| 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 | 30.1 | Very low | 31.8 | Very low | 218 Ų | 218 | 156.5 Ų | 156.5 | 100% | 1.074 | 81% | 0.811 | S | S | * | * | 0 | 96.3 | 0 | -72.8 | 175.4 | 85.5 | 0 | 0 | 106 | |||||
| 2 | E | 30.4 | Very low | 31.3 | Very low | 164 Ų | 164 | 158.8 Ų | 158.8 | 77% | 0.766 | 82% | 0.815 | S | S | * | * | 75.9 | 118.1 | 94.7 | -79.9 | -172.6 | 151.5 | 0 | 0 | 111.1 | |||||
| 3 | Q | 32.7 | Very low | 31.3 | Very low | 159 Ų | 159 | 158.1 Ų | 158.1 | 74% | 0.743 | 82% | 0.823 | S | S | * | * | 174 | 110.3 | 117.5 | -93.1 | 174.6 | 6.3 | 0 | 0 | 107.1 | |||||
| 4 | R | 30.7 | Very low | 31.2 | Very low | 200 Ų | 200 | 155.2 Ų | 155.2 | 76% | 0.755 | 82% | 0.815 | S | S | * | * | 97 | 119 | 95 | -89.6 | -174.9 | -173.5 | -164.8 | 2 | 108.9 | |||||
| 5 | M | 27.8 | Very low | 31.1 | Very low | 148 Ų | 148 | 154.5 Ų | 154.5 | 73% | 0.729 | 81% | 0.812 | S | S | * | * | 62.1 | 122.9 | 104.9 | -65.1 | 177.5 | 91.2 | 0 | 0 | 109.9 | |||||
| 6 | E | 34.1 | Very low | 31.1 | Very low | 151 Ų | 151 | 160.6 Ų | 160.6 | 71% | 0.706 | 82% | 0.821 | S | S | * | * | -177.7 | 162.1 | 53.7 | -130.7 | 154.4 | -149.3 | 0 | 0 | 110.3 | |||||
| 7 | N | 36.5 | Very low | 31 | Very low | 151 Ų | 151 | 165.4 Ų | 165.4 | 81% | 0.807 | 83% | 0.826 | S | S | * | * | trans | 108.4 | 85.9 | 157.4 | -62.4 | -25.9 | 0 | 0 | 0 | 118 | ||||
| 8 | V | 30.2 | Very low | 31.2 | Very low | 132 Ų | 132 | 163.6 Ų | 163.6 | 80% | 0.8 | 83% | 0.825 | S | S | * | * | trans | -81.2 | 130.4 | 159.5 | 172.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 9 | Q | 35.9 | Very low | 31.4 | Very low | 195 Ų | 195 | 164.3 Ų | 164.3 | 91% | 0.911 | 83% | 0.825 | S | S | * | * | trans | -117.6 | 123.7 | 153.6 | -82.7 | -171.9 | -15.5 | 0 | 0 | 108.3 | ||||
| 10 | P | 30.9 | Very low | 31.5 | Very low | 122 Ų | 122 | 165.2 Ų | 165.2 | 79% | 0.792 | 82% | 0.824 | S | S | * | * | trans | -94.6 | 145.2 | -171.9 | 35.4 | -31.4 | 0 | 0 | 0 | 112 | ||||
| 11 | G | 30.8 | Very low | 31.6 | Very low | 81 Ų | 81 | 165.5 Ų | 165.5 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | 153.8 | 34.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 12 | Q | 25.3 | Very low | 31.8 | Very low | 185 Ų | 185 | 163.7 Ų | 163.7 | 86% | 0.864 | 81% | 0.812 | S | S | * | * | trans | -125.1 | 118.9 | 161.6 | -79.2 | -168.9 | -21.9 | 0 | 0 | 109.1 | ||||
| 13 | T | 32.1 | Very low | 32 | Very low | 149 Ų | 149 | 164 Ų | 164 | 91% | 0.914 | 81% | 0.813 | S | S | * | * | trans | -146.3 | 96.9 | 153.9 | -4.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 14 | V | 29.8 | Very low | 32.2 | Very low | 118 Ų | 118 | 161.5 Ų | 161.5 | 72% | 0.715 | 81% | 0.814 | S | S | * | * | trans | -83.3 | 139.6 | 165 | 167.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 15 | N | 29.4 | Very low | 32.3 | Very low | 144 Ų | 144 | 161.1 Ų | 161.1 | 77% | 0.77 | 82% | 0.817 | S | S | * | * | trans | 50.1 | 111.1 | 157.6 | -68.3 | -19.5 | 0 | 0 | 0 | 120.3 | ||||
| 16 | R | 30.4 | Very low | 32.8 | Very low | 253 Ų | 253 | 158 Ų | 158 | 96% | 0.955 | 82% | 0.815 | S | S | * | * | 173.7 | 88.2 | 125.5 | -97.3 | 175.9 | -168.7 | -171.4 | 5.3 | 110.4 | |||||
| 17 | R | 30.2 | Very low | 32.8 | Very low | 241 Ų | 241 | 158.5 Ų | 158.5 | 91% | 0.909 | 82% | 0.823 | S | S | * | * | trans | -158.9 | 50.2 | 159.4 | -156.3 | -179.9 | -91 | -167.2 | -5.3 | 112.1 | ||||
| 18 | V | 34 | Very low | 33 | Very low | 133 Ų | 133 | 155.8 Ų | 155.8 | 81% | 0.806 | 82% | 0.822 | S | S | * | * | S | Bend | trans | -100.6 | -5.9 | 175.3 | 177.8 | 0 | 0 | 0 | 0 | 112.8 | ||
| 19 | E | 35.1 | Very low | 33.4 | Very low | 178 Ų | 178 | 157.6 Ų | 157.6 | 83% | 0.832 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -112.8 | 16.8 | -169.8 | -76.7 | -176.6 | 162.7 | 0 | 0 | 117.4 | ||
| 20 | F | 33.9 | Very low | 33.6 | Very low | 181 Ų | 181 | 154 Ų | 154 | 79% | 0.794 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -130.1 | 7 | 176.8 | -94.5 | -78.4 | 0 | 0 | 0 | 117.9 | ||
| 21 | E | 33.8 | Very low | 34.2 | Very low | 172 Ų | 172 | 153.5 Ų | 153.5 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -111.3 | 0.5 | 175.2 | -83.4 | -175.8 | 161.9 | 0 | 0 | 115.1 | E23 | E21-E23 VanDerWaalsContact C-N 3.3Å; E21-E23 PolarHBondContact O-N 3.17Å |
| 22 | Q | 34.7 | Very low | 34.5 | Very low | 180 Ų | 180 | 159.3 Ų | 159.3 | 84% | 0.841 | 82% | 0.821 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | -18 | 174.1 | -96.4 | -179.2 | -19.2 | 0 | 0 | 113.9 | ||
| 23 | E | 33.5 | Very low | 35.2 | Very low | 171 Ų | 171 | 161.2 Ų | 161.2 | 80% | 0.799 | 82% | 0.82 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -12.5 | 179.1 | -77 | -173.3 | 148.9 | 0 | 0 | 114.8 | E21 | E21-E23 VanDerWaalsContact C-N 3.3Å; E21-E23 PolarHBondContact O-N 3.17Å |
| 24 | S | 36.7 | Very low | 35.5 | Very low | 107 Ų | 107 | 163.8 Ų | 163.8 | 75% | 0.748 | 82% | 0.819 | S | S | * | * | G | 310 helix | trans | -82.3 | -13.4 | -179.1 | -179.7 | 0 | 0 | 0 | 0 | 114 | A26 | S24-A26 VanDerWaalsContact C-N 3.35Å; S24-A26 PolarHBondContact O-N 3.45Å |
| 25 | K | 33.9 | Very low | 36 | Very low | 192 Ų | 192 | 163.5 Ų | 163.5 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | G | 310 helix | trans | -86.6 | 8.9 | -175.2 | -76 | -172.3 | 177.4 | 176.8 | 0 | 115.7 | ||
| 26 | A | 36.7 | Very low | 36.5 | Very low | 83 Ų | 83 | 162.2 Ų | 162.2 | 69% | 0.686 | 82% | 0.815 | S | S | * | * | G | 310 helix | trans | -81.4 | -10.8 | -174.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | S24 | S24-A26 VanDerWaalsContact C-N 3.35Å; S24-A26 PolarHBondContact O-N 3.45Å |
| 27 | N | 35.5 | Very low | 37 | Very low | 160 Ų | 160 | 157.7 Ų | 157.7 | 86% | 0.856 | 81% | 0.808 | S | S | * | * | trans | -135.5 | 37.5 | -167.8 | -85.4 | -21.7 | 0 | 0 | 0 | 117.2 | ||||
| 28 | A | 39.3 | Very low | 37.5 | Very low | 95 Ų | 95 | 156.6 Ų | 156.6 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | trans | -106.2 | 101.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 29 | L | 39.5 | Very low | 38 | Very low | 169 Ų | 169 | 161.4 Ų | 161.4 | 89% | 0.885 | 81% | 0.81 | S | S | * | * | trans | -53.3 | 136.2 | 172.2 | -86.4 | 125.1 | 0 | 0 | 0 | 111.5 | S31 | L29-S31 PolarHBondContact O-N 3.26Š| ||
| 30 | P | 40.7 | Very low | 38.1 | Very low | 119 Ų | 119 | 162.5 Ų | 162.5 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | trans | -73 | 115.7 | -173.5 | 26.4 | -32.1 | 0 | 0 | 0 | 112.1 | K32 | P30-K32 PolarHBondContact O-N 3.11Š| ||
| 31 | S | 42.9 | Very low | 38.5 | Very low | 113 Ų | 113 | 163.2 Ų | 163.2 | 79% | 0.79 | 81% | 0.814 | S | S | * | * | trans | -59.3 | 118.5 | 165.7 | 169.4 | 0 | 0 | 0 | 0 | 110.1 | L29 R33 | L29-S31 PolarHBondContact O-N 3.26Å; S31-R33 VanDerWaalsContact C-N 3.34Å; S31-R33 PolarHBondContact O-N 3.41Å | ||
| 32 | K | 38 | Very low | 39 | Very low | 203 Ų | 203 | 159.4 Ų | 159.4 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | -63.6 | 87.6 | 176.1 | -73 | -178.8 | 177.8 | 177.7 | 0 | 110.4 | P30 K34 | P30-K32 PolarHBondContact O-N 3.11Å; K32-K34 PolarHBondContact O-N 3.43Å | ||
| 33 | R | 39.6 | Very low | 39.6 | Very low | 224 Ų | 224 | 156.4 Ų | 156.4 | 85% | 0.845 | 80% | 0.801 | S | S | * | * | trans | -73.2 | 107.2 | 169.3 | -153.8 | 175.4 | -164.8 | 175.7 | 4.1 | 108.3 | S31 V35 | S31-R33 VanDerWaalsContact C-N 3.34Å; S31-R33 PolarHBondContact O-N 3.41Å; R33-V35 PolarHBondContact O-N 3.31Å | ||
| 34 | K | 37 | Very low | 40.2 | Very low | 203 Ų | 203 | 154 Ų | 154 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | trans | -60.8 | 101.1 | 170.7 | -78.2 | -178.9 | 176.9 | 178.6 | 0 | 108.4 | K32 T36 | K32-K34 PolarHBondContact O-N 3.43Å; K34-T36 PolarHBondContact O-N 3.06Å | ||
| 35 | V | 40.7 | Very low | 40.5 | Very low | 112 Ų | 112 | 156.2 Ų | 156.2 | 68% | 0.679 | 79% | 0.788 | S | S | * | * | trans | -81.1 | 101.9 | 170.6 | 177.3 | 0 | 0 | 0 | 0 | 107.1 | R33 L37 | R33-V35 PolarHBondContact O-N 3.31Å; V35-L37 PolarHBondContact O-N 3.1Å | ||
| 36 | T | 39.6 | Very low | 41.5 | Very low | 118 Ų | 118 | 149.9 Ų | 149.9 | 72% | 0.724 | 76% | 0.759 | S | S | * | * | trans | -68.2 | 99.5 | 165.6 | 4.5 | 0 | 0 | 0 | 0 | 107.6 | K34 Y38 | K34-T36 PolarHBondContact O-N 3.06Å; T36-Y38 PolarHBondContact O-N 3.28Å | ||
| 37 | L | 42.2 | Very low | 42.6 | Very low | 157 Ų | 157 | 153.7 Ų | 153.7 | 82% | 0.822 | 77% | 0.768 | S | S | * | * | trans | -63.1 | 96.2 | 171.5 | -81.3 | 156.6 | 0 | 0 | 0 | 108.7 | V35 R39 | V35-L37 PolarHBondContact O-N 3.1Å; L37-R39 VanDerWaalsContact C-N 3.25Å; L37-R39 PolarHBondContact O-N 3Å | ||
| 38 | Y | 41.1 | Very low | 44.6 | Very low | 218 Ų | 218 | 149.9 Ų | 149.9 | 86% | 0.855 | 74% | 0.743 | S | S | * | * | trans | -65.1 | 95.1 | 158 | -79.7 | -87.5 | 0 | 0 | 0 | 106.9 | T36 K40 | T36-Y38 PolarHBondContact O-N 3.28Å; Y38-K40 VanDerWaalsContact C-N 3.31Å; Y38-K40 PolarHBondContact O-N 3.38Å | ||
| 39 | R | 43.4 | Very low | 46.7 | Very low | 235 Ų | 235 | 151.3 Ų | 151.3 | 89% | 0.887 | 73% | 0.729 | S | S | * | * | trans | -64.4 | 98.3 | 167.8 | -166.3 | 176.7 | -166.3 | 174.6 | 3.3 | 106.2 | L37 K41 | L37-R39 VanDerWaalsContact C-N 3.25Å; L37-R39 PolarHBondContact O-N 3Å; R39-K41 PolarHBondContact O-N 3.26Å | ||
| 40 | K | 37.6 | Very low | 48.8 | Very low | 200 Ų | 200 | 143.3 Ų | 143.3 | 87% | 0.87 | 69% | 0.688 | S | S | * | * | trans | -52.6 | 104.5 | 164.3 | -85.7 | -177.9 | 174.3 | 180 | 0 | 106.1 | Y38 S42 | Y38-K40 VanDerWaalsContact C-N 3.31Å; Y38-K40 PolarHBondContact O-N 3.38Å; K40-S42 PolarHBondContact O-N 3.42Å; K40-S42 VanDerWaalsContact O-N 3.15Å | ||
| 41 | K | 41.3 | Very low | 50.7 | Low | 196 Ų | 196 | 140.6 Ų | 140.6 | 85% | 0.852 | 68% | 0.681 | S | S | * | * | trans | -61.2 | 115.3 | 157.2 | -87.9 | -174.7 | 172.7 | -175.5 | 0 | 104.5 | R39 V43 | R39-K41 PolarHBondContact O-N 3.26Å; K41-V43 PolarHBondContact O-N 2.88Å | ||
| 42 | S | 45.2 | Very low | 52.6 | Low | 92 Ų | 92 | 136.9 Ų | 136.9 | 64% | 0.643 | 66% | 0.655 | S | S | * | * | trans | -48.6 | 124.2 | 165.6 | 37.5 | 0 | 0 | 0 | 0 | 107.4 | K40 E44 | K40-S42 PolarHBondContact O-N 3.42Å; K40-S42 VanDerWaalsContact O-N 3.15Å; S42-E44 PolarHBondContact O-N 2.87Å | ||
| 43 | V | 46.2 | Very low | 54.8 | Low | 118 Ų | 118 | 127.4 Ų | 127.4 | 72% | 0.715 | 61% | 0.614 | S | S | * | * | trans | -68.5 | 90.5 | 166.7 | 179.6 | 0 | 0 | 0 | 0 | 104.7 | K41 H45 | K41-V43 PolarHBondContact O-N 2.88Å; V43-H45 PolarHBondContact O-N 3.46Å; V43-H45 PolarHBondContact O-ND1 3.25Å | ||
| 44 | E | 47.9 | Very low | 56.8 | Low | 120 Ų | 120 | 117.5 Ų | 117.5 | 56% | 0.561 | 58% | 0.578 | S | S | * | * | trans | -55.3 | 108.1 | 166.3 | -77.3 | 172.9 | 176.2 | 0 | 0 | 106.4 | S42 Y46 | S42-E44 PolarHBondContact O-N 2.87Å; E44-Y46 HydrophobicContact CB-CD2 4.2Å; E44-Y46 HydrophobicContact CB-CE2 3.7Å; E44-Y46 WeakPolarHBondContact O-CD2 3.4Å; E44-Y46 PolarHBondContact O-N 3.22Å; E44-Y46 VanDerWaalsContact O-N 3.1Å; E44-Y46 VanDerWaalsContact OE2-CZ 3.27Å; E44-Y46 PolarHBondContact OE2-OH 3.05Å | ||
| 45 | H | 42.8 | Very low | 59 | Low | 154 Ų | 154 | 111 Ų | 111 | 71% | 0.713 | 55% | 0.55 | S | S | * | * | trans | -69 | 104.4 | 166.9 | -81.3 | 35.7 | 0 | 0 | 0 | 105.7 | V43 D47 | V43-H45 PolarHBondContact O-N 3.46Å; V43-H45 PolarHBondContact O-ND1 3.25Å; H45-D47 PolarHBondContact O-N 3.46Å | ||
| 46 | Y | 54.3 | Low | 61.1 | Low | 59 Ų | 59 | 105.6 Ų | 105.6 | 23% | 0.231 | 52% | 0.518 | C | S | . | . | trans | -79 | 111.2 | 166.9 | -69.5 | -87.5 | 0 | 0 | 0 | 106.7 | E44 F48 T319 V321 Q322 | E44-Y46 HydrophobicContact CB-CD2 4.2Å; E44-Y46 HydrophobicContact CB-CE2 3.7Å; E44-Y46 WeakPolarHBondContact O-CD2 3.4Å; E44-Y46 PolarHBondContact O-N 3.22Å; E44-Y46 VanDerWaalsContact O-N 3.1Å; E44-Y46 VanDerWaalsContact OE2-CZ 3.27Å; E44-Y46 PolarHBondContact OE2-OH 3.05Å; Y46-F48 PolarHBondContact O-N 3.1Å; Y46-F48 VanDerWaalsContact O-N 3.08Å; Y46-T319 WeakPolarHBondContact CD1-OG1 3.37Å; Y46-T319 HydrophobicContact CE1-CG2 3.58Å; Y46-T319 WeakPolarHBondContact CE1-OG1 3.4Å; Y46-V321 HydrophobicContact CD2-CB 3.84Å; Y46-V321 HydrophobicContact CD2-CG1 3.64Å; Y46-V321 HydrophobicContact CD2-CG2 4.28Å; Y46-V321 HydrophobicContact CE2-CB 3.93Å; Y46-V321 HydrophobicContact CE2-CG1 4.17Å; Y46-V321 HydrophobicContact CE2-CG2 3.94Å; Y46-V321 HydrophobicContact CG-CB 4.43Å; Y46-V321 HydrophobicContact CG-CG1 4.28Å; Y46-Q322 HydrophobicContact CD1-CG 4.15Å | ||
| 47 | D | 60.4 | Low | 63.2 | Low | 163 Ų | 163 | 100.2 Ų | 100.2 | 87% | 0.872 | 49% | 0.485 | S | S | * | . | S | Bend | trans | -68.7 | -3.6 | -177.7 | -72.6 | -29.3 | 0 | 0 | 0 | 113.8 | H45 | H45-D47 PolarHBondContact O-N 3.46Š|
| 48 | F | 77.7 | Confident | 65 | Low | 79 Ų | 79 | 95.8 Ų | 95.8 | 35% | 0.346 | 47% | 0.467 | S | S | . | . | trans | -142.6 | 120.9 | -172.4 | -175.1 | -97.8 | 0 | 0 | 0 | 112.4 | Y46 F50 E55 Q322 | Y46-F48 PolarHBondContact O-N 3.1Å; Y46-F48 VanDerWaalsContact O-N 3.08Å; F48-F50 AromaticContact CE1-CD1 3.6Å; F48-F50 HydrophobicContact CE1-CD1 3.6Å; F48-F50 HydrophobicContact CE1-CD2 4.23Å; F48-F50 AromaticContact CE1-CE1 3.57Å; F48-F50 HydrophobicContact CE1-CE1 3.57Å; F48-F50 HydrophobicContact CE1-CE2 4.19Å; F48-F50 AromaticContact CE1-CG 3.95Å; F48-F50 HydrophobicContact CE1-CG 3.95Å; F48-F50 AromaticContact CE1-CZ 3.88Å; F48-F50 HydrophobicContact CE1-CZ 3.88Å; F48-F50 HydrophobicContact CZ-CD1 4.13Å; F48-F50 HydrophobicContact CZ-CE1 4.28Å; F48-E55 WeakPolarHBondContact CZ-OE1 3.2Å; F48-Q322 WeakPolarHBondContact O-CG 3.39Å | ||
| 49 | Y | 82.5 | Confident | 66.9 | Low | 125 Ų | 125 | 89.6 Ų | 89.6 | 49% | 0.49 | 44% | 0.444 | S | S | . | . | trans | -109.7 | 137.4 | 168.6 | -64.6 | -88.5 | 0 | 0 | 0 | 108.7 | V321 | Y49-V321 WeakPolarHBondContact CD1-O 3.24Å; Y49-V321 HydrophobicContact CE1-CG1 4.01Å; Y49-V321 WeakPolarHBondContact CE1-O 3.38Å | ||
| 50 | F | 83.2 | Confident | 68.5 | Low | 1 Ų | 1 | 78.5 Ų | 78.5 | 0% | 0.004 | 40% | 0.402 | C | S | . | . | trans | -72.8 | 133.7 | 171.7 | -67.9 | -83.1 | 0 | 0 | 0 | 109.7 | F48 E55 V56 K59 V318 Q322 L323 I326 | F48-F50 AromaticContact CE1-CD1 3.6Å; F48-F50 HydrophobicContact CE1-CD1 3.6Å; F48-F50 HydrophobicContact CE1-CD2 4.23Å; F48-F50 AromaticContact CE1-CE1 3.57Å; F48-F50 HydrophobicContact CE1-CE1 3.57Å; F48-F50 HydrophobicContact CE1-CE2 4.19Å; F48-F50 AromaticContact CE1-CG 3.95Å; F48-F50 HydrophobicContact CE1-CG 3.95Å; F48-F50 AromaticContact CE1-CZ 3.88Å; F48-F50 HydrophobicContact CE1-CZ 3.88Å; F48-F50 HydrophobicContact CZ-CD1 4.13Å; F48-F50 HydrophobicContact CZ-CE1 4.28Å; F50-E55 HydrophobicContact CD1-CB 4.41Å; F50-E55 HydrophobicContact CD1-CG 4.08Å; F50-V56 HydrophobicContact CB-CG2 3.68Å; F50-V56 HydrophobicContact CD1-CB 4.28Å; F50-V56 HydrophobicContact CD1-CG2 3.5Å; F50-V56 HydrophobicContact CD2-CG2 3.88Å; F50-V56 HydrophobicContact CE1-CB 4.43Å; F50-V56 HydrophobicContact CE1-CG2 4.01Å; F50-V56 HydrophobicContact CE2-CG2 4.37Å; F50-V56 HydrophobicContact CG-CG2 3.42Å; F50-V56 VanDerWaalsContact CG-CG2 3.42Å; F50-V56 HydrophobicContact CZ-CG2 4.42Å; F50-K59 HydrophobicContact CE1-CB 4.47Å; F50-K59 HydrophobicContact CE1-CD 3.69Å; F50-K59 HydrophobicContact CZ-CD 3.82Å; F50-V318 HydrophobicContact CE2-CG1 4.08Å; F50-Q322 HydrophobicContact CD2-CB 3.96Å; F50-Q322 HydrophobicContact CE2-CB 4.05Å; F50-Q322 PolarHBondContact N-O 2.94Å; F50-Q322 VanDerWaalsContact N-O 3.08Å; F50-L323 HydrophobicContact CD2-CD2 3.92Å; F50-L323 HydrophobicContact CE2-CD2 4.43Å; F50-I326 HydrophobicContact CB-CD1 4.37Å; F50-I326 WeakPolarHBondContact O-CG2 3.26Å | ||
| 51 | G | 81.2 | Confident | 70.4 | Confident | 62 Ų | 62 | 69.8 Ų | 69.8 | 64% | 0.639 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -88.7 | -19.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114 | E55 | G51-E55 PolarHBondContact N-OE2 2.91Š|
| 52 | S | 83.3 | Confident | 71.9 | Confident | 35 Ų | 35 | 62.8 Ų | 62.8 | 25% | 0.245 | 34% | 0.341 | C | S | . | . | trans | -152.7 | 159.6 | 178.3 | 62.8 | 0 | 0 | 0 | 0 | 111.9 | E54 E55 V56 | S52-E54 PolarHBondContact O-N 3.34Å; S52-E55 WeakPolarHBondContact O-CB 3.44Å; S52-E55 PolarHBondContact O-N 3.45Å; S52-E55 WeakPolarHBondContact OG-CB 3.37Å; S52-E55 PolarHBondContact OG-N 3.45Å; S52-E55 VanDerWaalsContact OG-N 3.14Å; S52-V56 PolarHBondContact O-N 2.93Å | ||
| 53 | V | 83.4 | Confident | 73.6 | Confident | 4 Ų | 4 | 60.8 Ų | 60.8 | 2% | 0.024 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -66.6 | -30.3 | 174.6 | -170.7 | 0 | 0 | 0 | 0 | 110.9 | E55 V56 L57 R288 L291 I326 | V53-E55 VanDerWaalsContact C-N 3.32Å; V53-E55 PolarHBondContact O-N 3.45Å; V53-V56 WeakPolarHBondContact O-CB 3.49Å; V53-V56 PolarHBondContact O-N 3.36Å; V53-L57 HydrophobicContact CG1-CD1 4.29Å; V53-L57 HydrophobicContact CG1-CG 4.36Å; V53-L57 WeakPolarHBondContact O-CG 3.47Å; V53-L57 PolarHBondContact O-N 2.83Å; V53-R288 HydrophobicContact CB-CG 4.27Å; V53-R288 HydrophobicContact CG1-CG 3.51Å; V53-L291 HydrophobicContact CG1-CD1 4.27Å; V53-L291 HydrophobicContact CG2-CD1 3.77Å; V53-I326 HydrophobicContact CG2-CD1 4.26Å |
| 54 | E | 82.6 | Confident | 75.5 | Confident | 16 Ų | 16 | 55.4 Ų | 55.4 | 8% | 0.075 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62.9 | -38.4 | 174.8 | -69.1 | 78.9 | -165.7 | 0 | 0 | 112.2 | S52 L57 S58 D232 R288 L539 | S52-E54 PolarHBondContact O-N 3.34Å; E54-L57 PolarHBondContact O-N 2.8Å; E54-S58 VanDerWaalsContact O-CB 3.24Å; E54-S58 WeakPolarHBondContact O-CB 3.34Å; E54-S58 PolarHBondContact O-N 3.38Å; E54-S58 PolarHBondContact O-OG 3.24Å; E54-D232 WeakPolarHBondContact CB-OD2 3.5Å; E54-D232 WeakPolarHBondContact CG-OD2 3.47Å; E54-R288 IonicContact OE1-CZ 2.87Å; E54-R288 VanDerWaalsContact OE1-CZ 3.27Å; E54-R288 IonicContact OE1-NH1 3.71Å; E54-R288 PolarHBondContact OE1-NH1 3.31Å; E54-R288 IonicContact OE1-NH2 3.97Å; E54-R288 PolarHBondContact OE1-NH2 2.93Å; E54-L539 HydrophobicContact CB-CD2 4.31Å; E54-L539 HydrophobicContact CG-CD1 4.49Å; E54-L539 HydrophobicContact CG-CD2 3.64Å; E54-L539 HydrophobicContact CG-CG 4.42Å |
| 55 | E | 83 | Confident | 77.4 | Confident | 66 Ų | 66 | 52.9 Ų | 52.9 | 31% | 0.308 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -63 | -44 | 173.7 | -170.4 | 177.8 | -170 | 0 | 0 | 111.2 | F48 F50 G51 S52 V53 S58 K59 | F48-E55 WeakPolarHBondContact CZ-OE1 3.2Å; F50-E55 HydrophobicContact CD1-CB 4.41Å; F50-E55 HydrophobicContact CD1-CG 4.08Å; G51-E55 PolarHBondContact N-OE2 2.91Å; S52-E55 WeakPolarHBondContact O-CB 3.44Å; S52-E55 PolarHBondContact O-N 3.45Å; S52-E55 WeakPolarHBondContact OG-CB 3.37Å; S52-E55 PolarHBondContact OG-N 3.45Å; S52-E55 VanDerWaalsContact OG-N 3.14Å; V53-E55 VanDerWaalsContact C-N 3.32Å; V53-E55 PolarHBondContact O-N 3.45Å; E55-S58 WeakPolarHBondContact CA-OG 3.28Å; E55-S58 PolarHBondContact O-N 2.76Å; E55-S58 PolarHBondContact O-OG 3.15Å; E55-K59 WeakPolarHBondContact O-CB 3.47Å; E55-K59 PolarHBondContact O-N 2.85Å |
| 56 | V | 84.4 | Confident | 79.7 | Confident | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -58.1 | -51.2 | 174.1 | 179.1 | 0 | 0 | 0 | 0 | 110.7 | F50 S52 V53 S58 K59 I60 I303 L323 I326 | F50-V56 HydrophobicContact CB-CG2 3.68Å; F50-V56 HydrophobicContact CD1-CB 4.28Å; F50-V56 HydrophobicContact CD1-CG2 3.5Å; F50-V56 HydrophobicContact CD2-CG2 3.88Å; F50-V56 HydrophobicContact CE1-CB 4.43Å; F50-V56 HydrophobicContact CE1-CG2 4.01Å; F50-V56 HydrophobicContact CE2-CG2 4.37Å; F50-V56 HydrophobicContact CG-CG2 3.42Å; F50-V56 VanDerWaalsContact CG-CG2 3.42Å; F50-V56 HydrophobicContact CZ-CG2 4.42Å; S52-V56 PolarHBondContact O-N 2.93Å; V53-V56 WeakPolarHBondContact O-CB 3.49Å; V53-V56 PolarHBondContact O-N 3.36Å; V56-S58 VanDerWaalsContact C-N 3.33Å; V56-S58 PolarHBondContact O-N 3.28Å; V56-K59 PolarHBondContact O-N 3.32Å; V56-I60 HydrophobicContact CG1-CD1 3.96Å; V56-I60 WeakPolarHBondContact O-CG1 3.42Å; V56-I60 PolarHBondContact O-N 2.98Å; V56-I303 HydrophobicContact CG1-CD1 3.54Å; V56-I303 HydrophobicContact CG1-CG1 3.93Å; V56-I303 HydrophobicContact CG1-CG2 4.11Å; V56-L323 HydrophobicContact CG2-CD2 3.86Å; V56-I326 HydrophobicContact CG2-CD1 3.93Å |
| 57 | L | 83 | Confident | 81.4 | Confident | 5 Ų | 5 | 43.4 Ų | 43.4 | 3% | 0.026 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.9 | -35.7 | -179.8 | -69.3 | 174.4 | 0 | 0 | 0 | 112.2 | V53 E54 K59 I60 G61 D232 | V53-L57 HydrophobicContact CG1-CD1 4.29Å; V53-L57 HydrophobicContact CG1-CG 4.36Å; V53-L57 WeakPolarHBondContact O-CG 3.47Å; V53-L57 PolarHBondContact O-N 2.83Å; E54-L57 PolarHBondContact O-N 2.8Å; L57-K59 VanDerWaalsContact C-N 3.32Å; L57-K59 PolarHBondContact O-N 3.02Å; L57-I60 HydrophobicContact CD2-CD1 4.34Å; L57-I60 PolarHBondContact O-N 3.02Å; L57-G61 CarbonylContact O-C 3.11Å; L57-G61 PolarHBondContact O-N 3.15Å; L57-D232 HydrophobicContact CB-CB 4.49Å; L57-D232 HydrophobicContact CD1-CB 4Å |
| 58 | S | 81.4 | Confident | 82.8 | Confident | 64 Ų | 64 | 39.9 Ų | 39.9 | 45% | 0.448 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -64.3 | -38.8 | 175.9 | 78.4 | 0 | 0 | 0 | 0 | 111.8 | E54 E55 V56 G61 | E54-S58 VanDerWaalsContact O-CB 3.24Å; E54-S58 WeakPolarHBondContact O-CB 3.34Å; E54-S58 PolarHBondContact O-N 3.38Å; E54-S58 PolarHBondContact O-OG 3.24Å; E55-S58 WeakPolarHBondContact CA-OG 3.28Å; E55-S58 PolarHBondContact O-N 2.76Å; E55-S58 PolarHBondContact O-OG 3.15Å; V56-S58 VanDerWaalsContact C-N 3.33Å; V56-S58 PolarHBondContact O-N 3.28Å; S58-G61 PolarHBondContact O-N 3.04Å |
| 59 | K | 79.9 | Confident | 83.5 | Confident | 87 Ų | 87 | 38.5 Ų | 38.5 | 38% | 0.378 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -72.1 | -38.7 | 178.3 | -166.5 | -173.9 | 177.9 | 177.7 | 0 | 111.8 | F50 E55 V56 L57 G61 Y307 R314 | F50-K59 HydrophobicContact CE1-CB 4.47Å; F50-K59 HydrophobicContact CE1-CD 3.69Å; F50-K59 HydrophobicContact CZ-CD 3.82Å; E55-K59 WeakPolarHBondContact O-CB 3.47Å; E55-K59 PolarHBondContact O-N 2.85Å; V56-K59 PolarHBondContact O-N 3.32Å; L57-K59 VanDerWaalsContact C-N 3.32Å; L57-K59 PolarHBondContact O-N 3.02Å; K59-G61 PolarHBondContact O-N 2.97Å; K59-Y307 WeakPolarHBondContact CB-OH 3.45Å; K59-Y307 WeakPolarHBondContact CD-OH 3.39Å; K59-Y307 HydrophobicContact CG-CE1 4.48Å; K59-Y307 WeakPolarHBondContact CG-OH 3.34Å; K59-Y307 WeakPolarHBondContact O-CE1 3.32Å; K59-R314 PolarHBondContact O-NH2 3.24Å |
| 60 | I | 78.3 | Confident | 83.9 | Confident | 2 Ų | 2 | 32.7 Ų | 32.7 | 1% | 0.01 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.6 | -33.8 | 170.4 | -63.6 | 163.5 | 0 | 0 | 0 | 110.1 | V56 L57 I303 L306 Y307 R312 R314 | V56-I60 HydrophobicContact CG1-CD1 3.96Å; V56-I60 WeakPolarHBondContact O-CG1 3.42Å; V56-I60 PolarHBondContact O-N 2.98Å; L57-I60 HydrophobicContact CD2-CD1 4.34Å; L57-I60 PolarHBondContact O-N 3.02Å; I60-I303 HydrophobicContact CD1-CB 4.46Å; I60-I303 HydrophobicContact CD1-CG1 4.2Å; I60-I303 HydrophobicContact CD1-CG2 3.95Å; I60-I303 HydrophobicContact CG1-CG2 4.25Å; I60-L306 HydrophobicContact CD1-CD1 4.14Å; I60-L306 HydrophobicContact CG2-CB 3.94Å; I60-Y307 HydrophobicContact CB-CE1 4.45Å; I60-Y307 HydrophobicContact CG1-CD2 4.3Å; I60-Y307 HydrophobicContact CG1-CE1 4.16Å; I60-Y307 HydrophobicContact CG1-CE2 3.6Å; I60-Y307 PolarHBondContact N-OH 3.45Å; I60-R312 PolarHBondContact O-NE 2.91Å; I60-R312 PolarHBondContact O-NH2 3.29Å; I60-R314 PolarHBondContact O-NH2 2.78Å; I60-R314 VanDerWaalsContact O-NH2 3.09Å |
| 61 | G | 76.3 | Confident | 84.2 | Confident | 17 Ų | 17 | 33 Ų | 33 | 18% | 0.175 | 19% | 0.194 | C | C | . | . | trans | 100 | 120.8 | -173.8 | 0 | 0 | 0 | 0 | 0 | 110 | L57 S58 K59 F63 R312 | L57-G61 CarbonylContact O-C 3.11Å; L57-G61 PolarHBondContact O-N 3.15Å; S58-G61 PolarHBondContact O-N 3.04Å; K59-G61 PolarHBondContact O-N 2.97Å; G61-F63 PolarHBondContact O-N 3.22Å; G61-F63 VanDerWaalsContact O-N 3.14Å; G61-R312 VanDerWaalsContact CA-NH2 3.3Å; G61-R312 PolarHBondContact O-NH2 3.36Å | ||
| 62 | I | 72.7 | Confident | 84.5 | Confident | 50 Ų | 50 | 32.3 Ų | 32.3 | 26% | 0.256 | 18% | 0.18 | S | C | . | . | S | Bend | trans | -62.7 | -27 | -163.6 | -56.4 | 175.8 | 0 | 0 | 0 | 113.7 | D232 Y235 | I62-D232 VanDerWaalsContact CG2-C 3.48Å; I62-D232 HydrophobicContact CG2-CB 4.18Å; I62-D232 WeakPolarHBondContact CG2-O 3.31Å; I62-Y235 HydrophobicContact CB-CD2 4.19Å; I62-Y235 HydrophobicContact CG2-CD2 3.75Å |
| 63 | F | 81.6 | Confident | 84.7 | Confident | 50 Ų | 50 | 31.1 Ų | 31.1 | 22% | 0.219 | 17% | 0.171 | C | C | . | . | S | Bend | trans | -147.8 | 112.7 | 174.7 | -158.2 | -98.1 | 0 | 0 | 0 | 109.2 | G61 Q67 I68 T231 Y235 L238 R312 | G61-F63 PolarHBondContact O-N 3.22Å; G61-F63 VanDerWaalsContact O-N 3.14Å; F63-Q67 HydrophobicContact CD2-CB 3.87Å; F63-Q67 HydrophobicContact CD2-CG 4.39Å; F63-Q67 HydrophobicContact CE2-CB 3.84Å; F63-Q67 HydrophobicContact CG-CB 4.38Å; F63-Q67 HydrophobicContact CZ-CB 4.35Å; F63-I68 HydrophobicContact CD1-CG1 4.2Å; F63-I68 HydrophobicContact CE1-CD1 4.21Å; F63-I68 HydrophobicContact CE1-CG1 3.5Å; F63-I68 VanDerWaalsContact CE1-CG1 3.5Å; F63-I68 HydrophobicContact CZ-CG1 4.11Å; F63-T231 HydrophobicContact CD2-CG2 3.9Å; F63-T231 HydrophobicContact CE2-CG2 4.26Å; F63-Y235 HydrophobicContact CB-CD1 4.16Å; F63-Y235 HydrophobicContact CB-CD2 4.25Å; F63-Y235 HydrophobicContact CB-CG 3.97Å; F63-Y235 HydrophobicContact CG-CD1 4.39Å; F63-Y235 HydrophobicContact CG-CG 4.47Å; F63-L238 HydrophobicContact CD1-CD2 4.02Å; F63-L238 HydrophobicContact CD2-CD2 4.17Å; F63-L238 HydrophobicContact CE1-CD2 3.41Å; F63-L238 VanDerWaalsContact CE1-CD2 3.41Å; F63-L238 HydrophobicContact CE1-CG 4.39Å; F63-L238 HydrophobicContact CE2-CB 4.24Å; F63-L238 HydrophobicContact CE2-CD2 3.6Å; F63-L238 HydrophobicContact CE2-CG 3.92Å; F63-L238 HydrophobicContact CG-CD2 4.37Å; F63-L238 HydrophobicContact CZ-CD2 3.19Å; F63-L238 HydrophobicContact CZ-CG 3.71Å; F63-R312 PolarHBondContact O-NH2 2.84Å |
| 64 | G | 85.2 | Confident | 84.9 | Confident | 4 Ų | 4 | 31 Ų | 31 | 4% | 0.041 | 17% | 0.171 | C | C | . | . | trans | -135.6 | -170.3 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y66 Q67 I68 | G64-Y66 PolarHBondContact O-N 3.39Å; G64-Q67 PolarHBondContact O-N 3.35Å; G64-Q67 VanDerWaalsContact O-N 3.13Å; G64-Q67 PolarHBondContact O-OE1 3.24Å; G64-I68 WeakPolarHBondContact O-CG1 3.39Å; G64-I68 PolarHBondContact O-N 3.39Å | ||
| 65 | P | 89.3 | Confident | 84.9 | Confident | 67 Ų | 67 | 31.8 Ų | 31.8 | 44% | 0.435 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -54 | -38.5 | 179 | -27.9 | 36.7 | 0 | 0 | 0 | 113.2 | I68 F69 W311 | P65-I68 PolarHBondContact O-N 2.99Å; P65-F69 VanDerWaalsContact O-CB 3.32Å; P65-F69 WeakPolarHBondContact O-CB 3.46Å; P65-F69 PolarHBondContact O-N 2.96Å; P65-W311 WeakPolarHBondContact CD-O 3.5Å; P65-W311 WeakPolarHBondContact CG-O 3.41Å |
| 66 | Y | 90.4 | Very high | 84.9 | Confident | 7 Ų | 7 | 32.8 Ų | 32.8 | 3% | 0.027 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.1 | -49.9 | 175.6 | 175.9 | -105.3 | 0 | 0 | 0 | 112.7 | G64 I68 F69 C70 Q284 L306 W311 | G64-Y66 PolarHBondContact O-N 3.39Å; Y66-I68 VanDerWaalsContact C-N 3.31Å; Y66-I68 PolarHBondContact O-N 3.01Å; Y66-F69 WeakPolarHBondContact O-CB 3.39Å; Y66-F69 PolarHBondContact O-N 3.34Å; Y66-C70 VanDerWaalsContact CE2-SG 3.55Å; Y66-C70 PolarHBondContact O-N 3.48Å; Y66-C70 PolarHBondContact O-SG 2.94Å; Y66-C70 VanDerWaalsContact O-SG 3.39Å; Y66-Q284 HydrophobicContact CE2-CB 4.37Å; Y66-Q284 HydrophobicContact CE2-CG 4.03Å; Y66-Q284 WeakPolarHBondContact OH-CA 3.25Å; Y66-Q284 WeakPolarHBondContact OH-CB 3.26Å; Y66-Q284 PolarHBondContact OH-N 3.42Å; Y66-Q284 PolarHBondContact OH-O 2.78Å; Y66-L306 HydrophobicContact CD1-CD2 3.34Å; Y66-L306 HydrophobicContact CD2-CD2 3.82Å; Y66-L306 HydrophobicContact CE1-CD2 3.59Å; Y66-L306 HydrophobicContact CE2-CD2 4.04Å; Y66-L306 HydrophobicContact CG-CD2 3.47Å; Y66-L306 VanDerWaalsContact CG-CD2 3.47Å; Y66-W311 VanDerWaalsContact CA-CE3 3.44Å; Y66-W311 AromaticContact CD2-CD2 3.8Å; Y66-W311 HydrophobicContact CD2-CD2 3.8Å; Y66-W311 AromaticContact CD2-CE2 3.62Å; Y66-W311 HydrophobicContact CD2-CE3 4.04Å; Y66-W311 HydrophobicContact CD2-CG 4.41Å; Y66-W311 AromaticContact CD2-CH2 3.96Å; Y66-W311 HydrophobicContact CD2-CH2 3.96Å; Y66-W311 AromaticContact CD2-CZ2 3.72Å; Y66-W311 HydrophobicContact CD2-CZ2 3.72Å; Y66-W311 HydrophobicContact CD2-CZ3 4.12Å; Y66-W311 HydrophobicContact CE2-CZ2 4.26Å; Y66-W311 HydrophobicContact CG-CD2 4.25Å; Y66-W311 HydrophobicContact CG-CE3 4.38Å |
| 67 | Q | 90.2 | Very high | 84.8 | Confident | 8 Ų | 8 | 32.8 Ų | 32.8 | 4% | 0.037 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.1 | -38.4 | 179.4 | -69.4 | 79.9 | 3.6 | 0 | 0 | 111.6 | F63 G64 C70 C71 S230 T231 | F63-Q67 HydrophobicContact CD2-CB 3.87Å; F63-Q67 HydrophobicContact CD2-CG 4.39Å; F63-Q67 HydrophobicContact CE2-CB 3.84Å; F63-Q67 HydrophobicContact CG-CB 4.38Å; F63-Q67 HydrophobicContact CZ-CB 4.35Å; G64-Q67 PolarHBondContact O-N 3.35Å; G64-Q67 VanDerWaalsContact O-N 3.13Å; G64-Q67 PolarHBondContact O-OE1 3.24Å; Q67-C70 PolarHBondContact O-N 2.85Å; Q67-C71 WeakPolarHBondContact O-CB 3.12Å; Q67-C71 PolarHBondContact O-N 3.29Å; Q67-C71 PolarHBondContact O-SG 3.31Å; Q67-S230 PolarHBondContact NE2-O 2.74Å; Q67-T231 HydrophobicContact CB-CG2 4.44Å; Q67-T231 HydrophobicContact CG-CG2 3.86Å |
| 68 | I | 90.2 | Very high | 84.6 | Confident | 88 Ų | 88 | 32.9 Ų | 32.9 | 45% | 0.451 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -63 | -43.7 | 174.4 | -66.4 | 167.8 | 0 | 0 | 0 | 110.5 | F63 G64 P65 Y66 C71 S72 | F63-I68 HydrophobicContact CD1-CG1 4.2Å; F63-I68 HydrophobicContact CE1-CD1 4.21Å; F63-I68 HydrophobicContact CE1-CG1 3.5Å; F63-I68 VanDerWaalsContact CE1-CG1 3.5Å; F63-I68 HydrophobicContact CZ-CG1 4.11Å; G64-I68 WeakPolarHBondContact O-CG1 3.39Å; G64-I68 PolarHBondContact O-N 3.39Å; P65-I68 PolarHBondContact O-N 2.99Å; Y66-I68 VanDerWaalsContact C-N 3.31Å; Y66-I68 PolarHBondContact O-N 3.01Å; I68-C71 PolarHBondContact O-N 3.05Å; I68-S72 WeakPolarHBondContact O-CB 3.34Å; I68-S72 PolarHBondContact O-N 3.34Å; I68-S72 PolarHBondContact O-OG 3.19Å |
| 69 | F | 91.7 | Very high | 84.6 | Confident | 51 Ų | 51 | 29.9 Ų | 29.9 | 22% | 0.224 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -59.9 | -50.8 | 175.2 | 167.3 | -98.8 | 0 | 0 | 0 | 111.5 | P65 Y66 C71 S72 V73 L282 F283 W311 | P65-F69 VanDerWaalsContact O-CB 3.32Å; P65-F69 WeakPolarHBondContact O-CB 3.46Å; P65-F69 PolarHBondContact O-N 2.96Å; Y66-F69 WeakPolarHBondContact O-CB 3.39Å; Y66-F69 PolarHBondContact O-N 3.34Å; F69-C71 VanDerWaalsContact C-N 3.34Å; F69-C71 PolarHBondContact O-N 3.42Å; F69-S72 WeakPolarHBondContact O-CB 3.27Å; F69-S72 PolarHBondContact O-N 3.47Å; F69-S72 VanDerWaalsContact O-N 3.1Å; F69-V73 HydrophobicContact CD2-CG2 4.07Å; F69-V73 HydrophobicContact CE1-CG2 4.14Å; F69-V73 HydrophobicContact CE2-CG2 3.64Å; F69-V73 HydrophobicContact CZ-CG2 3.69Å; F69-V73 WeakPolarHBondContact O-CG2 3.45Å; F69-V73 PolarHBondContact O-N 2.86Å; F69-L282 HydrophobicContact CE1-CB 3.8Å; F69-L282 HydrophobicContact CE1-CD1 4.47Å; F69-L282 HydrophobicContact CE2-CD1 4.33Å; F69-L282 HydrophobicContact CZ-CB 3.82Å; F69-L282 HydrophobicContact CZ-CD1 3.79Å; F69-L282 HydrophobicContact CZ-CG 4.38Å; F69-F283 HydrophobicContact CD1-CE2 4.41Å; F69-F283 AromaticContact CE1-CD2 3.97Å; F69-F283 HydrophobicContact CE1-CD2 3.97Å; F69-F283 AromaticContact CE1-CE2 3.94Å; F69-F283 HydrophobicContact CE1-CE2 3.94Å; F69-W311 HydrophobicContact CB-CH2 4.17Å; F69-W311 HydrophobicContact CB-CZ3 3.79Å; F69-W311 AromaticContact CD1-CH2 3.48Å; F69-W311 HydrophobicContact CD1-CH2 3.48Å; F69-W311 VanDerWaalsContact CD1-CH2 3.48Å; F69-W311 HydrophobicContact CD1-CZ2 4.43Å; F69-W311 AromaticContact CD1-CZ3 3.99Å; F69-W311 HydrophobicContact CD1-CZ3 3.99Å; F69-W311 HydrophobicContact CD2-CH2 4.39Å; F69-W311 AromaticContact CE1-CH2 3.88Å; F69-W311 HydrophobicContact CE1-CH2 3.88Å; F69-W311 AromaticContact CG-CH2 3.75Å; F69-W311 HydrophobicContact CG-CH2 3.75Å; F69-W311 AromaticContact CG-CZ3 3.88Å; F69-W311 HydrophobicContact CG-CZ3 3.88Å; F69-W311 HydrophobicContact CZ-CH2 4.48Å |
| 70 | C | 90.6 | Very high | 84.5 | Confident | 3 Ų | 3 | 25.8 Ų | 25.8 | 2% | 0.02 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -60 | -44.3 | 177.8 | -66.9 | 0 | 0 | 0 | 0 | 111.7 | Y66 Q67 S72 V73 T74 L227 F283 | Y66-C70 VanDerWaalsContact CE2-SG 3.55Å; Y66-C70 PolarHBondContact O-N 3.48Å; Y66-C70 PolarHBondContact O-SG 2.94Å; Y66-C70 VanDerWaalsContact O-SG 3.39Å; Q67-C70 PolarHBondContact O-N 2.85Å; C70-S72 VanDerWaalsContact C-N 3.29Å; C70-S72 PolarHBondContact O-N 3.06Å; C70-V73 PolarHBondContact O-N 2.96Å; C70-T74 WeakPolarHBondContact O-CB 3.39Å; C70-T74 PolarHBondContact O-N 2.83Å; C70-T74 PolarHBondContact O-OG1 2.84Å; C70-T74 VanDerWaalsContact O-OG1 3.07Å; C70-L227 HydrophobicContact CB-CD2 3.67Å; C70-F283 HydrophobicContact CB-CE1 4.4Å; C70-F283 HydrophobicContact CB-CE2 4.16Å; C70-F283 HydrophobicContact CB-CZ 3.89Å |
| 71 | C | 88.9 | Confident | 84.5 | Confident | 6 Ų | 6 | 26 Ų | 26 | 4% | 0.041 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.5 | -41.1 | 175.2 | -71.4 | 0 | 0 | 0 | 0 | 111.8 | Q67 I68 F69 F75 C242 | Q67-C71 WeakPolarHBondContact O-CB 3.12Å; Q67-C71 PolarHBondContact O-N 3.29Å; Q67-C71 PolarHBondContact O-SG 3.31Å; I68-C71 PolarHBondContact O-N 3.05Å; F69-C71 VanDerWaalsContact C-N 3.34Å; F69-C71 PolarHBondContact O-N 3.42Å; C71-F75 WeakPolarHBondContact O-CB 3.37Å; C71-F75 PolarHBondContact O-N 3.09Å; C71-C242 HydrophobicContact CB-CB 3.7Å |
| 72 | S | 87.6 | Confident | 84.6 | Confident | 49 Ų | 49 | 26 Ų | 26 | 34% | 0.343 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -67.6 | -48.5 | 179.6 | -57.2 | 0 | 0 | 0 | 0 | 111.3 | I68 F69 C70 F75 F76 | I68-S72 WeakPolarHBondContact O-CB 3.34Å; I68-S72 PolarHBondContact O-N 3.34Å; I68-S72 PolarHBondContact O-OG 3.19Å; F69-S72 WeakPolarHBondContact O-CB 3.27Å; F69-S72 PolarHBondContact O-N 3.47Å; F69-S72 VanDerWaalsContact O-N 3.1Å; C70-S72 VanDerWaalsContact C-N 3.29Å; C70-S72 PolarHBondContact O-N 3.06Å; S72-F75 PolarHBondContact O-N 3.39Å; S72-F76 WeakPolarHBondContact O-CD2 3.33Å; S72-F76 PolarHBondContact O-N 2.74Å |
| 73 | V | 89 | Confident | 85.1 | Confident | 9 Ų | 9 | 23.6 Ų | 23.6 | 6% | 0.055 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -60.3 | -48.6 | 177.1 | 173 | 0 | 0 | 0 | 0 | 110.4 | F69 C70 F75 F76 S77 Y280 F283 | F69-V73 HydrophobicContact CD2-CG2 4.07Å; F69-V73 HydrophobicContact CE1-CG2 4.14Å; F69-V73 HydrophobicContact CE2-CG2 3.64Å; F69-V73 HydrophobicContact CZ-CG2 3.69Å; F69-V73 WeakPolarHBondContact O-CG2 3.45Å; F69-V73 PolarHBondContact O-N 2.86Å; C70-V73 PolarHBondContact O-N 2.96Å; V73-F75 VanDerWaalsContact C-N 3.32Å; V73-F75 PolarHBondContact O-N 2.79Å; V73-F76 PolarHBondContact O-N 3.03Å; V73-S77 WeakPolarHBondContact O-CB 3.38Å; V73-S77 PolarHBondContact O-N 2.87Å; V73-S77 PolarHBondContact O-OG 3.06Å; V73-Y280 HydrophobicContact CG1-CD1 4.32Å; V73-Y280 HydrophobicContact CG1-CE1 4.08Å; V73-Y280 HydrophobicContact CG1-CE2 4.45Å; V73-F283 HydrophobicContact CB-CE2 3.75Å; V73-F283 HydrophobicContact CB-CZ 3.91Å; V73-F283 HydrophobicContact CG1-CE2 3.75Å; V73-F283 HydrophobicContact CG1-CZ 3.88Å; V73-F283 HydrophobicContact CG2-CE2 4.15Å |
| 74 | T | 86.5 | Confident | 85.3 | Confident | 3 Ų | 3 | 21.4 Ų | 21.4 | 2% | 0.018 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -58.9 | -44.4 | 176.3 | -64.1 | 0 | 0 | 0 | 0 | 111.4 | C70 S77 A78 C223 M224 L227 | C70-T74 WeakPolarHBondContact O-CB 3.39Å; C70-T74 PolarHBondContact O-N 2.83Å; C70-T74 PolarHBondContact O-OG1 2.84Å; C70-T74 VanDerWaalsContact O-OG1 3.07Å; T74-S77 PolarHBondContact O-N 2.88Å; T74-A78 WeakPolarHBondContact O-CB 3.31Å; T74-A78 PolarHBondContact O-N 3.41Å; T74-C223 HydrophobicContact CG2-CB 3.67Å; T74-M224 HydrophobicContact CG2-CE 4.22Å; T74-L227 HydrophobicContact CG2-CD1 3.85Å |
