185 PolarHBondContact O-N 3Å; C185-F187 VanDerWaalsContact C-N 3.32Å; C185-F187 PolarHBondContact O-N 3.41Å; C185-V188 PolarHBondContact O-N 3.08Å; C185-L189 WeakPolarHBondContact O-CB 3.39Å; C185-L189 VanDerWaalsContact O-CG 3.28Å; C185-L189 WeakPolarHBondContact O-CG 3.14Å; C185-L189 PolarHBondContact O-N 2.75Å |
| 186 | M | 94.1 | Very high | 93.2 | Very high | 82 Ų | 82 | 75.8 Ų | 75.8 | 40% | 0.404 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -59.9 | -40.9 | 175.3 | -76.3 | -169.6 | -93.8 | 0 | 0 | 112.2 | L134 Y137 T182 G183 F184 L189 S190 | L134-M186 HydrophobicContact CD1-CB 4.09Å; Y137-M186 HydrophobicContact CD1-CE 4.14Å; Y137-M186 HydrophobicContact CD2-CE 4.04Å; Y137-M186 HydrophobicContact CE1-CE 3.8Å; Y137-M186 HydrophobicContact CE2-CE 3.68Å; Y137-M186 HydrophobicContact CG-CE 4.25Å; T182-M186 HydrophobicContact CG2-CE 3.67Å; T182-M186 WeakPolarHBondContact O-CB 3.25Å; T182-M186 WeakPolarHBondContact O-CG 3.45Å; T182-M186 PolarHBondContact O-N 3.48Å; G183-M186 PolarHBondContact O-N 3.27Å; F184-M186 VanDerWaalsContact C-N 3.35Å; F184-M186 PolarHBondContact O-N 2.86Å; M186-L189 PolarHBondContact O-N 2.95Å; M186-S190 WeakPolarHBondContact O-CB 3.25Å; M186-S190 PolarHBondContact O-N 3.32Å |
| 187 | F | 94.3 | Very high | 92.8 | Very high | 8 Ų | 8 | 85.3 Ų | 85.3 | 4% | 0.035 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -59.2 | -50.8 | 173.4 | 175.1 | -112.9 | 0 | 0 | 0 | 111.6 | L134 G183 F184 C185 L189 S190 L191 Q199 F200 F203 | L134-F187 HydrophobicContact CD2-CB 3.76Å; L134-F187 HydrophobicContact CD2-CD2 3.71Å; L134-F187 HydrophobicContact CD2-CG 4.2Å; G183-F187 PolarHBondContact O-N 3.39Å; F184-F187 WeakPolarHBondContact O-CB 3.48Å; F184-F187 PolarHBondContact O-N 3.31Å; C185-F187 VanDerWaalsContact C-N 3.32Å; C185-F187 PolarHBondContact O-N 3.41Å; F187-L189 VanDerWaalsContact C-N 3.3Å; F187-L189 PolarHBondContact O-N 2.9Å; F187-S190 WeakPolarHBondContact O-CB 3.39Å; F187-S190 PolarHBondContact O-N 2.92Å; F187-S190 PolarHBondContact O-OG 2.87Å; F187-L191 HydrophobicContact CE1-CD2 4.24Å; F187-L191 HydrophobicContact CE2-CD2 4.33Å; F187-L191 HydrophobicContact CZ-CD2 3.93Å; F187-L191 PolarHBondContact O-N 3.01Å; F187-Q199 HydrophobicContact CE2-CB 4.22Å; F187-Q199 HydrophobicContact CZ-CB 4.4Å; F187-F200 HydrophobicContact CE1-CD1 4.22Å; F187-F200 AromaticContact CE1-CE1 3.94Å; F187-F200 HydrophobicContact CE1-CE1 3.94Å; F187-F200 HydrophobicContact CE1-CZ 4.32Å; F187-F200 HydrophobicContact CZ-CD1 4.26Å; F187-F200 HydrophobicContact CZ-CE1 4.37Å; F187-F203 HydrophobicContact CB-CD2 4.22Å; F187-F203 HydrophobicContact CB-CE2 4.07Å; F187-F203 AromaticContact CD1-CD2 3.65Å; F187-F203 HydrophobicContact CD1-CD2 3.65Å; F187-F203 AromaticContact CD1-CE2 3.77Å; F187-F203 HydrophobicContact CD1-CE2 3.77Å; F187-F203 HydrophobicContact CD1-CG 4.16Å; F187-F203 HydrophobicContact CD1-CZ 4.4Å; F187-F203 HydrophobicContact CD2-CB 4.33Å; F187-F203 AromaticContact CD2-CD2 3.6Å; F187-F203 HydrophobicContact CD2-CD2 3.6Å; F187-F203 HydrophobicContact CD2-CE2 4.3Å; F187-F203 HydrophobicContact CD2-CG 4.28Å; F187-F203 HydrophobicContact CE1-CB 4.16Å; F187-F203 HydrophobicContact CE1-CD1 4.37Å; F187-F203 AromaticContact CE1-CD2 3.85Å; F187-F203 HydrophobicContact CE1-CD2 3.85Å; F187-F203 HydrophobicContact CE1-CE2 4.31Å; F187-F203 AromaticContact CE1-CG 3.88Å; F187-F203 HydrophobicContact CE1-CG 3.88Å; F187-F203 HydrophobicContact CE2-CB 3.66Å; F187-F203 AromaticContact CE2-CD2 3.8Å; F187-F203 HydrophobicContact CE2-CD2 3.8Å; F187-F203 HydrophobicContact CE2-CG 4.01Å; F187-F203 AromaticContact CG-CD2 3.52Å; F187-F203 HydrophobicContact CG-CD2 3.52Å; F187-F203 AromaticContact CG-CE2 3.76Å; F187-F203 HydrophobicContact CG-CE2 3.76Å; F187-F203 HydrophobicContact CG-CG 4.35Å; F187-F203 HydrophobicContact CZ-CB 3.56Å; F187-F203 AromaticContact CZ-CD2 3.92Å; F187-F203 HydrophobicContact CZ-CD2 3.92Å; F187-F203 AromaticContact CZ-CG 3.79Å; F187-F203 HydrophobicContact CZ-CG 3.79Å |
| 188 | V | 93.7 | Very high | 92.3 | Very high | 68 Ų | 68 | 79.9 Ų | 79.9 | 41% | 0.412 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -60.3 | -41.3 | -179.6 | 173.5 | 0 | 0 | 0 | 0 | 111.2 | F184 C185 S190 L191 | F184-V188 HydrophobicContact CD1-CG2 4.36Å; F184-V188 HydrophobicContact CE1-CG2 3.97Å; F184-V188 HydrophobicContact CZ-CG2 4.14Å; F184-V188 WeakPolarHBondContact O-CG2 3.5Å; F184-V188 PolarHBondContact O-N 3.39Å; C185-V188 PolarHBondContact O-N 3.08Å; V188-S190 VanDerWaalsContact C-N 3.28Å; V188-S190 PolarHBondContact O-N 3.16Å; V188-L191 HydrophobicContact CG1-CD1 4.46Å; V188-L191 WeakPolarHBondContact O-CB 3.3Å; V188-L191 VanDerWaalsContact O-CG 3.31Å; V188-L191 WeakPolarHBondContact O-CG 3.43Å; V188-L191 PolarHBondContact O-N 3.45Å |
| 189 | L | 92.5 | Very high | 92 | Very high | 151 Ų | 151 | 78.7 Ų | 78.7 | 79% | 0.791 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -68.3 | -26.5 | 176.3 | -67.4 | 173.8 | 0 | 0 | 0 | 112.9 | C185 M186 F187 L191 | C185-L189 WeakPolarHBondContact O-CB 3.39Å; C185-L189 VanDerWaalsContact O-CG 3.28Å; C185-L189 WeakPolarHBondContact O-CG 3.14Å; C185-L189 PolarHBondContact O-N 2.75Å; M186-L189 PolarHBondContact O-N 2.95Å; F187-L189 VanDerWaalsContact C-N 3.3Å; F187-L189 PolarHBondContact O-N 2.9Å; L189-L191 PolarHBondContact O-N 3.27Å |
| 190 | S | 90.4 | Very high | 91.7 | Very high | 26 Ų | 26 | 81.9 Ų | 81.9 | 18% | 0.182 | 39% | 0.389 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -3.4 | 176.1 | 79.7 | 0 | 0 | 0 | 0 | 114.2 | M186 F187 V188 V192 Q199 | M186-S190 WeakPolarHBondContact O-CB 3.25Å; M186-S190 PolarHBondContact O-N 3.32Å; F187-S190 WeakPolarHBondContact O-CB 3.39Å; F187-S190 PolarHBondContact O-N 2.92Å; F187-S190 PolarHBondContact O-OG 2.87Å; V188-S190 VanDerWaalsContact C-N 3.28Å; V188-S190 PolarHBondContact O-N 3.16Å; S190-V192 WeakPolarHBondContact O-CG2 3.45Å; S190-V192 PolarHBondContact O-N 3.24Å; S190-Q199 PolarHBondContact O-NE2 3.05Å |
| 191 | L | 90.6 | Very high | 91.4 | Very high | 52 Ų | 52 | 84.7 Ų | 84.7 | 27% | 0.272 | 40% | 0.4 | S | S | . | . | trans | -66.9 | 122.2 | -173.9 | -70 | 174.9 | 0 | 0 | 0 | 112.2 | F187 V188 L189 Y196 Q199 F200 | F187-L191 HydrophobicContact CE1-CD2 4.24Å; F187-L191 HydrophobicContact CE2-CD2 4.33Å; F187-L191 HydrophobicContact CZ-CD2 3.93Å; F187-L191 PolarHBondContact O-N 3.01Å; V188-L191 HydrophobicContact CG1-CD1 4.46Å; V188-L191 WeakPolarHBondContact O-CB 3.3Å; V188-L191 VanDerWaalsContact O-CG 3.31Å; V188-L191 WeakPolarHBondContact O-CG 3.43Å; V188-L191 PolarHBondContact O-N 3.45Å; L189-L191 PolarHBondContact O-N 3.27Å; L191-Y196 HydrophobicContact CB-CD1 4.3Å; L191-Y196 HydrophobicContact CB-CE1 4.06Å; L191-Y196 HydrophobicContact CD2-CD1 4.41Å; L191-Q199 VanDerWaalsContact CA-OE1 3.28Å; L191-Q199 HydrophobicContact CD2-CB 4.11Å; L191-F200 HydrophobicContact CD2-CE2 4.34Å | ||
| 192 | V | 88.7 | Confident | 90.9 | Very high | 59 Ų | 59 | 81.1 Ų | 81.1 | 36% | 0.358 | 38% | 0.381 | S | S | . | . | trans | -107.9 | 130.3 | -179.4 | -174.9 | 0 | 0 | 0 | 0 | 109.9 | S190 H195 Y196 | S190-V192 WeakPolarHBondContact O-CG2 3.45Å; S190-V192 PolarHBondContact O-N 3.24Å; V192-H195 PolarHBondContact O-N 2.99Å; V192-H195 VanDerWaalsContact O-N 3.16Å; V192-Y196 WeakPolarHBondContact O-CD1 3.47Å; V192-Y196 WeakPolarHBondContact O-CE1 3.47Å | ||
| 193 | K | 85.6 | Confident | 90.7 | Very high | 166 Ų | 166 | 79.3 Ų | 79.3 | 72% | 0.722 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.4 | 144 | 174 | -74.8 | 177.9 | -179.1 | -179.4 | 0 | 110.2 | H195 Y196 | K193-H195 VanDerWaalsContact C-N 3.26Å; K193-H195 PolarHBondContact O-N 2.98Å; K193-H195 PolarHBondContact O-ND1 3.06Å; K193-Y196 WeakPolarHBondContact CG-OH 3.39Å |
| 194 | K | 85.8 | Confident | 90.6 | Very high | 200 Ų | 200 | 80.8 Ų | 80.8 | 87% | 0.87 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.4 | -18.1 | -174.7 | -52 | 178.7 | 175.3 | -179.5 | 0 | 116.4 | ||
| 195 | H | 85.6 | Confident | 90.4 | Very high | 58 Ų | 58 | 78.2 Ų | 78.2 | 27% | 0.269 | 37% | 0.37 | S | S | . | . | trans | -113.7 | 11.7 | -176.1 | -57.4 | 94.2 | 0 | 0 | 0 | 114.6 | Y126 L128 V192 K193 R197 L198 Q199 | Y126-H195 AromaticContact CD1-CD2 3.44Å; Y126-H195 VanDerWaalsContact CD1-CD2 3.44Å; Y126-H195 WeakPolarHBondContact CD1-CD2 3.14Å; Y126-H195 AromaticContact CD1-NE2 3.47Å; Y126-H195 WeakPolarHBondContact CD1-NE2 3.29Å; L128-H195 HydrophobicContact CD2-CB 3.99Å; V192-H195 PolarHBondContact O-N 2.99Å; V192-H195 VanDerWaalsContact O-N 3.16Å; K193-H195 VanDerWaalsContact C-N 3.26Å; K193-H195 PolarHBondContact O-N 2.98Å; K193-H195 PolarHBondContact O-ND1 3.06Å; H195-R197 PolarHBondContact O-N 3.36Å; H195-L198 PolarHBondContact O-N 2.67Å; H195-L198 VanDerWaalsContact O-N 3.13Å; H195-Q199 PolarHBondContact O-N 3.25Å | ||
| 196 | Y | 88.9 | Confident | 90.3 | Very high | 104 Ų | 104 | 75.4 Ų | 75.4 | 41% | 0.408 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -53.5 | -49.3 | -175.2 | -58.9 | -42.1 | 0 | 0 | 0 | 113.5 | L191 V192 K193 L198 Q199 F200 | L191-Y196 HydrophobicContact CB-CD1 4.3Å; L191-Y196 HydrophobicContact CB-CE1 4.06Å; L191-Y196 HydrophobicContact CD2-CD1 4.41Å; V192-Y196 WeakPolarHBondContact O-CD1 3.47Å; V192-Y196 WeakPolarHBondContact O-CE1 3.47Å; K193-Y196 WeakPolarHBondContact CG-OH 3.39Å; Y196-L198 VanDerWaalsContact C-N 3.28Å; Y196-L198 PolarHBondContact O-N 3.17Å; Y196-Q199 PolarHBondContact O-N 3.41Å; Y196-F200 VanDerWaalsContact O-CD2 3.23Å; Y196-F200 WeakPolarHBondContact O-CD2 3.49Å; Y196-F200 PolarHBondContact O-N 2.98Å |
| 197 | R | 88.3 | Confident | 90.3 | Very high | 209 Ų | 209 | 73.6 Ų | 73.6 | 79% | 0.789 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -54.9 | -47.9 | -179.9 | -71.9 | -174.6 | 178.4 | 175.6 | -0.5 | 111 | H195 F200 Y201 | H195-R197 PolarHBondContact O-N 3.36Å; R197-F200 PolarHBondContact O-N 2.97Å; R197-Y201 HydrophobicContact CB-CD2 4.42Å; R197-Y201 HydrophobicContact CB-CE2 4.11Å; R197-Y201 WeakPolarHBondContact O-CD2 3.42Å; R197-Y201 PolarHBondContact O-N 3.34Å |
| 198 | L | 86.4 | Confident | 90.3 | Very high | 18 Ų | 18 | 77 Ų | 77 | 9% | 0.094 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -63.6 | -45.3 | 179.3 | -178.7 | 59.7 | 0 | 0 | 0 | 112.2 | Y123 Y126 L128 H195 Y196 F200 Y201 M202 | Y123-L198 HydrophobicContact CD1-CD1 3.23Å; Y123-L198 HydrophobicContact CD2-CD1 4.12Å; Y123-L198 HydrophobicContact CE1-CD1 3.73Å; Y123-L198 HydrophobicContact CG-CD1 3.46Å; Y123-L198 VanDerWaalsContact CG-CD1 3.46Å; Y126-L198 HydrophobicContact CD1-CD2 4.48Å; Y126-L198 HydrophobicContact CD2-CD2 3.28Å; Y126-L198 HydrophobicContact CE2-CD2 4.06Å; Y126-L198 HydrophobicContact CG-CD2 3.52Å; L128-L198 HydrophobicContact CD1-CD2 3.65Å; L128-L198 HydrophobicContact CD1-CG 3.83Å; L128-L198 HydrophobicContact CG-CD2 4.42Å; H195-L198 PolarHBondContact O-N 2.67Å; H195-L198 VanDerWaalsContact O-N 3.13Å; Y196-L198 VanDerWaalsContact C-N 3.28Å; Y196-L198 PolarHBondContact O-N 3.17Å; L198-F200 VanDerWaalsContact C-N 3.31Å; L198-F200 PolarHBondContact O-N 2.87Å; L198-Y201 PolarHBondContact O-N 3.05Å; L198-M202 HydrophobicContact CD1-CG 4.19Å; L198-M202 HydrophobicContact CG-CG 4.45Å; L198-M202 WeakPolarHBondContact O-CB 3.07Å; L198-M202 VanDerWaalsContact O-CG 3.24Å; L198-M202 WeakPolarHBondContact O-CG 3.41Å; L198-M202 PolarHBondContact O-N 3.03Å |
| 199 | Q | 89.6 | Confident | 90.3 | Very high | 10 Ų | 10 | 74.1 Ų | 74.1 | 5% | 0.047 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -61.2 | -39 | 177.5 | -70.4 | -178.6 | -50.8 | 0 | 0 | 112.1 | L128 F187 S190 L191 H195 Y196 F203 | L128-Q199 HydrophobicContact CD1-CG 4.38Å; L128-Q199 HydrophobicContact CD2-CG 3.71Å; F187-Q199 HydrophobicContact CE2-CB 4.22Å; F187-Q199 HydrophobicContact CZ-CB 4.4Å; S190-Q199 PolarHBondContact O-NE2 3.05Å; L191-Q199 VanDerWaalsContact CA-OE1 3.28Å; L191-Q199 HydrophobicContact CD2-CB 4.11Å; H195-Q199 PolarHBondContact O-N 3.25Å; Y196-Q199 PolarHBondContact O-N 3.41Å; Q199-F203 VanDerWaalsContact O-CB 3.28Å; Q199-F203 WeakPolarHBondContact O-CB 3.19Å; Q199-F203 PolarHBondContact O-N 3.21Å |
| 200 | F | 91.5 | Very high | 90.4 | Very high | 115 Ų | 115 | 67.1 Ų | 67.1 | 50% | 0.504 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -70.2 | -37.8 | 174.3 | -82.8 | -75.1 | 0 | 0 | 0 | 113 | F187 L191 Y196 R197 L198 M202 F203 G204 | F187-F200 HydrophobicContact CE1-CD1 4.22Å; F187-F200 AromaticContact CE1-CE1 3.94Å; F187-F200 HydrophobicContact CE1-CE1 3.94Å; F187-F200 HydrophobicContact CE1-CZ 4.32Å; F187-F200 HydrophobicContact CZ-CD1 4.26Å; F187-F200 HydrophobicContact CZ-CE1 4.37Å; L191-F200 HydrophobicContact CD2-CE2 4.34Å; Y196-F200 VanDerWaalsContact O-CD2 3.23Å; Y196-F200 WeakPolarHBondContact O-CD2 3.49Å; Y196-F200 PolarHBondContact O-N 2.98Å; R197-F200 PolarHBondContact O-N 2.97Å; L198-F200 VanDerWaalsContact C-N 3.31Å; L198-F200 PolarHBondContact O-N 2.87Å; F200-M202 VanDerWaalsContact C-N 3.33Å; F200-F203 PolarHBondContact O-N 3.45Å; F200-G204 PolarHBondContact O-N 2.92Å |
| 201 | Y | 90.1 | Very high | 90.6 | Very high | 153 Ų | 153 | 71.4 Ų | 71.4 | 60% | 0.6 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -60.7 | -44.9 | 172.8 | -75.9 | -56.6 | 0 | 0 | 0 | 111.4 | R197 L198 G204 W205 | R197-Y201 HydrophobicContact CB-CD2 4.42Å; R197-Y201 HydrophobicContact CB-CE2 4.11Å; R197-Y201 WeakPolarHBondContact O-CD2 3.42Å; R197-Y201 PolarHBondContact O-N 3.34Å; L198-Y201 PolarHBondContact O-N 3.05Å; Y201-G204 PolarHBondContact O-N 2.68Å; Y201-W205 VanDerWaalsContact O-CB 3.31Å; Y201-W205 WeakPolarHBondContact O-CB 3.04Å; Y201-W205 PolarHBondContact O-N 3.47Å |
| 202 | M | 88.3 | Confident | 90.7 | Very high | 4 Ų | 4 | 71.9 Ų | 71.9 | 2% | 0.02 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -66.4 | -40.9 | 177.8 | -74.8 | -61.1 | -144.9 | 0 | 0 | 112.7 | Y123 F131 L198 F200 W205 T206 | Y123-M202 HydrophobicContact CD2-CE 3.37Å; Y123-M202 HydrophobicContact CD2-SD 3.65Å; Y123-M202 HydrophobicContact CE2-CE 4.44Å; Y123-M202 HydrophobicContact CE2-SD 4.21Å; Y123-M202 HydrophobicContact CG-CE 3.71Å; Y123-M202 HydrophobicContact CG-SD 4.45Å; F131-M202 HydrophobicContact CD1-CE 4.35Å; F131-M202 HydrophobicContact CD2-CB 3.91Å; F131-M202 HydrophobicContact CE1-CE 3.98Å; F131-M202 HydrophobicContact CE1-SD 3.88Å; F131-M202 HydrophobicContact CE2-CB 3.47Å; F131-M202 VanDerWaalsContact CE2-CB 3.47Å; F131-M202 HydrophobicContact CE2-CG 4.18Å; F131-M202 HydrophobicContact CE2-SD 4.24Å; F131-M202 HydrophobicContact CZ-CB 3.89Å; F131-M202 HydrophobicContact CZ-CE 4.35Å; F131-M202 HydrophobicContact CZ-CG 4.19Å; F131-M202 HydrophobicContact CZ-SD 3.65Å; L198-M202 HydrophobicContact CD1-CG 4.19Å; L198-M202 HydrophobicContact CG-CG 4.45Å; L198-M202 WeakPolarHBondContact O-CB 3.07Å; L198-M202 VanDerWaalsContact O-CG 3.24Å; L198-M202 WeakPolarHBondContact O-CG 3.41Å; L198-M202 PolarHBondContact O-N 3.03Å; F200-M202 VanDerWaalsContact C-N 3.33Å; M202-W205 WeakPolarHBondContact O-CB 3.38Å; M202-W205 PolarHBondContact O-N 3.15Å; M202-T206 PolarHBondContact O-N 3.26Å; M202-T206 PolarHBondContact O-OG1 3.29Å |
| 203 | F | 92.6 | Very high | 90.9 | Very high | 33 Ų | 33 | 69 Ų | 69 | 15% | 0.145 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -60.3 | -47.2 | 172.6 | -175.8 | -97.8 | 0 | 0 | 0 | 111.3 | F138 F184 F187 Q199 F200 T206 H207 | F138-F203 HydrophobicContact CE2-CD2 4.28Å; F138-F203 AromaticContact CE2-CE2 3.79Å; F138-F203 HydrophobicContact CE2-CE2 3.79Å; F138-F203 AromaticContact CZ-CE2 3.73Å; F138-F203 HydrophobicContact CZ-CE2 3.73Å; F138-F203 HydrophobicContact CZ-CZ 4.44Å; F184-F203 HydrophobicContact CD2-CZ 4.12Å; F187-F203 HydrophobicContact CB-CD2 4.22Å; F187-F203 HydrophobicContact CB-CE2 4.07Å; F187-F203 AromaticContact CD1-CD2 3.65Å; F187-F203 HydrophobicContact CD1-CD2 3.65Å; F187-F203 AromaticContact CD1-CE2 3.77Å; F187-F203 HydrophobicContact CD1-CE2 3.77Å; F187-F203 HydrophobicContact CD1-CG 4.16Å; F187-F203 HydrophobicContact CD1-CZ 4.4Å; F187-F203 HydrophobicContact CD2-CB 4.33Å; F187-F203 AromaticContact CD2-CD2 3.6Å; F187-F203 HydrophobicContact CD2-CD2 3.6Å; F187-F203 HydrophobicContact CD2-CE2 4.3Å; F187-F203 HydrophobicContact CD2-CG 4.28Å; F187-F203 HydrophobicContact CE1-CB 4.16Å; F187-F203 HydrophobicContact CE1-CD1 4.37Å; F187-F203 AromaticContact CE1-CD2 3.85Å; F187-F203 HydrophobicContact CE1-CD2 3.85Å; F187-F203 HydrophobicContact CE1-CE2 4.31Å; F187-F203 AromaticContact CE1-CG 3.88Å; F187-F203 HydrophobicContact CE1-CG 3.88Å; F187-F203 HydrophobicContact CE2-CB 3.66Å; F187-F203 AromaticContact CE2-CD2 3.8Å; F187-F203 HydrophobicContact CE2-CD2 3.8Å; F187-F203 HydrophobicContact CE2-CG 4.01Å; F187-F203 AromaticContact CG-CD2 3.52Å; F187-F203 HydrophobicContact CG-CD2 3.52Å; F187-F203 AromaticContact CG-CE2 3.76Å; F187-F203 HydrophobicContact CG-CE2 3.76Å; F187-F203 HydrophobicContact CG-CG 4.35Å; F187-F203 HydrophobicContact CZ-CB 3.56Å; F187-F203 AromaticContact CZ-CD2 3.92Å; F187-F203 HydrophobicContact CZ-CD2 3.92Å; F187-F203 AromaticContact CZ-CG 3.79Å; F187-F203 HydrophobicContact CZ-CG 3.79Å; Q199-F203 VanDerWaalsContact O-CB 3.28Å; Q199-F203 WeakPolarHBondContact O-CB 3.19Å; Q199-F203 PolarHBondContact O-N 3.21Å; F200-F203 PolarHBondContact O-N 3.45Å; F203-T206 PolarHBondContact O-N 3.36Å; F203-H207 AromaticContact CD1-ND1 3.87Å; F203-H207 AromaticContact CD2-CE1 3.73Å; F203-H207 AromaticContact CE1-CE1 3.57Å; F203-H207 AromaticContact CE1-ND1 3.73Å; F203-H207 AromaticContact CE2-CE1 3.24Å; F203-H207 WeakPolarHBondContact CE2-CE1 3.46Å; F203-H207 AromaticContact CE2-ND1 3.96Å; F203-H207 AromaticContact CZ-CE1 3.13Å; F203-H207 WeakPolarHBondContact CZ-CE1 3.41Å; F203-H207 AromaticContact CZ-ND1 3.78Å; F203-H207 AromaticContact CZ-NE2 3.68Å; F203-H207 PolarHBondContact O-N 2.99Å; F203-H207 VanDerWaalsContact O-N 3.1Å; F203-H207 PolarHBondContact O-ND1 3.4Å |
| 204 | G | 93.6 | Very high | 91.3 | Very high | 31 Ų | 31 | 61.1 Ų | 61.1 | 32% | 0.32 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | F200 Y201 T206 H207 V208 | F200-G204 PolarHBondContact O-N 2.92Å; Y201-G204 PolarHBondContact O-N 2.68Å; G204-T206 PolarHBondContact O-N 3.05Å; G204-H207 PolarHBondContact O-N 2.98Å; G204-V208 WeakPolarHBondContact O-CB 3.41Å; G204-V208 WeakPolarHBondContact O-CG2 3.46Å; G204-V208 PolarHBondContact O-N 3.49Å |
| 205 | W | 90.9 | Very high | 91.7 | Very high | 34 Ų | 34 | 53 Ų | 53 | 13% | 0.129 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -56.6 | -48.8 | 175.9 | -177 | -86.4 | 0 | 0 | 0 | 111.9 | I115 Y201 M202 H207 V208 T209 F366 F370 | I115-W205 HydrophobicContact CG2-CZ2 3.94Å; I115-W205 PolarHBondContact O-NE1 3.47Å; Y201-W205 VanDerWaalsContact O-CB 3.31Å; Y201-W205 WeakPolarHBondContact O-CB 3.04Å; Y201-W205 PolarHBondContact O-N 3.47Å; M202-W205 WeakPolarHBondContact O-CB 3.38Å; M202-W205 PolarHBondContact O-N 3.15Å; W205-H207 PolarHBondContact O-N 3.07Å; W205-V208 PolarHBondContact O-N 3.3Å; W205-T209 WeakPolarHBondContact O-CB 3.46Å; W205-T209 PolarHBondContact O-N 3.41Å; W205-T209 PolarHBondContact O-OG1 3.45Å; W205-F366 HydrophobicContact CH2-CE1 4.09Å; W205-F366 AromaticContact CH2-CE2 3.7Å; W205-F366 HydrophobicContact CH2-CE2 3.7Å; W205-F366 AromaticContact CH2-CZ 3.14Å; W205-F366 HydrophobicContact CH2-CZ 3.14Å; W205-F366 HydrophobicContact CZ2-CE1 4.46Å; W205-F366 HydrophobicContact CZ2-CE2 4.44Å; W205-F366 AromaticContact CZ2-CZ 3.62Å; W205-F366 HydrophobicContact CZ2-CZ 3.62Å; W205-F366 AromaticContact CZ3-CE2 3.93Å; W205-F366 HydrophobicContact CZ3-CE2 3.93Å; W205-F366 AromaticContact CZ3-CZ 3.86Å; W205-F366 HydrophobicContact CZ3-CZ 3.86Å; W205-F370 HydrophobicContact CH2-CD2 4.28Å; W205-F370 HydrophobicContact CH2-CE1 4.21Å; W205-F370 AromaticContact CH2-CE2 3.67Å; W205-F370 HydrophobicContact CH2-CE2 3.67Å; W205-F370 AromaticContact CH2-CZ 3.65Å; W205-F370 HydrophobicContact CH2-CZ 3.65Å; W205-F370 HydrophobicContact CZ3-CE1 4.1Å; W205-F370 AromaticContact CZ3-CE2 3.79Å; W205-F370 HydrophobicContact CZ3-CE2 3.79Å; W205-F370 AromaticContact CZ3-CZ 3.41Å; W205-F370 HydrophobicContact CZ3-CZ 3.41Å; W205-F370 VanDerWaalsContact CZ3-CZ 3.41Å |
| 206 | T | 94.1 | Very high | 92.1 | Very high | 2 Ų | 2 | 51.7 Ų | 51.7 | 1% | 0.012 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.7 | -46.1 | 176.9 | -62 | 0 | 0 | 0 | 0 | 111 | F112 I116 S135 F138 M202 F203 G204 T209 L210 | F112-T206 HydrophobicContact CZ-CG2 4.34Å; I116-T206 HydrophobicContact CD1-CG2 4.4Å; S135-T206 PolarHBondContact OG-OG1 3.47Å; F138-T206 HydrophobicContact CB-CG2 4.37Å; M202-T206 PolarHBondContact O-N 3.26Å; M202-T206 PolarHBondContact O-OG1 3.29Å; F203-T206 PolarHBondContact O-N 3.36Å; G204-T206 PolarHBondContact O-N 3.05Å; T206-T209 PolarHBondContact O-N 2.95Å; T206-L210 HydrophobicContact CG2-CD1 3.92Å; T206-L210 HydrophobicContact CG2-CG 4.43Å; T206-L210 WeakPolarHBondContact O-CG 3.5Å; T206-L210 PolarHBondContact O-N 3.14Å |
| 207 | H | 95.6 | Very high | 92.4 | Very high | 44 Ų | 44 | 47 Ų | 47 | 20% | 0.204 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -67.7 | -40.7 | -178.8 | -74 | 74.2 | 0 | 0 | 0 | 113.1 | Y180 F203 G204 W205 T209 L210 L211 | Y180-H207 AromaticContact CE2-NE2 3.61Å; Y180-H207 AromaticContact CZ-NE2 3.89Å; Y180-H207 PolarHBondContact OH-NE2 2.89Å; F203-H207 AromaticContact CD1-ND1 3.87Å; F203-H207 AromaticContact CD2-CE1 3.73Å; F203-H207 AromaticContact CE1-CE1 3.57Å; F203-H207 AromaticContact CE1-ND1 3.73Å; F203-H207 AromaticContact CE2-CE1 3.24Å; F203-H207 WeakPolarHBondContact CE2-CE1 3.46Å; F203-H207 AromaticContact CE2-ND1 3.96Å; F203-H207 AromaticContact CZ-CE1 3.13Å; F203-H207 WeakPolarHBondContact CZ-CE1 3.41Å; F203-H207 AromaticContact CZ-ND1 3.78Å; F203-H207 AromaticContact CZ-NE2 3.68Å; F203-H207 PolarHBondContact O-N 2.99Å; F203-H207 VanDerWaalsContact O-N 3.1Å; F203-H207 PolarHBondContact O-ND1 3.4Å; G204-H207 PolarHBondContact O-N 2.98Å; W205-H207 PolarHBondContact O-N 3.07Å; H207-T209 VanDerWaalsContact C-N 3.33Å; H207-L210 PolarHBondContact O-N 3.04Å; H207-L211 WeakPolarHBondContact O-CB 3.49Å; H207-L211 PolarHBondContact O-N 2.9Å |
| 208 | V | 93.9 | Very high | 92.7 | Very high | 81 Ų | 81 | 38 Ų | 38 | 49% | 0.491 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -64.1 | -41.6 | 174.2 | 171.3 | 0 | 0 | 0 | 0 | 110.5 | G204 W205 L210 L211 I212 | G204-V208 WeakPolarHBondContact O-CB 3.41Å; G204-V208 WeakPolarHBondContact O-CG2 3.46Å; G204-V208 PolarHBondContact O-N 3.49Å; W205-V208 PolarHBondContact O-N 3.3Å; V208-L210 VanDerWaalsContact C-N 3.35Å; V208-L210 PolarHBondContact O-N 3.29Å; V208-L211 PolarHBondContact O-N 3.15Å; V208-I212 HydrophobicContact CG1-CD1 3.78Å; V208-I212 HydrophobicContact CG1-CG1 4.49Å; V208-I212 WeakPolarHBondContact O-CG1 3.49Å; V208-I212 PolarHBondContact O-N 2.92Å |
| 209 | T | 93.3 | Very high | 93.1 | Very high | 6 Ų | 6 | 38.4 Ų | 38.4 | 4% | 0.037 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.1 | -42.3 | 176.1 | -53.7 | 0 | 0 | 0 | 0 | 111.1 | F112 I115 W205 T206 H207 I212 V213 | F112-T209 HydrophobicContact CD2-CG2 3.64Å; F112-T209 HydrophobicContact CE2-CG2 4.08Å; I115-T209 HydrophobicContact CB-CG2 3.79Å; I115-T209 HydrophobicContact CD1-CG2 4.08Å; I115-T209 HydrophobicContact CG2-CG2 3.57Å; I115-T209 VanDerWaalsContact CG2-OG1 3.27Å; I115-T209 WeakPolarHBondContact CG2-OG1 3.32Å; W205-T209 WeakPolarHBondContact O-CB 3.46Å; W205-T209 PolarHBondContact O-N 3.41Å; W205-T209 PolarHBondContact O-OG1 3.45Å; T206-T209 PolarHBondContact O-N 2.95Å; H207-T209 VanDerWaalsContact C-N 3.33Å; T209-I212 PolarHBondContact O-N 3.45Å; T209-V213 HydrophobicContact CG2-CG2 4.03Å; T209-V213 VanDerWaalsContact O-CB 3.29Å; T209-V213 WeakPolarHBondContact O-CB 3.31Å; T209-V213 WeakPolarHBondContact O-CG2 3.48Å; T209-V213 PolarHBondContact O-N 3.34Å |
| 210 | L | 95.5 | Very high | 93.3 | Very high | 5 Ų | 5 | 38.8 Ų | 38.8 | 3% | 0.026 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.4 | -43.7 | 176.7 | -70.6 | 167.8 | 0 | 0 | 0 | 111.8 | F112 F138 L139 V142 T206 H207 V208 I212 V214 | F112-L210 HydrophobicContact CD2-CD2 3.93Å; F112-L210 HydrophobicContact CE2-CD2 3.45Å; F112-L210 VanDerWaalsContact CE2-CD2 3.45Å; F112-L210 HydrophobicContact CE2-CG 3.79Å; F112-L210 HydrophobicContact CZ-CD2 4.07Å; F138-L210 HydrophobicContact CB-CD1 3.6Å; L139-L210 HydrophobicContact CB-CD2 4.06Å; L139-L210 HydrophobicContact CD1-CD2 3.62Å; L139-L210 HydrophobicContact CG-CD2 4.47Å; V142-L210 HydrophobicContact CB-CD2 4.5Å; V142-L210 HydrophobicContact CG2-CD1 4.03Å; T206-L210 HydrophobicContact CG2-CD1 3.92Å; T206-L210 HydrophobicContact CG2-CG 4.43Å; T206-L210 WeakPolarHBondContact O-CG 3.5Å; T206-L210 PolarHBondContact O-N 3.14Å; H207-L210 PolarHBondContact O-N 3.04Å; V208-L210 VanDerWaalsContact C-N 3.35Å; V208-L210 PolarHBondContact O-N 3.29Å; L210-I212 VanDerWaalsContact C-N 3.33Å; L210-I212 PolarHBondContact O-N 3.18Å; L210-V214 HydrophobicContact CB-CG2 4.44Å; L210-V214 HydrophobicContact CD2-CG2 3.74Å; L210-V214 VanDerWaalsContact O-CB 3.28Å; L210-V214 WeakPolarHBondContact O-CB 3.49Å; L210-V214 WeakPolarHBondContact O-CG2 3.38Å; L210-V214 PolarHBondContact O-N 3.47Å |
| 211 | L | 93.9 | Very high | 93.4 | Very high | 115 Ų | 115 | 33.3 Ų | 33.3 | 60% | 0.602 | 17% | 0.171 | S | C | * | . | H | α-helix | trans | -59.7 | -43.8 | 175.7 | 179.6 | 66 | 0 | 0 | 0 | 111.6 | H207 V208 T215 | H207-L211 WeakPolarHBondContact O-CB 3.49Å; H207-L211 PolarHBondContact O-N 2.9Å; V208-L211 PolarHBondContact O-N 3.15Å; L211-T215 WeakPolarHBondContact O-CB 3.41Å; L211-T215 PolarHBondContact O-OG1 3.29Å; L211-T215 VanDerWaalsContact O-OG1 3.12Å |