| 75 | F | 83.3 | Confident | 85.3 | Confident | 32 Ų | 32 | 22.4 Ų | 22.4 | 14% | 0.14 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -59.7 | -53.4 | 178.5 | 171.2 | -97.5 | 0 | 0 | 0 | 112 | C71 S72 V73 S77 A78 I79 A247 A248 L251 | C71-F75 WeakPolarHBondContact O-CB 3.37Å; C71-F75 PolarHBondContact O-N 3.09Å; S72-F75 PolarHBondContact O-N 3.39Å; V73-F75 VanDerWaalsContact C-N 3.32Å; V73-F75 PolarHBondContact O-N 2.79Å; F75-S77 VanDerWaalsContact C-N 3.29Å; F75-S77 PolarHBondContact O-N 3.42Å; F75-A78 PolarHBondContact O-N 3.32Å; F75-I79 HydrophobicContact CE1-CD1 3.97Å; F75-I79 HydrophobicContact CZ-CD1 4.3Å; F75-I79 PolarHBondContact O-N 3.27Å; F75-A247 HydrophobicContact CE1-CB 4.25Å; F75-A247 HydrophobicContact CE2-CB 3.57Å; F75-A247 HydrophobicContact CZ-CB 3.24Å; F75-A248 HydrophobicContact CE2-CB 4.46Å; F75-L251 HydrophobicContact CE1-CD1 4.22Å; F75-L251 HydrophobicContact CZ-CD1 4.28Å |
| 76 | F | 83.1 | Confident | 84.8 | Confident | 87 Ų | 87 | 19.5 Ų | 19.5 | 38% | 0.382 | 10% | 0.098 | S | C | . | . | H | α-helix | trans | -65.2 | -33 | -179.4 | -78.3 | -72 | 0 | 0 | 0 | 112.2 | S72 V73 A78 I79 L276 | S72-F76 WeakPolarHBondContact O-CD2 3.33Å; S72-F76 PolarHBondContact O-N 2.74Å; V73-F76 PolarHBondContact O-N 3.03Å; F76-A78 VanDerWaalsContact C-N 3.33Å; F76-I79 HydrophobicContact CD1-CD1 3.73Å; F76-I79 HydrophobicContact CE1-CD1 4.37Å; F76-I79 WeakPolarHBondContact O-CB 3.35Å; F76-I79 PolarHBondContact O-N 2.99Å; F76-L276 HydrophobicContact CB-CD1 3.48Å; F76-L276 VanDerWaalsContact CB-CD1 3.48Å; F76-L276 HydrophobicContact CB-CD2 3.64Å; F76-L276 HydrophobicContact CB-CG 4.19Å; F76-L276 HydrophobicContact CG-CD2 4.44Å; F76-L276 WeakPolarHBondContact O-CD1 3.35Å |
| 77 | S | 82.4 | Confident | 84.4 | Confident | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -71.9 | -35.3 | 178.6 | -64.6 | 0 | 0 | 0 | 0 | 110.7 | V73 T74 F75 I79 A80 W81 L276 Y280 | V73-S77 WeakPolarHBondContact O-CB 3.38Å; V73-S77 PolarHBondContact O-N 2.87Å; V73-S77 PolarHBondContact O-OG 3.06Å; T74-S77 PolarHBondContact O-N 2.88Å; F75-S77 VanDerWaalsContact C-N 3.29Å; F75-S77 PolarHBondContact O-N 3.42Å; S77-I79 VanDerWaalsContact C-N 3.25Å; S77-I79 PolarHBondContact O-N 3.39Å; S77-A80 WeakPolarHBondContact O-CB 3.42Å; S77-A80 PolarHBondContact O-N 2.9Å; S77-W81 VanDerWaalsContact CB-CZ2 3.5Å; S77-W81 VanDerWaalsContact O-CD2 3.3Å; S77-L276 WeakPolarHBondContact OG-CB 3.46Å; S77-L276 WeakPolarHBondContact OG-CD1 3.22Å; S77-Y280 WeakPolarHBondContact CB-OH 3.36Å; S77-Y280 WeakPolarHBondContact OG-CE2 3.48Å; S77-Y280 PolarHBondContact OG-OH 3.06Å |
| 78 | A | 79.2 | Confident | 84 | Confident | 6 Ų | 6 | 19.3 Ų | 19.3 | 5% | 0.05 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -64.7 | -29.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | T74 F75 F76 A80 W81 F82 L245 | T74-A78 WeakPolarHBondContact O-CB 3.31Å; T74-A78 PolarHBondContact O-N 3.41Å; F75-A78 PolarHBondContact O-N 3.32Å; F76-A78 VanDerWaalsContact C-N 3.33Å; A78-A80 PolarHBondContact O-N 3.09Å; A78-W81 VanDerWaalsContact CA-CE3 3.45Å; A78-W81 HydrophobicContact CB-CE3 4.14Å; A78-W81 HydrophobicContact CB-CZ3 4.08Å; A78-W81 PolarHBondContact O-N 3.32Å; A78-F82 WeakPolarHBondContact O-CB 3.49Å; A78-F82 PolarHBondContact O-N 2.98Å; A78-L245 HydrophobicContact CB-CD2 3.24Å; A78-L245 HydrophobicContact CB-CG 4.05Å; A78-L245 VanDerWaalsContact O-CD2 3.29Å; A78-L245 WeakPolarHBondContact O-CD2 3.18Å |
| 79 | I | 79.7 | Confident | 83.2 | Confident | 2 Ų | 2 | 15.7 Ų | 15.7 | 1% | 0.01 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -54.2 | -45.6 | 169.7 | -59.9 | 172.6 | 0 | 0 | 0 | 110.3 | F75 F76 S77 W81 A83 A248 L251 F252 | F75-I79 HydrophobicContact CE1-CD1 3.97Å; F75-I79 HydrophobicContact CZ-CD1 4.3Å; F75-I79 PolarHBondContact O-N 3.27Å; F76-I79 HydrophobicContact CD1-CD1 3.73Å; F76-I79 HydrophobicContact CE1-CD1 4.37Å; F76-I79 WeakPolarHBondContact O-CB 3.35Å; F76-I79 PolarHBondContact O-N 2.99Å; S77-I79 VanDerWaalsContact C-N 3.25Å; S77-I79 PolarHBondContact O-N 3.39Å; I79-W81 VanDerWaalsContact C-N 3.3Å; I79-W81 PolarHBondContact O-N 2.94Å; I79-A83 WeakPolarHBondContact O-CB 3.46Å; I79-A83 PolarHBondContact O-N 2.02Å; I79-A83 VanDerWaalsContact O-N 3.09Å; I79-A248 HydrophobicContact CB-CB 4.45Å; I79-A248 HydrophobicContact CG1-CB 3.7Å; I79-L251 HydrophobicContact CD1-CD1 3.45Å; I79-L251 VanDerWaalsContact CD1-CD1 3.45Å; I79-F252 HydrophobicContact CB-CE1 4.32Å; I79-F252 HydrophobicContact CB-CZ 4.21Å; I79-F252 HydrophobicContact CG2-CD1 4.23Å; I79-F252 HydrophobicContact CG2-CE1 3.36Å; I79-F252 HydrophobicContact CG2-CZ 3.71Å; I79-F252 WeakPolarHBondContact O-CE1 3.28Å; I79-F252 WeakPolarHBondContact O-CZ 3.39Å |
| 80 | A | 79.4 | Confident | 81.9 | Confident | 1 Ų | 1 | 14.2 Ų | 14.2 | 1% | 0.008 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -63.3 | -36.9 | -175 | 0 | 0 | 0 | 0 | 0 | 113.8 | S77 A78 N84 V269 S273 | S77-A80 WeakPolarHBondContact O-CB 3.42Å; S77-A80 PolarHBondContact O-N 2.9Å; A78-A80 PolarHBondContact O-N 3.09Å; A80-N84 PolarHBondContact O-ND2 2.95Å; A80-V269 VanDerWaalsContact CA-CG1 3.47Å; A80-V269 HydrophobicContact CB-CG1 4.16Å; A80-S273 WeakPolarHBondContact CB-OG 3.4Å |
| 81 | W | 77.1 | Confident | 80.7 | Confident | 5 Ų | 5 | 14.5 Ų | 14.5 | 2% | 0.019 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -85.5 | -40.2 | -176.6 | -47.7 | -44.5 | 0 | 0 | 0 | 112.1 | S77 A78 I79 A83 N84 H186 F216 I219 Y280 | S77-W81 VanDerWaalsContact CB-CZ2 3.5Å; S77-W81 VanDerWaalsContact O-CD2 3.3Å; A78-W81 VanDerWaalsContact CA-CE3 3.45Å; A78-W81 HydrophobicContact CB-CE3 4.14Å; A78-W81 HydrophobicContact CB-CZ3 4.08Å; A78-W81 PolarHBondContact O-N 3.32Å; I79-W81 VanDerWaalsContact C-N 3.3Å; I79-W81 PolarHBondContact O-N 2.94Å; W81-A83 PolarHBondContact O-N 2.86Å; W81-N84 PolarHBondContact O-N 3.23Å; W81-H186 AromaticContact CZ2-ND1 3.79Å; W81-F216 HydrophobicContact CB-CB 3.76Å; W81-F216 HydrophobicContact CB-CD1 3.86Å; W81-F216 HydrophobicContact CB-CD2 3.27Å; W81-F216 HydrophobicContact CB-CE1 4.29Å; W81-F216 HydrophobicContact CB-CE2 3.76Å; W81-F216 HydrophobicContact CB-CG 3.35Å; W81-F216 HydrophobicContact CB-CZ 4.25Å; W81-F216 AromaticContact CD2-CD2 3.62Å; W81-F216 HydrophobicContact CD2-CD2 3.62Å; W81-F216 HydrophobicContact CD2-CE2 4.21Å; W81-F216 HydrophobicContact CD2-CG 4.39Å; W81-F216 AromaticContact CE3-CD2 3.29Å; W81-F216 HydrophobicContact CE3-CD2 3.29Å; W81-F216 AromaticContact CE3-CE2 3.51Å; W81-F216 HydrophobicContact CE3-CE2 3.51Å; W81-F216 HydrophobicContact CE3-CG 4.42Å; W81-F216 HydrophobicContact CG-CB 4.07Å; W81-F216 AromaticContact CG-CD2 3.65Å; W81-F216 HydrophobicContact CG-CD2 3.65Å; W81-F216 HydrophobicContact CG-CE2 4.35Å; W81-F216 AromaticContact CG-CG 3.98Å; W81-F216 HydrophobicContact CG-CG 3.98Å; W81-F216 HydrophobicContact CZ3-CD2 4.32Å; W81-F216 HydrophobicContact CZ3-CE2 4.44Å; W81-I219 HydrophobicContact CH2-CB 3.76Å; W81-I219 HydrophobicContact CH2-CD1 4.14Å; W81-I219 HydrophobicContact CH2-CG2 2.95Å; W81-I219 HydrophobicContact CZ2-CB 3.9Å; W81-I219 HydrophobicContact CZ2-CD1 3.38Å; W81-I219 HydrophobicContact CZ2-CG1 4.2Å; W81-I219 HydrophobicContact CZ2-CG2 3.42Å; W81-I219 VanDerWaalsContact CZ2-CG2 3.42Å; W81-I219 HydrophobicContact CZ3-CB 4.14Å; W81-I219 HydrophobicContact CZ3-CG2 3.58Å; W81-Y280 VanDerWaalsContact CH2-OH 3.29Å; W81-Y280 WeakPolarHBondContact CH2-OH 3.16Å |
| 82 | F | 78.9 | Confident | 79.2 | Confident | 18 Ų | 18 | 15 Ų | 15 | 8% | 0.079 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -67.5 | -25.3 | 177.7 | -167.6 | -97.9 | 0 | 0 | 0 | 112.4 | A78 N84 Y85 V86 L245 Y249 F252 | A78-F82 WeakPolarHBondContact O-CB 3.49Å; A78-F82 PolarHBondContact O-N 2.98Å; F82-N84 VanDerWaalsContact C-N 3.26Å; F82-N84 PolarHBondContact O-N 3.13Å; F82-Y85 HydrophobicContact CD2-CD1 4.06Å; F82-Y85 AromaticContact CE2-CD1 3.46Å; F82-Y85 HydrophobicContact CE2-CD1 3.46Å; F82-Y85 VanDerWaalsContact CE2-CD1 3.46Å; F82-Y85 HydrophobicContact CE2-CE1 4.03Å; F82-Y85 HydrophobicContact CE2-CG 4.33Å; F82-Y85 AromaticContact CZ-CD1 3.81Å; F82-Y85 HydrophobicContact CZ-CD1 3.81Å; F82-Y85 HydrophobicContact CZ-CE1 4.27Å; F82-Y85 WeakPolarHBondContact O-CB 3.45Å; F82-Y85 PolarHBondContact O-N 3.48Å; F82-Y85 VanDerWaalsContact O-N 3.11Å; F82-V86 HydrophobicContact CD1-CG2 3.41Å; F82-V86 VanDerWaalsContact CD1-CG2 3.41Å; F82-V86 HydrophobicContact CE1-CG2 3.18Å; F82-V86 HydrophobicContact CG-CG2 4.45Å; F82-V86 HydrophobicContact CZ-CG2 3.99Å; F82-V86 WeakPolarHBondContact O-CG2 3.21Å; F82-V86 PolarHBondContact O-N 2.04Å; F82-L245 HydrophobicContact CB-CD1 3.83Å; F82-L245 HydrophobicContact CB-CD2 3.86Å; F82-L245 HydrophobicContact CB-CG 4.47Å; F82-L245 HydrophobicContact CD2-CD1 3.51Å; F82-L245 HydrophobicContact CE2-CD1 4.27Å; F82-L245 HydrophobicContact CG-CD1 3.78Å; F82-L245 HydrophobicContact CG-CD2 4.4Å; F82-Y249 HydrophobicContact CE1-CD1 4.38Å; F82-Y249 HydrophobicContact CE1-CD2 4.48Å; F82-Y249 AromaticContact CE1-CE1 3.8Å; F82-Y249 HydrophobicContact CE1-CE1 3.8Å; F82-Y249 AromaticContact CE1-CE2 3.91Å; F82-Y249 HydrophobicContact CE1-CE2 3.91Å; F82-Y249 AromaticContact CE1-CZ 3.54Å; F82-Y249 AromaticContact CZ-CE1 3.92Å; F82-Y249 HydrophobicContact CZ-CE1 3.92Å; F82-Y249 AromaticContact CZ-CE2 3.99Å; F82-Y249 HydrophobicContact CZ-CE2 3.99Å; F82-Y249 AromaticContact CZ-CZ 3.39Å; F82-Y249 WeakPolarHBondContact CZ-OH 3.26Å; F82-F252 HydrophobicContact CB-CE2 4.19Å; F82-F252 HydrophobicContact CB-CZ 4.02Å; F82-F252 HydrophobicContact CD1-CD2 4.02Å; F82-F252 AromaticContact CD1-CE2 3.31Å; F82-F252 HydrophobicContact CD1-CE2 3.31Å; F82-F252 AromaticContact CD1-CZ 3.95Å; F82-F252 HydrophobicContact CD1-CZ 3.95Å; F82-F252 HydrophobicContact CE1-CD2 4.45Å; F82-F252 HydrophobicContact CE1-CE2 4.11Å; F82-F252 HydrophobicContact CG-CE2 4.19Å; F82-F252 HydrophobicContact CG-CZ 4.5Å |
| 83 | A | 82.9 | Confident | 78 | Confident | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -56.3 | -38.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | I79 W81 V86 I87 F252 Y265 V269 | I79-A83 WeakPolarHBondContact O-CB 3.46Å; I79-A83 PolarHBondContact O-N 2.02Å; I79-A83 VanDerWaalsContact O-N 3.09Å; W81-A83 PolarHBondContact O-N 2.86Å; A83-V86 PolarHBondContact O-N 3.29Å; A83-I87 PolarHBondContact O-N 3.12Å; A83-F252 HydrophobicContact CB-CD1 4.39Å; A83-F252 HydrophobicContact CB-CE1 3.72Å; A83-F252 HydrophobicContact CB-CZ 4.34Å; A83-Y265 WeakPolarHBondContact CA-OH 3.12Å; A83-Y265 HydrophobicContact CB-CE1 3.84Å; A83-Y265 WeakPolarHBondContact CB-OH 3.33Å; A83-V269 HydrophobicContact CB-CB 4.26Å; A83-V269 HydrophobicContact CB-CG1 3.57Å; A83-V269 HydrophobicContact CB-CG2 3.95Å |
| 84 | N | 85.2 | Confident | 76.6 | Confident | 3 Ų | 3 | 15.1 Ų | 15.1 | 2% | 0.016 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -70.9 | -36.1 | 177.3 | -75.4 | -87 | 0 | 0 | 0 | 111.2 | A80 W81 F82 I87 L88 F158 Q209 T212 | A80-N84 PolarHBondContact O-ND2 2.95Å; W81-N84 PolarHBondContact O-N 3.23Å; F82-N84 VanDerWaalsContact C-N 3.26Å; F82-N84 PolarHBondContact O-N 3.13Å; N84-I87 WeakPolarHBondContact O-CG2 3.24Å; N84-L88 VanDerWaalsContact O-CG 3.22Å; N84-L88 WeakPolarHBondContact O-CG 3.39Å; N84-L88 PolarHBondContact O-N 2.95Å; N84-F158 HydrophobicContact CB-CD2 4.32Å; N84-F158 HydrophobicContact CB-CE2 3.74Å; N84-F158 HydrophobicContact CB-CZ 4.26Å; N84-Q209 PolarHBondContact OD1-NE2 2.58Å; N84-T212 HydrophobicContact CB-CG2 4.38Å |
| 85 | Y | 84.9 | Confident | 75.7 | Confident | 26 Ų | 26 | 16.6 Ų | 16.6 | 10% | 0.102 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -63.4 | -47.5 | 171.8 | -177.9 | -107 | 0 | 0 | 0 | 111.4 | F82 I87 L88 F89 L155 F158 L159 | F82-Y85 HydrophobicContact CD2-CD1 4.06Å; F82-Y85 AromaticContact CE2-CD1 3.46Å; F82-Y85 HydrophobicContact CE2-CD1 3.46Å; F82-Y85 VanDerWaalsContact CE2-CD1 3.46Å; F82-Y85 HydrophobicContact CE2-CE1 4.03Å; F82-Y85 HydrophobicContact CE2-CG 4.33Å; F82-Y85 AromaticContact CZ-CD1 3.81Å; F82-Y85 HydrophobicContact CZ-CD1 3.81Å; F82-Y85 HydrophobicContact CZ-CE1 4.27Å; F82-Y85 WeakPolarHBondContact O-CB 3.45Å; F82-Y85 PolarHBondContact O-N 3.48Å; F82-Y85 VanDerWaalsContact O-N 3.11Å; Y85-I87 PolarHBondContact O-N 3.09Å; Y85-L88 PolarHBondContact O-N 2.99Å; Y85-F89 HydrophobicContact CE1-CB 4.43Å; Y85-F89 HydrophobicContact CE1-CD2 4.16Å; Y85-F89 HydrophobicContact CE1-CG 4.42Å; Y85-F89 HydrophobicContact CE2-CD2 4.33Å; Y85-F89 AromaticContact CZ-CD2 3.72Å; Y85-F89 VanDerWaalsContact O-CB 3.26Å; Y85-F89 WeakPolarHBondContact O-CB 2.89Å; Y85-F89 PolarHBondContact O-N 2.73Å; Y85-F89 WeakPolarHBondContact OH-CD2 3.05Å; Y85-L155 HydrophobicContact CD2-CD1 3.89Å; Y85-L155 HydrophobicContact CE2-CD1 3.72Å; Y85-F158 HydrophobicContact CD2-CD1 4.02Å; Y85-F158 AromaticContact CD2-CE1 3.76Å; Y85-F158 HydrophobicContact CD2-CE1 3.76Å; Y85-F158 HydrophobicContact CG-CE1 4.13Å; Y85-L159 HydrophobicContact CD2-CD2 4.07Å; Y85-L159 HydrophobicContact CE2-CD1 4.49Å; Y85-L159 HydrophobicContact CE2-CD2 3.75Å; Y85-L159 HydrophobicContact CE2-CG 4.39Å |
| 86 | V | 79.9 | Confident | 75.4 | Confident | 5 Ų | 5 | 16.2 Ų | 16.2 | 3% | 0.03 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -58.5 | -48 | -179.4 | 161.7 | 0 | 0 | 0 | 0 | 112 | F82 A83 L88 F89 Y90 F252 F384 | F82-V86 HydrophobicContact CD1-CG2 3.41Å; F82-V86 VanDerWaalsContact CD1-CG2 3.41Å; F82-V86 HydrophobicContact CE1-CG2 3.18Å; F82-V86 HydrophobicContact CG-CG2 4.45Å; F82-V86 HydrophobicContact CZ-CG2 3.99Å; F82-V86 WeakPolarHBondContact O-CG2 3.21Å; F82-V86 PolarHBondContact O-N 2.04Å; A83-V86 PolarHBondContact O-N 3.29Å; V86-L88 VanDerWaalsContact C-N 3.28Å; V86-L88 PolarHBondContact O-N 3.07Å; V86-F89 PolarHBondContact O-N 3.27Å; V86-Y90 HydrophobicContact CG1-CD2 4.46Å; V86-Y90 WeakPolarHBondContact O-CD2 3.48Å; V86-Y90 PolarHBondContact O-N 3.45Å; V86-F252 HydrophobicContact CG2-CD2 4.37Å; V86-F384 HydrophobicContact CB-CE1 4.45Å; V86-F384 HydrophobicContact CB-CZ 4.13Å; V86-F384 HydrophobicContact CG1-CE1 3.86Å; V86-F384 HydrophobicContact CG1-CE2 3.78Å; V86-F384 HydrophobicContact CG1-CZ 3.25Å; V86-F384 HydrophobicContact CG2-CE1 3.73Å; V86-F384 HydrophobicContact CG2-CZ 3.86Å |
| 87 | I | 81 | Confident | 75.3 | Confident | 12 Ų | 12 | 12.6 Ų | 12.6 | 6% | 0.062 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -65.2 | -35.1 | -176.6 | -155.5 | 168.4 | 0 | 0 | 0 | 112 | A83 N84 Y85 G91 W262 Y265 L266 | A83-I87 PolarHBondContact O-N 3.12Å; N84-I87 WeakPolarHBondContact O-CG2 3.24Å; Y85-I87 PolarHBondContact O-N 3.09Å; I87-G91 PolarHBondContact O-N 3.48Å; I87-W262 HydrophobicContact CD1-CB 3.58Å; I87-W262 HydrophobicContact CD1-CE3 4.34Å; I87-W262 HydrophobicContact CG1-CB 4.47Å; I87-Y265 HydrophobicContact CB-CE1 4.43Å; I87-Y265 HydrophobicContact CD1-CD1 3.8Å; I87-Y265 HydrophobicContact CD1-CE1 4.27Å; I87-L266 HydrophobicContact CD1-CD2 4.46Å; I87-L266 HydrophobicContact CD1-CG 4.27Å |
| 88 | L | 82.4 | Confident | 75.4 | Confident | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -74.9 | -45.4 | 176.8 | -67.2 | 177.4 | 0 | 0 | 0 | 111.8 | N84 Y85 V86 Y90 G91 L137 L154 L155 F158 F205 Q209 | N84-L88 VanDerWaalsContact O-CG 3.22Å; N84-L88 WeakPolarHBondContact O-CG 3.39Å; N84-L88 PolarHBondContact O-N 2.95Å; Y85-L88 PolarHBondContact O-N 2.99Å; V86-L88 VanDerWaalsContact C-N 3.28Å; V86-L88 PolarHBondContact O-N 3.07Å; L88-Y90 VanDerWaalsContact C-N 3.3Å; L88-Y90 PolarHBondContact O-N 3.26Å; L88-G91 PolarHBondContact O-N 2.89Å; L88-L137 HydrophobicContact CD2-CD2 4.28Å; L88-L154 HydrophobicContact CD2-CB 3.57Å; L88-L154 HydrophobicContact CD2-CD1 4.21Å; L88-L154 HydrophobicContact CD2-CG 4.48Å; L88-L155 HydrophobicContact CB-CB 4.32Å; L88-L155 HydrophobicContact CB-CD1 4.09Å; L88-F158 HydrophobicContact CD1-CB 3.54Å; L88-F158 HydrophobicContact CD1-CD2 4.39Å; L88-F158 HydrophobicContact CD1-CG 3.95Å; L88-F205 HydrophobicContact CD2-CE1 3.93Å; L88-Q209 HydrophobicContact CD1-CB 4.45Å; L88-Q209 HydrophobicContact CD1-CG 4.14Å |
| 89 | F | 72.8 | Confident | 75.9 | Confident | 11 Ų | 11 | 14.1 Ų | 14.1 | 5% | 0.048 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -60.6 | -40.3 | 179.8 | -166.2 | -88.4 | 0 | 0 | 0 | 111.5 | Y85 V86 M92 L155 L368 L369 | Y85-F89 HydrophobicContact CE1-CB 4.43Å; Y85-F89 HydrophobicContact CE1-CD2 4.16Å; Y85-F89 HydrophobicContact CE1-CG 4.42Å; Y85-F89 HydrophobicContact CE2-CD2 4.33Å; Y85-F89 AromaticContact CZ-CD2 3.72Å; Y85-F89 VanDerWaalsContact O-CB 3.26Å; Y85-F89 WeakPolarHBondContact O-CB 2.89Å; Y85-F89 PolarHBondContact O-N 2.73Å; Y85-F89 WeakPolarHBondContact OH-CD2 3.05Å; V86-F89 PolarHBondContact O-N 3.27Å; F89-M92 HydrophobicContact CD2-CE 4.2Å; F89-M92 HydrophobicContact CG-CE 4.3Å; F89-M92 WeakPolarHBondContact O-CE 3.22Å; F89-L155 HydrophobicContact CD2-CD2 4.16Å; F89-L368 HydrophobicContact CE1-CB 4.34Å; F89-L368 HydrophobicContact CE1-CD2 3.95Å; F89-L368 HydrophobicContact CE1-CG 4.32Å; F89-L368 HydrophobicContact CZ-CB 4.16Å; F89-L368 HydrophobicContact CZ-CD2 4.36Å; F89-L369 HydrophobicContact CD1-CD2 4.24Å; F89-L369 HydrophobicContact CD2-CD2 4.05Å; F89-L369 HydrophobicContact CE1-CD2 3.68Å; F89-L369 HydrophobicContact CE1-CG 4.43Å; F89-L369 HydrophobicContact CE2-CD1 4.31Å; F89-L369 HydrophobicContact CE2-CD2 3.46Å; F89-L369 VanDerWaalsContact CE2-CD2 3.46Å; F89-L369 HydrophobicContact CE2-CG 3.86Å; F89-L369 HydrophobicContact CG-CD2 4.42Å; F89-L369 HydrophobicContact CZ-CD2 3.27Å; F89-L369 HydrophobicContact CZ-CG 3.63Å |
| 90 | Y | 64.4 | Low | 76.3 | Confident | 21 Ų | 21 | 16.2 Ų | 16.2 | 8% | 0.082 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -94.4 | -13.8 | -179.9 | -74.1 | -90.1 | 0 | 0 | 0 | 114.7 | V86 L88 M92 T93 L368 M377 F380 H383 F384 | V86-Y90 HydrophobicContact CG1-CD2 4.46Å; V86-Y90 WeakPolarHBondContact O-CD2 3.48Å; V86-Y90 PolarHBondContact O-N 3.45Å; L88-Y90 VanDerWaalsContact C-N 3.3Å; L88-Y90 PolarHBondContact O-N 3.26Å; Y90-M92 PolarHBondContact O-N 3.37Å; Y90-T93 HydrophobicContact CD1-CG2 3.71Å; Y90-T93 HydrophobicContact CE1-CG2 4.49Å; Y90-T93 WeakPolarHBondContact O-CB 3.14Å; Y90-T93 PolarHBondContact O-N 3.2Å; Y90-T93 PolarHBondContact O-OG1 3.45Å; Y90-L368 VanDerWaalsContact OH-CD2 3.28Å; Y90-L368 WeakPolarHBondContact OH-CD2 3.45Å; Y90-M377 HydrophobicContact CE1-SD 4.06Å; Y90-F380 AromaticContact CD1-CD1 3.85Å; Y90-F380 HydrophobicContact CD1-CD1 3.85Å; Y90-F380 AromaticContact CD1-CE1 3.97Å; Y90-F380 HydrophobicContact CD1-CE1 3.97Å; Y90-F380 HydrophobicContact CG-CD1 4.25Å; Y90-F380 HydrophobicContact CG-CE1 4.39Å; Y90-H383 AromaticContact CE1-CD2 3.87Å; Y90-H383 AromaticContact CZ-CD2 3.68Å; Y90-H383 AromaticContact CZ-NE2 3.57Å; Y90-H383 PolarHBondContact OH-CD2 2.96Å; Y90-H383 VanDerWaalsContact OH-CD2 3.26Å; Y90-H383 PolarHBondContact OH-NE2 2.95Å; Y90-F384 AromaticContact CD2-CE2 3.86Å; Y90-F384 HydrophobicContact CD2-CE2 3.86Å; Y90-F384 AromaticContact CD2-CZ 3.58Å; Y90-F384 HydrophobicContact CD2-CZ 3.58Å; Y90-F384 HydrophobicContact CE2-CE1 4.33Å; Y90-F384 AromaticContact CE2-CE2 3.88Å; Y90-F384 HydrophobicContact CE2-CE2 3.88Å; Y90-F384 AromaticContact CE2-CZ 3.36Å; Y90-F384 HydrophobicContact CE2-CZ 3.36Å; Y90-F384 HydrophobicContact CG-CE2 4.26Å; Y90-F384 HydrophobicContact CG-CZ 4.41Å |
| 91 | G | 65.5 | Low | 76.7 | Confident | 8 Ų | 8 | 16.3 Ų | 16.3 | 8% | 0.082 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -52.1 | -25.9 | 163.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I87 L88 T93 T138 I151 | I87-G91 PolarHBondContact O-N 3.48Å; L88-G91 PolarHBondContact O-N 2.89Å; G91-T93 VanDerWaalsContact C-N 3.31Å; G91-T93 PolarHBondContact O-N 3.11Å; G91-T138 WeakPolarHBondContact O-CG2 3.17Å; G91-I151 WeakPolarHBondContact O-CD1 3.5Å |
| 92 | M | 58.3 | Low | 77.1 | Confident | 16 Ų | 16 | 18.3 Ų | 18.3 | 8% | 0.079 | 10% | 0.103 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.2 | -18.1 | 176.4 | -64 | -170.9 | -75.4 | 0 | 0 | 114.6 | F89 Y90 K148 I151 F152 L155 L369 | F89-M92 HydrophobicContact CD2-CE 4.2Å; F89-M92 HydrophobicContact CG-CE 4.3Å; F89-M92 WeakPolarHBondContact O-CE 3.22Å; Y90-M92 PolarHBondContact O-N 3.37Å; M92-K148 VanDerWaalsContact O-CE 3.23Å; M92-K148 WeakPolarHBondContact O-CE 3.14Å; M92-K148 PolarHBondContact O-NZ 3.37Å; M92-I151 HydrophobicContact CG-CB 4.3Å; M92-I151 HydrophobicContact CG-CG2 3.63Å; M92-F152 HydrophobicContact SD-CB 4.39Å; M92-F152 HydrophobicContact SD-CD2 3.81Å; M92-L155 HydrophobicContact CE-CD2 3.49Å; M92-L155 VanDerWaalsContact CE-CD2 3.49Å; M92-L155 HydrophobicContact SD-CD2 4.25Å; M92-L369 HydrophobicContact CE-CD1 4.48Å; M92-L369 HydrophobicContact CE-CD2 3.21Å; M92-L369 HydrophobicContact CE-CG 4.47Å; M92-L369 HydrophobicContact SD-CD2 4.33Å |
| 93 | T | 61.4 | Low | 77.5 | Confident | 8 Ų | 8 | 23.8 Ų | 23.8 | 5% | 0.049 | 13% | 0.132 | C | C | . | . | S | Bend | trans | -62.4 | 140 | 175.1 | 59.3 | 0 | 0 | 0 | 0 | 110.4 | Y90 G91 T95 F380 | Y90-T93 HydrophobicContact CD1-CG2 3.71Å; Y90-T93 HydrophobicContact CE1-CG2 4.49Å; Y90-T93 WeakPolarHBondContact O-CB 3.14Å; Y90-T93 PolarHBondContact O-N 3.2Å; Y90-T93 PolarHBondContact O-OG1 3.45Å; G91-T93 VanDerWaalsContact C-N 3.31Å; G91-T93 PolarHBondContact O-N 3.11Å; T93-T95 PolarHBondContact O-N 2.96Å; T93-T95 VanDerWaalsContact O-N 3.14Å; T93-F380 HydrophobicContact CG2-CE1 3.83Å; T93-F380 WeakPolarHBondContact OG1-CE1 3.35Å; T93-F380 WeakPolarHBondContact OG1-CZ 3.03Å |
| 94 | E | 60.1 | Low | 77.7 | Confident | 54 Ų | 54 | 29.7 Ų | 29.7 | 25% | 0.252 | 16% | 0.164 | S | C | . | . | trans | -74.3 | 109.1 | -172.2 | -162.5 | 140.6 | 173.5 | 0 | 0 | 110.3 | K114 K148 | E94-K114 VanDerWaalsContact CD-NZ 3.27Å; E94-K114 WeakPolarHBondContact OE1-CD 3.39Å; E94-K114 WeakPolarHBondContact OE1-CE 3.02Å; E94-K114 IonicContact OE1-NZ 3.29Å; E94-K114 PolarHBondContact OE1-NZ 2.89Å; E94-K114 IonicContact OE2-NZ 3.03Å; E94-K114 PolarHBondContact OE2-NZ 3.12Å; E94-K148 IonicContact OE2-NZ 2.7Å; E94-K148 PolarHBondContact OE2-NZ 3.29Å | ||
| 95 | T | 68.3 | Low | 77.8 | Confident | 34 Ų | 34 | 35.5 Ų | 35.5 | 21% | 0.209 | 20% | 0.195 | C | C | . | . | trans | -80.5 | 142.2 | 167.1 | 50.5 | 0 | 0 | 0 | 0 | 109.4 | T93 W97 | T93-T95 PolarHBondContact O-N 2.96Å; T93-T95 VanDerWaalsContact O-N 3.14Å; T95-W97 PolarHBondContact OG1-NE1 2.94Å | ||
| 96 | A | 75.5 | Confident | 77.9 | Confident | 24 Ų | 24 | 36.5 Ų | 36.5 | 20% | 0.198 | 21% | 0.208 | C | C | . | . | trans | -79.5 | 133.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | I111 V130 | A96-I111 HydrophobicContact CB-CD1 3.49Å; A96-I111 VanDerWaalsContact CB-CD1 3.49Å; A96-I111 HydrophobicContact CB-CG1 3.57Å; A96-V130 HydrophobicContact CB-CB 3.89Å; A96-V130 HydrophobicContact CB-CG2 3.58Å; A96-V130 WeakPolarHBondContact O-CB 3.42Å; A96-V130 WeakPolarHBondContact O-CG2 3.27Å; A96-V130 PolarHBondContact O-N 3.21Å | ||
| 97 | W | 82 | Confident | 78.2 | Confident | 10 Ų | 10 | 41.2 Ų | 41.2 | 4% | 0.038 | 24% | 0.237 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 149.1 | 177.7 | -68.6 | 78.2 | 0 | 0 | 0 | 110.3 | T95 S109 S110 F117 L127 T138 K142 V144 | T95-W97 PolarHBondContact OG1-NE1 2.94Å; W97-S109 CarbonylContact O-C 3.56Å; W97-S109 VanDerWaalsContact O-CA 3.26Å; W97-S109 WeakPolarHBondContact O-CA 3.45Å; W97-S110 PolarHBondContact N-OG 2.91Å; W97-S110 PolarHBondContact O-N 3.29Å; W97-F117 HydrophobicContact CB-CE1 4.12Å; W97-F117 HydrophobicContact CB-CE2 4.1Å; W97-F117 HydrophobicContact CB-CZ 3.46Å; W97-F117 VanDerWaalsContact CB-CZ 3.46Å; W97-F117 HydrophobicContact CG-CZ 4.45Å; W97-L127 HydrophobicContact CB-CD1 4.41Å; W97-L127 HydrophobicContact CE3-CD1 3.78Å; W97-L127 HydrophobicContact CE3-CD2 4.22Å; W97-L127 HydrophobicContact CE3-CG 3.75Å; W97-L127 HydrophobicContact CZ3-CD1 4.47Å; W97-L127 HydrophobicContact CZ3-CD2 4.14Å; W97-L127 HydrophobicContact CZ3-CG 3.96Å; W97-T138 WeakPolarHBondContact CZ2-O 3.27Å; W97-K142 HydrophobicContact CH2-CG 4.31Å; W97-K142 HydrophobicContact CZ3-CG 4.4Å; W97-V144 HydrophobicContact CD2-CG1 3.55Å; W97-V144 HydrophobicContact CE3-CG1 4.34Å; W97-V144 HydrophobicContact CG-CG1 3.62Å; W97-V144 HydrophobicContact CZ2-CG1 3.8Å |
| 98 | T | 85.4 | Confident | 78.4 | Confident | 36 Ų | 36 | 41.6 Ų | 41.6 | 22% | 0.221 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.8 | 141.9 | 175.7 | 53.2 | 0 | 0 | 0 | 0 | 109.7 | T107 I108 K128 V130 | T98-T107 HydrophobicContact CG2-CG2 4.35Å; T98-I108 CarbonylContact C-O 3.35Å; T98-I108 WeakPolarHBondContact CA-O 2.99Å; T98-K128 PolarHBondContact N-O 3.21Å; T98-K128 PolarHBondContact O-N 3.33Å; T98-K128 PolarHBondContact OG1-O 3.34Å; T98-K128 VanDerWaalsContact OG1-O 3.09Å; T98-V130 HydrophobicContact CG2-CG2 3.86Å |
| 99 | C | 87.7 | Confident | 78.5 | Confident | 2 Ų | 2 | 42.4 Ų | 42.4 | 1% | 0.014 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -147.5 | 158.3 | 172.9 | 81.3 | 0 | 0 | 0 | 0 | 109.6 | I108 F117 C124 L127 | C99-I108 PolarHBondContact N-O 3.29Å; C99-I108 PolarHBondContact O-N 3.43Å; C99-F117 HydrophobicContact CB-CE2 4.03Å; C99-C124 HydrophobicContact CB-CB 3.72Å; C99-C124 WeakPolarHBondContact CB-SG 3.4Å; C99-C124 WeakPolarHBondContact SG-CB 3.28Å; C99-C124 CovalentContact SG-SG 2.02Å; C99-C124 PolarHBondContact SG-SG 2.9Å; C99-L127 HydrophobicContact CB-CD1 4.05Å |
| 100 | T | 88.6 | Confident | 78.8 | Confident | 46 Ų | 46 | 42.4 Ų | 42.4 | 28% | 0.282 | 25% | 0.246 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -95 | 122.2 | -179.6 | -53 | 0 | 0 | 0 | 0 | 110.4 | A106 C124 F125 | T100-A106 CarbonylContact C-O 3.43Å; T100-A106 WeakPolarHBondContact CA-O 3.35Å; T100-C124 PolarHBondContact N-SG 3.35Å; T100-C124 VanDerWaalsContact N-SG 3.41Å; T100-C124 PolarHBondContact O-SG 3.08Å; T100-F125 PolarHBondContact N-O 2.99Å; T100-F125 PolarHBondContact O-N 3.5Å |
| 101 | D | 87.7 | Confident | 79.3 | Confident | 4 Ų | 4 | 47.1 Ų | 47.1 | 2% | 0.021 | 27% | 0.271 | C | S | . | . | trans | -55.7 | 127.5 | 177.4 | -164.2 | -40.7 | 0 | 0 | 0 | 111 | I103 N105 A106 I108 Y116 | D101-I103 PolarHBondContact O-N 3.03Å; D101-I103 WeakPolarHBondContact OD1-CB 3.39Å; D101-I103 PolarHBondContact OD1-N 3.14Å; D101-N105 VanDerWaalsContact O-CA 3.25Å; D101-N105 WeakPolarHBondContact O-CA 3.3Å; D101-N105 PolarHBondContact O-N 3.19Å; D101-N105 VanDerWaalsContact O-N 3.1Å; D101-A106 HydrophobicContact CB-CB 4.46Å; D101-A106 WeakPolarHBondContact CB-O 3.21Å; D101-A106 PolarHBondContact N-O 3.48Å; D101-I108 HydrophobicContact CB-CD1 3.57Å; D101-I108 HydrophobicContact CB-CG1 4.39Å; D101-I108 WeakPolarHBondContact OD2-CD1 3.46Å; D101-Y116 PolarHBondContact OD2-OH 3.26Å | ||
| 102 | P | 87.1 | Confident | 79.9 | Confident | 47 Ų | 47 | 53.6 Ų | 53.6 | 31% | 0.305 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | -19.2 | 176.2 | 27.7 | -34.6 | 0 | 0 | 0 | 114.4 | F125 | P102-F125 HydrophobicContact CB-CD2 4.22Å; P102-F125 HydrophobicContact CB-CE2 3.8Å |
| 103 | I | 86.1 | Confident | 80.9 | Confident | 133 Ų | 133 | 56.5 Ų | 56.5 | 68% | 0.682 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.9 | -55.8 | -175.4 | -57.1 | 172.2 | 0 | 0 | 0 | 110.4 | D101 | D101-I103 PolarHBondContact O-N 3.03Å; D101-I103 WeakPolarHBondContact OD1-CB 3.39Å; D101-I103 PolarHBondContact OD1-N 3.14Å |
| 104 | D | 87.5 | Confident | 81.9 | Confident | 124 Ų | 124 | 60.9 Ų | 60.9 | 66% | 0.663 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99 | -4.2 | -173.2 | -71.1 | -22.7 | 0 | 0 | 0 | 113.8 | A106 | D104-A106 HydrophobicContact CB-CB 4.27Å; D104-A106 PolarHBondContact O-N 3.24Å |
| 105 | N | 86.5 | Confident | 83 | Confident | 125 Ų | 125 | 65.2 Ų | 65.2 | 67% | 0.668 | 36% | 0.358 | S | S | * | . | trans | 54.5 | 18.1 | -169.4 | -77.8 | -35.6 | 0 | 0 | 0 | 114.1 | D101 | D101-N105 VanDerWaalsContact O-CA 3.25Å; D101-N105 WeakPolarHBondContact O-CA 3.3Å; D101-N105 PolarHBondContact O-N 3.19Å; D101-N105 VanDerWaalsContact O-N 3.1Å | ||
| 106 | A | 87.4 | Confident | 83.8 | Confident | 46 Ų | 46 | 67 Ų | 67 | 38% | 0.38 | 36% | 0.362 | S | S | . | . | P | Polyproline II helix | trans | -77.7 | 149.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | T100 D101 D104 | T100-A106 CarbonylContact C-O 3.43Å; T100-A106 WeakPolarHBondContact CA-O 3.35Å; D101-A106 HydrophobicContact CB-CB 4.46Å; D101-A106 WeakPolarHBondContact CB-O 3.21Å; D101-A106 PolarHBondContact N-O 3.48Å; D104-A106 HydrophobicContact CB-CB 4.27Å; D104-A106 PolarHBondContact O-N 3.24Å |
| 107 | T | 86.3 | Confident | 84.4 | Confident | 104 Ų | 104 | 66 Ų | 66 | 64% | 0.638 | 35% | 0.353 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -85.3 | 116.3 | 172 | -54.7 | 0 | 0 | 0 | 0 | 109.4 | T98 | T98-T107 HydrophobicContact CG2-CG2 4.35Å |
| 108 | I | 85.9 | Confident | 84.6 | Confident | 20 Ų | 20 | 67.1 Ų | 67.1 | 10% | 0.103 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 140 | 178.1 | -62.2 | 157.5 | 0 | 0 | 0 | 108.4 | T98 C99 D101 Y116 F117 I120 | T98-I108 CarbonylContact C-O 3.35Å; T98-I108 WeakPolarHBondContact CA-O 2.99Å; C99-I108 PolarHBondContact N-O 3.29Å; C99-I108 PolarHBondContact O-N 3.43Å; D101-I108 HydrophobicContact CB-CD1 3.57Å; D101-I108 HydrophobicContact CB-CG1 4.39Å; D101-I108 WeakPolarHBondContact OD2-CD1 3.46Å; I108-Y116 HydrophobicContact CD1-CD1 3.87Å; I108-Y116 HydrophobicContact CD1-CE1 3.4Å; I108-Y116 VanDerWaalsContact CD1-CE1 3.4Å; I108-Y116 HydrophobicContact CG1-CD1 4.5Å; I108-Y116 HydrophobicContact CG1-CE1 4.32Å; I108-Y116 HydrophobicContact CG2-CD1 4.34Å; I108-F117 HydrophobicContact CG2-CB 4.1Å; I108-F117 HydrophobicContact CG2-CD2 4.14Å; I108-I120 HydrophobicContact CD1-CD1 3.21Å |
| 109 | S | 83.6 | Confident | 84.7 | Confident | 17 Ų | 17 | 71.7 Ų | 71.7 | 12% | 0.119 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 143.6 | 174.5 | 72.4 | 0 | 0 | 0 | 0 | 111.2 | W97 I111 N112 D113 | W97-S109 CarbonylContact O-C 3.56Å; W97-S109 VanDerWaalsContact O-CA 3.26Å; W97-S109 WeakPolarHBondContact O-CA 3.45Å; S109-I111 PolarHBondContact O-N 3.21Å; S109-I111 VanDerWaalsContact O-N 3.15Å; S109-N112 PolarHBondContact O-N 2.85Å; S109-N112 WeakPolarHBondContact OG-CB 3.3Å; S109-N112 PolarHBondContact OG-N 3.01Å; S109-N112 PolarHBondContact OG-ND2 3.36Å; S109-D113 PolarHBondContact O-N 2.61Å |
| 110 | S | 78.7 | Confident | 84.6 | Confident | 11 Ų | 11 | 72.5 Ų | 72.5 | 8% | 0.077 | 39% | 0.385 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.2 | -14.6 | 173.5 | 70.9 | 0 | 0 | 0 | 0 | 113.2 | W97 | W97-S110 PolarHBondContact N-OG 2.91Å; W97-S110 PolarHBondContact O-N 3.29Å |
| 111 | I | 75.9 | Confident | 84.5 | Confident | 121 Ų | 121 | 71.4 Ų | 71.4 | 62% | 0.621 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.7 | -43.8 | 176.7 | -54.7 | 176.8 | 0 | 0 | 0 | 110.5 | A96 S109 | A96-I111 HydrophobicContact CB-CD1 3.49Å; A96-I111 VanDerWaalsContact CB-CD1 3.49Å; A96-I111 HydrophobicContact CB-CG1 3.57Å; S109-I111 PolarHBondContact O-N 3.21Å; S109-I111 VanDerWaalsContact O-N 3.15Å |
| 112 | N | 77 | Confident | 84.3 | Confident | 144 Ų | 144 | 78.2 Ų | 78.2 | 77% | 0.77 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81 | -44.9 | -170.8 | -67.8 | -8.3 | 0 | 0 | 0 | 112 | S109 | S109-N112 PolarHBondContact O-N 2.85Å; S109-N112 WeakPolarHBondContact OG-CB 3.3Å; S109-N112 PolarHBondContact OG-N 3.01Å; S109-N112 PolarHBondContact OG-ND2 3.36Å |
| 113 | D | 80.7 | Confident | 84.3 | Confident | 77 Ų | 77 | 79 Ų | 79 | 41% | 0.412 | 42% | 0.42 | S | S | . | . | trans | -142.9 | 86.9 | 179.7 | -165.8 | -22.1 | 0 | 0 | 0 | 110.1 | S109 E115 Y116 F117 | S109-D113 PolarHBondContact O-N 2.61Å; D113-E115 PolarHBondContact OD1-N 2.85Å; D113-Y116 WeakPolarHBondContact OD1-CB 3.43Å; D113-Y116 PolarHBondContact OD1-N 3.4Å; D113-Y116 WeakPolarHBondContact OD2-CB 3.43Å; D113-F117 WeakPolarHBondContact O-CB 3.01Å; D113-F117 PolarHBondContact O-N 3.18Å | ||
| 114 | K | 80.9 | Confident | 84.3 | Confident | 100 Ų | 100 | 73.5 Ų | 73.5 | 44% | 0.435 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65.6 | -38.7 | -176.6 | -179 | 173.1 | 177.7 | 167.2 | 0 | 112.5 | E94 C118 | E94-K114 VanDerWaalsContact CD-NZ 3.27Å; E94-K114 WeakPolarHBondContact OE1-CD 3.39Å; E94-K114 WeakPolarHBondContact OE1-CE 3.02Å; E94-K114 IonicContact OE1-NZ 3.29Å; E94-K114 PolarHBondContact OE1-NZ 2.89Å; E94-K114 IonicContact OE2-NZ 3.03Å; E94-K114 PolarHBondContact OE2-NZ 3.12Å; K114-C118 WeakPolarHBondContact O-CB 3.28Å; K114-C118 PolarHBondContact O-N 3.47Å; K114-C118 VanDerWaalsContact O-N 3.07Å; K114-C118 PolarHBondContact O-SG 3.21Å |
| 115 | E | 84.3 | Confident | 84.2 | Confident | 144 Ų | 144 | 73.9 Ų | 73.9 | 67% | 0.673 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -70.5 | -48.2 | -176.2 | -171.1 | 168.7 | -173.8 | 0 | 0 | 110.1 | D113 C118 Q119 | D113-E115 PolarHBondContact OD1-N 2.85Å; E115-C118 PolarHBondContact O-N 3.35Å; E115-Q119 WeakPolarHBondContact O-CG 3.34Å; E115-Q119 PolarHBondContact O-N 2.94Å; E115-Q119 VanDerWaalsContact O-N 3.09Å |
| 116 | Y | 85.8 | Confident | 84 | Confident | 72 Ų | 72 | 70.4 Ų | 70.4 | 28% | 0.282 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.7 | -46.4 | 175.9 | -173.4 | -119.5 | 0 | 0 | 0 | 112 | D101 I108 D113 C118 Q119 I120 | D101-Y116 PolarHBondContact OD2-OH 3.26Å; I108-Y116 HydrophobicContact CD1-CD1 3.87Å; I108-Y116 HydrophobicContact CD1-CE1 3.4Å; I108-Y116 VanDerWaalsContact CD1-CE1 3.4Å; I108-Y116 HydrophobicContact CG1-CD1 4.5Å; I108-Y116 HydrophobicContact CG1-CE1 4.32Å; I108-Y116 HydrophobicContact CG2-CD1 4.34Å; D113-Y116 WeakPolarHBondContact OD1-CB 3.43Å; D113-Y116 PolarHBondContact OD1-N 3.4Å; D113-Y116 WeakPolarHBondContact OD2-CB 3.43Å; Y116-C118 PolarHBondContact O-N 2.88Å; Y116-Q119 PolarHBondContact O-N 3.39Å; Y116-I120 HydrophobicContact CD1-CD1 4.45Å; Y116-I120 HydrophobicContact CD2-CG2 4.32Å; Y116-I120 HydrophobicContact CE1-CD1 3.99Å; Y116-I120 HydrophobicContact CE2-CG2 3.77Å; Y116-I120 WeakPolarHBondContact O-CG1 3.37Å; Y116-I120 PolarHBondContact O-N 2.99Å; Y116-I120 VanDerWaalsContact O-N 3.15Å |
| 117 | F | 86.6 | Confident | 83.8 | Confident | 2 Ų | 2 | 69.9 Ų | 69.9 | 1% | 0.009 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -52.8 | -43.4 | 176 | 176.6 | -92.1 | 0 | 0 | 0 | 111.9 | W97 C99 I108 D113 M121 L127 | W97-F117 HydrophobicContact CB-CE1 4.12Å; W97-F117 HydrophobicContact CB-CE2 4.1Å; W97-F117 HydrophobicContact CB-CZ 3.46Å; W97-F117 VanDerWaalsContact CB-CZ 3.46Å; W97-F117 HydrophobicContact CG-CZ 4.45Å; C99-F117 HydrophobicContact CB-CE2 4.03Å; I108-F117 HydrophobicContact CG2-CB 4.1Å; I108-F117 HydrophobicContact CG2-CD2 4.14Å; D113-F117 WeakPolarHBondContact O-CB 3.01Å; D113-F117 PolarHBondContact O-N 3.18Å; F117-M121 WeakPolarHBondContact O-CB 3.41Å; F117-M121 PolarHBondContact O-N 3.21Å; F117-M121 VanDerWaalsContact O-N 3.12Å; F117-L127 HydrophobicContact CE2-CD1 4.22Å; F117-L127 HydrophobicContact CZ-CD1 3.69Å |
| 118 | C | 86.6 | Confident | 83.6 | Confident | 34 Ų | 34 | 71.9 Ų | 71.9 | 23% | 0.23 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -74.7 | -24.1 | -179.9 | -71.4 | 0 | 0 | 0 | 0 | 114.5 | K114 E115 Y116 C145 | K114-C118 WeakPolarHBondContact O-CB 3.28Å; K114-C118 PolarHBondContact O-N 3.47Å; K114-C118 VanDerWaalsContact O-N 3.07Å; K114-C118 PolarHBondContact O-SG 3.21Å; E115-C118 PolarHBondContact O-N 3.35Å; Y116-C118 PolarHBondContact O-N 2.88Å; C118-C145 WeakPolarHBondContact CA-SG 3.39Å; C118-C145 HydrophobicContact CB-CB 3.63Å; C118-C145 WeakPolarHBondContact CB-SG 3.43Å; C118-C145 WeakPolarHBondContact SG-CB 3.16Å; C118-C145 CovalentContact SG-SG 2.04Å; C118-C145 PolarHBondContact SG-SG 2.96Å |
| 119 | Q | 87.1 | Confident | 83.1 | Confident | 133 Ų | 133 | 72.6 Ų | 72.6 | 62% | 0.621 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -73.6 | -40.7 | 175.1 | -73 | 175.5 | 5.7 | 0 | 0 | 112.2 | E115 Y116 | E115-Q119 WeakPolarHBondContact O-CG 3.34Å; E115-Q119 PolarHBondContact O-N 2.94Å; E115-Q119 VanDerWaalsContact O-N 3.09Å; Y116-Q119 PolarHBondContact O-N 3.39Å |
| 120 | I | 87.4 | Confident | 82.6 | Confident | 19 Ų | 19 | 74.5 Ų | 74.5 | 10% | 0.097 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -94.3 | -3.5 | -176.6 | 68.5 | 162.7 | 0 | 0 | 0 | 113.8 | I108 Y116 D122 S123 C124 | I108-I120 HydrophobicContact CD1-CD1 3.21Å; Y116-I120 HydrophobicContact CD1-CD1 4.45Å; Y116-I120 HydrophobicContact CD2-CG2 4.32Å; Y116-I120 HydrophobicContact CE1-CD1 3.99Å; Y116-I120 HydrophobicContact CE2-CG2 3.77Å; Y116-I120 WeakPolarHBondContact O-CG1 3.37Å; Y116-I120 PolarHBondContact O-N 2.99Å; Y116-I120 VanDerWaalsContact O-N 3.15Å; I120-D122 PolarHBondContact O-N 3.26Å; I120-D122 VanDerWaalsContact O-N 3.09Å; I120-S123 CarbonylContact O-C 3.58Å; I120-S123 PolarHBondContact O-N 3.07Å; I120-S123 PolarHBondContact O-OG 2.75Å; I120-C124 WeakPolarHBondContact O-CB 3.32Å; I120-C124 PolarHBondContact O-N 3.42Å |