| 212 | I | 91.6 | Very high | 93.4 | Very high | 62 Ų | 62 | 27.3 Ų | 27.3 | 32% | 0.318 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -76.3 | -40.7 | -178.6 | -65.9 | 170.6 | 0 | 0 | 0 | 111.5 | V208 T209 L210 Q216 Y393 | V208-I212 HydrophobicContact CG1-CD1 3.78Å; V208-I212 HydrophobicContact CG1-CG1 4.49Å; V208-I212 WeakPolarHBondContact O-CG1 3.49Å; V208-I212 PolarHBondContact O-N 2.92Å; T209-I212 PolarHBondContact O-N 3.45Å; L210-I212 VanDerWaalsContact C-N 3.33Å; L210-I212 PolarHBondContact O-N 3.18Å; I212-Q216 VanDerWaalsContact O-CB 3.32Å; I212-Q216 WeakPolarHBondContact O-CB 3.34Å; I212-Q216 WeakPolarHBondContact O-CG 3.27Å; I212-Y393 HydrophobicContact CG2-CD2 3.75Å; I212-Y393 HydrophobicContact CG2-CE2 3.93Å |
| 213 | V | 93.7 | Very high | 93.7 | Very high | 0 Ų | 0 | 27.3 Ų | 27.3 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -89.5 | -45.8 | -170.4 | 176.7 | 0 | 0 | 0 | 0 | 111.8 | Q108 C111 F112 I115 T209 S217 M386 Y393 | Q108-V213 HydrophobicContact CB-CG1 4.35Å; Q108-V213 HydrophobicContact CG-CG1 3.62Å; Q108-V213 WeakPolarHBondContact O-CG1 3.26Å; C111-V213 HydrophobicContact CB-CG1 4.05Å; F112-V213 HydrophobicContact CB-CG1 4.28Å; I115-V213 HydrophobicContact CD1-CG2 4.27Å; T209-V213 HydrophobicContact CG2-CG2 4.03Å; T209-V213 VanDerWaalsContact O-CB 3.29Å; T209-V213 WeakPolarHBondContact O-CB 3.31Å; T209-V213 WeakPolarHBondContact O-CG2 3.48Å; T209-V213 PolarHBondContact O-N 3.34Å; V213-S217 PolarHBondContact O-N 3.29Å; V213-S217 VanDerWaalsContact O-N 3.15Å; V213-S217 PolarHBondContact O-OG 3.35Å; V213-M386 HydrophobicContact CG2-CE 3.67Å; V213-Y393 HydrophobicContact CG2-CE2 4.29Å |
| 214 | V | 95.1 | Very high | 93.7 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -79.4 | -39.8 | -174.1 | -170.3 | 0 | 0 | 0 | 0 | 111.9 | L139 V142 F146 Y147 L210 Q216 S217 H218 | L139-V214 HydrophobicContact CD1-CG2 3.84Å; V142-V214 HydrophobicContact CG1-CB 3.97Å; V142-V214 HydrophobicContact CG1-CG1 3.81Å; V142-V214 HydrophobicContact CG1-CG2 4.23Å; F146-V214 HydrophobicContact CD2-CG1 4.07Å; Y147-V214 HydrophobicContact CE2-CG1 4.4Å; L210-V214 HydrophobicContact CB-CG2 4.44Å; L210-V214 HydrophobicContact CD2-CG2 3.74Å; L210-V214 VanDerWaalsContact O-CB 3.28Å; L210-V214 WeakPolarHBondContact O-CB 3.49Å; L210-V214 WeakPolarHBondContact O-CG2 3.38Å; L210-V214 PolarHBondContact O-N 3.47Å; V214-Q216 VanDerWaalsContact C-N 3.28Å; V214-Q216 PolarHBondContact O-N 2.04Å; V214-S217 WeakPolarHBondContact CA-OG 3.32Å; V214-S217 PolarHBondContact O-N 2.84Å; V214-S217 PolarHBondContact O-OG 3.15Å; V214-H218 VanDerWaalsContact O-CB 3.31Å; V214-H218 WeakPolarHBondContact O-CB 3.5Å; V214-H218 PolarHBondContact O-N 3.04Å |
| 215 | T | 93.3 | Very high | 93.5 | Very high | 30 Ų | 30 | 24.3 Ų | 24.3 | 18% | 0.184 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -63.6 | -39.8 | 176.2 | -55.1 | 0 | 0 | 0 | 0 | 110.5 | L211 H218 L219 | L211-T215 WeakPolarHBondContact O-CB 3.41Å; L211-T215 PolarHBondContact O-OG1 3.29Å; L211-T215 VanDerWaalsContact O-OG1 3.12Å; T215-H218 PolarHBondContact O-N 3.41Å; T215-L219 HydrophobicContact CG2-CD1 4.23Å; T215-L219 HydrophobicContact CG2-CG 4.49Å; T215-L219 VanDerWaalsContact O-CG 3.26Å; T215-L219 WeakPolarHBondContact O-CG 2.86Å; T215-L219 PolarHBondContact O-N 3.3Å |
| 216 | Q | 93.8 | Very high | 93.3 | Very high | 29 Ų | 29 | 25.2 Ų | 25.2 | 14% | 0.136 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -68.5 | -43.9 | 179.8 | -60.6 | -58.9 | -23.6 | 0 | 0 | 112.2 | I212 V214 H218 L219 I220 Y393 T397 | I212-Q216 VanDerWaalsContact O-CB 3.32Å; I212-Q216 WeakPolarHBondContact O-CB 3.34Å; I212-Q216 WeakPolarHBondContact O-CG 3.27Å; V214-Q216 VanDerWaalsContact C-N 3.28Å; V214-Q216 PolarHBondContact O-N 2.04Å; Q216-H218 VanDerWaalsContact C-N 3.29Å; Q216-H218 PolarHBondContact O-N 3.2Å; Q216-L219 PolarHBondContact O-N 2.94Å; Q216-I220 VanDerWaalsContact O-CG1 3.26Å; Q216-I220 WeakPolarHBondContact O-CG1 3.12Å; Q216-I220 PolarHBondContact O-N 3.23Å; Q216-Y393 HydrophobicContact CB-CD1 3.93Å; Q216-Y393 HydrophobicContact CB-CE1 4.38Å; Q216-Y393 HydrophobicContact CB-CG 4.11Å; Q216-Y393 HydrophobicContact CG-CD1 4.37Å; Q216-Y393 HydrophobicContact CG-CD2 4.47Å; Q216-Y393 HydrophobicContact CG-CG 4.04Å; Q216-Y393 PolarHBondContact OE1-O 3.33Å; Q216-T397 PolarHBondContact NE2-OG1 3.31Å; Q216-T397 PolarHBondContact OE1-OG1 2.95Å |
| 217 | S | 94.7 | Very high | 93.1 | Very high | 5 Ų | 5 | 25.1 Ų | 25.1 | 4% | 0.035 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -63.1 | -35.4 | 175 | 61 | 0 | 0 | 0 | 0 | 112.7 | Q108 Y147 V213 V214 I220 I221 | Q108-S217 WeakPolarHBondContact CG-OG 3.22Å; Q108-S217 PolarHBondContact OE1-OG 2.78Å; Y147-S217 WeakPolarHBondContact OH-CB 3.35Å; Y147-S217 PolarHBondContact OH-OG 3.4Å; V213-S217 PolarHBondContact O-N 3.29Å; V213-S217 VanDerWaalsContact O-N 3.15Å; V213-S217 PolarHBondContact O-OG 3.35Å; V214-S217 WeakPolarHBondContact CA-OG 3.32Å; V214-S217 PolarHBondContact O-N 2.84Å; V214-S217 PolarHBondContact O-OG 3.15Å; S217-I220 PolarHBondContact O-N 2.7Å; S217-I221 WeakPolarHBondContact O-CG1 3.48Å; S217-I221 PolarHBondContact O-N 2.86Å |
| 218 | H | 94.6 | Very high | 93 | Very high | 21 Ų | 21 | 23 Ų | 23 | 10% | 0.097 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -64 | -44.8 | 173.4 | 171.9 | 79.3 | 0 | 0 | 0 | 112 | F146 Y147 T150 V214 T215 Q216 I221 H222 | F146-H218 HydrophobicContact CB-CB 4.24Å; F146-H218 HydrophobicContact CD1-CB 4.35Å; F146-H218 AromaticContact CD1-CD2 3.64Å; F146-H218 AromaticContact CD1-CG 3.8Å; F146-H218 AromaticContact CD1-NE2 3.79Å; F146-H218 HydrophobicContact CG-CB 4.39Å; F146-H218 PolarHBondContact O-CE1 3.35Å; Y147-H218 HydrophobicContact CE1-CB 4.49Å; Y147-H218 PolarHBondContact OH-N 3.48Å; T150-H218 PolarHBondContact OG1-CE1 2.89Å; T150-H218 PolarHBondContact OG1-ND1 3.26Å; V214-H218 VanDerWaalsContact O-CB 3.31Å; V214-H218 WeakPolarHBondContact O-CB 3.5Å; V214-H218 PolarHBondContact O-N 3.04Å; T215-H218 PolarHBondContact O-N 3.41Å; Q216-H218 VanDerWaalsContact C-N 3.29Å; Q216-H218 PolarHBondContact O-N 3.2Å; H218-I221 PolarHBondContact O-N 3.04Å; H218-H222 AromaticContact CD2-CD2 3.91Å; H218-H222 AromaticContact CE1-CD2 3.29Å; H218-H222 PolarHBondContact CE1-CD2 3.18Å; H218-H222 AromaticContact CE1-NE2 3.24Å; H218-H222 PolarHBondContact CE1-NE2 3.27Å; H218-H222 AromaticContact ND1-CD2 3.8Å; H218-H222 AromaticContact NE2-CD2 3.34Å; H218-H222 PolarHBondContact NE2-CD2 3.26Å; H218-H222 VanDerWaalsContact NE2-CD2 3.34Å; H218-H222 AromaticContact NE2-NE2 3.5Å; H218-H222 PolarHBondContact O-N 2.98Å |
| 219 | L | 94.7 | Very high | 93 | Very high | 27 Ų | 27 | 19.1 Ų | 19.1 | 14% | 0.141 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -64.2 | -40.3 | 176.3 | -65.4 | 173.2 | 0 | 0 | 0 | 112 | T215 Q216 I221 H222 N223 T397 N400 | T215-L219 HydrophobicContact CG2-CD1 4.23Å; T215-L219 HydrophobicContact CG2-CG 4.49Å; T215-L219 VanDerWaalsContact O-CG 3.26Å; T215-L219 WeakPolarHBondContact O-CG 2.86Å; T215-L219 PolarHBondContact O-N 3.3Å; Q216-L219 PolarHBondContact O-N 2.94Å; L219-I221 VanDerWaalsContact C-N 3.32Å; L219-I221 PolarHBondContact O-N 2.7Å; L219-H222 PolarHBondContact O-N 3.11Å; L219-N223 PolarHBondContact O-N 3.04Å; L219-N223 PolarHBondContact O-ND2 3.47Å; L219-N223 PolarHBondContact O-OD1 3.27Å; L219-T397 HydrophobicContact CD1-CG2 4.4Å; L219-N400 HydrophobicContact CB-CB 4.38Å; L219-N400 HydrophobicContact CD2-CB 4.04Å |
| 220 | I | 94.6 | Very high | 93 | Very high | 17 Ų | 17 | 19.2 Ų | 19.2 | 9% | 0.087 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -57.2 | -46.3 | 173.8 | -70.7 | 173 | 0 | 0 | 0 | 110.8 | V104 Q216 S217 N223 L224 F231 A396 | V104-I220 HydrophobicContact CG1-CB 4.3Å; V104-I220 HydrophobicContact CG1-CG2 3.96Å; V104-I220 HydrophobicContact CG2-CG2 3.8Å; Q216-I220 VanDerWaalsContact O-CG1 3.26Å; Q216-I220 WeakPolarHBondContact O-CG1 3.12Å; Q216-I220 PolarHBondContact O-N 3.23Å; S217-I220 PolarHBondContact O-N 2.7Å; I220-N223 PolarHBondContact O-N 2.91Å; I220-L224 WeakPolarHBondContact O-CB 3.48Å; I220-L224 PolarHBondContact O-N 2.95Å; I220-F231 HydrophobicContact CG2-CD2 3.55Å; I220-F231 HydrophobicContact CG2-CE2 3.4Å; I220-F231 VanDerWaalsContact CG2-CE2 3.4Å; I220-A396 HydrophobicContact CD1-CB 4.02Å; I220-A396 HydrophobicContact CG1-CB 3.35Å |
| 221 | I | 93.3 | Very high | 93 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -68.2 | -38.7 | -180 | -74.4 | 165.4 | 0 | 0 | 0 | 111.3 | M101 V104 L105 Y147 T150 S217 H218 L219 N223 L224 F225 | M101-I221 HydrophobicContact CG-CD1 3.86Å; M101-I221 HydrophobicContact CG-CG1 4.14Å; M101-I221 HydrophobicContact CG-CG2 4.23Å; V104-I221 HydrophobicContact CB-CD1 4.22Å; V104-I221 HydrophobicContact CB-CG1 4.22Å; V104-I221 HydrophobicContact CG1-CD1 3.87Å; V104-I221 HydrophobicContact CG1-CG1 3.9Å; L105-I221 HydrophobicContact CD2-CD1 4.08Å; L105-I221 HydrophobicContact CG-CD1 4.09Å; Y147-I221 HydrophobicContact CD1-CD1 4.38Å; Y147-I221 HydrophobicContact CE1-CB 4.46Å; Y147-I221 HydrophobicContact CE1-CD1 3.38Å; Y147-I221 HydrophobicContact CE1-CG1 4.47Å; T150-I221 HydrophobicContact CG2-CG2 4.33Å; S217-I221 WeakPolarHBondContact O-CG1 3.48Å; S217-I221 PolarHBondContact O-N 2.86Å; H218-I221 PolarHBondContact O-N 3.04Å; L219-I221 VanDerWaalsContact C-N 3.32Å; L219-I221 PolarHBondContact O-N 2.7Å; I221-N223 PolarHBondContact O-N 3.27Å; I221-L224 WeakPolarHBondContact O-CB 3.3Å; I221-L224 PolarHBondContact O-N 2.7Å; I221-F225 HydrophobicContact CG2-CD2 3.76Å; I221-F225 HydrophobicContact CG2-CE2 3.41Å; I221-F225 VanDerWaalsContact CG2-CE2 3.41Å; I221-F225 HydrophobicContact CG2-CZ 4.16Å; I221-F225 WeakPolarHBondContact O-CD2 3.33Å; I221-F225 PolarHBondContact O-N 3.37Å |
| 222 | H | 91 | Very high | 93 | Very high | 27 Ų | 27 | 14.5 Ų | 14.5 | 13% | 0.125 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -60.5 | -44.8 | 172.1 | -97.8 | -75.3 | 0 | 0 | 0 | 112.1 | T150 Y154 H218 L219 L224 F225 E226 | T150-H222 PolarHBondContact OG1-NE2 2.78Å; Y154-H222 AromaticContact CE2-CE1 3.6Å; Y154-H222 AromaticContact CE2-ND1 3.62Å; Y154-H222 AromaticContact CZ-ND1 3.91Å; Y154-H222 PolarHBondContact OH-ND1 3.11Å; H218-H222 AromaticContact CD2-CD2 3.91Å; H218-H222 AromaticContact CE1-CD2 3.29Å; H218-H222 PolarHBondContact CE1-CD2 3.18Å; H218-H222 AromaticContact CE1-NE2 3.24Å; H218-H222 PolarHBondContact CE1-NE2 3.27Å; H218-H222 AromaticContact ND1-CD2 3.8Å; H218-H222 AromaticContact NE2-CD2 3.34Å; H218-H222 PolarHBondContact NE2-CD2 3.26Å; H218-H222 VanDerWaalsContact NE2-CD2 3.34Å; H218-H222 AromaticContact NE2-NE2 3.5Å; H218-H222 PolarHBondContact O-N 2.98Å; L219-H222 PolarHBondContact O-N 3.11Å; H222-L224 VanDerWaalsContact C-N 3.31Å; H222-L224 PolarHBondContact O-N 3.49Å; H222-F225 PolarHBondContact O-N 3.4Å; H222-E226 WeakPolarHBondContact O-CG 3.41Å; H222-E226 PolarHBondContact O-N 2.94Å |
| 223 | N | 93.2 | Very high | 93.2 | Very high | 4 Ų | 4 | 11.6 Ų | 11.6 | 2% | 0.021 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -63.4 | -39.5 | 177.4 | -60.6 | -19.2 | 0 | 0 | 0 | 111.2 | L219 I220 I221 F225 E226 W230 A396 V399 N400 I403 | L219-N223 PolarHBondContact O-N 3.04Å; L219-N223 PolarHBondContact O-ND2 3.47Å; L219-N223 PolarHBondContact O-OD1 3.27Å; I220-N223 PolarHBondContact O-N 2.91Å; I221-N223 PolarHBondContact O-N 3.27Å; N223-F225 VanDerWaalsContact C-N 3.35Å; N223-F225 PolarHBondContact O-N 3.33Å; N223-E226 PolarHBondContact O-N 3.49Å; N223-W230 WeakPolarHBondContact O-CB 3.31Å; N223-A396 PolarHBondContact ND2-O 3.29Å; N223-V399 HydrophobicContact CB-CG1 4.06Å; N223-V399 WeakPolarHBondContact ND2-CB 3.28Å; N223-V399 WeakPolarHBondContact ND2-CG1 3.26Å; N223-N400 WeakPolarHBondContact OD1-CA 3.37Å; N223-N400 VanDerWaalsContact OD1-CB 3.25Å; N223-N400 WeakPolarHBondContact OD1-CB 3.48Å; N223-N400 PolarHBondContact OD1-ND2 3.5Å; N223-I403 HydrophobicContact CB-CD1 4.43Å |
| 224 | L | 92.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 11.8 Ų | 11.8 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -59.3 | -43 | 175.8 | 176.8 | 71.5 | 0 | 0 | 0 | 112.2 | L100 M101 I220 I221 H222 G227 M228 F231 | L100-L224 HydrophobicContact CB-CD1 4.22Å; L100-L224 HydrophobicContact CB-CD2 3.88Å; L100-L224 HydrophobicContact CD1-CD1 3.89Å; M101-L224 HydrophobicContact CB-CD2 4.34Å; I220-L224 WeakPolarHBondContact O-CB 3.48Å; I220-L224 PolarHBondContact O-N 2.95Å; I221-L224 WeakPolarHBondContact O-CB 3.3Å; I221-L224 PolarHBondContact O-N 2.7Å; H222-L224 VanDerWaalsContact C-N 3.31Å; H222-L224 PolarHBondContact O-N 3.49Å; L224-G227 CarbonylContact O-C 3.35Å; L224-G227 VanDerWaalsContact O-C 3.28Å; L224-G227 PolarHBondContact O-N 3.43Å; L224-M228 HydrophobicContact CD1-CB 4.47Å; L224-M228 HydrophobicContact CD1-CG 3.86Å; L224-F231 HydrophobicContact CB-CB 4.18Å; L224-F231 HydrophobicContact CB-CD2 4.46Å; L224-F231 HydrophobicContact CB-CG 4.48Å; L224-F231 HydrophobicContact CD1-CB 3.84Å; L224-F231 HydrophobicContact CD1-CD1 4.1Å; L224-F231 HydrophobicContact CD1-CD2 4.46Å; L224-F231 HydrophobicContact CD1-CG 3.89Å |
| 225 | F | 89.5 | Confident | 93.3 | Very high | 2 Ų | 2 | 12.8 Ų | 12.8 | 1% | 0.009 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -73.6 | -24.2 | -177.7 | -72.5 | -41.1 | 0 | 0 | 0 | 114.3 | M101 T150 Y154 F155 I221 H222 N223 G227 P296 V297 | M101-F225 HydrophobicContact SD-CE2 4.35Å; M101-F225 HydrophobicContact SD-CZ 3.69Å; T150-F225 HydrophobicContact CG2-CD2 4.05Å; T150-F225 HydrophobicContact CG2-CE2 3.78Å; Y154-F225 HydrophobicContact CD1-CB 3.94Å; Y154-F225 HydrophobicContact CD1-CD2 4.34Å; Y154-F225 HydrophobicContact CD1-CG 4.23Å; Y154-F225 AromaticContact CD2-CD2 3.72Å; Y154-F225 HydrophobicContact CD2-CD2 3.72Å; Y154-F225 HydrophobicContact CD2-CE2 4.24Å; Y154-F225 HydrophobicContact CD2-CG 4.4Å; Y154-F225 HydrophobicContact CE1-CB 3.47Å; Y154-F225 VanDerWaalsContact CE1-CB 3.47Å; Y154-F225 HydrophobicContact CE1-CD2 4.4Å; Y154-F225 HydrophobicContact CE1-CG 4.21Å; Y154-F225 HydrophobicContact CE2-CB 4.14Å; Y154-F225 AromaticContact CE2-CD2 3.77Å; Y154-F225 HydrophobicContact CE2-CD2 3.77Å; Y154-F225 HydrophobicContact CE2-CG 4.37Å; Y154-F225 HydrophobicContact CG-CB 4.46Å; Y154-F225 HydrophobicContact CG-CD2 4.02Å; Y154-F225 HydrophobicContact CG-CG 4.34Å; F155-F225 HydrophobicContact CE2-CZ 4.15Å; F155-F225 HydrophobicContact CZ-CZ 4.34Å; I221-F225 HydrophobicContact CG2-CD2 3.76Å; I221-F225 HydrophobicContact CG2-CE2 3.41Å; I221-F225 VanDerWaalsContact CG2-CE2 3.41Å; I221-F225 HydrophobicContact CG2-CZ 4.16Å; I221-F225 WeakPolarHBondContact O-CD2 3.33Å; I221-F225 PolarHBondContact O-N 3.37Å; H222-F225 PolarHBondContact O-N 3.4Å; N223-F225 VanDerWaalsContact C-N 3.35Å; N223-F225 PolarHBondContact O-N 3.33Å; F225-G227 PolarHBondContact O-N 2.89Å; F225-P296 WeakPolarHBondContact O-CA 3.36Å; F225-V297 HydrophobicContact CD1-CB 3.78Å; F225-V297 HydrophobicContact CD1-CG1 4.09Å; F225-V297 HydrophobicContact CD1-CG2 4.09Å; F225-V297 HydrophobicContact CE1-CB 4.42Å; F225-V297 HydrophobicContact CE1-CG1 4.24Å; F225-V297 PolarHBondContact O-N 3.21Å |
| 226 | E | 87.6 | Confident | 93.3 | Very high | 52 Ų | 52 | 12.1 Ų | 12.1 | 24% | 0.243 | 6% | 0.06 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -15.7 | 170 | -63.5 | -63.6 | 122.8 | 0 | 0 | 113 | Y154 H222 N223 I403 R408 | Y154-E226 PolarHBondContact OH-OE1 3.11Å; Y154-E226 VanDerWaalsContact OH-OE1 3.04Å; H222-E226 WeakPolarHBondContact O-CG 3.41Å; H222-E226 PolarHBondContact O-N 2.94Å; N223-E226 PolarHBondContact O-N 3.49Å; E226-I403 HydrophobicContact CG-CG2 4.46Å; E226-R408 VanDerWaalsContact CD-NE 3.3Å; E226-R408 IonicContact OE1-CZ 3.34Å; E226-R408 IonicContact OE1-NE 3.93Å; E226-R408 IonicContact OE1-NH2 3.11Å; E226-R408 PolarHBondContact OE1-NH2 3.21Å; E226-R408 IonicContact OE2-CZ 3.7Å; E226-R408 IonicContact OE2-NE 3.14Å; E226-R408 PolarHBondContact OE2-NE 3.28Å; E226-R408 IonicContact OE2-NH2 3.32Å |
| 227 | G | 90.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 10.7 Ų | 10.7 | 0% | 0 | 5% | 0.054 | C | C | . | . | trans | 147.6 | 134.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | L224 F225 I229 W230 | L224-G227 CarbonylContact O-C 3.35Å; L224-G227 VanDerWaalsContact O-C 3.28Å; L224-G227 PolarHBondContact O-N 3.43Å; F225-G227 PolarHBondContact O-N 2.89Å; G227-I229 PolarHBondContact O-N 3.29Å; G227-W230 WeakPolarHBondContact O-CB 2.95Å; G227-W230 PolarHBondContact O-N 3.22Å | ||
| 228 | M | 92.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 10.6 Ų | 10.6 | 0% | 0 | 5% | 0.053 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -24.8 | -176.3 | -69.6 | -171.6 | -75.1 | 0 | 0 | 113.1 | P97 L100 L224 W230 F231 I232 Y292 F293 | P97-M228 HydrophobicContact CB-CG 4.42Å; P97-M228 HydrophobicContact CB-SD 4.1Å; P97-M228 HydrophobicContact CG-SD 4.45Å; L100-M228 HydrophobicContact CD1-SD 4.03Å; L224-M228 HydrophobicContact CD1-CB 4.47Å; L224-M228 HydrophobicContact CD1-CG 3.86Å; M228-W230 VanDerWaalsContact C-N 3.25Å; M228-W230 PolarHBondContact O-N 3.46Å; M228-F231 WeakPolarHBondContact O-CB 3.48Å; M228-F231 PolarHBondContact O-N 3.2Å; M228-I232 HydrophobicContact CB-CD1 4.1Å; M228-I232 WeakPolarHBondContact O-CG1 3.25Å; M228-I232 PolarHBondContact O-N 2.95Å; M228-Y292 HydrophobicContact CE-CD1 3.49Å; M228-Y292 VanDerWaalsContact CE-CD1 3.49Å; M228-Y292 HydrophobicContact CE-CD2 4.13Å; M228-Y292 HydrophobicContact CE-CE1 3.26Å; M228-Y292 HydrophobicContact CE-CE2 3.93Å; M228-Y292 HydrophobicContact CE-CG 3.93Å; M228-Y292 WeakPolarHBondContact CE-O 3.37Å; M228-Y292 HydrophobicContact SD-CE1 4.2Å; M228-F293 HydrophobicContact CB-CD1 4.38Å; M228-F293 HydrophobicContact CE-CD1 4.48Å; M228-F293 PolarHBondContact N-O 2.91Å |
| 229 | I | 94.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -60 | -35 | 175.3 | -160.1 | 167.9 | 0 | 0 | 0 | 112.5 | G227 F231 V233 M287 F293 V294 F316 F341 | G227-I229 PolarHBondContact O-N 3.29Å; I229-F231 PolarHBondContact O-N 3.17Å; I229-V233 HydrophobicContact CG1-CG2 3.68Å; I229-V233 WeakPolarHBondContact O-CB 3.2Å; I229-V233 PolarHBondContact O-N 2.97Å; I229-V233 VanDerWaalsContact O-N 3.11Å; I229-M287 HydrophobicContact CD1-CB 3.74Å; I229-M287 HydrophobicContact CG1-CB 4.09Å; I229-M287 HydrophobicContact CG1-CE 4.29Å; I229-F293 HydrophobicContact CB-CB 4.4Å; I229-F293 WeakPolarHBondContact CB-O 3.4Å; I229-F293 PolarHBondContact N-O 3.2Å; I229-V294 HydrophobicContact CD1-CG2 4.35Å; I229-F316 HydrophobicContact CD1-CD1 4.46Å; I229-F316 HydrophobicContact CD1-CE1 4.01Å; I229-F316 HydrophobicContact CG2-CE1 3.83Å; I229-F316 HydrophobicContact CG2-CZ 3.86Å; I229-F341 HydrophobicContact CD1-CD1 3.62Å; I229-F341 HydrophobicContact CD1-CE1 3.34Å; I229-F341 HydrophobicContact CD1-CG 4.41Å; I229-F341 HydrophobicContact CD1-CZ 3.89Å; I229-F341 HydrophobicContact CG1-CD1 4.34Å; I229-F341 HydrophobicContact CG1-CE1 3.55Å; I229-F341 HydrophobicContact CG1-CZ 3.69Å; I229-F341 HydrophobicContact CG2-CE2 4.34Å; I229-F341 HydrophobicContact CG2-CZ 4.21Å |
| 230 | W | 94.2 | Very high | 93.3 | Very high | 7 Ų | 7 | 12 Ų | 12 | 3% | 0.027 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -72.1 | -14.9 | 176.3 | -67.6 | 111.8 | 0 | 0 | 0 | 113.5 | N223 G227 M228 P234 L315 F341 L348 V399 Y402 I403 I407 | N223-W230 WeakPolarHBondContact O-CB 3.31Å; G227-W230 WeakPolarHBondContact O-CB 2.95Å; G227-W230 PolarHBondContact O-N 3.22Å; M228-W230 VanDerWaalsContact C-N 3.25Å; M228-W230 PolarHBondContact O-N 3.46Å; W230-P234 WeakPolarHBondContact O-CD 3.34Å; W230-P234 VanDerWaalsContact O-CG 3.31Å; W230-P234 WeakPolarHBondContact O-CG 3.5Å; W230-L315 HydrophobicContact CH2-CD2 4.42Å; W230-L315 HydrophobicContact CZ2-CD2 3.7Å; W230-F341 HydrophobicContact CD2-CE2 4.07Å; W230-F341 AromaticContact CE2-CE2 3.91Å; W230-F341 AromaticContact CE3-CE2 3.97Å; W230-F341 HydrophobicContact CE3-CE2 3.97Å; W230-F341 AromaticContact CH2-CD2 3.96Å; W230-F341 HydrophobicContact CH2-CD2 3.96Å; W230-F341 AromaticContact CH2-CE2 3.54Å; W230-F341 HydrophobicContact CH2-CE2 3.54Å; W230-F341 AromaticContact CZ2-CD2 3.96Å; W230-F341 HydrophobicContact CZ2-CD2 3.96Å; W230-F341 AromaticContact CZ2-CE2 3.66Å; W230-F341 HydrophobicContact CZ2-CE2 3.66Å; W230-F341 AromaticContact CZ3-CE2 3.73Å; W230-F341 HydrophobicContact CZ3-CE2 3.73Å; W230-L348 HydrophobicContact CE3-CD1 4.29Å; W230-L348 HydrophobicContact CZ3-CD1 4.02Å; W230-V399 HydrophobicContact CE3-CG1 4.29Å; W230-V399 WeakPolarHBondContact O-CG1 3.09Å; W230-Y402 HydrophobicContact CZ3-CD1 4.29Å; W230-I403 HydrophobicContact CB-CD1 3.83Å; W230-I403 HydrophobicContact CD2-CD1 3.54Å; W230-I403 HydrophobicContact CD2-CG1 3.72Å; W230-I403 HydrophobicContact CE3-CD1 3.66Å; W230-I403 HydrophobicContact CE3-CG1 3.55Å; W230-I403 HydrophobicContact CG-CD1 3.63Å; W230-I403 HydrophobicContact CG-CG1 4.32Å; W230-I403 HydrophobicContact CH2-CG1 4.21Å; W230-I403 HydrophobicContact CZ2-CG1 4.33Å; W230-I403 HydrophobicContact CZ3-CD1 4.42Å; W230-I403 HydrophobicContact CZ3-CG1 3.81Å; W230-I407 HydrophobicContact CH2-CD1 3.69Å; W230-I407 HydrophobicContact CH2-CG1 3.52Å; W230-I407 HydrophobicContact CH2-CG2 4.46Å; W230-I407 HydrophobicContact CZ2-CB 4.36Å; W230-I407 HydrophobicContact CZ2-CD1 4.04Å; W230-I407 HydrophobicContact CZ2-CG1 3.8Å; W230-I407 HydrophobicContact CZ2-CG2 3.85Å; W230-I407 HydrophobicContact CZ3-CG1 4.43Å |
| 231 | F | 94.4 | Very high | 93.3 | Very high | 15 Ų | 15 | 11.3 Ų | 11.3 | 7% | 0.066 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -95 | -51.3 | 172.1 | 170.3 | -94 | 0 | 0 | 0 | 111.1 | F89 L100 V104 I220 L224 M228 I229 I235 | F89-F231 HydrophobicContact CE2-CE1 4.15Å; F89-F231 HydrophobicContact CZ-CE1 4.37Å; L100-F231 HydrophobicContact CD2-CD1 4.43Å; L100-F231 HydrophobicContact CD2-CE1 3.62Å; L100-F231 HydrophobicContact CD2-CZ 4.06Å; V104-F231 HydrophobicContact CG2-CE2 3.99Å; V104-F231 HydrophobicContact CG2-CZ 4.37Å; I220-F231 HydrophobicContact CG2-CD2 3.55Å; I220-F231 HydrophobicContact CG2-CE2 3.4Å; I220-F231 VanDerWaalsContact CG2-CE2 3.4Å; L224-F231 HydrophobicContact CB-CB 4.18Å; L224-F231 HydrophobicContact CB-CD2 4.46Å; L224-F231 HydrophobicContact CB-CG 4.48Å; L224-F231 HydrophobicContact CD1-CB 3.84Å; L224-F231 HydrophobicContact CD1-CD1 4.1Å; L224-F231 HydrophobicContact CD1-CD2 4.46Å; L224-F231 HydrophobicContact CD1-CG 3.89Å; M228-F231 WeakPolarHBondContact O-CB 3.48Å; M228-F231 PolarHBondContact O-N 3.2Å; I229-F231 PolarHBondContact O-N 3.17Å; F231-I235 HydrophobicContact CD1-CD1 4.11Å; F231-I235 HydrophobicContact CD2-CD1 3.55Å; F231-I235 HydrophobicContact CE1-CD1 3.74Å; F231-I235 HydrophobicContact CE2-CD1 3.15Å; F231-I235 HydrophobicContact CG-CD1 4.01Å; F231-I235 HydrophobicContact CZ-CD1 3.26Å; F231-I235 WeakPolarHBondContact O-CB 3.32Å; F231-I235 WeakPolarHBondContact O-CG1 3.17Å; F231-I235 PolarHBondContact O-N 3.13Å |
| 232 | I | 94.8 | Very high | 93.1 | Very high | 7 Ų | 7 | 14.8 Ų | 14.8 | 4% | 0.036 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -70.9 | -45.5 | -169.8 | -63.5 | 170.6 | 0 | 0 | 0 | 111.7 | F89 I93 M228 S236 M287 F293 | F89-I232 HydrophobicContact CE1-CG2 4.47Å; I93-I232 HydrophobicContact CD1-CD1 3.84Å; I93-I232 HydrophobicContact CD1-CG1 4.06Å; I93-I232 HydrophobicContact CD1-CG2 4.25Å; I93-I232 HydrophobicContact CG1-CD1 3.97Å; I93-I232 HydrophobicContact CG1-CG1 4.34Å; I93-I232 HydrophobicContact CG2-CD1 3.88Å; M228-I232 HydrophobicContact CB-CD1 4.1Å; M228-I232 WeakPolarHBondContact O-CG1 3.25Å; M228-I232 PolarHBondContact O-N 2.95Å; I232-S236 WeakPolarHBondContact O-CB 3.48Å; I232-S236 PolarHBondContact O-N 3.15Å; I232-S236 PolarHBondContact O-OG 2.85Å; I232-M287 HydrophobicContact CB-CE 3.77Å; I232-M287 HydrophobicContact CB-SD 4.32Å; I232-M287 HydrophobicContact CD1-CE 3.71Å; I232-M287 HydrophobicContact CG1-CE 4.3Å; I232-M287 HydrophobicContact CG2-CE 3.71Å; I232-M287 HydrophobicContact CG2-SD 3.8Å; I232-F293 HydrophobicContact CD1-CD1 3.75Å; I232-F293 HydrophobicContact CD1-CE1 3.82Å |
| 233 | V | 95.4 | Very high | 93 | Very high | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -63.8 | -50.9 | -175.6 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | I229 I235 S236 C237 L283 M287 F341 | I229-V233 HydrophobicContact CG1-CG2 3.68Å; I229-V233 WeakPolarHBondContact O-CB 3.2Å; I229-V233 PolarHBondContact O-N 2.97Å; I229-V233 VanDerWaalsContact O-N 3.11Å; V233-I235 PolarHBondContact O-N 3.36Å; V233-S236 PolarHBondContact O-N 3.29Å; V233-C237 WeakPolarHBondContact O-CB 3.35Å; V233-C237 PolarHBondContact O-N 2.9Å; V233-C237 PolarHBondContact O-SG 3.02Å; V233-L283 HydrophobicContact CB-CD2 4.5Å; V233-L283 HydrophobicContact CG2-CD2 4.1Å; V233-L283 HydrophobicContact CG2-CG 4.2Å; V233-M287 HydrophobicContact CG2-SD 3.71Å; V233-F341 HydrophobicContact CG2-CE1 4.22Å |
| 234 | P | 95.5 | Very high | 93 | Very high | 4 Ų | 4 | 18.7 Ų | 18.7 | 3% | 0.026 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -55 | -49.9 | 174.5 | -34 | 42.5 | 0 | 0 | 0 | 114.8 | W230 S236 C237 V238 L348 M395 V399 | W230-P234 WeakPolarHBondContact O-CD 3.34Å; W230-P234 VanDerWaalsContact O-CG 3.31Å; W230-P234 WeakPolarHBondContact O-CG 3.5Å; P234-S236 VanDerWaalsContact C-N 3.31Å; P234-S236 PolarHBondContact O-N 3.28Å; P234-C237 WeakPolarHBondContact O-CB 3.36Å; P234-C237 PolarHBondContact O-N 2.89Å; P234-V238 PolarHBondContact O-N 3.39Å; P234-L348 HydrophobicContact CG-CD1 4.16Å; P234-M395 HydrophobicContact CB-CE 3.53Å; P234-M395 HydrophobicContact CB-CG 3.85Å; P234-M395 HydrophobicContact CG-CE 4.09Å; P234-V399 HydrophobicContact CB-CG2 3.6Å; P234-V399 HydrophobicContact CG-CG1 4.3Å; P234-V399 HydrophobicContact CG-CG2 3.38Å |
| 235 | I | 94.1 | Very high | 92.9 | Very high | 21 Ų | 21 | 19.9 Ų | 19.9 | 11% | 0.108 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -62 | -44 | -178.8 | -73.2 | 173 | 0 | 0 | 0 | 110.3 | F89 F231 V233 C237 V238 I239 Q392 | F89-I235 HydrophobicContact CE2-CG2 4.49Å; F89-I235 HydrophobicContact CZ-CG2 4.16Å; F231-I235 HydrophobicContact CD1-CD1 4.11Å; F231-I235 HydrophobicContact CD2-CD1 3.55Å; F231-I235 HydrophobicContact CE1-CD1 3.74Å; F231-I235 HydrophobicContact CE2-CD1 3.15Å; F231-I235 HydrophobicContact CG-CD1 4.01Å; F231-I235 HydrophobicContact CZ-CD1 3.26Å; F231-I235 WeakPolarHBondContact O-CB 3.32Å; F231-I235 WeakPolarHBondContact O-CG1 3.17Å; F231-I235 PolarHBondContact O-N 3.13Å; V233-I235 PolarHBondContact O-N 3.36Å; I235-C237 VanDerWaalsContact C-N 3.32Å; I235-C237 PolarHBondContact O-N 2.93Å; I235-V238 PolarHBondContact O-N 3.21Å; I235-I239 HydrophobicContact CG2-CD1 3.79Å; I235-I239 WeakPolarHBondContact O-CG1 3.38Å; I235-I239 PolarHBondContact O-N 3.27Å; I235-Q392 PolarHBondContact O-NE2 3.46Å |
| 236 | S | 94.5 | Very high | 92.8 | Very high | 16 Ų | 16 | 24.3 Ų | 24.3 | 11% | 0.112 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -65.4 | -35.9 | 178.2 | -55.7 | 0 | 0 | 0 | 0 | 111.7 | I232 V233 P234 I239 C240 | I232-S236 WeakPolarHBondContact O-CB 3.48Å; I232-S236 PolarHBondContact O-N 3.15Å; I232-S236 PolarHBondContact O-OG 2.85Å; V233-S236 PolarHBondContact O-N 3.29Å; P234-S236 VanDerWaalsContact C-N 3.31Å; P234-S236 PolarHBondContact O-N 3.28Å; S236-I239 PolarHBondContact O-N 3.39Å; S236-C240 WeakPolarHBondContact O-CB 3.43Å; S236-C240 PolarHBondContact O-N 3.13Å |
| 237 | C | 95.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.8 | -43.4 | 174.8 | -70.1 | 0 | 0 | 0 | 0 | 111.7 | V233 P234 I235 C240 N241 T276 A352 | V233-C237 WeakPolarHBondContact O-CB 3.35Å; V233-C237 PolarHBondContact O-N 2.9Å; V233-C237 PolarHBondContact O-SG 3.02Å; P234-C237 WeakPolarHBondContact O-CB 3.36Å; P234-C237 PolarHBondContact O-N 2.89Å; I235-C237 VanDerWaalsContact C-N 3.32Å; I235-C237 PolarHBondContact O-N 2.93Å; C237-C240 PolarHBondContact O-N 3.1Å; C237-N241 VanDerWaalsContact O-CB 3.31Å; C237-N241 WeakPolarHBondContact O-CB 3.29Å; C237-N241 PolarHBondContact O-N 3.47Å; C237-T276 HydrophobicContact CB-CG2 3.82Å; C237-T276 VanDerWaalsContact O-CG2 3.29Å; C237-T276 WeakPolarHBondContact O-CG2 3.4Å; C237-A352 HydrophobicContact CB-CB 3.83Å |
| 238 | V | 94.5 | Very high | 92.9 | Very high | 3 Ų | 3 | 28.5 Ų | 28.5 | 2% | 0.018 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.4 | -44.7 | 176.2 | 174 | 0 | 0 | 0 | 0 | 111 | P234 I235 N241 D242 A352 C391 Q392 M395 | P234-V238 PolarHBondContact O-N 3.39Å; I235-V238 PolarHBondContact O-N 3.21Å; V238-N241 PolarHBondContact O-N 3.01Å; V238-D242 PolarHBondContact O-N 2.92Å; V238-A352 HydrophobicContact CG2-CB 3.85Å; V238-C391 HydrophobicContact CG1-CB 3.71Å; V238-Q392 HydrophobicContact CG1-CG 4.5Å; V238-Q392 VanDerWaalsContact CG1-NE2 3.35Å; V238-M395 HydrophobicContact CG2-CB 4Å; V238-M395 HydrophobicContact CG2-CG 3.87Å; V238-M395 HydrophobicContact CG2-SD 4.39Å |
| 239 | I | 92.6 | Very high | 92.7 | Very high | 67 Ų | 67 | 29.4 Ų | 29.4 | 34% | 0.344 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -62.1 | -46.1 | 177 | -66.3 | 166.4 | 0 | 0 | 0 | 110.8 | I235 S236 N241 D242 I243 | I235-I239 HydrophobicContact CG2-CD1 3.79Å; I235-I239 WeakPolarHBondContact O-CG1 3.38Å; I235-I239 PolarHBondContact O-N 3.27Å; S236-I239 PolarHBondContact O-N 3.39Å; I239-N241 VanDerWaalsContact C-N 3.31Å; I239-N241 PolarHBondContact O-N 3.13Å; I239-D242 PolarHBondContact O-N 3.49Å; I239-I243 HydrophobicContact CG2-CD1 3.81Å; I239-I243 WeakPolarHBondContact O-CG1 3.48Å; I239-I243 PolarHBondContact O-N 3.23Å |
| 240 | C | 94 | Very high | 92.2 | Very high | 9 Ų | 9 | 34.2 Ų | 34.2 | 6% | 0.061 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.5 | -44.7 | 177.1 | -174.1 | 0 | 0 | 0 | 0 | 110.7 | S236 C237 D242 I243 M244 F279 | S236-C240 WeakPolarHBondContact O-CB 3.43Å; S236-C240 PolarHBondContact O-N 3.13Å; C237-C240 PolarHBondContact O-N 3.1Å; C240-D242 PolarHBondContact O-N 3.4Å; C240-I243 PolarHBondContact O-N 3.22Å; C240-M244 VanDerWaalsContact O-CB 3.29Å; C240-M244 WeakPolarHBondContact O-CB 3.37Å; C240-M244 WeakPolarHBondContact O-CG 3.44Å; C240-M244 PolarHBondContact O-N 3.48Å; C240-F279 HydrophobicContact CB-CD1 3.56Å; C240-F279 HydrophobicContact CB-CE1 3.82Å; C240-F279 HydrophobicContact CB-CG 4.02Å; C240-F279 HydrophobicContact CB-CZ 4.48Å; C240-F279 WeakPolarHBondContact SG-CG 3.36Å |
| 241 | N | 94.7 | Very high | 91.9 | Very high | 4 Ų | 4 | 40.2 Ų | 40.2 | 2% | 0.021 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.1 | -45.6 | 178.2 | -176.2 | 66.9 | 0 | 0 | 0 | 112.1 | C237 V238 I239 I243 M244 A245 T276 S353 | C237-N241 VanDerWaalsContact O-CB 3.31Å; C237-N241 WeakPolarHBondContact O-CB 3.29Å; C237-N241 PolarHBondContact O-N 3.47Å; V238-N241 PolarHBondContact O-N 3.01Å; I239-N241 VanDerWaalsContact C-N 3.31Å; I239-N241 PolarHBondContact O-N 3.13Å; N241-I243 PolarHBondContact O-N 3.24Å; N241-M244 PolarHBondContact O-N 3.07Å; N241-A245 WeakPolarHBondContact O-CB 3.42Å; N241-A245 PolarHBondContact O-N 3.49Å; N241-T276 WeakPolarHBondContact CA-OG1 3.44Å; N241-T276 HydrophobicContact CB-CG2 4.16Å; N241-T276 VanDerWaalsContact CB-OG1 3.28Å; N241-T276 WeakPolarHBondContact CB-OG1 3.43Å; N241-T276 PolarHBondContact N-OG1 2.97Å; N241-T276 PolarHBondContact OD1-OG1 3.11Å; N241-S353 WeakPolarHBondContact OD1-CA 3.35Å; N241-S353 VanDerWaalsContact OD1-CB 3.22Å; N241-S353 WeakPolarHBondContact OD1-CB 3.45Å; N241-S353 PolarHBondContact OD1-OG 3.28Å |
| 242 | D | 89.5 | Confident | 91.8 | Very high | 72 Ų | 72 | 45.8 Ų | 45.8 | 39% | 0.385 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.9 | -40.8 | 178.7 | -79.9 | -14.5 | 0 | 0 | 0 | 112.2 | V238 I239 C240 Y246 | V238-D242 PolarHBondContact O-N 2.92Å; I239-D242 PolarHBondContact O-N 3.49Å; C240-D242 PolarHBondContact O-N 3.4Å; D242-Y246 WeakPolarHBondContact O-CB 3.31Å; D242-Y246 PolarHBondContact O-N 3.04Å; D242-Y246 VanDerWaalsContact O-N 3.17Å |
| 243 | I | 89.2 | Confident | 91.3 | Very high | 57 Ų | 57 | 46.8 Ų | 46.8 | 29% | 0.292 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -66.5 | -49.9 | 176.9 | -66.3 | 168.8 | 0 | 0 | 0 | 110.5 | T82 I239 C240 N241 Y246 M247 | T82-I243 HydrophobicContact CG2-CD1 4.22Å; I239-I243 HydrophobicContact CG2-CD1 3.81Å; I239-I243 WeakPolarHBondContact O-CG1 3.48Å; I239-I243 PolarHBondContact O-N 3.23Å; C240-I243 PolarHBondContact O-N 3.22Å; N241-I243 PolarHBondContact O-N 3.24Å; I243-Y246 WeakPolarHBondContact O-CB 3.29Å; I243-Y246 PolarHBondContact O-N 3.33Å; I243-M247 HydrophobicContact CG2-CG 4.43Å; I243-M247 HydrophobicContact CG2-SD 3.97Å; I243-M247 WeakPolarHBondContact O-CG 3.32Å; I243-M247 PolarHBondContact O-N 3.33Å |
| 244 | M | 92.3 | Very high | 90.9 | Very high | 56 Ų | 56 | 57.5 Ų | 57.5 | 28% | 0.276 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -69.2 | -40.7 | -175.8 | -67.4 | -64 | 165.6 | 0 | 0 | 111.3 | C240 N241 Y246 M247 F248 A275 | C240-M244 VanDerWaalsContact O-CB 3.29Å; C240-M244 WeakPolarHBondContact O-CB 3.37Å; C240-M244 WeakPolarHBondContact O-CG 3.44Å; C240-M244 PolarHBondContact O-N 3.48Å; N241-M244 PolarHBondContact O-N 3.07Å; M244-Y246 VanDerWaalsContact C-N 3.27Å; M244-Y246 PolarHBondContact O-N 3.44Å; M244-M247 PolarHBondContact O-N 3.3Å; M244-M247 VanDerWaalsContact O-N 3.14Å; M244-M247 HydrophobicContact SD-SD 4.14Å; M244-F248 HydrophobicContact CB-CD2 4.39Å; M244-F248 VanDerWaalsContact O-CD2 3.25Å; M244-F248 WeakPolarHBondContact O-CD2 3.49Å; M244-F248 PolarHBondContact O-N 3.07Å; M244-A275 HydrophobicContact CB-CB 3.81Å; M244-A275 HydrophobicContact CG-CB 3.63Å; M244-A275 HydrophobicContact SD-CB 4.09Å |
| 245 | A | 91.4 | Very high | 90.6 | Very high | 26 Ų | 26 | 60.4 Ų | 60.4 | 22% | 0.215 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.6 | -37.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112 | N241 G249 G268 | N241-A245 WeakPolarHBondContact O-CB 3.42Å; N241-A245 PolarHBondContact O-N 3.49Å; A245-G249 WeakPolarHBondContact O-CA 3.42Å; A245-G249 PolarHBondContact O-N 2.71Å; A245-G268 VanDerWaalsContact CA-O 3.3Å; A245-G268 WeakPolarHBondContact CA-O 3.45Å; A245-G268 WeakPolarHBondContact O-CA 3.26Å |
| 246 | Y | 86.7 | Confident | 90.3 | Very high | 95 Ų | 95 | 63.2 Ų | 63.2 | 37% | 0.373 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -66.8 | -44.5 | 171.9 | 173.3 | -103.6 | 0 | 0 | 0 | 112.3 | W75 D242 I243 M244 G249 F250 | W75-Y246 AromaticContact CE3-CE1 3.82Å; W75-Y246 HydrophobicContact CE3-CE1 3.82Å; W75-Y246 HydrophobicContact CH2-CE1 4.11Å; W75-Y246 HydrophobicContact CZ3-CD1 4.29Å; W75-Y246 AromaticContact CZ3-CE1 3.33Å; W75-Y246 HydrophobicContact CZ3-CE1 3.33Å; W75-Y246 AromaticContact CZ3-CZ 3.9Å; D242-Y246 WeakPolarHBondContact O-CB 3.31Å; D242-Y246 PolarHBondContact O-N 3.04Å; D242-Y246 VanDerWaalsContact O-N 3.17Å; I243-Y246 WeakPolarHBondContact O-CB 3.29Å; I243-Y246 PolarHBondContact O-N 3.33Å; M244-Y246 VanDerWaalsContact C-N 3.27Å; M244-Y246 PolarHBondContact O-N 3.44Å; Y246-G249 PolarHBondContact O-N 3.26Å; Y246-F250 VanDerWaalsContact O-CB 3.28Å; Y246-F250 WeakPolarHBondContact O-CB 3.45Å; Y246-F250 PolarHBondContact O-N 3.49Å |
| 247 | M | 88.4 | Confident | 89.9 | Confident | 70 Ų | 70 | 64.4 Ų | 64.4 | 35% | 0.345 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.4 | -52.7 | 178.9 | -73.6 | 179.8 | 63.8 | 0 | 0 | 111.9 | I243 M244 G249 F250 F251 | I243-M247 HydrophobicContact CG2-CG 4.43Å; I243-M247 HydrophobicContact CG2-SD 3.97Å; I243-M247 WeakPolarHBondContact O-CG 3.32Å; I243-M247 PolarHBondContact O-N 3.33Å; M244-M247 PolarHBondContact O-N 3.3Å; M244-M247 VanDerWaalsContact O-N 3.14Å; M244-M247 HydrophobicContact SD-SD 4.14Å; M247-G249 VanDerWaalsContact C-N 3.31Å; M247-G249 PolarHBondContact O-N 3.47Å; M247-F250 PolarHBondContact O-N 3.43Å; M247-F251 WeakPolarHBondContact O-CD2 3.22Å; M247-F251 PolarHBondContact O-N 3.24Å; M247-F251 VanDerWaalsContact O-N 3.11Å |
| 248 | F | 91.5 | Very high | 89.3 | Confident | 70 Ų | 70 | 67.6 Ų | 67.6 | 31% | 0.307 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64.1 | -37.6 | 177.3 | -77.7 | -76.6 | 0 | 0 | 0 | 111.7 | M244 F250 F252 G253 A275 | M244-F248 HydrophobicContact CB-CD2 4.39Å; M244-F248 VanDerWaalsContact O-CD2 3.25Å; M244-F248 WeakPolarHBondContact O-CD2 3.49Å; M244-F248 PolarHBondContact O-N 3.07Å; F248-F250 VanDerWaalsContact C-N 3.34Å; F248-F250 PolarHBondContact O-N 2.93Å; F248-F252 AromaticContact CD1-CD2 3.92Å; F248-F252 HydrophobicContact CD1-CD2 3.92Å; F248-F252 HydrophobicContact CD1-CE2 4.14Å; F248-F252 HydrophobicContact CE1-CE2 4.46Å; F248-F252 WeakPolarHBondContact O-CA 3.43Å; F248-F252 WeakPolarHBondContact O-CB 3.38Å; F248-F252 PolarHBondContact O-N 2.98Å; F248-G253 PolarHBondContact O-N 3.49Å; F248-A275 HydrophobicContact CE2-CB 4.1Å |
| 249 | G | 87.9 | Confident | 88.5 | Confident | 18 Ų | 18 | 77.5 Ų | 77.5 | 19% | 0.186 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -64.2 | -35.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | A245 Y246 M247 G253 T265 | A245-G249 WeakPolarHBondContact O-CA 3.42Å; A245-G249 PolarHBondContact O-N 2.71Å; Y246-G249 PolarHBondContact O-N 3.26Å; M247-G249 VanDerWaalsContact C-N 3.31Å; M247-G249 PolarHBondContact O-N 3.47Å; G249-G253 WeakPolarHBondContact O-CA 3.33Å; G249-G253 PolarHBondContact O-N 2.81Å; G249-T265 WeakPolarHBondContact CA-OG1 2.85Å |
| 250 | F | 84.6 | Confident | 87.8 | Confident | 101 Ų | 101 | 77.7 Ų | 77.7 | 44% | 0.443 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -70.6 | -41.8 | 178.3 | -178.6 | -94.9 | 0 | 0 | 0 | 112.7 | W75 Y246 M247 F248 | W75-F250 HydrophobicContact CZ3-CD1 4.25Å; W75-F250 HydrophobicContact CZ3-CG 4.26Å; Y246-F250 VanDerWaalsContact O-CB 3.28Å; Y246-F250 WeakPolarHBondContact O-CB 3.45Å; Y246-F250 PolarHBondContact O-N 3.49Å; M247-F250 PolarHBondContact O-N 3.43Å; F248-F250 VanDerWaalsContact C-N 3.34Å; F248-F250 PolarHBondContact O-N 2.93Å |
| 251 | F | 88.4 | Confident | 86.7 | Confident | 134 Ų | 134 | 78.3 Ų | 78.3 | 59% | 0.588 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -85.3 | -37.3 | -177.3 | -71.6 | -68.3 | 0 | 0 | 0 | 113.8 | M247 | M247-F251 WeakPolarHBondContact O-CD2 3.22Å; M247-F251 PolarHBondContact O-N 3.24Å; M247-F251 VanDerWaalsContact O-N 3.11Å |
| 252 | F | 90.8 | Very high | 85.4 | Confident | 132 Ų | 132 | 82.7 Ų | 82.7 | 58% | 0.579 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -121.1 | -4.5 | -170.5 | -56.9 | -79.6 | 0 | 0 | 0 | 113.7 | F248 R254 E267 | F248-F252 AromaticContact CD1-CD2 3.92Å; F248-F252 HydrophobicContact CD1-CD2 3.92Å; F248-F252 HydrophobicContact CD1-CE2 4.14Å; F248-F252 HydrophobicContact CE1-CE2 4.46Å; F248-F252 WeakPolarHBondContact O-CA 3.43Å; F248-F252 WeakPolarHBondContact O-CB 3.38Å; F248-F252 PolarHBondContact O-N 2.98Å; F252-R254 PolarHBondContact O-N 3.15Å; F252-E267 HydrophobicContact CB-CB 4.4Å |
| 253 | G | 85.5 | Confident | 84.7 | Confident | 28 Ų | 28 | 88.6 Ų | 88.6 | 29% | 0.289 | 44% | 0.435 | S | S | . | . | trans | -67.6 | 123 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | F248 G249 E267 | F248-G253 PolarHBondContact O-N 3.49Å; G249-G253 WeakPolarHBondContact O-CA 3.33Å; G249-G253 PolarHBondContact O-N 2.81Å; G253-E267 WeakPolarHBondContact CA-OE2 3.26Å | ||
| 254 | R | 87.5 | Confident | 84.5 | Confident | 225 Ų | 225 | 89 Ų | 89 | 85% | 0.849 | 43% | 0.434 | S | S | * | . | trans | -131.4 | -30.9 | 175.3 | -64.1 | -176.9 | -177.3 | 179.6 | 1.3 | 112.1 | F252 E267 | F252-R254 PolarHBondContact O-N 3.15Å; R254-E267 PolarHBondContact N-OE1 3.39Å; R254-E267 PolarHBondContact N-OE2 3.37Å | ||
| 255 | T | 89.3 | Confident | 84.4 | Confident | 64 Ų | 64 | 87.3 Ų | 87.3 | 39% | 0.393 | 43% | 0.427 | S | S | . | . | S | Bend | trans | -111.8 | 118.4 | -172.9 | 54.3 | 0 | 0 | 0 | 0 | 111.8 | T265 W266 E267 | T255-T265 CarbonylContact O-C 3.5Å; T255-T265 WeakPolarHBondContact O-CA 3.44Å; T255-T265 VanDerWaalsContact O-CB 3.25Å; T255-T265 WeakPolarHBondContact O-CB 3.4Å; T255-W266 PolarHBondContact O-N 2.92Å; T255-E267 PolarHBondContact N-OE1 2.84Å; T255-E267 PolarHBondContact N-OE2 2.99Å; T255-E267 VanDerWaalsContact OG1-CD 3.23Å; T255-E267 PolarHBondContact OG1-OE1 3.29Å; T255-E267 PolarHBondContact OG1-OE2 3.42Å |
| 256 | P | 87.7 | Confident | 84.5 | Confident | 81 Ų | 81 | 92.3 Ų | 92.3 | 53% | 0.526 | 44% | 0.441 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.3 | 141.2 | -179.8 | 28.2 | -33.7 | 0 | 0 | 0 | 111.4 | K264 | P256-K264 WeakPolarHBondContact CA-O 3.41Å |
| 257 | L | 85.9 | Confident | 84.8 | Confident | 40 Ų | 40 | 90.2 Ų | 90.2 | 21% | 0.209 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.5 | -45.5 | -176.5 | -176.1 | 64.2 | 0 | 0 | 0 | 112.4 | K264 W266 F269 F361 | L257-K264 HydrophobicContact CB-CB 4.38Å; L257-K264 WeakPolarHBondContact CB-O 3.43Å; L257-K264 PolarHBondContact N-O 3.12Å; L257-W266 HydrophobicContact CD1-CD2 3.52Å; L257-W266 HydrophobicContact CD1-CE3 4.03Å; L257-W266 HydrophobicContact CD1-CG 3.87Å; L257-W266 HydrophobicContact CD1-CH2 4.25Å; L257-W266 HydrophobicContact CD1-CZ2 3.77Å; L257-W266 HydrophobicContact CD1-CZ3 4.37Å; L257-F269 HydrophobicContact CD2-CB 4.32Å; L257-F269 HydrophobicContact CD2-CD2 4.16Å; L257-F269 HydrophobicContact CD2-CG 4.34Å; L257-F361 HydrophobicContact CD2-CE2 4.3Å; L257-F361 HydrophobicContact CD2-CZ 3.79Å |
| 258 | I | 82.9 | Confident | 85 | Confident | 68 Ų | 68 | 86.9 Ų | 86.9 | 35% | 0.349 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.4 | 141.5 | -177 | -168 | 171.5 | 0 | 0 | 0 | 111.2 | L260 S261 F361 | I258-L260 VanDerWaalsContact C-N 3.26Å; I258-L260 HydrophobicContact CD1-CB 4.32Å; I258-L260 HydrophobicContact CG1-CB 4.26Å; I258-L260 PolarHBondContact O-N 3.34Å; I258-S261 CarbonylContact O-C 3.28Å; I258-S261 PolarHBondContact O-N 3.29Å; I258-F361 HydrophobicContact CG2-CD1 4.19Å; I258-F361 HydrophobicContact CG2-CE1 3.91Å; I258-F361 HydrophobicContact CG2-CZ 4.41Å |
| 259 | K | 78.2 | Confident | 85 | Confident | 210 Ų | 210 | 85.4 Ų | 85.4 | 91% | 0.913 | 41% | 0.412 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -35 | 179.3 | -68.6 | -173.4 | 178 | -176.6 | 0 | 113.3 | S261 | K259-S261 PolarHBondContact O-N 3.3Š|
| 260 | L | 77.3 | Confident | 85.3 | Confident | 71 Ų | 71 | 89.5 Ų | 89.5 | 37% | 0.372 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -24.3 | 177.3 | -175.3 | 65.6 | 0 | 0 | 0 | 112.7 | I258 R368 | I258-L260 VanDerWaalsContact C-N 3.26Å; I258-L260 HydrophobicContact CD1-CB 4.32Å; I258-L260 HydrophobicContact CG1-CB 4.26Å; I258-L260 PolarHBondContact O-N 3.34Å; L260-R368 HydrophobicContact CD1-CB 4.41Å; L260-R368 HydrophobicContact CD1-CG 3.94Å |
| 261 | S | 70.3 | Confident | 85.8 | Confident | 22 Ų | 22 | 85.3 Ų | 85.3 | 15% | 0.154 | 41% | 0.414 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.6 | 76.8 | -177.1 | -159.6 | 0 | 0 | 0 | 0 | 110.7 | I258 K259 K263 K264 | I258-S261 CarbonylContact O-C 3.28Å; I258-S261 PolarHBondContact O-N 3.29Å; K259-S261 PolarHBondContact O-N 3.3Å; S261-K263 PolarHBondContact O-N 2.93Å; S261-K264 PolarHBondContact O-N 3.24Å; S261-K264 VanDerWaalsContact O-N 3.09Å |
| 262 | P | 67.4 | Low | 86.1 | Confident | 97 Ų | 97 | 78.9 Ų | 78.9 | 63% | 0.63 | 39% | 0.386 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -65.1 | -14.9 | -171.9 | 25.2 | -34.4 | 0 | 0 | 0 | 113.8 | ||
| 263 | K | 75.8 | Confident | 86.3 | Confident | 195 Ų | 195 | 74.7 Ų | 74.7 | 85% | 0.848 | 37% | 0.369 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -82.5 | -15.1 | 177.8 | -65.6 | -176.2 | 179.8 | 178.8 | 0 | 113.8 | S261 | S261-K263 PolarHBondContact O-N 2.93Å |
| 264 | K | 84.3 | Confident | 86.8 | Confident | 65 Ų | 65 | 80.3 Ų | 80.3 | 28% | 0.283 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 132.8 | 176.2 | -60.8 | -150.3 | -157.6 | 174.8 | 0 | 109.5 | P256 L257 S261 F361 | P256-K264 WeakPolarHBondContact CA-O 3.41Å; L257-K264 HydrophobicContact CB-CB 4.38Å; L257-K264 WeakPolarHBondContact CB-O 3.43Å; L257-K264 PolarHBondContact N-O 3.12Å; S261-K264 PolarHBondContact O-N 3.24Å; S261-K264 VanDerWaalsContact O-N 3.09Å; K264-F361 HydrophobicContact CD-CE1 3.46Å; K264-F361 VanDerWaalsContact CD-CE1 3.46Å; K264-F361 HydrophobicContact CD-CZ 3.78Å; K264-F361 VanDerWaalsContact CE-CE1 3.44Å; K264-F361 HydrophobicContact CG-CE1 4.31Å; K264-F361 VanDerWaalsContact NZ-CE1 3.31Å |
| 265 | T | 91.4 | Very high | 87.2 | Confident | 21 Ų | 21 | 70.4 Ų | 70.4 | 13% | 0.129 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 155.5 | -176.1 | 64.7 | 0 | 0 | 0 | 0 | 112.6 | G249 T255 E267 G268 F269 | G249-T265 WeakPolarHBondContact CA-OG1 2.85Å; T255-T265 CarbonylContact O-C 3.5Å; T255-T265 WeakPolarHBondContact O-CA 3.44Å; T255-T265 VanDerWaalsContact O-CB 3.25Å; T255-T265 WeakPolarHBondContact O-CB 3.4Å; T265-E267 VanDerWaalsContact C-N 3.33Å; T265-E267 WeakPolarHBondContact CB-OE2 3.35Å; T265-G268 PolarHBondContact O-N 2.89Å; T265-G268 PolarHBondContact OG1-N 2.9Å; T265-G268 VanDerWaalsContact OG1-N 3.17Å; T265-F269 PolarHBondContact O-N 3.5Å |
| 266 | W | 92.1 | Very high | 87.6 | Confident | 131 Ų | 131 | 67.3 Ų | 67.3 | 50% | 0.496 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -63.9 | -39 | 174.8 | -88.1 | 98.7 | 0 | 0 | 0 | 111.9 | T255 L257 G268 F269 I270 | T255-W266 PolarHBondContact O-N 2.92Å; L257-W266 HydrophobicContact CD1-CD2 3.52Å; L257-W266 HydrophobicContact CD1-CE3 4.03Å; L257-W266 HydrophobicContact CD1-CG 3.87Å; L257-W266 HydrophobicContact CD1-CH2 4.25Å; L257-W266 HydrophobicContact CD1-CZ2 3.77Å; L257-W266 HydrophobicContact CD1-CZ3 4.37Å; W266-G268 VanDerWaalsContact C-N 3.3Å; W266-G268 PolarHBondContact O-N 2.94Å; W266-F269 PolarHBondContact O-N 2.88Å; W266-I270 HydrophobicContact CE3-CD1 4.47Å; W266-I270 WeakPolarHBondContact O-CG1 3.32Å; W266-I270 PolarHBondContact O-N 3.33Å |
| 267 | E | 93.3 | Very high | 88.1 | Confident | 51 Ų | 51 | 65.4 Ų | 65.4 | 24% | 0.238 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -65 | -38.5 | 178.5 | -54.8 | 85.6 | 178.5 | 0 | 0 | 111 | F252 G253 R254 T255 T265 G271 | F252-E267 HydrophobicContact CB-CB 4.4Å; G253-E267 WeakPolarHBondContact CA-OE2 3.26Å; R254-E267 PolarHBondContact N-OE1 3.39Å; R254-E267 PolarHBondContact N-OE2 3.37Å; T255-E267 PolarHBondContact N-OE1 2.84Å; T255-E267 PolarHBondContact N-OE2 2.99Å; T255-E267 VanDerWaalsContact OG1-CD 3.23Å; T255-E267 PolarHBondContact OG1-OE1 3.29Å; T255-E267 PolarHBondContact OG1-OE2 3.42Å; T265-E267 VanDerWaalsContact C-N 3.33Å; T265-E267 WeakPolarHBondContact CB-OE2 3.35Å; E267-G271 PolarHBondContact O-N 3.47Å |
| 268 | G | 92.7 | Very high | 88.6 | Confident | 1 Ų | 1 | 66.5 Ų | 66.5 | 1% | 0.01 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | A245 T265 W266 G272 | A245-G268 VanDerWaalsContact CA-O 3.3Å; A245-G268 WeakPolarHBondContact CA-O 3.45Å; A245-G268 WeakPolarHBondContact O-CA 3.26Å; T265-G268 PolarHBondContact O-N 2.89Å; T265-G268 PolarHBondContact OG1-N 2.9Å; T265-G268 VanDerWaalsContact OG1-N 3.17Å; W266-G268 VanDerWaalsContact C-N 3.3Å; W266-G268 PolarHBondContact O-N 2.94Å; G268-G272 PolarHBondContact O-N 2.92Å |
| 269 | F | 92.4 | Very high | 89.2 | Confident | 39 Ų | 39 | 66.8 Ų | 66.8 | 17% | 0.171 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.7 | -46.7 | 179.2 | -175.3 | -102 | 0 | 0 | 0 | 112.6 | L257 T265 W266 G272 L273 S353 P357 | L257-F269 HydrophobicContact CD2-CB 4.32Å; L257-F269 HydrophobicContact CD2-CD2 4.16Å; L257-F269 HydrophobicContact CD2-CG 4.34Å; T265-F269 PolarHBondContact O-N 3.5Å; W266-F269 PolarHBondContact O-N 2.88Å; F269-G272 PolarHBondContact O-N 3.33Å; F269-L273 PolarHBondContact O-N 3.49Å; F269-S353 WeakPolarHBondContact CE2-O 3.3Å; F269-P357 HydrophobicContact CE2-CG 4.25Å |
| 270 | I | 94.2 | Very high | 90.1 | Very high | 103 Ų | 103 | 56.8 Ų | 56.8 | 53% | 0.528 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -69.3 | -43.1 | 179.7 | -63.2 | 167.1 | 0 | 0 | 0 | 111.3 | W266 G272 L273 F274 | W266-I270 HydrophobicContact CE3-CD1 4.47Å; W266-I270 WeakPolarHBondContact O-CG1 3.32Å; W266-I270 PolarHBondContact O-N 3.33Å; I270-G272 VanDerWaalsContact C-N 3.33Å; I270-G272 PolarHBondContact O-N 2.88Å; I270-L273 WeakPolarHBondContact O-CB 3.13Å; I270-L273 PolarHBondContact O-N 3.34Å; I270-F274 PolarHBondContact O-N 3.48Å |
| 271 | G | 93.8 | Very high | 91 | Very high | 13 Ų | 13 | 56 Ų | 56 | 13% | 0.134 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63.7 | -39.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | E267 F274 A275 | E267-G271 PolarHBondContact O-N 3.47Å; G271-F274 PolarHBondContact O-N 2.87Å; G271-A275 WeakPolarHBondContact O-CB 3.32Å; G271-A275 PolarHBondContact O-N 3.39Å |
| 272 | G | 94.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.1 | -44.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | G268 F269 I270 A275 T276 | G268-G272 PolarHBondContact O-N 2.92Å; F269-G272 PolarHBondContact O-N 3.33Å; I270-G272 VanDerWaalsContact C-N 3.33Å; I270-G272 PolarHBondContact O-N 2.88Å; G272-A275 PolarHBondContact O-N 3.26Å; G272-T276 VanDerWaalsContact O-CB 3.24Å; G272-T276 WeakPolarHBondContact O-CB 3.3Å; G272-T276 PolarHBondContact O-N 2.99Å; G272-T276 PolarHBondContact O-OG1 3.34Å |
| 273 | L | 95.8 | Very high | 93.5 | Very high | 43 Ų | 43 | 58.2 Ų | 58.2 | 23% | 0.225 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -58 | -53.8 | 176.8 | 176.4 | 62.2 | 0 | 0 | 0 | 112.5 | F269 I270 A275 T276 I277 S353 I354 | F269-L273 PolarHBondContact O-N 3.49Å; I270-L273 WeakPolarHBondContact O-CB 3.13Å; I270-L273 PolarHBondContact O-N 3.34Å; L273-A275 PolarHBondContact O-N 3.47Å; L273-T276 PolarHBondContact O-N 3.37Å; L273-I277 HydrophobicContact CD1-CD1 3.77Å; L273-I277 HydrophobicContact CD1-CG1 4.28Å; L273-I277 HydrophobicContact CG-CD1 4.12Å; L273-I277 WeakPolarHBondContact O-CG1 3.26Å; L273-I277 PolarHBondContact O-N 2.61Å; L273-S353 WeakPolarHBondContact CA-OG 3.44Å; L273-S353 WeakPolarHBondContact CB-OG 3.26Å; L273-S353 PolarHBondContact N-OG 2.99Å; L273-I354 HydrophobicContact CD1-CD1 4.22Å; L273-I354 HydrophobicContact CD1-CG1 3.92Å; L273-I354 HydrophobicContact CD2-CD1 4.42Å; L273-I354 HydrophobicContact CD2-CG1 4.32Å |
| 274 | F | 96 | Very high | 94.4 | Very high | 146 Ų | 146 | 49 Ų | 49 | 64% | 0.64 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -59.9 | -48.1 | -179.6 | 178.1 | -100.2 | 0 | 0 | 0 | 111.5 | I270 G271 T276 I277 V278 | I270-F274 PolarHBondContact O-N 3.48Å; G271-F274 PolarHBondContact O-N 2.87Å; F274-T276 VanDerWaalsContact C-N 3.34Å; F274-T276 PolarHBondContact O-N 3.38Å; F274-I277 PolarHBondContact O-N 2.86Å; F274-V278 HydrophobicContact CE1-CG2 4.16Å; F274-V278 HydrophobicContact CE2-CG2 4.31Å; F274-V278 HydrophobicContact CZ-CG2 4.02Å; F274-V278 WeakPolarHBondContact O-CG2 3.27Å; F274-V278 PolarHBondContact O-N 2.82Å; F274-V278 VanDerWaalsContact O-N 3.16Å |
| 275 | A | 96.3 | Very high | 94.9 | Very high | 17 Ų | 17 | 51.7 Ų | 51.7 | 14% | 0.14 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64.1 | -37.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | M244 F248 G271 G272 L273 V278 F279 | M244-A275 HydrophobicContact CB-CB 3.81Å; M244-A275 HydrophobicContact CG-CB 3.63Å; M244-A275 HydrophobicContact SD-CB 4.09Å; F248-A275 HydrophobicContact CE2-CB 4.1Å; G271-A275 WeakPolarHBondContact O-CB 3.32Å; G271-A275 PolarHBondContact O-N 3.39Å; G272-A275 PolarHBondContact O-N 3.26Å; L273-A275 PolarHBondContact O-N 3.47Å; A275-V278 PolarHBondContact O-N 3.47Å; A275-F279 VanDerWaalsContact O-CB 3.22Å; A275-F279 WeakPolarHBondContact O-CB 3.3Å; A275-F279 PolarHBondContact O-N 2.91Å |