| 121 | M | 84.7 | Confident | 82.1 | Confident | 22 Ų | 22 | 80.1 Ų | 80.1 | 11% | 0.108 | 43% | 0.433 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51.9 | -39.3 | -171.3 | -176.3 | -175 | 67.5 | 0 | 0 | 113.7 | F117 S123 V144 C145 | F117-M121 WeakPolarHBondContact O-CB 3.41Å; F117-M121 PolarHBondContact O-N 3.21Å; F117-M121 VanDerWaalsContact O-N 3.12Å; M121-S123 VanDerWaalsContact C-N 3.32Å; M121-S123 PolarHBondContact O-N 2.91Å; M121-V144 HydrophobicContact CG-CG2 4.46Å; M121-V144 HydrophobicContact SD-CB 3.94Å; M121-V144 HydrophobicContact SD-CG2 3.28Å; M121-V144 WeakPolarHBondContact SD-CG2 3.15Å; M121-C145 HydrophobicContact CE-CB 3.94Å; M121-C145 HydrophobicContact SD-CB 3.73Å; M121-C145 VanDerWaalsContact SD-SG 3.69Å |
| 122 | D | 85 | Confident | 81.6 | Confident | 147 Ų | 147 | 77.3 Ų | 77.3 | 79% | 0.786 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.2 | -23.1 | -178.3 | -69.5 | -27.9 | 0 | 0 | 0 | 113 | I120 | I120-D122 PolarHBondContact O-N 3.26Å; I120-D122 VanDerWaalsContact O-N 3.09Å |
| 123 | S | 86.3 | Confident | 81.1 | Confident | 65 Ų | 65 | 75.1 Ų | 75.1 | 46% | 0.455 | 41% | 0.409 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.6 | -9.6 | 176.4 | 58.7 | 0 | 0 | 0 | 0 | 113.7 | I120 M121 | I120-S123 CarbonylContact O-C 3.58Å; I120-S123 PolarHBondContact O-N 3.07Å; I120-S123 PolarHBondContact O-OG 2.75Å; M121-S123 VanDerWaalsContact C-N 3.32Å; M121-S123 PolarHBondContact O-N 2.91Å |
| 124 | C | 85.5 | Confident | 80.5 | Confident | 17 Ų | 17 | 72.3 Ų | 72.3 | 12% | 0.115 | 39% | 0.393 | C | S | . | . | trans | -72.8 | 139.9 | -174 | -150.2 | 0 | 0 | 0 | 0 | 112.6 | C99 T100 I120 | C99-C124 HydrophobicContact CB-CB 3.72Å; C99-C124 WeakPolarHBondContact CB-SG 3.4Å; C99-C124 WeakPolarHBondContact SG-CB 3.28Å; C99-C124 CovalentContact SG-SG 2.02Å; C99-C124 PolarHBondContact SG-SG 2.9Å; T100-C124 PolarHBondContact N-SG 3.35Å; T100-C124 VanDerWaalsContact N-SG 3.41Å; T100-C124 PolarHBondContact O-SG 3.08Å; I120-C124 WeakPolarHBondContact O-CB 3.32Å; I120-C124 PolarHBondContact O-N 3.42Å | ||
| 125 | F | 86.1 | Confident | 80.1 | Confident | 131 Ų | 131 | 69.8 Ų | 69.8 | 58% | 0.575 | 39% | 0.391 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 144.6 | 178.6 | -62.3 | -68.8 | 0 | 0 | 0 | 111.9 | T100 P102 L127 | T100-F125 PolarHBondContact N-O 2.99Å; T100-F125 PolarHBondContact O-N 3.5Å; P102-F125 HydrophobicContact CB-CD2 4.22Å; P102-F125 HydrophobicContact CB-CE2 3.8Å; F125-L127 PolarHBondContact O-N 2.99Å |
| 126 | G | 83 | Confident | 79.7 | Confident | 52 Ų | 52 | 63.5 Ų | 63.5 | 54% | 0.536 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 64 | 40.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | K128 | G126-K128 WeakPolarHBondContact O-CG 3.5Å; G126-K128 PolarHBondContact O-N 3.44Å |
| 127 | L | 83.4 | Confident | 79.5 | Confident | 36 Ų | 36 | 60.1 Ų | 60.1 | 19% | 0.188 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -52 | 112.3 | 174.8 | -178.1 | 68.9 | 0 | 0 | 0 | 110.9 | W97 C99 F117 F125 K142 V144 | W97-L127 HydrophobicContact CB-CD1 4.41Å; W97-L127 HydrophobicContact CE3-CD1 3.78Å; W97-L127 HydrophobicContact CE3-CD2 4.22Å; W97-L127 HydrophobicContact CE3-CG 3.75Å; W97-L127 HydrophobicContact CZ3-CD1 4.47Å; W97-L127 HydrophobicContact CZ3-CD2 4.14Å; W97-L127 HydrophobicContact CZ3-CG 3.96Å; C99-L127 HydrophobicContact CB-CD1 4.05Å; F117-L127 HydrophobicContact CE2-CD1 4.22Å; F117-L127 HydrophobicContact CZ-CD1 3.69Å; F125-L127 PolarHBondContact O-N 2.99Å; L127-K142 HydrophobicContact CD2-CB 4.31Å; L127-K142 HydrophobicContact CD2-CD 4.14Å; L127-K142 HydrophobicContact CD2-CG 4.28Å; L127-V144 HydrophobicContact CD2-CG2 4.21Å |
| 128 | K | 81.8 | Confident | 79 | Confident | 145 Ų | 145 | 60.2 Ų | 60.2 | 63% | 0.63 | 35% | 0.35 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -129.1 | 132.3 | 179.7 | -74.3 | 173.4 | -176.2 | 179.4 | 0 | 109.5 | T98 G126 | T98-K128 PolarHBondContact N-O 3.21Å; T98-K128 PolarHBondContact O-N 3.33Å; T98-K128 PolarHBondContact OG1-O 3.34Å; T98-K128 VanDerWaalsContact OG1-O 3.09Å; G126-K128 WeakPolarHBondContact O-CG 3.5Å; G126-K128 PolarHBondContact O-N 3.44Å |
| 129 | G | 75.4 | Confident | 78.6 | Confident | 35 Ų | 35 | 60.5 Ų | 60.5 | 36% | 0.361 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.2 | 140 | 163.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||
| 130 | V | 73.6 | Confident | 78.4 | Confident | 57 Ų | 57 | 58.2 Ų | 58.2 | 35% | 0.345 | 35% | 0.345 | S | S | . | . | trans | -57.2 | 135.6 | 162.9 | 176.4 | 0 | 0 | 0 | 0 | 106.6 | A96 T98 S132 | A96-V130 HydrophobicContact CB-CB 3.89Å; A96-V130 HydrophobicContact CB-CG2 3.58Å; A96-V130 WeakPolarHBondContact O-CB 3.42Å; A96-V130 WeakPolarHBondContact O-CG2 3.27Å; A96-V130 PolarHBondContact O-N 3.21Å; T98-V130 HydrophobicContact CG2-CG2 3.86Å; V130-S132 PolarHBondContact O-N 2.85Å | ||
| 131 | P | 66.1 | Low | 78.3 | Confident | 130 Ų | 130 | 58.7 Ų | 58.7 | 84% | 0.844 | 35% | 0.345 | S | S | * | . | trans | -52.3 | 108.2 | 176.4 | 18.6 | -30.4 | 0 | 0 | 0 | 109.7 | ||||
| 132 | S | 66.3 | Low | 78.2 | Confident | 61 Ų | 61 | 62.9 Ų | 62.9 | 43% | 0.427 | 36% | 0.363 | S | S | . | . | trans | -92 | 164.4 | 175.8 | 54 | 0 | 0 | 0 | 0 | 109.4 | V130 F134 | V130-S132 PolarHBondContact O-N 2.85Å; S132-F134 PolarHBondContact O-N 3.14Å; S132-F134 PolarHBondContact OG-O 3.5Å | ||
| 133 | Q | 66 | Low | 78.1 | Confident | 98 Ų | 98 | 56.1 Ų | 56.1 | 46% | 0.458 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -64.5 | -20.4 | 172.6 | -66.7 | 175.9 | -12.6 | 0 | 0 | 112.7 | Y381 | Q133-Y381 HydrophobicContact CB-CE2 3.73Å; Q133-Y381 HydrophobicContact CG-CE2 4.16Å; Q133-Y381 PolarHBondContact O-OH 3.43Å; Q133-Y381 VanDerWaalsContact O-OH 3.07Å |
| 134 | F | 68.9 | Low | 77.7 | Confident | 19 Ų | 19 | 53.5 Ų | 53.5 | 8% | 0.083 | 31% | 0.308 | C | S | . | . | S | Bend | trans | -140.9 | 126.5 | -174.3 | -173.4 | -100.7 | 0 | 0 | 0 | 111.6 | S132 S136 L256 A260 W262 | S132-F134 PolarHBondContact O-N 3.14Å; S132-F134 PolarHBondContact OG-O 3.5Å; F134-S136 PolarHBondContact O-N 3.4Å; F134-L256 HydrophobicContact CD2-CD2 4.13Å; F134-L256 HydrophobicContact CE2-CD2 3.54Å; F134-L256 HydrophobicContact CZ-CD2 3.79Å; F134-A260 CarbonylContact C-O 3.54Å; F134-A260 WeakPolarHBondContact CA-O 3.45Å; F134-W262 HydrophobicContact CE1-CB 3.8Å; F134-W262 VanDerWaalsContact CZ-CA 3.46Å; F134-W262 HydrophobicContact CZ-CB 3.84Å |
| 135 | A | 71.8 | Confident | 77.6 | Confident | 46 Ų | 46 | 54.1 Ų | 54.1 | 38% | 0.38 | 31% | 0.312 | S | S | . | . | B | Isolated β-bridge | trans | -75.2 | 98.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | A260 E261 W262 | A135-A260 PolarHBondContact N-O 3.43Å; A135-E261 HydrophobicContact CB-CB 4.38Å; A135-E261 HydrophobicContact CB-CG 4.14Å; A135-W262 PolarHBondContact O-N 2.94Å |
| 136 | S | 77.3 | Confident | 77.4 | Confident | 13 Ų | 13 | 54.3 Ų | 54.3 | 9% | 0.091 | 32% | 0.319 | C | S | . | . | trans | -85.5 | 161.6 | -175.7 | 56.8 | 0 | 0 | 0 | 0 | 112.9 | F134 T138 A139 E140 | F134-S136 PolarHBondContact O-N 3.4Å; S136-T138 PolarHBondContact O-N 2.84Å; S136-T138 VanDerWaalsContact O-N 3.14Å; S136-T138 PolarHBondContact OG-OG1 3.23Å; S136-A139 WeakPolarHBondContact O-CB 3.22Å; S136-A139 PolarHBondContact O-N 3.43Å; S136-A139 PolarHBondContact OG-N 3.4Å; S136-E140 PolarHBondContact O-N 2.67Å | ||
| 137 | L | 81.1 | Confident | 77.4 | Confident | 1 Ų | 1 | 58.4 Ų | 58.4 | 1% | 0.005 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -55.1 | -28 | 168.2 | 65.5 | 90.7 | 0 | 0 | 0 | 112.7 | L88 A139 E140 W141 L143 I151 L154 F205 W262 | L88-L137 HydrophobicContact CD2-CD2 4.28Å; L137-A139 VanDerWaalsContact C-N 3.35Å; L137-E140 PolarHBondContact O-N 3.4Å; L137-W141 HydrophobicContact CB-CE3 4.41Å; L137-W141 HydrophobicContact CB-CZ3 4.28Å; L137-W141 PolarHBondContact O-N 3.34Å; L137-W141 VanDerWaalsContact O-N 3.09Å; L137-L143 HydrophobicContact CD1-CD1 3.84Å; L137-I151 HydrophobicContact CD1-CG1 4.3Å; L137-L154 HydrophobicContact CD1-CD1 4.13Å; L137-F205 HydrophobicContact CD2-CE1 4.48Å; L137-W262 HydrophobicContact CB-CD2 4.34Å; L137-W262 HydrophobicContact CB-CG 4.43Å |
| 138 | T | 76.5 | Confident | 77.1 | Confident | 3 Ų | 3 | 59.1 Ų | 59.1 | 2% | 0.018 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -70.1 | -33.8 | 176.9 | 59.4 | 0 | 0 | 0 | 0 | 111.9 | G91 W97 S136 K142 L143 I151 | G91-T138 WeakPolarHBondContact O-CG2 3.17Å; W97-T138 WeakPolarHBondContact CZ2-O 3.27Å; S136-T138 PolarHBondContact O-N 2.84Å; S136-T138 VanDerWaalsContact O-N 3.14Å; S136-T138 PolarHBondContact OG-OG1 3.23Å; T138-K142 VanDerWaalsContact O-CA 3.27Å; T138-K142 WeakPolarHBondContact O-CA 3.41Å; T138-K142 PolarHBondContact O-N 2.93Å; T138-L143 HydrophobicContact CG2-CB 4.34Å; T138-L143 PolarHBondContact O-N 2.76Å; T138-I151 HydrophobicContact CG2-CD1 3.26Å; T138-I151 HydrophobicContact CG2-CG1 3.71Å |
| 139 | A | 77.7 | Confident | 77.1 | Confident | 41 Ų | 41 | 55.9 Ų | 55.9 | 34% | 0.339 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -68 | -42 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S136 L137 | S136-A139 WeakPolarHBondContact O-CB 3.22Å; S136-A139 PolarHBondContact O-N 3.43Å; S136-A139 PolarHBondContact OG-N 3.4Å; L137-A139 VanDerWaalsContact C-N 3.35Å |
| 140 | E | 82.3 | Confident | 77.7 | Confident | 84 Ų | 84 | 55.7 Ų | 55.7 | 39% | 0.393 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -69.1 | -49.6 | -178.1 | -171.5 | 172.2 | 166.7 | 0 | 0 | 112.7 | S136 L137 W262 R263 | S136-E140 PolarHBondContact O-N 2.67Å; L137-E140 PolarHBondContact O-N 3.4Å; E140-W262 VanDerWaalsContact OE2-CE2 3.23Å; E140-W262 VanDerWaalsContact OE2-CZ2 3.23Å; E140-W262 WeakPolarHBondContact OE2-CZ2 3.21Å; E140-W262 PolarHBondContact OE2-NE1 3Å; E140-R263 IonicContact OE1-CZ 3.27Å; E140-R263 IonicContact OE1-NE 2.88Å; E140-R263 PolarHBondContact OE1-NE 3.26Å; E140-R263 IonicContact OE1-NH2 3.84Å; E140-R263 PolarHBondContact OE1-NH2 2.65Å; E140-R263 IonicContact OE2-CZ 3.94Å; E140-R263 IonicContact OE2-NE 3.15Å; E140-R263 PolarHBondContact OE2-NE 2.91Å; E140-R263 VanDerWaalsContact OE2-NE 3.15Å; E140-R263 IonicContact OE2-NH2 2.62Å; E140-R263 PolarHBondContact OE2-NH2 3.47Å |
| 141 | W | 85 | Confident | 78.1 | Confident | 30 Ų | 30 | 53 Ų | 53 | 11% | 0.114 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | 9.2 | -178 | -61.3 | -35.2 | 0 | 0 | 0 | 114.4 | L137 L143 L154 T200 W202 F205 W262 | L137-W141 HydrophobicContact CB-CE3 4.41Å; L137-W141 HydrophobicContact CB-CZ3 4.28Å; L137-W141 PolarHBondContact O-N 3.34Å; L137-W141 VanDerWaalsContact O-N 3.09Å; W141-L143 VanDerWaalsContact C-N 3.29Å; W141-L143 HydrophobicContact CB-CD1 4.47Å; W141-L143 HydrophobicContact CB-CD2 4.02Å; W141-L143 HydrophobicContact CB-CG 3.93Å; W141-L143 HydrophobicContact CE3-CD1 4.31Å; W141-L143 PolarHBondContact O-N 3.06Å; W141-L154 HydrophobicContact CZ3-CD1 4.27Å; W141-T200 PolarHBondContact NE1-O 2.99Å; W141-W202 HydrophobicContact CD2-CB 3.83Å; W141-W202 HydrophobicContact CE3-CB 3.5Å; W141-W202 HydrophobicContact CG-CB 4.43Å; W141-W202 HydrophobicContact CH2-CB 4.43Å; W141-W202 HydrophobicContact CZ3-CB 3.84Å; W141-F205 HydrophobicContact CH2-CB 3.38Å; W141-F205 AromaticContact CH2-CD1 3.67Å; W141-F205 HydrophobicContact CH2-CD1 3.67Å; W141-F205 AromaticContact CH2-CD2 3.99Å; W141-F205 HydrophobicContact CH2-CD2 3.99Å; W141-F205 HydrophobicContact CH2-CE1 4.4Å; W141-F205 AromaticContact CH2-CG 3.43Å; W141-F205 HydrophobicContact CH2-CG 3.43Å; W141-F205 VanDerWaalsContact CH2-CG 3.43Å; W141-F205 HydrophobicContact CZ2-CB 4.18Å; W141-F205 HydrophobicContact CZ3-CB 4.04Å; W141-F205 AromaticContact CZ3-CD1 3.71Å; W141-F205 HydrophobicContact CZ3-CD1 3.71Å; W141-F205 HydrophobicContact CZ3-CE1 4.34Å; W141-F205 AromaticContact CZ3-CG 3.98Å; W141-F205 HydrophobicContact CZ3-CG 3.98Å; W141-W262 HydrophobicContact CH2-CH2 4.38Å; W141-W262 HydrophobicContact CH2-CZ2 4.47Å; W141-W262 HydrophobicContact CZ2-CZ2 4.38Å |
| 142 | K | 82.8 | Confident | 79 | Confident | 110 Ų | 110 | 47.9 Ų | 47.9 | 48% | 0.478 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 49.2 | 49.6 | 179.4 | -60.4 | 171.5 | 175.7 | -178.1 | 0 | 111.9 | W97 L127 T138 V144 | W97-K142 HydrophobicContact CH2-CG 4.31Å; W97-K142 HydrophobicContact CZ3-CG 4.4Å; L127-K142 HydrophobicContact CD2-CB 4.31Å; L127-K142 HydrophobicContact CD2-CD 4.14Å; L127-K142 HydrophobicContact CD2-CG 4.28Å; T138-K142 VanDerWaalsContact O-CA 3.27Å; T138-K142 WeakPolarHBondContact O-CA 3.41Å; T138-K142 PolarHBondContact O-N 2.93Å; K142-V144 WeakPolarHBondContact O-CG2 3.13Å; K142-V144 PolarHBondContact O-N 3.2Å |
| 143 | L | 82.7 | Confident | 80.1 | Confident | 5 Ų | 5 | 47.4 Ų | 47.4 | 3% | 0.026 | 25% | 0.245 | C | C | . | . | trans | -81.1 | 65.8 | -177.6 | -58.7 | -176.5 | 0 | 0 | 0 | 111.3 | L137 T138 W141 R147 L150 I151 | L137-L143 HydrophobicContact CD1-CD1 3.84Å; T138-L143 HydrophobicContact CG2-CB 4.34Å; T138-L143 PolarHBondContact O-N 2.76Å; W141-L143 VanDerWaalsContact C-N 3.29Å; W141-L143 HydrophobicContact CB-CD1 4.47Å; W141-L143 HydrophobicContact CB-CD2 4.02Å; W141-L143 HydrophobicContact CB-CG 3.93Å; W141-L143 HydrophobicContact CE3-CD1 4.31Å; W141-L143 PolarHBondContact O-N 3.06Å; L143-R147 HydrophobicContact CD2-CB 4.24Å; L143-L150 HydrophobicContact CD1-CB 4.46Å; L143-L150 HydrophobicContact CD2-CB 4.22Å; L143-L150 HydrophobicContact CD2-CD1 3.83Å; L143-I151 HydrophobicContact CB-CD1 4.18Å; L143-I151 HydrophobicContact CB-CG1 4.14Å; L143-I151 HydrophobicContact CD1-CG1 3.73Å | ||
| 144 | V | 79.5 | Confident | 81.3 | Confident | 10 Ų | 10 | 42.8 Ų | 42.8 | 6% | 0.061 | 22% | 0.224 | C | C | . | . | trans | -110.6 | 157.9 | -178 | -80 | 0 | 0 | 0 | 0 | 112.1 | W97 M121 L127 K142 N146 R147 | W97-V144 HydrophobicContact CD2-CG1 3.55Å; W97-V144 HydrophobicContact CE3-CG1 4.34Å; W97-V144 HydrophobicContact CG-CG1 3.62Å; W97-V144 HydrophobicContact CZ2-CG1 3.8Å; M121-V144 HydrophobicContact CG-CG2 4.46Å; M121-V144 HydrophobicContact SD-CB 3.94Å; M121-V144 HydrophobicContact SD-CG2 3.28Å; M121-V144 WeakPolarHBondContact SD-CG2 3.15Å; L127-V144 HydrophobicContact CD2-CG2 4.21Å; K142-V144 WeakPolarHBondContact O-CG2 3.13Å; K142-V144 PolarHBondContact O-N 3.2Å; V144-N146 PolarHBondContact O-N 3.48Å; V144-R147 WeakPolarHBondContact O-CB 3.25Å; V144-R147 PolarHBondContact O-N 3.13Å | ||
| 145 | C | 82.2 | Confident | 82.3 | Confident | 30 Ų | 30 | 42 Ų | 42 | 20% | 0.203 | 22% | 0.221 | C | C | . | . | G | 310 helix | trans | 51.3 | -119.3 | 176.8 | -61.2 | 0 | 0 | 0 | 0 | 112.4 | C118 M121 R147 K148 | C118-C145 WeakPolarHBondContact CA-SG 3.39Å; C118-C145 HydrophobicContact CB-CB 3.63Å; C118-C145 WeakPolarHBondContact CB-SG 3.43Å; C118-C145 WeakPolarHBondContact SG-CB 3.16Å; C118-C145 CovalentContact SG-SG 2.04Å; C118-C145 PolarHBondContact SG-SG 2.96Å; M121-C145 HydrophobicContact CE-CB 3.94Å; M121-C145 HydrophobicContact SD-CB 3.73Å; M121-C145 VanDerWaalsContact SD-SG 3.69Å; C145-R147 PolarHBondContact O-N 2.61Å; C145-R147 VanDerWaalsContact O-N 3.09Å; C145-K148 VanDerWaalsContact O-CB 3.23Å; C145-K148 WeakPolarHBondContact O-CB 3.49Å; C145-K148 PolarHBondContact O-N 3.09Å |
| 146 | N | 81.4 | Confident | 83.3 | Confident | 135 Ų | 135 | 42.1 Ų | 42.1 | 72% | 0.722 | 21% | 0.214 | S | C | * | . | G | 310 helix | trans | -59 | -23.3 | 179.7 | -65.8 | -27.2 | 0 | 0 | 0 | 113.4 | V144 | V144-N146 PolarHBondContact O-N 3.48Š|
| 147 | R | 83.2 | Confident | 84.1 | Confident | 137 Ų | 137 | 43 Ų | 43 | 52% | 0.517 | 22% | 0.22 | S | C | . | . | G | 310 helix | trans | -86.9 | -7.1 | 177.3 | -64.2 | -173.1 | 179 | -163.6 | 0.4 | 113.8 | L143 V144 C145 V149 L150 | L143-R147 HydrophobicContact CD2-CB 4.24Å; V144-R147 WeakPolarHBondContact O-CB 3.25Å; V144-R147 PolarHBondContact O-N 3.13Å; C145-R147 PolarHBondContact O-N 2.61Å; C145-R147 VanDerWaalsContact O-N 3.09Å; R147-V149 PolarHBondContact O-N 2.93Å; R147-L150 HydrophobicContact CB-CD1 4.16Å; R147-L150 HydrophobicContact CG-CD1 4.39Å; R147-L150 VanDerWaalsContact O-CB 3.25Å; R147-L150 WeakPolarHBondContact O-CB 3.28Å; R147-L150 WeakPolarHBondContact O-CG 3.27Å; R147-L150 PolarHBondContact O-N 3.31Å |
| 148 | K | 77.2 | Confident | 84.7 | Confident | 52 Ų | 52 | 43 Ų | 43 | 23% | 0.226 | 22% | 0.22 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.2 | -34.5 | 178.6 | -169.8 | 179.9 | -177.9 | -178.2 | 0 | 111.8 | M92 E94 C145 L150 I151 | M92-K148 VanDerWaalsContact O-CE 3.23Å; M92-K148 WeakPolarHBondContact O-CE 3.14Å; M92-K148 PolarHBondContact O-NZ 3.37Å; E94-K148 IonicContact OE2-NZ 2.7Å; E94-K148 PolarHBondContact OE2-NZ 3.29Å; C145-K148 VanDerWaalsContact O-CB 3.23Å; C145-K148 WeakPolarHBondContact O-CB 3.49Å; C145-K148 PolarHBondContact O-N 3.09Å; K148-L150 PolarHBondContact O-N 2.81Å; K148-L150 VanDerWaalsContact O-N 3.08Å; K148-I151 HydrophobicContact CG-CD1 4.05Å; K148-I151 WeakPolarHBondContact O-CB 3.39Å; K148-I151 PolarHBondContact O-N 3.5Å |
| 149 | V | 82.3 | Confident | 85.6 | Confident | 77 Ų | 77 | 43 Ų | 43 | 47% | 0.467 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -56.6 | -26 | 176.2 | 74.1 | 0 | 0 | 0 | 0 | 112.6 | R147 I151 F152 V153 | R147-V149 PolarHBondContact O-N 2.93Å; V149-I151 PolarHBondContact O-N 2.98Å; V149-F152 WeakPolarHBondContact O-CB 3.31Å; V149-F152 PolarHBondContact O-N 3.28Å; V149-F152 VanDerWaalsContact O-N 3.13Å; V149-V153 WeakPolarHBondContact O-CG2 3.47Å; V149-V153 PolarHBondContact O-N 3.5Å |
| 150 | L | 87.2 | Confident | 86.5 | Confident | 30 Ų | 30 | 43.7 Ų | 43.7 | 16% | 0.157 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.3 | -27.7 | 179.2 | -62.4 | 177.1 | 0 | 0 | 0 | 112.5 | L143 R147 K148 F152 V153 L154 W202 | L143-L150 HydrophobicContact CD1-CB 4.46Å; L143-L150 HydrophobicContact CD2-CB 4.22Å; L143-L150 HydrophobicContact CD2-CD1 3.83Å; R147-L150 HydrophobicContact CB-CD1 4.16Å; R147-L150 HydrophobicContact CG-CD1 4.39Å; R147-L150 VanDerWaalsContact O-CB 3.25Å; R147-L150 WeakPolarHBondContact O-CB 3.28Å; R147-L150 WeakPolarHBondContact O-CG 3.27Å; R147-L150 PolarHBondContact O-N 3.31Å; K148-L150 PolarHBondContact O-N 2.81Å; K148-L150 VanDerWaalsContact O-N 3.08Å; L150-F152 VanDerWaalsContact C-N 3.35Å; L150-V153 WeakPolarHBondContact O-CB 3.23Å; L150-V153 PolarHBondContact O-N 3.26Å; L150-L154 WeakPolarHBondContact O-CG 3.31Å; L150-L154 PolarHBondContact O-N 3.15Å; L150-W202 HydrophobicContact CD1-CD2 4.3Å; L150-W202 HydrophobicContact CD1-CZ2 4.16Å; L150-W202 HydrophobicContact CD2-CE3 4.49Å; L150-W202 HydrophobicContact CD2-CH2 3.71Å; L150-W202 HydrophobicContact CD2-CZ2 3.94Å; L150-W202 HydrophobicContact CD2-CZ3 4.01Å |
| 151 | I | 83.4 | Confident | 87.2 | Confident | 2 Ų | 2 | 39.7 Ų | 39.7 | 1% | 0.01 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.2 | -41.7 | 175.3 | -55.9 | 151.8 | 0 | 0 | 0 | 110 | G91 M92 L137 T138 L143 K148 V149 V153 L154 L155 | G91-I151 WeakPolarHBondContact O-CD1 3.5Å; M92-I151 HydrophobicContact CG-CB 4.3Å; M92-I151 HydrophobicContact CG-CG2 3.63Å; L137-I151 HydrophobicContact CD1-CG1 4.3Å; T138-I151 HydrophobicContact CG2-CD1 3.26Å; T138-I151 HydrophobicContact CG2-CG1 3.71Å; L143-I151 HydrophobicContact CB-CD1 4.18Å; L143-I151 HydrophobicContact CB-CG1 4.14Å; L143-I151 HydrophobicContact CD1-CG1 3.73Å; K148-I151 HydrophobicContact CG-CD1 4.05Å; K148-I151 WeakPolarHBondContact O-CB 3.39Å; K148-I151 PolarHBondContact O-N 3.5Å; V149-I151 PolarHBondContact O-N 2.98Å; I151-V153 VanDerWaalsContact C-N 3.3Å; I151-V153 PolarHBondContact O-N 3.25Å; I151-L154 WeakPolarHBondContact O-CB 3.45Å; I151-L154 PolarHBondContact O-N 3.17Å; I151-L155 PolarHBondContact O-N 2.95Å |
| 152 | F | 84.1 | Confident | 87.7 | Confident | 21 Ų | 21 | 39 Ų | 39 | 9% | 0.092 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63.6 | -39 | 173.8 | -172.5 | -117.1 | 0 | 0 | 0 | 111.2 | M92 V149 L150 L154 L155 I156 S496 | M92-F152 HydrophobicContact SD-CB 4.39Å; M92-F152 HydrophobicContact SD-CD2 3.81Å; V149-F152 WeakPolarHBondContact O-CB 3.31Å; V149-F152 PolarHBondContact O-N 3.28Å; V149-F152 VanDerWaalsContact O-N 3.13Å; L150-F152 VanDerWaalsContact C-N 3.35Å; F152-L154 PolarHBondContact O-N 3.4Å; F152-L155 HydrophobicContact CD2-CD2 4.44Å; F152-L155 WeakPolarHBondContact O-CB 3.25Å; F152-L155 PolarHBondContact O-N 3.14Å; F152-I156 HydrophobicContact CD1-CD1 3.6Å; F152-I156 HydrophobicContact CD1-CG1 4.38Å; F152-I156 HydrophobicContact CE1-CD1 3.31Å; F152-I156 HydrophobicContact CE1-CG1 4.11Å; F152-I156 HydrophobicContact CG-CD1 4.37Å; F152-I156 HydrophobicContact CZ-CD1 3.83Å; F152-I156 HydrophobicContact CZ-CG1 4.17Å; F152-I156 WeakPolarHBondContact O-CG1 3.37Å; F152-I156 PolarHBondContact O-N 2.6Å; F152-S496 WeakPolarHBondContact CE1-OG 3.24Å; F152-S496 WeakPolarHBondContact CZ-OG 3.39Å |
| 153 | V | 89.3 | Confident | 88.4 | Confident | 52 Ų | 52 | 35 Ų | 35 | 32% | 0.315 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -59.5 | -43.9 | 171.8 | 174 | 0 | 0 | 0 | 0 | 111.5 | V149 L150 I151 L155 I156 C157 | V149-V153 WeakPolarHBondContact O-CG2 3.47Å; V149-V153 PolarHBondContact O-N 3.5Å; L150-V153 WeakPolarHBondContact O-CB 3.23Å; L150-V153 PolarHBondContact O-N 3.26Å; I151-V153 VanDerWaalsContact C-N 3.3Å; I151-V153 PolarHBondContact O-N 3.25Å; V153-L155 VanDerWaalsContact C-N 3.34Å; V153-L155 PolarHBondContact O-N 2.81Å; V153-I156 PolarHBondContact O-N 3.38Å; V153-C157 PolarHBondContact O-N 2.98Å; V153-C157 PolarHBondContact O-SG 3.48Å |
| 154 | L | 91.7 | Very high | 89.1 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.8 | -42.6 | 176.2 | -68.1 | 173.8 | 0 | 0 | 0 | 112 | L88 L137 W141 L150 I151 F152 C157 F158 F205 A206 | L88-L154 HydrophobicContact CD2-CB 3.57Å; L88-L154 HydrophobicContact CD2-CD1 4.21Å; L88-L154 HydrophobicContact CD2-CG 4.48Å; L137-L154 HydrophobicContact CD1-CD1 4.13Å; W141-L154 HydrophobicContact CZ3-CD1 4.27Å; L150-L154 WeakPolarHBondContact O-CG 3.31Å; L150-L154 PolarHBondContact O-N 3.15Å; I151-L154 WeakPolarHBondContact O-CB 3.45Å; I151-L154 PolarHBondContact O-N 3.17Å; F152-L154 PolarHBondContact O-N 3.4Å; L154-C157 PolarHBondContact O-N 3.05Å; L154-F158 PolarHBondContact O-N 2.95Å; L154-F205 HydrophobicContact CD1-CD1 3.91Å; L154-F205 HydrophobicContact CD1-CE1 4.12Å; L154-F205 HydrophobicContact CD2-CD1 3.76Å; L154-F205 HydrophobicContact CD2-CE1 4.48Å; L154-F205 HydrophobicContact CG-CD1 4.42Å; L154-A206 HydrophobicContact CD2-CB 3.5Å; L154-A206 VanDerWaalsContact CD2-CB 3.5Å |
| 155 | L | 89.5 | Confident | 89.9 | Confident | 4 Ų | 4 | 37.1 Ų | 37.1 | 2% | 0.021 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.3 | -45.4 | 174.3 | 179 | 63.5 | 0 | 0 | 0 | 111.6 | Y85 L88 F89 M92 I151 F152 V153 F158 L159 | Y85-L155 HydrophobicContact CD2-CD1 3.89Å; Y85-L155 HydrophobicContact CE2-CD1 3.72Å; L88-L155 HydrophobicContact CB-CB 4.32Å; L88-L155 HydrophobicContact CB-CD1 4.09Å; F89-L155 HydrophobicContact CD2-CD2 4.16Å; M92-L155 HydrophobicContact CE-CD2 3.49Å; M92-L155 VanDerWaalsContact CE-CD2 3.49Å; M92-L155 HydrophobicContact SD-CD2 4.25Å; I151-L155 PolarHBondContact O-N 2.95Å; F152-L155 HydrophobicContact CD2-CD2 4.44Å; F152-L155 WeakPolarHBondContact O-CB 3.25Å; F152-L155 PolarHBondContact O-N 3.14Å; V153-L155 VanDerWaalsContact C-N 3.34Å; V153-L155 PolarHBondContact O-N 2.81Å; L155-F158 PolarHBondContact O-N 3.02Å; L155-L159 HydrophobicContact CD1-CD1 4.15Å; L155-L159 HydrophobicContact CD1-CG 4.19Å; L155-L159 HydrophobicContact CG-CD1 4.02Å; L155-L159 HydrophobicContact CG-CG 4.41Å; L155-L159 WeakPolarHBondContact O-CB 3.42Å; L155-L159 WeakPolarHBondContact O-CG 3.22Å; L155-L159 PolarHBondContact O-N 2.74Å |
| 156 | I | 92.1 | Very high | 90.5 | Very high | 47 Ų | 47 | 35.7 Ų | 35.7 | 24% | 0.241 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.5 | -46.5 | 176 | -71 | 170.7 | 0 | 0 | 0 | 110.4 | F152 V153 F158 L159 V160 I492 | F152-I156 HydrophobicContact CD1-CD1 3.6Å; F152-I156 HydrophobicContact CD1-CG1 4.38Å; F152-I156 HydrophobicContact CE1-CD1 3.31Å; F152-I156 HydrophobicContact CE1-CG1 4.11Å; F152-I156 HydrophobicContact CG-CD1 4.37Å; F152-I156 HydrophobicContact CZ-CD1 3.83Å; F152-I156 HydrophobicContact CZ-CG1 4.17Å; F152-I156 WeakPolarHBondContact O-CG1 3.37Å; F152-I156 PolarHBondContact O-N 2.6Å; V153-I156 PolarHBondContact O-N 3.38Å; I156-F158 VanDerWaalsContact C-N 3.28Å; I156-F158 PolarHBondContact O-N 3.17Å; I156-L159 PolarHBondContact O-N 2.72Å; I156-V160 HydrophobicContact CG2-CG2 3.79Å; I156-V160 WeakPolarHBondContact O-CB 3.23Å; I156-V160 VanDerWaalsContact O-CG2 3.24Å; I156-V160 WeakPolarHBondContact O-CG2 3.38Å; I156-V160 PolarHBondContact O-N 3.46Å; I156-I492 HydrophobicContact CG1-CG2 4.22Å |
| 157 | C | 94.9 | Very high | 91.2 | Very high | 33 Ų | 33 | 31.9 Ų | 31.9 | 22% | 0.223 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -55 | -46.9 | 177.7 | -72.7 | 0 | 0 | 0 | 0 | 111.1 | V153 L154 G161 F210 | V153-C157 PolarHBondContact O-N 2.98Å; V153-C157 PolarHBondContact O-SG 3.48Å; L154-C157 PolarHBondContact O-N 3.05Å; C157-G161 PolarHBondContact O-N 3.49Å; C157-F210 HydrophobicContact CB-CB 4.37Å; C157-F210 VanDerWaalsContact O-CA 3.32Å; C157-F210 WeakPolarHBondContact O-CA 3.31Å; C157-F210 WeakPolarHBondContact O-CD2 3.28Å |
| 158 | F | 94.2 | Very high | 91.7 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.1 | -47 | 176.2 | 178.7 | -96.2 | 0 | 0 | 0 | 112.7 | N84 Y85 L88 L154 L155 I156 G161 R162 Q209 T212 G213 F216 | N84-F158 HydrophobicContact CB-CD2 4.32Å; N84-F158 HydrophobicContact CB-CE2 3.74Å; N84-F158 HydrophobicContact CB-CZ 4.26Å; Y85-F158 HydrophobicContact CD2-CD1 4.02Å; Y85-F158 AromaticContact CD2-CE1 3.76Å; Y85-F158 HydrophobicContact CD2-CE1 3.76Å; Y85-F158 HydrophobicContact CG-CE1 4.13Å; L88-F158 HydrophobicContact CD1-CB 3.54Å; L88-F158 HydrophobicContact CD1-CD2 4.39Å; L88-F158 HydrophobicContact CD1-CG 3.95Å; L154-F158 PolarHBondContact O-N 2.95Å; L155-F158 PolarHBondContact O-N 3.02Å; I156-F158 VanDerWaalsContact C-N 3.28Å; I156-F158 PolarHBondContact O-N 3.17Å; F158-G161 WeakPolarHBondContact O-CA 3.18Å; F158-G161 PolarHBondContact O-N 3.5Å; F158-R162 HydrophobicContact CD1-CG 4.39Å; F158-R162 HydrophobicContact CE1-CG 4.04Å; F158-R162 HydrophobicContact CZ-CG 4.27Å; F158-R162 PolarHBondContact O-N 3.4Å; F158-Q209 HydrophobicContact CB-CB 4.32Å; F158-Q209 WeakPolarHBondContact CD2-O 3.25Å; F158-T212 HydrophobicContact CE2-CG2 4.24Å; F158-G213 WeakPolarHBondContact O-CA 3.12Å; F158-F216 HydrophobicContact CE1-CD1 4.43Å; F158-F216 AromaticContact CZ-CD1 3.85Å; F158-F216 HydrophobicContact CZ-CD1 3.85Å |
| 159 | L | 94.2 | Very high | 92.3 | Very high | 2 Ų | 2 | 27.6 Ų | 27.6 | 1% | 0.01 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -67.8 | -41.5 | -179.1 | -71.2 | 179.3 | 0 | 0 | 0 | 112.9 | Y85 L155 I156 G161 R162 I163 D488 T491 I492 | Y85-L159 HydrophobicContact CD2-CD2 4.07Å; Y85-L159 HydrophobicContact CE2-CD1 4.49Å; Y85-L159 HydrophobicContact CE2-CD2 3.75Å; Y85-L159 HydrophobicContact CE2-CG 4.39Å; L155-L159 HydrophobicContact CD1-CD1 4.15Å; L155-L159 HydrophobicContact CD1-CG 4.19Å; L155-L159 HydrophobicContact CG-CD1 4.02Å; L155-L159 HydrophobicContact CG-CG 4.41Å; L155-L159 WeakPolarHBondContact O-CB 3.42Å; L155-L159 WeakPolarHBondContact O-CG 3.22Å; L155-L159 PolarHBondContact O-N 2.74Å; I156-L159 PolarHBondContact O-N 2.72Å; L159-G161 VanDerWaalsContact C-N 3.27Å; L159-G161 PolarHBondContact O-N 2.92Å; L159-R162 WeakPolarHBondContact O-CB 3.45Å; L159-R162 PolarHBondContact O-N 3.43Å; L159-R162 VanDerWaalsContact O-N 3.12Å; L159-I163 VanDerWaalsContact O-CG1 3.31Å; L159-I163 WeakPolarHBondContact O-CG1 3.25Å; L159-I163 PolarHBondContact O-N 3.45Å; L159-D488 HydrophobicContact CD2-CB 4.24Å; L159-T491 HydrophobicContact CD1-CG2 4.13Å; L159-I492 HydrophobicContact CB-CD1 3.72Å; L159-I492 HydrophobicContact CB-CG1 3.83Å; L159-I492 HydrophobicContact CD1-CG1 3.72Å; L159-I492 HydrophobicContact CG-CG1 4.44Å |
| 160 | V | 96.9 | Very high | 92.8 | Very high | 57 Ų | 57 | 24 Ų | 24 | 35% | 0.345 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -62.4 | -40.3 | 173 | 177.9 | 0 | 0 | 0 | 0 | 110 | I156 R162 I163 V164 F210 I492 | I156-V160 HydrophobicContact CG2-CG2 3.79Å; I156-V160 WeakPolarHBondContact O-CB 3.23Å; I156-V160 VanDerWaalsContact O-CG2 3.24Å; I156-V160 WeakPolarHBondContact O-CG2 3.38Å; I156-V160 PolarHBondContact O-N 3.46Å; V160-R162 PolarHBondContact O-N 3.26Å; V160-I163 PolarHBondContact O-N 3.48Å; V160-V164 WeakPolarHBondContact O-CG2 3.42Å; V160-V164 PolarHBondContact O-N 3.35Å; V160-F210 HydrophobicContact CG1-CD2 4.49Å; V160-F210 HydrophobicContact CG1-CE2 4.04Å; V160-I492 HydrophobicContact CG2-CD1 3.88Å |
| 161 | G | 97.3 | Very high | 93 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -51.8 | -55 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | C157 F158 L159 I163 V164 G165 F210 G213 A214 | C157-G161 PolarHBondContact O-N 3.49Å; F158-G161 WeakPolarHBondContact O-CA 3.18Å; F158-G161 PolarHBondContact O-N 3.5Å; L159-G161 VanDerWaalsContact C-N 3.27Å; L159-G161 PolarHBondContact O-N 2.92Å; G161-I163 VanDerWaalsContact C-N 3.33Å; G161-I163 PolarHBondContact O-N 3.24Å; G161-V164 PolarHBondContact O-N 2.83Å; G161-G165 PolarHBondContact O-N 3.04Å; G161-F210 VanDerWaalsContact CA-O 3.28Å; G161-F210 WeakPolarHBondContact CA-O 3.43Å; G161-G213 VanDerWaalsContact C-C 3.42Å; G161-A214 WeakPolarHBondContact O-CA 3.42Å; G161-A214 WeakPolarHBondContact O-CB 3.32Å; G161-A214 PolarHBondContact O-N 3.09Å |
| 162 | R | 96 | Very high | 93.3 | Very high | 16 Ų | 16 | 27 Ų | 27 | 6% | 0.06 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -57.8 | -41.3 | 178.7 | -72.3 | -179.2 | 72.5 | -148.1 | -3 | 113.4 | F158 L159 V160 G165 A166 G213 F216 D488 | F158-R162 HydrophobicContact CD1-CG 4.39Å; F158-R162 HydrophobicContact CE1-CG 4.04Å; F158-R162 HydrophobicContact CZ-CG 4.27Å; F158-R162 PolarHBondContact O-N 3.4Å; L159-R162 WeakPolarHBondContact O-CB 3.45Å; L159-R162 PolarHBondContact O-N 3.43Å; L159-R162 VanDerWaalsContact O-N 3.12Å; V160-R162 PolarHBondContact O-N 3.26Å; R162-G165 PolarHBondContact O-N 2.89Å; R162-A166 WeakPolarHBondContact O-CB 3.46Å; R162-A166 PolarHBondContact O-N 2.97Å; R162-G213 WeakPolarHBondContact CA-O 3.16Å; R162-G213 WeakPolarHBondContact CG-O 3.31Å; R162-G213 VanDerWaalsContact N-C 3.31Å; R162-G213 PolarHBondContact N-O 3.1Å; R162-F216 VanDerWaalsContact CD-CD1 3.48Å; R162-F216 HydrophobicContact CG-CB 4.41Å; R162-F216 HydrophobicContact CG-CD1 3.96Å; R162-F216 VanDerWaalsContact CZ-CE1 3.46Å; R162-D488 VanDerWaalsContact CB-OD2 3.24Å; R162-D488 WeakPolarHBondContact CB-OD2 3.37Å; R162-D488 IonicContact CZ-OD1 2.65Å; R162-D488 IonicContact CZ-OD2 2.83Å; R162-D488 IonicContact NE-OD2 2.81Å; R162-D488 PolarHBondContact NE-OD2 2.9Å; R162-D488 IonicContact NH1-OD1 3.31Å; R162-D488 PolarHBondContact NH1-OD1 3.15Å; R162-D488 IonicContact NH1-OD2 3.12Å; R162-D488 PolarHBondContact NH1-OD2 3.23Å; R162-D488 IonicContact NH2-OD1 3.44Å; R162-D488 IonicContact NH2-OD2 3.15Å |
| 163 | I | 97.2 | Very high | 93.4 | Very high | 26 Ų | 26 | 26 Ų | 26 | 13% | 0.133 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -57.9 | -51.2 | 175.9 | -70.5 | 168.3 | 0 | 0 | 0 | 110.6 | L159 V160 G161 A166 I167 S485 D488 L489 I492 | L159-I163 VanDerWaalsContact O-CG1 3.31Å; L159-I163 WeakPolarHBondContact O-CG1 3.25Å; L159-I163 PolarHBondContact O-N 3.45Å; V160-I163 PolarHBondContact O-N 3.48Å; G161-I163 VanDerWaalsContact C-N 3.33Å; G161-I163 PolarHBondContact O-N 3.24Å; I163-A166 PolarHBondContact O-N 2.97Å; I163-I167 HydrophobicContact CG2-CD1 4.17Å; I163-I167 WeakPolarHBondContact O-CG1 3.19Å; I163-I167 PolarHBondContact O-N 3.33Å; I163-I167 VanDerWaalsContact O-N 3.14Å; I163-S485 PolarHBondContact O-OG 3.44Å; I163-D488 HydrophobicContact CD1-CB 4.12Å; I163-D488 HydrophobicContact CG1-CB 3.69Å; I163-L489 HydrophobicContact CD1-CB 4Å; I163-L489 HydrophobicContact CD1-CD1 4.47Å; I163-I492 HydrophobicContact CD1-CD1 3.79Å |
| 164 | V | 97.4 | Very high | 93.3 | Very high | 54 Ų | 54 | 23.5 Ų | 23.5 | 33% | 0.327 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -63.3 | -45.7 | 179.9 | 172.5 | 0 | 0 | 0 | 0 | 110.3 | V160 G161 A166 I167 I168 | V160-V164 WeakPolarHBondContact O-CG2 3.42Å; V160-V164 PolarHBondContact O-N 3.35Å; G161-V164 PolarHBondContact O-N 2.83Å; V164-A166 PolarHBondContact O-N 3.03Å; V164-I167 PolarHBondContact O-N 3.48Å; V164-I168 HydrophobicContact CG1-CD1 3.57Å; V164-I168 HydrophobicContact CG1-CG1 4.36Å; V164-I168 WeakPolarHBondContact O-CB 3.34Å; V164-I168 VanDerWaalsContact O-CG1 3.29Å; V164-I168 WeakPolarHBondContact O-CG1 3.31Å; V164-I168 PolarHBondContact O-N 3.27Å |
| 165 | G | 95.8 | Very high | 93 | Very high | 4 Ų | 4 | 25.2 Ų | 25.2 | 4% | 0.041 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -59.4 | -42.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | G161 R162 G169 A214 Q218 | G161-G165 PolarHBondContact O-N 3.04Å; R162-G165 PolarHBondContact O-N 2.89Å; G165-G169 VanDerWaalsContact O-CA 3.3Å; G165-G169 WeakPolarHBondContact O-CA 3.47Å; G165-G169 PolarHBondContact O-N 3.48Å; G165-A214 WeakPolarHBondContact CA-O 3.32Å; G165-Q218 VanDerWaalsContact O-CA 3.28Å; G165-Q218 WeakPolarHBondContact O-CA 3.42Å; G165-Q218 PolarHBondContact O-N 3.26Å |
| 166 | A | 95.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -69.3 | -41.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | R162 I163 V164 G170 G217 G481 I484 S485 | R162-A166 WeakPolarHBondContact O-CB 3.46Å; R162-A166 PolarHBondContact O-N 2.97Å; I163-A166 PolarHBondContact O-N 2.97Å; V164-A166 PolarHBondContact O-N 3.03Å; A166-G170 PolarHBondContact O-N 3.44Å; A166-G217 WeakPolarHBondContact CA-O 3.35Å; A166-G481 VanDerWaalsContact O-CA 3.29Å; A166-G481 WeakPolarHBondContact O-CA 3.21Å; A166-I484 HydrophobicContact CB-CB 4.41Å; A166-I484 HydrophobicContact CB-CG2 4.18Å; A166-S485 WeakPolarHBondContact CB-OG 3.36Å |
| 167 | I | 95.2 | Very high | 92.4 | Very high | 56 Ų | 56 | 30.7 Ų | 30.7 | 29% | 0.287 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -64.2 | -55.2 | 174.7 | -66.2 | 166.4 | 0 | 0 | 0 | 110.3 | I163 V164 G169 G170 H171 L338 S485 | I163-I167 HydrophobicContact CG2-CD1 4.17Å; I163-I167 WeakPolarHBondContact O-CG1 3.19Å; I163-I167 PolarHBondContact O-N 3.33Å; I163-I167 VanDerWaalsContact O-N 3.14Å; V164-I167 PolarHBondContact O-N 3.48Å; I167-G169 PolarHBondContact O-N 2.98Å; I167-G170 PolarHBondContact O-N 3.08Å; I167-H171 PolarHBondContact O-CD2 3.4Å; I167-H171 PolarHBondContact O-N 3.35Å; I167-L338 HydrophobicContact CG2-CD1 4.27Å; I167-S485 WeakPolarHBondContact CG1-OG 3.18Å |
| 168 | I | 93.6 | Very high | 92 | Very high | 99 Ų | 99 | 29.1 Ų | 29.1 | 51% | 0.508 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -59.6 | -41.6 | 179.8 | -66.5 | 173.9 | 0 | 0 | 0 | 110 | V164 H171 L172 | V164-I168 HydrophobicContact CG1-CD1 3.57Å; V164-I168 HydrophobicContact CG1-CG1 4.36Å; V164-I168 WeakPolarHBondContact O-CB 3.34Å; V164-I168 VanDerWaalsContact O-CG1 3.29Å; V164-I168 WeakPolarHBondContact O-CG1 3.31Å; V164-I168 PolarHBondContact O-N 3.27Å; I168-H171 PolarHBondContact O-N 3.5Å; I168-L172 WeakPolarHBondContact O-CB 3.31Å; I168-L172 PolarHBondContact O-N 3.4Å |
| 169 | G | 91.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64.2 | -39.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | G165 I167 L172 S173 | G165-G169 VanDerWaalsContact O-CA 3.3Å; G165-G169 WeakPolarHBondContact O-CA 3.47Å; G165-G169 PolarHBondContact O-N 3.48Å; I167-G169 PolarHBondContact O-N 2.98Å; G169-L172 PolarHBondContact O-N 3.18Å; G169-S173 VanDerWaalsContact O-CB 3.29Å; G169-S173 WeakPolarHBondContact O-CB 3.22Å; G169-S173 PolarHBondContact O-N 3.44Å; G169-S173 PolarHBondContact O-OG 3.08Å; G169-S173 VanDerWaalsContact O-OG 3.13Å |
| 170 | G | 91.2 | Very high | 91 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.6 | -43.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A166 I167 S173 D174 G477 | A166-G170 PolarHBondContact O-N 3.44Å; I167-G170 PolarHBondContact O-N 3.08Å; G170-S173 PolarHBondContact O-OG 3.07Å; G170-D174 PolarHBondContact O-N 3.26Å; G170-D174 VanDerWaalsContact O-N 3.15Å; G170-G477 VanDerWaalsContact CA-C 3.46Å; G170-G477 WeakPolarHBondContact CA-O 3.3Å |