| 276 | T | 96.8 | Very high | 95 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -69.1 | -37.8 | -179.9 | -54.8 | 0 | 0 | 0 | 0 | 111.9 | C237 N241 G272 L273 F274 F279 G280 S349 | C237-T276 HydrophobicContact CB-CG2 3.82Å; C237-T276 VanDerWaalsContact O-CG2 3.29Å; C237-T276 WeakPolarHBondContact O-CG2 3.4Å; N241-T276 WeakPolarHBondContact CA-OG1 3.44Å; N241-T276 HydrophobicContact CB-CG2 4.16Å; N241-T276 VanDerWaalsContact CB-OG1 3.28Å; N241-T276 WeakPolarHBondContact CB-OG1 3.43Å; N241-T276 PolarHBondContact N-OG1 2.97Å; N241-T276 PolarHBondContact OD1-OG1 3.11Å; G272-T276 VanDerWaalsContact O-CB 3.24Å; G272-T276 WeakPolarHBondContact O-CB 3.3Å; G272-T276 PolarHBondContact O-N 2.99Å; G272-T276 PolarHBondContact O-OG1 3.34Å; L273-T276 PolarHBondContact O-N 3.37Å; F274-T276 VanDerWaalsContact C-N 3.34Å; F274-T276 PolarHBondContact O-N 3.38Å; T276-F279 PolarHBondContact O-N 3.38Å; T276-G280 PolarHBondContact O-N 3.34Å; T276-S349 WeakPolarHBondContact O-CB 3.45Å |
| 277 | I | 97.4 | Very high | 95.1 | Very high | 41 Ų | 41 | 48.8 Ų | 48.8 | 21% | 0.21 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.6 | -48.9 | 175.5 | -68.9 | 168.9 | 0 | 0 | 0 | 110.4 | L273 F274 F279 G280 I281 I346 | L273-I277 HydrophobicContact CD1-CD1 3.77Å; L273-I277 HydrophobicContact CD1-CG1 4.28Å; L273-I277 HydrophobicContact CG-CD1 4.12Å; L273-I277 WeakPolarHBondContact O-CG1 3.26Å; L273-I277 PolarHBondContact O-N 2.61Å; F274-I277 PolarHBondContact O-N 2.86Å; I277-F279 VanDerWaalsContact C-N 3.31Å; I277-F279 PolarHBondContact O-N 2.89Å; I277-G280 PolarHBondContact O-N 3.47Å; I277-I281 HydrophobicContact CG2-CD1 3.96Å; I277-I281 WeakPolarHBondContact O-CG1 3.41Å; I277-I281 PolarHBondContact O-N 3.36Å; I277-I346 HydrophobicContact CG2-CG2 4.49Å |
| 278 | V | 96.7 | Very high | 95.1 | Very high | 63 Ų | 63 | 46.7 Ų | 46.7 | 38% | 0.382 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -59.2 | -45.4 | 177.5 | 174 | 0 | 0 | 0 | 0 | 110.6 | F274 A275 I281 M282 | F274-V278 HydrophobicContact CE1-CG2 4.16Å; F274-V278 HydrophobicContact CE2-CG2 4.31Å; F274-V278 HydrophobicContact CZ-CG2 4.02Å; F274-V278 WeakPolarHBondContact O-CG2 3.27Å; F274-V278 PolarHBondContact O-N 2.82Å; F274-V278 VanDerWaalsContact O-N 3.16Å; A275-V278 PolarHBondContact O-N 3.47Å; V278-I281 PolarHBondContact O-N 3.19Å; V278-M282 WeakPolarHBondContact O-CG 3.4Å; V278-M282 PolarHBondContact O-N 3.43Å |
| 279 | F | 97.1 | Very high | 94.9 | Very high | 73 Ų | 73 | 48.9 Ų | 48.9 | 32% | 0.32 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -61.3 | -44.2 | 176.4 | 176.1 | -100.6 | 0 | 0 | 0 | 112.4 | C240 A275 T276 I277 M282 L283 | C240-F279 HydrophobicContact CB-CD1 3.56Å; C240-F279 HydrophobicContact CB-CE1 3.82Å; C240-F279 HydrophobicContact CB-CG 4.02Å; C240-F279 HydrophobicContact CB-CZ 4.48Å; C240-F279 WeakPolarHBondContact SG-CG 3.36Å; A275-F279 VanDerWaalsContact O-CB 3.22Å; A275-F279 WeakPolarHBondContact O-CB 3.3Å; A275-F279 PolarHBondContact O-N 2.91Å; T276-F279 PolarHBondContact O-N 3.38Å; I277-F279 VanDerWaalsContact C-N 3.31Å; I277-F279 PolarHBondContact O-N 2.89Å; F279-M282 PolarHBondContact O-N 3.22Å; F279-L283 HydrophobicContact CE1-CB 4.47Å; F279-L283 HydrophobicContact CE1-CD2 3.8Å; F279-L283 HydrophobicContact CZ-CB 4.46Å; F279-L283 HydrophobicContact CZ-CD2 3.91Å; F279-L283 VanDerWaalsContact O-CB 3.28Å; F279-L283 WeakPolarHBondContact O-CB 3.4Å; F279-L283 PolarHBondContact O-N 3.32Å |
| 280 | G | 96.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -59.4 | -47.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | T276 I277 M282 L283 S284 S345 | T276-G280 PolarHBondContact O-N 3.34Å; I277-G280 PolarHBondContact O-N 3.47Å; G280-M282 VanDerWaalsContact C-N 3.35Å; G280-M282 PolarHBondContact O-N 3.19Å; G280-L283 PolarHBondContact O-N 3.01Å; G280-S284 VanDerWaalsContact O-CB 3.25Å; G280-S284 WeakPolarHBondContact O-CB 3.26Å; G280-S284 PolarHBondContact O-N 3.42Å; G280-S284 PolarHBondContact O-OG 2.83Å; G280-S345 PolarHBondContact O-OG 3Å |
| 281 | I | 95.4 | Very high | 94.6 | Very high | 54 Ų | 54 | 55 Ų | 55 | 28% | 0.277 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.1 | -42.7 | 177.3 | -65.3 | 168 | 0 | 0 | 0 | 111.4 | I277 V278 S284 Y285 Q342 I346 | I277-I281 HydrophobicContact CG2-CD1 3.96Å; I277-I281 WeakPolarHBondContact O-CG1 3.41Å; I277-I281 PolarHBondContact O-N 3.36Å; V278-I281 PolarHBondContact O-N 3.19Å; I281-S284 WeakPolarHBondContact CA-OG 3.45Å; I281-S284 PolarHBondContact O-OG 3.44Å; I281-Y285 WeakPolarHBondContact O-CB 3.45Å; I281-Y285 PolarHBondContact O-N 3.47Å; I281-Y285 VanDerWaalsContact O-N 3.12Å; I281-Q342 PolarHBondContact O-NE2 3.49Å; I281-I346 HydrophobicContact CD1-CD1 3.98Å; I281-I346 HydrophobicContact CD1-CG1 3.79Å; I281-I346 HydrophobicContact CG1-CD1 4.25Å; I281-I346 HydrophobicContact CG1-CG1 3.7Å |
| 282 | M | 95.9 | Very high | 94.5 | Very high | 132 Ų | 132 | 58.3 Ų | 58.3 | 65% | 0.65 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -68.9 | -46 | 178.7 | -74.3 | -159.1 | 159.8 | 0 | 0 | 112.3 | V278 F279 G280 Y285 V286 | V278-M282 WeakPolarHBondContact O-CG 3.4Å; V278-M282 PolarHBondContact O-N 3.43Å; F279-M282 PolarHBondContact O-N 3.22Å; G280-M282 VanDerWaalsContact C-N 3.35Å; G280-M282 PolarHBondContact O-N 3.19Å; M282-Y285 WeakPolarHBondContact O-CB 3.38Å; M282-Y285 PolarHBondContact O-N 2.89Å; M282-V286 WeakPolarHBondContact O-CG2 3.42Å; M282-V286 PolarHBondContact O-N 3.42Å; M282-V286 VanDerWaalsContact O-N 3.16Å |
| 283 | L | 95.4 | Very high | 94.3 | Very high | 35 Ų | 35 | 60.3 Ų | 60.3 | 18% | 0.183 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -64.1 | -43.8 | 179.8 | -177.5 | 64.4 | 0 | 0 | 0 | 111.1 | V233 F279 G280 Y285 V286 M287 | V233-L283 HydrophobicContact CB-CD2 4.5Å; V233-L283 HydrophobicContact CG2-CD2 4.1Å; V233-L283 HydrophobicContact CG2-CG 4.2Å; F279-L283 HydrophobicContact CE1-CB 4.47Å; F279-L283 HydrophobicContact CE1-CD2 3.8Å; F279-L283 HydrophobicContact CZ-CB 4.46Å; F279-L283 HydrophobicContact CZ-CD2 3.91Å; F279-L283 VanDerWaalsContact O-CB 3.28Å; F279-L283 WeakPolarHBondContact O-CB 3.4Å; F279-L283 PolarHBondContact O-N 3.32Å; G280-L283 PolarHBondContact O-N 3.01Å; L283-Y285 VanDerWaalsContact C-N 3.34Å; L283-Y285 PolarHBondContact O-N 3.24Å; L283-V286 PolarHBondContact O-N 3Å; L283-M287 HydrophobicContact CD1-CG 4.06Å; L283-M287 HydrophobicContact CD1-SD 3.79Å; L283-M287 HydrophobicContact CD2-SD 4.32Å; L283-M287 HydrophobicContact CG-CG 4.34Å; L283-M287 HydrophobicContact CG-SD 3.81Å; L283-M287 WeakPolarHBondContact O-CB 3.49Å; L283-M287 VanDerWaalsContact O-CG 3.3Å; L283-M287 WeakPolarHBondContact O-CG 3.42Å; L283-M287 PolarHBondContact O-N 2.91Å |
| 284 | S | 94.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -62.7 | -38.8 | 177.1 | 52.2 | 0 | 0 | 0 | 0 | 112.5 | G280 I281 A288 S345 | G280-S284 VanDerWaalsContact O-CB 3.25Å; G280-S284 WeakPolarHBondContact O-CB 3.26Å; G280-S284 PolarHBondContact O-N 3.42Å; G280-S284 PolarHBondContact O-OG 2.83Å; I281-S284 WeakPolarHBondContact CA-OG 3.45Å; I281-S284 PolarHBondContact O-OG 3.44Å; S284-A288 WeakPolarHBondContact O-CB 3.46Å; S284-A288 PolarHBondContact O-N 2.93Å; S284-S345 WeakPolarHBondContact OG-CB 3.32Å; S284-S345 PolarHBondContact OG-OG 3.3Å |
| 285 | Y | 94.1 | Very high | 93.7 | Very high | 123 Ų | 123 | 51.6 Ų | 51.6 | 48% | 0.482 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -59.4 | -48.8 | 174 | -178.3 | -102.8 | 0 | 0 | 0 | 112.4 | I281 M282 L283 L318 Y339 | I281-Y285 WeakPolarHBondContact O-CB 3.45Å; I281-Y285 PolarHBondContact O-N 3.47Å; I281-Y285 VanDerWaalsContact O-N 3.12Å; M282-Y285 WeakPolarHBondContact O-CB 3.38Å; M282-Y285 PolarHBondContact O-N 2.89Å; L283-Y285 VanDerWaalsContact C-N 3.34Å; L283-Y285 PolarHBondContact O-N 3.24Å; Y285-L318 HydrophobicContact CE2-CD1 4.46Å; Y285-Y339 AromaticContact CD2-CD2 3.89Å; Y285-Y339 HydrophobicContact CD2-CD2 3.89Å; Y285-Y339 AromaticContact CD2-CE2 3.87Å; Y285-Y339 HydrophobicContact CD2-CE2 3.87Å; Y285-Y339 HydrophobicContact CE2-CD2 4.33Å; Y285-Y339 AromaticContact CE2-CE2 3.97Å; Y285-Y339 HydrophobicContact CE2-CE2 3.97Å |
| 286 | V | 94.1 | Very high | 93.2 | Very high | 83 Ų | 83 | 53 Ų | 53 | 50% | 0.503 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -64.3 | -46.9 | -179.5 | 174.2 | 0 | 0 | 0 | 0 | 110.5 | M282 L283 G289 Y290 | M282-V286 WeakPolarHBondContact O-CG2 3.42Å; M282-V286 PolarHBondContact O-N 3.42Å; M282-V286 VanDerWaalsContact O-N 3.16Å; L283-V286 PolarHBondContact O-N 3Å; V286-G289 PolarHBondContact O-N 3.36Å; V286-Y290 HydrophobicContact CG1-CE2 4.26Å; V286-Y290 WeakPolarHBondContact O-CD2 3.32Å; V286-Y290 WeakPolarHBondContact O-CE2 3.24Å |
| 287 | M | 93.6 | Very high | 92.7 | Very high | 8 Ų | 8 | 53.3 Ų | 53.3 | 4% | 0.039 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -73.3 | -35.3 | -174.3 | -67.6 | -173.2 | 70.9 | 0 | 0 | 113.4 | I229 I232 V233 L283 G289 Y290 F293 | I229-M287 HydrophobicContact CD1-CB 3.74Å; I229-M287 HydrophobicContact CG1-CB 4.09Å; I229-M287 HydrophobicContact CG1-CE 4.29Å; I232-M287 HydrophobicContact CB-CE 3.77Å; I232-M287 HydrophobicContact CB-SD 4.32Å; I232-M287 HydrophobicContact CD1-CE 3.71Å; I232-M287 HydrophobicContact CG1-CE 4.3Å; I232-M287 HydrophobicContact CG2-CE 3.71Å; I232-M287 HydrophobicContact CG2-SD 3.8Å; V233-M287 HydrophobicContact CG2-SD 3.71Å; L283-M287 HydrophobicContact CD1-CG 4.06Å; L283-M287 HydrophobicContact CD1-SD 3.79Å; L283-M287 HydrophobicContact CD2-SD 4.32Å; L283-M287 HydrophobicContact CG-CG 4.34Å; L283-M287 HydrophobicContact CG-SD 3.81Å; L283-M287 WeakPolarHBondContact O-CB 3.49Å; L283-M287 VanDerWaalsContact O-CG 3.3Å; L283-M287 WeakPolarHBondContact O-CG 3.42Å; L283-M287 PolarHBondContact O-N 2.91Å; M287-G289 PolarHBondContact O-N 3.04Å; M287-Y290 PolarHBondContact O-N 3.17Å; M287-Y290 VanDerWaalsContact O-N 3.1Å; M287-F293 HydrophobicContact CB-CB 4.47Å; M287-F293 HydrophobicContact CB-CD2 4.28Å; M287-F293 HydrophobicContact CE-CB 3.78Å; M287-F293 HydrophobicContact CE-CD1 3.49Å; M287-F293 VanDerWaalsContact CE-CD1 3.49Å; M287-F293 HydrophobicContact CE-CD2 3.94Å; M287-F293 HydrophobicContact CE-CE1 4.03Å; M287-F293 HydrophobicContact CE-CE2 4.45Å; M287-F293 HydrophobicContact CE-CG 3.45Å; M287-F293 VanDerWaalsContact CE-CG 3.45Å; M287-F293 HydrophobicContact CE-CZ 4.49Å; M287-F293 HydrophobicContact CG-CD2 4.31Å |
| 288 | A | 91.9 | Very high | 91.8 | Very high | 6 Ų | 6 | 57.4 Ų | 57.4 | 5% | 0.05 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.7 | -24.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S284 Y290 F316 Y339 | S284-A288 WeakPolarHBondContact O-CB 3.46Å; S284-A288 PolarHBondContact O-N 2.93Å; A288-Y290 VanDerWaalsContact C-N 3.27Å; A288-Y290 PolarHBondContact O-N 2.91Å; A288-F316 HydrophobicContact CB-CD1 4.22Å; A288-Y339 HydrophobicContact CB-CD1 3.99Å; A288-Y339 HydrophobicContact CB-CD2 3.74Å; A288-Y339 HydrophobicContact CB-CE1 4.26Å; A288-Y339 HydrophobicContact CB-CE2 4.02Å; A288-Y339 HydrophobicContact CB-CG 3.71Å |
| 289 | G | 89 | Confident | 90.8 | Very high | 47 Ų | 47 | 56.1 Ų | 56.1 | 49% | 0.485 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | -13.6 | 176 | 0 | 0 | 0 | 0 | 0 | 115.1 | V286 M287 | V286-G289 PolarHBondContact O-N 3.36Å; M287-G289 PolarHBondContact O-N 3.04Å |
| 290 | Y | 91.7 | Very high | 89.7 | Confident | 141 Ų | 141 | 54.9 Ų | 54.9 | 55% | 0.553 | 27% | 0.267 | S | S | * | . | trans | -114.5 | 119.5 | -176.2 | -61.2 | -84.1 | 0 | 0 | 0 | 112 | V286 M287 A288 Y292 F293 V294 | V286-Y290 HydrophobicContact CG1-CE2 4.26Å; V286-Y290 WeakPolarHBondContact O-CD2 3.32Å; V286-Y290 WeakPolarHBondContact O-CE2 3.24Å; M287-Y290 PolarHBondContact O-N 3.17Å; M287-Y290 VanDerWaalsContact O-N 3.1Å; A288-Y290 VanDerWaalsContact C-N 3.27Å; A288-Y290 PolarHBondContact O-N 2.91Å; Y290-Y292 PolarHBondContact O-N 2.86Å; Y290-Y292 VanDerWaalsContact O-N 3.15Å; Y290-F293 HydrophobicContact CD2-CD2 4.45Å; Y290-F293 HydrophobicContact CD2-CE2 4.47Å; Y290-F293 HydrophobicContact CG-CD2 4.49Å; Y290-F293 PolarHBondContact O-N 3.11Å; Y290-V294 PolarHBondContact O-N 2.83Å | ||
| 291 | R | 89.9 | Confident | 88.5 | Confident | 131 Ų | 131 | 58.7 Ų | 58.7 | 49% | 0.494 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -53.5 | -37.5 | 178.4 | -59.8 | 176.4 | 78.1 | 148.1 | -5.6 | 112.6 | F293 V294 C295 C310 P312 | R291-F293 VanDerWaalsContact C-N 3.26Å; R291-F293 PolarHBondContact O-N 3.11Å; R291-V294 PolarHBondContact O-N 2.73Å; R291-V294 VanDerWaalsContact O-N 3.15Å; R291-C295 WeakPolarHBondContact O-CB 3.39Å; R291-C295 PolarHBondContact O-N 3.12Å; R291-C295 PolarHBondContact O-SG 3.2Å; R291-C310 PolarHBondContact NE-O 3.43Å; R291-C310 VanDerWaalsContact NE-O 3.07Å; R291-C310 VanDerWaalsContact NH2-C 3.34Å; R291-C310 PolarHBondContact NH2-O 3.39Å; R291-P312 HydrophobicContact CG-CG 4.06Å |
| 292 | Y | 90.2 | Very high | 87.5 | Confident | 81 Ų | 81 | 63.7 Ų | 63.7 | 32% | 0.318 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -50.9 | -42.7 | 177.3 | -177.6 | -101.1 | 0 | 0 | 0 | 113 | I93 G96 M228 Y290 V308 | I93-Y292 PolarHBondContact O-OH 3.44Å; G96-Y292 VanDerWaalsContact CA-OH 3.31Å; G96-Y292 WeakPolarHBondContact CA-OH 3.22Å; M228-Y292 HydrophobicContact CE-CD1 3.49Å; M228-Y292 VanDerWaalsContact CE-CD1 3.49Å; M228-Y292 HydrophobicContact CE-CD2 4.13Å; M228-Y292 HydrophobicContact CE-CE1 3.26Å; M228-Y292 HydrophobicContact CE-CE2 3.93Å; M228-Y292 HydrophobicContact CE-CG 3.93Å; M228-Y292 WeakPolarHBondContact CE-O 3.37Å; M228-Y292 HydrophobicContact SD-CE1 4.2Å; Y290-Y292 PolarHBondContact O-N 2.86Å; Y290-Y292 VanDerWaalsContact O-N 3.15Å; Y292-V308 HydrophobicContact CD2-CG2 3.56Å; Y292-V308 HydrophobicContact CE2-CG2 4.08Å; Y292-V308 HydrophobicContact CG-CG2 4.37Å |
| 293 | F | 91.9 | Very high | 86.3 | Confident | 43 Ų | 43 | 59.6 Ų | 59.6 | 19% | 0.189 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -84.6 | -28.3 | -178.4 | -64.3 | -58.6 | 0 | 0 | 0 | 113.7 | I93 M228 I229 I232 M287 Y290 R291 | I93-F293 HydrophobicContact CG2-CE1 3.7Å; I93-F293 HydrophobicContact CG2-CZ 4.38Å; M228-F293 HydrophobicContact CB-CD1 4.38Å; M228-F293 HydrophobicContact CE-CD1 4.48Å; M228-F293 PolarHBondContact N-O 2.91Å; I229-F293 HydrophobicContact CB-CB 4.4Å; I229-F293 WeakPolarHBondContact CB-O 3.4Å; I229-F293 PolarHBondContact N-O 3.2Å; I232-F293 HydrophobicContact CD1-CD1 3.75Å; I232-F293 HydrophobicContact CD1-CE1 3.82Å; M287-F293 HydrophobicContact CB-CB 4.47Å; M287-F293 HydrophobicContact CB-CD2 4.28Å; M287-F293 HydrophobicContact CE-CB 3.78Å; M287-F293 HydrophobicContact CE-CD1 3.49Å; M287-F293 VanDerWaalsContact CE-CD1 3.49Å; M287-F293 HydrophobicContact CE-CD2 3.94Å; M287-F293 HydrophobicContact CE-CE1 4.03Å; M287-F293 HydrophobicContact CE-CE2 4.45Å; M287-F293 HydrophobicContact CE-CG 3.45Å; M287-F293 VanDerWaalsContact CE-CG 3.45Å; M287-F293 HydrophobicContact CE-CZ 4.49Å; M287-F293 HydrophobicContact CG-CD2 4.31Å; Y290-F293 HydrophobicContact CD2-CD2 4.45Å; Y290-F293 HydrophobicContact CD2-CE2 4.47Å; Y290-F293 HydrophobicContact CG-CD2 4.49Å; Y290-F293 PolarHBondContact O-N 3.11Å; R291-F293 VanDerWaalsContact C-N 3.26Å; R291-F293 PolarHBondContact O-N 3.11Å |
| 294 | V | 90.7 | Very high | 85.2 | Confident | 5 Ų | 5 | 62.3 Ų | 62.3 | 3% | 0.03 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -87.6 | -37.6 | -169.2 | 163.7 | 0 | 0 | 0 | 0 | 112 | I229 Y290 R291 P312 F316 | I229-V294 HydrophobicContact CD1-CG2 4.35Å; Y290-V294 PolarHBondContact O-N 2.83Å; R291-V294 PolarHBondContact O-N 2.73Å; R291-V294 VanDerWaalsContact O-N 3.15Å; V294-P312 HydrophobicContact CG1-CB 4.34Å; V294-F316 HydrophobicContact CB-CD1 4.34Å; V294-F316 HydrophobicContact CB-CD2 4.33Å; V294-F316 HydrophobicContact CB-CG 4.17Å; V294-F316 HydrophobicContact CG1-CB 3.67Å; V294-F316 HydrophobicContact CG1-CD1 3.86Å; V294-F316 HydrophobicContact CG1-CD2 3.12Å; V294-F316 HydrophobicContact CG1-CE1 4.24Å; V294-F316 HydrophobicContact CG1-CE2 3.54Å; V294-F316 HydrophobicContact CG1-CG 3.26Å; V294-F316 HydrophobicContact CG1-CZ 4.07Å; V294-F316 HydrophobicContact CG2-CB 4.15Å; V294-F316 HydrophobicContact CG2-CD1 3.62Å; V294-F316 HydrophobicContact CG2-CD2 4.45Å; V294-F316 HydrophobicContact CG2-CE1 4.04Å; V294-F316 HydrophobicContact CG2-CG 3.83Å |
| 295 | C | 87.8 | Confident | 84.2 | Confident | 0 Ų | 0 | 71 Ų | 71 | 0% | 0 | 35% | 0.346 | C | S | . | . | S | Bend | trans | -72.3 | 140.6 | -172.1 | -74.8 | 0 | 0 | 0 | 0 | 112.6 | R291 V308 C310 | R291-C295 WeakPolarHBondContact O-CB 3.39Å; R291-C295 PolarHBondContact O-N 3.12Å; R291-C295 PolarHBondContact O-SG 3.2Å; C295-V308 HydrophobicContact CB-CB 4.35Å; C295-V308 WeakPolarHBondContact CB-O 3.34Å; C295-C310 WeakPolarHBondContact CA-SG 3.28Å; C295-C310 HydrophobicContact CB-CB 3.7Å; C295-C310 WeakPolarHBondContact CB-SG 3.47Å; C295-C310 WeakPolarHBondContact SG-CA 3.27Å; C295-C310 WeakPolarHBondContact SG-CB 3.42Å; C295-C310 PolarHBondContact SG-N 3.49Å; C295-C310 PolarHBondContact SG-O 2.93Å; C295-C310 CovalentContact SG-SG 2.04Å; C295-C310 PolarHBondContact SG-SG 2.87Å |
| 296 | P | 86.5 | Confident | 83.2 | Confident | 46 Ų | 46 | 68.7 Ų | 68.7 | 30% | 0.299 | 34% | 0.339 | S | S | . | . | P | Polyproline II helix | trans | -63.9 | 152.2 | 172.5 | 29.4 | -34.2 | 0 | 0 | 0 | 109.7 | F225 E298 | F225-P296 WeakPolarHBondContact O-CA 3.36Å; P296-E298 PolarHBondContact O-N 2.95Å |
| 297 | V | 84.9 | Confident | 82.5 | Confident | 7 Ų | 7 | 67.8 Ų | 67.8 | 4% | 0.042 | 33% | 0.329 | C | S | . | . | P | Polyproline II helix | trans | -84.5 | 116.8 | -179.5 | -177.8 | 0 | 0 | 0 | 0 | 108.5 | P97 F225 F306 V308 | P97-V297 HydrophobicContact CB-CG1 4.31Å; P97-V297 HydrophobicContact CB-CG2 3.66Å; P97-V297 HydrophobicContact CG-CG1 4.03Å; P97-V297 HydrophobicContact CG-CG2 3.87Å; F225-V297 HydrophobicContact CD1-CB 3.78Å; F225-V297 HydrophobicContact CD1-CG1 4.09Å; F225-V297 HydrophobicContact CD1-CG2 4.09Å; F225-V297 HydrophobicContact CE1-CB 4.42Å; F225-V297 HydrophobicContact CE1-CG1 4.24Å; F225-V297 PolarHBondContact O-N 3.21Å; V297-F306 HydrophobicContact CG1-CD1 4.05Å; V297-V308 HydrophobicContact CG2-CG1 4.15Å |
| 298 | E | 79.1 | Confident | 82 | Confident | 128 Ų | 128 | 68.3 Ų | 68.3 | 60% | 0.598 | 33% | 0.333 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 149.2 | 178.1 | -65.4 | -172.4 | 177.1 | 0 | 0 | 111.3 | P296 Q307 | P296-E298 PolarHBondContact O-N 2.95Å; E298-Q307 PolarHBondContact N-O 2.81Å; E298-Q307 PolarHBondContact O-N 3.47Å |
| 299 | F | 76.2 | Confident | 81.4 | Confident | 35 Ų | 35 | 73.9 Ų | 73.9 | 15% | 0.154 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.9 | 115.3 | 176 | -175.8 | -96.4 | 0 | 0 | 0 | 110 | L158 F306 | L158-F299 HydrophobicContact CB-CE1 4.26Å; L158-F299 HydrophobicContact CD1-CE1 4.48Å; L158-F299 HydrophobicContact CD1-CZ 4.17Å; F299-F306 HydrophobicContact CD2-CD1 4.31Å; F299-F306 HydrophobicContact CD2-CE1 4.08Å; F299-F306 HydrophobicContact CD2-CZ 4.22Å |
| 300 | N | 73.9 | Confident | 81.1 | Confident | 47 Ų | 47 | 73 Ų | 73 | 25% | 0.251 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.1 | 118.9 | 177.1 | -173.5 | -29.5 | 0 | 0 | 0 | 110.7 | D302 N304 R305 Q307 | N300-D302 VanDerWaalsContact C-N 3.34Å; N300-D302 PolarHBondContact O-N 2.7Å; N300-D302 PolarHBondContact OD1-N 3.33Å; N300-N304 PolarHBondContact O-N 2.89Å; N300-N304 VanDerWaalsContact O-N 3.09Å; N300-R305 PolarHBondContact N-O 3.47Å; N300-Q307 HydrophobicContact CB-CG 4.03Å; N300-Q307 VanDerWaalsContact ND2-CD 3.29Å; N300-Q307 PolarHBondContact ND2-NE2 3.35Å; N300-Q307 VanDerWaalsContact ND2-NE2 3.11Å; N300-Q307 PolarHBondContact ND2-OE1 3.47Å |
| 301 | N | 70.4 | Confident | 80.6 | Confident | 81 Ų | 81 | 74.2 Ų | 74.2 | 43% | 0.433 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -30.7 | -177.9 | -66.7 | -23.9 | 0 | 0 | 0 | 113.9 | T157 | T157-N301 WeakPolarHBondContact CB-OD1 3.39Å; T157-N301 PolarHBondContact OG1-OD1 2.92Å |
| 302 | D | 74.2 | Confident | 80.3 | Confident | 158 Ų | 158 | 69.4 Ų | 69.4 | 85% | 0.845 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.7 | -33.3 | -173.3 | -62.9 | -35.5 | 0 | 0 | 0 | 111.9 | N300 | N300-D302 VanDerWaalsContact C-N 3.34Å; N300-D302 PolarHBondContact O-N 2.7Å; N300-D302 PolarHBondContact OD1-N 3.33Å |
| 303 | S | 70.8 | Confident | 79.9 | Confident | 46 Ų | 46 | 68.6 Ų | 68.6 | 32% | 0.322 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101 | -7.1 | -179.3 | 62.4 | 0 | 0 | 0 | 0 | 113.7 | R305 Q307 | S303-R305 WeakPolarHBondContact O-CG 3.29Å; S303-R305 PolarHBondContact O-N 3.32Å; S303-R305 VanDerWaalsContact O-N 3.13Å; S303-Q307 PolarHBondContact OG-NE2 2.94Å |
| 304 | N | 72.4 | Confident | 79.6 | Confident | 92 Ų | 92 | 73.5 Ų | 73.5 | 49% | 0.492 | 37% | 0.374 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47.5 | 34.7 | -170.4 | -82.7 | -21.9 | 0 | 0 | 0 | 112.4 | N300 | N300-N304 PolarHBondContact O-N 2.89Å; N300-N304 VanDerWaalsContact O-N 3.09Å |
| 305 | R | 75.1 | Confident | 79.4 | Confident | 183 Ų | 183 | 74.4 Ų | 74.4 | 69% | 0.691 | 38% | 0.379 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -132 | 150.1 | -177.5 | -73.7 | 176.6 | -174.8 | -158.5 | 1.6 | 109.9 | N300 S303 | N300-R305 PolarHBondContact N-O 3.47Å; S303-R305 WeakPolarHBondContact O-CG 3.29Å; S303-R305 PolarHBondContact O-N 3.32Å; S303-R305 VanDerWaalsContact O-N 3.13Å |
| 306 | F | 73.7 | Confident | 79.5 | Confident | 75 Ų | 75 | 75 Ų | 75 | 33% | 0.329 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.8 | 131.8 | 169.5 | -61.1 | -88.3 | 0 | 0 | 0 | 109.3 | M98 F155 V297 F299 | M98-F306 HydrophobicContact CE-CE1 4.15Å; M98-F306 HydrophobicContact CE-CE2 3.96Å; M98-F306 HydrophobicContact CE-CZ 3.49Å; M98-F306 VanDerWaalsContact CE-CZ 3.49Å; M98-F306 HydrophobicContact CG-CD1 4.22Å; M98-F306 HydrophobicContact CG-CD2 3.52Å; M98-F306 HydrophobicContact CG-CE1 4.12Å; M98-F306 HydrophobicContact CG-CE2 3.46Å; M98-F306 VanDerWaalsContact CG-CE2 3.46Å; M98-F306 HydrophobicContact CG-CG 3.88Å; M98-F306 HydrophobicContact CG-CZ 3.72Å; M98-F306 HydrophobicContact SD-CD1 3.9Å; M98-F306 HydrophobicContact SD-CD2 4.12Å; M98-F306 HydrophobicContact SD-CE1 3.39Å; M98-F306 WeakPolarHBondContact SD-CE1 3.49Å; M98-F306 HydrophobicContact SD-CE2 3.7Å; M98-F306 HydrophobicContact SD-CG 4.19Å; M98-F306 HydrophobicContact SD-CZ 3.24Å; M98-F306 WeakPolarHBondContact SD-CZ 3.22Å; F155-F306 HydrophobicContact CD1-CE1 4.17Å; F155-F306 HydrophobicContact CD1-CZ 4.38Å; F155-F306 HydrophobicContact CE1-CD1 4.47Å; F155-F306 AromaticContact CE1-CE1 3.18Å; F155-F306 HydrophobicContact CE1-CE1 3.18Å; F155-F306 AromaticContact CE1-CZ 3.35Å; F155-F306 HydrophobicContact CE1-CZ 3.35Å; F155-F306 AromaticContact CZ-CE1 3.57Å; F155-F306 HydrophobicContact CZ-CE1 3.57Å; F155-F306 AromaticContact CZ-CZ 3.93Å; F155-F306 HydrophobicContact CZ-CZ 3.93Å; V297-F306 HydrophobicContact CG1-CD1 4.05Å; F299-F306 HydrophobicContact CD2-CD1 4.31Å; F299-F306 HydrophobicContact CD2-CE1 4.08Å; F299-F306 HydrophobicContact CD2-CZ 4.22Å |
| 307 | Q | 79.6 | Confident | 79.5 | Confident | 63 Ų | 63 | 77 Ų | 77 | 29% | 0.294 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.4 | 144.5 | 176.7 | -61.8 | -178.3 | 1.5 | 0 | 0 | 108.3 | E298 N300 S303 | E298-Q307 PolarHBondContact N-O 2.81Å; E298-Q307 PolarHBondContact O-N 3.47Å; N300-Q307 HydrophobicContact CB-CG 4.03Å; N300-Q307 VanDerWaalsContact ND2-CD 3.29Å; N300-Q307 PolarHBondContact ND2-NE2 3.35Å; N300-Q307 VanDerWaalsContact ND2-NE2 3.11Å; N300-Q307 PolarHBondContact ND2-OE1 3.47Å; S303-Q307 PolarHBondContact OG-NE2 2.94Å |
| 308 | V | 81.6 | Confident | 79.8 | Confident | 20 Ų | 20 | 80 Ų | 80 | 12% | 0.121 | 40% | 0.402 | C | S | . | . | trans | -116.5 | 38.1 | 173.4 | -70.1 | 0 | 0 | 0 | 0 | 108.8 | P97 Y292 C295 V297 | P97-V308 HydrophobicContact CG-CG1 4.4Å; Y292-V308 HydrophobicContact CD2-CG2 3.56Å; Y292-V308 HydrophobicContact CE2-CG2 4.08Å; Y292-V308 HydrophobicContact CG-CG2 4.37Å; C295-V308 HydrophobicContact CB-CB 4.35Å; C295-V308 WeakPolarHBondContact CB-O 3.34Å; V297-V308 HydrophobicContact CG2-CG1 4.15Å | ||
| 309 | D | 80.7 | Confident | 80.2 | Confident | 123 Ų | 123 | 77.2 Ų | 77.2 | 66% | 0.658 | 39% | 0.389 | S | S | * | . | trans | -104.1 | 98.5 | -177 | -70.7 | -41.5 | 0 | 0 | 0 | 109.2 | ||||
| 310 | C | 81.1 | Confident | 80.8 | Confident | 29 Ų | 29 | 82.4 Ų | 82.4 | 20% | 0.196 | 41% | 0.413 | C | S | . | . | trans | -133.4 | 158.6 | 177.2 | 82.1 | 0 | 0 | 0 | 0 | 110 | R291 C295 P312 | R291-C310 PolarHBondContact NE-O 3.43Å; R291-C310 VanDerWaalsContact NE-O 3.07Å; R291-C310 VanDerWaalsContact NH2-C 3.34Å; R291-C310 PolarHBondContact NH2-O 3.39Å; C295-C310 WeakPolarHBondContact CA-SG 3.28Å; C295-C310 HydrophobicContact CB-CB 3.7Å; C295-C310 WeakPolarHBondContact CB-SG 3.47Å; C295-C310 WeakPolarHBondContact SG-CA 3.27Å; C295-C310 WeakPolarHBondContact SG-CB 3.42Å; C295-C310 PolarHBondContact SG-N 3.49Å; C295-C310 PolarHBondContact SG-O 2.93Å; C295-C310 CovalentContact SG-SG 2.04Å; C295-C310 PolarHBondContact SG-SG 2.87Å; C310-P312 WeakPolarHBondContact O-CD 3.33Å | ||
| 311 | E | 81.1 | Confident | 81.4 | Confident | 165 Ų | 165 | 83.5 Ų | 83.5 | 77% | 0.771 | 42% | 0.415 | S | S | * | . | P | Polyproline II helix | trans | -72.9 | 121.1 | 163.1 | -168.8 | 170.8 | -178.4 | 0 | 0 | 108.7 | S313 | E311-S313 PolarHBondContact O-N 3.33Š|
| 312 | P | 83.6 | Confident | 82.1 | Confident | 31 Ų | 31 | 85.4 Ų | 85.4 | 20% | 0.201 | 43% | 0.429 | C | S | . | . | P | Polyproline II helix | trans | -58.2 | 130.8 | -178 | -25.1 | 35 | 0 | 0 | 0 | 111.1 | R291 V294 C310 F316 Q317 | R291-P312 HydrophobicContact CG-CG 4.06Å; V294-P312 HydrophobicContact CG1-CB 4.34Å; C310-P312 WeakPolarHBondContact O-CD 3.33Å; P312-F316 HydrophobicContact CB-CB 4.29Å; P312-Q317 PolarHBondContact O-NE2 3.2Å |
| 313 | S | 83 | Confident | 82.5 | Confident | 63 Ų | 63 | 79.4 Ų | 79.4 | 44% | 0.441 | 40% | 0.397 | S | S | . | . | P | Polyproline II helix | trans | -63.2 | 162.6 | 175.8 | 66.8 | 0 | 0 | 0 | 0 | 111.3 | E311 L315 F316 | E311-S313 PolarHBondContact O-N 3.33Å; S313-L315 PolarHBondContact O-N 3.34Å; S313-F316 PolarHBondContact O-N 2.9Å; S313-F316 VanDerWaalsContact OG-CD2 3.32Å; S313-F316 WeakPolarHBondContact OG-CD2 3.44Å |
| 314 | E | 84.9 | Confident | 83 | Confident | 146 Ų | 146 | 81.3 Ų | 81.3 | 68% | 0.682 | 41% | 0.409 | S | S | * | . | G | 310 helix | trans | -52.2 | -26.9 | 178.9 | -62.7 | -177.3 | 171.1 | 0 | 0 | 113 | F316 Q317 Q319 | E314-F316 PolarHBondContact O-N 2.99Å; E314-Q317 PolarHBondContact O-N 3.22Å; E314-Q319 PolarHBondContact O-NE2 3.05Å |
| 315 | L | 86.1 | Confident | 83.3 | Confident | 25 Ų | 25 | 79.3 Ų | 79.3 | 13% | 0.131 | 41% | 0.41 | C | S | . | . | G | 310 helix | trans | -58 | -29.3 | 175.8 | -168.2 | 65.9 | 0 | 0 | 0 | 113.7 | W230 S313 P340 F341 H344 I407 | W230-L315 HydrophobicContact CH2-CD2 4.42Å; W230-L315 HydrophobicContact CZ2-CD2 3.7Å; S313-L315 PolarHBondContact O-N 3.34Å; L315-P340 HydrophobicContact CD1-CB 4.03Å; L315-P340 WeakPolarHBondContact O-CD 3.38Å; L315-F341 HydrophobicContact CD2-CD2 4.13Å; L315-F341 HydrophobicContact CG-CB 4.17Å; L315-F341 HydrophobicContact CG-CD2 4.42Å; L315-F341 PolarHBondContact O-N 3.47Å; L315-H344 WeakPolarHBondContact CD1-CD2 3.31Å; L315-H344 WeakPolarHBondContact CD1-NE2 3.31Å; L315-I407 HydrophobicContact CD1-CD1 4.32Å; L315-I407 HydrophobicContact CD2-CD1 4.16Å; L315-I407 HydrophobicContact CD2-CG2 4.02Å |
| 316 | F | 89.8 | Confident | 83.4 | Confident | 13 Ų | 13 | 76 Ų | 76 | 6% | 0.057 | 41% | 0.41 | C | S | . | . | G | 310 helix | trans | -116.4 | 16.3 | -175.1 | -52.8 | -77.2 | 0 | 0 | 0 | 112.2 | I229 A288 V294 P312 S313 E314 Y339 F341 | I229-F316 HydrophobicContact CD1-CD1 4.46Å; I229-F316 HydrophobicContact CD1-CE1 4.01Å; I229-F316 HydrophobicContact CG2-CE1 3.83Å; I229-F316 HydrophobicContact CG2-CZ 3.86Å; A288-F316 HydrophobicContact CB-CD1 4.22Å; V294-F316 HydrophobicContact CB-CD1 4.34Å; V294-F316 HydrophobicContact CB-CD2 4.33Å; V294-F316 HydrophobicContact CB-CG 4.17Å; V294-F316 HydrophobicContact CG1-CB 3.67Å; V294-F316 HydrophobicContact CG1-CD1 3.86Å; V294-F316 HydrophobicContact CG1-CD2 3.12Å; V294-F316 HydrophobicContact CG1-CE1 4.24Å; V294-F316 HydrophobicContact CG1-CE2 3.54Å; V294-F316 HydrophobicContact CG1-CG 3.26Å; V294-F316 HydrophobicContact CG1-CZ 4.07Å; V294-F316 HydrophobicContact CG2-CB 4.15Å; V294-F316 HydrophobicContact CG2-CD1 3.62Å; V294-F316 HydrophobicContact CG2-CD2 4.45Å; V294-F316 HydrophobicContact CG2-CE1 4.04Å; V294-F316 HydrophobicContact CG2-CG 3.83Å; P312-F316 HydrophobicContact CB-CB 4.29Å; S313-F316 PolarHBondContact O-N 2.9Å; S313-F316 VanDerWaalsContact OG-CD2 3.32Å; S313-F316 WeakPolarHBondContact OG-CD2 3.44Å; E314-F316 PolarHBondContact O-N 2.99Å; F316-Y339 VanDerWaalsContact C-CD1 3.47Å; F316-Y339 VanDerWaalsContact O-CD1 3.29Å; F316-Y339 WeakPolarHBondContact O-CD1 3.49Å; F316-Y339 WeakPolarHBondContact O-CE1 3.42Å; F316-F341 HydrophobicContact CD1-CB 3.86Å; F316-F341 HydrophobicContact CD1-CD2 4.41Å; F316-F341 HydrophobicContact CD1-CG 4.06Å; F316-F341 HydrophobicContact CE1-CB 3.81Å; F316-F341 HydrophobicContact CE1-CD1 4.17Å; F316-F341 AromaticContact CE1-CD2 3.51Å; F316-F341 HydrophobicContact CE1-CD2 3.51Å; F316-F341 HydrophobicContact CE1-CE2 4.12Å; F316-F341 AromaticContact CE1-CG 3.54Å; F316-F341 HydrophobicContact CE1-CG 3.54Å; F316-F341 HydrophobicContact CZ-CD2 4.04Å; F316-F341 HydrophobicContact CZ-CE2 4.49Å; F316-F341 HydrophobicContact CZ-CG 4.49Å |
| 317 | Q | 88.3 | Confident | 83.5 | Confident | 86 Ų | 86 | 76.7 Ų | 76.7 | 40% | 0.402 | 42% | 0.416 | S | S | . | . | S | Bend | trans | -99.6 | 143.6 | 169.6 | -63.7 | -176.7 | 9.3 | 0 | 0 | 109.5 | P312 E314 Q319 P340 | P312-Q317 PolarHBondContact O-NE2 3.2Å; E314-Q317 PolarHBondContact O-N 3.22Å; Q317-Q319 PolarHBondContact O-N 3.27Å; Q317-P340 WeakPolarHBondContact O-CD 3.46Å |
| 318 | L | 90.5 | Very high | 83.6 | Confident | 70 Ų | 70 | 77.8 Ų | 77.8 | 37% | 0.366 | 42% | 0.421 | S | S | . | . | trans | -71.5 | 121.4 | -178.2 | -154.1 | 89.8 | 0 | 0 | 0 | 108.8 | Y285 R337 Y339 | Y285-L318 HydrophobicContact CE2-CD1 4.46Å; L318-R337 HydrophobicContact CD2-CB 3.75Å; L318-R337 HydrophobicContact CD2-CG 4.26Å; L318-R337 HydrophobicContact CG-CB 4.15Å; L318-Y339 HydrophobicContact CB-CE1 4.22Å; L318-Y339 HydrophobicContact CD1-CD1 4.28Å; L318-Y339 HydrophobicContact CD1-CD2 3.98Å; L318-Y339 HydrophobicContact CD1-CE1 3.96Å; L318-Y339 HydrophobicContact CD1-CE2 3.62Å; L318-Y339 HydrophobicContact CD1-CG 4.3Å | ||
| 319 | Q | 87.8 | Confident | 83.5 | Confident | 70 Ų | 70 | 81.5 Ų | 81.5 | 33% | 0.327 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 151.1 | 179.4 | -65.6 | -176.7 | 4.8 | 0 | 0 | 110.7 | E314 Q317 Y321 R337 L338 P340 | E314-Q319 PolarHBondContact O-NE2 3.05Å; Q317-Q319 PolarHBondContact O-N 3.27Å; Q319-Y321 HydrophobicContact CB-CD2 4.32Å; Q319-Y321 HydrophobicContact CB-CE2 3.72Å; Q319-Y321 PolarHBondContact OE1-OH 3.29Å; Q319-R337 WeakPolarHBondContact O-CA 3.34Å; Q319-L338 PolarHBondContact N-O 3.3Å; Q319-L338 VanDerWaalsContact N-O 3.12Å; Q319-L338 PolarHBondContact O-N 3.09Å; Q319-L338 VanDerWaalsContact O-N 3.08Å; Q319-P340 HydrophobicContact CG-CG 4.17Å |
| 320 | E | 89.3 | Confident | 83.6 | Confident | 144 Ų | 144 | 81.3 Ų | 81.3 | 67% | 0.673 | 45% | 0.451 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -91.1 | 123.4 | 174.6 | -78.5 | -177.3 | -176.5 | 0 | 0 | 110.4 | R337 | E320-R337 HydrophobicContact CG-CG 3.67Å |
| 321 | Y | 85.7 | Confident | 83.6 | Confident | 70 Ų | 70 | 83.1 Ų | 83.1 | 28% | 0.275 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 136.6 | 176.5 | -69.7 | -96.3 | 0 | 0 | 0 | 110.3 | Q319 T335 V336 L338 P340 I343 | Q319-Y321 HydrophobicContact CB-CD2 4.32Å; Q319-Y321 HydrophobicContact CB-CE2 3.72Å; Q319-Y321 PolarHBondContact OE1-OH 3.29Å; Y321-T335 WeakPolarHBondContact O-CA 3.35Å; Y321-V336 PolarHBondContact N-O 3.3Å; Y321-V336 PolarHBondContact O-N 3.16Å; Y321-L338 HydrophobicContact CD2-CD1 3.55Å; Y321-L338 HydrophobicContact CD2-CD2 3.78Å; Y321-L338 HydrophobicContact CD2-CG 3.39Å; Y321-L338 HydrophobicContact CE2-CD1 3.3Å; Y321-L338 HydrophobicContact CE2-CD2 4.42Å; Y321-L338 HydrophobicContact CE2-CG 3.65Å; Y321-L338 HydrophobicContact CG-CD1 4.33Å; Y321-L338 HydrophobicContact CG-CD2 4.12Å; Y321-L338 HydrophobicContact CG-CG 4.21Å; Y321-P340 WeakPolarHBondContact OH-CG 3.33Å; Y321-I343 HydrophobicContact CE1-CD1 4.19Å |
| 322 | T | 85.9 | Confident | 83.5 | Confident | 121 Ų | 121 | 78.2 Ų | 78.2 | 74% | 0.742 | 46% | 0.455 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.8 | 128.7 | 171.4 | 49.6 | 0 | 0 | 0 | 0 | 109.5 | T335 | T322-T335 HydrophobicContact CG2-CG2 4.43Å |
| 323 | L | 81.1 | Confident | 83.4 | Confident | 33 Ų | 33 | 84.7 Ų | 84.7 | 17% | 0.173 | 48% | 0.476 | C | S | . | . | P | Polyproline II helix | trans | -75.5 | 142.2 | -179.7 | -74.1 | 178.5 | 0 | 0 | 0 | 110.8 | L327 W333 T334 V336 | L323-L327 HydrophobicContact CB-CB 4.34Å; L323-L327 HydrophobicContact CD2-CB 4.41Å; L323-L327 HydrophobicContact CD2-CD2 3.73Å; L323-W333 HydrophobicContact CD1-CB 4.04Å; L323-W333 VanDerWaalsContact CD1-O 3.31Å; L323-W333 WeakPolarHBondContact CD1-O 3.28Å; L323-T334 PolarHBondContact N-O 2.87Å; L323-V336 HydrophobicContact CD1-CG2 3.54Å; L323-V336 HydrophobicContact CD2-CG2 3.97Å; L323-V336 HydrophobicContact CG-CG2 3.79Å |
| 324 | P | 82.1 | Confident | 83.2 | Confident | 86 Ų | 86 | 85.9 Ų | 85.9 | 56% | 0.558 | 48% | 0.481 | S | S | * | . | P | Polyproline II helix | trans | -60.8 | 143.9 | 169.3 | -16.7 | 28.4 | 0 | 0 | 0 | 110 | V326 L327 E328 | P324-V326 PolarHBondContact O-N 3.47Å; P324-L327 PolarHBondContact O-N 2.97Å; P324-E328 PolarHBondContact O-N 2.87Å; P324-E328 VanDerWaalsContact O-N 3.14Å |
| 325 | G | 77.4 | Confident | 83.3 | Confident | 50 Ų | 50 | 82.3 Ų | 82.3 | 52% | 0.515 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -55.4 | -23.6 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | S329 | G325-S329 PolarHBondContact O-N 3.22Å; G325-S329 VanDerWaalsContact O-N 3.1Å |
| 326 | V | 78.3 | Confident | 83.4 | Confident | 114 Ų | 114 | 82.9 Ų | 82.9 | 69% | 0.691 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -65.5 | -45.2 | 172.1 | -177 | 0 | 0 | 0 | 0 | 111.4 | P324 S329 V330 | P324-V326 PolarHBondContact O-N 3.47Å; V326-S329 PolarHBondContact O-OG 3.24Å; V326-V330 WeakPolarHBondContact O-CG2 3.47Å |
| 327 | L | 76.3 | Confident | 83.3 | Confident | 88 Ų | 88 | 90.1 Ų | 90.1 | 46% | 0.461 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -71.1 | -38.6 | 178.1 | -116.8 | 75 | 0 | 0 | 0 | 111.2 | L323 P324 S329 V330 T331 | L323-L327 HydrophobicContact CB-CB 4.34Å; L323-L327 HydrophobicContact CD2-CB 4.41Å; L323-L327 HydrophobicContact CD2-CD2 3.73Å; P324-L327 PolarHBondContact O-N 2.97Å; L327-S329 VanDerWaalsContact C-N 3.29Å; L327-S329 PolarHBondContact O-N 2.93Å; L327-V330 PolarHBondContact O-N 3.45Å; L327-T331 PolarHBondContact O-N 3.44Å; L327-T331 PolarHBondContact O-OG1 3.5Å |
| 328 | E | 81.6 | Confident | 83.4 | Confident | 86 Ų | 86 | 87.6 Ų | 87.6 | 40% | 0.402 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -57.2 | -42.1 | 175.7 | -173.8 | -178.2 | 178.7 | 0 | 0 | 111.6 | P324 V330 G332 | P324-E328 PolarHBondContact O-N 2.87Å; P324-E328 VanDerWaalsContact O-N 3.14Å; E328-V330 PolarHBondContact O-N 3.25Å; E328-G332 VanDerWaalsContact O-CA 3.29Å; E328-G332 WeakPolarHBondContact O-CA 3.31Å; E328-G332 PolarHBondContact O-N 3.29Å |
| 329 | S | 78.3 | Confident | 83.5 | Confident | 98 Ų | 98 | 86 Ų | 86 | 69% | 0.685 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -65.2 | -24 | 177.4 | 73.5 | 0 | 0 | 0 | 0 | 114.3 | G325 V326 L327 | G325-S329 PolarHBondContact O-N 3.22Å; G325-S329 VanDerWaalsContact O-N 3.1Å; V326-S329 PolarHBondContact O-OG 3.24Å; L327-S329 VanDerWaalsContact C-N 3.29Å; L327-S329 PolarHBondContact O-N 2.93Å |
| 330 | V | 83.7 | Confident | 83.6 | Confident | 120 Ų | 120 | 83.2 Ų | 83.2 | 73% | 0.727 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -95.2 | -40.5 | -177.5 | 175.3 | 0 | 0 | 0 | 0 | 111.6 | V326 L327 E328 | V326-V330 WeakPolarHBondContact O-CG2 3.47Å; L327-V330 PolarHBondContact O-N 3.45Å; E328-V330 PolarHBondContact O-N 3.25Å |
| 331 | T | 79.9 | Confident | 83.8 | Confident | 66 Ų | 66 | 76.3 Ų | 76.3 | 41% | 0.405 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -99.2 | -20.5 | -174.2 | 64.3 | 0 | 0 | 0 | 0 | 113.6 | L327 W333 | L327-T331 PolarHBondContact O-N 3.44Å; L327-T331 PolarHBondContact O-OG1 3.5Å; T331-W333 PolarHBondContact O-N 3.09Å; T331-W333 PolarHBondContact OG1-N 3.47Å |
| 332 | G | 80.3 | Confident | 84.1 | Confident | 63 Ų | 63 | 74 Ų | 74 | 65% | 0.649 | 43% | 0.426 | S | S | * | . | trans | 71 | 9.6 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | E328 | E328-G332 VanDerWaalsContact O-CA 3.29Å; E328-G332 WeakPolarHBondContact O-CA 3.31Å; E328-G332 PolarHBondContact O-N 3.29Å | ||
| 333 | W | 81.4 | Confident | 84.4 | Confident | 167 Ų | 167 | 72.3 Ų | 72.3 | 63% | 0.633 | 41% | 0.411 | S | S | * | . | trans | -101.8 | 136.7 | 178.7 | -64.3 | -6.2 | 0 | 0 | 0 | 110.6 | L323 T331 V336 | L323-W333 HydrophobicContact CD1-CB 4.04Å; L323-W333 VanDerWaalsContact CD1-O 3.31Å; L323-W333 WeakPolarHBondContact CD1-O 3.28Å; T331-W333 PolarHBondContact O-N 3.09Å; T331-W333 PolarHBondContact OG1-N 3.47Å; W333-V336 HydrophobicContact CE3-CG2 4.03Å | ||
| 334 | T | 79.6 | Confident | 85.1 | Confident | 88 Ų | 88 | 72.4 Ų | 72.4 | 54% | 0.54 | 41% | 0.411 | S | S | . | . | S | Bend | trans | -92.5 | -36.1 | 179 | 52.3 | 0 | 0 | 0 | 0 | 112.2 | L323 | L323-T334 PolarHBondContact N-O 2.87Š|
| 335 | T | 86.8 | Confident | 85.7 | Confident | 71 Ų | 71 | 68.3 Ų | 68.3 | 44% | 0.436 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 145.5 | 178.4 | 58.3 | 0 | 0 | 0 | 0 | 111.4 | Y321 T322 | Y321-T335 WeakPolarHBondContact O-CA 3.35Å; T322-T335 HydrophobicContact CG2-CG2 4.43Å |
| 336 | V | 87.2 | Confident | 86.6 | Confident | 36 Ų | 36 | 69.2 Ų | 69.2 | 22% | 0.218 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.2 | 136 | 174.5 | 178.5 | 0 | 0 | 0 | 0 | 109.4 | Y321 L323 W333 L338 | Y321-V336 PolarHBondContact N-O 3.3Å; Y321-V336 PolarHBondContact O-N 3.16Å; L323-V336 HydrophobicContact CD1-CG2 3.54Å; L323-V336 HydrophobicContact CD2-CG2 3.97Å; L323-V336 HydrophobicContact CG-CG2 3.79Å; W333-V336 HydrophobicContact CE3-CG2 4.03Å; V336-L338 HydrophobicContact CB-CD2 4.43Å; V336-L338 HydrophobicContact CG1-CD2 4.06Å |
| 337 | R | 88.6 | Confident | 87.4 | Confident | 166 Ų | 166 | 65.4 Ų | 65.4 | 63% | 0.626 | 36% | 0.357 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.7 | 116.1 | 172.9 | -68.2 | -172.7 | -59.1 | 159.6 | -0.5 | 109.6 | L318 Q319 E320 | L318-R337 HydrophobicContact CD2-CB 3.75Å; L318-R337 HydrophobicContact CD2-CG 4.26Å; L318-R337 HydrophobicContact CG-CB 4.15Å; Q319-R337 WeakPolarHBondContact O-CA 3.34Å; E320-R337 HydrophobicContact CG-CG 3.67Å |
| 338 | L | 90.4 | Very high | 88.4 | Confident | 32 Ų | 32 | 61.2 Ų | 61.2 | 17% | 0.168 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.2 | 151 | -179.6 | 61.6 | 98.5 | 0 | 0 | 0 | 110.2 | Q319 Y321 V336 I343 | Q319-L338 PolarHBondContact N-O 3.3Å; Q319-L338 VanDerWaalsContact N-O 3.12Å; Q319-L338 PolarHBondContact O-N 3.09Å; Q319-L338 VanDerWaalsContact O-N 3.08Å; Y321-L338 HydrophobicContact CD2-CD1 3.55Å; Y321-L338 HydrophobicContact CD2-CD2 3.78Å; Y321-L338 HydrophobicContact CD2-CG 3.39Å; Y321-L338 HydrophobicContact CE2-CD1 3.3Å; Y321-L338 HydrophobicContact CE2-CD2 4.42Å; Y321-L338 HydrophobicContact CE2-CG 3.65Å; Y321-L338 HydrophobicContact CG-CD1 4.33Å; Y321-L338 HydrophobicContact CG-CD2 4.12Å; Y321-L338 HydrophobicContact CG-CG 4.21Å; V336-L338 HydrophobicContact CB-CD2 4.43Å; V336-L338 HydrophobicContact CG1-CD2 4.06Å; L338-I343 HydrophobicContact CD1-CD1 3.89Å; L338-I343 HydrophobicContact CD1-CG1 3.87Å |
| 339 | Y | 91.3 | Very high | 89.1 | Confident | 36 Ų | 36 | 57.1 Ų | 57.1 | 14% | 0.141 | 32% | 0.316 | C | S | . | . | trans | -74.9 | 134.3 | 169 | -66.6 | -77.6 | 0 | 0 | 0 | 108.5 | Y285 A288 F316 L318 F341 Q342 | Y285-Y339 AromaticContact CD2-CD2 3.89Å; Y285-Y339 HydrophobicContact CD2-CD2 3.89Å; Y285-Y339 AromaticContact CD2-CE2 3.87Å; Y285-Y339 HydrophobicContact CD2-CE2 3.87Å; Y285-Y339 HydrophobicContact CE2-CD2 4.33Å; Y285-Y339 AromaticContact CE2-CE2 3.97Å; Y285-Y339 HydrophobicContact CE2-CE2 3.97Å; A288-Y339 HydrophobicContact CB-CD1 3.99Å; A288-Y339 HydrophobicContact CB-CD2 3.74Å; A288-Y339 HydrophobicContact CB-CE1 4.26Å; A288-Y339 HydrophobicContact CB-CE2 4.02Å; A288-Y339 HydrophobicContact CB-CG 3.71Å; F316-Y339 VanDerWaalsContact C-CD1 3.47Å; F316-Y339 VanDerWaalsContact O-CD1 3.29Å; F316-Y339 WeakPolarHBondContact O-CD1 3.49Å; F316-Y339 WeakPolarHBondContact O-CE1 3.42Å; L318-Y339 HydrophobicContact CB-CE1 4.22Å; L318-Y339 HydrophobicContact CD1-CD1 4.28Å; L318-Y339 HydrophobicContact CD1-CD2 3.98Å; L318-Y339 HydrophobicContact CD1-CE1 3.96Å; L318-Y339 HydrophobicContact CD1-CE2 3.62Å; L318-Y339 HydrophobicContact CD1-CG 4.3Å; Y339-F341 PolarHBondContact O-N 3.02Å; Y339-F341 VanDerWaalsContact O-N 3.09Å; Y339-Q342 VanDerWaalsContact O-CB 3.32Å; Y339-Q342 WeakPolarHBondContact O-CB 3.4Å; Y339-Q342 PolarHBondContact O-N 3.5Å | ||
| 340 | P | 90.8 | Very high | 90 | Very high | 12 Ų | 12 | 53.9 Ų | 53.9 | 8% | 0.078 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -52.7 | -33.8 | 174.2 | -25 | 31 | 0 | 0 | 0 | 112.4 | L315 Q317 Q319 Y321 Q342 I343 H344 | L315-P340 HydrophobicContact CD1-CB 4.03Å; L315-P340 WeakPolarHBondContact O-CD 3.38Å; Q317-P340 WeakPolarHBondContact O-CD 3.46Å; Q319-P340 HydrophobicContact CG-CG 4.17Å; Y321-P340 WeakPolarHBondContact OH-CG 3.33Å; P340-Q342 PolarHBondContact O-N 3.06Å; P340-I343 WeakPolarHBondContact O-CB 3.31Å; P340-I343 PolarHBondContact O-N 3.09Å; P340-I343 VanDerWaalsContact O-N 3.07Å; P340-H344 PolarHBondContact O-CD2 3.33Å; P340-H344 VanDerWaalsContact O-CD2 3.3Å |
| 341 | F | 92.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -55.4 | -29.6 | 172.6 | -172 | -104.6 | 0 | 0 | 0 | 114.7 | I229 W230 V233 L315 F316 Y339 I343 H344 S345 | I229-F341 HydrophobicContact CD1-CD1 3.62Å; I229-F341 HydrophobicContact CD1-CE1 3.34Å; I229-F341 HydrophobicContact CD1-CG 4.41Å; I229-F341 HydrophobicContact CD1-CZ 3.89Å; I229-F341 HydrophobicContact CG1-CD1 4.34Å; I229-F341 HydrophobicContact CG1-CE1 3.55Å; I229-F341 HydrophobicContact CG1-CZ 3.69Å; I229-F341 HydrophobicContact CG2-CE2 4.34Å; I229-F341 HydrophobicContact CG2-CZ 4.21Å; W230-F341 HydrophobicContact CD2-CE2 4.07Å; W230-F341 AromaticContact CE2-CE2 3.91Å; W230-F341 AromaticContact CE3-CE2 3.97Å; W230-F341 HydrophobicContact CE3-CE2 3.97Å; W230-F341 AromaticContact CH2-CD2 3.96Å; W230-F341 HydrophobicContact CH2-CD2 3.96Å; W230-F341 AromaticContact CH2-CE2 3.54Å; W230-F341 HydrophobicContact CH2-CE2 3.54Å; W230-F341 AromaticContact CZ2-CD2 3.96Å; W230-F341 HydrophobicContact CZ2-CD2 3.96Å; W230-F341 AromaticContact CZ2-CE2 3.66Å; W230-F341 HydrophobicContact CZ2-CE2 3.66Å; W230-F341 AromaticContact CZ3-CE2 3.73Å; W230-F341 HydrophobicContact CZ3-CE2 3.73Å; V233-F341 HydrophobicContact CG2-CE1 4.22Å; L315-F341 HydrophobicContact CD2-CD2 4.13Å; L315-F341 HydrophobicContact CG-CB 4.17Å; L315-F341 HydrophobicContact CG-CD2 4.42Å; L315-F341 PolarHBondContact O-N 3.47Å; F316-F341 HydrophobicContact CD1-CB 3.86Å; F316-F341 HydrophobicContact CD1-CD2 4.41Å; F316-F341 HydrophobicContact CD1-CG 4.06Å; F316-F341 HydrophobicContact CE1-CB 3.81Å; F316-F341 HydrophobicContact CE1-CD1 4.17Å; F316-F341 AromaticContact CE1-CD2 3.51Å; F316-F341 HydrophobicContact CE1-CD2 3.51Å; F316-F341 HydrophobicContact CE1-CE2 4.12Å; F316-F341 AromaticContact CE1-CG 3.54Å; F316-F341 HydrophobicContact CE1-CG 3.54Å; F316-F341 HydrophobicContact CZ-CD2 4.04Å; F316-F341 HydrophobicContact CZ-CE2 4.49Å; F316-F341 HydrophobicContact CZ-CG 4.49Å; Y339-F341 PolarHBondContact O-N 3.02Å; Y339-F341 VanDerWaalsContact O-N 3.09Å; F341-I343 VanDerWaalsContact C-N 3.28Å; F341-I343 PolarHBondContact O-N 3.11Å; F341-H344 WeakPolarHBondContact O-CB 3.29Å; F341-H344 PolarHBondContact O-N 3.38Å; F341-S345 PolarHBondContact O-N 3.27Å |
| 342 | Q | 93.4 | Very high | 91.4 | Very high | 22 Ų | 22 | 47 Ų | 47 | 10% | 0.103 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64.3 | -34.2 | 177.3 | -67.3 | 178.8 | -87.9 | 0 | 0 | 111.8 | I281 Y339 P340 H344 S345 I346 | I281-Q342 PolarHBondContact O-NE2 3.49Å; Y339-Q342 VanDerWaalsContact O-CB 3.32Å; Y339-Q342 WeakPolarHBondContact O-CB 3.4Å; Y339-Q342 PolarHBondContact O-N 3.5Å; P340-Q342 PolarHBondContact O-N 3.06Å; Q342-H344 VanDerWaalsContact C-N 3.34Å; Q342-S345 WeakPolarHBondContact O-CB 3.37Å; Q342-S345 PolarHBondContact O-N 3.48Å; Q342-I346 WeakPolarHBondContact O-CG1 3.4Å; Q342-I346 PolarHBondContact O-N 3.34Å; Q342-I346 VanDerWaalsContact O-N 3.11Å |
| 343 | I | 91.9 | Very high | 92.1 | Very high | 84 Ų | 84 | 44 Ų | 44 | 43% | 0.431 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -64.5 | -44 | 175 | -57.5 | 173.7 | 0 | 0 | 0 | 109.6 | Y321 L338 P340 F341 S345 I346 | Y321-I343 HydrophobicContact CE1-CD1 4.19Å; L338-I343 HydrophobicContact CD1-CD1 3.89Å; L338-I343 HydrophobicContact CD1-CG1 3.87Å; P340-I343 WeakPolarHBondContact O-CB 3.31Å; P340-I343 PolarHBondContact O-N 3.09Å; P340-I343 VanDerWaalsContact O-N 3.07Å; F341-I343 VanDerWaalsContact C-N 3.28Å; F341-I343 PolarHBondContact O-N 3.11Å; I343-S345 VanDerWaalsContact C-N 3.32Å; I343-S345 PolarHBondContact O-N 3.46Å; I343-I346 WeakPolarHBondContact O-CB 3.4Å; I343-I346 PolarHBondContact O-N 3.33Å |
| 344 | H | 94.1 | Very high | 92.7 | Very high | 35 Ų | 35 | 39.6 Ų | 39.6 | 16% | 0.162 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.5 | -37.1 | 174.7 | -61.9 | -66.1 | 0 | 0 | 0 | 112 | L315 P340 F341 Q342 I346 A347 L348 Y402 | L315-H344 WeakPolarHBondContact CD1-CD2 3.31Å; L315-H344 WeakPolarHBondContact CD1-NE2 3.31Å; P340-H344 PolarHBondContact O-CD2 3.33Å; P340-H344 VanDerWaalsContact O-CD2 3.3Å; F341-H344 WeakPolarHBondContact O-CB 3.29Å; F341-H344 PolarHBondContact O-N 3.38Å; Q342-H344 VanDerWaalsContact C-N 3.34Å; H344-I346 VanDerWaalsContact C-N 3.26Å; H344-I346 PolarHBondContact O-N 2.86Å; H344-A347 WeakPolarHBondContact O-CB 3.22Å; H344-A347 PolarHBondContact O-N 2.66Å; H344-L348 WeakPolarHBondContact O-CG 3.33Å; H344-L348 PolarHBondContact O-N 3.47Å; H344-Y402 HydrophobicContact CB-CE1 3.91Å; H344-Y402 AromaticContact CG-CE1 3.99Å; H344-Y402 AromaticContact ND1-CE1 3.47Å; H344-Y402 WeakPolarHBondContact ND1-CE1 3.28Å; H344-Y402 AromaticContact ND1-CZ 3.56Å; H344-Y402 PolarHBondContact ND1-OH 2.91Å |
| 345 | S | 95.7 | Very high | 93.4 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.7 | -33 | 175 | -171.4 | 0 | 0 | 0 | 0 | 112.8 | G280 S284 F341 Q342 I343 L348 S349 | G280-S345 PolarHBondContact O-OG 3Å; S284-S345 WeakPolarHBondContact OG-CB 3.32Å; S284-S345 PolarHBondContact OG-OG 3.3Å; F341-S345 PolarHBondContact O-N 3.27Å; Q342-S345 WeakPolarHBondContact O-CB 3.37Å; Q342-S345 PolarHBondContact O-N 3.48Å; I343-S345 VanDerWaalsContact C-N 3.32Å; I343-S345 PolarHBondContact O-N 3.46Å; S345-L348 PolarHBondContact O-N 3.35Å; S345-S349 VanDerWaalsContact O-CB 3.32Å; S345-S349 WeakPolarHBondContact O-CB 3.44Å; S345-S349 PolarHBondContact O-N 3.47Å; S345-S349 PolarHBondContact O-OG 3.37Å |
| 346 | I | 95.8 | Very high | 93.6 | Very high | 70 Ų | 70 | 34.6 Ų | 34.6 | 36% | 0.359 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -62.1 | -43.5 | 172.7 | -64.8 | 167.9 | 0 | 0 | 0 | 110.8 | I277 I281 Q342 I343 H344 S349 S350 | I277-I346 HydrophobicContact CG2-CG2 4.49Å; I281-I346 HydrophobicContact CD1-CD1 3.98Å; I281-I346 HydrophobicContact CD1-CG1 3.79Å; I281-I346 HydrophobicContact CG1-CD1 4.25Å; I281-I346 HydrophobicContact CG1-CG1 3.7Å; Q342-I346 WeakPolarHBondContact O-CG1 3.4Å; Q342-I346 PolarHBondContact O-N 3.34Å; Q342-I346 VanDerWaalsContact O-N 3.11Å; I343-I346 WeakPolarHBondContact O-CB 3.4Å; I343-I346 PolarHBondContact O-N 3.33Å; H344-I346 VanDerWaalsContact C-N 3.26Å; H344-I346 PolarHBondContact O-N 2.86Å; I346-S349 WeakPolarHBondContact CA-OG 3.32Å; I346-S349 PolarHBondContact O-OG 2.98Å; I346-S349 VanDerWaalsContact O-OG 3.04Å; I346-S350 WeakPolarHBondContact O-CB 3.45Å; I346-S350 PolarHBondContact O-N 3.13Å; I346-S350 PolarHBondContact O-OG 3.26Å |
| 347 | A | 96 | Very high | 93.7 | Very high | 33 Ų | 33 | 33.1 Ų | 33.1 | 27% | 0.273 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -64.9 | -43.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | H344 F351 Y402 | H344-A347 WeakPolarHBondContact O-CB 3.22Å; H344-A347 PolarHBondContact O-N 2.66Å; A347-F351 WeakPolarHBondContact O-CB 3.26Å; A347-F351 PolarHBondContact O-N 3.28Å; A347-Y402 HydrophobicContact CB-CE2 3.71Å |
| 348 | L | 96.7 | Very high | 93.8 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.3 | -48.9 | 177.4 | -64.1 | 175.7 | 0 | 0 | 0 | 112.2 | W230 P234 H344 S345 F351 A352 M395 F398 V399 Y402 | W230-L348 HydrophobicContact CE3-CD1 4.29Å; W230-L348 HydrophobicContact CZ3-CD1 4.02Å; P234-L348 HydrophobicContact CG-CD1 4.16Å; H344-L348 WeakPolarHBondContact O-CG 3.33Å; H344-L348 PolarHBondContact O-N 3.47Å; S345-L348 PolarHBondContact O-N 3.35Å; L348-F351 PolarHBondContact O-N 3.38Å; L348-A352 WeakPolarHBondContact O-CB 3.43Å; L348-A352 PolarHBondContact O-N 3.4Å; L348-M395 HydrophobicContact CB-CE 3.97Å; L348-M395 HydrophobicContact CD2-CE 4.1Å; L348-M395 VanDerWaalsContact O-CE 3.32Å; L348-M395 WeakPolarHBondContact O-CE 3.4Å; L348-F398 HydrophobicContact CD2-CD1 4.18Å; L348-F398 HydrophobicContact CD2-CE1 3.85Å; L348-V399 HydrophobicContact CD2-CG2 3.98Å; L348-Y402 HydrophobicContact CD2-CD1 4.39Å; L348-Y402 HydrophobicContact CD2-CG 4.45Å |
| 349 | S | 97.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 29.6 Ų | 29.6 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -66.3 | -39.3 | 179.3 | 52.3 | 0 | 0 | 0 | 0 | 112.5 | T276 S345 I346 A352 S353 | T276-S349 WeakPolarHBondContact O-CB 3.45Å; S345-S349 VanDerWaalsContact O-CB 3.32Å; S345-S349 WeakPolarHBondContact O-CB 3.44Å; S345-S349 PolarHBondContact O-N 3.47Å; S345-S349 PolarHBondContact O-OG 3.37Å; I346-S349 WeakPolarHBondContact CA-OG 3.32Å; I346-S349 PolarHBondContact O-OG 2.98Å; I346-S349 VanDerWaalsContact O-OG 3.04Å; S349-A352 PolarHBondContact O-N 2.93Å; S349-S353 PolarHBondContact O-N 2.96Å |
| 350 | S | 96.8 | Very high | 93.5 | Very high | 31 Ų | 31 | 28 Ų | 28 | 22% | 0.217 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.2 | -45.2 | 174.7 | -60.3 | 0 | 0 | 0 | 0 | 111.3 | I346 S353 I354 | I346-S350 WeakPolarHBondContact O-CB 3.45Å; I346-S350 PolarHBondContact O-N 3.13Å; I346-S350 PolarHBondContact O-OG 3.26Å; S350-S353 PolarHBondContact O-N 3.09Å; S350-I354 WeakPolarHBondContact O-CB 3.11Å; S350-I354 VanDerWaalsContact O-CG1 3.3Å; S350-I354 WeakPolarHBondContact O-CG1 3.48Å; S350-I354 PolarHBondContact O-N 3.43Å |