| 171 | H | 91.9 | Very high | 90.4 | Very high | 53 Ų | 53 | 36 Ų | 36 | 25% | 0.245 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -66.8 | -39.4 | 174.7 | -81.1 | -86.7 | 0 | 0 | 0 | 112.8 | I167 I168 N175 | I167-H171 PolarHBondContact O-CD2 3.4Å; I167-H171 PolarHBondContact O-N 3.35Å; I168-H171 PolarHBondContact O-N 3.5Å; H171-N175 VanDerWaalsContact O-CB 3.27Å; H171-N175 WeakPolarHBondContact O-CB 3.23Å; H171-N175 PolarHBondContact O-N 2.81Å; H171-N175 VanDerWaalsContact O-N 3.15Å; H171-N175 PolarHBondContact O-ND2 3.26Å |
| 172 | L | 89.7 | Confident | 90.1 | Very high | 42 Ų | 42 | 36 Ų | 36 | 22% | 0.22 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -66.4 | -45.8 | 178.4 | -174.3 | 64.8 | 0 | 0 | 0 | 110.4 | I168 G169 D174 N175 F176 M185 | I168-L172 WeakPolarHBondContact O-CB 3.31Å; I168-L172 PolarHBondContact O-N 3.4Å; G169-L172 PolarHBondContact O-N 3.18Å; L172-D174 PolarHBondContact O-N 2.9Å; L172-N175 PolarHBondContact O-N 2.87Å; L172-F176 HydrophobicContact CD1-CB 3.9Å; L172-F176 HydrophobicContact CD1-CD2 3.64Å; L172-F176 HydrophobicContact CD1-CE2 4.42Å; L172-F176 HydrophobicContact CD1-CG 3.95Å; L172-F176 PolarHBondContact O-N 3.3Å; L172-M185 HydrophobicContact CD2-CE 4.37Å |
| 173 | S | 87.5 | Confident | 89.7 | Confident | 1 Ų | 1 | 39.2 Ų | 39.2 | 1% | 0.007 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.8 | -40.5 | -178.4 | 66.1 | 0 | 0 | 0 | 0 | 112.5 | G169 G170 G177 R178 | G169-S173 VanDerWaalsContact O-CB 3.29Å; G169-S173 WeakPolarHBondContact O-CB 3.22Å; G169-S173 PolarHBondContact O-N 3.44Å; G169-S173 PolarHBondContact O-OG 3.08Å; G169-S173 VanDerWaalsContact O-OG 3.13Å; G170-S173 PolarHBondContact O-OG 3.07Å; S173-G177 CarbonylContact O-C 3.5Å; S173-R178 WeakPolarHBondContact O-CG 3.35Å |
| 174 | D | 86.8 | Confident | 89.4 | Confident | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -83.9 | -22.8 | -175.7 | -69.7 | -14.6 | 0 | 0 | 0 | 112.9 | G170 L172 R178 W289 K293 V475 G477 I478 | G170-D174 PolarHBondContact O-N 3.26Å; G170-D174 VanDerWaalsContact O-N 3.15Å; L172-D174 PolarHBondContact O-N 2.9Å; D174-R178 IonicContact OD1-NE 3.42Å; D174-R178 IonicContact OD1-NH2 3.2Å; D174-W289 PolarHBondContact O-NE1 3.3Å; D174-K293 WeakPolarHBondContact O-CE 3.26Å; D174-V475 WeakPolarHBondContact OD2-CA 3.37Å; D174-G477 PolarHBondContact OD1-N 3.39Å; D174-G477 VanDerWaalsContact OD2-CA 3.27Å; D174-G477 WeakPolarHBondContact OD2-CA 3.47Å; D174-G477 PolarHBondContact OD2-N 2.88Å; D174-I478 HydrophobicContact CB-CG1 4.46Å; D174-I478 PolarHBondContact OD2-N 3.42Å |
| 175 | N | 85.5 | Confident | 89.1 | Confident | 36 Ų | 36 | 41.9 Ų | 41.9 | 19% | 0.193 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -102.5 | -40.2 | -177.6 | -65.2 | -50.1 | 0 | 0 | 0 | 114.8 | H171 L172 L335 | H171-N175 VanDerWaalsContact O-CB 3.27Å; H171-N175 WeakPolarHBondContact O-CB 3.23Å; H171-N175 PolarHBondContact O-N 2.81Å; H171-N175 VanDerWaalsContact O-N 3.15Å; H171-N175 PolarHBondContact O-ND2 3.26Å; L172-N175 PolarHBondContact O-N 2.87Å; N175-L335 HydrophobicContact CB-CD2 4.34Å; N175-L335 WeakPolarHBondContact OD1-CD2 3.38Å |
| 176 | F | 84.4 | Confident | 88.8 | Confident | 161 Ų | 161 | 41.7 Ų | 41.7 | 71% | 0.706 | 20% | 0.198 | S | C | * | . | H | α-helix | trans | -104.7 | -8.8 | -174.4 | -67.9 | -89.1 | 0 | 0 | 0 | 113.7 | L172 | L172-F176 HydrophobicContact CD1-CB 3.9Å; L172-F176 HydrophobicContact CD1-CD2 3.64Å; L172-F176 HydrophobicContact CD1-CE2 4.42Å; L172-F176 HydrophobicContact CD1-CG 3.95Å; L172-F176 PolarHBondContact O-N 3.3Å |
| 177 | G | 83.8 | Confident | 88.6 | Confident | 4 Ų | 4 | 43.2 Ų | 43.2 | 4% | 0.041 | 21% | 0.209 | C | C | . | . | trans | 106.6 | 157.3 | -172.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | S173 | S173-G177 CarbonylContact O-C 3.5Š| ||
| 178 | R | 85.5 | Confident | 88.5 | Confident | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 22% | 0.216 | C | C | . | . | S | Bend | trans | -91.8 | -34 | -171.4 | -51.8 | -157.1 | 177.8 | 113.5 | -3.6 | 112.8 | S173 D174 L182 L226 E229 E285 S286 | S173-R178 WeakPolarHBondContact O-CG 3.35Å; D174-R178 IonicContact OD1-NE 3.42Å; D174-R178 IonicContact OD1-NH2 3.2Å; R178-L182 VanDerWaalsContact O-CG 3.3Å; R178-L182 WeakPolarHBondContact O-CG 3.48Å; R178-L226 HydrophobicContact CB-CB 4.44Å; R178-L226 HydrophobicContact CB-CD1 4.4Å; R178-E229 VanDerWaalsContact CZ-CD 3.44Å; R178-E229 IonicContact CZ-OE1 2.79Å; R178-E229 VanDerWaalsContact CZ-OE1 3.31Å; R178-E229 IonicContact CZ-OE2 3.56Å; R178-E229 IonicContact NH1-OE1 3.48Å; R178-E229 PolarHBondContact NH1-OE1 3.12Å; R178-E229 IonicContact NH1-OE2 3.99Å; R178-E229 PolarHBondContact NH1-OE2 3.3Å; R178-E229 VanDerWaalsContact NH1-OE2 3.15Å; R178-E229 VanDerWaalsContact NH2-CD 3.26Å; R178-E229 IonicContact NH2-OE1 2.84Å; R178-E229 PolarHBondContact NH2-OE1 2.7Å; R178-E229 IonicContact NH2-OE2 3.72Å; R178-E229 PolarHBondContact NH2-OE2 3.31Å; R178-E285 VanDerWaalsContact CB-OE1 3.25Å; R178-E285 WeakPolarHBondContact CB-OE1 3.22Å; R178-E285 VanDerWaalsContact CG-OE1 3.3Å; R178-E285 WeakPolarHBondContact CG-OE1 3.27Å; R178-E285 VanDerWaalsContact N-CD 3.31Å; R178-E285 PolarHBondContact N-OE1 2.86Å; R178-E285 PolarHBondContact N-OE2 3.28Å; R178-S286 PolarHBondContact NH1-OG 3.38Å |
| 179 | T | 87.1 | Confident | 88.4 | Confident | 28 Ų | 28 | 40.9 Ų | 40.9 | 17% | 0.172 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -82.3 | -39.9 | -172.4 | 57.3 | 0 | 0 | 0 | 0 | 113.2 | G181 L182 F183 L226 F283 Q284 E285 | T179-G181 VanDerWaalsContact C-N 3.29Å; T179-G181 PolarHBondContact O-N 3.29Å; T179-L182 WeakPolarHBondContact O-CB 3.33Å; T179-L182 PolarHBondContact O-N 3.3Å; T179-F183 PolarHBondContact O-N 2.82Å; T179-L226 HydrophobicContact CG2-CD2 4.06Å; T179-F283 HydrophobicContact CG2-CB 3.92Å; T179-Q284 WeakPolarHBondContact CG2-O 3.38Å; T179-E285 HydrophobicContact CG2-CB 4.45Å; T179-E285 PolarHBondContact N-OE2 2.77Å; T179-E285 PolarHBondContact OG1-OE2 3.24Å |
| 180 | Y | 81.3 | Confident | 88.4 | Confident | 171 Ų | 171 | 43.8 Ų | 43.8 | 67% | 0.671 | 21% | 0.208 | S | C | * | . | H | α-helix | trans | -58.2 | -41.6 | -178.4 | -176.6 | -102.5 | 0 | 0 | 0 | 112.3 | L182 L184 | Y180-L182 VanDerWaalsContact C-N 3.33Å; Y180-L182 PolarHBondContact O-N 3.21Å; Y180-L184 HydrophobicContact CE1-CD2 4.46Å; Y180-L184 PolarHBondContact O-N 3.23Å |
| 181 | G | 84.8 | Confident | 88.5 | Confident | 4 Ų | 4 | 47.8 Ų | 47.8 | 4% | 0.041 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.9 | -34.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | T179 M185 | T179-G181 VanDerWaalsContact C-N 3.29Å; T179-G181 PolarHBondContact O-N 3.29Å; G181-M185 WeakPolarHBondContact O-CB 3.35Å; G181-M185 WeakPolarHBondContact O-CG 3.49Å; G181-M185 PolarHBondContact O-N 3.03Å |
| 182 | L | 90.2 | Very high | 88.6 | Confident | 1 Ų | 1 | 45.5 Ų | 45.5 | 1% | 0.005 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.6 | -51.1 | -177.7 | -67 | 171.3 | 0 | 0 | 0 | 112 | R178 T179 Y180 H186 I219 A222 L226 Y280 F283 | R178-L182 VanDerWaalsContact O-CG 3.3Å; R178-L182 WeakPolarHBondContact O-CG 3.48Å; T179-L182 WeakPolarHBondContact O-CB 3.33Å; T179-L182 PolarHBondContact O-N 3.3Å; Y180-L182 VanDerWaalsContact C-N 3.33Å; Y180-L182 PolarHBondContact O-N 3.21Å; L182-H186 WeakPolarHBondContact O-CB 3.47Å; L182-H186 PolarHBondContact O-N 3.17Å; L182-I219 HydrophobicContact CD2-CB 4.3Å; L182-I219 HydrophobicContact CD2-CG2 3.59Å; L182-A222 HydrophobicContact CD2-CB 3.65Å; L182-A222 HydrophobicContact CG-CB 4.18Å; L182-L226 HydrophobicContact CD1-CD2 4.19Å; L182-Y280 HydrophobicContact CB-CD1 3.79Å; L182-Y280 HydrophobicContact CB-CE1 4.17Å; L182-Y280 HydrophobicContact CB-CG 4.23Å; L182-Y280 HydrophobicContact CD1-CD1 4.03Å; L182-Y280 HydrophobicContact CD1-CE1 4.15Å; L182-Y280 HydrophobicContact CD2-CE1 4.28Å; L182-Y280 HydrophobicContact CG-CD1 4.39Å; L182-Y280 HydrophobicContact CG-CE1 4.45Å; L182-F283 HydrophobicContact CD1-CD1 3.8Å; L182-F283 HydrophobicContact CD1-CE1 4.2Å |
| 183 | F | 88.2 | Confident | 88.7 | Confident | 83 Ų | 83 | 43.7 Ų | 43.7 | 36% | 0.364 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -63.2 | -46.5 | -178.4 | 176 | -96.8 | 0 | 0 | 0 | 111.6 | T179 S187 L277 I281 | T179-F183 PolarHBondContact O-N 2.82Å; F183-S187 WeakPolarHBondContact O-CB 3.5Å; F183-S187 PolarHBondContact O-N 3.14Å; F183-S187 PolarHBondContact O-OG 3.45Å; F183-L277 HydrophobicContact CD2-CD1 3.56Å; F183-L277 HydrophobicContact CD2-CG 4.33Å; F183-L277 HydrophobicContact CE2-CD1 3.33Å; F183-L277 HydrophobicContact CE2-CD2 4.44Å; F183-L277 HydrophobicContact CE2-CG 3.76Å; F183-L277 HydrophobicContact CG-CD1 4.49Å; F183-L277 HydrophobicContact CZ-CD1 4.1Å; F183-I281 HydrophobicContact CD2-CD1 4.32Å; F183-I281 HydrophobicContact CD2-CG1 3.62Å; F183-I281 HydrophobicContact CE2-CD1 3.73Å; F183-I281 HydrophobicContact CE2-CG1 3.56Å; F183-I281 HydrophobicContact CZ-CD1 4.5Å |
| 184 | L | 90 | Very high | 89 | Confident | 88 Ų | 88 | 46.4 Ų | 46.4 | 46% | 0.461 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.7 | -48.7 | -179.3 | -179.7 | 62.4 | 0 | 0 | 0 | 111.5 | Y180 S187 F188 | Y180-L184 HydrophobicContact CE1-CD2 4.46Å; Y180-L184 PolarHBondContact O-N 3.23Å; L184-S187 PolarHBondContact O-N 3.26Å; L184-F188 WeakPolarHBondContact O-CB 3.27Å; L184-F188 PolarHBondContact O-N 3.31Å |
| 185 | M | 91 | Very high | 89.4 | Confident | 49 Ų | 49 | 50.3 Ų | 50.3 | 24% | 0.241 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -70.7 | -35.2 | -177.8 | -67.2 | -65.5 | 177.1 | 0 | 0 | 112.2 | L172 G181 G189 I215 Q218 I219 | L172-M185 HydrophobicContact CD2-CE 4.37Å; G181-M185 WeakPolarHBondContact O-CB 3.35Å; G181-M185 WeakPolarHBondContact O-CG 3.49Å; G181-M185 PolarHBondContact O-N 3.03Å; M185-G189 PolarHBondContact O-N 3.34Å; M185-I215 HydrophobicContact CB-CG2 4.32Å; M185-I215 VanDerWaalsContact O-CG2 3.31Å; M185-I215 WeakPolarHBondContact O-CG2 3.46Å; M185-Q218 VanDerWaalsContact CB-OE1 3.24Å; M185-Q218 HydrophobicContact CG-CG 4.14Å; M185-Q218 VanDerWaalsContact CG-OE1 3.28Å; M185-I219 HydrophobicContact CB-CD1 4.24Å; M185-I219 HydrophobicContact CB-CG1 4.07Å |
| 186 | H | 90.3 | Very high | 89.8 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -66.4 | -43 | 174.7 | -168.6 | 68 | 0 | 0 | 0 | 111.9 | W81 L182 G189 M190 I219 S273 Y280 | W81-H186 AromaticContact CZ2-ND1 3.79Å; L182-H186 WeakPolarHBondContact O-CB 3.47Å; L182-H186 PolarHBondContact O-N 3.17Å; H186-G189 PolarHBondContact O-N 2.97Å; H186-M190 PolarHBondContact O-N 3.36Å; H186-I219 HydrophobicContact CB-CD1 4.16Å; H186-S273 PolarHBondContact NE2-O 2.88Å; H186-Y280 HydrophobicContact CB-CD2 3.97Å; H186-Y280 HydrophobicContact CB-CE2 4Å; H186-Y280 AromaticContact CD2-CD2 3.93Å; H186-Y280 AromaticContact CD2-CE2 3.97Å; H186-Y280 AromaticContact CG-CD2 3.9Å; H186-Y280 AromaticContact CG-CE2 3.69Å; H186-Y280 AromaticContact ND1-CE2 3.88Å |
| 187 | S | 90.7 | Very high | 90.2 | Very high | 32 Ų | 32 | 42.2 Ų | 42.2 | 22% | 0.224 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.5 | -49.8 | 175.1 | -57.7 | 0 | 0 | 0 | 0 | 111.3 | F183 L184 G189 M190 L277 | F183-S187 WeakPolarHBondContact O-CB 3.5Å; F183-S187 PolarHBondContact O-N 3.14Å; F183-S187 PolarHBondContact O-OG 3.45Å; L184-S187 PolarHBondContact O-N 3.26Å; S187-G189 VanDerWaalsContact C-N 3.27Å; S187-G189 PolarHBondContact O-N 3.44Å; S187-M190 WeakPolarHBondContact O-CB 3.35Å; S187-M190 PolarHBondContact O-N 3.14Å; S187-L277 WeakPolarHBondContact OG-CD1 3.11Å |
| 188 | F | 92.8 | Very high | 90.6 | Very high | 101 Ų | 101 | 45.3 Ų | 45.3 | 44% | 0.443 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -61.1 | -39 | 176.5 | -177.6 | -124.5 | 0 | 0 | 0 | 111.5 | L184 M190 V191 V192 I211 I215 | L184-F188 WeakPolarHBondContact O-CB 3.27Å; L184-F188 PolarHBondContact O-N 3.31Å; F188-M190 VanDerWaalsContact C-N 3.3Å; F188-M190 PolarHBondContact O-N 3.33Å; F188-V191 PolarHBondContact O-N 2.67Å; F188-V191 VanDerWaalsContact O-N 3.13Å; F188-V192 HydrophobicContact CD1-CG2 4.21Å; F188-V192 HydrophobicContact CD2-CG2 4.21Å; F188-V192 HydrophobicContact CE1-CG2 3.85Å; F188-V192 HydrophobicContact CE2-CG2 3.85Å; F188-V192 HydrophobicContact CG-CG2 4.37Å; F188-V192 HydrophobicContact CZ-CG2 3.65Å; F188-V192 WeakPolarHBondContact O-CG2 3.49Å; F188-V192 PolarHBondContact O-N 3.3Å; F188-I211 HydrophobicContact CE1-CG2 3.76Å; F188-I211 HydrophobicContact CZ-CG2 4.16Å; F188-I215 HydrophobicContact CD1-CD1 3.5Å; F188-I215 VanDerWaalsContact CD1-CD1 3.5Å; F188-I215 HydrophobicContact CD1-CG1 4.12Å; F188-I215 HydrophobicContact CE1-CD1 3.94Å; F188-I215 HydrophobicContact CG-CD1 4.33Å |
| 189 | G | 92.3 | Very high | 91 | Very high | 4 Ų | 4 | 45.7 Ų | 45.7 | 4% | 0.041 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.2 | -28.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | M185 H186 S187 R193 I215 | M185-G189 PolarHBondContact O-N 3.34Å; H186-G189 PolarHBondContact O-N 2.97Å; S187-G189 VanDerWaalsContact C-N 3.27Å; S187-G189 PolarHBondContact O-N 3.44Å; G189-R193 WeakPolarHBondContact O-CB 3.48Å; G189-R193 WeakPolarHBondContact O-CG 3.23Å; G189-R193 PolarHBondContact O-N 3.31Å; G189-R193 VanDerWaalsContact O-N 3.09Å; G189-R193 PolarHBondContact O-NE 2.91Å; G189-I215 VanDerWaalsContact CA-CD1 3.49Å |
| 190 | M | 90.4 | Very high | 91.1 | Very high | 61 Ų | 61 | 49 Ų | 49 | 30% | 0.3 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -65.9 | -43.4 | 171.2 | -70.3 | 179.5 | 63.9 | 0 | 0 | 111.6 | H186 S187 F188 A194 A274 L277 | H186-M190 PolarHBondContact O-N 3.36Å; S187-M190 WeakPolarHBondContact O-CB 3.35Å; S187-M190 PolarHBondContact O-N 3.14Å; F188-M190 VanDerWaalsContact C-N 3.3Å; F188-M190 PolarHBondContact O-N 3.33Å; M190-A194 PolarHBondContact O-N 3.42Å; M190-A274 HydrophobicContact CE-CB 3.5Å; M190-A274 VanDerWaalsContact CE-CB 3.5Å; M190-A274 HydrophobicContact SD-CB 4.42Å; M190-L277 HydrophobicContact SD-CD2 4.48Å |
| 191 | V | 93.9 | Very high | 91.5 | Very high | 85 Ų | 85 | 45.6 Ų | 45.6 | 52% | 0.515 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.8 | -48.5 | 178.5 | -179.6 | 0 | 0 | 0 | 0 | 110.7 | F188 R193 A194 L195 | F188-V191 PolarHBondContact O-N 2.67Å; F188-V191 VanDerWaalsContact O-N 3.13Å; V191-R193 VanDerWaalsContact C-N 3.3Å; V191-R193 PolarHBondContact O-N 2.94Å; V191-A194 PolarHBondContact O-N 2.91Å; V191-L195 HydrophobicContact CG1-CD1 4.23Å; V191-L195 WeakPolarHBondContact O-CG 3.34Å; V191-L195 PolarHBondContact O-N 3.07Å |
| 192 | V | 94.6 | Very high | 91.8 | Very high | 4 Ų | 4 | 49.5 Ų | 49.5 | 2% | 0.024 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.4 | -40.5 | 179.8 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | F188 L195 S196 F208 I211 T212 I215 | F188-V192 HydrophobicContact CD1-CG2 4.21Å; F188-V192 HydrophobicContact CD2-CG2 4.21Å; F188-V192 HydrophobicContact CE1-CG2 3.85Å; F188-V192 HydrophobicContact CE2-CG2 3.85Å; F188-V192 HydrophobicContact CG-CG2 4.37Å; F188-V192 HydrophobicContact CZ-CG2 3.65Å; F188-V192 WeakPolarHBondContact O-CG2 3.49Å; F188-V192 PolarHBondContact O-N 3.3Å; V192-L195 PolarHBondContact O-N 3.04Å; V192-S196 WeakPolarHBondContact O-CB 3.28Å; V192-S196 PolarHBondContact O-N 3.44Å; V192-F208 HydrophobicContact CG1-CB 4.41Å; V192-F208 HydrophobicContact CG1-CD1 4.36Å; V192-I211 HydrophobicContact CB-CG2 4.34Å; V192-I211 HydrophobicContact CG1-CB 3.9Å; V192-I211 HydrophobicContact CG1-CG2 3.77Å; V192-I211 HydrophobicContact CG2-CG2 3.68Å; V192-T212 WeakPolarHBondContact CG1-OG1 3.39Å; V192-I215 HydrophobicContact CB-CD1 4.39Å; V192-I215 HydrophobicContact CG2-CD1 4.13Å |
| 193 | R | 92 | Very high | 91.9 | Very high | 5 Ų | 5 | 52.3 Ų | 52.3 | 2% | 0.019 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -66.2 | -40.8 | 176 | -74.7 | -179.4 | -63.2 | 160.4 | -3.1 | 112.4 | G189 V191 L195 S196 I197 T212 S270 S273 | G189-R193 WeakPolarHBondContact O-CB 3.48Å; G189-R193 WeakPolarHBondContact O-CG 3.23Å; G189-R193 PolarHBondContact O-N 3.31Å; G189-R193 VanDerWaalsContact O-N 3.09Å; G189-R193 PolarHBondContact O-NE 2.91Å; V191-R193 VanDerWaalsContact C-N 3.3Å; V191-R193 PolarHBondContact O-N 2.94Å; R193-L195 VanDerWaalsContact C-N 3.3Å; R193-L195 PolarHBondContact O-N 3.24Å; R193-S196 WeakPolarHBondContact O-CB 3.32Å; R193-S196 PolarHBondContact O-N 2.9Å; R193-I197 WeakPolarHBondContact O-CD1 3.28Å; R193-I197 VanDerWaalsContact O-CG1 3.22Å; R193-I197 WeakPolarHBondContact O-CG1 3.27Å; R193-I197 PolarHBondContact O-N 2.7Å; R193-T212 HydrophobicContact CG-CG2 4.27Å; R193-S270 PolarHBondContact NH1-OG 3.13Å; R193-S273 PolarHBondContact NH1-OG 3Å; R193-S273 PolarHBondContact NH2-OG 3.14Å |
| 194 | A | 93.8 | Very high | 92.3 | Very high | 57 Ų | 57 | 50.2 Ų | 50.2 | 47% | 0.471 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -60.6 | -41.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | M190 V191 I197 A198 | M190-A194 PolarHBondContact O-N 3.42Å; V191-A194 PolarHBondContact O-N 2.91Å; A194-I197 PolarHBondContact O-N 3.48Å; A194-A198 WeakPolarHBondContact O-CB 3.33Å; A194-A198 PolarHBondContact O-N 2.85Å |
| 195 | L | 95.3 | Very high | 92.4 | Very high | 83 Ų | 83 | 46 Ų | 46 | 44% | 0.435 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -65.8 | -39.3 | 174.4 | -65.9 | 173 | 0 | 0 | 0 | 112.3 | V191 V192 R193 A198 S199 F208 | V191-L195 HydrophobicContact CG1-CD1 4.23Å; V191-L195 WeakPolarHBondContact O-CG 3.34Å; V191-L195 PolarHBondContact O-N 3.07Å; V192-L195 PolarHBondContact O-N 3.04Å; R193-L195 VanDerWaalsContact C-N 3.3Å; R193-L195 PolarHBondContact O-N 3.24Å; L195-A198 PolarHBondContact O-N 2.96Å; L195-A198 VanDerWaalsContact O-N 3.17Å; L195-S199 PolarHBondContact O-N 3.05Å; L195-F208 HydrophobicContact CB-CD1 4.08Å; L195-F208 HydrophobicContact CB-CD2 4.41Å; L195-F208 HydrophobicContact CB-CE1 3.68Å; L195-F208 HydrophobicContact CB-CE2 4.04Å; L195-F208 HydrophobicContact CB-CG 4.45Å; L195-F208 HydrophobicContact CB-CZ 3.67Å; L195-F208 HydrophobicContact CD1-CE1 3.93Å; L195-F208 HydrophobicContact CD1-CZ 4.33Å; L195-F208 HydrophobicContact CG-CE1 4.43Å |
| 196 | S | 93.2 | Very high | 92.6 | Very high | 1 Ų | 1 | 44.1 Ų | 44.1 | 1% | 0.007 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.7 | -45.9 | 173.4 | -168.7 | 0 | 0 | 0 | 0 | 111.4 | V192 R193 A198 S199 F205 Q209 | V192-S196 WeakPolarHBondContact O-CB 3.28Å; V192-S196 PolarHBondContact O-N 3.44Å; R193-S196 WeakPolarHBondContact O-CB 3.32Å; R193-S196 PolarHBondContact O-N 2.9Å; S196-A198 VanDerWaalsContact C-N 3.26Å; S196-A198 PolarHBondContact O-N 2.87Å; S196-S199 WeakPolarHBondContact O-CB 3.49Å; S196-S199 PolarHBondContact O-N 3.41Å; S196-S199 PolarHBondContact O-OG 2.93Å; S196-F205 VanDerWaalsContact OG-CD2 3.22Å; S196-F205 WeakPolarHBondContact OG-CD2 3.42Å; S196-F205 WeakPolarHBondContact OG-CE2 3.46Å; S196-Q209 PolarHBondContact OG-NE2 3.49Å |
| 197 | I | 92.3 | Very high | 92.9 | Very high | 25 Ų | 25 | 48.3 Ų | 48.3 | 13% | 0.128 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -66.4 | -26.4 | 176.2 | -66.4 | 162.3 | 0 | 0 | 0 | 112.1 | R193 A194 R263 L266 I267 | R193-I197 WeakPolarHBondContact O-CD1 3.28Å; R193-I197 VanDerWaalsContact O-CG1 3.22Å; R193-I197 WeakPolarHBondContact O-CG1 3.27Å; R193-I197 PolarHBondContact O-N 2.7Å; A194-I197 PolarHBondContact O-N 3.48Å; I197-R263 PolarHBondContact O-NH1 3.35Å; I197-L266 HydrophobicContact CD1-CB 3.76Å; I197-L266 HydrophobicContact CG1-CB 3.59Å; I197-L266 HydrophobicContact CG1-CD1 4.07Å; I197-I267 HydrophobicContact CD1-CG1 4.05Å; I197-I267 HydrophobicContact CG2-CD1 4.05Å; I197-I267 HydrophobicContact CG2-CG1 3.72Å |
| 198 | A | 93.6 | Very high | 93.1 | Very high | 70 Ų | 70 | 48.9 Ų | 48.9 | 58% | 0.579 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -87.8 | -10.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | A194 L195 S196 T200 | A194-A198 WeakPolarHBondContact O-CB 3.33Å; A194-A198 PolarHBondContact O-N 2.85Å; L195-A198 PolarHBondContact O-N 2.96Å; L195-A198 VanDerWaalsContact O-N 3.17Å; S196-A198 VanDerWaalsContact C-N 3.26Å; S196-A198 PolarHBondContact O-N 2.87Å; A198-T200 PolarHBondContact O-N 3.39Å |
| 199 | S | 92.3 | Very high | 93.2 | Very high | 8 Ų | 8 | 44.1 Ų | 44.1 | 6% | 0.056 | 26% | 0.264 | C | S | . | . | trans | -63.4 | 130.8 | -176.5 | 66.5 | 0 | 0 | 0 | 0 | 111.8 | L195 S196 F205 R263 | L195-S199 PolarHBondContact O-N 3.05Å; S196-S199 WeakPolarHBondContact O-CB 3.49Å; S196-S199 PolarHBondContact O-N 3.41Å; S196-S199 PolarHBondContact O-OG 2.93Å; S199-F205 WeakPolarHBondContact OG-CB 3.35Å; S199-F205 WeakPolarHBondContact OG-CD2 3.46Å; S199-R263 PolarHBondContact O-NH1 2.78Å; S199-R263 PolarHBondContact O-NH2 3.24Å | ||
| 200 | T | 90.2 | Very high | 93.4 | Very high | 97 Ų | 97 | 47.6 Ų | 47.6 | 60% | 0.595 | 28% | 0.278 | S | S | * | . | trans | -92.6 | -26 | 177 | 46.8 | 0 | 0 | 0 | 0 | 112.4 | W141 A198 | W141-T200 PolarHBondContact NE1-O 2.99Å; A198-T200 PolarHBondContact O-N 3.39Å | ||
| 201 | D | 90.3 | Very high | 93.7 | Very high | 99 Ų | 99 | 47 Ų | 47 | 53% | 0.529 | 28% | 0.275 | S | S | . | . | S | Bend | trans | -115.6 | 141.1 | -175.1 | -54.6 | -71.8 | 0 | 0 | 0 | 111.5 | A204 F205 | D201-A204 PolarHBondContact O-N 3.04Å; D201-F205 PolarHBondContact O-N 3.29Å; D201-F205 VanDerWaalsContact O-N 3.12Å |
| 202 | W | 89.4 | Confident | 93.7 | Very high | 87 Ų | 87 | 43.1 Ų | 43.1 | 33% | 0.33 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.4 | -33 | -179.9 | 76.5 | -95.1 | 0 | 0 | 0 | 114.8 | W141 L150 F205 A206 | W141-W202 HydrophobicContact CD2-CB 3.83Å; W141-W202 HydrophobicContact CE3-CB 3.5Å; W141-W202 HydrophobicContact CG-CB 4.43Å; W141-W202 HydrophobicContact CH2-CB 4.43Å; W141-W202 HydrophobicContact CZ3-CB 3.84Å; L150-W202 HydrophobicContact CD1-CD2 4.3Å; L150-W202 HydrophobicContact CD1-CZ2 4.16Å; L150-W202 HydrophobicContact CD2-CE3 4.49Å; L150-W202 HydrophobicContact CD2-CH2 3.71Å; L150-W202 HydrophobicContact CD2-CZ2 3.94Å; L150-W202 HydrophobicContact CD2-CZ3 4.01Å; W202-F205 WeakPolarHBondContact O-CB 3.28Å; W202-F205 PolarHBondContact O-N 3.47Å; W202-A206 PolarHBondContact O-N 2.98Å |
| 203 | P | 93.7 | Very high | 93.8 | Very high | 60 Ų | 60 | 42.9 Ų | 42.9 | 39% | 0.39 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -70 | -38.4 | 178.5 | -18.2 | 33.1 | 0 | 0 | 0 | 112.3 | F205 A206 V207 | P203-F205 VanDerWaalsContact C-N 3.31Å; P203-A206 WeakPolarHBondContact O-CB 3.16Å; P203-A206 PolarHBondContact O-N 3.45Å; P203-V207 PolarHBondContact O-N 2.74Å; P203-V207 VanDerWaalsContact O-N 3.11Å |
| 204 | A | 95.1 | Very high | 93.9 | Very high | 39 Ų | 39 | 43.7 Ų | 43.7 | 32% | 0.322 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.1 | -43.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110 | D201 A206 V207 F208 | D201-A204 PolarHBondContact O-N 3.04Å; A204-A206 VanDerWaalsContact C-N 3.32Å; A204-A206 PolarHBondContact O-N 3.03Å; A204-V207 PolarHBondContact O-N 2.93Å; A204-F208 HydrophobicContact CB-CE2 4.31Å; A204-F208 WeakPolarHBondContact O-CD2 3.25Å; A204-F208 WeakPolarHBondContact O-CG 3.44Å; A204-F208 PolarHBondContact O-N 3.35Å |
| 205 | F | 93.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58.2 | -42.6 | 173 | -171.9 | -109.9 | 0 | 0 | 0 | 112.3 | L88 L137 W141 L154 S196 S199 D201 W202 P203 V207 F208 Q209 W262 L266 | L88-F205 HydrophobicContact CD2-CE1 3.93Å; L137-F205 HydrophobicContact CD2-CE1 4.48Å; W141-F205 HydrophobicContact CH2-CB 3.38Å; W141-F205 AromaticContact CH2-CD1 3.67Å; W141-F205 HydrophobicContact CH2-CD1 3.67Å; W141-F205 AromaticContact CH2-CD2 3.99Å; W141-F205 HydrophobicContact CH2-CD2 3.99Å; W141-F205 HydrophobicContact CH2-CE1 4.4Å; W141-F205 AromaticContact CH2-CG 3.43Å; W141-F205 HydrophobicContact CH2-CG 3.43Å; W141-F205 VanDerWaalsContact CH2-CG 3.43Å; W141-F205 HydrophobicContact CZ2-CB 4.18Å; W141-F205 HydrophobicContact CZ3-CB 4.04Å; W141-F205 AromaticContact CZ3-CD1 3.71Å; W141-F205 HydrophobicContact CZ3-CD1 3.71Å; W141-F205 HydrophobicContact CZ3-CE1 4.34Å; W141-F205 AromaticContact CZ3-CG 3.98Å; W141-F205 HydrophobicContact CZ3-CG 3.98Å; L154-F205 HydrophobicContact CD1-CD1 3.91Å; L154-F205 HydrophobicContact CD1-CE1 4.12Å; L154-F205 HydrophobicContact CD2-CD1 3.76Å; L154-F205 HydrophobicContact CD2-CE1 4.48Å; L154-F205 HydrophobicContact CG-CD1 4.42Å; S196-F205 VanDerWaalsContact OG-CD2 3.22Å; S196-F205 WeakPolarHBondContact OG-CD2 3.42Å; S196-F205 WeakPolarHBondContact OG-CE2 3.46Å; S199-F205 WeakPolarHBondContact OG-CB 3.35Å; S199-F205 WeakPolarHBondContact OG-CD2 3.46Å; D201-F205 PolarHBondContact O-N 3.29Å; D201-F205 VanDerWaalsContact O-N 3.12Å; W202-F205 WeakPolarHBondContact O-CB 3.28Å; W202-F205 PolarHBondContact O-N 3.47Å; P203-F205 VanDerWaalsContact C-N 3.31Å; F205-V207 PolarHBondContact O-N 2.9Å; F205-F208 PolarHBondContact O-N 3.08Å; F205-Q209 HydrophobicContact CD1-CG 3.84Å; F205-Q209 HydrophobicContact CE1-CG 3.59Å; F205-Q209 HydrophobicContact CE2-CG 4.3Å; F205-Q209 HydrophobicContact CG-CG 4.3Å; F205-Q209 HydrophobicContact CZ-CG 3.84Å; F205-Q209 WeakPolarHBondContact O-CB 3.4Å; F205-Q209 VanDerWaalsContact O-CG 3.29Å; F205-Q209 WeakPolarHBondContact O-CG 3.33Å; F205-Q209 PolarHBondContact O-N 3.44Å; F205-W262 HydrophobicContact CD2-CH2 4.42Å; F205-W262 HydrophobicContact CD2-CZ3 4.46Å; F205-W262 HydrophobicContact CE2-CH2 4.15Å; F205-W262 AromaticContact CE2-CZ3 3.75Å; F205-W262 HydrophobicContact CE2-CZ3 3.75Å; F205-W262 HydrophobicContact CZ-CZ3 4.21Å; F205-L266 HydrophobicContact CE2-CD1 4.46Å |
| 206 | A | 94.4 | Very high | 93.8 | Very high | 9 Ų | 9 | 37.4 Ų | 37.4 | 7% | 0.074 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.3 | -44.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L154 W202 P203 A204 Q209 F210 | L154-A206 HydrophobicContact CD2-CB 3.5Å; L154-A206 VanDerWaalsContact CD2-CB 3.5Å; W202-A206 PolarHBondContact O-N 2.98Å; P203-A206 WeakPolarHBondContact O-CB 3.16Å; P203-A206 PolarHBondContact O-N 3.45Å; A204-A206 VanDerWaalsContact C-N 3.32Å; A204-A206 PolarHBondContact O-N 3.03Å; A206-Q209 PolarHBondContact O-N 2.82Å; A206-F210 PolarHBondContact O-N 3.02Å |
| 207 | V | 97 | Very high | 93.8 | Very high | 87 Ų | 87 | 37.3 Ų | 37.3 | 53% | 0.527 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -62.5 | -45.4 | 176.1 | 174.5 | 0 | 0 | 0 | 0 | 110.7 | P203 A204 F205 Q209 F210 I211 | P203-V207 PolarHBondContact O-N 2.74Å; P203-V207 VanDerWaalsContact O-N 3.11Å; A204-V207 PolarHBondContact O-N 2.93Å; F205-V207 PolarHBondContact O-N 2.9Å; V207-Q209 VanDerWaalsContact C-N 3.32Å; V207-Q209 PolarHBondContact O-N 2.97Å; V207-F210 WeakPolarHBondContact O-CB 3.33Å; V207-F210 PolarHBondContact O-N 3.31Å; V207-I211 HydrophobicContact CG1-CD1 4.12Å; V207-I211 WeakPolarHBondContact O-CG1 3.35Å; V207-I211 PolarHBondContact O-N 3.29Å |
| 208 | F | 95.5 | Very high | 93.8 | Very high | 45 Ų | 45 | 36.4 Ų | 36.4 | 20% | 0.197 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.7 | -32.9 | 177.2 | -63.4 | -51 | 0 | 0 | 0 | 112.8 | V192 L195 A204 F205 I211 T212 | V192-F208 HydrophobicContact CG1-CB 4.41Å; V192-F208 HydrophobicContact CG1-CD1 4.36Å; L195-F208 HydrophobicContact CB-CD1 4.08Å; L195-F208 HydrophobicContact CB-CD2 4.41Å; L195-F208 HydrophobicContact CB-CE1 3.68Å; L195-F208 HydrophobicContact CB-CE2 4.04Å; L195-F208 HydrophobicContact CB-CG 4.45Å; L195-F208 HydrophobicContact CB-CZ 3.67Å; L195-F208 HydrophobicContact CD1-CE1 3.93Å; L195-F208 HydrophobicContact CD1-CZ 4.33Å; L195-F208 HydrophobicContact CG-CE1 4.43Å; A204-F208 HydrophobicContact CB-CE2 4.31Å; A204-F208 WeakPolarHBondContact O-CD2 3.25Å; A204-F208 WeakPolarHBondContact O-CG 3.44Å; A204-F208 PolarHBondContact O-N 3.35Å; F205-F208 PolarHBondContact O-N 3.08Å; F208-I211 PolarHBondContact O-N 3.05Å; F208-T212 VanDerWaalsContact O-CB 3.28Å; F208-T212 WeakPolarHBondContact O-CB 3.13Å; F208-T212 PolarHBondContact O-N 2.83Å; F208-T212 PolarHBondContact O-OG1 3.47Å |
| 209 | Q | 94 | Very high | 93.7 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -67.3 | -40.3 | 173.9 | -74.4 | -58 | -35.9 | 0 | 0 | 111.6 | N84 L88 F158 S196 F205 A206 V207 T212 G213 | N84-Q209 PolarHBondContact OD1-NE2 2.58Å; L88-Q209 HydrophobicContact CD1-CB 4.45Å; L88-Q209 HydrophobicContact CD1-CG 4.14Å; F158-Q209 HydrophobicContact CB-CB 4.32Å; F158-Q209 WeakPolarHBondContact CD2-O 3.25Å; S196-Q209 PolarHBondContact OG-NE2 3.49Å; F205-Q209 HydrophobicContact CD1-CG 3.84Å; F205-Q209 HydrophobicContact CE1-CG 3.59Å; F205-Q209 HydrophobicContact CE2-CG 4.3Å; F205-Q209 HydrophobicContact CG-CG 4.3Å; F205-Q209 HydrophobicContact CZ-CG 3.84Å; F205-Q209 WeakPolarHBondContact O-CB 3.4Å; F205-Q209 VanDerWaalsContact O-CG 3.29Å; F205-Q209 WeakPolarHBondContact O-CG 3.33Å; F205-Q209 PolarHBondContact O-N 3.44Å; A206-Q209 PolarHBondContact O-N 2.82Å; V207-Q209 VanDerWaalsContact C-N 3.32Å; V207-Q209 PolarHBondContact O-N 2.97Å; Q209-T212 PolarHBondContact O-N 2.93Å; Q209-G213 PolarHBondContact O-N 2.82Å |
| 210 | F | 96.6 | Very high | 93.6 | Very high | 78 Ų | 78 | 33.8 Ų | 33.8 | 34% | 0.342 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -58.2 | -48.9 | 171.3 | 172 | -91.5 | 0 | 0 | 0 | 112 | C157 V160 G161 A206 V207 T212 G213 A214 | C157-F210 HydrophobicContact CB-CB 4.37Å; C157-F210 VanDerWaalsContact O-CA 3.32Å; C157-F210 WeakPolarHBondContact O-CA 3.31Å; C157-F210 WeakPolarHBondContact O-CD2 3.28Å; V160-F210 HydrophobicContact CG1-CD2 4.49Å; V160-F210 HydrophobicContact CG1-CE2 4.04Å; G161-F210 VanDerWaalsContact CA-O 3.28Å; G161-F210 WeakPolarHBondContact CA-O 3.43Å; A206-F210 PolarHBondContact O-N 3.02Å; V207-F210 WeakPolarHBondContact O-CB 3.33Å; V207-F210 PolarHBondContact O-N 3.31Å; F210-T212 PolarHBondContact O-N 3.34Å; F210-G213 PolarHBondContact O-N 3.04Å; F210-A214 PolarHBondContact O-N 3.39Å |
| 211 | I | 96.7 | Very high | 93.8 | Very high | 47 Ų | 47 | 29.1 Ų | 29.1 | 24% | 0.241 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.9 | -42.2 | 179.4 | -60.3 | 167.7 | 0 | 0 | 0 | 110.8 | F188 V192 V207 F208 G213 A214 I215 | F188-I211 HydrophobicContact CE1-CG2 3.76Å; F188-I211 HydrophobicContact CZ-CG2 4.16Å; V192-I211 HydrophobicContact CB-CG2 4.34Å; V192-I211 HydrophobicContact CG1-CB 3.9Å; V192-I211 HydrophobicContact CG1-CG2 3.77Å; V192-I211 HydrophobicContact CG2-CG2 3.68Å; V207-I211 HydrophobicContact CG1-CD1 4.12Å; V207-I211 WeakPolarHBondContact O-CG1 3.35Å; V207-I211 PolarHBondContact O-N 3.29Å; F208-I211 PolarHBondContact O-N 3.05Å; I211-G213 VanDerWaalsContact C-N 3.3Å; I211-G213 PolarHBondContact O-N 3.47Å; I211-A214 PolarHBondContact O-N 3.36Å; I211-I215 HydrophobicContact CG2-CD1 4.06Å; I211-I215 WeakPolarHBondContact O-CG1 3.18Å; I211-I215 PolarHBondContact O-N 3.04Å |
| 212 | T | 94.3 | Very high | 93.9 | Very high | 4 Ų | 4 | 24.4 Ų | 24.4 | 3% | 0.025 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -61.2 | -41.1 | 176.4 | -58.8 | 0 | 0 | 0 | 0 | 111.2 | N84 F158 V192 R193 F208 Q209 F210 I215 F216 | N84-T212 HydrophobicContact CB-CG2 4.38Å; F158-T212 HydrophobicContact CE2-CG2 4.24Å; V192-T212 WeakPolarHBondContact CG1-OG1 3.39Å; R193-T212 HydrophobicContact CG-CG2 4.27Å; F208-T212 VanDerWaalsContact O-CB 3.28Å; F208-T212 WeakPolarHBondContact O-CB 3.13Å; F208-T212 PolarHBondContact O-N 2.83Å; F208-T212 PolarHBondContact O-OG1 3.47Å; Q209-T212 PolarHBondContact O-N 2.93Å; F210-T212 PolarHBondContact O-N 3.34Å; T212-I215 PolarHBondContact O-N 2.87Å; T212-F216 PolarHBondContact O-N 3.34Å |
| 213 | G | 95.2 | Very high | 94 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -59.2 | -48 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | F158 G161 R162 Q209 F210 I211 I215 F216 G217 | F158-G213 WeakPolarHBondContact O-CA 3.12Å; G161-G213 VanDerWaalsContact C-C 3.42Å; R162-G213 WeakPolarHBondContact CA-O 3.16Å; R162-G213 WeakPolarHBondContact CG-O 3.31Å; R162-G213 VanDerWaalsContact N-C 3.31Å; R162-G213 PolarHBondContact N-O 3.1Å; Q209-G213 PolarHBondContact O-N 2.82Å; F210-G213 PolarHBondContact O-N 3.04Å; I211-G213 VanDerWaalsContact C-N 3.3Å; I211-G213 PolarHBondContact O-N 3.47Å; G213-I215 VanDerWaalsContact C-N 3.32Å; G213-I215 PolarHBondContact O-N 2.98Å; G213-F216 WeakPolarHBondContact O-CB 3.17Å; G213-F216 PolarHBondContact O-N 3.28Å; G213-F216 VanDerWaalsContact O-N 3.12Å; G213-G217 PolarHBondContact O-N 2.94Å |
| 214 | A | 95.7 | Very high | 93.8 | Very high | 22 Ų | 22 | 17.9 Ų | 17.9 | 18% | 0.182 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -60.8 | -40.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113 | G161 G165 F210 I211 Q218 | G161-A214 WeakPolarHBondContact O-CA 3.42Å; G161-A214 WeakPolarHBondContact O-CB 3.32Å; G161-A214 PolarHBondContact O-N 3.09Å; G165-A214 WeakPolarHBondContact CA-O 3.32Å; F210-A214 PolarHBondContact O-N 3.39Å; I211-A214 PolarHBondContact O-N 3.36Å; A214-Q218 PolarHBondContact O-N 2.89Å; A214-Q218 VanDerWaalsContact O-N 3.09Å |
| 215 | I | 93.5 | Very high | 93.7 | Very high | 5 Ų | 5 | 16 Ų | 16 | 3% | 0.026 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -63.3 | -45.2 | 174.6 | -67.1 | 168.6 | 0 | 0 | 0 | 110.4 | M185 F188 G189 V192 I211 T212 G213 Q218 I219 | M185-I215 HydrophobicContact CB-CG2 4.32Å; M185-I215 VanDerWaalsContact O-CG2 3.31Å; M185-I215 WeakPolarHBondContact O-CG2 3.46Å; F188-I215 HydrophobicContact CD1-CD1 3.5Å; F188-I215 VanDerWaalsContact CD1-CD1 3.5Å; F188-I215 HydrophobicContact CD1-CG1 4.12Å; F188-I215 HydrophobicContact CE1-CD1 3.94Å; F188-I215 HydrophobicContact CG-CD1 4.33Å; G189-I215 VanDerWaalsContact CA-CD1 3.49Å; V192-I215 HydrophobicContact CB-CD1 4.39Å; V192-I215 HydrophobicContact CG2-CD1 4.13Å; I211-I215 HydrophobicContact CG2-CD1 4.06Å; I211-I215 WeakPolarHBondContact O-CG1 3.18Å; I211-I215 PolarHBondContact O-N 3.04Å; T212-I215 PolarHBondContact O-N 2.87Å; G213-I215 VanDerWaalsContact C-N 3.32Å; G213-I215 PolarHBondContact O-N 2.98Å; I215-Q218 PolarHBondContact O-N 3.18Å; I215-I219 HydrophobicContact CG2-CD1 3.64Å; I215-I219 HydrophobicContact CG2-CG1 4.36Å; I215-I219 VanDerWaalsContact O-CG1 3.31Å; I215-I219 WeakPolarHBondContact O-CG1 3.49Å; I215-I219 PolarHBondContact O-N 2.87Å |
| 216 | F | 92.1 | Very high | 93.6 | Very high | 2 Ų | 2 | 16 Ų | 16 | 1% | 0.009 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -61.5 | -48.1 | 178.4 | 178.8 | -153 | 0 | 0 | 0 | 112.3 | W81 F158 R162 T212 G213 Q218 I219 Q220 L245 | W81-F216 HydrophobicContact CB-CB 3.76Å; W81-F216 HydrophobicContact CB-CD1 3.86Å; W81-F216 HydrophobicContact CB-CD2 3.27Å; W81-F216 HydrophobicContact CB-CE1 4.29Å; W81-F216 HydrophobicContact CB-CE2 3.76Å; W81-F216 HydrophobicContact CB-CG 3.35Å; W81-F216 HydrophobicContact CB-CZ 4.25Å; W81-F216 AromaticContact CD2-CD2 3.62Å; W81-F216 HydrophobicContact CD2-CD2 3.62Å; W81-F216 HydrophobicContact CD2-CE2 4.21Å; W81-F216 HydrophobicContact CD2-CG 4.39Å; W81-F216 AromaticContact CE3-CD2 3.29Å; W81-F216 HydrophobicContact CE3-CD2 3.29Å; W81-F216 AromaticContact CE3-CE2 3.51Å; W81-F216 HydrophobicContact CE3-CE2 3.51Å; W81-F216 HydrophobicContact CE3-CG 4.42Å; W81-F216 HydrophobicContact CG-CB 4.07Å; W81-F216 AromaticContact CG-CD2 3.65Å; W81-F216 HydrophobicContact CG-CD2 3.65Å; W81-F216 HydrophobicContact CG-CE2 4.35Å; W81-F216 AromaticContact CG-CG 3.98Å; W81-F216 HydrophobicContact CG-CG 3.98Å; W81-F216 HydrophobicContact CZ3-CD2 4.32Å; W81-F216 HydrophobicContact CZ3-CE2 4.44Å; F158-F216 HydrophobicContact CE1-CD1 4.43Å; F158-F216 AromaticContact CZ-CD1 3.85Å; F158-F216 HydrophobicContact CZ-CD1 3.85Å; R162-F216 VanDerWaalsContact CD-CD1 3.48Å; R162-F216 HydrophobicContact CG-CB 4.41Å; R162-F216 HydrophobicContact CG-CD1 3.96Å; R162-F216 VanDerWaalsContact CZ-CE1 3.46Å; T212-F216 PolarHBondContact O-N 3.34Å; G213-F216 WeakPolarHBondContact O-CB 3.17Å; G213-F216 PolarHBondContact O-N 3.28Å; G213-F216 VanDerWaalsContact O-N 3.12Å; F216-Q218 VanDerWaalsContact C-N 3.28Å; F216-Q218 PolarHBondContact O-N 3.48Å; F216-I219 PolarHBondContact O-N 2.98Å; F216-Q220 HydrophobicContact CD2-CB 4.18Å; F216-Q220 HydrophobicContact CE2-CB 4Å; F216-Q220 HydrophobicContact CE2-CG 4.34Å; F216-Q220 VanDerWaalsContact O-CB 3.24Å; F216-Q220 WeakPolarHBondContact O-CB 3.19Å; F216-Q220 PolarHBondContact O-N 3.44Å; F216-L245 HydrophobicContact CZ-CD1 4.4Å |
| 217 | G | 93.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -57.4 | -42 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | A166 G213 T221 | A166-G217 WeakPolarHBondContact CA-O 3.35Å; G213-G217 PolarHBondContact O-N 2.94Å; G217-T221 WeakPolarHBondContact O-CB 3.24Å; G217-T221 PolarHBondContact O-N 3.47Å; G217-T221 PolarHBondContact O-OG1 2.94Å |
| 218 | Q | 93.4 | Very high | 93 | Very high | 6 Ų | 6 | 11.9 Ų | 11.9 | 3% | 0.028 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -63.6 | -51 | 176.8 | -178.3 | -78.6 | -32.5 | 0 | 0 | 111.7 | G165 M185 A214 I215 F216 T221 A222 | G165-Q218 VanDerWaalsContact O-CA 3.28Å; G165-Q218 WeakPolarHBondContact O-CA 3.42Å; G165-Q218 PolarHBondContact O-N 3.26Å; M185-Q218 VanDerWaalsContact CB-OE1 3.24Å; M185-Q218 HydrophobicContact CG-CG 4.14Å; M185-Q218 VanDerWaalsContact CG-OE1 3.28Å; A214-Q218 PolarHBondContact O-N 2.89Å; A214-Q218 VanDerWaalsContact O-N 3.09Å; I215-Q218 PolarHBondContact O-N 3.18Å; F216-Q218 VanDerWaalsContact C-N 3.28Å; F216-Q218 PolarHBondContact O-N 3.48Å; Q218-T221 PolarHBondContact O-N 3.11Å; Q218-A222 WeakPolarHBondContact O-CB 3.39Å; Q218-A222 PolarHBondContact O-N 3.49Å |
| 219 | I | 91.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 9.8 Ų | 9.8 | 0% | 0 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -68.4 | -40 | -174 | -62.8 | 172.1 | 0 | 0 | 0 | 110.7 | W81 L182 M185 H186 I215 F216 A222 C223 | W81-I219 HydrophobicContact CH2-CB 3.76Å; W81-I219 HydrophobicContact CH2-CD1 4.14Å; W81-I219 HydrophobicContact CH2-CG2 2.95Å; W81-I219 HydrophobicContact CZ2-CB 3.9Å; W81-I219 HydrophobicContact CZ2-CD1 3.38Å; W81-I219 HydrophobicContact CZ2-CG1 4.2Å; W81-I219 HydrophobicContact CZ2-CG2 3.42Å; W81-I219 VanDerWaalsContact CZ2-CG2 3.42Å; W81-I219 HydrophobicContact CZ3-CB 4.14Å; W81-I219 HydrophobicContact CZ3-CG2 3.58Å; L182-I219 HydrophobicContact CD2-CB 4.3Å; L182-I219 HydrophobicContact CD2-CG2 3.59Å; M185-I219 HydrophobicContact CB-CD1 4.24Å; M185-I219 HydrophobicContact CB-CG1 4.07Å; H186-I219 HydrophobicContact CB-CD1 4.16Å; I215-I219 HydrophobicContact CG2-CD1 3.64Å; I215-I219 HydrophobicContact CG2-CG1 4.36Å; I215-I219 VanDerWaalsContact O-CG1 3.31Å; I215-I219 WeakPolarHBondContact O-CG1 3.49Å; I215-I219 PolarHBondContact O-N 2.87Å; F216-I219 PolarHBondContact O-N 2.98Å; I219-A222 PolarHBondContact O-N 3.09Å; I219-C223 VanDerWaalsContact O-CB 3.29Å; I219-C223 WeakPolarHBondContact O-CB 3.39Å; I219-C223 PolarHBondContact O-N 3.44Å; I219-C223 PolarHBondContact O-SG 2.88Å |
| 220 | Q | 90.8 | Very high | 92.4 | Very high | 22 Ų | 22 | 10.1 Ų | 10.1 | 10% | 0.103 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -57.8 | -51.5 | 176.9 | -173 | 178 | 5.9 | 0 | 0 | 110.4 | F216 A222 C223 M224 I484 | F216-Q220 HydrophobicContact CD2-CB 4.18Å; F216-Q220 HydrophobicContact CE2-CB 4Å; F216-Q220 HydrophobicContact CE2-CG 4.34Å; F216-Q220 VanDerWaalsContact O-CB 3.24Å; F216-Q220 WeakPolarHBondContact O-CB 3.19Å; F216-Q220 PolarHBondContact O-N 3.44Å; Q220-A222 PolarHBondContact O-N 3.01Å; Q220-C223 PolarHBondContact O-N 2.9Å; Q220-M224 WeakPolarHBondContact O-CB 3.41Å; Q220-M224 VanDerWaalsContact O-CG 3.28Å; Q220-M224 WeakPolarHBondContact O-CG 3.48Å; Q220-M224 PolarHBondContact O-N 3.47Å; Q220-I484 HydrophobicContact CG-CD1 4.06Å |
| 221 | T | 92.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 6.5 Ų | 6.5 | 0% | 0 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -60.6 | -46.7 | 178.4 | -62.8 | 0 | 0 | 0 | 0 | 112.3 | G217 Q218 M224 T225 G477 F480 | G217-T221 WeakPolarHBondContact O-CB 3.24Å; G217-T221 PolarHBondContact O-N 3.47Å; G217-T221 PolarHBondContact O-OG1 2.94Å; Q218-T221 PolarHBondContact O-N 3.11Å; T221-M224 PolarHBondContact O-N 2.58Å; T221-T225 WeakPolarHBondContact O-CB 3.26Å; T221-T225 PolarHBondContact O-N 3.04Å; T221-T225 VanDerWaalsContact O-N 3.09Å; T221-T225 PolarHBondContact O-OG1 3.16Å; T221-G477 WeakPolarHBondContact CG2-O 3.29Å; T221-F480 HydrophobicContact CG2-CB 4.12Å |
| 222 | A | 92.7 | Very high | 90.9 | Very high | 0 Ų | 0 | 4.4 Ų | 4.4 | 0% | 0 | 3% | 0.027 | C | C | . | . | H | α-helix | trans | -64.6 | -44 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L182 Q218 I219 Q220 T225 L226 | L182-A222 HydrophobicContact CD2-CB 3.65Å; L182-A222 HydrophobicContact CG-CB 4.18Å; Q218-A222 WeakPolarHBondContact O-CB 3.39Å; Q218-A222 PolarHBondContact O-N 3.49Å; I219-A222 PolarHBondContact O-N 3.09Å; Q220-A222 PolarHBondContact O-N 3.01Å; A222-T225 PolarHBondContact O-N 3.45Å; A222-L226 VanDerWaalsContact O-CB 3.3Å; A222-L226 WeakPolarHBondContact O-CB 3.26Å; A222-L226 PolarHBondContact O-N 3.35Å |
| 223 | C | 91.4 | Very high | 90 | Very high | 1 Ų | 1 | 4.5 Ų | 4.5 | 1% | 0.007 | 3% | 0.028 | C | C | . | . | H | α-helix | trans | -63.2 | -44.1 | 176 | -73 | 0 | 0 | 0 | 0 | 111.6 | T74 I219 Q220 T225 L226 L227 | T74-C223 HydrophobicContact CG2-CB 3.67Å; I219-C223 VanDerWaalsContact O-CB 3.29Å; I219-C223 WeakPolarHBondContact O-CB 3.39Å; I219-C223 PolarHBondContact O-N 3.44Å; I219-C223 PolarHBondContact O-SG 2.88Å; Q220-C223 PolarHBondContact O-N 2.9Å; C223-T225 VanDerWaalsContact C-N 3.29Å; C223-T225 PolarHBondContact O-N 3.34Å; C223-L226 PolarHBondContact O-N 2.97Å; C223-L227 WeakPolarHBondContact O-CB 3.16Å; C223-L227 VanDerWaalsContact O-CG 3.23Å; C223-L227 WeakPolarHBondContact O-CG 3.22Å; C223-L227 PolarHBondContact O-N 3.06Å |
| 224 | M | 90.1 | Very high | 88.9 | Confident | 8 Ų | 8 | 7.5 Ų | 7.5 | 4% | 0.039 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -60.3 | -45.8 | -178.7 | -75.3 | -36.4 | 89.6 | 0 | 0 | 110.3 | T74 Q220 T221 T228 A243 F480 | T74-M224 HydrophobicContact CG2-CE 4.22Å; Q220-M224 WeakPolarHBondContact O-CB 3.41Å; Q220-M224 VanDerWaalsContact O-CG 3.28Å; Q220-M224 WeakPolarHBondContact O-CG 3.48Å; Q220-M224 PolarHBondContact O-N 3.47Å; T221-M224 PolarHBondContact O-N 2.58Å; M224-T228 WeakPolarHBondContact O-CB 3.44Å; M224-T228 VanDerWaalsContact O-CG2 3.27Å; M224-T228 WeakPolarHBondContact O-CG2 3.3Å; M224-T228 PolarHBondContact O-N 3.29Å; M224-T228 PolarHBondContact O-OG1 3.37Å; M224-A243 HydrophobicContact CE-CB 3.02Å; M224-A243 HydrophobicContact SD-CB 3.17Å; M224-A243 WeakPolarHBondContact SD-CB 3.43Å; M224-F480 HydrophobicContact CB-CD1 4.21Å; M224-F480 HydrophobicContact CB-CD2 4.1Å; M224-F480 HydrophobicContact CB-CE1 4.31Å; M224-F480 HydrophobicContact CB-CE2 4.18Å; M224-F480 HydrophobicContact CB-CG 4.11Å; M224-F480 HydrophobicContact CB-CZ 4.28Å |
| 225 | T | 92.1 | Very high | 88.2 | Confident | 0 Ų | 0 | 11.1 Ų | 11.1 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -66.7 | -46 | -178.5 | -46.9 | 0 | 0 | 0 | 0 | 111.1 | T221 A222 C223 T228 E229 R476 G477 | T221-T225 WeakPolarHBondContact O-CB 3.26Å; T221-T225 PolarHBondContact O-N 3.04Å; T221-T225 VanDerWaalsContact O-N 3.09Å; T221-T225 PolarHBondContact O-OG1 3.16Å; A222-T225 PolarHBondContact O-N 3.45Å; C223-T225 VanDerWaalsContact C-N 3.29Å; C223-T225 PolarHBondContact O-N 3.34Å; T225-T228 PolarHBondContact O-OG1 2.89Å; T225-T228 VanDerWaalsContact O-OG1 3.12Å; T225-E229 WeakPolarHBondContact CG2-OE2 3.36Å; T225-E229 WeakPolarHBondContact O-CB 3.3Å; T225-E229 WeakPolarHBondContact O-CG 3.39Å; T225-E229 PolarHBondContact O-N 3.45Å; T225-R476 HydrophobicContact CG2-CB 4.12Å; T225-R476 HydrophobicContact CG2-CG 4.16Å; T225-G477 VanDerWaalsContact OG1-CA 3.24Å; T225-G477 WeakPolarHBondContact OG1-CA 3.4Å |
| 226 | L | 91.9 | Very high | 87.7 | Confident | 1 Ų | 1 | 11.3 Ų | 11.3 | 1% | 0.005 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -63.1 | -45.2 | 178.8 | -176.8 | 64.1 | 0 | 0 | 0 | 112.4 | R178 T179 L182 A222 C223 E229 S230 F283 | R178-L226 HydrophobicContact CB-CB 4.44Å; R178-L226 HydrophobicContact CB-CD1 4.4Å; T179-L226 HydrophobicContact CG2-CD2 4.06Å; L182-L226 HydrophobicContact CD1-CD2 4.19Å; A222-L226 VanDerWaalsContact O-CB 3.3Å; A222-L226 WeakPolarHBondContact O-CB 3.26Å; A222-L226 PolarHBondContact O-N 3.35Å; C223-L226 PolarHBondContact O-N 2.97Å; L226-E229 PolarHBondContact O-N 2.71Å; L226-S230 WeakPolarHBondContact O-CB 3.47Å; L226-S230 PolarHBondContact O-N 3.3Å; L226-S230 PolarHBondContact O-OG 2.94Å; L226-F283 HydrophobicContact CD2-CD1 3.42Å; L226-F283 VanDerWaalsContact CD2-CD1 3.42Å; L226-F283 HydrophobicContact CD2-CE1 3.99Å; L226-F283 HydrophobicContact CD2-CG 4.37Å |
| 227 | L | 89.9 | Confident | 87.2 | Confident | 4 Ų | 4 | 12.2 Ų | 12.2 | 2% | 0.021 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -66.6 | -41.7 | -178.4 | -80.2 | 179.5 | 0 | 0 | 0 | 112.6 | C70 T74 C223 E229 S230 T231 P239 | C70-L227 HydrophobicContact CB-CD2 3.67Å; T74-L227 HydrophobicContact CG2-CD1 3.85Å; C223-L227 WeakPolarHBondContact O-CB 3.16Å; C223-L227 VanDerWaalsContact O-CG 3.23Å; C223-L227 WeakPolarHBondContact O-CG 3.22Å; C223-L227 PolarHBondContact O-N 3.06Å; L227-E229 VanDerWaalsContact C-N 3.25Å; L227-E229 PolarHBondContact O-N 2.92Å; L227-S230 PolarHBondContact O-N 2.81Å; L227-T231 PolarHBondContact O-OG1 3.1Å; L227-P239 HydrophobicContact CB-CB 3.63Å; L227-P239 HydrophobicContact CD1-CB 4.42Å; L227-P239 HydrophobicContact CD2-CB 4.37Å; L227-P239 HydrophobicContact CG-CB 4.37Å |
| 228 | T | 90.4 | Very high | 86.8 | Confident | 5 Ų | 5 | 14 Ų | 14 | 3% | 0.031 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -69.1 | -24.4 | 177.9 | 50.6 | 0 | 0 | 0 | 0 | 113 | M224 T225 I240 A468 F480 | M224-T228 WeakPolarHBondContact O-CB 3.44Å; M224-T228 VanDerWaalsContact O-CG2 3.27Å; M224-T228 WeakPolarHBondContact O-CG2 3.3Å; M224-T228 PolarHBondContact O-N 3.29Å; M224-T228 PolarHBondContact O-OG1 3.37Å; T225-T228 PolarHBondContact O-OG1 2.89Å; T225-T228 VanDerWaalsContact O-OG1 3.12Å; T228-I240 HydrophobicContact CG2-CD1 3.73Å; T228-I240 HydrophobicContact CG2-CG1 3.47Å; T228-I240 VanDerWaalsContact CG2-CG1 3.47Å; T228-A468 HydrophobicContact CG2-CB 3.97Å; T228-F480 HydrophobicContact CG2-CE2 4.38Å; T228-F480 HydrophobicContact CG2-CZ 4.09Å |
| 229 | E | 90.1 | Very high | 86.4 | Confident | 0 Ų | 0 | 13.7 Ų | 13.7 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -91.6 | -21.6 | 177.7 | -73.1 | -177.1 | 37.4 | 0 | 0 | 114.8 | R178 T225 L226 L227 T231 S286 R288 T473 R476 | R178-E229 VanDerWaalsContact CZ-CD 3.44Å; R178-E229 IonicContact CZ-OE1 2.79Å; R178-E229 VanDerWaalsContact CZ-OE1 3.31Å; R178-E229 IonicContact CZ-OE2 3.56Å; R178-E229 IonicContact NH1-OE1 3.48Å; R178-E229 PolarHBondContact NH1-OE1 3.12Å; R178-E229 IonicContact NH1-OE2 3.99Å; R178-E229 PolarHBondContact NH1-OE2 3.3Å; R178-E229 VanDerWaalsContact NH1-OE2 3.15Å; R178-E229 VanDerWaalsContact NH2-CD 3.26Å; R178-E229 IonicContact NH2-OE1 2.84Å; R178-E229 PolarHBondContact NH2-OE1 2.7Å; R178-E229 IonicContact NH2-OE2 3.72Å; R178-E229 PolarHBondContact NH2-OE2 3.31Å; T225-E229 WeakPolarHBondContact CG2-OE2 3.36Å; T225-E229 WeakPolarHBondContact O-CB 3.3Å; T225-E229 WeakPolarHBondContact O-CG 3.39Å; T225-E229 PolarHBondContact O-N 3.45Å; L226-E229 PolarHBondContact O-N 2.71Å; L227-E229 VanDerWaalsContact C-N 3.25Å; L227-E229 PolarHBondContact O-N 2.92Å; E229-T231 PolarHBondContact O-N 2.88Å; E229-S286 WeakPolarHBondContact CB-OG 3.41Å; E229-S286 PolarHBondContact OE1-OG 3.03Å; E229-R288 PolarHBondContact O-NE 2.92Å; E229-T473 WeakPolarHBondContact OE1-CG2 3.37Å; E229-R476 IonicContact OE2-CZ 3.59Å; E229-R476 IonicContact OE2-NH1 3.87Å; E229-R476 PolarHBondContact OE2-NH1 3.49Å |
| 230 | S | 85.6 | Confident | 86.2 | Confident | 8 Ų | 8 | 13.8 Ų | 13.8 | 6% | 0.056 | 8% | 0.075 | C | C | . | . | S | Bend | trans | -79.3 | -4.6 | 176.5 | -58.8 | 0 | 0 | 0 | 0 | 113.4 | Q67 L226 L227 | Q67-S230 PolarHBondContact NE2-O 2.74Å; L226-S230 WeakPolarHBondContact O-CB 3.47Å; L226-S230 PolarHBondContact O-N 3.3Å; L226-S230 PolarHBondContact O-OG 2.94Å; L227-S230 PolarHBondContact O-N 2.81Å |
| 231 | T | 84 | Confident | 86 | Confident | 1 Ų | 1 | 12.9 Ų | 12.9 | 1% | 0.006 | 7% | 0.071 | C | C | . | . | trans | -127.1 | 162.4 | 180 | 57.9 | 0 | 0 | 0 | 0 | 111.1 | F63 Q67 L227 E229 P239 | F63-T231 HydrophobicContact CD2-CG2 3.9Å; F63-T231 HydrophobicContact CE2-CG2 4.26Å; Q67-T231 HydrophobicContact CB-CG2 4.44Å; Q67-T231 HydrophobicContact CG-CG2 3.86Å; L227-T231 PolarHBondContact O-OG1 3.1Å; E229-T231 PolarHBondContact O-N 2.88Å; T231-P239 HydrophobicContact CG2-CG 3.44Å; T231-P239 VanDerWaalsContact CG2-CG 3.44Å; T231-P239 WeakPolarHBondContact OG1-CG 3.23Å | ||
| 232 | D | 79 | Confident | 85.5 | Confident | 4 Ų | 4 | 14.6 Ų | 14.6 | 2% | 0.021 | 8% | 0.083 | C | C | . | . | trans | -147.4 | 178.9 | 177.5 | -167.8 | 35.2 | 0 | 0 | 0 | 113.1 | E54 L57 I62 A234 Y235 R236 R288 | E54-D232 WeakPolarHBondContact CB-OD2 3.5Å; E54-D232 WeakPolarHBondContact CG-OD2 3.47Å; L57-D232 HydrophobicContact CB-CB 4.49Å; L57-D232 HydrophobicContact CD1-CB 4Å; I62-D232 VanDerWaalsContact CG2-C 3.48Å; I62-D232 HydrophobicContact CG2-CB 4.18Å; I62-D232 WeakPolarHBondContact CG2-O 3.31Å; D232-A234 PolarHBondContact O-N 3.36Å; D232-Y235 PolarHBondContact O-N 2.87Å; D232-R236 IonicContact OD1-CZ 2.66Å; D232-R236 VanDerWaalsContact OD1-CZ 3.29Å; D232-R236 IonicContact OD1-NE 3.41Å; D232-R236 PolarHBondContact OD1-NE 3.09Å; D232-R236 IonicContact OD1-NH2 3.42Å; D232-R236 PolarHBondContact OD1-NH2 2.71Å; D232-R288 IonicContact OD1-NH2 3.2Å | ||
| 233 | G | 74.6 | Confident | 85 | Confident | 6 Ų | 6 | 15 Ų | 15 | 6% | 0.062 | 9% | 0.086 | C | C | . | . | G | 310 helix | trans | 60.6 | -131.6 | 169.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y235 R236 | G233-Y235 PolarHBondContact O-N 3.47Å; G233-R236 WeakPolarHBondContact O-CG 3.46Å |
| 234 | A | 71.8 | Confident | 84.3 | Confident | 62 Ų | 62 | 15.2 Ų | 15.2 | 51% | 0.512 | 9% | 0.087 | S | C | . | . | G | 310 helix | trans | -69.9 | -17.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | D232 | D232-A234 PolarHBondContact O-N 3.36Š|
| 235 | Y | 81.1 | Confident | 83.4 | Confident | 98 Ų | 98 | 15.6 Ų | 15.6 | 38% | 0.384 | 9% | 0.089 | S | C | . | . | G | 310 helix | trans | -94.9 | -0.2 | -173.6 | -62.3 | -79.6 | 0 | 0 | 0 | 114 | I62 F63 D232 G233 Y237 L238 P239 M403 | I62-Y235 HydrophobicContact CB-CD2 4.19Å; I62-Y235 HydrophobicContact CG2-CD2 3.75Å; F63-Y235 HydrophobicContact CB-CD1 4.16Å; F63-Y235 HydrophobicContact CB-CD2 4.25Å; F63-Y235 HydrophobicContact CB-CG 3.97Å; F63-Y235 HydrophobicContact CG-CD1 4.39Å; F63-Y235 HydrophobicContact CG-CG 4.47Å; D232-Y235 PolarHBondContact O-N 2.87Å; G233-Y235 PolarHBondContact O-N 3.47Å; Y235-Y237 PolarHBondContact O-N 3.44Å; Y235-L238 WeakPolarHBondContact O-CB 3.44Å; Y235-L238 PolarHBondContact O-N 2.66Å; Y235-P239 WeakPolarHBondContact O-CD 3.24Å; Y235-M403 HydrophobicContact CE1-SD 4.42Å |
| 236 | R | 82.9 | Confident | 82.5 | Confident | 10 Ų | 10 | 15.7 Ų | 15.7 | 4% | 0.038 | 9% | 0.09 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.6 | -19.9 | -179.7 | -69.2 | -179.7 | -173.7 | 168.5 | 3.7 | 114.7 | D232 G233 R538 L540 | D232-R236 IonicContact OD1-CZ 2.66Å; D232-R236 VanDerWaalsContact OD1-CZ 3.29Å; D232-R236 IonicContact OD1-NE 3.41Å; D232-R236 PolarHBondContact OD1-NE 3.09Å; D232-R236 IonicContact OD1-NH2 3.42Å; D232-R236 PolarHBondContact OD1-NH2 2.71Å; G233-R236 WeakPolarHBondContact O-CG 3.46Å; R236-R538 PolarHBondContact NH1-O 3.33Å; R236-R538 PolarHBondContact NH2-O 3.15Å; R236-L540 HydrophobicContact CG-CD1 4.43Å; R236-L540 VanDerWaalsContact NE-CD1 3.26Å |
| 237 | Y | 82.5 | Confident | 81.5 | Confident | 20 Ų | 20 | 17 Ų | 17 | 8% | 0.078 | 10% | 0.101 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.6 | -33.9 | 176.3 | -93 | -82.3 | 0 | 0 | 0 | 113.8 | Y235 A241 C410 L461 T462 H465 | Y235-Y237 PolarHBondContact O-N 3.44Å; Y237-A241 WeakPolarHBondContact O-CB 2.91Å; Y237-A241 PolarHBondContact O-N 2.8Å; Y237-C410 WeakPolarHBondContact CE2-SG 3.23Å; Y237-C410 WeakPolarHBondContact OH-CB 3.48Å; Y237-C410 PolarHBondContact OH-SG 2.93Å; Y237-L461 HydrophobicContact CD1-CD1 4.32Å; Y237-L461 HydrophobicContact CD1-CD2 3.97Å; Y237-L461 HydrophobicContact CD1-CG 3.98Å; Y237-L461 HydrophobicContact CE1-CD2 4.42Å; Y237-L461 HydrophobicContact CE1-CG 4.19Å; Y237-T462 HydrophobicContact CE1-CG2 4.48Å; Y237-H465 HydrophobicContact CD1-CB 4.48Å; Y237-H465 AromaticContact CD2-CE1 3.69Å; Y237-H465 AromaticContact CD2-ND1 3.9Å; Y237-H465 HydrophobicContact CE1-CB 3.87Å; Y237-H465 AromaticContact CE1-CG 3.74Å; Y237-H465 AromaticContact CE2-CD2 3.52Å; Y237-H465 AromaticContact CE2-CE1 3.41Å; Y237-H465 VanDerWaalsContact CE2-CE1 3.41Å; Y237-H465 WeakPolarHBondContact CE2-CE1 3.45Å; Y237-H465 AromaticContact CE2-CG 3.76Å; Y237-H465 AromaticContact CE2-ND1 3.71Å; Y237-H465 AromaticContact CE2-NE2 3.26Å; Y237-H465 VanDerWaalsContact CE2-NE2 3.26Å; Y237-H465 WeakPolarHBondContact CE2-NE2 3.27Å; Y237-H465 AromaticContact CZ-CD2 3.29Å; Y237-H465 AromaticContact CZ-CE1 3.9Å; Y237-H465 AromaticContact CZ-CG 3.4Å; Y237-H465 VanDerWaalsContact CZ-CG 3.4Å; Y237-H465 AromaticContact CZ-ND1 3.81Å; Y237-H465 AromaticContact CZ-NE2 3.61Å; Y237-H465 PolarHBondContact OH-CD2 3.5Å |
| 238 | L | 84.8 | Confident | 80.9 | Confident | 37 Ų | 37 | 16.8 Ų | 16.8 | 19% | 0.194 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -68.8 | -42.6 | -166.5 | -174.3 | 54.7 | 0 | 0 | 0 | 113.1 | F63 Y235 I240 A241 C242 I399 | F63-L238 HydrophobicContact CD1-CD2 4.02Å; F63-L238 HydrophobicContact CD2-CD2 4.17Å; F63-L238 HydrophobicContact CE1-CD2 3.41Å; F63-L238 VanDerWaalsContact CE1-CD2 3.41Å; F63-L238 HydrophobicContact CE1-CG 4.39Å; F63-L238 HydrophobicContact CE2-CB 4.24Å; F63-L238 HydrophobicContact CE2-CD2 3.6Å; F63-L238 HydrophobicContact CE2-CG 3.92Å; F63-L238 HydrophobicContact CG-CD2 4.37Å; F63-L238 HydrophobicContact CZ-CD2 3.19Å; F63-L238 HydrophobicContact CZ-CG 3.71Å; Y235-L238 WeakPolarHBondContact O-CB 3.44Å; Y235-L238 PolarHBondContact O-N 2.66Å; L238-I240 VanDerWaalsContact C-N 3.33Å; L238-I240 PolarHBondContact O-N 3.41Å; L238-A241 WeakPolarHBondContact O-CB 3.21Å; L238-A241 PolarHBondContact O-N 3.13Å; L238-C242 PolarHBondContact O-N 3.18Å; L238-C242 PolarHBondContact O-SG 3.37Å; L238-I399 HydrophobicContact CD1-CD1 4.11Å; L238-I399 HydrophobicContact CD1-CG2 4.47Å |
| 239 | P | 85.1 | Confident | 80.4 | Confident | 1 Ų | 1 | 17.4 Ų | 17.4 | 1% | 0.006 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -67.8 | -34.6 | -179.2 | -17 | 28.9 | 0 | 0 | 0 | 113.3 | L227 T231 Y235 A241 C242 A243 | L227-P239 HydrophobicContact CB-CB 3.63Å; L227-P239 HydrophobicContact CD1-CB 4.42Å; L227-P239 HydrophobicContact CD2-CB 4.37Å; L227-P239 HydrophobicContact CG-CB 4.37Å; T231-P239 HydrophobicContact CG2-CG 3.44Å; T231-P239 VanDerWaalsContact CG2-CG 3.44Å; T231-P239 WeakPolarHBondContact OG1-CG 3.23Å; Y235-P239 WeakPolarHBondContact O-CD 3.24Å; P239-A241 VanDerWaalsContact C-N 3.35Å; P239-C242 PolarHBondContact O-N 3.44Å; P239-A243 PolarHBondContact O-N 3.41Å |
| 240 | I | 87.2 | Confident | 80.1 | Confident | 1 Ų | 1 | 19.5 Ų | 19.5 | 1% | 0.005 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -66.2 | -43 | 174.3 | -54.1 | 177.4 | 0 | 0 | 0 | 109.3 | T228 L238 C242 A243 Q244 L461 L464 H465 A468 | T228-I240 HydrophobicContact CG2-CD1 3.73Å; T228-I240 HydrophobicContact CG2-CG1 3.47Å; T228-I240 VanDerWaalsContact CG2-CG1 3.47Å; L238-I240 VanDerWaalsContact C-N 3.33Å; L238-I240 PolarHBondContact O-N 3.41Å; I240-C242 PolarHBondContact O-N 3.09Å; I240-A243 WeakPolarHBondContact O-CB 3.49Å; I240-A243 PolarHBondContact O-N 2.91Å; I240-A243 VanDerWaalsContact O-N 3.11Å; I240-Q244 WeakPolarHBondContact O-CG 3.31Å; I240-Q244 PolarHBondContact O-N 2.93Å; I240-L461 HydrophobicContact CB-CD1 3.77Å; I240-L461 HydrophobicContact CG2-CD1 3.61Å; I240-L464 HydrophobicContact CG2-CB 3.69Å; I240-L464 HydrophobicContact CG2-CD1 4.13Å; I240-H465 HydrophobicContact CD1-CB 3.82Å; I240-A468 HydrophobicContact CD1-CB 4.21Å |
| 241 | A | 86.4 | Confident | 80 | Confident | 3 Ų | 3 | 22 Ų | 22 | 3% | 0.025 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61.1 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | Y237 L238 P239 A243 Q244 L395 I399 L461 | Y237-A241 WeakPolarHBondContact O-CB 2.91Å; Y237-A241 PolarHBondContact O-N 2.8Å; L238-A241 WeakPolarHBondContact O-CB 3.21Å; L238-A241 PolarHBondContact O-N 3.13Å; P239-A241 VanDerWaalsContact C-N 3.35Å; A241-A243 PolarHBondContact O-N 3.49Å; A241-Q244 WeakPolarHBondContact O-CB 3.21Å; A241-Q244 PolarHBondContact O-N 3.46Å; A241-L395 HydrophobicContact CB-CD1 3.66Å; A241-L395 HydrophobicContact CB-CD2 4.11Å; A241-L395 HydrophobicContact CB-CG 4.12Å; A241-L395 WeakPolarHBondContact O-CD2 2.94Å; A241-I399 HydrophobicContact CB-CD1 3.58Å; A241-I399 HydrophobicContact CB-CG1 4.13Å; A241-L461 HydrophobicContact CB-CD1 4.01Å; A241-L461 HydrophobicContact CB-CD2 4.44Å |
| 242 | C | 82.4 | Confident | 79.9 | Confident | 37 Ų | 37 | 22 Ų | 22 | 25% | 0.25 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -60.4 | -29.3 | 175.5 | -68.3 | 0 | 0 | 0 | 0 | 112.4 | C71 L238 P239 I240 | C71-C242 HydrophobicContact CB-CB 3.7Å; L238-C242 PolarHBondContact O-N 3.18Å; L238-C242 PolarHBondContact O-SG 3.37Å; P239-C242 PolarHBondContact O-N 3.44Å; I240-C242 PolarHBondContact O-N 3.09Å |
| 243 | A | 81.3 | Confident | 80.1 | Confident | 9 Ų | 9 | 22.2 Ų | 22.2 | 7% | 0.074 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -80.8 | -13.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | M224 P239 I240 A241 L245 | M224-A243 HydrophobicContact CE-CB 3.02Å; M224-A243 HydrophobicContact SD-CB 3.17Å; M224-A243 WeakPolarHBondContact SD-CB 3.43Å; P239-A243 PolarHBondContact O-N 3.41Å; I240-A243 WeakPolarHBondContact O-CB 3.49Å; I240-A243 PolarHBondContact O-N 2.91Å; I240-A243 VanDerWaalsContact O-N 3.11Å; A241-A243 PolarHBondContact O-N 3.49Å; A243-L245 PolarHBondContact O-N 3.39Å |
| 244 | Q | 78 | Confident | 80.7 | Confident | 5 Ų | 5 | 26.5 Ų | 26.5 | 2% | 0.023 | 15% | 0.15 | C | C | . | . | S | Bend | trans | -74.4 | 15.8 | -174.9 | -75.5 | -161.7 | -46.1 | 0 | 0 | 115.6 | I240 A241 S246 R391 S457 H460 | I240-Q244 WeakPolarHBondContact O-CG 3.31Å; I240-Q244 PolarHBondContact O-N 2.93Å; A241-Q244 WeakPolarHBondContact O-CB 3.21Å; A241-Q244 PolarHBondContact O-N 3.46Å; Q244-S246 PolarHBondContact O-N 3.37Å; Q244-S246 PolarHBondContact O-OG 2.9Å; Q244-R391 PolarHBondContact O-NE 3.47Å; Q244-R391 VanDerWaalsContact O-NE 3.09Å; Q244-R391 PolarHBondContact O-NH2 2.93Å; Q244-S457 PolarHBondContact NE2-O 3.13Å; Q244-S457 PolarHBondContact OE1-O 3.42Å; Q244-S457 VanDerWaalsContact OE1-O 3.13Å; Q244-H460 PolarHBondContact NE2-ND1 3.06Å |
| 245 | L | 70.7 | Confident | 81.4 | Confident | 15 Ų | 15 | 24.1 Ų | 24.1 | 8% | 0.079 | 13% | 0.128 | C | C | . | . | trans | 58.4 | 11.5 | 171.4 | -71.5 | 163.4 | 0 | 0 | 0 | 115.2 | A78 F82 F216 A243 A247 A248 Y249 | A78-L245 HydrophobicContact CB-CD2 3.24Å; A78-L245 HydrophobicContact CB-CG 4.05Å; A78-L245 VanDerWaalsContact O-CD2 3.29Å; A78-L245 WeakPolarHBondContact O-CD2 3.18Å; F82-L245 HydrophobicContact CB-CD1 3.83Å; F82-L245 HydrophobicContact CB-CD2 3.86Å; F82-L245 HydrophobicContact CB-CG 4.47Å; F82-L245 HydrophobicContact CD2-CD1 3.51Å; F82-L245 HydrophobicContact CE2-CD1 4.27Å; F82-L245 HydrophobicContact CG-CD1 3.78Å; F82-L245 HydrophobicContact CG-CD2 4.4Å; F216-L245 HydrophobicContact CZ-CD1 4.4Å; A243-L245 PolarHBondContact O-N 3.39Å; L245-A247 PolarHBondContact O-N 3.32Å; L245-A248 HydrophobicContact CB-CB 4.28Å; L245-A248 HydrophobicContact CD2-CB 3.93Å; L245-A248 WeakPolarHBondContact O-CA 3.38Å; L245-A248 WeakPolarHBondContact O-CB 3.43Å; L245-A248 PolarHBondContact O-N 2.94Å; L245-Y249 WeakPolarHBondContact O-CD2 3.43Å; L245-Y249 PolarHBondContact O-N 3.32Å | ||
| 246 | S | 72.9 | Confident | 81.4 | Confident | 3 Ų | 3 | 20 Ų | 20 | 2% | 0.021 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -62.9 | -45.3 | -166.7 | -55.6 | 0 | 0 | 0 | 0 | 113.9 | Q244 A248 R391 L395 | Q244-S246 PolarHBondContact O-N 3.37Å; Q244-S246 PolarHBondContact O-OG 2.9Å; S246-A248 PolarHBondContact O-N 3.45Å; S246-R391 WeakPolarHBondContact OG-CG 3.47Å; S246-R391 PolarHBondContact OG-NE 2.84Å; S246-L395 WeakPolarHBondContact OG-CD2 3.27Å |
| 247 | A | 70.5 | Confident | 81.4 | Confident | 28 Ų | 28 | 27.1 Ų | 27.1 | 23% | 0.231 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -73 | -17.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113 | F75 L245 Y249 V250 L251 L392 | F75-A247 HydrophobicContact CE1-CB 4.25Å; F75-A247 HydrophobicContact CE2-CB 3.57Å; F75-A247 HydrophobicContact CZ-CB 3.24Å; L245-A247 PolarHBondContact O-N 3.32Å; A247-Y249 VanDerWaalsContact C-N 3.3Å; A247-Y249 PolarHBondContact O-N 3.36Å; A247-V250 PolarHBondContact O-N 2.95Å; A247-L251 WeakPolarHBondContact O-CG 3.34Å; A247-L251 PolarHBondContact O-N 2.93Å; A247-L392 HydrophobicContact CB-CD1 4.03Å; A247-L392 HydrophobicContact CB-CD2 3.81Å; A247-L392 HydrophobicContact CB-CG 4.33Å |
| 248 | A | 77 | Confident | 81.6 | Confident | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -63.5 | -39 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | F75 I79 L245 S246 V250 L251 F252 | F75-A248 HydrophobicContact CE2-CB 4.46Å; I79-A248 HydrophobicContact CB-CB 4.45Å; I79-A248 HydrophobicContact CG1-CB 3.7Å; L245-A248 HydrophobicContact CB-CB 4.28Å; L245-A248 HydrophobicContact CD2-CB 3.93Å; L245-A248 WeakPolarHBondContact O-CA 3.38Å; L245-A248 WeakPolarHBondContact O-CB 3.43Å; L245-A248 PolarHBondContact O-N 2.94Å; S246-A248 PolarHBondContact O-N 3.45Å; A248-V250 VanDerWaalsContact C-N 3.33Å; A248-V250 PolarHBondContact O-N 3.24Å; A248-L251 CarbonylContact O-C 3.55Å; A248-L251 PolarHBondContact O-N 2.74Å; A248-L251 VanDerWaalsContact O-N 3.13Å; A248-F252 VanDerWaalsContact C-CE2 3.44Å; A248-F252 HydrophobicContact CB-CD2 4.3Å; A248-F252 HydrophobicContact CB-CE2 3.46Å; A248-F252 VanDerWaalsContact CB-CE2 3.46Å; A248-F252 HydrophobicContact CB-CZ 3.86Å; A248-F252 WeakPolarHBondContact O-CD2 3.33Å; A248-F252 VanDerWaalsContact O-CE2 3.31Å; A248-F252 WeakPolarHBondContact O-CE2 3.1Å; A248-F252 WeakPolarHBondContact O-CG 3.36Å; A248-F252 PolarHBondContact O-N 3.09Å |
| 249 | Y | 81.3 | Confident | 81.6 | Confident | 18 Ų | 18 | 31.4 Ų | 31.4 | 7% | 0.071 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -54.3 | -44.8 | 175.2 | -76.2 | -96.8 | 0 | 0 | 0 | 113.2 | F82 L245 A247 F252 A253 F384 A387 | F82-Y249 HydrophobicContact CE1-CD1 4.38Å; F82-Y249 HydrophobicContact CE1-CD2 4.48Å; F82-Y249 AromaticContact CE1-CE1 3.8Å; F82-Y249 HydrophobicContact CE1-CE1 3.8Å; F82-Y249 AromaticContact CE1-CE2 3.91Å; F82-Y249 HydrophobicContact CE1-CE2 3.91Å; F82-Y249 AromaticContact CE1-CZ 3.54Å; F82-Y249 AromaticContact CZ-CE1 3.92Å; F82-Y249 HydrophobicContact CZ-CE1 3.92Å; F82-Y249 AromaticContact CZ-CE2 3.99Å; F82-Y249 HydrophobicContact CZ-CE2 3.99Å; F82-Y249 AromaticContact CZ-CZ 3.39Å; F82-Y249 WeakPolarHBondContact CZ-OH 3.26Å; L245-Y249 WeakPolarHBondContact O-CD2 3.43Å; L245-Y249 PolarHBondContact O-N 3.32Å; A247-Y249 VanDerWaalsContact C-N 3.3Å; A247-Y249 PolarHBondContact O-N 3.36Å; Y249-F252 PolarHBondContact O-N 3.38Å; Y249-A253 PolarHBondContact O-N 3.47Å; Y249-A253 VanDerWaalsContact O-N 3.14Å; Y249-F384 AromaticContact CD1-CD1 3.68Å; Y249-F384 HydrophobicContact CD1-CD1 3.68Å; Y249-F384 AromaticContact CD1-CE1 3.85Å; Y249-F384 HydrophobicContact CD1-CE1 3.85Å; Y249-F384 HydrophobicContact CE1-CD1 4.42Å; Y249-F384 HydrophobicContact CE1-CE1 4.15Å; Y249-A387 HydrophobicContact CD1-CB 4.23Å |
| 250 | V | 83.2 | Confident | 81.4 | Confident | 44 Ų | 44 | 33.6 Ų | 33.6 | 27% | 0.267 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -66.9 | -42.6 | 177.8 | -179.7 | 0 | 0 | 0 | 0 | 110.8 | A247 A248 F252 A253 L254 L385 L392 | A247-V250 PolarHBondContact O-N 2.95Å; A248-V250 VanDerWaalsContact C-N 3.33Å; A248-V250 PolarHBondContact O-N 3.24Å; V250-F252 VanDerWaalsContact C-N 3.31Å; V250-F252 PolarHBondContact O-N 3.31Å; V250-A253 WeakPolarHBondContact O-CB 3.48Å; V250-A253 PolarHBondContact O-N 3.42Å; V250-L254 PolarHBondContact O-N 3.45Å; V250-L385 HydrophobicContact CG1-CD1 4.04Å; V250-L392 HydrophobicContact CG2-CD1 3.97Å |
| 251 | L | 83.7 | Confident | 81.2 | Confident | 61 Ų | 61 | 36.8 Ų | 36.8 | 32% | 0.319 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -64.8 | -35 | 177 | -67.5 | 172.5 | 0 | 0 | 0 | 111.8 | F75 I79 A247 A248 L254 I255 | F75-L251 HydrophobicContact CE1-CD1 4.22Å; F75-L251 HydrophobicContact CZ-CD1 4.28Å; I79-L251 HydrophobicContact CD1-CD1 3.45Å; I79-L251 VanDerWaalsContact CD1-CD1 3.45Å; A247-L251 WeakPolarHBondContact O-CG 3.34Å; A247-L251 PolarHBondContact O-N 2.93Å; A248-L251 CarbonylContact O-C 3.55Å; A248-L251 PolarHBondContact O-N 2.74Å; A248-L251 VanDerWaalsContact O-N 3.13Å; L251-L254 WeakPolarHBondContact O-CB 3.07Å; L251-L254 PolarHBondContact O-N 3.46Å; L251-I255 VanDerWaalsContact O-CG1 3.24Å; L251-I255 WeakPolarHBondContact O-CG1 3.22Å; L251-I255 PolarHBondContact O-N 3.02Å |
| 252 | F | 82.2 | Confident | 81.2 | Confident | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.6 | -42.8 | 174.4 | -62.6 | -47.9 | 0 | 0 | 0 | 112.3 | I79 F82 A83 V86 A248 Y249 V250 L254 I255 L256 Y265 | I79-F252 HydrophobicContact CB-CE1 4.32Å; I79-F252 HydrophobicContact CB-CZ 4.21Å; I79-F252 HydrophobicContact CG2-CD1 4.23Å; I79-F252 HydrophobicContact CG2-CE1 3.36Å; I79-F252 HydrophobicContact CG2-CZ 3.71Å; I79-F252 WeakPolarHBondContact O-CE1 3.28Å; I79-F252 WeakPolarHBondContact O-CZ 3.39Å; F82-F252 HydrophobicContact CB-CE2 4.19Å; F82-F252 HydrophobicContact CB-CZ 4.02Å; F82-F252 HydrophobicContact CD1-CD2 4.02Å; F82-F252 AromaticContact CD1-CE2 3.31Å; F82-F252 HydrophobicContact CD1-CE2 3.31Å; F82-F252 AromaticContact CD1-CZ 3.95Å; F82-F252 HydrophobicContact CD1-CZ 3.95Å; F82-F252 HydrophobicContact CE1-CD2 4.45Å; F82-F252 HydrophobicContact CE1-CE2 4.11Å; F82-F252 HydrophobicContact CG-CE2 4.19Å; F82-F252 HydrophobicContact CG-CZ 4.5Å; A83-F252 HydrophobicContact CB-CD1 4.39Å; A83-F252 HydrophobicContact CB-CE1 3.72Å; A83-F252 HydrophobicContact CB-CZ 4.34Å; V86-F252 HydrophobicContact CG2-CD2 4.37Å; A248-F252 VanDerWaalsContact C-CE2 3.44Å; A248-F252 HydrophobicContact CB-CD2 4.3Å; A248-F252 HydrophobicContact CB-CE2 3.46Å; A248-F252 VanDerWaalsContact CB-CE2 3.46Å; A248-F252 HydrophobicContact CB-CZ 3.86Å; A248-F252 WeakPolarHBondContact O-CD2 3.33Å; A248-F252 VanDerWaalsContact O-CE2 3.31Å; A248-F252 WeakPolarHBondContact O-CE2 3.1Å; A248-F252 WeakPolarHBondContact O-CG 3.36Å; A248-F252 PolarHBondContact O-N 3.09Å; Y249-F252 PolarHBondContact O-N 3.38Å; V250-F252 VanDerWaalsContact C-N 3.31Å; V250-F252 PolarHBondContact O-N 3.31Å; F252-L254 PolarHBondContact O-N 3.2Å; F252-I255 PolarHBondContact O-N 3.24Å; F252-L256 VanDerWaalsContact O-CB 3.28Å; F252-L256 WeakPolarHBondContact O-CB 3.38Å; F252-L256 VanDerWaalsContact O-CG 3.23Å; F252-L256 WeakPolarHBondContact O-CG 3.27Å; F252-L256 PolarHBondContact O-N 3.02Å; F252-Y265 HydrophobicContact CD1-CE2 4.39Å; F252-Y265 WeakPolarHBondContact CD1-OH 3.45Å |
| 253 | A | 82.9 | Confident | 81.6 | Confident | 8 Ų | 8 | 36.8 Ų | 36.8 | 7% | 0.066 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -55 | -43 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111 | Y249 V250 Y257 F384 L385 | Y249-A253 PolarHBondContact O-N 3.47Å; Y249-A253 VanDerWaalsContact O-N 3.14Å; V250-A253 WeakPolarHBondContact O-CB 3.48Å; V250-A253 PolarHBondContact O-N 3.42Å; A253-Y257 WeakPolarHBondContact O-CB 3.47Å; A253-Y257 PolarHBondContact O-N 3.49Å; A253-Y257 VanDerWaalsContact O-N 3.12Å; A253-F384 HydrophobicContact CB-CB 3.72Å; A253-L385 HydrophobicContact CB-CB 4.18Å |
| 254 | L | 85.8 | Confident | 82 | Confident | 96 Ų | 96 | 40.8 Ų | 40.8 | 50% | 0.503 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -66.5 | -48.1 | 177.2 | -178 | 63 | 0 | 0 | 0 | 112.3 | V250 L251 F252 Y257 L258 | V250-L254 PolarHBondContact O-N 3.45Å; L251-L254 WeakPolarHBondContact O-CB 3.07Å; L251-L254 PolarHBondContact O-N 3.46Å; F252-L254 PolarHBondContact O-N 3.2Å; L254-Y257 WeakPolarHBondContact O-CB 3.45Å; L254-Y257 PolarHBondContact O-N 3.3Å; L254-L258 HydrophobicContact CD1-CD1 4.21Å; L254-L258 HydrophobicContact CD1-CG 4.45Å; L254-L258 HydrophobicContact CG-CD1 4.11Å; L254-L258 VanDerWaalsContact O-CG 3.31Å; L254-L258 WeakPolarHBondContact O-CG 3.38Å; L254-L258 PolarHBondContact O-N 2.87Å; L254-L258 VanDerWaalsContact O-N 3.07Å |
| 255 | I | 86.5 | Confident | 82.5 | Confident | 12 Ų | 12 | 40.6 Ų | 40.6 | 6% | 0.062 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -65.3 | -44.7 | -178.9 | -62.1 | 163.3 | 0 | 0 | 0 | 110.4 | L251 F252 Y257 L258 T259 Y265 I268 V269 I272 | L251-I255 VanDerWaalsContact O-CG1 3.24Å; L251-I255 WeakPolarHBondContact O-CG1 3.22Å; L251-I255 PolarHBondContact O-N 3.02Å; F252-I255 PolarHBondContact O-N 3.24Å; I255-Y257 PolarHBondContact O-N 2.96Å; I255-L258 PolarHBondContact O-N 3.13Å; I255-L258 VanDerWaalsContact O-N 3.08Å; I255-T259 HydrophobicContact CG2-CG2 4.03Å; I255-T259 WeakPolarHBondContact O-CG2 3.43Å; I255-T259 PolarHBondContact O-N 3.29Å; I255-T259 PolarHBondContact O-OG1 2.92Å; I255-T259 VanDerWaalsContact O-OG1 3.1Å; I255-Y265 HydrophobicContact CB-CD2 4.32Å; I255-Y265 HydrophobicContact CB-CE2 4.23Å; I255-Y265 HydrophobicContact CG2-CD2 3.66Å; I255-Y265 HydrophobicContact CG2-CE2 3.97Å; I255-I268 HydrophobicContact CG2-CB 4.24Å; I255-I268 HydrophobicContact CG2-CG2 3.86Å; I255-V269 HydrophobicContact CD1-CG2 4.04Å; I255-V269 HydrophobicContact CG2-CG2 4.23Å; I255-I272 HydrophobicContact CD1-CD1 3.7Å; I255-I272 HydrophobicContact CG1-CD1 4.26Å |
| 256 | L | 82.4 | Confident | 83.5 | Confident | 11 Ų | 11 | 40 Ų | 40 | 6% | 0.058 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -56.4 | -40.8 | 175.9 | -73.5 | 169.6 | 0 | 0 | 0 | 111.3 | F134 F252 L258 A260 Y265 Y381 F384 | F134-L256 HydrophobicContact CD2-CD2 4.13Å; F134-L256 HydrophobicContact CE2-CD2 3.54Å; F134-L256 HydrophobicContact CZ-CD2 3.79Å; F252-L256 VanDerWaalsContact O-CB 3.28Å; F252-L256 WeakPolarHBondContact O-CB 3.38Å; F252-L256 VanDerWaalsContact O-CG 3.23Å; F252-L256 WeakPolarHBondContact O-CG 3.27Å; F252-L256 PolarHBondContact O-N 3.02Å; L256-L258 VanDerWaalsContact C-N 3.33Å; L256-A260 PolarHBondContact O-N 2.92Å; L256-Y265 HydrophobicContact CD2-CD2 3.51Å; L256-Y265 HydrophobicContact CD2-CE2 3.6Å; L256-Y265 HydrophobicContact CD2-CG 4.04Å; L256-Y265 HydrophobicContact CG-CD2 3.94Å; L256-Y265 HydrophobicContact CG-CE2 3.69Å; L256-Y381 VanDerWaalsContact C-CE1 3.49Å; L256-Y381 HydrophobicContact CB-CD1 4.17Å; L256-Y381 HydrophobicContact CB-CE1 3.87Å; L256-F384 HydrophobicContact CD1-CD2 4Å; L256-F384 HydrophobicContact CD1-CE2 4.27Å |
| 257 | Y | 83.4 | Confident | 84.4 | Confident | 160 Ų | 160 | 43.3 Ų | 43.3 | 63% | 0.627 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -66.1 | -36.6 | 178.4 | 179.2 | -100.5 | 0 | 0 | 0 | 112.1 | A253 L254 I255 Y381 | A253-Y257 WeakPolarHBondContact O-CB 3.47Å; A253-Y257 PolarHBondContact O-N 3.49Å; A253-Y257 VanDerWaalsContact O-N 3.12Å; L254-Y257 WeakPolarHBondContact O-CB 3.45Å; L254-Y257 PolarHBondContact O-N 3.3Å; I255-Y257 PolarHBondContact O-N 2.96Å; Y257-Y381 HydrophobicContact CD2-CD1 4.47Å; Y257-Y381 HydrophobicContact CD2-CE1 4.43Å; Y257-Y381 VanDerWaalsContact N-CE1 3.34Å |
| 258 | L | 86.5 | Confident | 85.3 | Confident | 124 Ų | 124 | 45 Ų | 45 | 65% | 0.649 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -80 | -31.6 | -178.6 | -67.4 | 172.7 | 0 | 0 | 0 | 113.9 | L254 I255 L256 | L254-L258 HydrophobicContact CD1-CD1 4.21Å; L254-L258 HydrophobicContact CD1-CG 4.45Å; L254-L258 HydrophobicContact CG-CD1 4.11Å; L254-L258 VanDerWaalsContact O-CG 3.31Å; L254-L258 WeakPolarHBondContact O-CG 3.38Å; L254-L258 PolarHBondContact O-N 2.87Å; L254-L258 VanDerWaalsContact O-N 3.07Å; I255-L258 PolarHBondContact O-N 3.13Å; I255-L258 VanDerWaalsContact O-N 3.08Å; L256-L258 VanDerWaalsContact C-N 3.33Å |
| 259 | T | 84.2 | Confident | 85.9 | Confident | 23 Ų | 23 | 45.1 Ų | 45.1 | 14% | 0.141 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -96 | -31.4 | -172.1 | 60.1 | 0 | 0 | 0 | 0 | 114.4 | I255 E261 M264 Y265 I268 | I255-T259 HydrophobicContact CG2-CG2 4.03Å; I255-T259 WeakPolarHBondContact O-CG2 3.43Å; I255-T259 PolarHBondContact O-N 3.29Å; I255-T259 PolarHBondContact O-OG1 2.92Å; I255-T259 VanDerWaalsContact O-OG1 3.1Å; T259-E261 PolarHBondContact O-N 2.92Å; T259-M264 HydrophobicContact CG2-CB 4.34Å; T259-Y265 WeakPolarHBondContact OG1-CA 3.4Å; T259-Y265 WeakPolarHBondContact OG1-CB 3.35Å; T259-I268 HydrophobicContact CG2-CB 4.13Å; T259-I268 HydrophobicContact CG2-CG1 3.68Å |