| 351 | F | 96.7 | Very high | 93.4 | Very high | 40 Ų | 40 | 28.3 Ų | 28.3 | 18% | 0.175 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -64.4 | -45.5 | 176 | -175.1 | -84.3 | 0 | 0 | 0 | 111.8 | A347 L348 S353 I354 V355 G356 I394 M395 F398 | A347-F351 WeakPolarHBondContact O-CB 3.26Å; A347-F351 PolarHBondContact O-N 3.28Å; L348-F351 PolarHBondContact O-N 3.38Å; F351-S353 PolarHBondContact O-N 2.93Å; F351-I354 PolarHBondContact O-N 3.17Å; F351-V355 HydrophobicContact CD1-CB 4.34Å; F351-V355 HydrophobicContact CD2-CB 3.93Å; F351-V355 HydrophobicContact CD2-CG1 4.46Å; F351-V355 HydrophobicContact CD2-CG2 3.92Å; F351-V355 HydrophobicContact CE1-CB 4.1Å; F351-V355 HydrophobicContact CE1-CG1 4.2Å; F351-V355 HydrophobicContact CE2-CB 3.67Å; F351-V355 HydrophobicContact CE2-CG1 3.7Å; F351-V355 HydrophobicContact CE2-CG2 3.88Å; F351-V355 HydrophobicContact CG-CB 4.26Å; F351-V355 HydrophobicContact CZ-CB 3.77Å; F351-V355 HydrophobicContact CZ-CG1 3.54Å; F351-V355 HydrophobicContact CZ-CG2 4.47Å; F351-V355 PolarHBondContact O-N 3.49Å; F351-G356 PolarHBondContact O-N 2.89Å; F351-I394 HydrophobicContact CE1-CG2 3.84Å; F351-I394 HydrophobicContact CZ-CG2 3.68Å; F351-M395 HydrophobicContact CD1-SD 3.64Å; F351-M395 HydrophobicContact CE1-SD 4.24Å; F351-F398 HydrophobicContact CB-CD1 3.66Å; F351-F398 HydrophobicContact CB-CE1 3.34Å; F351-F398 HydrophobicContact CB-CE2 4.42Å; F351-F398 HydrophobicContact CB-CG 4.31Å; F351-F398 HydrophobicContact CB-CZ 3.77Å; F351-F398 HydrophobicContact CD1-CB 3.77Å; F351-F398 AromaticContact CD1-CD1 3.42Å; F351-F398 HydrophobicContact CD1-CD1 3.42Å; F351-F398 VanDerWaalsContact CD1-CD1 3.42Å; F351-F398 HydrophobicContact CD1-CD2 4.31Å; F351-F398 HydrophobicContact CD1-CE1 4.07Å; F351-F398 AromaticContact CD1-CG 3.56Å; F351-F398 HydrophobicContact CD1-CG 3.56Å; F351-F398 HydrophobicContact CD2-CB 4.34Å; F351-F398 AromaticContact CD2-CD1 3.87Å; F351-F398 HydrophobicContact CD2-CD1 3.87Å; F351-F398 AromaticContact CD2-CD2 3.49Å; F351-F398 HydrophobicContact CD2-CD2 3.49Å; F351-F398 VanDerWaalsContact CD2-CD2 3.49Å; F351-F398 AromaticContact CD2-CE1 3.97Å; F351-F398 HydrophobicContact CD2-CE1 3.97Å; F351-F398 AromaticContact CD2-CE2 3.62Å; F351-F398 HydrophobicContact CD2-CE2 3.62Å; F351-F398 AromaticContact CD2-CG 3.62Å; F351-F398 HydrophobicContact CD2-CG 3.62Å; F351-F398 AromaticContact CD2-CZ 3.85Å; F351-F398 HydrophobicContact CD2-CZ 3.85Å; F351-F398 HydrophobicContact CE1-CB 3.37Å; F351-F398 AromaticContact CE1-CD1 3.99Å; F351-F398 HydrophobicContact CE1-CD1 3.99Å; F351-F398 HydrophobicContact CE1-CD2 4.34Å; F351-F398 AromaticContact CE1-CG 3.65Å; F351-F398 HydrophobicContact CE1-CG 3.65Å; F351-F398 HydrophobicContact CE2-CB 4Å; F351-F398 HydrophobicContact CE2-CD1 4.38Å; F351-F398 AromaticContact CE2-CD2 3.52Å; F351-F398 HydrophobicContact CE2-CD2 3.52Å; F351-F398 HydrophobicContact CE2-CE2 4.06Å; F351-F398 AromaticContact CE2-CG 3.7Å; F351-F398 HydrophobicContact CE2-CG 3.7Å; F351-F398 HydrophobicContact CG-CB 4.24Å; F351-F398 AromaticContact CG-CD1 3.35Å; F351-F398 HydrophobicContact CG-CD1 3.35Å; F351-F398 AromaticContact CG-CD2 3.9Å; F351-F398 HydrophobicContact CG-CD2 3.9Å; F351-F398 AromaticContact CG-CE1 3.52Å; F351-F398 HydrophobicContact CG-CE1 3.52Å; F351-F398 HydrophobicContact CG-CE2 4.06Å; F351-F398 AromaticContact CG-CG 3.54Å; F351-F398 HydrophobicContact CG-CG 3.54Å; F351-F398 AromaticContact CG-CZ 3.88Å; F351-F398 HydrophobicContact CG-CZ 3.88Å; F351-F398 HydrophobicContact CZ-CB 3.5Å; F351-F398 VanDerWaalsContact CZ-CB 3.5Å; F351-F398 HydrophobicContact CZ-CD1 4.43Å; F351-F398 AromaticContact CZ-CD2 3.97Å; F351-F398 HydrophobicContact CZ-CD2 3.97Å; F351-F398 AromaticContact CZ-CG 3.71Å; F351-F398 HydrophobicContact CZ-CG 3.71Å |
| 352 | A | 96.1 | Very high | 93.2 | Very high | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.008 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -56.7 | -34.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | C237 V238 L348 S349 G356 P357 M395 | C237-A352 HydrophobicContact CB-CB 3.83Å; V238-A352 HydrophobicContact CG2-CB 3.85Å; L348-A352 WeakPolarHBondContact O-CB 3.43Å; L348-A352 PolarHBondContact O-N 3.4Å; S349-A352 PolarHBondContact O-N 2.93Å; A352-G356 WeakPolarHBondContact O-CA 3.42Å; A352-P357 WeakPolarHBondContact O-CD 3.43Å; A352-M395 HydrophobicContact CB-CE 4.14Å; A352-M395 HydrophobicContact CB-SD 3.91Å |
| 353 | S | 95.3 | Very high | 92.9 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -87 | -41.7 | 179.3 | -176 | 0 | 0 | 0 | 0 | 114.1 | N241 F269 L273 S349 S350 F351 P357 | N241-S353 WeakPolarHBondContact OD1-CA 3.35Å; N241-S353 VanDerWaalsContact OD1-CB 3.22Å; N241-S353 WeakPolarHBondContact OD1-CB 3.45Å; N241-S353 PolarHBondContact OD1-OG 3.28Å; F269-S353 WeakPolarHBondContact CE2-O 3.3Å; L273-S353 WeakPolarHBondContact CA-OG 3.44Å; L273-S353 WeakPolarHBondContact CB-OG 3.26Å; L273-S353 PolarHBondContact N-OG 2.99Å; S349-S353 PolarHBondContact O-N 2.96Å; S350-S353 PolarHBondContact O-N 3.09Å; F351-S353 PolarHBondContact O-N 2.93Å; S353-P357 WeakPolarHBondContact O-CD 3.14Å; S353-P357 WeakPolarHBondContact O-CG 3.45Å |
| 354 | I | 93.9 | Very high | 92.6 | Very high | 74 Ų | 74 | 31.5 Ų | 31.5 | 38% | 0.379 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -80.3 | -52.4 | -175.2 | -62.2 | 169.9 | 0 | 0 | 0 | 110.8 | L273 S350 F351 F358 | L273-I354 HydrophobicContact CD1-CD1 4.22Å; L273-I354 HydrophobicContact CD1-CG1 3.92Å; L273-I354 HydrophobicContact CD2-CD1 4.42Å; L273-I354 HydrophobicContact CD2-CG1 4.32Å; S350-I354 WeakPolarHBondContact O-CB 3.11Å; S350-I354 VanDerWaalsContact O-CG1 3.3Å; S350-I354 WeakPolarHBondContact O-CG1 3.48Å; S350-I354 PolarHBondContact O-N 3.43Å; F351-I354 PolarHBondContact O-N 3.17Å; I354-F358 WeakPolarHBondContact O-CD2 3.46Å; I354-F358 VanDerWaalsContact O-CE2 3.25Å; I354-F358 WeakPolarHBondContact O-CE2 3.3Å |
| 355 | V | 93.5 | Very high | 92.2 | Very high | 54 Ų | 54 | 31 Ų | 31 | 33% | 0.327 | 17% | 0.17 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -97.1 | -35.6 | -170.7 | -175.3 | 0 | 0 | 0 | 0 | 111.2 | F351 P357 F358 I394 | F351-V355 HydrophobicContact CD1-CB 4.34Å; F351-V355 HydrophobicContact CD2-CB 3.93Å; F351-V355 HydrophobicContact CD2-CG1 4.46Å; F351-V355 HydrophobicContact CD2-CG2 3.92Å; F351-V355 HydrophobicContact CE1-CB 4.1Å; F351-V355 HydrophobicContact CE1-CG1 4.2Å; F351-V355 HydrophobicContact CE2-CB 3.67Å; F351-V355 HydrophobicContact CE2-CG1 3.7Å; F351-V355 HydrophobicContact CE2-CG2 3.88Å; F351-V355 HydrophobicContact CG-CB 4.26Å; F351-V355 HydrophobicContact CZ-CB 3.77Å; F351-V355 HydrophobicContact CZ-CG1 3.54Å; F351-V355 HydrophobicContact CZ-CG2 4.47Å; F351-V355 PolarHBondContact O-N 3.49Å; V355-P357 VanDerWaalsContact C-CD 3.48Å; V355-P357 VanDerWaalsContact C-N 3.35Å; V355-F358 WeakPolarHBondContact O-CB 3.31Å; V355-F358 PolarHBondContact O-N 2.89Å; V355-I394 HydrophobicContact CG1-CG2 4.22Å |
| 356 | G | 91.6 | Very high | 91.8 | Very high | 1 Ų | 1 | 33.4 Ų | 33.4 | 1% | 0.01 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -47.2 | -47.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | F351 A352 F358 G359 | F351-G356 PolarHBondContact O-N 2.89Å; A352-G356 WeakPolarHBondContact O-CA 3.42Å; G356-F358 PolarHBondContact O-N 3.34Å; G356-F358 VanDerWaalsContact O-N 3.1Å; G356-G359 PolarHBondContact O-N 2.95Å |
| 357 | P | 90.4 | Very high | 91.4 | Very high | 5 Ų | 5 | 31 Ų | 31 | 3% | 0.032 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.7 | -20 | -179.1 | -27.5 | 38.5 | 0 | 0 | 0 | 115 | F269 A352 S353 V355 G359 G360 F361 | F269-P357 HydrophobicContact CE2-CG 4.25Å; A352-P357 WeakPolarHBondContact O-CD 3.43Å; S353-P357 WeakPolarHBondContact O-CD 3.14Å; S353-P357 WeakPolarHBondContact O-CG 3.45Å; V355-P357 VanDerWaalsContact C-CD 3.48Å; V355-P357 VanDerWaalsContact C-N 3.35Å; P357-G359 PolarHBondContact O-N 3.36Å; P357-G360 PolarHBondContact O-N 3.08Å; P357-F361 HydrophobicContact CB-CE2 4.06Å; P357-F361 HydrophobicContact CB-CZ 4.36Å; P357-F361 VanDerWaalsContact O-CD2 3.27Å; P357-F361 WeakPolarHBondContact O-CD2 3.2Å; P357-F361 WeakPolarHBondContact O-CG 3.35Å; P357-F361 PolarHBondContact O-N 3.42Å |
| 358 | F | 89 | Confident | 90.9 | Very high | 118 Ų | 118 | 36.1 Ų | 36.1 | 52% | 0.518 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -66.2 | -27.3 | 174.8 | -72.5 | -92.9 | 0 | 0 | 0 | 112.5 | I354 V355 G356 F361 F362 | I354-F358 WeakPolarHBondContact O-CD2 3.46Å; I354-F358 VanDerWaalsContact O-CE2 3.25Å; I354-F358 WeakPolarHBondContact O-CE2 3.3Å; V355-F358 WeakPolarHBondContact O-CB 3.31Å; V355-F358 PolarHBondContact O-N 2.89Å; G356-F358 PolarHBondContact O-N 3.34Å; G356-F358 VanDerWaalsContact O-N 3.1Å; F358-F361 HydrophobicContact CD1-CD2 4.13Å; F358-F361 HydrophobicContact CG-CD2 4.26Å; F358-F361 PolarHBondContact O-N 2.98Å; F358-F362 WeakPolarHBondContact O-CB 3.22Å; F358-F362 PolarHBondContact O-N 2.95Å |
| 359 | G | 88.9 | Confident | 90.4 | Very high | 5 Ų | 5 | 39.1 Ų | 39.1 | 5% | 0.052 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.7 | -47.4 | 170.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | G356 P357 F361 F362 A363 | G356-G359 PolarHBondContact O-N 2.95Å; P357-G359 PolarHBondContact O-N 3.36Å; G359-F361 PolarHBondContact O-N 3.15Å; G359-F362 WeakPolarHBondContact O-CB 3.3Å; G359-F362 PolarHBondContact O-N 2.76Å; G359-A363 PolarHBondContact O-N 3.44Å |
| 360 | G | 87.7 | Confident | 89.8 | Confident | 3 Ų | 3 | 40.5 Ų | 40.5 | 3% | 0.031 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -67.3 | -32.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | P357 S364 D390 C391 | P357-G360 PolarHBondContact O-N 3.08Å; G360-S364 VanDerWaalsContact O-CB 3.27Å; G360-S364 WeakPolarHBondContact O-CB 3.38Å; G360-S364 PolarHBondContact O-N 2.84Å; G360-S364 PolarHBondContact O-OG 2.88Å; G360-D390 WeakPolarHBondContact CA-OD2 3.46Å; G360-C391 PolarHBondContact N-SG 3.05Å |
| 361 | F | 88.3 | Confident | 89.1 | Confident | 18 Ų | 18 | 44 Ų | 44 | 8% | 0.079 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -67.1 | -41.9 | 171.7 | -62.8 | -41.5 | 0 | 0 | 0 | 112.1 | L257 I258 K264 P357 F358 G359 S364 G365 | L257-F361 HydrophobicContact CD2-CE2 4.3Å; L257-F361 HydrophobicContact CD2-CZ 3.79Å; I258-F361 HydrophobicContact CG2-CD1 4.19Å; I258-F361 HydrophobicContact CG2-CE1 3.91Å; I258-F361 HydrophobicContact CG2-CZ 4.41Å; K264-F361 HydrophobicContact CD-CE1 3.46Å; K264-F361 VanDerWaalsContact CD-CE1 3.46Å; K264-F361 HydrophobicContact CD-CZ 3.78Å; K264-F361 VanDerWaalsContact CE-CE1 3.44Å; K264-F361 HydrophobicContact CG-CE1 4.31Å; K264-F361 VanDerWaalsContact NZ-CE1 3.31Å; P357-F361 HydrophobicContact CB-CE2 4.06Å; P357-F361 HydrophobicContact CB-CZ 4.36Å; P357-F361 VanDerWaalsContact O-CD2 3.27Å; P357-F361 WeakPolarHBondContact O-CD2 3.2Å; P357-F361 WeakPolarHBondContact O-CG 3.35Å; P357-F361 PolarHBondContact O-N 3.42Å; F358-F361 HydrophobicContact CD1-CD2 4.13Å; F358-F361 HydrophobicContact CG-CD2 4.26Å; F358-F361 PolarHBondContact O-N 2.98Å; G359-F361 PolarHBondContact O-N 3.15Å; F361-S364 PolarHBondContact O-N 3.39Å; F361-G365 PolarHBondContact O-N 3.45Å |
| 362 | F | 88.3 | Confident | 88.4 | Confident | 140 Ų | 140 | 43 Ų | 43 | 61% | 0.614 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -61.4 | -49.4 | 175.7 | 176.5 | -97.1 | 0 | 0 | 0 | 111.2 | F358 G359 S364 G365 F366 | F358-F362 WeakPolarHBondContact O-CB 3.22Å; F358-F362 PolarHBondContact O-N 2.95Å; G359-F362 WeakPolarHBondContact O-CB 3.3Å; G359-F362 PolarHBondContact O-N 2.76Å; F362-S364 VanDerWaalsContact C-N 3.33Å; F362-S364 PolarHBondContact O-N 3.49Å; F362-G365 PolarHBondContact O-N 3.44Å; F362-G365 VanDerWaalsContact O-N 3.15Å; F362-F366 PolarHBondContact O-N 3.41Å |
| 363 | A | 87 | Confident | 87.5 | Confident | 7 Ų | 7 | 49.6 Ų | 49.6 | 6% | 0.058 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.1 | -40.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | G359 G365 F366 K367 F375 D390 | G359-A363 PolarHBondContact O-N 3.44Å; A363-G365 PolarHBondContact O-N 2.93Å; A363-F366 WeakPolarHBondContact O-CB 3.33Å; A363-F366 PolarHBondContact O-N 2.8Å; A363-K367 WeakPolarHBondContact O-CG 3.25Å; A363-K367 PolarHBondContact O-N 3.39Å; A363-F375 HydrophobicContact CB-CE2 4.07Å; A363-F375 HydrophobicContact CB-CZ 4.23Å; A363-D390 HydrophobicContact CB-CB 3.53Å; A363-D390 WeakPolarHBondContact CB-OD2 3.33Å |
| 364 | S | 85.3 | Confident | 86.7 | Confident | 26 Ų | 26 | 52.3 Ų | 52.3 | 18% | 0.182 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61 | -44.4 | 173.3 | -63.8 | 0 | 0 | 0 | 0 | 112.1 | G360 F361 F362 K367 R368 | G360-S364 VanDerWaalsContact O-CB 3.27Å; G360-S364 WeakPolarHBondContact O-CB 3.38Å; G360-S364 PolarHBondContact O-N 2.84Å; G360-S364 PolarHBondContact O-OG 2.88Å; F361-S364 PolarHBondContact O-N 3.39Å; F362-S364 VanDerWaalsContact C-N 3.33Å; F362-S364 PolarHBondContact O-N 3.49Å; S364-K367 PolarHBondContact O-N 2.83Å; S364-R368 WeakPolarHBondContact O-CG 2.97Å; S364-R368 PolarHBondContact O-N 3.32Å |
| 365 | G | 86.6 | Confident | 85.9 | Confident | 25 Ų | 25 | 49.5 Ų | 49.5 | 26% | 0.258 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.1 | -43.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F361 F362 A363 K367 R368 A369 | F361-G365 PolarHBondContact O-N 3.45Å; F362-G365 PolarHBondContact O-N 3.44Å; F362-G365 VanDerWaalsContact O-N 3.15Å; A363-G365 PolarHBondContact O-N 2.93Å; G365-K367 PolarHBondContact O-N 2.82Å; G365-R368 PolarHBondContact O-N 2.95Å; G365-A369 PolarHBondContact O-N 2.9Å |
| 366 | F | 86.7 | Confident | 85.2 | Confident | 50 Ų | 50 | 48.1 Ų | 48.1 | 22% | 0.219 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -55.9 | -49.8 | 173.1 | 178.7 | -87.3 | 0 | 0 | 0 | 111.5 | W205 F362 A363 R368 A369 F370 F375 | W205-F366 HydrophobicContact CH2-CE1 4.09Å; W205-F366 AromaticContact CH2-CE2 3.7Å; W205-F366 HydrophobicContact CH2-CE2 3.7Å; W205-F366 AromaticContact CH2-CZ 3.14Å; W205-F366 HydrophobicContact CH2-CZ 3.14Å; W205-F366 HydrophobicContact CZ2-CE1 4.46Å; W205-F366 HydrophobicContact CZ2-CE2 4.44Å; W205-F366 AromaticContact CZ2-CZ 3.62Å; W205-F366 HydrophobicContact CZ2-CZ 3.62Å; W205-F366 AromaticContact CZ3-CE2 3.93Å; W205-F366 HydrophobicContact CZ3-CE2 3.93Å; W205-F366 AromaticContact CZ3-CZ 3.86Å; W205-F366 HydrophobicContact CZ3-CZ 3.86Å; F362-F366 PolarHBondContact O-N 3.41Å; A363-F366 WeakPolarHBondContact O-CB 3.33Å; A363-F366 PolarHBondContact O-N 2.8Å; F366-R368 VanDerWaalsContact C-N 3.32Å; F366-R368 PolarHBondContact O-N 3.11Å; F366-A369 WeakPolarHBondContact O-CB 3.05Å; F366-A369 PolarHBondContact O-N 3.21Å; F366-A369 VanDerWaalsContact O-N 3.15Å; F366-F370 HydrophobicContact CD1-CD2 4.08Å; F366-F370 HydrophobicContact CD1-CE2 4.3Å; F366-F370 HydrophobicContact CD2-CD2 4.4Å; F366-F370 AromaticContact CD2-CE2 3.84Å; F366-F370 HydrophobicContact CD2-CE2 3.84Å; F366-F370 AromaticContact CE1-CD2 3.89Å; F366-F370 HydrophobicContact CE1-CD2 3.89Å; F366-F370 HydrophobicContact CE1-CE2 4.02Å; F366-F370 HydrophobicContact CE2-CD2 4.26Å; F366-F370 AromaticContact CE2-CE2 3.56Å; F366-F370 HydrophobicContact CE2-CE2 3.56Å; F366-F370 HydrophobicContact CE2-CZ 4.47Å; F366-F370 HydrophobicContact CG-CD2 4.35Å; F366-F370 HydrophobicContact CG-CE2 4.24Å; F366-F370 HydrophobicContact CZ-CD2 4.04Å; F366-F370 AromaticContact CZ-CE2 3.69Å; F366-F370 HydrophobicContact CZ-CE2 3.69Å; F366-F370 VanDerWaalsContact O-CD2 3.22Å; F366-F370 WeakPolarHBondContact O-CD2 3.13Å; F366-F370 PolarHBondContact O-N 3.34Å; F366-F375 AromaticContact CD1-CE1 3.62Å; F366-F375 HydrophobicContact CD1-CE1 3.62Å; F366-F375 AromaticContact CD1-CZ 3.85Å; F366-F375 HydrophobicContact CD1-CZ 3.85Å; F366-F375 HydrophobicContact CE1-CD1 4.44Å; F366-F375 AromaticContact CE1-CE1 3.55Å; F366-F375 HydrophobicContact CE1-CE1 3.55Å; F366-F375 HydrophobicContact CE1-CZ 4.26Å |
| 367 | K | 87 | Confident | 84.5 | Confident | 19 Ų | 19 | 50.8 Ų | 50.8 | 8% | 0.083 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.7 | -42.8 | 178.4 | -71.1 | -176.2 | -60.3 | 175.7 | 0 | 112.3 | A363 S364 G365 A369 F370 K371 I372 K373 F375 D387 | A363-K367 WeakPolarHBondContact O-CG 3.25Å; A363-K367 PolarHBondContact O-N 3.39Å; S364-K367 PolarHBondContact O-N 2.83Å; G365-K367 PolarHBondContact O-N 2.82Å; K367-A369 PolarHBondContact O-N 3.34Å; K367-F370 CarbonylContact O-C 3.41Å; K367-F370 PolarHBondContact O-N 2.79Å; K367-K371 PolarHBondContact O-N 3.35Å; K367-I372 CarbonylContact C-O 3.19Å; K367-I372 HydrophobicContact CB-CD1 4.49Å; K367-I372 HydrophobicContact CB-CG1 3.91Å; K367-I372 HydrophobicContact CG-CD1 4.2Å; K367-I372 HydrophobicContact CG-CG1 4.13Å; K367-I372 VanDerWaalsContact O-CG1 3.29Å; K367-I372 WeakPolarHBondContact O-CG1 3.24Å; K367-I372 PolarHBondContact O-N 2.9Å; K367-I372 VanDerWaalsContact O-O 3.05Å; K367-K373 VanDerWaalsContact CD-O 3.26Å; K367-K373 WeakPolarHBondContact CD-O 3.32Å; K367-K373 VanDerWaalsContact CE-O 3.31Å; K367-K373 WeakPolarHBondContact CE-O 3.14Å; K367-K373 PolarHBondContact NZ-O 2.87Å; K367-F375 HydrophobicContact CD-CD2 3.72Å; K367-F375 HydrophobicContact CD-CE2 3.62Å; K367-F375 HydrophobicContact CD-CG 4.4Å; K367-F375 HydrophobicContact CD-CZ 4.27Å; K367-F375 HydrophobicContact CG-CD2 4.18Å; K367-F375 HydrophobicContact CG-CE1 4.41Å; K367-F375 HydrophobicContact CG-CE2 3.8Å; K367-F375 HydrophobicContact CG-CZ 3.92Å; K367-D387 WeakPolarHBondContact CD-OD1 3.35Å; K367-D387 WeakPolarHBondContact CE-OD1 3.2Å; K367-D387 IonicContact NZ-OD1 2.67Å; K367-D387 PolarHBondContact NZ-OD1 3.36Å |
| 368 | R | 86.4 | Confident | 83.8 | Confident | 141 Ų | 141 | 53.8 Ų | 53.8 | 53% | 0.532 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.1 | -36.3 | 176.9 | -61.8 | -49 | 175.2 | -167.1 | -2.2 | 113.1 | L260 S364 G365 F366 F370 K371 | L260-R368 HydrophobicContact CD1-CB 4.41Å; L260-R368 HydrophobicContact CD1-CG 3.94Å; S364-R368 WeakPolarHBondContact O-CG 2.97Å; S364-R368 PolarHBondContact O-N 3.32Å; G365-R368 PolarHBondContact O-N 2.95Å; F366-R368 VanDerWaalsContact C-N 3.32Å; F366-R368 PolarHBondContact O-N 3.11Å; R368-F370 PolarHBondContact O-N 3.15Å; R368-K371 PolarHBondContact O-N 2.75Å |
| 369 | A | 85.9 | Confident | 82.7 | Confident | 64 Ų | 64 | 50.4 Ų | 50.4 | 53% | 0.529 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.7 | -30.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G365 F366 K367 | G365-A369 PolarHBondContact O-N 2.9Å; F366-A369 WeakPolarHBondContact O-CB 3.05Å; F366-A369 PolarHBondContact O-N 3.21Å; F366-A369 VanDerWaalsContact O-N 3.15Å; K367-A369 PolarHBondContact O-N 3.34Å |
| 370 | F | 83.7 | Confident | 81.1 | Confident | 29 Ų | 29 | 53 Ų | 53 | 13% | 0.127 | 28% | 0.276 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.3 | 10.7 | 175.8 | -64.4 | -71.6 | 0 | 0 | 0 | 114 | V47 V122 W205 F366 K367 R368 I372 | V47-F370 HydrophobicContact CG1-CD1 4.35Å; V122-F370 HydrophobicContact CG1-CD1 4.33Å; V122-F370 HydrophobicContact CG2-CD1 4.13Å; W205-F370 HydrophobicContact CH2-CD2 4.28Å; W205-F370 HydrophobicContact CH2-CE1 4.21Å; W205-F370 AromaticContact CH2-CE2 3.67Å; W205-F370 HydrophobicContact CH2-CE2 3.67Å; W205-F370 AromaticContact CH2-CZ 3.65Å; W205-F370 HydrophobicContact CH2-CZ 3.65Å; W205-F370 HydrophobicContact CZ3-CE1 4.1Å; W205-F370 AromaticContact CZ3-CE2 3.79Å; W205-F370 HydrophobicContact CZ3-CE2 3.79Å; W205-F370 AromaticContact CZ3-CZ 3.41Å; W205-F370 HydrophobicContact CZ3-CZ 3.41Å; W205-F370 VanDerWaalsContact CZ3-CZ 3.41Å; F366-F370 HydrophobicContact CD1-CD2 4.08Å; F366-F370 HydrophobicContact CD1-CE2 4.3Å; F366-F370 HydrophobicContact CD2-CD2 4.4Å; F366-F370 AromaticContact CD2-CE2 3.84Å; F366-F370 HydrophobicContact CD2-CE2 3.84Å; F366-F370 AromaticContact CE1-CD2 3.89Å; F366-F370 HydrophobicContact CE1-CD2 3.89Å; F366-F370 HydrophobicContact CE1-CE2 4.02Å; F366-F370 HydrophobicContact CE2-CD2 4.26Å; F366-F370 AromaticContact CE2-CE2 3.56Å; F366-F370 HydrophobicContact CE2-CE2 3.56Å; F366-F370 HydrophobicContact CE2-CZ 4.47Å; F366-F370 HydrophobicContact CG-CD2 4.35Å; F366-F370 HydrophobicContact CG-CE2 4.24Å; F366-F370 HydrophobicContact CZ-CD2 4.04Å; F366-F370 AromaticContact CZ-CE2 3.69Å; F366-F370 HydrophobicContact CZ-CE2 3.69Å; F366-F370 VanDerWaalsContact O-CD2 3.22Å; F366-F370 WeakPolarHBondContact O-CD2 3.13Å; F366-F370 PolarHBondContact O-N 3.34Å; K367-F370 CarbonylContact O-C 3.41Å; K367-F370 PolarHBondContact O-N 2.79Å; R368-F370 PolarHBondContact O-N 3.15Å; F370-I372 HydrophobicContact CB-CD1 4.44Å; F370-I372 HydrophobicContact CB-CG1 4.16Å; F370-I372 PolarHBondContact O-N 3.41Å; F370-I372 VanDerWaalsContact O-N 3.13Å |
| 371 | K | 84.1 | Confident | 79.7 | Confident | 104 Ų | 104 | 55 Ų | 55 | 45% | 0.452 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.9 | 26.5 | -176.8 | -56.6 | 178.9 | 178 | 176.7 | 0 | 114 | E49 K367 R368 | E49-K371 HydrophobicContact CG-CD 4.09Å; E49-K371 IonicContact OE1-NZ 2.93Å; K367-K371 PolarHBondContact O-N 3.35Å; R368-K371 PolarHBondContact O-N 2.75Å |
| 372 | I | 81.3 | Confident | 78.5 | Confident | 19 Ų | 19 | 54.9 Ų | 54.9 | 10% | 0.097 | 30% | 0.296 | C | S | . | . | trans | -103.1 | 158.3 | 174.1 | 61.2 | 173.6 | 0 | 0 | 0 | 110.6 | V50 I118 K367 F370 | V50-I372 HydrophobicContact CB-CG2 3.89Å; V50-I372 HydrophobicContact CG1-CG2 4.01Å; V50-I372 HydrophobicContact CG2-CG2 4.06Å; I118-I372 HydrophobicContact CD1-CD1 3.76Å; I118-I372 HydrophobicContact CG1-CD1 4.2Å; I118-I372 HydrophobicContact CG2-CD1 3.89Å; K367-I372 CarbonylContact C-O 3.19Å; K367-I372 HydrophobicContact CB-CD1 4.49Å; K367-I372 HydrophobicContact CB-CG1 3.91Å; K367-I372 HydrophobicContact CG-CD1 4.2Å; K367-I372 HydrophobicContact CG-CG1 4.13Å; K367-I372 VanDerWaalsContact O-CG1 3.29Å; K367-I372 WeakPolarHBondContact O-CG1 3.24Å; K367-I372 PolarHBondContact O-N 2.9Å; K367-I372 VanDerWaalsContact O-O 3.05Å; F370-I372 HydrophobicContact CB-CD1 4.44Å; F370-I372 HydrophobicContact CB-CG1 4.16Å; F370-I372 PolarHBondContact O-N 3.41Å; F370-I372 VanDerWaalsContact O-N 3.13Å | ||
| 373 | K | 76.3 | Confident | 77.9 | Confident | 139 Ų | 139 | 48.5 Ų | 48.5 | 60% | 0.604 | 27% | 0.27 | S | S | * | . | S | Bend | trans | -100.5 | -42.6 | 178.4 | -174.4 | -176.8 | 170.7 | -170.9 | 0 | 112.7 | K367 | K367-K373 VanDerWaalsContact CD-O 3.26Å; K367-K373 WeakPolarHBondContact CD-O 3.32Å; K367-K373 VanDerWaalsContact CE-O 3.31Å; K367-K373 WeakPolarHBondContact CE-O 3.14Å; K367-K373 PolarHBondContact NZ-O 2.87Å |
| 374 | D | 78.3 | Confident | 77.6 | Confident | 58 Ų | 58 | 48.2 Ų | 48.2 | 31% | 0.31 | 27% | 0.268 | S | S | . | . | S | Bend | trans | -132.3 | 151.2 | -175.9 | -58.7 | -53.6 | 0 | 0 | 0 | 108.5 | A376 | D374-A376 VanDerWaalsContact C-N 3.3Š|
| 375 | F | 77.3 | Confident | 77.6 | Confident | 14 Ų | 14 | 48.3 Ų | 48.3 | 6% | 0.061 | 27% | 0.266 | C | S | . | . | S | Bend | trans | -69.7 | -31.8 | -178.8 | -75.9 | -89 | 0 | 0 | 0 | 111.9 | I115 I118 A363 F366 K367 M386 D387 | I115-F375 HydrophobicContact CG1-CD1 4.11Å; I115-F375 HydrophobicContact CG1-CE1 4.18Å; I118-F375 HydrophobicContact CD1-CB 3.97Å; I118-F375 HydrophobicContact CD1-CD1 3.39Å; I118-F375 HydrophobicContact CD1-CE1 4.3Å; I118-F375 HydrophobicContact CD1-CG 4.08Å; I118-F375 WeakPolarHBondContact CD1-O 3.41Å; A363-F375 HydrophobicContact CB-CE2 4.07Å; A363-F375 HydrophobicContact CB-CZ 4.23Å; F366-F375 AromaticContact CD1-CE1 3.62Å; F366-F375 HydrophobicContact CD1-CE1 3.62Å; F366-F375 AromaticContact CD1-CZ 3.85Å; F366-F375 HydrophobicContact CD1-CZ 3.85Å; F366-F375 HydrophobicContact CE1-CD1 4.44Å; F366-F375 AromaticContact CE1-CE1 3.55Å; F366-F375 HydrophobicContact CE1-CE1 3.55Å; F366-F375 HydrophobicContact CE1-CZ 4.26Å; K367-F375 HydrophobicContact CD-CD2 3.72Å; K367-F375 HydrophobicContact CD-CE2 3.62Å; K367-F375 HydrophobicContact CD-CG 4.4Å; K367-F375 HydrophobicContact CD-CZ 4.27Å; K367-F375 HydrophobicContact CG-CD2 4.18Å; K367-F375 HydrophobicContact CG-CE1 4.41Å; K367-F375 HydrophobicContact CG-CE2 3.8Å; K367-F375 HydrophobicContact CG-CZ 3.92Å; F375-M386 HydrophobicContact CB-CB 4.04Å; F375-M386 HydrophobicContact CD1-CB 4.31Å; F375-M386 HydrophobicContact CD1-CG 3.93Å; F375-M386 HydrophobicContact CD2-CB 3.85Å; F375-M386 HydrophobicContact CD2-CG 3.61Å; F375-M386 HydrophobicContact CE1-CG 4Å; F375-M386 HydrophobicContact CE2-CB 4.42Å; F375-M386 HydrophobicContact CE2-CG 3.68Å; F375-M386 HydrophobicContact CG-CB 3.83Å; F375-M386 HydrophobicContact CG-CG 3.79Å; F375-M386 HydrophobicContact CZ-CG 3.9Å; F375-D387 VanDerWaalsContact CD2-OD1 3.27Å; F375-D387 WeakPolarHBondContact CD2-OD1 3.33Å; F375-D387 PolarHBondContact N-OD2 3.14Å |
| 376 | A | 79.3 | Confident | 77.5 | Confident | 25 Ų | 25 | 47.4 Ų | 47.4 | 21% | 0.207 | 26% | 0.255 | C | S | . | . | trans | -161.2 | 174.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | E114 D374 T378 G383 G384 | E114-A376 HydrophobicContact CB-CB 4.38Å; E114-A376 HydrophobicContact CG-CB 3.69Å; D374-A376 VanDerWaalsContact C-N 3.3Å; A376-T378 WeakPolarHBondContact CB-OG1 3.49Å; A376-G383 CarbonylContact O-C 3.58Å; A376-G383 WeakPolarHBondContact O-CA 3.47Å; A376-G384 WeakPolarHBondContact O-CA 3.47Å; A376-G384 PolarHBondContact O-N 2.89Å | ||
| 377 | N | 77.6 | Confident | 77.4 | Confident | 57 Ų | 57 | 46 Ų | 46 | 31% | 0.305 | 25% | 0.25 | S | C | . | . | trans | -103.7 | 43 | 169.4 | -74.4 | 5.2 | 0 | 0 | 0 | 111.1 | P53 P54 | P53-N377 VanDerWaalsContact CB-ND2 3.3Å; P53-N377 WeakPolarHBondContact CB-ND2 3.47Å; P53-N377 VanDerWaalsContact CG-ND2 3.27Å; P53-N377 WeakPolarHBondContact CG-ND2 3.38Å; P54-N377 PolarHBondContact O-ND2 2.81Å | ||
| 378 | T | 74.2 | Confident | 77.2 | Confident | 68 Ų | 68 | 50.2 Ų | 50.2 | 42% | 0.417 | 27% | 0.265 | S | S | . | . | trans | -71.9 | -33.6 | -173.5 | -53.5 | 0 | 0 | 0 | 0 | 112.4 | E114 A376 G383 I385 | E114-T378 WeakPolarHBondContact OE1-CB 3.48Å; E114-T378 PolarHBondContact OE1-OG1 2.78Å; A376-T378 WeakPolarHBondContact CB-OG1 3.49Å; T378-G383 PolarHBondContact N-O 2.91Å; T378-I385 HydrophobicContact CG2-CD1 3.73Å; T378-I385 HydrophobicContact CG2-CG1 3.87Å | ||