| 260 | A | 80.5 | Confident | 86.3 | Confident | 47 Ų | 47 | 45.3 Ų | 45.3 | 39% | 0.388 | 23% | 0.233 | S | C | . | . | trans | 53.1 | -6.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | F134 A135 L256 | F134-A260 CarbonylContact C-O 3.54Å; F134-A260 WeakPolarHBondContact CA-O 3.45Å; A135-A260 PolarHBondContact N-O 3.43Å; L256-A260 PolarHBondContact O-N 2.92Å | ||
| 261 | E | 84.5 | Confident | 86.5 | Confident | 68 Ų | 68 | 48.7 Ų | 48.7 | 32% | 0.318 | 25% | 0.249 | S | C | . | . | B | Isolated β-bridge | trans | -129.4 | 143.2 | 177.6 | -169.8 | -163.7 | 160.8 | 0 | 0 | 110.6 | A135 T259 R263 M264 Y265 | A135-E261 HydrophobicContact CB-CB 4.38Å; A135-E261 HydrophobicContact CB-CG 4.14Å; T259-E261 PolarHBondContact O-N 2.92Å; E261-R263 PolarHBondContact O-N 2.84Å; E261-M264 HydrophobicContact CB-CB 4.24Å; E261-M264 HydrophobicContact CB-CG 4.26Å; E261-M264 PolarHBondContact O-N 3.24Å; E261-M264 WeakPolarHBondContact OE2-CG 3.33Å; E261-Y265 VanDerWaalsContact O-CB 3.27Å; E261-Y265 WeakPolarHBondContact O-CB 3.25Å; E261-Y265 PolarHBondContact O-N 3.24Å |
| 262 | W | 85.9 | Confident | 86.7 | Confident | 3 Ų | 3 | 49.2 Ų | 49.2 | 1% | 0.011 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.3 | -37.1 | -177 | 81.2 | -93.6 | 0 | 0 | 0 | 114.5 | I87 F134 A135 L137 E140 W141 F205 Y265 L266 | I87-W262 HydrophobicContact CD1-CB 3.58Å; I87-W262 HydrophobicContact CD1-CE3 4.34Å; I87-W262 HydrophobicContact CG1-CB 4.47Å; F134-W262 HydrophobicContact CE1-CB 3.8Å; F134-W262 VanDerWaalsContact CZ-CA 3.46Å; F134-W262 HydrophobicContact CZ-CB 3.84Å; A135-W262 PolarHBondContact O-N 2.94Å; L137-W262 HydrophobicContact CB-CD2 4.34Å; L137-W262 HydrophobicContact CB-CG 4.43Å; E140-W262 VanDerWaalsContact OE2-CE2 3.23Å; E140-W262 VanDerWaalsContact OE2-CZ2 3.23Å; E140-W262 WeakPolarHBondContact OE2-CZ2 3.21Å; E140-W262 PolarHBondContact OE2-NE1 3Å; W141-W262 HydrophobicContact CH2-CH2 4.38Å; W141-W262 HydrophobicContact CH2-CZ2 4.47Å; W141-W262 HydrophobicContact CZ2-CZ2 4.38Å; F205-W262 HydrophobicContact CD2-CH2 4.42Å; F205-W262 HydrophobicContact CD2-CZ3 4.46Å; F205-W262 HydrophobicContact CE2-CH2 4.15Å; F205-W262 AromaticContact CE2-CZ3 3.75Å; F205-W262 HydrophobicContact CE2-CZ3 3.75Å; F205-W262 HydrophobicContact CZ-CZ3 4.21Å; W262-Y265 WeakPolarHBondContact O-CB 3.38Å; W262-L266 HydrophobicContact CE3-CD1 3.71Å; W262-L266 HydrophobicContact CE3-CG 4.47Å; W262-L266 HydrophobicContact CZ3-CD1 3.67Å; W262-L266 WeakPolarHBondContact O-CG 3.39Å; W262-L266 PolarHBondContact O-N 3.48Å; W262-L266 VanDerWaalsContact O-N 3.09Å |
| 263 | R | 90.4 | Very high | 86.8 | Confident | 37 Ų | 37 | 49.2 Ų | 49.2 | 14% | 0.14 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -69.2 | -48.2 | 176.6 | -64.6 | -173.9 | -176.9 | -97.4 | 1.9 | 110.9 | E140 I197 S199 E261 Y265 L266 I267 | E140-R263 IonicContact OE1-CZ 3.27Å; E140-R263 IonicContact OE1-NE 2.88Å; E140-R263 PolarHBondContact OE1-NE 3.26Å; E140-R263 IonicContact OE1-NH2 3.84Å; E140-R263 PolarHBondContact OE1-NH2 2.65Å; E140-R263 IonicContact OE2-CZ 3.94Å; E140-R263 IonicContact OE2-NE 3.15Å; E140-R263 PolarHBondContact OE2-NE 2.91Å; E140-R263 VanDerWaalsContact OE2-NE 3.15Å; E140-R263 IonicContact OE2-NH2 2.62Å; E140-R263 PolarHBondContact OE2-NH2 3.47Å; I197-R263 PolarHBondContact O-NH1 3.35Å; S199-R263 PolarHBondContact O-NH1 2.78Å; S199-R263 PolarHBondContact O-NH2 3.24Å; E261-R263 PolarHBondContact O-N 2.84Å; R263-Y265 VanDerWaalsContact C-N 3.27Å; R263-Y265 PolarHBondContact O-N 3.39Å; R263-L266 PolarHBondContact O-N 3.13Å; R263-L266 VanDerWaalsContact O-N 3.16Å; R263-I267 VanDerWaalsContact O-CG1 3.28Å; R263-I267 WeakPolarHBondContact O-CG1 2.99Å; R263-I267 PolarHBondContact O-N 3.48Å |
| 264 | M | 90.1 | Very high | 86.9 | Confident | 94 Ų | 94 | 49.9 Ų | 49.9 | 46% | 0.463 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -59.4 | -39.7 | 175.6 | -67.9 | -60.7 | 178 | 0 | 0 | 111.9 | T259 E261 I267 I268 | T259-M264 HydrophobicContact CG2-CB 4.34Å; E261-M264 HydrophobicContact CB-CB 4.24Å; E261-M264 HydrophobicContact CB-CG 4.26Å; E261-M264 PolarHBondContact O-N 3.24Å; E261-M264 WeakPolarHBondContact OE2-CG 3.33Å; M264-I267 PolarHBondContact O-N 2.87Å; M264-I267 HydrophobicContact SD-CD1 4.12Å; M264-I268 WeakPolarHBondContact O-CG1 3.48Å; M264-I268 PolarHBondContact O-N 3.05Å |
| 265 | Y | 88.9 | Confident | 86.8 | Confident | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -55.9 | -52.5 | 172.8 | 172.7 | -101.4 | 0 | 0 | 0 | 111.8 | A83 I87 F252 I255 L256 T259 E261 W262 R263 I267 I268 V269 | A83-Y265 WeakPolarHBondContact CA-OH 3.12Å; A83-Y265 HydrophobicContact CB-CE1 3.84Å; A83-Y265 WeakPolarHBondContact CB-OH 3.33Å; I87-Y265 HydrophobicContact CB-CE1 4.43Å; I87-Y265 HydrophobicContact CD1-CD1 3.8Å; I87-Y265 HydrophobicContact CD1-CE1 4.27Å; F252-Y265 HydrophobicContact CD1-CE2 4.39Å; F252-Y265 WeakPolarHBondContact CD1-OH 3.45Å; I255-Y265 HydrophobicContact CB-CD2 4.32Å; I255-Y265 HydrophobicContact CB-CE2 4.23Å; I255-Y265 HydrophobicContact CG2-CD2 3.66Å; I255-Y265 HydrophobicContact CG2-CE2 3.97Å; L256-Y265 HydrophobicContact CD2-CD2 3.51Å; L256-Y265 HydrophobicContact CD2-CE2 3.6Å; L256-Y265 HydrophobicContact CD2-CG 4.04Å; L256-Y265 HydrophobicContact CG-CD2 3.94Å; L256-Y265 HydrophobicContact CG-CE2 3.69Å; T259-Y265 WeakPolarHBondContact OG1-CA 3.4Å; T259-Y265 WeakPolarHBondContact OG1-CB 3.35Å; E261-Y265 VanDerWaalsContact O-CB 3.27Å; E261-Y265 WeakPolarHBondContact O-CB 3.25Å; E261-Y265 PolarHBondContact O-N 3.24Å; W262-Y265 WeakPolarHBondContact O-CB 3.38Å; R263-Y265 VanDerWaalsContact C-N 3.27Å; R263-Y265 PolarHBondContact O-N 3.39Å; Y265-I267 VanDerWaalsContact C-N 3.33Å; Y265-I267 PolarHBondContact O-N 3.47Å; Y265-I268 PolarHBondContact O-N 2.73Å; Y265-V269 HydrophobicContact CD2-CG2 4.35Å; Y265-V269 HydrophobicContact CE1-CG2 4.36Å; Y265-V269 HydrophobicContact CE2-CG2 4Å; Y265-V269 WeakPolarHBondContact O-CB 3.45Å; Y265-V269 VanDerWaalsContact O-CG2 3.26Å; Y265-V269 WeakPolarHBondContact O-CG2 3.48Å; Y265-V269 PolarHBondContact O-N 3.21Å |
| 266 | L | 90.3 | Very high | 86.5 | Confident | 3 Ų | 3 | 49.5 Ų | 49.5 | 2% | 0.016 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.7 | -33.8 | 179 | -69.2 | -179.8 | 0 | 0 | 0 | 112.9 | I87 I197 F205 W262 R263 S270 | I87-L266 HydrophobicContact CD1-CD2 4.46Å; I87-L266 HydrophobicContact CD1-CG 4.27Å; I197-L266 HydrophobicContact CD1-CB 3.76Å; I197-L266 HydrophobicContact CG1-CB 3.59Å; I197-L266 HydrophobicContact CG1-CD1 4.07Å; F205-L266 HydrophobicContact CE2-CD1 4.46Å; W262-L266 HydrophobicContact CE3-CD1 3.71Å; W262-L266 HydrophobicContact CE3-CG 4.47Å; W262-L266 HydrophobicContact CZ3-CD1 3.67Å; W262-L266 WeakPolarHBondContact O-CG 3.39Å; W262-L266 PolarHBondContact O-N 3.48Å; W262-L266 VanDerWaalsContact O-N 3.09Å; R263-L266 PolarHBondContact O-N 3.13Å; R263-L266 VanDerWaalsContact O-N 3.16Å; L266-S270 WeakPolarHBondContact O-CB 3.43Å; L266-S270 PolarHBondContact O-N 2.95Å; L266-S270 PolarHBondContact O-OG 3.35Å |
| 267 | I | 91.7 | Very high | 86.5 | Confident | 72 Ų | 72 | 50.7 Ų | 50.7 | 37% | 0.369 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63 | -52.9 | 175 | -69.6 | 166.3 | 0 | 0 | 0 | 110.3 | I197 R263 M264 Y265 V269 S270 L271 | I197-I267 HydrophobicContact CD1-CG1 4.05Å; I197-I267 HydrophobicContact CG2-CD1 4.05Å; I197-I267 HydrophobicContact CG2-CG1 3.72Å; R263-I267 VanDerWaalsContact O-CG1 3.28Å; R263-I267 WeakPolarHBondContact O-CG1 2.99Å; R263-I267 PolarHBondContact O-N 3.48Å; M264-I267 PolarHBondContact O-N 2.87Å; M264-I267 HydrophobicContact SD-CD1 4.12Å; Y265-I267 VanDerWaalsContact C-N 3.33Å; Y265-I267 PolarHBondContact O-N 3.47Å; I267-V269 PolarHBondContact O-N 2.99Å; I267-S270 PolarHBondContact O-N 2.73Å; I267-S270 VanDerWaalsContact O-N 3.16Å; I267-L271 WeakPolarHBondContact O-CB 3.38Å; I267-L271 PolarHBondContact O-N 3.48Å |
| 268 | I | 90.7 | Very high | 86.5 | Confident | 65 Ų | 65 | 51.2 Ų | 51.2 | 33% | 0.333 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.5 | -45.3 | -178.7 | -67.3 | -60.4 | 0 | 0 | 0 | 110.8 | I255 T259 M264 Y265 S270 L271 I272 | I255-I268 HydrophobicContact CG2-CB 4.24Å; I255-I268 HydrophobicContact CG2-CG2 3.86Å; T259-I268 HydrophobicContact CG2-CB 4.13Å; T259-I268 HydrophobicContact CG2-CG1 3.68Å; M264-I268 WeakPolarHBondContact O-CG1 3.48Å; M264-I268 PolarHBondContact O-N 3.05Å; Y265-I268 PolarHBondContact O-N 2.73Å; I268-S270 VanDerWaalsContact C-N 3.28Å; I268-S270 PolarHBondContact O-N 2.67Å; I268-L271 PolarHBondContact O-N 3.43Å; I268-I272 HydrophobicContact CG2-CD1 3.83Å; I268-I272 HydrophobicContact CG2-CG1 4.38Å; I268-I272 VanDerWaalsContact O-CG1 3.31Å; I268-I272 WeakPolarHBondContact O-CG1 3.3Å; I268-I272 PolarHBondContact O-N 3.08Å |
| 269 | V | 88.8 | Confident | 86.5 | Confident | 1 Ų | 1 | 45.6 Ų | 45.6 | 1% | 0.006 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.9 | -42.3 | 175.4 | 168.7 | 0 | 0 | 0 | 0 | 111.4 | A80 A83 I255 Y265 I267 I272 S273 | A80-V269 VanDerWaalsContact CA-CG1 3.47Å; A80-V269 HydrophobicContact CB-CG1 4.16Å; A83-V269 HydrophobicContact CB-CB 4.26Å; A83-V269 HydrophobicContact CB-CG1 3.57Å; A83-V269 HydrophobicContact CB-CG2 3.95Å; I255-V269 HydrophobicContact CD1-CG2 4.04Å; I255-V269 HydrophobicContact CG2-CG2 4.23Å; Y265-V269 HydrophobicContact CD2-CG2 4.35Å; Y265-V269 HydrophobicContact CE1-CG2 4.36Å; Y265-V269 HydrophobicContact CE2-CG2 4Å; Y265-V269 WeakPolarHBondContact O-CB 3.45Å; Y265-V269 VanDerWaalsContact O-CG2 3.26Å; Y265-V269 WeakPolarHBondContact O-CG2 3.48Å; Y265-V269 PolarHBondContact O-N 3.21Å; I267-V269 PolarHBondContact O-N 2.99Å; V269-I272 PolarHBondContact O-N 2.62Å; V269-S273 PolarHBondContact O-N 3.02Å; V269-S273 VanDerWaalsContact O-N 3.14Å; V269-S273 PolarHBondContact O-OG 3.35Å |
| 270 | S | 88.9 | Confident | 86.7 | Confident | 22 Ų | 22 | 44.8 Ų | 44.8 | 15% | 0.154 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -65 | -40.9 | 178 | -61.9 | 0 | 0 | 0 | 0 | 111.8 | R193 L266 I267 I268 S273 A274 | R193-S270 PolarHBondContact NH1-OG 3.13Å; L266-S270 WeakPolarHBondContact O-CB 3.43Å; L266-S270 PolarHBondContact O-N 2.95Å; L266-S270 PolarHBondContact O-OG 3.35Å; I267-S270 PolarHBondContact O-N 2.73Å; I267-S270 VanDerWaalsContact O-N 3.16Å; I268-S270 VanDerWaalsContact C-N 3.28Å; I268-S270 PolarHBondContact O-N 2.67Å; S270-S273 PolarHBondContact O-N 3.27Å; S270-S273 PolarHBondContact O-OG 3.23Å; S270-A274 PolarHBondContact O-N 3.13Å |
| 271 | L | 88.8 | Confident | 87.2 | Confident | 116 Ų | 116 | 47.3 Ų | 47.3 | 61% | 0.607 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -64.6 | -43.3 | 176.3 | -174 | 61.4 | 0 | 0 | 0 | 112.3 | I267 I268 S273 A274 P275 | I267-L271 WeakPolarHBondContact O-CB 3.38Å; I267-L271 PolarHBondContact O-N 3.48Å; I268-L271 PolarHBondContact O-N 3.43Å; L271-S273 PolarHBondContact O-N 3.29Å; L271-A274 PolarHBondContact O-N 3.12Å; L271-P275 VanDerWaalsContact O-CD 3.24Å; L271-P275 WeakPolarHBondContact O-CD 3.29Å |
| 272 | I | 87.1 | Confident | 87.5 | Confident | 71 Ų | 71 | 47 Ų | 47 | 36% | 0.364 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -59.5 | -36.6 | 175.6 | -68.7 | 169.7 | 0 | 0 | 0 | 110.7 | I255 I268 V269 P275 | I255-I272 HydrophobicContact CD1-CD1 3.7Å; I255-I272 HydrophobicContact CG1-CD1 4.26Å; I268-I272 HydrophobicContact CG2-CD1 3.83Å; I268-I272 HydrophobicContact CG2-CG1 4.38Å; I268-I272 VanDerWaalsContact O-CG1 3.31Å; I268-I272 WeakPolarHBondContact O-CG1 3.3Å; I268-I272 PolarHBondContact O-N 3.08Å; V269-I272 PolarHBondContact O-N 2.62Å; I272-P275 WeakPolarHBondContact O-CD 3.45Å |
| 273 | S | 85 | Confident | 87.8 | Confident | 1 Ų | 1 | 47.3 Ų | 47.3 | 1% | 0.007 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -83.6 | -13.2 | -179.1 | 74.3 | 0 | 0 | 0 | 0 | 115.5 | A80 H186 R193 V269 S270 L271 L276 | A80-S273 WeakPolarHBondContact CB-OG 3.4Å; H186-S273 PolarHBondContact NE2-O 2.88Å; R193-S273 PolarHBondContact NH1-OG 3Å; R193-S273 PolarHBondContact NH2-OG 3.14Å; V269-S273 PolarHBondContact O-N 3.02Å; V269-S273 VanDerWaalsContact O-N 3.14Å; V269-S273 PolarHBondContact O-OG 3.35Å; S270-S273 PolarHBondContact O-N 3.27Å; S270-S273 PolarHBondContact O-OG 3.23Å; L271-S273 PolarHBondContact O-N 3.29Å; S273-L276 VanDerWaalsContact O-CB 3.28Å; S273-L276 WeakPolarHBondContact O-CB 3.15Å; S273-L276 WeakPolarHBondContact O-CG 3.38Å; S273-L276 PolarHBondContact O-N 3.43Å |
| 274 | A | 84.3 | Confident | 87.9 | Confident | 22 Ų | 22 | 47.5 Ų | 47.5 | 18% | 0.182 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -44.4 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113 | M190 S270 L271 L276 L277 | M190-A274 HydrophobicContact CE-CB 3.5Å; M190-A274 VanDerWaalsContact CE-CB 3.5Å; M190-A274 HydrophobicContact SD-CB 4.42Å; S270-A274 PolarHBondContact O-N 3.13Å; L271-A274 PolarHBondContact O-N 3.12Å; A274-L276 PolarHBondContact O-N 3.49Å; A274-L276 VanDerWaalsContact O-N 3.07Å; A274-L277 VanDerWaalsContact O-CB 3.31Å; A274-L277 WeakPolarHBondContact O-CB 3.35Å; A274-L277 PolarHBondContact O-N 3.43Å; A274-L277 VanDerWaalsContact O-N 3.12Å |
| 275 | P | 84.4 | Confident | 88 | Confident | 79 Ų | 79 | 44.1 Ų | 44.1 | 51% | 0.513 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -21.9 | 177.2 | -24.3 | 34.5 | 0 | 0 | 0 | 114 | L271 I272 L277 Y278 | L271-P275 VanDerWaalsContact O-CD 3.24Å; L271-P275 WeakPolarHBondContact O-CD 3.29Å; I272-P275 WeakPolarHBondContact O-CD 3.45Å; P275-L277 PolarHBondContact O-N 3.44Å; P275-Y278 WeakPolarHBondContact O-CB 3.37Å; P275-Y278 WeakPolarHBondContact O-CD2 3.42Å; P275-Y278 PolarHBondContact O-N 3.49Å; P275-Y278 VanDerWaalsContact O-N 3.13Å |
| 276 | L | 81 | Confident | 88.1 | Confident | 21 Ų | 21 | 44.1 Ų | 44.1 | 11% | 0.11 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -68.8 | -15.3 | -179.3 | -50.6 | 173.9 | 0 | 0 | 0 | 112.8 | F76 S77 S273 A274 Y278 G279 Y280 | F76-L276 HydrophobicContact CB-CD1 3.48Å; F76-L276 VanDerWaalsContact CB-CD1 3.48Å; F76-L276 HydrophobicContact CB-CD2 3.64Å; F76-L276 HydrophobicContact CB-CG 4.19Å; F76-L276 HydrophobicContact CG-CD2 4.44Å; F76-L276 WeakPolarHBondContact O-CD1 3.35Å; S77-L276 WeakPolarHBondContact OG-CB 3.46Å; S77-L276 WeakPolarHBondContact OG-CD1 3.22Å; S273-L276 VanDerWaalsContact O-CB 3.28Å; S273-L276 WeakPolarHBondContact O-CB 3.15Å; S273-L276 WeakPolarHBondContact O-CG 3.38Å; S273-L276 PolarHBondContact O-N 3.43Å; A274-L276 PolarHBondContact O-N 3.49Å; A274-L276 VanDerWaalsContact O-N 3.07Å; L276-Y278 PolarHBondContact O-N 2.89Å; L276-G279 VanDerWaalsContact O-CA 3.29Å; L276-G279 WeakPolarHBondContact O-CA 3.35Å; L276-G279 PolarHBondContact O-N 2.69Å; L276-Y280 WeakPolarHBondContact O-CD2 3.31Å; L276-Y280 PolarHBondContact O-N 3.24Å; L276-Y280 VanDerWaalsContact O-N 3.13Å |
| 277 | L | 81.2 | Confident | 88.1 | Confident | 36 Ų | 36 | 44.1 Ų | 44.1 | 19% | 0.188 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -55 | -43.1 | 169.1 | -177.7 | 63.5 | 0 | 0 | 0 | 111.4 | F183 S187 M190 A274 P275 G279 Y280 | F183-L277 HydrophobicContact CD2-CD1 3.56Å; F183-L277 HydrophobicContact CD2-CG 4.33Å; F183-L277 HydrophobicContact CE2-CD1 3.33Å; F183-L277 HydrophobicContact CE2-CD2 4.44Å; F183-L277 HydrophobicContact CE2-CG 3.76Å; F183-L277 HydrophobicContact CG-CD1 4.49Å; F183-L277 HydrophobicContact CZ-CD1 4.1Å; S187-L277 WeakPolarHBondContact OG-CD1 3.11Å; M190-L277 HydrophobicContact SD-CD2 4.48Å; A274-L277 VanDerWaalsContact O-CB 3.31Å; A274-L277 WeakPolarHBondContact O-CB 3.35Å; A274-L277 PolarHBondContact O-N 3.43Å; A274-L277 VanDerWaalsContact O-N 3.12Å; P275-L277 PolarHBondContact O-N 3.44Å; L277-G279 PolarHBondContact O-N 3.31Å; L277-Y280 PolarHBondContact O-N 3.4Å |
| 278 | Y | 83 | Confident | 88.1 | Confident | 170 Ų | 170 | 40.7 Ų | 40.7 | 67% | 0.667 | 21% | 0.21 | S | C | * | . | H | α-helix | trans | -66.7 | -30.1 | 174 | -61.6 | -72.1 | 0 | 0 | 0 | 111.9 | P275 L276 I281 | P275-Y278 WeakPolarHBondContact O-CB 3.37Å; P275-Y278 WeakPolarHBondContact O-CD2 3.42Å; P275-Y278 PolarHBondContact O-N 3.49Å; P275-Y278 VanDerWaalsContact O-N 3.13Å; L276-Y278 PolarHBondContact O-N 2.89Å; Y278-I281 HydrophobicContact CD1-CD1 4.36Å; Y278-I281 PolarHBondContact O-N 3Å |
| 279 | G | 87.5 | Confident | 88.1 | Confident | 7 Ų | 7 | 38 Ų | 38 | 7% | 0.072 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.6 | -47.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L276 L277 I281 L282 F283 | L276-G279 VanDerWaalsContact O-CA 3.29Å; L276-G279 WeakPolarHBondContact O-CA 3.35Å; L276-G279 PolarHBondContact O-N 2.69Å; L277-G279 PolarHBondContact O-N 3.31Å; G279-I281 VanDerWaalsContact C-N 3.3Å; G279-I281 PolarHBondContact O-N 2.96Å; G279-L282 PolarHBondContact O-N 3.44Å; G279-F283 VanDerWaalsContact O-CD2 3.25Å; G279-F283 WeakPolarHBondContact O-CD2 3.24Å |
| 280 | Y | 88.6 | Confident | 88.2 | Confident | 5 Ų | 5 | 38 Ų | 38 | 2% | 0.02 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -67.5 | -24.8 | -179.7 | -71.7 | -58.4 | 0 | 0 | 0 | 114.6 | V73 S77 W81 L182 H186 L276 L277 L282 F283 | V73-Y280 HydrophobicContact CG1-CD1 4.32Å; V73-Y280 HydrophobicContact CG1-CE1 4.08Å; V73-Y280 HydrophobicContact CG1-CE2 4.45Å; S77-Y280 WeakPolarHBondContact CB-OH 3.36Å; S77-Y280 WeakPolarHBondContact OG-CE2 3.48Å; S77-Y280 PolarHBondContact OG-OH 3.06Å; W81-Y280 VanDerWaalsContact CH2-OH 3.29Å; W81-Y280 WeakPolarHBondContact CH2-OH 3.16Å; L182-Y280 HydrophobicContact CB-CD1 3.79Å; L182-Y280 HydrophobicContact CB-CE1 4.17Å; L182-Y280 HydrophobicContact CB-CG 4.23Å; L182-Y280 HydrophobicContact CD1-CD1 4.03Å; L182-Y280 HydrophobicContact CD1-CE1 4.15Å; L182-Y280 HydrophobicContact CD2-CE1 4.28Å; L182-Y280 HydrophobicContact CG-CD1 4.39Å; L182-Y280 HydrophobicContact CG-CE1 4.45Å; H186-Y280 HydrophobicContact CB-CD2 3.97Å; H186-Y280 HydrophobicContact CB-CE2 4Å; H186-Y280 AromaticContact CD2-CD2 3.93Å; H186-Y280 AromaticContact CD2-CE2 3.97Å; H186-Y280 AromaticContact CG-CD2 3.9Å; H186-Y280 AromaticContact CG-CE2 3.69Å; H186-Y280 AromaticContact ND1-CE2 3.88Å; L276-Y280 WeakPolarHBondContact O-CD2 3.31Å; L276-Y280 PolarHBondContact O-N 3.24Å; L276-Y280 VanDerWaalsContact O-N 3.13Å; L277-Y280 PolarHBondContact O-N 3.4Å; Y280-L282 PolarHBondContact O-N 3.2Å; Y280-F283 HydrophobicContact CD1-CD1 4.06Å; Y280-F283 HydrophobicContact CD1-CD2 4.48Å; Y280-F283 AromaticContact CD1-CE1 4Å; Y280-F283 HydrophobicContact CD1-CE1 4Å; Y280-F283 HydrophobicContact CD1-CE2 4.41Å; Y280-F283 HydrophobicContact CD1-CG 4.33Å; Y280-F283 HydrophobicContact CD1-CZ 4.18Å; Y280-F283 HydrophobicContact CE1-CD1 4.44Å; Y280-F283 AromaticContact CE1-CE1 3.96Å; Y280-F283 HydrophobicContact CE1-CE1 3.96Å; Y280-F283 HydrophobicContact CE1-CZ 4.11Å; Y280-F283 WeakPolarHBondContact O-CB 3.15Å; Y280-F283 PolarHBondContact O-N 2.93Å |
| 281 | I | 89.7 | Confident | 88.3 | Confident | 100 Ų | 100 | 37.1 Ų | 37.1 | 51% | 0.513 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -65.7 | -31 | 175 | -61.7 | 173.5 | 0 | 0 | 0 | 110.9 | F183 Y278 G279 F283 | F183-I281 HydrophobicContact CD2-CD1 4.32Å; F183-I281 HydrophobicContact CD2-CG1 3.62Å; F183-I281 HydrophobicContact CE2-CD1 3.73Å; F183-I281 HydrophobicContact CE2-CG1 3.56Å; F183-I281 HydrophobicContact CZ-CD1 4.5Å; Y278-I281 HydrophobicContact CD1-CD1 4.36Å; Y278-I281 PolarHBondContact O-N 3Å; G279-I281 VanDerWaalsContact C-N 3.3Å; G279-I281 PolarHBondContact O-N 2.96Å; I281-F283 VanDerWaalsContact C-N 3.33Å |
| 282 | L | 91.1 | Very high | 88.3 | Confident | 62 Ų | 62 | 31.9 Ų | 31.9 | 33% | 0.325 | 16% | 0.162 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.2 | -6.8 | -178.6 | -61.9 | 177.7 | 0 | 0 | 0 | 113.3 | F69 G279 Y280 Q284 W311 | F69-L282 HydrophobicContact CE1-CB 3.8Å; F69-L282 HydrophobicContact CE1-CD1 4.47Å; F69-L282 HydrophobicContact CE2-CD1 4.33Å; F69-L282 HydrophobicContact CZ-CB 3.82Å; F69-L282 HydrophobicContact CZ-CD1 3.79Å; F69-L282 HydrophobicContact CZ-CG 4.38Å; G279-L282 PolarHBondContact O-N 3.44Å; Y280-L282 PolarHBondContact O-N 3.2Å; L282-Q284 PolarHBondContact O-N 2.77Å; L282-Q284 PolarHBondContact O-NE2 3.15Å; L282-W311 HydrophobicContact CB-CZ2 4.48Å |
| 283 | F | 91.7 | Very high | 88.4 | Confident | 10 Ų | 10 | 29.6 Ų | 29.6 | 4% | 0.044 | 15% | 0.15 | C | C | . | . | P | Polyproline II helix | trans | -67.5 | 130 | 178 | -84.3 | -145.4 | 0 | 0 | 0 | 110 | F69 C70 V73 T179 L182 L226 G279 Y280 I281 | F69-F283 HydrophobicContact CD1-CE2 4.41Å; F69-F283 AromaticContact CE1-CD2 3.97Å; F69-F283 HydrophobicContact CE1-CD2 3.97Å; F69-F283 AromaticContact CE1-CE2 3.94Å; F69-F283 HydrophobicContact CE1-CE2 3.94Å; C70-F283 HydrophobicContact CB-CE1 4.4Å; C70-F283 HydrophobicContact CB-CE2 4.16Å; C70-F283 HydrophobicContact CB-CZ 3.89Å; V73-F283 HydrophobicContact CB-CE2 3.75Å; V73-F283 HydrophobicContact CB-CZ 3.91Å; V73-F283 HydrophobicContact CG1-CE2 3.75Å; V73-F283 HydrophobicContact CG1-CZ 3.88Å; V73-F283 HydrophobicContact CG2-CE2 4.15Å; T179-F283 HydrophobicContact CG2-CB 3.92Å; L182-F283 HydrophobicContact CD1-CD1 3.8Å; L182-F283 HydrophobicContact CD1-CE1 4.2Å; L226-F283 HydrophobicContact CD2-CD1 3.42Å; L226-F283 VanDerWaalsContact CD2-CD1 3.42Å; L226-F283 HydrophobicContact CD2-CE1 3.99Å; L226-F283 HydrophobicContact CD2-CG 4.37Å; G279-F283 VanDerWaalsContact O-CD2 3.25Å; G279-F283 WeakPolarHBondContact O-CD2 3.24Å; Y280-F283 HydrophobicContact CD1-CD1 4.06Å; Y280-F283 HydrophobicContact CD1-CD2 4.48Å; Y280-F283 AromaticContact CD1-CE1 4Å; Y280-F283 HydrophobicContact CD1-CE1 4Å; Y280-F283 HydrophobicContact CD1-CE2 4.41Å; Y280-F283 HydrophobicContact CD1-CG 4.33Å; Y280-F283 HydrophobicContact CD1-CZ 4.18Å; Y280-F283 HydrophobicContact CE1-CD1 4.44Å; Y280-F283 AromaticContact CE1-CE1 3.96Å; Y280-F283 HydrophobicContact CE1-CE1 3.96Å; Y280-F283 HydrophobicContact CE1-CZ 4.11Å; Y280-F283 WeakPolarHBondContact O-CB 3.15Å; Y280-F283 PolarHBondContact O-N 2.93Å; I281-F283 VanDerWaalsContact C-N 3.33Å |
| 284 | Q | 92.4 | Very high | 88.5 | Confident | 40 Ų | 40 | 31.8 Ų | 31.8 | 19% | 0.187 | 17% | 0.165 | C | C | . | . | P | Polyproline II helix | trans | -89.7 | 146.7 | 170.3 | -57.1 | -57.4 | -47.8 | 0 | 0 | 110.2 | Y66 T179 L282 V302 E305 L306 | Y66-Q284 HydrophobicContact CE2-CB 4.37Å; Y66-Q284 HydrophobicContact CE2-CG 4.03Å; Y66-Q284 WeakPolarHBondContact OH-CA 3.25Å; Y66-Q284 WeakPolarHBondContact OH-CB 3.26Å; Y66-Q284 PolarHBondContact OH-N 3.42Å; Y66-Q284 PolarHBondContact OH-O 2.78Å; T179-Q284 WeakPolarHBondContact CG2-O 3.38Å; L282-Q284 PolarHBondContact O-N 2.77Å; L282-Q284 PolarHBondContact O-NE2 3.15Å; Q284-V302 HydrophobicContact CB-CG1 3.84Å; Q284-V302 HydrophobicContact CB-CG2 4.44Å; Q284-E305 HydrophobicContact CG-CG 4.17Å; Q284-L306 HydrophobicContact CG-CD2 4.25Å |
| 285 | E | 93.1 | Very high | 88.8 | Confident | 24 Ų | 24 | 34.3 Ų | 34.3 | 11% | 0.112 | 17% | 0.172 | C | C | . | . | P | Polyproline II helix | trans | -66 | 155.8 | 175.3 | -170.4 | 54.3 | -102.3 | 0 | 0 | 111.1 | R178 T179 P287 W289 L290 V302 | R178-E285 VanDerWaalsContact CB-OE1 3.25Å; R178-E285 WeakPolarHBondContact CB-OE1 3.22Å; R178-E285 VanDerWaalsContact CG-OE1 3.3Å; R178-E285 WeakPolarHBondContact CG-OE1 3.27Å; R178-E285 VanDerWaalsContact N-CD 3.31Å; R178-E285 PolarHBondContact N-OE1 2.86Å; R178-E285 PolarHBondContact N-OE2 3.28Å; T179-E285 HydrophobicContact CG2-CB 4.45Å; T179-E285 PolarHBondContact N-OE2 2.77Å; T179-E285 PolarHBondContact OG1-OE2 3.24Å; E285-P287 WeakPolarHBondContact O-CD 3.49Å; E285-W289 HydrophobicContact CG-CE3 3.77Å; E285-W289 HydrophobicContact CG-CZ3 3.99Å; E285-L290 HydrophobicContact CB-CD1 4.11Å; E285-L290 HydrophobicContact CB-CG 4.45Å; E285-L290 HydrophobicContact CG-CD1 4.2Å; E285-L290 HydrophobicContact CG-CD2 4.02Å; E285-L290 HydrophobicContact CG-CG 3.99Å; E285-V302 WeakPolarHBondContact O-CG1 3.4Å |
| 286 | S | 91.5 | Very high | 89.1 | Confident | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 16% | 0.157 | C | C | . | . | P | Polyproline II helix | trans | -65.4 | 124.4 | -179 | 168.3 | 0 | 0 | 0 | 0 | 111.6 | R178 E229 R288 W289 L290 | R178-S286 PolarHBondContact NH1-OG 3.38Å; E229-S286 WeakPolarHBondContact CB-OG 3.41Å; E229-S286 PolarHBondContact OE1-OG 3.03Å; S286-R288 VanDerWaalsContact C-N 3.25Å; S286-R288 PolarHBondContact O-N 3.49Å; S286-R288 PolarHBondContact OG-N 3.47Å; S286-W289 PolarHBondContact O-N 3.24Å; S286-W289 PolarHBondContact OG-N 2.93Å; S286-L290 WeakPolarHBondContact O-CG 3.28Å; S286-L290 PolarHBondContact O-N 3.01Å |
| 287 | P | 90.7 | Very high | 89.6 | Confident | 2 Ų | 2 | 33.7 Ų | 33.7 | 1% | 0.013 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -57.8 | -39 | 173.4 | -23.3 | 32.8 | 0 | 0 | 0 | 112.4 | E285 L290 L291 V302 I303 L306 | E285-P287 WeakPolarHBondContact O-CD 3.49Å; P287-L290 PolarHBondContact O-N 3.37Å; P287-L291 VanDerWaalsContact O-CG 3.22Å; P287-L291 WeakPolarHBondContact O-CG 3.41Å; P287-L291 PolarHBondContact O-N 3.31Å; P287-V302 HydrophobicContact CG-CG1 4.01Å; P287-I303 HydrophobicContact CB-CD1 4.47Å; P287-I303 HydrophobicContact CB-CG1 4.27Å; P287-I303 HydrophobicContact CG-CG1 4.46Å; P287-L306 HydrophobicContact CG-CD1 4.42Å |
| 288 | R | 90.2 | Very high | 90.1 | Very high | 1 Ų | 1 | 35.8 Ų | 35.8 | 0% | 0.004 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.6 | -45.1 | 178.7 | -70.4 | 176.5 | -176.5 | -85.2 | 2.9 | 111.3 | V53 E54 E229 D232 S286 L291 V292 T473 | V53-R288 HydrophobicContact CB-CG 4.27Å; V53-R288 HydrophobicContact CG1-CG 3.51Å; E54-R288 IonicContact OE1-CZ 2.87Å; E54-R288 VanDerWaalsContact OE1-CZ 3.27Å; E54-R288 IonicContact OE1-NH1 3.71Å; E54-R288 PolarHBondContact OE1-NH1 3.31Å; E54-R288 IonicContact OE1-NH2 3.97Å; E54-R288 PolarHBondContact OE1-NH2 2.93Å; E229-R288 PolarHBondContact O-NE 2.92Å; D232-R288 IonicContact OD1-NH2 3.2Å; S286-R288 VanDerWaalsContact C-N 3.25Å; S286-R288 PolarHBondContact O-N 3.49Å; S286-R288 PolarHBondContact OG-N 3.47Å; R288-L291 PolarHBondContact O-N 3.09Å; R288-V292 WeakPolarHBondContact O-CB 3.41Å; R288-V292 VanDerWaalsContact O-CG2 3.31Å; R288-V292 WeakPolarHBondContact O-CG2 3.4Å; R288-V292 PolarHBondContact O-N 3.37Å; R288-T473 HydrophobicContact CB-CG2 4.06Å |
| 289 | W | 91.1 | Very high | 90.5 | Very high | 9 Ų | 9 | 27.7 Ų | 27.7 | 3% | 0.034 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -65.7 | -43.2 | 179.9 | -179.5 | 85.7 | 0 | 0 | 0 | 111.8 | D174 E285 S286 L291 V292 K293 K295 T473 | D174-W289 PolarHBondContact O-NE1 3.3Å; E285-W289 HydrophobicContact CG-CE3 3.77Å; E285-W289 HydrophobicContact CG-CZ3 3.99Å; S286-W289 PolarHBondContact O-N 3.24Å; S286-W289 PolarHBondContact OG-N 2.93Å; W289-L291 VanDerWaalsContact C-N 3.35Å; W289-L291 PolarHBondContact O-N 3.28Å; W289-V292 PolarHBondContact O-N 2.99Å; W289-K293 HydrophobicContact CD2-CG 4.07Å; W289-K293 HydrophobicContact CH2-CG 4.34Å; W289-K293 HydrophobicContact CZ2-CD 4.48Å; W289-K293 HydrophobicContact CZ2-CG 3.84Å; W289-K293 WeakPolarHBondContact O-CB 3.48Å; W289-K293 WeakPolarHBondContact O-CG 3.37Å; W289-K293 PolarHBondContact O-N 2.94Å; W289-K295 HydrophobicContact CZ3-CD 4.29Å; W289-T473 HydrophobicContact CB-CG2 4.38Å |
| 290 | L | 91.6 | Very high | 90.7 | Very high | 1 Ų | 1 | 27.5 Ų | 27.5 | 1% | 0.005 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.7 | -43.3 | 177.3 | -68.9 | 170.3 | 0 | 0 | 0 | 112 | E285 S286 P287 K293 S294 K295 E298 A299 V302 | E285-L290 HydrophobicContact CB-CD1 4.11Å; E285-L290 HydrophobicContact CB-CG 4.45Å; E285-L290 HydrophobicContact CG-CD1 4.2Å; E285-L290 HydrophobicContact CG-CD2 4.02Å; E285-L290 HydrophobicContact CG-CG 3.99Å; S286-L290 WeakPolarHBondContact O-CG 3.28Å; S286-L290 PolarHBondContact O-N 3.01Å; P287-L290 PolarHBondContact O-N 3.37Å; L290-K293 CarbonylContact O-C 3.57Å; L290-K293 PolarHBondContact O-N 3.45Å; L290-S294 PolarHBondContact O-N 2.88Å; L290-K295 HydrophobicContact CB-CB 4.33Å; L290-K295 HydrophobicContact CD2-CB 3.99Å; L290-K295 HydrophobicContact CD2-CD 3.84Å; L290-K295 WeakPolarHBondContact O-CA 3.31Å; L290-K295 WeakPolarHBondContact O-CB 3.4Å; L290-K295 PolarHBondContact O-N 3.21Å; L290-E298 HydrophobicContact CD1-CB 4.18Å; L290-E298 HydrophobicContact CD2-CB 3.9Å; L290-E298 WeakPolarHBondContact CD2-OE2 3.12Å; L290-A299 HydrophobicContact CB-CB 3.78Å; L290-A299 HydrophobicContact CD1-CB 4.34Å; L290-V302 HydrophobicContact CD1-CB 4.32Å; L290-V302 HydrophobicContact CD1-CG2 3.78Å |
| 291 | L | 90.6 | Very high | 90.9 | Very high | 2 Ų | 2 | 33.9 Ų | 33.9 | 1% | 0.01 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -66.8 | -39.1 | 177.9 | -68.4 | 170.3 | 0 | 0 | 0 | 112.8 | V53 P287 R288 W289 K293 S294 T296 A299 L323 I326 S328 | V53-L291 HydrophobicContact CG1-CD1 4.27Å; V53-L291 HydrophobicContact CG2-CD1 3.77Å; P287-L291 VanDerWaalsContact O-CG 3.22Å; P287-L291 WeakPolarHBondContact O-CG 3.41Å; P287-L291 PolarHBondContact O-N 3.31Å; R288-L291 PolarHBondContact O-N 3.09Å; W289-L291 VanDerWaalsContact C-N 3.35Å; W289-L291 PolarHBondContact O-N 3.28Å; L291-K293 VanDerWaalsContact C-N 3.31Å; L291-S294 PolarHBondContact O-N 3.41Å; L291-T296 HydrophobicContact CD2-CG2 4.46Å; L291-A299 HydrophobicContact CD2-CB 3.83Å; L291-A299 HydrophobicContact CG-CB 4Å; L291-L323 HydrophobicContact CD2-CB 3.96Å; L291-L323 HydrophobicContact CD2-CD1 4.39Å; L291-I326 HydrophobicContact CD1-CD1 3.55Å; L291-I326 HydrophobicContact CD1-CG1 4.06Å; L291-I326 HydrophobicContact CD2-CD1 4.39Å; L291-I326 HydrophobicContact CD2-CG1 4.24Å; L291-S328 PolarHBondContact O-N 2.93Å |
| 292 | V | 88.8 | Confident | 91.1 | Very high | 6 Ų | 6 | 29.7 Ų | 29.7 | 4% | 0.036 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64.7 | -38.3 | 173.9 | 165.2 | 0 | 0 | 0 | 0 | 111.2 | R288 W289 S294 S328 D331 T473 V474 N542 | R288-V292 WeakPolarHBondContact O-CB 3.41Å; R288-V292 VanDerWaalsContact O-CG2 3.31Å; R288-V292 WeakPolarHBondContact O-CG2 3.4Å; R288-V292 PolarHBondContact O-N 3.37Å; W289-V292 PolarHBondContact O-N 2.99Å; V292-S294 PolarHBondContact O-N 3.42Å; V292-S328 PolarHBondContact O-OG 3.45Å; V292-D331 HydrophobicContact CG1-CB 4.43Å; V292-T473 HydrophobicContact CG2-CG2 4.33Å; V292-V474 HydrophobicContact CG1-CG1 3.28Å; V292-N542 HydrophobicContact CG2-CB 3.83Å |
| 293 | K | 88.9 | Confident | 91.1 | Very high | 24 Ų | 24 | 26.7 Ų | 26.7 | 10% | 0.104 | 14% | 0.142 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | 9.4 | 176.2 | -67.7 | -64.7 | -173.3 | -179.4 | 0 | 114.3 | D174 W289 L290 L291 K295 | D174-K293 WeakPolarHBondContact O-CE 3.26Å; W289-K293 HydrophobicContact CD2-CG 4.07Å; W289-K293 HydrophobicContact CH2-CG 4.34Å; W289-K293 HydrophobicContact CZ2-CD 4.48Å; W289-K293 HydrophobicContact CZ2-CG 3.84Å; W289-K293 WeakPolarHBondContact O-CB 3.48Å; W289-K293 WeakPolarHBondContact O-CG 3.37Å; W289-K293 PolarHBondContact O-N 2.94Å; L290-K293 CarbonylContact O-C 3.57Å; L290-K293 PolarHBondContact O-N 3.45Å; L291-K293 VanDerWaalsContact C-N 3.31Å; K293-K295 HydrophobicContact CB-CD 4.16Å; K293-K295 HydrophobicContact CB-CG 4.3Å; K293-K295 PolarHBondContact O-N 3.47Å; K293-K295 VanDerWaalsContact O-N 3.17Å |
| 294 | S | 88 | Confident | 91 | Very high | 47 Ų | 47 | 28 Ų | 28 | 33% | 0.329 | 15% | 0.15 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 59.8 | 21.1 | -178.7 | -34.3 | 0 | 0 | 0 | 0 | 113.9 | L290 L291 V292 T296 S328 | L290-S294 PolarHBondContact O-N 2.88Å; L291-S294 PolarHBondContact O-N 3.41Å; V292-S294 PolarHBondContact O-N 3.42Å; S294-T296 VanDerWaalsContact C-N 3.3Å; S294-T296 PolarHBondContact O-N 3.16Å; S294-S328 WeakPolarHBondContact CB-O 3.25Å; S294-S328 PolarHBondContact OG-O 3.03Å |
| 295 | K | 89.8 | Confident | 91 | Very high | 75 Ų | 75 | 28.4 Ų | 28.4 | 33% | 0.326 | 15% | 0.152 | S | C | . | . | trans | -90.8 | 58.6 | 178.9 | -70.3 | 172 | 152.7 | -124 | 0 | 110.7 | W289 L290 K293 A297 E298 A299 | W289-K295 HydrophobicContact CZ3-CD 4.29Å; L290-K295 HydrophobicContact CB-CB 4.33Å; L290-K295 HydrophobicContact CD2-CB 3.99Å; L290-K295 HydrophobicContact CD2-CD 3.84Å; L290-K295 WeakPolarHBondContact O-CA 3.31Å; L290-K295 WeakPolarHBondContact O-CB 3.4Å; L290-K295 PolarHBondContact O-N 3.21Å; K293-K295 HydrophobicContact CB-CD 4.16Å; K293-K295 HydrophobicContact CB-CG 4.3Å; K293-K295 PolarHBondContact O-N 3.47Å; K293-K295 VanDerWaalsContact O-N 3.17Å; K295-A297 VanDerWaalsContact C-N 3.32Å; K295-A297 PolarHBondContact O-N 2.9Å; K295-E298 HydrophobicContact CB-CB 4.25Å; K295-E298 HydrophobicContact CB-CG 4.48Å; K295-E298 WeakPolarHBondContact CE-OE1 3.21Å; K295-E298 VanDerWaalsContact NZ-CD 3.27Å; K295-E298 IonicContact NZ-OE1 2.78Å; K295-E298 PolarHBondContact NZ-OE1 2.92Å; K295-E298 IonicContact NZ-OE2 2.86Å; K295-E298 PolarHBondContact NZ-OE2 2.91Å; K295-E298 PolarHBondContact O-N 2.71Å; K295-A299 PolarHBondContact O-N 2.73Å | ||
| 296 | T | 89.9 | Confident | 90.8 | Very high | 32 Ų | 32 | 27.6 Ų | 27.6 | 20% | 0.196 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61.8 | -35.5 | -173.2 | 52.7 | 0 | 0 | 0 | 0 | 113.9 | L291 S294 A299 A300 S327 | L291-T296 HydrophobicContact CD2-CG2 4.46Å; S294-T296 VanDerWaalsContact C-N 3.3Å; S294-T296 PolarHBondContact O-N 3.16Å; T296-A299 PolarHBondContact O-N 3.32Å; T296-A300 WeakPolarHBondContact O-CB 3.43Å; T296-A300 PolarHBondContact O-N 3.09Å; T296-S327 VanDerWaalsContact CG2-CB 3.46Å; T296-S327 WeakPolarHBondContact CG2-OG 3.35Å |
| 297 | A | 91.9 | Very high | 90.6 | Very high | 54 Ų | 54 | 27.6 Ų | 27.6 | 45% | 0.446 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -66.3 | -44.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | K295 A299 A300 Q301 | K295-A297 VanDerWaalsContact C-N 3.32Å; K295-A297 PolarHBondContact O-N 2.9Å; A297-A299 VanDerWaalsContact C-N 3.34Å; A297-A300 PolarHBondContact O-N 3.12Å; A297-Q301 WeakPolarHBondContact O-CG 3.09Å; A297-Q301 PolarHBondContact O-N 3.28Å; A297-Q301 VanDerWaalsContact O-N 3.09Å |
| 298 | E | 92.6 | Very high | 90.4 | Very high | 80 Ų | 80 | 28.7 Ų | 28.7 | 37% | 0.374 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -65.6 | -39.6 | 174.9 | -64.9 | 174.5 | -140.7 | 0 | 0 | 110.4 | L290 K295 A300 Q301 V302 | L290-E298 HydrophobicContact CD1-CB 4.18Å; L290-E298 HydrophobicContact CD2-CB 3.9Å; L290-E298 WeakPolarHBondContact CD2-OE2 3.12Å; K295-E298 HydrophobicContact CB-CB 4.25Å; K295-E298 HydrophobicContact CB-CG 4.48Å; K295-E298 WeakPolarHBondContact CE-OE1 3.21Å; K295-E298 VanDerWaalsContact NZ-CD 3.27Å; K295-E298 IonicContact NZ-OE1 2.78Å; K295-E298 PolarHBondContact NZ-OE1 2.92Å; K295-E298 IonicContact NZ-OE2 2.86Å; K295-E298 PolarHBondContact NZ-OE2 2.91Å; K295-E298 PolarHBondContact O-N 2.71Å; E298-A300 PolarHBondContact O-N 2.59Å; E298-Q301 PolarHBondContact O-N 2.8Å; E298-V302 WeakPolarHBondContact O-CG2 3.22Å; E298-V302 PolarHBondContact O-N 3.28Å |
| 299 | A | 91.7 | Very high | 90.2 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -60.8 | -45.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L290 L291 K295 T296 A297 Q301 V302 I303 L323 | L290-A299 HydrophobicContact CB-CB 3.78Å; L290-A299 HydrophobicContact CD1-CB 4.34Å; L291-A299 HydrophobicContact CD2-CB 3.83Å; L291-A299 HydrophobicContact CG-CB 4Å; K295-A299 PolarHBondContact O-N 2.73Å; T296-A299 PolarHBondContact O-N 3.32Å; A297-A299 VanDerWaalsContact C-N 3.34Å; A299-Q301 VanDerWaalsContact C-N 3.34Å; A299-Q301 PolarHBondContact O-N 3.27Å; A299-V302 PolarHBondContact O-N 3.34Å; A299-I303 WeakPolarHBondContact O-CB 3.29Å; A299-I303 WeakPolarHBondContact O-CD1 3.39Å; A299-I303 WeakPolarHBondContact O-CG1 3.39Å; A299-I303 PolarHBondContact O-N 2.98Å; A299-L323 HydrophobicContact CB-CD1 4.12Å |