| 379 | I | 65.9 | Low | 77.2 | Confident | 48 Ų | 48 | 46.4 Ų | 46.4 | 25% | 0.246 | 25% | 0.253 | C | S | . | . | B | Isolated β-bridge | trans | -117.1 | 115.8 | 178.6 | -53.3 | 177.8 | 0 | 0 | 0 | 109 | L81 G381 H382 G383 I385 | L81-I379 HydrophobicContact CD2-CG2 4Å; I379-G381 PolarHBondContact O-N 3.06Å; I379-H382 HydrophobicContact CB-CB 4.04Å; I379-H382 HydrophobicContact CG2-CB 3.76Å; I379-H382 PolarHBondContact O-N 3.34Å; I379-G383 PolarHBondContact N-O 3.1Å; I379-G383 PolarHBondContact O-N 3.25Å; I379-I385 HydrophobicContact CD1-CG1 4.34Å |
| 380 | P | 55.8 | Low | 77.1 | Confident | 60 Ų | 60 | 44.4 Ų | 44.4 | 39% | 0.39 | 23% | 0.233 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -46 | 120.4 | 177.6 | -35.5 | 39.6 | 0 | 0 | 0 | 114.1 | D56 H382 | D56-P380 VanDerWaalsContact O-CB 3.29Å; D56-P380 WeakPolarHBondContact O-CB 3.33Å; P380-H382 PolarHBondContact O-N 3.35Å |
| 381 | G | 58.5 | Low | 77.1 | Confident | 45 Ų | 45 | 43.2 Ų | 43.2 | 46% | 0.464 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 69.2 | 3.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | I379 | I379-G381 PolarHBondContact O-N 3.06Š|
| 382 | H | 63.6 | Low | 77.4 | Confident | 14 Ų | 14 | 38.8 Ų | 38.8 | 7% | 0.065 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -126.2 | -0.8 | -175.8 | -79.5 | 60.9 | 0 | 0 | 0 | 114.8 | L81 I379 P380 R388 | L81-H382 HydrophobicContact CD2-CB 4.16Å; L81-H382 WeakPolarHBondContact CD2-CE1 3.36Å; L81-H382 VanDerWaalsContact CD2-CG 3.4Å; L81-H382 WeakPolarHBondContact CD2-ND1 3.41Å; I379-H382 HydrophobicContact CB-CB 4.04Å; I379-H382 HydrophobicContact CG2-CB 3.76Å; I379-H382 PolarHBondContact O-N 3.34Å; P380-H382 PolarHBondContact O-N 3.35Å; H382-R388 VanDerWaalsContact CA-NH2 3.3Å; H382-R388 VanDerWaalsContact CB-NH2 3.34Å; H382-R388 PolarHBondContact CD2-NH2 3.18Å; H382-R388 VanDerWaalsContact CD2-NH2 3.32Å; H382-R388 PolarHBondContact O-NE 2.89Å; H382-R388 PolarHBondContact O-NH2 2.99Å |
| 383 | G | 76.2 | Confident | 77.7 | Confident | 7 Ų | 7 | 38.9 Ų | 38.9 | 7% | 0.072 | 21% | 0.208 | C | C | . | . | B | Isolated β-bridge | trans | 81.9 | -151.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | A376 T378 I379 | A376-G383 CarbonylContact O-C 3.58Å; A376-G383 WeakPolarHBondContact O-CA 3.47Å; T378-G383 PolarHBondContact N-O 2.91Å; I379-G383 PolarHBondContact N-O 3.1Å; I379-G383 PolarHBondContact O-N 3.25Å |
| 384 | G | 80.7 | Confident | 78.4 | Confident | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 19% | 0.194 | C | C | . | . | trans | -80.2 | 167.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A376 M386 D387 | A376-G384 WeakPolarHBondContact O-CA 3.47Å; A376-G384 PolarHBondContact O-N 2.89Å; G384-M386 VanDerWaalsContact C-N 3.29Å; G384-D387 WeakPolarHBondContact CA-OD2 3.49Å; G384-D387 PolarHBondContact N-OD2 2.8Å; G384-D387 WeakPolarHBondContact O-CB 3.36Å; G384-D387 PolarHBondContact O-N 2.88Å | ||
| 385 | I | 84.8 | Confident | 79.2 | Confident | 28 Ų | 28 | 32.4 Ų | 32.4 | 14% | 0.144 | 18% | 0.18 | C | C | . | . | S | Bend | trans | -66.5 | -38.5 | 169.9 | -67.2 | 172.2 | 0 | 0 | 0 | 109.2 | V107 K110 E114 T378 I379 D387 R388 F389 | V107-I385 HydrophobicContact CG1-CG2 3.89Å; K110-I385 HydrophobicContact CB-CD1 3.69Å; K110-I385 HydrophobicContact CG-CD1 4.03Å; E114-I385 PolarHBondContact OE1-N 2.85Å; E114-I385 PolarHBondContact OE2-N 3.13Å; T378-I385 HydrophobicContact CG2-CD1 3.73Å; T378-I385 HydrophobicContact CG2-CG1 3.87Å; I379-I385 HydrophobicContact CD1-CG1 4.34Å; I385-D387 PolarHBondContact O-N 3.32Å; I385-R388 WeakPolarHBondContact O-CB 3.44Å; I385-R388 PolarHBondContact O-N 2.97Å; I385-F389 HydrophobicContact CG2-CD2 3.8Å; I385-F389 HydrophobicContact CG2-CE2 3.95Å; I385-F389 WeakPolarHBondContact O-CD2 3.44Å; I385-F389 PolarHBondContact O-N 3.44Å |
| 386 | M | 85 | Confident | 79.9 | Confident | 7 Ų | 7 | 32.1 Ų | 32.1 | 3% | 0.034 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -59.5 | -35.2 | 176.8 | 179.9 | 56 | 84 | 0 | 0 | 112.5 | C111 E114 I115 V213 F375 G384 R388 F389 D390 Y393 | C111-M386 HydrophobicContact CB-CE 3.73Å; E114-M386 WeakPolarHBondContact OE2-CB 3.24Å; E114-M386 PolarHBondContact OE2-N 3.03Å; I115-M386 HydrophobicContact CD1-CE 3.13Å; I115-M386 HydrophobicContact CD1-CG 4.31Å; I115-M386 HydrophobicContact CD1-SD 4.34Å; I115-M386 HydrophobicContact CG1-CE 3.93Å; I115-M386 HydrophobicContact CG1-CG 4.44Å; V213-M386 HydrophobicContact CG2-CE 3.67Å; F375-M386 HydrophobicContact CB-CB 4.04Å; F375-M386 HydrophobicContact CD1-CB 4.31Å; F375-M386 HydrophobicContact CD1-CG 3.93Å; F375-M386 HydrophobicContact CD2-CB 3.85Å; F375-M386 HydrophobicContact CD2-CG 3.61Å; F375-M386 HydrophobicContact CE1-CG 4Å; F375-M386 HydrophobicContact CE2-CB 4.42Å; F375-M386 HydrophobicContact CE2-CG 3.68Å; F375-M386 HydrophobicContact CG-CB 3.83Å; F375-M386 HydrophobicContact CG-CG 3.79Å; F375-M386 HydrophobicContact CZ-CG 3.9Å; G384-M386 VanDerWaalsContact C-N 3.29Å; M386-R388 PolarHBondContact O-N 2.98Å; M386-F389 PolarHBondContact O-N 3.25Å; M386-D390 PolarHBondContact O-N 3.07Å; M386-D390 VanDerWaalsContact O-N 3.17Å; M386-Y393 HydrophobicContact CE-CE2 3.56Å; M386-Y393 WeakPolarHBondContact CE-OH 3.49Å; M386-Y393 HydrophobicContact SD-CE2 3.61Å |
| 387 | D | 82.8 | Confident | 80.6 | Confident | 19 Ų | 19 | 33.1 Ų | 33.1 | 10% | 0.102 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.9 | -12.1 | 175.9 | -67.9 | -66.6 | 0 | 0 | 0 | 113.8 | K367 F375 G384 I385 | K367-D387 WeakPolarHBondContact CD-OD1 3.35Å; K367-D387 WeakPolarHBondContact CE-OD1 3.2Å; K367-D387 IonicContact NZ-OD1 2.67Å; K367-D387 PolarHBondContact NZ-OD1 3.36Å; F375-D387 VanDerWaalsContact CD2-OD1 3.27Å; F375-D387 WeakPolarHBondContact CD2-OD1 3.33Å; F375-D387 PolarHBondContact N-OD2 3.14Å; G384-D387 WeakPolarHBondContact CA-OD2 3.49Å; G384-D387 PolarHBondContact N-OD2 2.8Å; G384-D387 WeakPolarHBondContact O-CB 3.36Å; G384-D387 PolarHBondContact O-N 2.88Å; I385-D387 PolarHBondContact O-N 3.32Å |
| 388 | R | 84.5 | Confident | 81.5 | Confident | 108 Ų | 108 | 32.6 Ų | 32.6 | 41% | 0.408 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -106.9 | -18 | -178.7 | -58.7 | -66.6 | 161.1 | 178.3 | -5.9 | 113.5 | H382 I385 M386 | H382-R388 VanDerWaalsContact CA-NH2 3.3Å; H382-R388 VanDerWaalsContact CB-NH2 3.34Å; H382-R388 PolarHBondContact CD2-NH2 3.18Å; H382-R388 VanDerWaalsContact CD2-NH2 3.32Å; H382-R388 PolarHBondContact O-NE 2.89Å; H382-R388 PolarHBondContact O-NH2 2.99Å; I385-R388 WeakPolarHBondContact O-CB 3.44Å; I385-R388 PolarHBondContact O-N 2.97Å; M386-R388 PolarHBondContact O-N 2.98Å |
| 389 | F | 85.3 | Confident | 82.5 | Confident | 62 Ų | 62 | 29.5 Ų | 29.5 | 27% | 0.272 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -111.3 | -0.2 | -177.1 | -75 | -84.6 | 0 | 0 | 0 | 113.3 | V107 I385 M386 C391 Q392 Y393 | V107-F389 HydrophobicContact CG1-CD1 4.32Å; V107-F389 HydrophobicContact CG1-CD2 3.68Å; V107-F389 HydrophobicContact CG1-CE1 4.19Å; V107-F389 HydrophobicContact CG1-CE2 3.53Å; V107-F389 HydrophobicContact CG1-CG 4.09Å; V107-F389 HydrophobicContact CG1-CZ 3.8Å; V107-F389 HydrophobicContact CG2-CE2 4.14Å; V107-F389 HydrophobicContact CG2-CZ 4.13Å; I385-F389 HydrophobicContact CG2-CD2 3.8Å; I385-F389 HydrophobicContact CG2-CE2 3.95Å; I385-F389 WeakPolarHBondContact O-CD2 3.44Å; I385-F389 PolarHBondContact O-N 3.44Å; M386-F389 PolarHBondContact O-N 3.25Å; F389-C391 PolarHBondContact O-N 3.41Å; F389-Q392 HydrophobicContact CB-CB 4.49Å; F389-Q392 HydrophobicContact CD1-CB 4.05Å; F389-Q392 HydrophobicContact CD1-CG 4Å; F389-Q392 WeakPolarHBondContact O-CB 3.4Å; F389-Q392 PolarHBondContact O-N 3.03Å; F389-Y393 HydrophobicContact CB-CE1 3.99Å; F389-Y393 VanDerWaalsContact O-CD1 3.3Å; F389-Y393 WeakPolarHBondContact O-CD1 3.2Å; F389-Y393 PolarHBondContact O-N 3.26Å; F389-Y393 VanDerWaalsContact O-N 3.14Å |
| 390 | D | 83.2 | Confident | 83.9 | Confident | 21 Ų | 21 | 28.5 Ų | 28.5 | 11% | 0.112 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -57.8 | -45.4 | 178.9 | 57 | 0.6 | 0 | 0 | 0 | 113.7 | G360 A363 M386 Q392 | G360-D390 WeakPolarHBondContact CA-OD2 3.46Å; A363-D390 HydrophobicContact CB-CB 3.53Å; A363-D390 WeakPolarHBondContact CB-OD2 3.33Å; M386-D390 PolarHBondContact O-N 3.07Å; M386-D390 VanDerWaalsContact O-N 3.17Å; D390-Q392 VanDerWaalsContact C-N 3.33Å |
| 391 | C | 85.1 | Confident | 85.7 | Confident | 5 Ų | 5 | 29.4 Ų | 29.4 | 3% | 0.034 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -70.6 | -29.1 | 173.2 | -65.9 | 0 | 0 | 0 | 0 | 112.5 | V238 G360 F389 Y393 | V238-C391 HydrophobicContact CG1-CB 3.71Å; G360-C391 PolarHBondContact N-SG 3.05Å; F389-C391 PolarHBondContact O-N 3.41Å; C391-Y393 VanDerWaalsContact C-N 3.33Å; C391-Y393 PolarHBondContact O-N 3.22Å |
| 392 | Q | 90.4 | Very high | 87.4 | Confident | 10 Ų | 10 | 28.4 Ų | 28.4 | 5% | 0.047 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -72.4 | -27.2 | -176.4 | -60.3 | -67.4 | -5.6 | 0 | 0 | 112.4 | I235 V238 F389 D390 M395 A396 | I235-Q392 PolarHBondContact O-NE2 3.46Å; V238-Q392 HydrophobicContact CG1-CG 4.5Å; V238-Q392 VanDerWaalsContact CG1-NE2 3.35Å; F389-Q392 HydrophobicContact CB-CB 4.49Å; F389-Q392 HydrophobicContact CD1-CB 4.05Å; F389-Q392 HydrophobicContact CD1-CG 4Å; F389-Q392 WeakPolarHBondContact O-CB 3.4Å; F389-Q392 PolarHBondContact O-N 3.03Å; D390-Q392 VanDerWaalsContact C-N 3.33Å; Q392-M395 PolarHBondContact O-N 2.98Å; Q392-A396 PolarHBondContact O-N 2.98Å |
| 393 | Y | 87.9 | Confident | 88.7 | Confident | 21 Ų | 21 | 27.9 Ų | 27.9 | 8% | 0.082 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -63.1 | -47.7 | 179.6 | -73.3 | -1.9 | 0 | 0 | 0 | 112.4 | C111 I212 V213 Q216 M386 F389 C391 M395 A396 T397 | C111-Y393 WeakPolarHBondContact CB-OH 3.25Å; C111-Y393 PolarHBondContact SG-OH 3.28Å; I212-Y393 HydrophobicContact CG2-CD2 3.75Å; I212-Y393 HydrophobicContact CG2-CE2 3.93Å; V213-Y393 HydrophobicContact CG2-CE2 4.29Å; Q216-Y393 HydrophobicContact CB-CD1 3.93Å; Q216-Y393 HydrophobicContact CB-CE1 4.38Å; Q216-Y393 HydrophobicContact CB-CG 4.11Å; Q216-Y393 HydrophobicContact CG-CD1 4.37Å; Q216-Y393 HydrophobicContact CG-CD2 4.47Å; Q216-Y393 HydrophobicContact CG-CG 4.04Å; Q216-Y393 PolarHBondContact OE1-O 3.33Å; M386-Y393 HydrophobicContact CE-CE2 3.56Å; M386-Y393 WeakPolarHBondContact CE-OH 3.49Å; M386-Y393 HydrophobicContact SD-CE2 3.61Å; F389-Y393 HydrophobicContact CB-CE1 3.99Å; F389-Y393 VanDerWaalsContact O-CD1 3.3Å; F389-Y393 WeakPolarHBondContact O-CD1 3.2Å; F389-Y393 PolarHBondContact O-N 3.26Å; F389-Y393 VanDerWaalsContact O-N 3.14Å; C391-Y393 VanDerWaalsContact C-N 3.33Å; C391-Y393 PolarHBondContact O-N 3.22Å; Y393-M395 VanDerWaalsContact C-N 3.26Å; Y393-M395 PolarHBondContact O-N 3.04Å; Y393-A396 PolarHBondContact O-N 3.02Å; Y393-T397 PolarHBondContact O-N 3.36Å |
| 394 | I | 91 | Very high | 89.3 | Confident | 61 Ų | 61 | 29.9 Ų | 29.9 | 31% | 0.313 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -65.9 | -36.8 | 177.4 | -59.4 | -175.2 | 0 | 0 | 0 | 110.3 | F351 V355 T397 F398 | F351-I394 HydrophobicContact CE1-CG2 3.84Å; F351-I394 HydrophobicContact CZ-CG2 3.68Å; V355-I394 HydrophobicContact CG1-CG2 4.22Å; I394-T397 PolarHBondContact O-N 3.42Å; I394-F398 PolarHBondContact O-N 2.98Å; I394-F398 VanDerWaalsContact O-N 3.1Å |
| 395 | M | 94.4 | Very high | 89.8 | Confident | 1 Ų | 1 | 33.7 Ų | 33.7 | 1% | 0.005 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.7 | -43.2 | 177.7 | -168.1 | 62.6 | -168.9 | 0 | 0 | 112.3 | P234 V238 L348 F351 A352 Q392 Y393 T397 F398 V399 | P234-M395 HydrophobicContact CB-CE 3.53Å; P234-M395 HydrophobicContact CB-CG 3.85Å; P234-M395 HydrophobicContact CG-CE 4.09Å; V238-M395 HydrophobicContact CG2-CB 4Å; V238-M395 HydrophobicContact CG2-CG 3.87Å; V238-M395 HydrophobicContact CG2-SD 4.39Å; L348-M395 HydrophobicContact CB-CE 3.97Å; L348-M395 HydrophobicContact CD2-CE 4.1Å; L348-M395 VanDerWaalsContact O-CE 3.32Å; L348-M395 WeakPolarHBondContact O-CE 3.4Å; F351-M395 HydrophobicContact CD1-SD 3.64Å; F351-M395 HydrophobicContact CE1-SD 4.24Å; A352-M395 HydrophobicContact CB-CE 4.14Å; A352-M395 HydrophobicContact CB-SD 3.91Å; Q392-M395 PolarHBondContact O-N 2.98Å; Y393-M395 VanDerWaalsContact C-N 3.26Å; Y393-M395 PolarHBondContact O-N 3.04Å; M395-T397 PolarHBondContact O-N 3.38Å; M395-F398 HydrophobicContact CE-CD1 4.26Å; M395-F398 PolarHBondContact O-N 3.49Å; M395-F398 HydrophobicContact SD-CD1 4.33Å; M395-V399 HydrophobicContact CE-CG2 3.82Å; M395-V399 HydrophobicContact CG-CG2 4.31Å; M395-V399 VanDerWaalsContact O-CG2 3.24Å; M395-V399 WeakPolarHBondContact O-CG2 3.22Å; M395-V399 PolarHBondContact O-N 3.43Å |
| 396 | A | 92.9 | Very high | 89.9 | Confident | 7 Ų | 7 | 39.1 Ų | 39.1 | 6% | 0.058 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59 | -45.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113 | I220 N223 Q392 Y393 N400 | I220-A396 HydrophobicContact CD1-CB 4.02Å; I220-A396 HydrophobicContact CG1-CB 3.35Å; N223-A396 PolarHBondContact ND2-O 3.29Å; Q392-A396 PolarHBondContact O-N 2.98Å; Y393-A396 PolarHBondContact O-N 3.02Å; A396-N400 PolarHBondContact O-N 3.47Å; A396-N400 VanDerWaalsContact O-N 3.15Å |
| 397 | T | 93.9 | Very high | 89.9 | Confident | 47 Ų | 47 | 41 Ų | 41 | 29% | 0.288 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -62.5 | -45.7 | 175.7 | -61.9 | 0 | 0 | 0 | 0 | 111.1 | Q216 L219 Y393 I394 M395 V399 N400 V401 | Q216-T397 PolarHBondContact NE2-OG1 3.31Å; Q216-T397 PolarHBondContact OE1-OG1 2.95Å; L219-T397 HydrophobicContact CD1-CG2 4.4Å; Y393-T397 PolarHBondContact O-N 3.36Å; I394-T397 PolarHBondContact O-N 3.42Å; M395-T397 PolarHBondContact O-N 3.38Å; T397-V399 PolarHBondContact O-N 2.93Å; T397-N400 PolarHBondContact O-N 3.41Å; T397-V401 HydrophobicContact CG2-CG2 4.35Å; T397-V401 WeakPolarHBondContact O-CG2 3.31Å; T397-V401 PolarHBondContact O-N 3.32Å |
| 398 | F | 95.7 | Very high | 89.5 | Confident | 46 Ų | 46 | 44.8 Ų | 44.8 | 20% | 0.202 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.2 | -47.6 | 179.8 | 175.6 | -110.9 | 0 | 0 | 0 | 112.1 | L348 F351 I394 M395 N400 V401 Y402 | L348-F398 HydrophobicContact CD2-CD1 4.18Å; L348-F398 HydrophobicContact CD2-CE1 3.85Å; F351-F398 HydrophobicContact CB-CD1 3.66Å; F351-F398 HydrophobicContact CB-CE1 3.34Å; F351-F398 HydrophobicContact CB-CE2 4.42Å; F351-F398 HydrophobicContact CB-CG 4.31Å; F351-F398 HydrophobicContact CB-CZ 3.77Å; F351-F398 HydrophobicContact CD1-CB 3.77Å; F351-F398 AromaticContact CD1-CD1 3.42Å; F351-F398 HydrophobicContact CD1-CD1 3.42Å; F351-F398 VanDerWaalsContact CD1-CD1 3.42Å; F351-F398 HydrophobicContact CD1-CD2 4.31Å; F351-F398 HydrophobicContact CD1-CE1 4.07Å; F351-F398 AromaticContact CD1-CG 3.56Å; F351-F398 HydrophobicContact CD1-CG 3.56Å; F351-F398 HydrophobicContact CD2-CB 4.34Å; F351-F398 AromaticContact CD2-CD1 3.87Å; F351-F398 HydrophobicContact CD2-CD1 3.87Å; F351-F398 AromaticContact CD2-CD2 3.49Å; F351-F398 HydrophobicContact CD2-CD2 3.49Å; F351-F398 VanDerWaalsContact CD2-CD2 3.49Å; F351-F398 AromaticContact CD2-CE1 3.97Å; F351-F398 HydrophobicContact CD2-CE1 3.97Å; F351-F398 AromaticContact CD2-CE2 3.62Å; F351-F398 HydrophobicContact CD2-CE2 3.62Å; F351-F398 AromaticContact CD2-CG 3.62Å; F351-F398 HydrophobicContact CD2-CG 3.62Å; F351-F398 AromaticContact CD2-CZ 3.85Å; F351-F398 HydrophobicContact CD2-CZ 3.85Å; F351-F398 HydrophobicContact CE1-CB 3.37Å; F351-F398 AromaticContact CE1-CD1 3.99Å; F351-F398 HydrophobicContact CE1-CD1 3.99Å; F351-F398 HydrophobicContact CE1-CD2 4.34Å; F351-F398 AromaticContact CE1-CG 3.65Å; F351-F398 HydrophobicContact CE1-CG 3.65Å; F351-F398 HydrophobicContact CE2-CB 4Å; F351-F398 HydrophobicContact CE2-CD1 4.38Å; F351-F398 AromaticContact CE2-CD2 3.52Å; F351-F398 HydrophobicContact CE2-CD2 3.52Å; F351-F398 HydrophobicContact CE2-CE2 4.06Å; F351-F398 AromaticContact CE2-CG 3.7Å; F351-F398 HydrophobicContact CE2-CG 3.7Å; F351-F398 HydrophobicContact CG-CB 4.24Å; F351-F398 AromaticContact CG-CD1 3.35Å; F351-F398 HydrophobicContact CG-CD1 3.35Å; F351-F398 AromaticContact CG-CD2 3.9Å; F351-F398 HydrophobicContact CG-CD2 3.9Å; F351-F398 AromaticContact CG-CE1 3.52Å; F351-F398 HydrophobicContact CG-CE1 3.52Å; F351-F398 HydrophobicContact CG-CE2 4.06Å; F351-F398 AromaticContact CG-CG 3.54Å; F351-F398 HydrophobicContact CG-CG 3.54Å; F351-F398 AromaticContact CG-CZ 3.88Å; F351-F398 HydrophobicContact CG-CZ 3.88Å; F351-F398 HydrophobicContact CZ-CB 3.5Å; F351-F398 VanDerWaalsContact CZ-CB 3.5Å; F351-F398 HydrophobicContact CZ-CD1 4.43Å; F351-F398 AromaticContact CZ-CD2 3.97Å; F351-F398 HydrophobicContact CZ-CD2 3.97Å; F351-F398 AromaticContact CZ-CG 3.71Å; F351-F398 HydrophobicContact CZ-CG 3.71Å; I394-F398 PolarHBondContact O-N 2.98Å; I394-F398 VanDerWaalsContact O-N 3.1Å; M395-F398 HydrophobicContact CE-CD1 4.26Å; M395-F398 PolarHBondContact O-N 3.49Å; M395-F398 HydrophobicContact SD-CD1 4.33Å; F398-N400 VanDerWaalsContact C-N 3.28Å; F398-N400 PolarHBondContact O-N 3.48Å; F398-V401 PolarHBondContact O-N 3.33Å; F398-Y402 HydrophobicContact CE1-CD2 4.3Å; F398-Y402 HydrophobicContact CE2-CD2 4.23Å; F398-Y402 AromaticContact CZ-CD2 3.74Å; F398-Y402 HydrophobicContact CZ-CD2 3.74Å; F398-Y402 HydrophobicContact CZ-CE2 4.41Å; F398-Y402 HydrophobicContact CZ-CG 4.45Å; F398-Y402 WeakPolarHBondContact O-CB 3.35Å; F398-Y402 PolarHBondContact O-N 3.1Å |
| 399 | V | 95.9 | Very high | 88.6 | Confident | 2 Ų | 2 | 42.2 Ų | 42.2 | 1% | 0.012 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -57.7 | -44.1 | 178.1 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | N223 W230 P234 L348 M395 T397 Y402 I403 | N223-V399 HydrophobicContact CB-CG1 4.06Å; N223-V399 WeakPolarHBondContact ND2-CB 3.28Å; N223-V399 WeakPolarHBondContact ND2-CG1 3.26Å; W230-V399 HydrophobicContact CE3-CG1 4.29Å; W230-V399 WeakPolarHBondContact O-CG1 3.09Å; P234-V399 HydrophobicContact CB-CG2 3.6Å; P234-V399 HydrophobicContact CG-CG1 4.3Å; P234-V399 HydrophobicContact CG-CG2 3.38Å; L348-V399 HydrophobicContact CD2-CG2 3.98Å; M395-V399 HydrophobicContact CE-CG2 3.82Å; M395-V399 HydrophobicContact CG-CG2 4.31Å; M395-V399 VanDerWaalsContact O-CG2 3.24Å; M395-V399 WeakPolarHBondContact O-CG2 3.22Å; M395-V399 PolarHBondContact O-N 3.43Å; T397-V399 PolarHBondContact O-N 2.93Å; V399-Y402 PolarHBondContact O-N 3.22Å; V399-I403 HydrophobicContact CG1-CD1 3.7Å; V399-I403 HydrophobicContact CG1-CG1 4.33Å; V399-I403 WeakPolarHBondContact O-CB 3.26Å; V399-I403 VanDerWaalsContact O-CG1 3.25Å; V399-I403 WeakPolarHBondContact O-CG1 3.23Å; V399-I403 PolarHBondContact O-N 2.87Å |
| 400 | N | 94.3 | Very high | 87.2 | Confident | 27 Ų | 27 | 45.1 Ų | 45.1 | 14% | 0.144 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.5 | -47.3 | -179.1 | -168.7 | -96.4 | 0 | 0 | 0 | 112.2 | L219 N223 A396 T397 F398 Y402 I403 A404 | L219-N400 HydrophobicContact CB-CB 4.38Å; L219-N400 HydrophobicContact CD2-CB 4.04Å; N223-N400 WeakPolarHBondContact OD1-CA 3.37Å; N223-N400 VanDerWaalsContact OD1-CB 3.25Å; N223-N400 WeakPolarHBondContact OD1-CB 3.48Å; N223-N400 PolarHBondContact OD1-ND2 3.5Å; A396-N400 PolarHBondContact O-N 3.47Å; A396-N400 VanDerWaalsContact O-N 3.15Å; T397-N400 PolarHBondContact O-N 3.41Å; F398-N400 VanDerWaalsContact C-N 3.28Å; F398-N400 PolarHBondContact O-N 3.48Å; N400-Y402 VanDerWaalsContact C-N 3.28Å; N400-Y402 PolarHBondContact O-N 3.43Å; N400-I403 PolarHBondContact O-N 2.97Å; N400-A404 WeakPolarHBondContact O-CB 3.34Å; N400-A404 PolarHBondContact O-N 3.13Å |
| 401 | V | 94.1 | Very high | 86.1 | Confident | 80 Ų | 80 | 48.5 Ų | 48.5 | 49% | 0.485 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -62.7 | -38.9 | 176.2 | 173 | 0 | 0 | 0 | 0 | 110.9 | T397 F398 A404 S405 | T397-V401 HydrophobicContact CG2-CG2 4.35Å; T397-V401 WeakPolarHBondContact O-CG2 3.31Å; T397-V401 PolarHBondContact O-N 3.32Å; F398-V401 PolarHBondContact O-N 3.33Å; V401-A404 PolarHBondContact O-N 3.3Å; V401-S405 VanDerWaalsContact O-CB 3.25Å; V401-S405 WeakPolarHBondContact O-CB 3.34Å; V401-S405 PolarHBondContact O-N 3.33Å; V401-S405 PolarHBondContact O-OG 3.24Å |
| 402 | Y | 94.6 | Very high | 85.1 | Confident | 24 Ų | 24 | 52.8 Ų | 52.8 | 9% | 0.094 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.5 | -48.3 | 178.8 | -169.8 | -87.3 | 0 | 0 | 0 | 111.3 | W230 H344 A347 L348 F398 V399 N400 A404 S405 F406 I407 | W230-Y402 HydrophobicContact CZ3-CD1 4.29Å; H344-Y402 HydrophobicContact CB-CE1 3.91Å; H344-Y402 AromaticContact CG-CE1 3.99Å; H344-Y402 AromaticContact ND1-CE1 3.47Å; H344-Y402 WeakPolarHBondContact ND1-CE1 3.28Å; H344-Y402 AromaticContact ND1-CZ 3.56Å; H344-Y402 PolarHBondContact ND1-OH 2.91Å; A347-Y402 HydrophobicContact CB-CE2 3.71Å; L348-Y402 HydrophobicContact CD2-CD1 4.39Å; L348-Y402 HydrophobicContact CD2-CG 4.45Å; F398-Y402 HydrophobicContact CE1-CD2 4.3Å; F398-Y402 HydrophobicContact CE2-CD2 4.23Å; F398-Y402 AromaticContact CZ-CD2 3.74Å; F398-Y402 HydrophobicContact CZ-CD2 3.74Å; F398-Y402 HydrophobicContact CZ-CE2 4.41Å; F398-Y402 HydrophobicContact CZ-CG 4.45Å; F398-Y402 WeakPolarHBondContact O-CB 3.35Å; F398-Y402 PolarHBondContact O-N 3.1Å; V399-Y402 PolarHBondContact O-N 3.22Å; N400-Y402 VanDerWaalsContact C-N 3.28Å; N400-Y402 PolarHBondContact O-N 3.43Å; Y402-A404 VanDerWaalsContact C-N 3.35Å; Y402-A404 PolarHBondContact O-N 3.29Å; Y402-S405 PolarHBondContact O-N 3.39Å; Y402-F406 HydrophobicContact CD1-CD2 4.32Å; Y402-F406 AromaticContact CD2-CD2 3.53Å; Y402-F406 HydrophobicContact CD2-CD2 3.53Å; Y402-F406 AromaticContact CD2-CE2 3.82Å; Y402-F406 HydrophobicContact CD2-CE2 3.82Å; Y402-F406 HydrophobicContact CE1-CB 4.34Å; Y402-F406 HydrophobicContact CE1-CD2 4.35Å; Y402-F406 AromaticContact CE2-CD2 3.56Å; Y402-F406 HydrophobicContact CE2-CD2 3.56Å; Y402-F406 AromaticContact CE2-CE2 3.89Å; Y402-F406 HydrophobicContact CE2-CE2 3.89Å; Y402-F406 HydrophobicContact CE2-CG 4.38Å; Y402-F406 AromaticContact CG-CD2 3.93Å; Y402-F406 HydrophobicContact CG-CD2 3.93Å; Y402-F406 AromaticContact CZ-CD2 3.98Å; Y402-F406 WeakPolarHBondContact O-CB 3.43Å; Y402-F406 WeakPolarHBondContact O-CD2 3.16Å; Y402-F406 PolarHBondContact O-N 2.81Å; Y402-I407 HydrophobicContact CD1-CG1 4.47Å; Y402-I407 HydrophobicContact CE1-CD1 4.44Å; Y402-I407 HydrophobicContact CE1-CG1 4.5Å |
| 403 | I | 91 | Very high | 83.6 | Confident | 2 Ų | 2 | 56 Ų | 56 | 1% | 0.01 | 33% | 0.329 | C | S | . | . | I | π-helix | trans | -58.7 | -48.7 | 174.4 | -68.9 | 166.5 | 0 | 0 | 0 | 109.8 | N223 E226 W230 V399 N400 S405 I407 R408 | N223-I403 HydrophobicContact CB-CD1 4.43Å; E226-I403 HydrophobicContact CG-CG2 4.46Å; W230-I403 HydrophobicContact CB-CD1 3.83Å; W230-I403 HydrophobicContact CD2-CD1 3.54Å; W230-I403 HydrophobicContact CD2-CG1 3.72Å; W230-I403 HydrophobicContact CE3-CD1 3.66Å; W230-I403 HydrophobicContact CE3-CG1 3.55Å; W230-I403 HydrophobicContact CG-CD1 3.63Å; W230-I403 HydrophobicContact CG-CG1 4.32Å; W230-I403 HydrophobicContact CH2-CG1 4.21Å; W230-I403 HydrophobicContact CZ2-CG1 4.33Å; W230-I403 HydrophobicContact CZ3-CD1 4.42Å; W230-I403 HydrophobicContact CZ3-CG1 3.81Å; V399-I403 HydrophobicContact CG1-CD1 3.7Å; V399-I403 HydrophobicContact CG1-CG1 4.33Å; V399-I403 WeakPolarHBondContact O-CB 3.26Å; V399-I403 VanDerWaalsContact O-CG1 3.25Å; V399-I403 WeakPolarHBondContact O-CG1 3.23Å; V399-I403 PolarHBondContact O-N 2.87Å; N400-I403 PolarHBondContact O-N 2.97Å; I403-S405 VanDerWaalsContact C-N 3.25Å; I403-S405 PolarHBondContact O-N 3.18Å; I403-I407 HydrophobicContact CG2-CB 4.28Å; I403-I407 CarbonylContact O-C 3.02Å; I403-I407 WeakPolarHBondContact O-CA 2.95Å; I403-I407 WeakPolarHBondContact O-CB 3.36Å; I403-I407 PolarHBondContact O-N 3.37Å; I403-R408 HydrophobicContact CG2-CG 3.88Å; I403-R408 PolarHBondContact O-N 3.1Å |
| 404 | A | 88.8 | Confident | 82.3 | Confident | 50 Ų | 50 | 59.2 Ų | 59.2 | 41% | 0.413 | 34% | 0.343 | S | S | . | . | I | π-helix | trans | -62.6 | -31.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | N400 V401 Y402 | N400-A404 WeakPolarHBondContact O-CB 3.34Å; N400-A404 PolarHBondContact O-N 3.13Å; V401-A404 PolarHBondContact O-N 3.3Å; Y402-A404 VanDerWaalsContact C-N 3.35Å; Y402-A404 PolarHBondContact O-N 3.29Å |
| 405 | S | 89.7 | Confident | 81.4 | Confident | 79 Ų | 79 | 59.5 Ų | 59.5 | 55% | 0.552 | 35% | 0.348 | S | S | * | . | I | π-helix | trans | -91.7 | -38.6 | -174.7 | -55.2 | 0 | 0 | 0 | 0 | 113.5 | V401 Y402 I403 | V401-S405 VanDerWaalsContact O-CB 3.25Å; V401-S405 WeakPolarHBondContact O-CB 3.34Å; V401-S405 PolarHBondContact O-N 3.33Å; V401-S405 PolarHBondContact O-OG 3.24Å; Y402-S405 PolarHBondContact O-N 3.39Å; I403-S405 VanDerWaalsContact C-N 3.25Å; I403-S405 PolarHBondContact O-N 3.18Å |
| 406 | F | 87.8 | Confident | 80.7 | Confident | 142 Ų | 142 | 63.1 Ų | 63.1 | 62% | 0.623 | 37% | 0.37 | S | S | * | . | I | π-helix | trans | -114.5 | -16.4 | -169.3 | -60.6 | -70.1 | 0 | 0 | 0 | 114.2 | Y402 | Y402-F406 HydrophobicContact CD1-CD2 4.32Å; Y402-F406 AromaticContact CD2-CD2 3.53Å; Y402-F406 HydrophobicContact CD2-CD2 3.53Å; Y402-F406 AromaticContact CD2-CE2 3.82Å; Y402-F406 HydrophobicContact CD2-CE2 3.82Å; Y402-F406 HydrophobicContact CE1-CB 4.34Å; Y402-F406 HydrophobicContact CE1-CD2 4.35Å; Y402-F406 AromaticContact CE2-CD2 3.56Å; Y402-F406 HydrophobicContact CE2-CD2 3.56Å; Y402-F406 AromaticContact CE2-CE2 3.89Å; Y402-F406 HydrophobicContact CE2-CE2 3.89Å; Y402-F406 HydrophobicContact CE2-CG 4.38Å; Y402-F406 AromaticContact CG-CD2 3.93Å; Y402-F406 HydrophobicContact CG-CD2 3.93Å; Y402-F406 AromaticContact CZ-CD2 3.98Å; Y402-F406 WeakPolarHBondContact O-CB 3.43Å; Y402-F406 WeakPolarHBondContact O-CD2 3.16Å; Y402-F406 PolarHBondContact O-N 2.81Å |