| 300 | A | 91.7 | Very high | 90 | Very high | 4 Ų | 4 | 43.8 Ų | 43.8 | 3% | 0.033 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.9 | -42.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | T296 A297 E298 I303 T304 V318 P320 L323 | T296-A300 WeakPolarHBondContact O-CB 3.43Å; T296-A300 PolarHBondContact O-N 3.09Å; A297-A300 PolarHBondContact O-N 3.12Å; E298-A300 PolarHBondContact O-N 2.59Å; A300-I303 PolarHBondContact O-N 3.32Å; A300-T304 VanDerWaalsContact O-CB 3.32Å; A300-T304 WeakPolarHBondContact O-CB 3.29Å; A300-T304 PolarHBondContact O-N 3.29Å; A300-T304 PolarHBondContact O-OG1 3.04Å; A300-V318 WeakPolarHBondContact CB-O 3.31Å; A300-P320 HydrophobicContact CB-CB 4.34Å; A300-L323 HydrophobicContact CB-CD1 3.86Å |
| 301 | Q | 92.8 | Very high | 89.9 | Confident | 138 Ų | 138 | 44.9 Ų | 44.9 | 65% | 0.645 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -63.2 | -47.5 | 176.2 | -73.3 | 174.4 | -7.9 | 0 | 0 | 112 | A297 E298 A299 I303 T304 E305 | A297-Q301 WeakPolarHBondContact O-CG 3.09Å; A297-Q301 PolarHBondContact O-N 3.28Å; A297-Q301 VanDerWaalsContact O-N 3.09Å; E298-Q301 PolarHBondContact O-N 2.8Å; A299-Q301 VanDerWaalsContact C-N 3.34Å; A299-Q301 PolarHBondContact O-N 3.27Å; Q301-I303 PolarHBondContact O-N 3.11Å; Q301-T304 PolarHBondContact O-N 3.23Å; Q301-E305 PolarHBondContact O-N 3.22Å |
| 302 | V | 92.2 | Very high | 89.7 | Confident | 12 Ų | 12 | 48.4 Ų | 48.4 | 7% | 0.073 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.4 | -47.8 | 176.7 | 163.7 | 0 | 0 | 0 | 0 | 110.8 | Q284 E285 P287 L290 E298 A299 T304 E305 L306 | Q284-V302 HydrophobicContact CB-CG1 3.84Å; Q284-V302 HydrophobicContact CB-CG2 4.44Å; E285-V302 WeakPolarHBondContact O-CG1 3.4Å; P287-V302 HydrophobicContact CG-CG1 4.01Å; L290-V302 HydrophobicContact CD1-CB 4.32Å; L290-V302 HydrophobicContact CD1-CG2 3.78Å; E298-V302 WeakPolarHBondContact O-CG2 3.22Å; E298-V302 PolarHBondContact O-N 3.28Å; A299-V302 PolarHBondContact O-N 3.34Å; V302-T304 VanDerWaalsContact C-N 3.31Å; V302-T304 PolarHBondContact O-N 3.32Å; V302-E305 PolarHBondContact O-N 2.88Å; V302-L306 HydrophobicContact CG1-CD1 4.14Å; V302-L306 HydrophobicContact CG1-CG 4.45Å; V302-L306 VanDerWaalsContact O-CG 3.3Å; V302-L306 WeakPolarHBondContact O-CG 3.46Å; V302-L306 PolarHBondContact O-N 3.37Å |
| 303 | I | 91.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.6 | -42.8 | -179.7 | -70.7 | 160 | 0 | 0 | 0 | 110.6 | V56 I60 P287 A299 A300 Q301 L306 Y307 V318 L323 | V56-I303 HydrophobicContact CG1-CD1 3.54Å; V56-I303 HydrophobicContact CG1-CG1 3.93Å; V56-I303 HydrophobicContact CG1-CG2 4.11Å; I60-I303 HydrophobicContact CD1-CB 4.46Å; I60-I303 HydrophobicContact CD1-CG1 4.2Å; I60-I303 HydrophobicContact CD1-CG2 3.95Å; I60-I303 HydrophobicContact CG1-CG2 4.25Å; P287-I303 HydrophobicContact CB-CD1 4.47Å; P287-I303 HydrophobicContact CB-CG1 4.27Å; P287-I303 HydrophobicContact CG-CG1 4.46Å; A299-I303 WeakPolarHBondContact O-CB 3.29Å; A299-I303 WeakPolarHBondContact O-CD1 3.39Å; A299-I303 WeakPolarHBondContact O-CG1 3.39Å; A299-I303 PolarHBondContact O-N 2.98Å; A300-I303 PolarHBondContact O-N 3.32Å; Q301-I303 PolarHBondContact O-N 3.11Å; I303-L306 WeakPolarHBondContact O-CB 3.44Å; I303-L306 PolarHBondContact O-N 2.9Å; I303-Y307 HydrophobicContact CG2-CD2 3.81Å; I303-Y307 HydrophobicContact CG2-CE2 3.48Å; I303-Y307 VanDerWaalsContact CG2-CE2 3.48Å; I303-Y307 WeakPolarHBondContact O-CD2 3.48Å; I303-Y307 PolarHBondContact O-N 3.46Å; I303-V318 HydrophobicContact CG2-CB 3.89Å; I303-V318 HydrophobicContact CG2-CG1 4.15Å; I303-V318 HydrophobicContact CG2-CG2 3.61Å; I303-L323 HydrophobicContact CD1-CD1 3.67Å; I303-L323 HydrophobicContact CD1-CD2 3.84Å; I303-L323 HydrophobicContact CD1-CG 4.43Å |
| 304 | T | 91 | Very high | 88.9 | Confident | 36 Ų | 36 | 54.1 Ų | 54.1 | 22% | 0.221 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -63.1 | -43.2 | 176.2 | -59.4 | 0 | 0 | 0 | 0 | 111.5 | A300 Q301 V302 L306 Y307 S308 E317 V318 | A300-T304 VanDerWaalsContact O-CB 3.32Å; A300-T304 WeakPolarHBondContact O-CB 3.29Å; A300-T304 PolarHBondContact O-N 3.29Å; A300-T304 PolarHBondContact O-OG1 3.04Å; Q301-T304 PolarHBondContact O-N 3.23Å; V302-T304 VanDerWaalsContact C-N 3.31Å; V302-T304 PolarHBondContact O-N 3.32Å; T304-L306 VanDerWaalsContact C-N 3.29Å; T304-L306 PolarHBondContact O-N 3.44Å; T304-Y307 CarbonylContact O-C 3.47Å; T304-Y307 WeakPolarHBondContact O-CA 3.49Å; T304-Y307 WeakPolarHBondContact O-CB 3.42Å; T304-Y307 PolarHBondContact O-N 3.18Å; T304-S308 PolarHBondContact O-N 3.4Å; T304-E317 HydrophobicContact CG2-CB 4.4Å; T304-E317 HydrophobicContact CG2-CG 4.21Å; T304-V318 PolarHBondContact OG1-N 3.12Å; T304-V318 PolarHBondContact OG1-O 3.41Å |
| 305 | E | 91 | Very high | 88.2 | Confident | 49 Ų | 49 | 55.2 Ų | 55.2 | 23% | 0.229 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59.6 | -40.7 | 172.8 | 174.9 | 62.7 | -164.8 | 0 | 0 | 110.8 | Q284 Q301 V302 Y307 S308 R310 W311 | Q284-E305 HydrophobicContact CG-CG 4.17Å; Q301-E305 PolarHBondContact O-N 3.22Å; V302-E305 PolarHBondContact O-N 2.88Å; E305-Y307 VanDerWaalsContact C-N 3.25Å; E305-Y307 PolarHBondContact O-N 3.07Å; E305-S308 WeakPolarHBondContact O-CB 3.37Å; E305-S308 PolarHBondContact O-N 3.05Å; E305-S308 PolarHBondContact O-OG 3.11Å; E305-R310 IonicContact OE1-CZ 3.24Å; E305-R310 IonicContact OE1-NH1 3.47Å; E305-R310 PolarHBondContact OE1-NH1 3.42Å; E305-W311 VanDerWaalsContact O-CD1 3.31Å; E305-W311 PolarHBondContact OE1-NE1 3.3Å |
| 306 | L | 89.6 | Confident | 87.7 | Confident | 7 Ų | 7 | 55.5 Ų | 55.5 | 4% | 0.037 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.5 | -25.2 | 175.7 | -66 | 175.9 | 0 | 0 | 0 | 113.5 | I60 Y66 Q284 P287 V302 I303 T304 R312 | I60-L306 HydrophobicContact CD1-CD1 4.14Å; I60-L306 HydrophobicContact CG2-CB 3.94Å; Y66-L306 HydrophobicContact CD1-CD2 3.34Å; Y66-L306 HydrophobicContact CD2-CD2 3.82Å; Y66-L306 HydrophobicContact CE1-CD2 3.59Å; Y66-L306 HydrophobicContact CE2-CD2 4.04Å; Y66-L306 HydrophobicContact CG-CD2 3.47Å; Y66-L306 VanDerWaalsContact CG-CD2 3.47Å; Q284-L306 HydrophobicContact CG-CD2 4.25Å; P287-L306 HydrophobicContact CG-CD1 4.42Å; V302-L306 HydrophobicContact CG1-CD1 4.14Å; V302-L306 HydrophobicContact CG1-CG 4.45Å; V302-L306 VanDerWaalsContact O-CG 3.3Å; V302-L306 WeakPolarHBondContact O-CG 3.46Å; V302-L306 PolarHBondContact O-N 3.37Å; I303-L306 WeakPolarHBondContact O-CB 3.44Å; I303-L306 PolarHBondContact O-N 2.9Å; T304-L306 VanDerWaalsContact C-N 3.29Å; T304-L306 PolarHBondContact O-N 3.44Å; L306-R312 WeakPolarHBondContact O-CG 3.48Å |
| 307 | Y | 87.4 | Confident | 87.4 | Confident | 1 Ų | 1 | 61.3 Ų | 61.3 | 0% | 0.004 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -78.8 | -24.9 | 169.9 | -79.1 | -67.9 | 0 | 0 | 0 | 113.4 | K59 I60 I303 T304 E305 R314 D316 V318 | K59-Y307 WeakPolarHBondContact CB-OH 3.45Å; K59-Y307 WeakPolarHBondContact CD-OH 3.39Å; K59-Y307 HydrophobicContact CG-CE1 4.48Å; K59-Y307 WeakPolarHBondContact CG-OH 3.34Å; K59-Y307 WeakPolarHBondContact O-CE1 3.32Å; I60-Y307 HydrophobicContact CB-CE1 4.45Å; I60-Y307 HydrophobicContact CG1-CD2 4.3Å; I60-Y307 HydrophobicContact CG1-CE1 4.16Å; I60-Y307 HydrophobicContact CG1-CE2 3.6Å; I60-Y307 PolarHBondContact N-OH 3.45Å; I303-Y307 HydrophobicContact CG2-CD2 3.81Å; I303-Y307 HydrophobicContact CG2-CE2 3.48Å; I303-Y307 VanDerWaalsContact CG2-CE2 3.48Å; I303-Y307 WeakPolarHBondContact O-CD2 3.48Å; I303-Y307 PolarHBondContact O-N 3.46Å; T304-Y307 CarbonylContact O-C 3.47Å; T304-Y307 WeakPolarHBondContact O-CA 3.49Å; T304-Y307 WeakPolarHBondContact O-CB 3.42Å; T304-Y307 PolarHBondContact O-N 3.18Å; E305-Y307 VanDerWaalsContact C-N 3.25Å; E305-Y307 PolarHBondContact O-N 3.07Å; Y307-R314 CarbonylContact C-O 3.54Å; Y307-R314 CarbonylContact O-C 3.59Å; Y307-R314 VanDerWaalsContact O-CA 3.32Å; Y307-R314 WeakPolarHBondContact O-CA 3.24Å; Y307-R314 VanDerWaalsContact O-CB 3.28Å; Y307-R314 WeakPolarHBondContact O-CB 3.45Å; Y307-R314 PolarHBondContact O-N 2.87Å; Y307-D316 HydrophobicContact CG-CB 4.37Å; Y307-V318 HydrophobicContact CD2-CG2 4.03Å; Y307-V318 HydrophobicContact CE2-CG2 3.73Å |
| 308 | S | 87.2 | Confident | 87 | Confident | 25 Ų | 25 | 59 Ų | 59 | 18% | 0.175 | 31% | 0.305 | C | S | . | . | S | Bend | trans | -50.6 | 161.8 | -171.7 | 74.3 | 0 | 0 | 0 | 0 | 114.1 | T304 E305 R310 W311 R312 G313 R314 | T304-S308 PolarHBondContact O-N 3.4Å; E305-S308 WeakPolarHBondContact O-CB 3.37Å; E305-S308 PolarHBondContact O-N 3.05Å; E305-S308 PolarHBondContact O-OG 3.11Å; S308-R310 PolarHBondContact O-N 3.27Å; S308-W311 PolarHBondContact O-N 3.23Å; S308-R312 PolarHBondContact O-N 3.33Å; S308-G313 PolarHBondContact O-N 3.23Å; S308-R314 CarbonylContact C-O 3.42Å; S308-R314 WeakPolarHBondContact CA-O 3.44Å |
| 309 | E | 84.8 | Confident | 86.8 | Confident | 168 Ų | 168 | 56.2 Ų | 56.2 | 79% | 0.785 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.5 | -33.3 | 177.9 | -69.3 | -169.3 | 166 | 0 | 0 | 112.9 | W311 G313 R314 | E309-W311 VanDerWaalsContact C-N 3.35Å; E309-W311 PolarHBondContact O-N 2.97Å; E309-G313 PolarHBondContact O-N 2.96Å; E309-R314 PolarHBondContact N-O 3.22Å; E309-R314 VanDerWaalsContact N-O 3.1Å |
| 310 | R | 87.7 | Confident | 86.5 | Confident | 158 Ų | 158 | 58.9 Ų | 58.9 | 60% | 0.596 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -42.5 | 179.1 | 179.7 | -178.2 | -73.4 | 160.2 | -7.4 | 113.2 | E305 S308 | E305-R310 IonicContact OE1-CZ 3.24Å; E305-R310 IonicContact OE1-NH1 3.47Å; E305-R310 PolarHBondContact OE1-NH1 3.42Å; S308-R310 PolarHBondContact O-N 3.27Å |
| 311 | W | 89.3 | Confident | 86.2 | Confident | 24 Ų | 24 | 61.2 Ų | 61.2 | 9% | 0.091 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.4 | -31.5 | -170 | -60.6 | 113.9 | 0 | 0 | 0 | 113.8 | P65 Y66 F69 L282 E305 S308 E309 | P65-W311 WeakPolarHBondContact CD-O 3.5Å; P65-W311 WeakPolarHBondContact CG-O 3.41Å; Y66-W311 VanDerWaalsContact CA-CE3 3.44Å; Y66-W311 AromaticContact CD2-CD2 3.8Å; Y66-W311 HydrophobicContact CD2-CD2 3.8Å; Y66-W311 AromaticContact CD2-CE2 3.62Å; Y66-W311 HydrophobicContact CD2-CE3 4.04Å; Y66-W311 HydrophobicContact CD2-CG 4.41Å; Y66-W311 AromaticContact CD2-CH2 3.96Å; Y66-W311 HydrophobicContact CD2-CH2 3.96Å; Y66-W311 AromaticContact CD2-CZ2 3.72Å; Y66-W311 HydrophobicContact CD2-CZ2 3.72Å; Y66-W311 HydrophobicContact CD2-CZ3 4.12Å; Y66-W311 HydrophobicContact CE2-CZ2 4.26Å; Y66-W311 HydrophobicContact CG-CD2 4.25Å; Y66-W311 HydrophobicContact CG-CE3 4.38Å; F69-W311 HydrophobicContact CB-CH2 4.17Å; F69-W311 HydrophobicContact CB-CZ3 3.79Å; F69-W311 AromaticContact CD1-CH2 3.48Å; F69-W311 HydrophobicContact CD1-CH2 3.48Å; F69-W311 VanDerWaalsContact CD1-CH2 3.48Å; F69-W311 HydrophobicContact CD1-CZ2 4.43Å; F69-W311 AromaticContact CD1-CZ3 3.99Å; F69-W311 HydrophobicContact CD1-CZ3 3.99Å; F69-W311 HydrophobicContact CD2-CH2 4.39Å; F69-W311 AromaticContact CE1-CH2 3.88Å; F69-W311 HydrophobicContact CE1-CH2 3.88Å; F69-W311 AromaticContact CG-CH2 3.75Å; F69-W311 HydrophobicContact CG-CH2 3.75Å; F69-W311 AromaticContact CG-CZ3 3.88Å; F69-W311 HydrophobicContact CG-CZ3 3.88Å; F69-W311 HydrophobicContact CZ-CH2 4.48Å; L282-W311 HydrophobicContact CB-CZ2 4.48Å; E305-W311 VanDerWaalsContact O-CD1 3.31Å; E305-W311 PolarHBondContact OE1-NE1 3.3Å; S308-W311 PolarHBondContact O-N 3.23Å; E309-W311 VanDerWaalsContact C-N 3.35Å; E309-W311 PolarHBondContact O-N 2.97Å |
| 312 | R | 86.5 | Confident | 85.8 | Confident | 76 Ų | 76 | 55.9 Ų | 55.9 | 29% | 0.287 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -132.1 | -6.2 | -175.6 | -73.4 | -63.1 | -165.3 | -173.3 | -1.8 | 114.5 | I60 G61 F63 L306 S308 R314 | I60-R312 PolarHBondContact O-NE 2.91Å; I60-R312 PolarHBondContact O-NH2 3.29Å; G61-R312 VanDerWaalsContact CA-NH2 3.3Å; G61-R312 PolarHBondContact O-NH2 3.36Å; F63-R312 PolarHBondContact O-NH2 2.84Å; L306-R312 WeakPolarHBondContact O-CG 3.48Å; S308-R312 PolarHBondContact O-N 3.33Å; R312-R314 PolarHBondContact O-N 3.07Å |
| 313 | G | 81.8 | Confident | 85.6 | Confident | 57 Ų | 57 | 55.3 Ų | 55.3 | 59% | 0.588 | 30% | 0.296 | S | S | * | . | S | Bend | trans | 68.6 | 20.3 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113 | S308 E309 | S308-G313 PolarHBondContact O-N 3.23Å; E309-G313 PolarHBondContact O-N 2.96Å |
| 314 | R | 78.4 | Confident | 85.2 | Confident | 93 Ų | 93 | 58.9 Ų | 58.9 | 35% | 0.351 | 32% | 0.318 | S | S | . | . | trans | -115.5 | 162.6 | 179.8 | -65.9 | -173.5 | -77.5 | -164.8 | 4.3 | 110.2 | K59 I60 Y307 S308 E309 R312 | K59-R314 PolarHBondContact O-NH2 3.24Å; I60-R314 PolarHBondContact O-NH2 2.78Å; I60-R314 VanDerWaalsContact O-NH2 3.09Å; Y307-R314 CarbonylContact C-O 3.54Å; Y307-R314 CarbonylContact O-C 3.59Å; Y307-R314 VanDerWaalsContact O-CA 3.32Å; Y307-R314 WeakPolarHBondContact O-CA 3.24Å; Y307-R314 VanDerWaalsContact O-CB 3.28Å; Y307-R314 WeakPolarHBondContact O-CB 3.45Å; Y307-R314 PolarHBondContact O-N 2.87Å; S308-R314 CarbonylContact C-O 3.42Å; S308-R314 WeakPolarHBondContact CA-O 3.44Å; E309-R314 PolarHBondContact N-O 3.22Å; E309-R314 VanDerWaalsContact N-O 3.1Å; R312-R314 PolarHBondContact O-N 3.07Å | ||
| 315 | G | 73 | Confident | 84.9 | Confident | 71 Ų | 71 | 60.4 Ų | 60.4 | 73% | 0.732 | 33% | 0.334 | S | S | * | . | trans | -126.5 | 20 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113 | E317 | G315-E317 PolarHBondContact O-N 2.79Š| ||
| 316 | D | 80.1 | Confident | 84.6 | Confident | 81 Ų | 81 | 59.7 Ų | 59.7 | 43% | 0.433 | 33% | 0.331 | S | S | . | . | P | Polyproline II helix | trans | -68 | 116.1 | -178.1 | -64.1 | -32.5 | 0 | 0 | 0 | 109.9 | Y307 | Y307-D316 HydrophobicContact CG-CB 4.37Š|
| 317 | E | 83.1 | Confident | 84.2 | Confident | 153 Ų | 153 | 60.3 Ų | 60.3 | 72% | 0.715 | 34% | 0.337 | S | S | * | . | P | Polyproline II helix | trans | -84.3 | 122.6 | 172.9 | -170.2 | 170.1 | -170.6 | 0 | 0 | 109.6 | T304 G315 | T304-E317 HydrophobicContact CG2-CB 4.4Å; T304-E317 HydrophobicContact CG2-CG 4.21Å; G315-E317 PolarHBondContact O-N 2.79Å |
| 318 | V | 84.8 | Confident | 83.5 | Confident | 6 Ų | 6 | 61.3 Ų | 61.3 | 4% | 0.036 | 34% | 0.344 | C | S | . | . | P | Polyproline II helix | trans | -95.4 | 122.1 | 172.7 | 173.7 | 0 | 0 | 0 | 0 | 107.9 | F50 A300 I303 T304 Y307 L323 | F50-V318 HydrophobicContact CE2-CG1 4.08Å; A300-V318 WeakPolarHBondContact CB-O 3.31Å; I303-V318 HydrophobicContact CG2-CB 3.89Å; I303-V318 HydrophobicContact CG2-CG1 4.15Å; I303-V318 HydrophobicContact CG2-CG2 3.61Å; T304-V318 PolarHBondContact OG1-N 3.12Å; T304-V318 PolarHBondContact OG1-O 3.41Å; Y307-V318 HydrophobicContact CD2-CG2 4.03Å; Y307-V318 HydrophobicContact CE2-CG2 3.73Å; V318-L323 HydrophobicContact CG1-CD1 4.13Å; V318-L323 HydrophobicContact CG1-CD2 4.35Å; V318-L323 HydrophobicContact CG1-CG 4.14Å |
| 319 | T | 86.6 | Confident | 82.5 | Confident | 22 Ų | 22 | 67.4 Ų | 67.4 | 14% | 0.135 | 37% | 0.374 | C | S | . | . | P | Polyproline II helix | trans | -89.6 | 151.7 | -179.2 | 66.3 | 0 | 0 | 0 | 0 | 110.8 | Y46 V321 Q322 | Y46-T319 WeakPolarHBondContact CD1-OG1 3.37Å; Y46-T319 HydrophobicContact CE1-CG2 3.58Å; Y46-T319 WeakPolarHBondContact CE1-OG1 3.4Å; T319-V321 PolarHBondContact O-N 2.89Å; T319-V321 VanDerWaalsContact O-N 3.09Å; T319-Q322 PolarHBondContact O-N 3.44Å |
| 320 | P | 85.4 | Confident | 81.5 | Confident | 55 Ų | 55 | 70.6 Ų | 70.6 | 36% | 0.357 | 38% | 0.379 | S | S | . | . | G | 310 helix | trans | -58.9 | -26.4 | 179.2 | 22 | -33.4 | 0 | 0 | 0 | 112.9 | A300 Q322 L323 T324 | A300-P320 HydrophobicContact CB-CB 4.34Å; P320-Q322 VanDerWaalsContact C-N 3.31Å; P320-Q322 PolarHBondContact O-N 2.78Å; P320-L323 PolarHBondContact O-N 2.98Å; P320-T324 WeakPolarHBondContact O-CG2 3.3Å; P320-T324 PolarHBondContact O-N 2.92Å |
| 321 | V | 85.7 | Confident | 80.5 | Confident | 53 Ų | 53 | 64.3 Ų | 64.3 | 32% | 0.321 | 36% | 0.357 | S | S | . | . | G | 310 helix | trans | -64.3 | -35.3 | 178.2 | -178.2 | 0 | 0 | 0 | 0 | 111.6 | Y46 Y49 T319 L323 T324 | Y46-V321 HydrophobicContact CD2-CB 3.84Å; Y46-V321 HydrophobicContact CD2-CG1 3.64Å; Y46-V321 HydrophobicContact CD2-CG2 4.28Å; Y46-V321 HydrophobicContact CE2-CB 3.93Å; Y46-V321 HydrophobicContact CE2-CG1 4.17Å; Y46-V321 HydrophobicContact CE2-CG2 3.94Å; Y46-V321 HydrophobicContact CG-CB 4.43Å; Y46-V321 HydrophobicContact CG-CG1 4.28Å; Y49-V321 WeakPolarHBondContact CD1-O 3.24Å; Y49-V321 HydrophobicContact CE1-CG1 4.01Å; Y49-V321 WeakPolarHBondContact CE1-O 3.38Å; T319-V321 PolarHBondContact O-N 2.89Å; T319-V321 VanDerWaalsContact O-N 3.09Å; V321-L323 PolarHBondContact O-N 2.88Å; V321-T324 PolarHBondContact O-N 3.18Å; V321-T324 PolarHBondContact O-OG1 3.24Å |
| 322 | Q | 85.2 | Confident | 79.3 | Confident | 27 Ų | 27 | 64.3 Ų | 64.3 | 13% | 0.126 | 37% | 0.365 | C | S | . | . | G | 310 helix | trans | -68.5 | -18.7 | 179.2 | -62.9 | 176.3 | -41.9 | 0 | 0 | 112.7 | Y46 F48 F50 T319 P320 | Y46-Q322 HydrophobicContact CD1-CG 4.15Å; F48-Q322 WeakPolarHBondContact O-CG 3.39Å; F50-Q322 HydrophobicContact CD2-CB 3.96Å; F50-Q322 HydrophobicContact CE2-CB 4.05Å; F50-Q322 PolarHBondContact N-O 2.94Å; F50-Q322 VanDerWaalsContact N-O 3.08Å; T319-Q322 PolarHBondContact O-N 3.44Å; P320-Q322 VanDerWaalsContact C-N 3.31Å; P320-Q322 PolarHBondContact O-N 2.78Å |
| 323 | L | 87.3 | Confident | 78.3 | Confident | 0 Ų | 0 | 70.6 Ų | 70.6 | 0% | 0 | 40% | 0.395 | C | S | . | . | G | 310 helix | trans | -103.7 | -4.2 | -176.1 | -60 | 171.5 | 0 | 0 | 0 | 113.5 | F50 V56 L291 A299 A300 I303 V318 P320 V321 A325 I326 S327 | F50-L323 HydrophobicContact CD2-CD2 3.92Å; F50-L323 HydrophobicContact CE2-CD2 4.43Å; V56-L323 HydrophobicContact CG2-CD2 3.86Å; L291-L323 HydrophobicContact CD2-CB 3.96Å; L291-L323 HydrophobicContact CD2-CD1 4.39Å; A299-L323 HydrophobicContact CB-CD1 4.12Å; A300-L323 HydrophobicContact CB-CD1 3.86Å; I303-L323 HydrophobicContact CD1-CD1 3.67Å; I303-L323 HydrophobicContact CD1-CD2 3.84Å; I303-L323 HydrophobicContact CD1-CG 4.43Å; V318-L323 HydrophobicContact CG1-CD1 4.13Å; V318-L323 HydrophobicContact CG1-CD2 4.35Å; V318-L323 HydrophobicContact CG1-CG 4.14Å; P320-L323 PolarHBondContact O-N 2.98Å; V321-L323 PolarHBondContact O-N 2.88Å; L323-A325 VanDerWaalsContact C-N 3.26Å; L323-A325 PolarHBondContact O-N 3.38Å; L323-I326 HydrophobicContact CB-CG1 4.46Å; L323-I326 HydrophobicContact CD2-CD1 3.83Å; L323-I326 WeakPolarHBondContact O-CG1 3.41Å; L323-I326 PolarHBondContact O-N 3.5Å; L323-S327 PolarHBondContact O-N 2.98Å |
| 324 | T | 84 | Confident | 78.2 | Confident | 75 Ų | 75 | 72.6 Ų | 72.6 | 46% | 0.46 | 39% | 0.387 | S | S | . | . | G | 310 helix | trans | -63.2 | -32.9 | -177.1 | 51.3 | 0 | 0 | 0 | 0 | 112.6 | P320 V321 I326 S327 | P320-T324 WeakPolarHBondContact O-CG2 3.3Å; P320-T324 PolarHBondContact O-N 2.92Å; V321-T324 PolarHBondContact O-N 3.18Å; V321-T324 PolarHBondContact O-OG1 3.24Å; T324-I326 PolarHBondContact O-N 2.73Å; T324-S327 PolarHBondContact O-N 3.17Å |
| 325 | A | 83.8 | Confident | 78.3 | Confident | 68 Ų | 68 | 74.2 Ų | 74.2 | 56% | 0.562 | 40% | 0.402 | S | S | * | . | G | 310 helix | trans | -65.1 | -24.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | L323 | L323-A325 VanDerWaalsContact C-N 3.26Å; L323-A325 PolarHBondContact O-N 3.38Å |
| 326 | I | 84.3 | Confident | 78.9 | Confident | 33 Ų | 33 | 71.1 Ų | 71.1 | 17% | 0.169 | 37% | 0.368 | C | S | . | . | G | 310 helix | trans | -107.8 | -6.9 | -177.4 | 57.5 | 175.9 | 0 | 0 | 0 | 113.4 | F50 V53 V56 L291 L323 T324 | F50-I326 HydrophobicContact CB-CD1 4.37Å; F50-I326 WeakPolarHBondContact O-CG2 3.26Å; V53-I326 HydrophobicContact CG2-CD1 4.26Å; V56-I326 HydrophobicContact CG2-CD1 3.93Å; L291-I326 HydrophobicContact CD1-CD1 3.55Å; L291-I326 HydrophobicContact CD1-CG1 4.06Å; L291-I326 HydrophobicContact CD2-CD1 4.39Å; L291-I326 HydrophobicContact CD2-CG1 4.24Å; L323-I326 HydrophobicContact CB-CG1 4.46Å; L323-I326 HydrophobicContact CD2-CD1 3.83Å; L323-I326 WeakPolarHBondContact O-CG1 3.41Å; L323-I326 PolarHBondContact O-N 3.5Å; T324-I326 PolarHBondContact O-N 2.73Å |
| 327 | S | 82 | Confident | 79.3 | Confident | 21 Ų | 21 | 70.1 Ų | 70.1 | 15% | 0.147 | 37% | 0.365 | C | S | . | . | trans | -70.5 | 136.1 | 177.2 | -177.7 | 0 | 0 | 0 | 0 | 110.4 | T296 L323 T324 | T296-S327 VanDerWaalsContact CG2-CB 3.46Å; T296-S327 WeakPolarHBondContact CG2-OG 3.35Å; L323-S327 PolarHBondContact O-N 2.98Å; T324-S327 PolarHBondContact O-N 3.17Å | ||
| 328 | S | 72.8 | Confident | 79.5 | Confident | 22 Ų | 22 | 65.2 Ų | 65.2 | 15% | 0.154 | 34% | 0.344 | C | S | . | . | trans | -80.8 | 127.5 | 170.8 | 109.5 | 0 | 0 | 0 | 0 | 109 | L291 V292 S294 D331 | L291-S328 PolarHBondContact O-N 2.93Å; V292-S328 PolarHBondContact O-OG 3.45Å; S294-S328 WeakPolarHBondContact CB-O 3.25Å; S294-S328 PolarHBondContact OG-O 3.03Å; S328-D331 PolarHBondContact OG-N 3.38Å | ||
| 329 | D | 66 | Low | 79.7 | Confident | 153 Ų | 153 | 71.7 Ų | 71.7 | 82% | 0.818 | 38% | 0.377 | S | S | * | . | S | Bend | trans | -83.1 | -17 | 170.6 | -80.4 | -18.5 | 0 | 0 | 0 | 112.3 | ||
| 330 | R | 64.4 | Low | 79.8 | Confident | 234 Ų | 234 | 71.7 Ų | 71.7 | 88% | 0.883 | 38% | 0.376 | S | S | * | . | S | Bend | trans | -96.4 | -31.2 | -165.3 | -64.9 | -173.2 | -172.1 | -152.6 | 2.7 | 114.9 | ||
| 331 | D | 65.8 | Low | 79.9 | Confident | 26 Ų | 26 | 69 Ų | 69 | 14% | 0.139 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -101.1 | -5.3 | -166.6 | -78.7 | -35.2 | 0 | 0 | 0 | 115.6 | V292 S328 K333 K334 Y336 V474 T543 | V292-D331 HydrophobicContact CG1-CB 4.43Å; S328-D331 PolarHBondContact OG-N 3.38Å; D331-K333 PolarHBondContact O-N 3.18Å; D331-K334 PolarHBondContact O-N 2.88Å; D331-Y336 VanDerWaalsContact CG-OH 3.26Å; D331-Y336 PolarHBondContact OD1-OH 3.02Å; D331-V474 HydrophobicContact CB-CG1 4.31Å; D331-T543 WeakPolarHBondContact OD2-CB 3.42Å; D331-T543 VanDerWaalsContact OD2-CG2 3.23Å; D331-T543 WeakPolarHBondContact OD2-CG2 3.34Å |
| 332 | G | 63.6 | Low | 80.1 | Confident | 25 Ų | 25 | 71 Ų | 71 | 26% | 0.258 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.3 | -26.1 | -171.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 333 | K | 67 | Low | 80.2 | Confident | 207 Ų | 207 | 74.6 Ų | 74.6 | 90% | 0.9 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.6 | -7 | -175.5 | -64.9 | -176.3 | -179 | 177.9 | 0 | 115 | D331 L335 | D331-K333 PolarHBondContact O-N 3.18Å; K333-L335 PolarHBondContact O-N 3.45Å |
| 334 | K | 78.1 | Confident | 80.2 | Confident | 99 Ų | 99 | 77.8 Ų | 77.8 | 43% | 0.43 | 40% | 0.4 | S | S | . | . | P | Polyproline II helix | trans | -78 | 127.1 | -177.6 | -168.3 | 174.4 | 173.6 | -168.7 | 0 | 109.6 | D331 Y336 | D331-K334 PolarHBondContact O-N 2.88Å; K334-Y336 HydrophobicContact CB-CE2 4.04Å; K334-Y336 HydrophobicContact CD-CE1 3.99Å; K334-Y336 HydrophobicContact CD-CE2 4.43Å; K334-Y336 HydrophobicContact CG-CE1 4.48Å; K334-Y336 HydrophobicContact CG-CE2 4.29Å |
| 335 | L | 80.9 | Confident | 80.4 | Confident | 128 Ų | 128 | 82.1 Ų | 82.1 | 67% | 0.67 | 41% | 0.412 | S | S | * | . | P | Polyproline II helix | trans | -85.1 | 126 | 169 | -66.2 | 176.3 | 0 | 0 | 0 | 108.2 | N175 K333 | N175-L335 HydrophobicContact CB-CD2 4.34Å; N175-L335 WeakPolarHBondContact OD1-CD2 3.38Å; K333-L335 PolarHBondContact O-N 3.45Å |
| 336 | Y | 85.3 | Confident | 80.6 | Confident | 5 Ų | 5 | 85 Ų | 85 | 2% | 0.02 | 41% | 0.412 | C | S | . | . | P | Polyproline II helix | trans | -99.8 | 151.2 | 178.4 | -69.5 | -84.1 | 0 | 0 | 0 | 110.9 | D331 K334 D340 V474 V475 F544 | D331-Y336 VanDerWaalsContact CG-OH 3.26Å; D331-Y336 PolarHBondContact OD1-OH 3.02Å; K334-Y336 HydrophobicContact CB-CE2 4.04Å; K334-Y336 HydrophobicContact CD-CE1 3.99Å; K334-Y336 HydrophobicContact CD-CE2 4.43Å; K334-Y336 HydrophobicContact CG-CE1 4.48Å; K334-Y336 HydrophobicContact CG-CE2 4.29Å; Y336-D340 WeakPolarHBondContact CA-OD2 3.44Å; Y336-D340 HydrophobicContact CD1-CB 4.21Å; Y336-V474 HydrophobicContact CD2-CB 3.97Å; Y336-V474 HydrophobicContact CE1-CG2 4.39Å; Y336-V474 HydrophobicContact CE2-CB 3.66Å; Y336-V474 HydrophobicContact CE2-CG1 3.83Å; Y336-V474 HydrophobicContact CE2-CG2 4.29Å; Y336-V475 HydrophobicContact CD1-CG1 3.75Å; Y336-V475 HydrophobicContact CG-CG1 3.7Å; Y336-F544 AromaticContact CD1-CE2 3.76Å; Y336-F544 HydrophobicContact CD1-CE2 3.76Å; Y336-F544 AromaticContact CE1-CD2 3.78Å; Y336-F544 HydrophobicContact CE1-CD2 3.78Å; Y336-F544 AromaticContact CE1-CE2 3.43Å; Y336-F544 HydrophobicContact CE1-CE2 3.43Å; Y336-F544 VanDerWaalsContact CE1-CE2 3.43Å |
| 337 | T | 88.9 | Confident | 80.8 | Confident | 60 Ų | 60 | 83.9 Ų | 83.9 | 37% | 0.368 | 41% | 0.407 | S | S | . | . | trans | -130.2 | 169.4 | -176.4 | 65.9 | 0 | 0 | 0 | 0 | 111.8 | L339 D340 | T337-L339 PolarHBondContact O-N 3.44Å; T337-L339 VanDerWaalsContact O-N 3.11Å; T337-D340 PolarHBondContact N-OD2 2.8Å; T337-D340 WeakPolarHBondContact O-CB 3Å; T337-D340 PolarHBondContact O-N 3.15Å; T337-D340 PolarHBondContact OG1-OD2 3.2Å | ||
| 338 | L | 88 | Confident | 81.3 | Confident | 51 Ų | 51 | 84.2 Ų | 84.2 | 27% | 0.267 | 41% | 0.41 | S | S | . | . | G | 310 helix | trans | -56.4 | -26.2 | 175 | -67.3 | 171.7 | 0 | 0 | 0 | 113.2 | I167 D340 L341 I478 F482 | I167-L338 HydrophobicContact CG2-CD1 4.27Å; L338-D340 PolarHBondContact O-N 2.94Å; L338-L341 HydrophobicContact CD2-CD1 4Å; L338-L341 VanDerWaalsContact O-CB 3.29Å; L338-L341 WeakPolarHBondContact O-CB 3.26Å; L338-L341 WeakPolarHBondContact O-CG 3.39Å; L338-L341 PolarHBondContact O-N 3.38Å; L338-I478 HydrophobicContact CD2-CG2 3.48Å; L338-I478 VanDerWaalsContact CD2-CG2 3.48Å; L338-I478 HydrophobicContact CG-CG2 4.24Å; L338-F482 HydrophobicContact CD2-CB 3.88Å; L338-F482 HydrophobicContact CD2-CD2 3.73Å; L338-F482 HydrophobicContact CD2-CG 4.13Å |
| 339 | L | 88.3 | Confident | 82.2 | Confident | 141 Ų | 141 | 86.8 Ų | 86.8 | 74% | 0.738 | 42% | 0.421 | S | S | * | . | G | 310 helix | trans | -65.6 | -27.2 | 176.8 | -64.4 | 170.7 | 0 | 0 | 0 | 112.2 | T337 L341 F342 | T337-L339 PolarHBondContact O-N 3.44Å; T337-L339 VanDerWaalsContact O-N 3.11Å; L339-L341 PolarHBondContact O-N 3.05Å; L339-F342 PolarHBondContact O-N 2.93Å |
| 340 | D | 88.3 | Confident | 83.4 | Confident | 22 Ų | 22 | 80.2 Ų | 80.2 | 12% | 0.118 | 39% | 0.387 | C | S | . | . | G | 310 helix | trans | -70.4 | -15.1 | 178.1 | -62.6 | -57.7 | 0 | 0 | 0 | 112.3 | Y336 T337 L338 F342 H343 L347 V475 F544 | Y336-D340 WeakPolarHBondContact CA-OD2 3.44Å; Y336-D340 HydrophobicContact CD1-CB 4.21Å; T337-D340 PolarHBondContact N-OD2 2.8Å; T337-D340 WeakPolarHBondContact O-CB 3Å; T337-D340 PolarHBondContact O-N 3.15Å; T337-D340 PolarHBondContact OG1-OD2 3.2Å; L338-D340 PolarHBondContact O-N 2.94Å; D340-F342 PolarHBondContact O-N 3.12Å; D340-H343 VanDerWaalsContact O-CB 3.24Å; D340-H343 WeakPolarHBondContact O-CB 3.36Å; D340-H343 PolarHBondContact O-N 3.35Å; D340-L347 WeakPolarHBondContact O-CD2 3.45Å; D340-V475 HydrophobicContact CB-CG1 4.34Å; D340-F544 HydrophobicContact CB-CE2 4.37Å; D340-F544 HydrophobicContact CB-CZ 3.9Å |
| 341 | L | 87.9 | Confident | 84.8 | Confident | 0 Ų | 0 | 69 Ų | 69 | 0% | 0 | 35% | 0.345 | C | S | . | . | G | 310 helix | trans | -66.8 | -13.5 | 169.1 | -58 | 174.5 | 0 | 0 | 0 | 112.5 | L338 L339 L347 T351 Y471 V475 I478 A479 F482 | L338-L341 HydrophobicContact CD2-CD1 4Å; L338-L341 VanDerWaalsContact O-CB 3.29Å; L338-L341 WeakPolarHBondContact O-CB 3.26Å; L338-L341 WeakPolarHBondContact O-CG 3.39Å; L338-L341 PolarHBondContact O-N 3.38Å; L339-L341 PolarHBondContact O-N 3.05Å; L341-L347 WeakPolarHBondContact O-CD2 3.31Å; L341-L347 WeakPolarHBondContact O-CG 3.48Å; L341-T351 PolarHBondContact O-OG1 3.25Å; L341-Y471 HydrophobicContact CB-CE1 4.27Å; L341-Y471 HydrophobicContact CD2-CD1 3.57Å; L341-Y471 HydrophobicContact CD2-CE1 3.56Å; L341-V475 HydrophobicContact CD2-CG2 4.44Å; L341-I478 HydrophobicContact CD1-CG2 4.33Å; L341-I478 HydrophobicContact CG-CG2 4.49Å; L341-A479 HydrophobicContact CD2-CB 3.7Å; L341-F482 HydrophobicContact CD1-CB 3.75Å; L341-F482 HydrophobicContact CD1-CD1 3.7Å; L341-F482 HydrophobicContact CD1-CD2 4.26Å; L341-F482 HydrophobicContact CD1-CE1 4.31Å; L341-F482 HydrophobicContact CD1-CG 3.65Å |
| 342 | F | 90.5 | Very high | 86.2 | Confident | 93 Ų | 93 | 70.1 Ų | 70.1 | 41% | 0.408 | 36% | 0.357 | S | S | . | . | G | 310 helix | trans | -114.6 | 15.9 | 177.6 | -60.5 | -89.6 | 0 | 0 | 0 | 112.1 | L339 D340 T344 A348 T351 F482 | L339-F342 PolarHBondContact O-N 2.93Å; D340-F342 PolarHBondContact O-N 3.12Å; F342-T344 VanDerWaalsContact C-N 3.29Å; F342-T344 PolarHBondContact O-N 3.36Å; F342-T344 VanDerWaalsContact O-N 3.17Å; F342-A348 HydrophobicContact CB-CB 4.36Å; F342-A348 HydrophobicContact CD1-CB 3.96Å; F342-T351 HydrophobicContact CD1-CG2 4.39Å; F342-T351 HydrophobicContact CE1-CG2 3.64Å; F342-T351 HydrophobicContact CE2-CG2 4.11Å; F342-T351 HydrophobicContact CZ-CG2 3.48Å; F342-T351 VanDerWaalsContact CZ-CG2 3.48Å; F342-F482 HydrophobicContact CE2-CZ 4.31Å; F342-F482 HydrophobicContact CZ-CZ 4.32Å |
| 343 | H | 86 | Confident | 87.7 | Confident | 104 Ų | 104 | 69 Ų | 69 | 48% | 0.481 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -56.5 | -36.6 | -170.5 | -171.9 | 71.1 | 0 | 0 | 0 | 114.6 | D340 F544 | D340-H343 VanDerWaalsContact O-CB 3.24Å; D340-H343 WeakPolarHBondContact O-CB 3.36Å; D340-H343 PolarHBondContact O-N 3.35Å; H343-F544 HydrophobicContact CB-CD1 4.34Å; H343-F544 HydrophobicContact CB-CE1 3.95Å |
| 344 | T | 88.4 | Confident | 89 | Confident | 66 Ų | 66 | 59.2 Ų | 59.2 | 41% | 0.405 | 30% | 0.303 | S | S | . | . | S | Bend | trans | -127.2 | 148.4 | -179.4 | -52.3 | 0 | 0 | 0 | 0 | 110 | F342 K346 L347 A348 | F342-T344 VanDerWaalsContact C-N 3.29Å; F342-T344 PolarHBondContact O-N 3.36Å; F342-T344 VanDerWaalsContact O-N 3.17Å; T344-K346 PolarHBondContact O-N 2.87Å; T344-K346 VanDerWaalsContact O-N 3.15Å; T344-L347 CarbonylContact O-C 3.18Å; T344-L347 WeakPolarHBondContact O-CA 3.27Å; T344-L347 WeakPolarHBondContact O-CB 3.39Å; T344-L347 PolarHBondContact O-N 3.35Å; T344-A348 PolarHBondContact O-N 2.92Å |
| 345 | K | 87.9 | Confident | 89.9 | Confident | 167 Ų | 167 | 55.8 Ų | 55.8 | 73% | 0.726 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -50.4 | -42.5 | 178.3 | -171.6 | 178.2 | -179.9 | -179.8 | 0 | 113 | A348 M349 | K345-A348 PolarHBondContact O-N 3.46Å; K345-M349 HydrophobicContact CG-CE 4.31Å; K345-M349 HydrophobicContact CG-SD 4.46Å; K345-M349 VanDerWaalsContact O-CG 3.29Å; K345-M349 WeakPolarHBondContact O-CG 3.32Å; K345-M349 PolarHBondContact O-N 3.33Å |
| 346 | K | 88 | Confident | 90.6 | Very high | 129 Ų | 129 | 51.8 Ų | 51.8 | 56% | 0.561 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -61.5 | -42.9 | 175.8 | -175.5 | -179.8 | 178.5 | -177.1 | 0 | 112.4 | T344 S350 | T344-K346 PolarHBondContact O-N 2.87Å; T344-K346 VanDerWaalsContact O-N 3.15Å; K346-S350 PolarHBondContact O-N 2.93Å; K346-S350 VanDerWaalsContact O-N 3.09Å; K346-S350 PolarHBondContact O-OG 3.09Å |
| 347 | L | 88.8 | Confident | 91.1 | Very high | 9 Ų | 9 | 51.5 Ų | 51.5 | 5% | 0.047 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -69.2 | -46.3 | 177.9 | -166.6 | 65 | 0 | 0 | 0 | 110.4 | D340 L341 T344 M349 S350 T351 V470 Y471 F544 | D340-L347 WeakPolarHBondContact O-CD2 3.45Å; L341-L347 WeakPolarHBondContact O-CD2 3.31Å; L341-L347 WeakPolarHBondContact O-CG 3.48Å; T344-L347 CarbonylContact O-C 3.18Å; T344-L347 WeakPolarHBondContact O-CA 3.27Å; T344-L347 WeakPolarHBondContact O-CB 3.39Å; T344-L347 PolarHBondContact O-N 3.35Å; L347-M349 VanDerWaalsContact C-N 3.34Å; L347-M349 PolarHBondContact O-N 3.01Å; L347-S350 CarbonylContact O-C 3.58Å; L347-S350 WeakPolarHBondContact O-CA 3.42Å; L347-S350 WeakPolarHBondContact O-CB 3.35Å; L347-S350 PolarHBondContact O-N 3.43Å; L347-T351 WeakPolarHBondContact O-CB 3.3Å; L347-T351 PolarHBondContact O-N 3.05Å; L347-T351 PolarHBondContact O-OG1 3.14Å; L347-V470 HydrophobicContact CD1-CG1 3.75Å; L347-Y471 HydrophobicContact CD1-CD1 3.85Å; L347-Y471 HydrophobicContact CD1-CE1 3.54Å; L347-Y471 HydrophobicContact CD2-CD1 4.43Å; L347-Y471 HydrophobicContact CD2-CE1 4.24Å; L347-Y471 HydrophobicContact CG-CD1 4.48Å; L347-Y471 HydrophobicContact CG-CE1 3.96Å; L347-F544 HydrophobicContact CD2-CE1 3.83Å |
| 348 | A | 91.8 | Very high | 91.4 | Very high | 27 Ų | 27 | 48.8 Ų | 48.8 | 22% | 0.223 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -56.9 | -43.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | F342 T344 K345 T351 A352 | F342-A348 HydrophobicContact CB-CB 4.36Å; F342-A348 HydrophobicContact CD1-CB 3.96Å; T344-A348 PolarHBondContact O-N 2.92Å; K345-A348 PolarHBondContact O-N 3.46Å; A348-T351 PolarHBondContact O-N 3.29Å; A348-A352 WeakPolarHBondContact O-CB 3.3Å; A348-A352 PolarHBondContact O-N 3.45Å |
| 349 | M | 92.4 | Very high | 91.8 | Very high | 77 Ų | 77 | 49.2 Ų | 49.2 | 38% | 0.379 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.6 | -41.2 | 174.3 | -69.9 | -176.6 | -55.3 | 0 | 0 | 112.1 | K345 L347 A352 A353 Y527 | K345-M349 HydrophobicContact CG-CE 4.31Å; K345-M349 HydrophobicContact CG-SD 4.46Å; K345-M349 VanDerWaalsContact O-CG 3.29Å; K345-M349 WeakPolarHBondContact O-CG 3.32Å; K345-M349 PolarHBondContact O-N 3.33Å; L347-M349 VanDerWaalsContact C-N 3.34Å; L347-M349 PolarHBondContact O-N 3.01Å; M349-A352 PolarHBondContact O-N 3.21Å; M349-A353 WeakPolarHBondContact O-CB 3.41Å; M349-A353 PolarHBondContact O-N 2.86Å; M349-Y527 HydrophobicContact CB-CD1 3.99Å; M349-Y527 HydrophobicContact CB-CE1 4.27Å; M349-Y527 HydrophobicContact CG-CE1 4.29Å; M349-Y527 HydrophobicContact SD-CD1 4.37Å; M349-Y527 HydrophobicContact SD-CE1 3.91Å |
| 350 | S | 91.7 | Very high | 92.1 | Very high | 14 Ų | 14 | 42.5 Ų | 42.5 | 10% | 0.098 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.7 | -40.7 | 176.3 | -54.6 | 0 | 0 | 0 | 0 | 111.3 | K346 L347 A353 L354 | K346-S350 PolarHBondContact O-N 2.93Å; K346-S350 VanDerWaalsContact O-N 3.09Å; K346-S350 PolarHBondContact O-OG 3.09Å; L347-S350 CarbonylContact O-C 3.58Å; L347-S350 WeakPolarHBondContact O-CA 3.42Å; L347-S350 WeakPolarHBondContact O-CB 3.35Å; L347-S350 PolarHBondContact O-N 3.43Å; S350-A353 PolarHBondContact O-N 3.06Å; S350-L354 WeakPolarHBondContact O-CB 3.48Å; S350-L354 WeakPolarHBondContact O-CG 3.29Å; S350-L354 PolarHBondContact O-N 3.42Å |
| 351 | T | 94.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61 | -47.1 | 175.3 | -54.6 | 0 | 0 | 0 | 0 | 110.7 | L341 F342 L347 A348 A353 L354 L355 Y471 F482 F483 | L341-T351 PolarHBondContact O-OG1 3.25Å; F342-T351 HydrophobicContact CD1-CG2 4.39Å; F342-T351 HydrophobicContact CE1-CG2 3.64Å; F342-T351 HydrophobicContact CE2-CG2 4.11Å; F342-T351 HydrophobicContact CZ-CG2 3.48Å; F342-T351 VanDerWaalsContact CZ-CG2 3.48Å; L347-T351 WeakPolarHBondContact O-CB 3.3Å; L347-T351 PolarHBondContact O-N 3.05Å; L347-T351 PolarHBondContact O-OG1 3.14Å; A348-T351 PolarHBondContact O-N 3.29Å; T351-A353 PolarHBondContact O-N 2.76Å; T351-L354 PolarHBondContact O-N 3.49Å; T351-L355 HydrophobicContact CG2-CD1 4.3Å; T351-L355 WeakPolarHBondContact O-CB 3.49Å; T351-L355 VanDerWaalsContact O-CG 3.3Å; T351-L355 WeakPolarHBondContact O-CG 3.48Å; T351-L355 PolarHBondContact O-N 3.16Å; T351-Y471 VanDerWaalsContact CA-OH 3.24Å; T351-Y471 WeakPolarHBondContact CA-OH 3.41Å; T351-Y471 WeakPolarHBondContact CB-OH 3.49Å; T351-Y471 PolarHBondContact OG1-OH 3.27Å; T351-F482 HydrophobicContact CG2-CE1 4.07Å; T351-F483 HydrophobicContact CG2-CZ 4.13Å |
| 352 | A | 94.7 | Very high | 92.6 | Very high | 49 Ų | 49 | 41.5 Ų | 41.5 | 41% | 0.405 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -61 | -43 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A348 M349 L355 V356 | A348-A352 WeakPolarHBondContact O-CB 3.3Å; A348-A352 PolarHBondContact O-N 3.45Å; M349-A352 PolarHBondContact O-N 3.21Å; A352-L355 PolarHBondContact O-N 3.22Å; A352-V356 WeakPolarHBondContact O-CG2 3.45Å; A352-V356 PolarHBondContact O-N 3.04Å; A352-V356 VanDerWaalsContact O-N 3.09Å |
| 353 | A | 94.7 | Very high | 92.6 | Very high | 1 Ų | 1 | 37.1 Ų | 37.1 | 1% | 0.008 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.7 | -41.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | M349 S350 T351 S357 V523 Y527 I528 | M349-A353 WeakPolarHBondContact O-CB 3.41Å; M349-A353 PolarHBondContact O-N 2.86Å; S350-A353 PolarHBondContact O-N 3.06Å; T351-A353 PolarHBondContact O-N 2.76Å; A353-S357 WeakPolarHBondContact O-CB 3.28Å; A353-S357 PolarHBondContact O-N 3.37Å; A353-S357 PolarHBondContact O-OG 2.72Å; A353-V523 HydrophobicContact CB-CG1 3.61Å; A353-Y527 HydrophobicContact CB-CG 4.47Å; A353-I528 HydrophobicContact CB-CG1 4.3Å |