| 407 | I | 85.4 | Confident | 79.6 | Confident | 48 Ų | 48 | 69 Ų | 69 | 25% | 0.246 | 40% | 0.396 | C | S | . | . | I | π-helix | trans | -118.5 | -51.2 | -170.3 | -50.5 | -64.4 | 0 | 0 | 0 | 111.9 | W230 L315 Y402 I403 G409 | W230-I407 HydrophobicContact CH2-CD1 3.69Å; W230-I407 HydrophobicContact CH2-CG1 3.52Å; W230-I407 HydrophobicContact CH2-CG2 4.46Å; W230-I407 HydrophobicContact CZ2-CB 4.36Å; W230-I407 HydrophobicContact CZ2-CD1 4.04Å; W230-I407 HydrophobicContact CZ2-CG1 3.8Å; W230-I407 HydrophobicContact CZ2-CG2 3.85Å; W230-I407 HydrophobicContact CZ3-CG1 4.43Å; L315-I407 HydrophobicContact CD1-CD1 4.32Å; L315-I407 HydrophobicContact CD2-CD1 4.16Å; L315-I407 HydrophobicContact CD2-CG2 4.02Å; Y402-I407 HydrophobicContact CD1-CG1 4.47Å; Y402-I407 HydrophobicContact CE1-CD1 4.44Å; Y402-I407 HydrophobicContact CE1-CG1 4.5Å; I403-I407 HydrophobicContact CG2-CB 4.28Å; I403-I407 CarbonylContact O-C 3.02Å; I403-I407 WeakPolarHBondContact O-CA 2.95Å; I403-I407 WeakPolarHBondContact O-CB 3.36Å; I403-I407 PolarHBondContact O-N 3.37Å; I407-G409 PolarHBondContact O-N 3.02Å |
| 408 | R | 73.9 | Confident | 78.6 | Confident | 98 Ų | 98 | 72.5 Ų | 72.5 | 37% | 0.37 | 41% | 0.409 | S | S | . | . | trans | -69.4 | 100.6 | -178.7 | -88.9 | -179.5 | -177.8 | 166.5 | -2.7 | 110 | E226 I403 | E226-R408 VanDerWaalsContact CD-NE 3.3Å; E226-R408 IonicContact OE1-CZ 3.34Å; E226-R408 IonicContact OE1-NE 3.93Å; E226-R408 IonicContact OE1-NH2 3.11Å; E226-R408 PolarHBondContact OE1-NH2 3.21Å; E226-R408 IonicContact OE2-CZ 3.7Å; E226-R408 IonicContact OE2-NE 3.14Å; E226-R408 PolarHBondContact OE2-NE 3.28Å; E226-R408 IonicContact OE2-NH2 3.32Å; I403-R408 HydrophobicContact CG2-CG 3.88Å; I403-R408 PolarHBondContact O-N 3.1Å | ||
| 409 | G | 64.6 | Low | 78 | Confident | 54 Ų | 54 | 72.9 Ų | 72.9 | 56% | 0.557 | 41% | 0.413 | S | S | * | . | trans | -74.9 | 165.7 | 154.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | I407 N411 | I407-G409 PolarHBondContact O-N 3.02Å; G409-N411 PolarHBondContact O-N 3.39Å; G409-N411 VanDerWaalsContact O-N 3.11Å | ||
| 410 | P | 56.8 | Low | 77.3 | Confident | 123 Ų | 123 | 78.1 Ų | 78.1 | 80% | 0.799 | 44% | 0.44 | S | S | * | . | trans | -61.2 | 113.8 | 172.7 | 23.8 | -30.9 | 0 | 0 | 0 | 110.1 | P412 | P410-P412 WeakPolarHBondContact O-CD 3.42Š| ||
| 411 | N | 60.3 | Low | 76.5 | Confident | 91 Ų | 91 | 80.9 Ų | 80.9 | 49% | 0.487 | 47% | 0.466 | S | S | . | . | trans | -70.1 | 110.4 | 177.8 | -177.5 | -27 | 0 | 0 | 0 | 109.8 | G409 S413 K414 V415 | G409-N411 PolarHBondContact O-N 3.39Å; G409-N411 VanDerWaalsContact O-N 3.11Å; N411-S413 VanDerWaalsContact C-N 3.26Å; N411-S413 PolarHBondContact O-N 2.86Å; N411-S413 WeakPolarHBondContact OD1-CB 3.45Å; N411-S413 PolarHBondContact OD1-N 2.99Å; N411-K414 HydrophobicContact CB-CB 4.2Å; N411-K414 PolarHBondContact O-N 3.47Å; N411-K414 PolarHBondContact OD1-N 3.43Å; N411-V415 WeakPolarHBondContact O-CG2 3.36Å; N411-V415 PolarHBondContact O-N 2.96Å | ||
| 412 | P | 64.3 | Low | 76 | Confident | 96 Ų | 96 | 79.9 Ų | 79.9 | 62% | 0.623 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -61.5 | -35.5 | -175.7 | -20.8 | 33.5 | 0 | 0 | 0 | 112.2 | P410 V415 V416 | P410-P412 WeakPolarHBondContact O-CD 3.42Å; P412-V415 PolarHBondContact O-N 2.88Å; P412-V416 VanDerWaalsContact O-CG2 3.26Å; P412-V416 WeakPolarHBondContact O-CG2 3.38Å; P412-V416 PolarHBondContact O-N 3.07Å |
| 413 | S | 59.2 | Low | 75.6 | Confident | 77 Ų | 77 | 87.3 Ų | 87.3 | 54% | 0.538 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.9 | -41.3 | -179.2 | -50.2 | 0 | 0 | 0 | 0 | 111.9 | N411 V416 Q417 | N411-S413 VanDerWaalsContact C-N 3.26Å; N411-S413 PolarHBondContact O-N 2.86Å; N411-S413 WeakPolarHBondContact OD1-CB 3.45Å; N411-S413 PolarHBondContact OD1-N 2.99Å; S413-V416 PolarHBondContact O-N 3.25Å; S413-Q417 WeakPolarHBondContact O-CG 3.5Å; S413-Q417 PolarHBondContact O-N 3.3Å |
| 414 | K | 59.7 | Low | 75.6 | Confident | 89 Ų | 89 | 91.7 Ų | 91.7 | 39% | 0.387 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.5 | -39.6 | 175.6 | -168.5 | 171.4 | -175.8 | 169.9 | 0 | 110.9 | D153 N411 Q417 Q418 | D153-K414 IonicContact OD2-NZ 3.64Å; D153-K414 PolarHBondContact OD2-NZ 3.48Å; N411-K414 HydrophobicContact CB-CB 4.2Å; N411-K414 PolarHBondContact O-N 3.47Å; N411-K414 PolarHBondContact OD1-N 3.43Å; K414-Q417 PolarHBondContact O-N 2.98Å; K414-Q418 WeakPolarHBondContact O-CG 3.46Å; K414-Q418 PolarHBondContact O-N 3.46Å |
| 415 | V | 73.2 | Confident | 75.6 | Confident | 67 Ų | 67 | 94.1 Ų | 94.1 | 41% | 0.406 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.7 | -46.7 | 173.8 | 176.4 | 0 | 0 | 0 | 0 | 110.3 | N411 P412 Q417 Q418 L419 | N411-V415 WeakPolarHBondContact O-CG2 3.36Å; N411-V415 PolarHBondContact O-N 2.96Å; P412-V415 PolarHBondContact O-N 2.88Å; V415-Q417 PolarHBondContact O-N 3.37Å; V415-Q418 PolarHBondContact O-N 3.26Å; V415-L419 HydrophobicContact CG1-CD1 4.2Å; V415-L419 HydrophobicContact CG1-CG 4.42Å; V415-L419 VanDerWaalsContact O-CG 3.26Å; V415-L419 WeakPolarHBondContact O-CG 3.41Å; V415-L419 PolarHBondContact O-N 3.47Å |
| 416 | V | 78.5 | Confident | 75.6 | Confident | 77 Ų | 77 | 94.3 Ų | 94.3 | 47% | 0.467 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.6 | -44 | 177.6 | 171 | 0 | 0 | 0 | 0 | 111.5 | P412 S413 Q418 L419 L420 | P412-V416 VanDerWaalsContact O-CG2 3.26Å; P412-V416 WeakPolarHBondContact O-CG2 3.38Å; P412-V416 PolarHBondContact O-N 3.07Å; S413-V416 PolarHBondContact O-N 3.25Å; V416-Q418 VanDerWaalsContact C-N 3.34Å; V416-Q418 PolarHBondContact O-N 3.04Å; V416-L419 WeakPolarHBondContact O-CB 3.39Å; V416-L419 PolarHBondContact O-N 3.43Å; V416-L419 VanDerWaalsContact O-N 3.16Å; V416-L420 HydrophobicContact CG1-CD1 3.98Å; V416-L420 HydrophobicContact CG1-CG 4.31Å; V416-L420 VanDerWaalsContact O-CG 3.29Å; V416-L420 WeakPolarHBondContact O-CG 3.3Å; V416-L420 PolarHBondContact O-N 3.19Å |
| 417 | Q | 70.3 | Confident | 75.7 | Confident | 129 Ų | 129 | 90.6 Ų | 90.6 | 60% | 0.603 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.8 | -40.8 | 176 | -76.2 | -179.5 | -3.7 | 0 | 0 | 112.5 | S413 K414 V415 L419 L420 A421 | S413-Q417 WeakPolarHBondContact O-CG 3.5Å; S413-Q417 PolarHBondContact O-N 3.3Å; K414-Q417 PolarHBondContact O-N 2.98Å; V415-Q417 PolarHBondContact O-N 3.37Å; Q417-L419 VanDerWaalsContact C-N 3.32Å; Q417-L419 PolarHBondContact O-N 3.35Å; Q417-L420 PolarHBondContact O-N 2.7Å; Q417-A421 PolarHBondContact O-N 3.18Å; Q417-A421 VanDerWaalsContact O-N 3.09Å |
| 418 | Q | 73.3 | Confident | 75.9 | Confident | 121 Ų | 121 | 93.6 Ų | 93.6 | 57% | 0.565 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.4 | -39.6 | 174 | -73.7 | 177.6 | -11.6 | 0 | 0 | 111.8 | K414 V415 V416 A421 | K414-Q418 WeakPolarHBondContact O-CG 3.46Å; K414-Q418 PolarHBondContact O-N 3.46Å; V415-Q418 PolarHBondContact O-N 3.26Å; V416-Q418 VanDerWaalsContact C-N 3.34Å; V416-Q418 PolarHBondContact O-N 3.04Å; Q418-A421 PolarHBondContact O-N 2.88Å |
| 419 | L | 82.8 | Confident | 76.8 | Confident | 54 Ų | 54 | 97 Ų | 97 | 28% | 0.283 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.6 | -43.5 | 174.1 | -68.9 | 176 | 0 | 0 | 0 | 111.5 | V415 V416 Q417 A421 L422 Q427 I430 | V415-L419 HydrophobicContact CG1-CD1 4.2Å; V415-L419 HydrophobicContact CG1-CG 4.42Å; V415-L419 VanDerWaalsContact O-CG 3.26Å; V415-L419 WeakPolarHBondContact O-CG 3.41Å; V415-L419 PolarHBondContact O-N 3.47Å; V416-L419 WeakPolarHBondContact O-CB 3.39Å; V416-L419 PolarHBondContact O-N 3.43Å; V416-L419 VanDerWaalsContact O-N 3.16Å; Q417-L419 VanDerWaalsContact C-N 3.32Å; Q417-L419 PolarHBondContact O-N 3.35Å; L419-A421 PolarHBondContact O-N 2.9Å; L419-L422 HydrophobicContact CD2-CD1 3.95Å; L419-L422 VanDerWaalsContact O-CB 3.31Å; L419-L422 WeakPolarHBondContact O-CB 3.4Å; L419-L422 PolarHBondContact O-N 3.09Å; L419-L422 VanDerWaalsContact O-N 3.09Å; L419-Q427 VanDerWaalsContact O-CG 3.31Å; L419-Q427 WeakPolarHBondContact O-CG 3.44Å; L419-I430 HydrophobicContact CD1-CG2 4.25Å; L419-I430 HydrophobicContact CD2-CB 4.39Å; L419-I430 HydrophobicContact CD2-CD1 3.38Å; L419-I430 HydrophobicContact CD2-CG1 4.41Å; L419-I430 HydrophobicContact CD2-CG2 3.79Å |
| 420 | L | 81.9 | Confident | 78.1 | Confident | 113 Ų | 113 | 97.1 Ų | 97.1 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.9 | -21.8 | 178.7 | -69 | 172.9 | 0 | 0 | 0 | 113.3 | V416 Q417 L422 Q427 | V416-L420 HydrophobicContact CG1-CD1 3.98Å; V416-L420 HydrophobicContact CG1-CG 4.31Å; V416-L420 VanDerWaalsContact O-CG 3.29Å; V416-L420 WeakPolarHBondContact O-CG 3.3Å; V416-L420 PolarHBondContact O-N 3.19Å; Q417-L420 PolarHBondContact O-N 2.7Å; L420-L422 VanDerWaalsContact C-N 3.32Å; L420-Q427 PolarHBondContact O-NE2 3.28Å |
| 421 | A | 77.1 | Confident | 79.7 | Confident | 84 Ų | 84 | 97.3 Ų | 97.3 | 69% | 0.694 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | -13.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q417 Q418 L419 | Q417-A421 PolarHBondContact O-N 3.18Å; Q417-A421 VanDerWaalsContact O-N 3.09Å; Q418-A421 PolarHBondContact O-N 2.88Å; L419-A421 PolarHBondContact O-N 2.9Å |
| 422 | L | 83.3 | Confident | 81.2 | Confident | 60 Ų | 60 | 97 Ų | 97 | 31% | 0.314 | 50% | 0.504 | S | S | . | . | S | Bend | trans | -73.7 | 165.4 | 177.5 | -64.2 | 167.2 | 0 | 0 | 0 | 111.6 | L419 L420 Q426 Q427 I430 | L419-L422 HydrophobicContact CD2-CD1 3.95Å; L419-L422 VanDerWaalsContact O-CB 3.31Å; L419-L422 WeakPolarHBondContact O-CB 3.4Å; L419-L422 PolarHBondContact O-N 3.09Å; L419-L422 VanDerWaalsContact O-N 3.09Å; L420-L422 VanDerWaalsContact C-N 3.32Å; L422-Q426 HydrophobicContact CB-CB 4.18Å; L422-Q427 HydrophobicContact CB-CG 4.16Å; L422-Q427 PolarHBondContact O-NE2 3.46Å; L422-I430 HydrophobicContact CD1-CD1 3.55Å |
| 423 | R | 86.8 | Confident | 82.5 | Confident | 180 Ų | 180 | 95.5 Ų | 95.5 | 68% | 0.679 | 50% | 0.496 | S | S | * | . | trans | -66.5 | 151 | 170.9 | -71.9 | -176.7 | -80.1 | -166.5 | -5.3 | 111 | D425 Q426 Q427 | R423-D425 WeakPolarHBondContact CB-OD1 3.09Å; R423-D425 PolarHBondContact O-N 3.49Å; R423-Q426 PolarHBondContact O-N 2.92Å; R423-Q427 WeakPolarHBondContact O-CG 3.46Å; R423-Q427 PolarHBondContact O-N 2.87Å | ||
| 424 | S | 89.7 | Confident | 84 | Confident | 93 Ų | 93 | 96.6 Ų | 96.6 | 65% | 0.65 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -57.6 | -33 | -174.2 | -49.4 | 0 | 0 | 0 | 0 | 113.8 | L428 | S424-L428 WeakPolarHBondContact O-CB 3.29Å; S424-L428 PolarHBondContact O-N 2.66Å |
| 425 | D | 90.1 | Very high | 85.4 | Confident | 102 Ų | 102 | 97.6 Ų | 97.6 | 55% | 0.545 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.4 | -42.8 | 174.3 | 61 | -43.8 | 0 | 0 | 0 | 112.2 | R423 L428 Y429 | R423-D425 WeakPolarHBondContact CB-OD1 3.09Å; R423-D425 PolarHBondContact O-N 3.49Å; D425-L428 PolarHBondContact O-N 3.43Å; D425-Y429 PolarHBondContact O-N 3.24Å; D425-Y429 VanDerWaalsContact O-N 3.09Å |
| 426 | Q | 89 | Confident | 86.2 | Confident | 83 Ų | 83 | 97.2 Ų | 97.2 | 39% | 0.388 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -71.5 | -37.6 | 177.4 | -62.6 | -160.7 | -44.8 | 0 | 0 | 112.1 | L422 R423 L428 Y429 I430 | L422-Q426 HydrophobicContact CB-CB 4.18Å; R423-Q426 PolarHBondContact O-N 2.92Å; Q426-L428 VanDerWaalsContact C-N 3.35Å; Q426-L428 PolarHBondContact O-N 3.41Å; Q426-Y429 PolarHBondContact O-N 3.34Å; Q426-I430 VanDerWaalsContact O-CG1 3.31Å; Q426-I430 WeakPolarHBondContact O-CG1 3.17Å; Q426-I430 PolarHBondContact O-N 3.16Å |
| 427 | Q | 89.8 | Confident | 86.7 | Confident | 63 Ų | 63 | 98.2 Ų | 98.2 | 29% | 0.294 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.5 | -47.5 | 173.1 | -67.5 | -179.3 | 13.8 | 0 | 0 | 111.3 | L419 L420 L422 R423 Y429 I430 F431 | L419-Q427 VanDerWaalsContact O-CG 3.31Å; L419-Q427 WeakPolarHBondContact O-CG 3.44Å; L420-Q427 PolarHBondContact O-NE2 3.28Å; L422-Q427 HydrophobicContact CB-CG 4.16Å; L422-Q427 PolarHBondContact O-NE2 3.46Å; R423-Q427 WeakPolarHBondContact O-CG 3.46Å; R423-Q427 PolarHBondContact O-N 2.87Å; Q427-Y429 VanDerWaalsContact C-N 3.35Å; Q427-Y429 PolarHBondContact O-N 3.29Å; Q427-I430 PolarHBondContact O-N 3.4Å; Q427-F431 WeakPolarHBondContact O-CB 3.48Å; Q427-F431 PolarHBondContact O-N 3.21Å |
| 428 | L | 89.4 | Confident | 87.7 | Confident | 112 Ų | 112 | 94.9 Ų | 94.9 | 59% | 0.586 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.2 | -40.2 | -179.6 | -146.9 | 89.3 | 0 | 0 | 0 | 111.8 | S424 D425 Q426 F431 N432 | S424-L428 WeakPolarHBondContact O-CB 3.29Å; S424-L428 PolarHBondContact O-N 2.66Å; D425-L428 PolarHBondContact O-N 3.43Å; Q426-L428 VanDerWaalsContact C-N 3.35Å; Q426-L428 PolarHBondContact O-N 3.41Å; L428-F431 PolarHBondContact O-N 3.41Å; L428-N432 WeakPolarHBondContact O-CB 3.21Å; L428-N432 VanDerWaalsContact O-CG 3.3Å; L428-N432 PolarHBondContact O-N 3.49Å; L428-N432 PolarHBondContact O-ND2 3.49Å; L428-N432 VanDerWaalsContact O-ND2 3.11Å |
| 429 | Y | 92.6 | Very high | 88.3 | Confident | 168 Ų | 168 | 92.8 Ų | 92.8 | 66% | 0.659 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -60.4 | -48.5 | 175.3 | 175.4 | -97.6 | 0 | 0 | 0 | 111.8 | D425 Q426 Q427 F431 N432 S433 | D425-Y429 PolarHBondContact O-N 3.24Å; D425-Y429 VanDerWaalsContact O-N 3.09Å; Q426-Y429 PolarHBondContact O-N 3.34Å; Q427-Y429 VanDerWaalsContact C-N 3.35Å; Q427-Y429 PolarHBondContact O-N 3.29Å; Y429-F431 PolarHBondContact O-N 3.42Å; Y429-N432 PolarHBondContact O-N 2.88Å; Y429-S433 WeakPolarHBondContact O-CB 3.36Å; Y429-S433 PolarHBondContact O-N 3.32Å |
| 430 | I | 91.8 | Very high | 88.6 | Confident | 57 Ų | 57 | 97.7 Ų | 97.7 | 29% | 0.292 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.5 | -42.9 | -179.6 | -67.1 | 170.1 | 0 | 0 | 0 | 110.6 | L419 L422 Q426 Q427 N432 S433 L434 | L419-I430 HydrophobicContact CD1-CG2 4.25Å; L419-I430 HydrophobicContact CD2-CB 4.39Å; L419-I430 HydrophobicContact CD2-CD1 3.38Å; L419-I430 HydrophobicContact CD2-CG1 4.41Å; L419-I430 HydrophobicContact CD2-CG2 3.79Å; L422-I430 HydrophobicContact CD1-CD1 3.55Å; Q426-I430 VanDerWaalsContact O-CG1 3.31Å; Q426-I430 WeakPolarHBondContact O-CG1 3.17Å; Q426-I430 PolarHBondContact O-N 3.16Å; Q427-I430 PolarHBondContact O-N 3.4Å; I430-N432 PolarHBondContact O-N 3.19Å; I430-S433 PolarHBondContact O-N 3.01Å; I430-L434 WeakPolarHBondContact O-CB 3.41Å; I430-L434 PolarHBondContact O-N 2.85Å |
| 431 | F | 91.4 | Very high | 88.9 | Confident | 128 Ų | 128 | 98.9 Ų | 98.9 | 56% | 0.561 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58 | -48.5 | 175.4 | 176.2 | -98.8 | 0 | 0 | 0 | 112 | Q427 L428 Y429 S433 L434 K435 | Q427-F431 WeakPolarHBondContact O-CB 3.48Å; Q427-F431 PolarHBondContact O-N 3.21Å; L428-F431 PolarHBondContact O-N 3.41Å; Y429-F431 PolarHBondContact O-N 3.42Å; F431-S433 PolarHBondContact O-N 3Å; F431-L434 PolarHBondContact O-N 3.3Å; F431-K435 HydrophobicContact CE1-CD 4.37Å; F431-K435 VanDerWaalsContact O-CB 3.3Å; F431-K435 WeakPolarHBondContact O-CB 3.22Å; F431-K435 PolarHBondContact O-N 3.16Å |
| 432 | N | 91.1 | Very high | 89.2 | Confident | 85 Ų | 85 | 96.6 Ų | 96.6 | 46% | 0.455 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.6 | -38.2 | 179.8 | -73.3 | -33.8 | 0 | 0 | 0 | 112.3 | L428 Y429 I430 K435 A436 | L428-N432 WeakPolarHBondContact O-CB 3.21Å; L428-N432 VanDerWaalsContact O-CG 3.3Å; L428-N432 PolarHBondContact O-N 3.49Å; L428-N432 PolarHBondContact O-ND2 3.49Å; L428-N432 VanDerWaalsContact O-ND2 3.11Å; Y429-N432 PolarHBondContact O-N 2.88Å; I430-N432 PolarHBondContact O-N 3.19Å; N432-K435 PolarHBondContact O-N 2.93Å; N432-A436 WeakPolarHBondContact O-CB 3.31Å; N432-A436 PolarHBondContact O-N 3.02Å |
| 433 | S | 90.9 | Very high | 89.1 | Confident | 64 Ų | 64 | 98.5 Ų | 98.5 | 45% | 0.448 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.3 | -45.6 | 175.6 | -174.1 | 0 | 0 | 0 | 0 | 111.8 | Y429 I430 F431 K435 A436 H437 | Y429-S433 WeakPolarHBondContact O-CB 3.36Å; Y429-S433 PolarHBondContact O-N 3.32Å; I430-S433 PolarHBondContact O-N 3.01Å; F431-S433 PolarHBondContact O-N 3Å; S433-K435 PolarHBondContact O-N 3.27Å; S433-A436 PolarHBondContact O-N 2.95Å; S433-H437 PolarHBondContact O-N 3.4Å |
| 434 | L | 90.6 | Very high | 88.6 | Confident | 100 Ų | 100 | 92.2 Ų | 92.2 | 52% | 0.524 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.7 | -43.7 | 176.2 | -174.3 | 65.9 | 0 | 0 | 0 | 111.2 | I430 F431 A436 H437 L438 | I430-L434 WeakPolarHBondContact O-CB 3.41Å; I430-L434 PolarHBondContact O-N 2.85Å; F431-L434 PolarHBondContact O-N 3.3Å; L434-A436 PolarHBondContact O-N 3.23Å; L434-H437 PolarHBondContact O-N 3.47Å; L434-L438 HydrophobicContact CD1-CD1 4.45Å; L434-L438 HydrophobicContact CD1-CG 4.48Å; L434-L438 HydrophobicContact CG-CD1 4Å; L434-L438 HydrophobicContact CG-CG 4.43Å; L434-L438 WeakPolarHBondContact O-CB 3.43Å; L434-L438 VanDerWaalsContact O-CG 3.3Å; L434-L438 WeakPolarHBondContact O-CG 3.44Å; L434-L438 PolarHBondContact O-N 2.87Å |
| 435 | K | 89.3 | Confident | 87.4 | Confident | 109 Ų | 109 | 97.3 Ų | 97.3 | 47% | 0.474 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.2 | -46.2 | 175.7 | -177.7 | 178.2 | 179.3 | 176.8 | 0 | 111.9 | F431 N432 S433 H437 L438 T439 L444 | F431-K435 HydrophobicContact CE1-CD 4.37Å; F431-K435 VanDerWaalsContact O-CB 3.3Å; F431-K435 WeakPolarHBondContact O-CB 3.22Å; F431-K435 PolarHBondContact O-N 3.16Å; N432-K435 PolarHBondContact O-N 2.93Å; S433-K435 PolarHBondContact O-N 3.27Å; K435-H437 VanDerWaalsContact C-N 3.33Å; K435-H437 PolarHBondContact O-N 3.33Å; K435-L438 PolarHBondContact O-N 3.46Å; K435-T439 WeakPolarHBondContact O-CB 3.37Å; K435-T439 PolarHBondContact O-N 3.29Å; K435-T439 PolarHBondContact O-OG1 3.38Å; K435-L444 HydrophobicContact CG-CD1 3.97Å; K435-L444 WeakPolarHBondContact O-CD1 3.48Å |
| 436 | A | 90 | Very high | 85.9 | Confident | 60 Ų | 60 | 95.4 Ų | 95.4 | 50% | 0.496 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.7 | -45.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | N432 S433 L434 T439 E440 | N432-A436 WeakPolarHBondContact O-CB 3.31Å; N432-A436 PolarHBondContact O-N 3.02Å; S433-A436 PolarHBondContact O-N 2.95Å; L434-A436 PolarHBondContact O-N 3.23Å; A436-T439 WeakPolarHBondContact O-CB 3.34Å; A436-T439 PolarHBondContact O-N 2.88Å; A436-E440 PolarHBondContact O-N 3.31Å |
| 437 | H | 90.6 | Very high | 84.5 | Confident | 97 Ų | 97 | 94.3 Ų | 94.3 | 45% | 0.449 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67 | -39.6 | -179.7 | -153.9 | 60.7 | 0 | 0 | 0 | 113 | S433 L434 K435 T439 E440 K441 | S433-H437 PolarHBondContact O-N 3.4Å; L434-H437 PolarHBondContact O-N 3.47Å; K435-H437 VanDerWaalsContact C-N 3.33Å; K435-H437 PolarHBondContact O-N 3.33Å; H437-T439 VanDerWaalsContact C-N 3.31Å; H437-T439 PolarHBondContact O-N 2.88Å; H437-E440 IonicContact ND1-OE2 3.75Å; H437-E440 PolarHBondContact O-N 3.4Å; H437-K441 PolarHBondContact O-N 2.91Å; H437-K441 VanDerWaalsContact O-N 3.09Å |
| 438 | L | 89.4 | Confident | 83.2 | Confident | 60 Ų | 60 | 98 Ų | 98 | 31% | 0.314 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.2 | -31.1 | 174.6 | -71.4 | 173.3 | 0 | 0 | 0 | 112.4 | L434 K435 G442 L443 L444 | L434-L438 HydrophobicContact CD1-CD1 4.45Å; L434-L438 HydrophobicContact CD1-CG 4.48Å; L434-L438 HydrophobicContact CG-CD1 4Å; L434-L438 HydrophobicContact CG-CG 4.43Å; L434-L438 WeakPolarHBondContact O-CB 3.43Å; L434-L438 VanDerWaalsContact O-CG 3.3Å; L434-L438 WeakPolarHBondContact O-CG 3.44Å; L434-L438 PolarHBondContact O-N 2.87Å; K435-L438 PolarHBondContact O-N 3.46Å; L438-G442 PolarHBondContact O-N 2.9Å; L438-L443 HydrophobicContact CD2-CB 4.5Å; L438-L443 HydrophobicContact CD2-CD1 4.11Å; L438-L443 PolarHBondContact O-N 2.72Å; L438-L443 VanDerWaalsContact O-N 3.12Å; L438-L444 HydrophobicContact CB-CD1 3.52Å; L438-L444 HydrophobicContact CB-CG 3.97Å |
| 439 | T | 87.1 | Confident | 81.6 | Confident | 76 Ų | 76 | 96.8 Ų | 96.8 | 47% | 0.466 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.9 | -43.7 | 175.5 | -54.8 | 0 | 0 | 0 | 0 | 110.5 | K435 A436 H437 K441 G442 L444 | K435-T439 WeakPolarHBondContact O-CB 3.37Å; K435-T439 PolarHBondContact O-N 3.29Å; K435-T439 PolarHBondContact O-OG1 3.38Å; A436-T439 WeakPolarHBondContact O-CB 3.34Å; A436-T439 PolarHBondContact O-N 2.88Å; H437-T439 VanDerWaalsContact C-N 3.31Å; H437-T439 PolarHBondContact O-N 2.88Å; T439-K441 VanDerWaalsContact C-N 3.3Å; T439-K441 PolarHBondContact O-N 3.44Å; T439-G442 PolarHBondContact O-N 3.38Å; T439-L444 WeakPolarHBondContact OG1-CD1 3.36Å |
| 440 | E | 89.9 | Confident | 79.6 | Confident | 157 Ų | 157 | 93.1 Ų | 93.1 | 73% | 0.734 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.3 | -39 | 175.4 | -172.8 | -179 | -172.3 | 0 | 0 | 112 | A436 H437 G442 | A436-E440 PolarHBondContact O-N 3.31Å; H437-E440 IonicContact ND1-OE2 3.75Å; H437-E440 PolarHBondContact O-N 3.4Å; E440-G442 PolarHBondContact O-N 2.86Å |
| 441 | K | 86.8 | Confident | 77.5 | Confident | 138 Ų | 138 | 97 Ų | 97 | 60% | 0.6 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -2.4 | 174.2 | -71.6 | -170 | 176.6 | -175.1 | 0 | 114.6 | H437 T439 L443 | H437-K441 PolarHBondContact O-N 2.91Å; H437-K441 VanDerWaalsContact O-N 3.09Å; T439-K441 VanDerWaalsContact C-N 3.3Å; T439-K441 PolarHBondContact O-N 3.44Å; K441-L443 HydrophobicContact CB-CD1 4.02Å; K441-L443 HydrophobicContact CB-CG 4.15Å; K441-L443 HydrophobicContact CD-CD1 4.41Å; K441-L443 PolarHBondContact O-N 3.24Å |
| 442 | G | 83.8 | Confident | 76.8 | Confident | 37 Ų | 37 | 95.4 Ų | 95.4 | 38% | 0.381 | 56% | 0.557 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 70.1 | 6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | L438 T439 E440 | L438-G442 PolarHBondContact O-N 2.9Å; T439-G442 PolarHBondContact O-N 3.38Å; E440-G442 PolarHBondContact O-N 2.86Å |
| 443 | L | 81.9 | Confident | 76.1 | Confident | 100 Ų | 100 | 95.9 Ų | 95.9 | 52% | 0.524 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -74.5 | -30.8 | -174.7 | -68.3 | 168.2 | 0 | 0 | 0 | 112.6 | L438 K441 A446 A447 | L438-L443 HydrophobicContact CD2-CB 4.5Å; L438-L443 HydrophobicContact CD2-CD1 4.11Å; L438-L443 PolarHBondContact O-N 2.72Å; L438-L443 VanDerWaalsContact O-N 3.12Å; K441-L443 HydrophobicContact CB-CD1 4.02Å; K441-L443 HydrophobicContact CB-CG 4.15Å; K441-L443 HydrophobicContact CD-CD1 4.41Å; K441-L443 PolarHBondContact O-N 3.24Å; L443-A446 PolarHBondContact O-N 2.9Å; L443-A447 PolarHBondContact O-N 3.09Å; L443-A447 VanDerWaalsContact O-N 3.14Å |
| 444 | L | 75 | Confident | 75.3 | Confident | 47 Ų | 47 | 97.7 Ų | 97.7 | 25% | 0.246 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -67.5 | -41.2 | 178.3 | -96 | 157.1 | 0 | 0 | 0 | 112.8 | K435 L438 T439 A446 A447 E448 | K435-L444 HydrophobicContact CG-CD1 3.97Å; K435-L444 WeakPolarHBondContact O-CD1 3.48Å; L438-L444 HydrophobicContact CB-CD1 3.52Å; L438-L444 HydrophobicContact CB-CG 3.97Å; T439-L444 WeakPolarHBondContact OG1-CD1 3.36Å; L444-A446 VanDerWaalsContact C-N 3.33Å; L444-A446 PolarHBondContact O-N 2.88Å; L444-A447 PolarHBondContact O-N 3.43Å; L444-E448 WeakPolarHBondContact O-CG 3.41Å; L444-E448 PolarHBondContact O-N 3.03Å |
| 445 | R | 65.9 | Low | 74.4 | Confident | 201 Ų | 201 | 97.6 Ų | 97.6 | 76% | 0.758 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67.2 | -33.8 | 176.3 | -78.1 | -175 | 175.9 | 172.4 | -0.5 | 112.6 | A449 | R445-A449 VanDerWaalsContact O-CB 3.32Å; R445-A449 WeakPolarHBondContact O-CB 3.28Å; R445-A449 PolarHBondContact O-N 2.98Å; R445-A449 VanDerWaalsContact O-N 3.1Å |
| 446 | A | 58.3 | Low | 73.4 | Confident | 62 Ų | 62 | 96.9 Ų | 96.9 | 51% | 0.512 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.1 | -35.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | L443 L444 A450 | L443-A446 PolarHBondContact O-N 2.9Å; L444-A446 VanDerWaalsContact C-N 3.33Å; L444-A446 PolarHBondContact O-N 2.88Å; A446-A450 WeakPolarHBondContact O-CB 3.49Å; A446-A450 PolarHBondContact O-N 2.63Å |
| 447 | A | 58.6 | Low | 72.3 | Confident | 60 Ų | 60 | 99.3 Ų | 99.3 | 50% | 0.496 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -71.9 | -41.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L443 L444 A449 A450 A451 | L443-A447 PolarHBondContact O-N 3.09Å; L443-A447 VanDerWaalsContact O-N 3.14Å; L444-A447 PolarHBondContact O-N 3.43Å; A447-A449 VanDerWaalsContact C-N 3.29Å; A447-A449 PolarHBondContact O-N 3.44Å; A447-A450 PolarHBondContact O-N 2.68Å; A447-A451 PolarHBondContact O-N 2.92Å; A447-A451 VanDerWaalsContact O-N 3.15Å |
| 448 | E | 62.8 | Low | 71 | Confident | 140 Ų | 140 | 99.5 Ų | 99.5 | 65% | 0.654 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68 | -24.8 | 175.9 | -74.3 | 175.5 | 170.1 | 0 | 0 | 113.4 | L444 | L444-E448 WeakPolarHBondContact O-CG 3.41Å; L444-E448 PolarHBondContact O-N 3.03Å |
| 449 | A | 54.9 | Low | 69.6 | Low | 87 Ų | 87 | 102.5 Ų | 102.5 | 72% | 0.719 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -14.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | R445 A447 | R445-A449 VanDerWaalsContact O-CB 3.32Å; R445-A449 WeakPolarHBondContact O-CB 3.28Å; R445-A449 PolarHBondContact O-N 2.98Å; R445-A449 VanDerWaalsContact O-N 3.1Å; A447-A449 VanDerWaalsContact C-N 3.29Å; A447-A449 PolarHBondContact O-N 3.44Å |
| 450 | A | 52.6 | Low | 68.2 | Low | 90 Ų | 90 | 104.8 Ų | 104.8 | 74% | 0.744 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | -14.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | A446 A447 | A446-A450 WeakPolarHBondContact O-CB 3.49Å; A446-A450 PolarHBondContact O-N 2.63Å; A447-A450 PolarHBondContact O-N 2.68Å |
| 451 | A | 47.3 | Very low | 66.2 | Low | 138 Ų | 138 | 100 Ų | 100 | 100% | 1.141 | 62% | 0.616 | S | S | * | * | trans | -93.7 | 0 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | A447 | A447-A451 PolarHBondContact O-N 2.92Å; A447-A451 VanDerWaalsContact O-N 3.15Å |
Retrieved 451 of 451 residues in 640.6 ms
(Link to these results)