| 354 | L | 95.3 | Very high | 92.8 | Very high | 2 Ų | 2 | 32.1 Ų | 32.1 | 1% | 0.01 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -69.8 | -34.5 | 176.4 | -72.3 | 168 | 0 | 0 | 0 | 112.1 | S350 T351 S357 V358 V463 T466 V467 Y471 F483 | S350-L354 WeakPolarHBondContact O-CB 3.48Å; S350-L354 WeakPolarHBondContact O-CG 3.29Å; S350-L354 PolarHBondContact O-N 3.42Å; T351-L354 PolarHBondContact O-N 3.49Å; L354-S357 WeakPolarHBondContact O-CB 3.5Å; L354-S357 PolarHBondContact O-N 3.17Å; L354-V358 VanDerWaalsContact O-CG2 3.31Å; L354-V358 WeakPolarHBondContact O-CG2 3.24Å; L354-V358 PolarHBondContact O-N 3.25Å; L354-V463 HydrophobicContact CD2-CG1 4.14Å; L354-T466 HydrophobicContact CD1-CG2 4.43Å; L354-T466 HydrophobicContact CD2-CG2 3.85Å; L354-V467 HydrophobicContact CD1-CG2 4.08Å; L354-V467 HydrophobicContact CD2-CG2 4.35Å; L354-Y471 HydrophobicContact CD1-CE2 3.82Å; L354-F483 HydrophobicContact CB-CD1 4.13Å; L354-F483 HydrophobicContact CB-CE1 3.35Å; L354-F483 HydrophobicContact CB-CE2 4.46Å; L354-F483 HydrophobicContact CB-CZ 3.56Å; L354-F483 HydrophobicContact CD1-CE2 4.26Å; L354-F483 HydrophobicContact CD1-CZ 3.92Å; L354-F483 HydrophobicContact CG-CZ 4.4Å |
| 355 | L | 96.2 | Very high | 92.8 | Very high | 26 Ų | 26 | 30 Ų | 30 | 14% | 0.136 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.2 | -47.9 | 173.7 | -80.2 | 174.9 | 0 | 0 | 0 | 111.6 | T351 A352 S357 V358 I359 F482 F483 F486 | T351-L355 HydrophobicContact CG2-CD1 4.3Å; T351-L355 WeakPolarHBondContact O-CB 3.49Å; T351-L355 VanDerWaalsContact O-CG 3.3Å; T351-L355 WeakPolarHBondContact O-CG 3.48Å; T351-L355 PolarHBondContact O-N 3.16Å; A352-L355 PolarHBondContact O-N 3.22Å; L355-S357 PolarHBondContact O-N 3.36Å; L355-V358 PolarHBondContact O-N 2.91Å; L355-I359 VanDerWaalsContact O-CG1 3.28Å; L355-I359 WeakPolarHBondContact O-CG1 3.46Å; L355-I359 PolarHBondContact O-N 3.41Å; L355-F482 HydrophobicContact CD1-CE1 4.02Å; L355-F482 HydrophobicContact CD1-CZ 4.26Å; L355-F482 HydrophobicContact CD2-CD1 4.32Å; L355-F482 HydrophobicContact CD2-CE1 3.62Å; L355-F482 HydrophobicContact CD2-CZ 4.17Å; L355-F482 HydrophobicContact CG-CE1 4.06Å; L355-F483 HydrophobicContact CD2-CD1 4.17Å; L355-F483 HydrophobicContact CD2-CE1 4.1Å; L355-F483 HydrophobicContact CG-CE1 4.02Å; L355-F486 HydrophobicContact CD2-CB 3.78Å; L355-F486 HydrophobicContact CD2-CD1 3.55Å; L355-F486 HydrophobicContact CD2-CD2 3.92Å; L355-F486 HydrophobicContact CD2-CE1 4.06Å; L355-F486 HydrophobicContact CD2-CE2 4.42Å; L355-F486 HydrophobicContact CD2-CG 3.44Å; L355-F486 VanDerWaalsContact CD2-CG 3.44Å; L355-F486 HydrophobicContact CD2-CZ 4.47Å |
| 356 | V | 95.8 | Very high | 92.6 | Very high | 44 Ų | 44 | 22 Ų | 22 | 27% | 0.267 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -59.7 | -39.6 | 174.4 | 171.4 | 0 | 0 | 0 | 0 | 110.7 | A352 I359 S360 I519 T520 | A352-V356 WeakPolarHBondContact O-CG2 3.45Å; A352-V356 PolarHBondContact O-N 3.04Å; A352-V356 VanDerWaalsContact O-N 3.09Å; V356-I359 PolarHBondContact O-N 2.93Å; V356-S360 PolarHBondContact O-N 3.4Å; V356-I519 HydrophobicContact CG1-CG2 4.37Å; V356-T520 HydrophobicContact CG1-CG2 4.28Å; V356-T520 WeakPolarHBondContact CG1-OG1 3.37Å; V356-T520 PolarHBondContact O-OG1 2.98Å |
| 357 | S | 96 | Very high | 92.2 | Very high | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -62.1 | -47.7 | 176.8 | -57 | 0 | 0 | 0 | 0 | 112.2 | A353 L354 L355 S360 I361 Y459 | A353-S357 WeakPolarHBondContact O-CB 3.28Å; A353-S357 PolarHBondContact O-N 3.37Å; A353-S357 PolarHBondContact O-OG 2.72Å; L354-S357 WeakPolarHBondContact O-CB 3.5Å; L354-S357 PolarHBondContact O-N 3.17Å; L355-S357 PolarHBondContact O-N 3.36Å; S357-S360 PolarHBondContact O-N 3.4Å; S357-S360 PolarHBondContact O-OG 3.42Å; S357-I361 WeakPolarHBondContact O-CG1 3.47Å; S357-I361 PolarHBondContact O-N 2.84Å; S357-Y459 WeakPolarHBondContact CA-OH 3.41Å; S357-Y459 VanDerWaalsContact CB-OH 3.24Å; S357-Y459 WeakPolarHBondContact CB-OH 3.49Å; S357-Y459 PolarHBondContact O-OH 3.01Å |
| 358 | V | 95.6 | Very high | 91.5 | Very high | 3 Ų | 3 | 16.1 Ų | 16.1 | 2% | 0.018 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -65.5 | -43 | 178.9 | 169.6 | 0 | 0 | 0 | 0 | 111.9 | L354 L355 S360 I361 S362 V463 F483 E487 | L354-V358 VanDerWaalsContact O-CG2 3.31Å; L354-V358 WeakPolarHBondContact O-CG2 3.24Å; L354-V358 PolarHBondContact O-N 3.25Å; L355-V358 PolarHBondContact O-N 2.91Å; V358-S360 PolarHBondContact O-N 3.37Å; V358-I361 WeakPolarHBondContact O-CB 3.45Å; V358-I361 PolarHBondContact O-N 3.03Å; V358-S362 PolarHBondContact O-N 3.34Å; V358-S362 PolarHBondContact O-OG 3.29Å; V358-S362 VanDerWaalsContact O-OG 3.12Å; V358-V463 HydrophobicContact CG2-CG1 3.87Å; V358-F483 WeakPolarHBondContact CG1-O 3.36Å; V358-F483 HydrophobicContact CG2-CB 4.16Å; V358-F483 HydrophobicContact CG2-CD1 4.04Å; V358-F483 HydrophobicContact CG2-CG 4.45Å; V358-E487 HydrophobicContact CG1-CB 3.34Å; V358-E487 HydrophobicContact CG1-CG 3.84Å; V358-E487 VanDerWaalsContact CG1-N 3.26Å |
| 359 | I | 94.8 | Very high | 90.3 | Very high | 59 Ų | 59 | 15.6 Ų | 15.6 | 30% | 0.303 | 9% | 0.091 | S | C | . | . | H | α-helix | trans | -59.5 | -36.7 | 175.7 | -69.5 | 167.2 | 0 | 0 | 0 | 111 | L355 V356 I361 S362 A363 I494 | L355-I359 VanDerWaalsContact O-CG1 3.28Å; L355-I359 WeakPolarHBondContact O-CG1 3.46Å; L355-I359 PolarHBondContact O-N 3.41Å; V356-I359 PolarHBondContact O-N 2.93Å; I359-I361 VanDerWaalsContact C-N 3.34Å; I359-S362 WeakPolarHBondContact O-CB 3.36Å; I359-S362 PolarHBondContact O-N 3.01Å; I359-A363 PolarHBondContact O-N 2.87Å; I359-I494 HydrophobicContact CG2-CD1 3.98Å |
| 360 | S | 94.9 | Very high | 88.8 | Confident | 0 Ų | 0 | 13.2 Ų | 13.2 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -67.7 | -32.8 | 175.7 | 72.2 | 0 | 0 | 0 | 0 | 113.5 | V356 S357 V358 A363 V364 Y459 T520 | V356-S360 PolarHBondContact O-N 3.4Å; S357-S360 PolarHBondContact O-N 3.4Å; S357-S360 PolarHBondContact O-OG 3.42Å; V358-S360 PolarHBondContact O-N 3.37Å; S360-A363 PolarHBondContact O-N 3.21Å; S360-V364 WeakPolarHBondContact O-CG2 3.21Å; S360-V364 PolarHBondContact O-N 3.35Å; S360-V364 VanDerWaalsContact O-N 3.09Å; S360-Y459 WeakPolarHBondContact OG-CE1 3.29Å; S360-Y459 PolarHBondContact OG-OH 3Å; S360-T520 WeakPolarHBondContact CB-OG1 3.22Å |
| 361 | I | 94.2 | Very high | 87.5 | Confident | 1 Ų | 1 | 12.6 Ų | 12.6 | 1% | 0.005 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -64.9 | -45.2 | 171.9 | -63.3 | 175.8 | 0 | 0 | 0 | 109.5 | S357 V358 I359 A363 V364 N365 Y459 H460 V463 | S357-I361 WeakPolarHBondContact O-CG1 3.47Å; S357-I361 PolarHBondContact O-N 2.84Å; V358-I361 WeakPolarHBondContact O-CB 3.45Å; V358-I361 PolarHBondContact O-N 3.03Å; I359-I361 VanDerWaalsContact C-N 3.34Å; I361-A363 VanDerWaalsContact C-N 3.3Å; I361-A363 PolarHBondContact O-N 2.66Å; I361-V364 PolarHBondContact O-N 2.85Å; I361-N365 WeakPolarHBondContact O-CB 3.49Å; I361-N365 VanDerWaalsContact O-CG 3.3Å; I361-N365 PolarHBondContact O-N 3.4Å; I361-N365 PolarHBondContact O-ND2 2.88Å; I361-Y459 HydrophobicContact CD1-CD1 3.97Å; I361-Y459 HydrophobicContact CD1-CE1 3.93Å; I361-Y459 HydrophobicContact CG1-CD1 3.49Å; I361-Y459 VanDerWaalsContact CG1-CD1 3.49Å; I361-Y459 HydrophobicContact CG1-CE1 3.3Å; I361-Y459 HydrophobicContact CG1-CG 4.49Å; I361-H460 HydrophobicContact CD1-CB 4Å; I361-V463 HydrophobicContact CD1-CB 4.35Å; I361-V463 HydrophobicContact CD1-CG2 4.15Å |
| 362 | S | 92.2 | Very high | 85.7 | Confident | 0 Ų | 0 | 13.3 Ų | 13.3 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -58.6 | -41.4 | 174.9 | -48 | 0 | 0 | 0 | 0 | 112.5 | V358 I359 N365 A366 E487 | V358-S362 PolarHBondContact O-N 3.34Å; V358-S362 PolarHBondContact O-OG 3.29Å; V358-S362 VanDerWaalsContact O-OG 3.12Å; I359-S362 WeakPolarHBondContact O-CB 3.36Å; I359-S362 PolarHBondContact O-N 3.01Å; S362-N365 PolarHBondContact O-N 3.42Å; S362-A366 VanDerWaalsContact O-CB 3.24Å; S362-A366 WeakPolarHBondContact O-CB 3.33Å; S362-A366 PolarHBondContact O-N 3.4Å; S362-E487 WeakPolarHBondContact CB-O 3.42Å; S362-E487 VanDerWaalsContact OG-C 3.32Å; S362-E487 VanDerWaalsContact OG-CA 3.29Å; S362-E487 WeakPolarHBondContact OG-CA 3.18Å; S362-E487 PolarHBondContact OG-O 3.44Å |
| 363 | A | 91.4 | Very high | 83.9 | Confident | 1 Ų | 1 | 15.9 Ų | 15.9 | 1% | 0.008 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -62.7 | -44.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I359 S360 I361 A366 S367 I494 V513 V516 | I359-A363 PolarHBondContact O-N 2.87Å; S360-A363 PolarHBondContact O-N 3.21Å; I361-A363 VanDerWaalsContact C-N 3.3Å; I361-A363 PolarHBondContact O-N 2.66Å; A363-A366 PolarHBondContact O-N 3.22Å; A363-S367 PolarHBondContact O-N 2.96Å; A363-I494 HydrophobicContact CB-CD1 3.79Å; A363-I494 HydrophobicContact CB-CG2 4.43Å; A363-V513 HydrophobicContact CB-CG1 4.41Å; A363-V513 HydrophobicContact CB-CG2 4.19Å; A363-V516 HydrophobicContact CB-CG1 4.4Å |
| 364 | V | 91 | Very high | 82 | Confident | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -65.8 | -43.3 | 175.5 | 174.8 | 0 | 0 | 0 | 0 | 111 | S360 I361 A366 S367 T421 F425 V513 L517 | S360-V364 WeakPolarHBondContact O-CG2 3.21Å; S360-V364 PolarHBondContact O-N 3.35Å; S360-V364 VanDerWaalsContact O-N 3.09Å; I361-V364 PolarHBondContact O-N 2.85Å; V364-A366 PolarHBondContact O-N 2.88Å; V364-S367 WeakPolarHBondContact O-CB 3.47Å; V364-S367 PolarHBondContact O-N 3.1Å; V364-S367 PolarHBondContact O-OG 2.84Å; V364-T421 HydrophobicContact CG1-CG2 4.43Å; V364-T421 HydrophobicContact CG2-CG2 3.86Å; V364-F425 HydrophobicContact CB-CE2 4.41Å; V364-F425 HydrophobicContact CB-CZ 4.5Å; V364-F425 HydrophobicContact CG1-CE2 4Å; V364-F425 HydrophobicContact CG1-CZ 4.17Å; V364-F425 HydrophobicContact CG2-CE2 3.86Å; V364-F425 HydrophobicContact CG2-CZ 4.28Å; V364-V513 HydrophobicContact CG2-CG1 4.26Å; V364-L517 HydrophobicContact CG2-CD1 4.12Å; V364-L517 HydrophobicContact CG2-CD2 3.8Å; V364-L517 HydrophobicContact CG2-CG 4.36Å |
| 365 | N | 86.7 | Confident | 79.8 | Confident | 20 Ų | 20 | 20.9 Ų | 20.9 | 11% | 0.107 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -63.3 | -42.3 | 177.2 | -72 | -20.1 | 0 | 0 | 0 | 111.8 | I361 S362 S367 L368 F452 | I361-N365 WeakPolarHBondContact O-CB 3.49Å; I361-N365 VanDerWaalsContact O-CG 3.3Å; I361-N365 PolarHBondContact O-N 3.4Å; I361-N365 PolarHBondContact O-ND2 2.88Å; S362-N365 PolarHBondContact O-N 3.42Å; N365-S367 VanDerWaalsContact C-N 3.29Å; N365-S367 PolarHBondContact O-N 2.72Å; N365-L368 VanDerWaalsContact O-CB 3.25Å; N365-L368 WeakPolarHBondContact O-CB 3.33Å; N365-L368 PolarHBondContact O-N 3.48Å; N365-F452 HydrophobicContact CB-CE2 4.37Å; N365-F452 WeakPolarHBondContact OD1-CE2 3.3Å |
| 366 | A | 83.8 | Confident | 77.5 | Confident | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -64.9 | -31 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S362 A363 V364 L368 L369 I494 I498 | S362-A366 VanDerWaalsContact O-CB 3.24Å; S362-A366 WeakPolarHBondContact O-CB 3.33Å; S362-A366 PolarHBondContact O-N 3.4Å; A363-A366 PolarHBondContact O-N 3.22Å; V364-A366 PolarHBondContact O-N 2.88Å; A366-L368 PolarHBondContact O-N 3.38Å; A366-L368 VanDerWaalsContact O-N 3.15Å; A366-L369 WeakPolarHBondContact O-CB 3.18Å; A366-L369 WeakPolarHBondContact O-CG 3.38Å; A366-L369 PolarHBondContact O-N 3.44Å; A366-I494 HydrophobicContact CB-CB 4.42Å; A366-I494 HydrophobicContact CB-CG2 4.07Å; A366-I498 HydrophobicContact CB-CD1 4.08Å |
| 367 | S | 80.4 | Confident | 75.5 | Confident | 9 Ų | 9 | 21 Ų | 21 | 6% | 0.063 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -63.4 | -17.2 | 175.3 | 80.4 | 0 | 0 | 0 | 0 | 113.8 | A363 V364 N365 L369 F370 F425 | A363-S367 PolarHBondContact O-N 2.96Å; V364-S367 WeakPolarHBondContact O-CB 3.47Å; V364-S367 PolarHBondContact O-N 3.1Å; V364-S367 PolarHBondContact O-OG 2.84Å; N365-S367 VanDerWaalsContact C-N 3.29Å; N365-S367 PolarHBondContact O-N 2.72Å; S367-L369 PolarHBondContact O-N 3.29Å; S367-F370 VanDerWaalsContact O-CB 3.3Å; S367-F370 WeakPolarHBondContact O-CB 3.03Å; S367-F370 PolarHBondContact O-N 3.2Å; S367-F425 VanDerWaalsContact OG-CZ 3.25Å; S367-F425 WeakPolarHBondContact OG-CZ 3.43Å |
| 368 | L | 74.3 | Confident | 73.7 | Confident | 5 Ų | 5 | 25.7 Ų | 25.7 | 3% | 0.026 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -66.1 | -28.7 | 172.4 | -162.3 | 66.9 | 0 | 0 | 0 | 111.6 | F89 Y90 N365 A366 F370 L371 S372 M377 M449 F452 | F89-L368 HydrophobicContact CE1-CB 4.34Å; F89-L368 HydrophobicContact CE1-CD2 3.95Å; F89-L368 HydrophobicContact CE1-CG 4.32Å; F89-L368 HydrophobicContact CZ-CB 4.16Å; F89-L368 HydrophobicContact CZ-CD2 4.36Å; Y90-L368 VanDerWaalsContact OH-CD2 3.28Å; Y90-L368 WeakPolarHBondContact OH-CD2 3.45Å; N365-L368 VanDerWaalsContact O-CB 3.25Å; N365-L368 WeakPolarHBondContact O-CB 3.33Å; N365-L368 PolarHBondContact O-N 3.48Å; A366-L368 PolarHBondContact O-N 3.38Å; A366-L368 VanDerWaalsContact O-N 3.15Å; L368-F370 VanDerWaalsContact C-N 3.31Å; L368-F370 PolarHBondContact O-N 3.43Å; L368-L371 WeakPolarHBondContact O-CB 3.41Å; L368-L371 PolarHBondContact O-N 2.8Å; L368-L371 VanDerWaalsContact O-N 3.13Å; L368-S372 PolarHBondContact O-N 3.11Å; L368-M377 HydrophobicContact CD1-CE 3.23Å; L368-M377 HydrophobicContact CG-CE 3.71Å; L368-M449 HydrophobicContact CD1-SD 4.35Å; L368-F452 HydrophobicContact CB-CD2 4.48Å; L368-F452 HydrophobicContact CD1-CG 4.39Å; L368-F452 HydrophobicContact CD2-CD2 4.23Å; L368-F452 HydrophobicContact CD2-CE1 4.2Å; L368-F452 HydrophobicContact CD2-CE2 3.89Å; L368-F452 HydrophobicContact CD2-CZ 3.88Å |
| 369 | L | 65.6 | Low | 72.7 | Confident | 16 Ų | 16 | 28 Ų | 28 | 8% | 0.084 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.3 | -36.3 | 175 | -60.9 | 174.2 | 0 | 0 | 0 | 111.7 | F89 M92 A366 S367 L371 S372 | F89-L369 HydrophobicContact CD1-CD2 4.24Å; F89-L369 HydrophobicContact CD2-CD2 4.05Å; F89-L369 HydrophobicContact CE1-CD2 3.68Å; F89-L369 HydrophobicContact CE1-CG 4.43Å; F89-L369 HydrophobicContact CE2-CD1 4.31Å; F89-L369 HydrophobicContact CE2-CD2 3.46Å; F89-L369 VanDerWaalsContact CE2-CD2 3.46Å; F89-L369 HydrophobicContact CE2-CG 3.86Å; F89-L369 HydrophobicContact CG-CD2 4.42Å; F89-L369 HydrophobicContact CZ-CD2 3.27Å; F89-L369 HydrophobicContact CZ-CG 3.63Å; M92-L369 HydrophobicContact CE-CD1 4.48Å; M92-L369 HydrophobicContact CE-CD2 3.21Å; M92-L369 HydrophobicContact CE-CG 4.47Å; M92-L369 HydrophobicContact SD-CD2 4.33Å; A366-L369 WeakPolarHBondContact O-CB 3.18Å; A366-L369 WeakPolarHBondContact O-CG 3.38Å; A366-L369 PolarHBondContact O-N 3.44Å; S367-L369 PolarHBondContact O-N 3.29Å; L369-L371 PolarHBondContact O-N 3.06Å; L369-S372 WeakPolarHBondContact O-CB 3.42Å; L369-S372 PolarHBondContact O-N 2.86Å; L369-S372 VanDerWaalsContact O-N 3.11Å; L369-S372 PolarHBondContact O-OG 3.34Å |
| 370 | F | 62.5 | Low | 71.7 | Confident | 27 Ų | 27 | 26.7 Ų | 26.7 | 12% | 0.118 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -57.9 | -39.6 | 172.9 | 167.9 | -94.6 | 0 | 0 | 0 | 111.4 | S367 L368 S372 L432 I498 T502 A506 | S367-F370 VanDerWaalsContact O-CB 3.3Å; S367-F370 WeakPolarHBondContact O-CB 3.03Å; S367-F370 PolarHBondContact O-N 3.2Å; L368-F370 VanDerWaalsContact C-N 3.31Å; L368-F370 PolarHBondContact O-N 3.43Å; F370-S372 VanDerWaalsContact C-N 3.3Å; F370-S372 PolarHBondContact O-N 3.26Å; F370-L432 HydrophobicContact CZ-CD1 4.34Å; F370-L432 HydrophobicContact CZ-CD2 3.99Å; F370-I498 HydrophobicContact CB-CG2 4.34Å; F370-T502 HydrophobicContact CD2-CG2 3.47Å; F370-T502 VanDerWaalsContact CD2-CG2 3.47Å; F370-T502 HydrophobicContact CE2-CG2 3.82Å; F370-A506 HydrophobicContact CE2-CB 3.52Å; F370-A506 WeakPolarHBondContact CE2-O 3.45Å; F370-A506 HydrophobicContact CZ-CB 3.85Å |
| 371 | L | 63 | Low | 70.9 | Confident | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.005 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -78.2 | -12.6 | -179.9 | -138.8 | 69.3 | 0 | 0 | 0 | 113.5 | L368 L369 H373 Q374 M377 Y445 V448 | L368-L371 WeakPolarHBondContact O-CB 3.41Å; L368-L371 PolarHBondContact O-N 2.8Å; L368-L371 VanDerWaalsContact O-N 3.13Å; L369-L371 PolarHBondContact O-N 3.06Å; L371-H373 PolarHBondContact O-N 3.42Å; L371-H373 VanDerWaalsContact O-N 3.12Å; L371-Q374 HydrophobicContact CD1-CG 4.25Å; L371-Q374 VanDerWaalsContact CD1-OE1 3.31Å; L371-Q374 HydrophobicContact CG-CG 4.38Å; L371-Q374 WeakPolarHBondContact O-CB 3.33Å; L371-Q374 PolarHBondContact O-N 3.29Å; L371-M377 HydrophobicContact CB-CE 3.93Å; L371-M377 HydrophobicContact CD2-CE 3.86Å; L371-M377 HydrophobicContact CG-CE 4.33Å; L371-M377 VanDerWaalsContact O-CG 3.22Å; L371-M377 WeakPolarHBondContact O-CG 3.15Å; L371-Y445 HydrophobicContact CD2-CD2 3.39Å; L371-Y445 HydrophobicContact CD2-CE2 3.9Å; L371-Y445 HydrophobicContact CD2-CG 4.25Å; L371-Y445 HydrophobicContact CG-CD2 4.03Å; L371-V448 HydrophobicContact CD1-CB 4.48Å; L371-V448 HydrophobicContact CD1-CG2 4.28Å; L371-V448 HydrophobicContact CD2-CB 3.83Å; L371-V448 HydrophobicContact CD2-CG1 3.81Å |
| 372 | S | 57.9 | Low | 70.2 | Confident | 16 Ų | 16 | 31.4 Ų | 31.4 | 11% | 0.112 | 17% | 0.166 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.5 | -20.3 | 177.7 | 75.9 | 0 | 0 | 0 | 0 | 113.3 | L368 L369 F370 Q374 | L368-S372 PolarHBondContact O-N 3.11Å; L369-S372 WeakPolarHBondContact O-CB 3.42Å; L369-S372 PolarHBondContact O-N 2.86Å; L369-S372 VanDerWaalsContact O-N 3.11Å; L369-S372 PolarHBondContact O-OG 3.34Å; F370-S372 VanDerWaalsContact C-N 3.3Å; F370-S372 PolarHBondContact O-N 3.26Å; S372-Q374 VanDerWaalsContact C-N 3.34Å |
| 373 | H | 55.3 | Low | 69.8 | Low | 103 Ų | 103 | 31.4 Ų | 31.4 | 48% | 0.477 | 17% | 0.166 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | -16.1 | 173.2 | -64.4 | -67.6 | 0 | 0 | 0 | 113.6 | L371 | L371-H373 PolarHBondContact O-N 3.42Å; L371-H373 VanDerWaalsContact O-N 3.12Å |
| 374 | Q | 55 | Low | 69.3 | Low | 34 Ų | 34 | 31.5 Ų | 31.5 | 16% | 0.159 | 17% | 0.166 | C | C | . | . | S | Bend | trans | -83 | 138 | 178.7 | -64 | -168.1 | -19.5 | 0 | 0 | 111.3 | L371 S372 F376 M377 T444 | L371-Q374 HydrophobicContact CD1-CG 4.25Å; L371-Q374 VanDerWaalsContact CD1-OE1 3.31Å; L371-Q374 HydrophobicContact CG-CG 4.38Å; L371-Q374 WeakPolarHBondContact O-CB 3.33Å; L371-Q374 PolarHBondContact O-N 3.29Å; S372-Q374 VanDerWaalsContact C-N 3.34Å; Q374-F376 PolarHBondContact O-N 3.12Å; Q374-M377 PolarHBondContact O-N 3.37Å; Q374-T444 PolarHBondContact NE2-OG1 2.88Å |
| 375 | A | 49.1 | Very low | 69.1 | Low | 74 Ų | 74 | 36 Ų | 36 | 61% | 0.612 | 19% | 0.19 | S | C | * | . | G | 310 helix | trans | -50.8 | -28.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | M377 Q378 | A375-M377 PolarHBondContact O-N 3.46Å; A375-Q378 VanDerWaalsContact O-CB 3.24Å; A375-Q378 WeakPolarHBondContact O-CB 3.35Å; A375-Q378 PolarHBondContact O-N 2.98Å; A375-Q378 VanDerWaalsContact O-N 3.13Å |
| 376 | F | 48.7 | Very low | 69.1 | Low | 70 Ų | 70 | 38.2 Ų | 38.2 | 31% | 0.307 | 20% | 0.202 | S | C | . | . | G | 310 helix | trans | -70.7 | -29.8 | 179.6 | -154.6 | -81.2 | 0 | 0 | 0 | 113.2 | Q374 Q378 N379 V382 Y445 | Q374-F376 PolarHBondContact O-N 3.12Å; F376-Q378 PolarHBondContact O-N 3.43Å; F376-N379 PolarHBondContact O-N 3.18Å; F376-V382 HydrophobicContact CE1-CB 4.27Å; F376-V382 HydrophobicContact CE1-CG1 3.64Å; F376-V382 HydrophobicContact CZ-CB 4.39Å; F376-V382 HydrophobicContact CZ-CG1 3.48Å; F376-V382 VanDerWaalsContact CZ-CG1 3.48Å; F376-Y445 HydrophobicContact CB-CD1 4.44Å; F376-Y445 HydrophobicContact CB-CD2 4.05Å; F376-Y445 HydrophobicContact CB-CE1 4.38Å; F376-Y445 HydrophobicContact CB-CE2 3.98Å; F376-Y445 HydrophobicContact CB-CG 4.29Å; F376-Y445 HydrophobicContact CD1-CD1 4.02Å; F376-Y445 HydrophobicContact CD1-CD2 4.49Å; F376-Y445 AromaticContact CD1-CE1 3.24Å; F376-Y445 HydrophobicContact CD1-CE1 3.24Å; F376-Y445 AromaticContact CD1-CE2 3.81Å; F376-Y445 HydrophobicContact CD1-CE2 3.81Å; F376-Y445 AromaticContact CD1-CZ 3.13Å; F376-Y445 WeakPolarHBondContact CD1-OH 3.43Å; F376-Y445 HydrophobicContact CE1-CD1 4.37Å; F376-Y445 AromaticContact CE1-CE1 3.44Å; F376-Y445 HydrophobicContact CE1-CE1 3.44Å; F376-Y445 VanDerWaalsContact CE1-CE1 3.44Å; F376-Y445 AromaticContact CE1-CZ 3.66Å; F376-Y445 WeakPolarHBondContact CE1-OH 3.38Å; F376-Y445 HydrophobicContact CG-CD1 4.15Å; F376-Y445 AromaticContact CG-CE1 3.84Å; F376-Y445 HydrophobicContact CG-CE1 3.84Å; F376-Y445 HydrophobicContact CG-CE2 4.24Å; F376-Y445 HydrophobicContact CG-CG 4.49Å; F376-Y445 AromaticContact CG-CZ 3.9Å; F376-Y445 HydrophobicContact CZ-CE1 4.22Å |
| 377 | M | 52.7 | Low | 69.2 | Low | 1 Ų | 1 | 38.2 Ų | 38.2 | 1% | 0.005 | 20% | 0.202 | C | C | . | . | G | 310 helix | trans | -66.6 | -15.8 | 171.9 | -73.6 | -62.7 | -171.8 | 0 | 0 | 113 | Y90 L368 L371 Q374 A375 N379 H383 Y445 M449 | Y90-M377 HydrophobicContact CE1-SD 4.06Å; L368-M377 HydrophobicContact CD1-CE 3.23Å; L368-M377 HydrophobicContact CG-CE 3.71Å; L371-M377 HydrophobicContact CB-CE 3.93Å; L371-M377 HydrophobicContact CD2-CE 3.86Å; L371-M377 HydrophobicContact CG-CE 4.33Å; L371-M377 VanDerWaalsContact O-CG 3.22Å; L371-M377 WeakPolarHBondContact O-CG 3.15Å; Q374-M377 PolarHBondContact O-N 3.37Å; A375-M377 PolarHBondContact O-N 3.46Å; M377-N379 VanDerWaalsContact C-N 3.31Å; M377-H383 VanDerWaalsContact SD-CE1 3.51Å; M377-H383 PolarHBondContact SD-ND1 3.29Å; M377-H383 VanDerWaalsContact SD-ND1 3.4Å; M377-Y445 HydrophobicContact CE-CE2 3.83Å; M377-Y445 HydrophobicContact CG-CE2 4.24Å; M377-Y445 HydrophobicContact SD-CE2 4.09Å; M377-M449 HydrophobicContact CE-SD 4.38Å |
| 378 | Q | 59 | Low | 69.6 | Low | 99 Ų | 99 | 37.8 Ų | 37.8 | 46% | 0.463 | 20% | 0.199 | S | C | . | . | G | 310 helix | trans | -75 | -22.2 | 178 | -57.6 | 179.6 | -31.3 | 0 | 0 | 112.1 | A375 F376 F380 | A375-Q378 VanDerWaalsContact O-CB 3.24Å; A375-Q378 WeakPolarHBondContact O-CB 3.35Å; A375-Q378 PolarHBondContact O-N 2.98Å; A375-Q378 VanDerWaalsContact O-N 3.13Å; F376-Q378 PolarHBondContact O-N 3.43Å; Q378-F380 PolarHBondContact O-N 2.96Å |
| 379 | N | 73.4 | Confident | 70.3 | Confident | 53 Ų | 53 | 39.9 Ų | 39.9 | 28% | 0.283 | 22% | 0.217 | S | C | . | . | trans | -93.5 | 86.5 | 169.8 | -166.8 | -36.3 | 0 | 0 | 0 | 110.3 | F376 M377 Y381 V382 H383 | F376-N379 PolarHBondContact O-N 3.18Å; M377-N379 VanDerWaalsContact C-N 3.31Å; N379-Y381 PolarHBondContact O-N 2.82Å; N379-Y381 PolarHBondContact OD1-N 3.33Å; N379-V382 PolarHBondContact O-N 3.06Å; N379-V382 PolarHBondContact OD1-N 3.27Å; N379-H383 PolarHBondContact O-N 2.89Å | ||
| 380 | F | 73.7 | Confident | 71.6 | Confident | 30 Ų | 30 | 41.1 Ų | 41.1 | 13% | 0.132 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -54.5 | -38.7 | -178 | -52 | -67.6 | 0 | 0 | 0 | 112.6 | Y90 T93 Q378 H383 F384 | Y90-F380 AromaticContact CD1-CD1 3.85Å; Y90-F380 HydrophobicContact CD1-CD1 3.85Å; Y90-F380 AromaticContact CD1-CE1 3.97Å; Y90-F380 HydrophobicContact CD1-CE1 3.97Å; Y90-F380 HydrophobicContact CG-CD1 4.25Å; Y90-F380 HydrophobicContact CG-CE1 4.39Å; T93-F380 HydrophobicContact CG2-CE1 3.83Å; T93-F380 WeakPolarHBondContact OG1-CE1 3.35Å; T93-F380 WeakPolarHBondContact OG1-CZ 3.03Å; Q378-F380 PolarHBondContact O-N 2.96Å; F380-H383 PolarHBondContact O-N 3.28Å; F380-F384 HydrophobicContact CB-CD2 4.49Å; F380-F384 VanDerWaalsContact O-CD2 3.25Å; F380-F384 WeakPolarHBondContact O-CD2 3.21Å; F380-F384 PolarHBondContact O-N 3.23Å |
| 381 | Y | 78.3 | Confident | 72.9 | Confident | 38 Ų | 38 | 40.6 Ų | 40.6 | 15% | 0.149 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.7 | -49.4 | -176.1 | -49.3 | -59.7 | 0 | 0 | 0 | 112.1 | Q133 L256 Y257 N379 L385 | Q133-Y381 HydrophobicContact CB-CE2 3.73Å; Q133-Y381 HydrophobicContact CG-CE2 4.16Å; Q133-Y381 PolarHBondContact O-OH 3.43Å; Q133-Y381 VanDerWaalsContact O-OH 3.07Å; L256-Y381 VanDerWaalsContact C-CE1 3.49Å; L256-Y381 HydrophobicContact CB-CD1 4.17Å; L256-Y381 HydrophobicContact CB-CE1 3.87Å; Y257-Y381 HydrophobicContact CD2-CD1 4.47Å; Y257-Y381 HydrophobicContact CD2-CE1 4.43Å; Y257-Y381 VanDerWaalsContact N-CE1 3.34Å; N379-Y381 PolarHBondContact O-N 2.82Å; N379-Y381 PolarHBondContact OD1-N 3.33Å; Y381-L385 WeakPolarHBondContact O-CB 3.48Å; Y381-L385 PolarHBondContact O-N 3.34Å |
| 382 | V | 81.3 | Confident | 74.2 | Confident | 62 Ų | 62 | 43.2 Ų | 43.2 | 38% | 0.376 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -67.8 | -41.2 | -178 | -179.2 | 0 | 0 | 0 | 0 | 110.3 | F376 N379 L385 L386 | F376-V382 HydrophobicContact CE1-CB 4.27Å; F376-V382 HydrophobicContact CE1-CG1 3.64Å; F376-V382 HydrophobicContact CZ-CB 4.39Å; F376-V382 HydrophobicContact CZ-CG1 3.48Å; F376-V382 VanDerWaalsContact CZ-CG1 3.48Å; N379-V382 PolarHBondContact O-N 3.06Å; N379-V382 PolarHBondContact OD1-N 3.27Å; V382-L385 PolarHBondContact O-N 2.94Å; V382-L386 WeakPolarHBondContact O-CB 3.46Å; V382-L386 PolarHBondContact O-N 3.36Å |
| 383 | H | 82.6 | Confident | 75.9 | Confident | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.005 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.7 | -50 | 178.1 | 175.6 | 70 | 0 | 0 | 0 | 112.3 | Y90 M377 N379 F380 L386 A387 Y445 M449 | Y90-H383 AromaticContact CE1-CD2 3.87Å; Y90-H383 AromaticContact CZ-CD2 3.68Å; Y90-H383 AromaticContact CZ-NE2 3.57Å; Y90-H383 PolarHBondContact OH-CD2 2.96Å; Y90-H383 VanDerWaalsContact OH-CD2 3.26Å; Y90-H383 PolarHBondContact OH-NE2 2.95Å; M377-H383 VanDerWaalsContact SD-CE1 3.51Å; M377-H383 PolarHBondContact SD-ND1 3.29Å; M377-H383 VanDerWaalsContact SD-ND1 3.4Å; N379-H383 PolarHBondContact O-N 2.89Å; F380-H383 PolarHBondContact O-N 3.28Å; H383-L386 PolarHBondContact O-N 3.31Å; H383-A387 VanDerWaalsContact O-CB 3.24Å; H383-A387 WeakPolarHBondContact O-CB 3.28Å; H383-A387 PolarHBondContact O-N 3.36Å; H383-Y445 AromaticContact ND1-CZ 3.97Å; H383-Y445 PolarHBondContact ND1-OH 2.95Å; H383-M449 VanDerWaalsContact CE1-CE 3.47Å; H383-M449 WeakPolarHBondContact CE1-CE 3.41Å; H383-M449 PolarHBondContact CE1-SD 3.47Å; H383-M449 WeakPolarHBondContact ND1-CE 3.47Å; H383-M449 PolarHBondContact ND1-SD 2.94Å; H383-M449 VanDerWaalsContact ND1-SD 3.4Å |
| 384 | F | 81.2 | Confident | 77.7 | Confident | 2 Ų | 2 | 44.4 Ų | 44.4 | 1% | 0.009 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -67.5 | -38.3 | 179.7 | -85.3 | -72.8 | 0 | 0 | 0 | 113 | V86 Y90 Y249 A253 L256 F380 G388 | V86-F384 HydrophobicContact CB-CE1 4.45Å; V86-F384 HydrophobicContact CB-CZ 4.13Å; V86-F384 HydrophobicContact CG1-CE1 3.86Å; V86-F384 HydrophobicContact CG1-CE2 3.78Å; V86-F384 HydrophobicContact CG1-CZ 3.25Å; V86-F384 HydrophobicContact CG2-CE1 3.73Å; V86-F384 HydrophobicContact CG2-CZ 3.86Å; Y90-F384 AromaticContact CD2-CE2 3.86Å; Y90-F384 HydrophobicContact CD2-CE2 3.86Å; Y90-F384 AromaticContact CD2-CZ 3.58Å; Y90-F384 HydrophobicContact CD2-CZ 3.58Å; Y90-F384 HydrophobicContact CE2-CE1 4.33Å; Y90-F384 AromaticContact CE2-CE2 3.88Å; Y90-F384 HydrophobicContact CE2-CE2 3.88Å; Y90-F384 AromaticContact CE2-CZ 3.36Å; Y90-F384 HydrophobicContact CE2-CZ 3.36Å; Y90-F384 HydrophobicContact CG-CE2 4.26Å; Y90-F384 HydrophobicContact CG-CZ 4.41Å; Y249-F384 AromaticContact CD1-CD1 3.68Å; Y249-F384 HydrophobicContact CD1-CD1 3.68Å; Y249-F384 AromaticContact CD1-CE1 3.85Å; Y249-F384 HydrophobicContact CD1-CE1 3.85Å; Y249-F384 HydrophobicContact CE1-CD1 4.42Å; Y249-F384 HydrophobicContact CE1-CE1 4.15Å; A253-F384 HydrophobicContact CB-CB 3.72Å; L256-F384 HydrophobicContact CD1-CD2 4Å; L256-F384 HydrophobicContact CD1-CE2 4.27Å; F380-F384 HydrophobicContact CB-CD2 4.49Å; F380-F384 VanDerWaalsContact O-CD2 3.25Å; F380-F384 WeakPolarHBondContact O-CD2 3.21Å; F380-F384 PolarHBondContact O-N 3.23Å; F384-G388 PolarHBondContact O-N 2.84Å |
| 385 | L | 86.3 | Confident | 79.4 | Confident | 95 Ų | 95 | 43.3 Ų | 43.3 | 50% | 0.497 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -63.4 | -46.5 | 176.2 | -175.5 | 64.8 | 0 | 0 | 0 | 110.8 | V250 A253 Y381 V382 A389 | V250-L385 HydrophobicContact CG1-CD1 4.04Å; A253-L385 HydrophobicContact CB-CB 4.18Å; Y381-L385 WeakPolarHBondContact O-CB 3.48Å; Y381-L385 PolarHBondContact O-N 3.34Å; V382-L385 PolarHBondContact O-N 2.94Å; L385-A389 WeakPolarHBondContact O-CB 3.36Å; L385-A389 PolarHBondContact O-N 3.49Å |
| 386 | L | 86.6 | Confident | 81.4 | Confident | 67 Ų | 67 | 43.2 Ų | 43.2 | 35% | 0.351 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -67.5 | -46.1 | 179.1 | -177.1 | 61.5 | 0 | 0 | 0 | 111.8 | V382 H383 A389 L390 Y445 M449 | V382-L386 WeakPolarHBondContact O-CB 3.46Å; V382-L386 PolarHBondContact O-N 3.36Å; H383-L386 PolarHBondContact O-N 3.31Å; L386-A389 PolarHBondContact O-N 2.79Å; L386-L390 HydrophobicContact CD1-CD1 4.02Å; L386-L390 HydrophobicContact CD1-CG 4.14Å; L386-L390 HydrophobicContact CG-CD1 4.01Å; L386-L390 HydrophobicContact CG-CG 4.5Å; L386-L390 WeakPolarHBondContact O-CB 3.36Å; L386-L390 VanDerWaalsContact O-CG 3.31Å; L386-L390 WeakPolarHBondContact O-CG 3.22Å; L386-L390 PolarHBondContact O-N 3.21Å; L386-Y445 HydrophobicContact CD2-CE1 4.48Å; L386-M449 HydrophobicContact CD2-CE 4.39Å; L386-M449 HydrophobicContact CG-CE 4.43Å |
| 387 | A | 86.9 | Confident | 83.4 | Confident | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.3 | -51.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y249 H383 A389 L390 R391 M449 N453 | Y249-A387 HydrophobicContact CD1-CB 4.23Å; H383-A387 VanDerWaalsContact O-CB 3.24Å; H383-A387 WeakPolarHBondContact O-CB 3.28Å; H383-A387 PolarHBondContact O-N 3.36Å; A387-A389 PolarHBondContact O-N 3.11Å; A387-L390 PolarHBondContact O-N 2.99Å; A387-R391 WeakPolarHBondContact O-CB 3.24Å; A387-R391 PolarHBondContact O-N 3.49Å; A387-M449 HydrophobicContact CB-CE 3.95Å; A387-N453 WeakPolarHBondContact CA-OD1 3.17Å; A387-N453 PolarHBondContact O-OD1 3.19Å |
| 388 | G | 87.7 | Confident | 85.3 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.7 | -43 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | F384 R391 L392 | F384-G388 PolarHBondContact O-N 2.84Å; G388-R391 PolarHBondContact O-N 3.05Å; G388-L392 WeakPolarHBondContact O-CB 3.28Å; G388-L392 WeakPolarHBondContact O-CG 3.48Å; G388-L392 PolarHBondContact O-N 3.47Å |
| 389 | A | 90.4 | Very high | 86.7 | Confident | 49 Ų | 49 | 40.5 Ų | 40.5 | 41% | 0.405 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -63.5 | -48.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | L385 L386 A387 L392 F393 | L385-A389 WeakPolarHBondContact O-CB 3.36Å; L385-A389 PolarHBondContact O-N 3.49Å; L386-A389 PolarHBondContact O-N 2.79Å; A387-A389 PolarHBondContact O-N 3.11Å; A389-L392 PolarHBondContact O-N 2.94Å; A389-F393 VanDerWaalsContact O-CB 3.27Å; A389-F393 WeakPolarHBondContact O-CB 3.46Å; A389-F393 PolarHBondContact O-N 2.92Å |
| 390 | L | 91.6 | Very high | 87.4 | Confident | 42 Ų | 42 | 41.6 Ų | 41.6 | 22% | 0.22 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.6 | -44.5 | 177.4 | -73 | 174.1 | 0 | 0 | 0 | 111.6 | L386 A387 L392 F393 F394 N453 | L386-L390 HydrophobicContact CD1-CD1 4.02Å; L386-L390 HydrophobicContact CD1-CG 4.14Å; L386-L390 HydrophobicContact CG-CD1 4.01Å; L386-L390 HydrophobicContact CG-CG 4.5Å; L386-L390 WeakPolarHBondContact O-CB 3.36Å; L386-L390 VanDerWaalsContact O-CG 3.31Å; L386-L390 WeakPolarHBondContact O-CG 3.22Å; L386-L390 PolarHBondContact O-N 3.21Å; A387-L390 PolarHBondContact O-N 2.99Å; L390-L392 PolarHBondContact O-N 3.46Å; L390-F393 WeakPolarHBondContact O-CB 3.43Å; L390-F393 PolarHBondContact O-N 3.39Å; L390-F394 HydrophobicContact CB-CE2 4.12Å; L390-F394 HydrophobicContact CD2-CE2 4.5Å; L390-F394 HydrophobicContact CD2-CZ 4.17Å; L390-F394 VanDerWaalsContact O-CD2 3.25Å; L390-F394 WeakPolarHBondContact O-CD2 3.18Å; L390-F394 VanDerWaalsContact O-CG 3.31Å; L390-F394 WeakPolarHBondContact O-CG 3.38Å; L390-F394 PolarHBondContact O-N 3.14Å; L390-N453 HydrophobicContact CB-CB 3.94Å |
| 391 | R | 90.6 | Very high | 88.2 | Confident | 15 Ų | 15 | 43.7 Ų | 43.7 | 6% | 0.057 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.5 | -41.9 | 179.6 | -161 | -177.5 | 167.4 | 91.6 | 6.2 | 111.6 | Q244 S246 A387 G388 L395 G456 | Q244-R391 PolarHBondContact O-NE 3.47Å; Q244-R391 VanDerWaalsContact O-NE 3.09Å; Q244-R391 PolarHBondContact O-NH2 2.93Å; S246-R391 WeakPolarHBondContact OG-CG 3.47Å; S246-R391 PolarHBondContact OG-NE 2.84Å; A387-R391 WeakPolarHBondContact O-CB 3.24Å; A387-R391 PolarHBondContact O-N 3.49Å; G388-R391 PolarHBondContact O-N 3.05Å; R391-L395 WeakPolarHBondContact O-CB 3.21Å; R391-L395 PolarHBondContact O-N 2.79Å; R391-G456 VanDerWaalsContact CZ-C 3.49Å; R391-G456 PolarHBondContact NH1-O 3.34Å; R391-G456 PolarHBondContact NH2-O 3.35Å |
| 392 | L | 89.9 | Confident | 88.5 | Confident | 57 Ų | 57 | 42.7 Ų | 42.7 | 30% | 0.298 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -64.1 | -43.2 | 173 | -80.8 | 173.7 | 0 | 0 | 0 | 112.3 | A247 V250 G388 A389 L390 T396 | A247-L392 HydrophobicContact CB-CD1 4.03Å; A247-L392 HydrophobicContact CB-CD2 3.81Å; A247-L392 HydrophobicContact CB-CG 4.33Å; V250-L392 HydrophobicContact CG2-CD1 3.97Å; G388-L392 WeakPolarHBondContact O-CB 3.28Å; G388-L392 WeakPolarHBondContact O-CG 3.48Å; G388-L392 PolarHBondContact O-N 3.47Å; A389-L392 PolarHBondContact O-N 2.94Å; L390-L392 PolarHBondContact O-N 3.46Å; L392-T396 VanDerWaalsContact O-CB 3.28Å; L392-T396 WeakPolarHBondContact O-CB 3.28Å; L392-T396 PolarHBondContact O-N 2.88Å; L392-T396 PolarHBondContact O-OG1 3.24Å |
| 393 | F | 93 | Very high | 88.6 | Confident | 120 Ų | 120 | 43.9 Ų | 43.9 | 53% | 0.526 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -61 | -53.1 | 179.2 | 176.3 | -102.8 | 0 | 0 | 0 | 111.5 | A389 L390 L395 T396 I397 | A389-F393 VanDerWaalsContact O-CB 3.27Å; A389-F393 WeakPolarHBondContact O-CB 3.46Å; A389-F393 PolarHBondContact O-N 2.92Å; L390-F393 WeakPolarHBondContact O-CB 3.43Å; L390-F393 PolarHBondContact O-N 3.39Å; F393-L395 PolarHBondContact O-N 2.83Å; F393-T396 PolarHBondContact O-N 2.94Å; F393-I397 HydrophobicContact CD1-CD1 3.93Å; F393-I397 HydrophobicContact CD2-CD1 4.06Å; F393-I397 HydrophobicContact CE1-CD1 3.41Å; F393-I397 VanDerWaalsContact CE1-CD1 3.41Å; F393-I397 HydrophobicContact CE2-CD1 3.57Å; F393-I397 HydrophobicContact CE2-CG1 4.49Å; F393-I397 HydrophobicContact CG-CD1 4.23Å; F393-I397 HydrophobicContact CZ-CD1 3.23Å; F393-I397 WeakPolarHBondContact O-CG1 3.5Å; F393-I397 PolarHBondContact O-N 3.17Å |
| 394 | F | 93.3 | Very high | 88.8 | Confident | 23 Ų | 23 | 51.8 Ų | 51.8 | 10% | 0.101 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.6 | -40.3 | 179 | -62.9 | -33.5 | 0 | 0 | 0 | 112.7 | L390 T398 F450 N453 I454 S457 V458 | L390-F394 HydrophobicContact CB-CE2 4.12Å; L390-F394 HydrophobicContact CD2-CE2 4.5Å; L390-F394 HydrophobicContact CD2-CZ 4.17Å; L390-F394 VanDerWaalsContact O-CD2 3.25Å; L390-F394 WeakPolarHBondContact O-CD2 3.18Å; L390-F394 VanDerWaalsContact O-CG 3.31Å; L390-F394 WeakPolarHBondContact O-CG 3.38Å; L390-F394 PolarHBondContact O-N 3.14Å; F394-T398 WeakPolarHBondContact O-CB 3.48Å; F394-T398 PolarHBondContact O-N 3.04Å; F394-T398 PolarHBondContact O-OG1 3.22Å; F394-F450 AromaticContact CE1-CE2 3.98Å; F394-F450 HydrophobicContact CE1-CE2 3.98Å; F394-F450 HydrophobicContact CE2-CD2 4.38Å; F394-F450 HydrophobicContact CE2-CE2 4.38Å; F394-F450 AromaticContact CZ-CD2 3.69Å; F394-F450 HydrophobicContact CZ-CD2 3.69Å; F394-F450 AromaticContact CZ-CE2 3.41Å; F394-F450 HydrophobicContact CZ-CE2 3.41Å; F394-F450 VanDerWaalsContact CZ-CE2 3.41Å; F394-F450 HydrophobicContact CZ-CZ 4.14Å; F394-N453 HydrophobicContact CD2-CB 4.15Å; F394-N453 HydrophobicContact CE2-CB 3.95Å; F394-I454 HydrophobicContact CD2-CB 4.29Å; F394-I454 HydrophobicContact CE2-CB 4.28Å; F394-S457 WeakPolarHBondContact CB-OG 3.32Å; F394-V458 HydrophobicContact CB-CG2 3.94Å |
| 395 | L | 91 | Very high | 89.1 | Confident | 11 Ų | 11 | 54.5 Ų | 54.5 | 6% | 0.058 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.3 | -48.2 | 176.8 | -175 | 61 | 0 | 0 | 0 | 111.3 | A241 S246 R391 F393 I397 T398 I399 L461 | A241-L395 HydrophobicContact CB-CD1 3.66Å; A241-L395 HydrophobicContact CB-CD2 4.11Å; A241-L395 HydrophobicContact CB-CG 4.12Å; A241-L395 WeakPolarHBondContact O-CD2 2.94Å; S246-L395 WeakPolarHBondContact OG-CD2 3.27Å; R391-L395 WeakPolarHBondContact O-CB 3.21Å; R391-L395 PolarHBondContact O-N 2.79Å; F393-L395 PolarHBondContact O-N 2.83Å; L395-I397 PolarHBondContact O-N 2.95Å; L395-T398 PolarHBondContact O-N 3.38Å; L395-I399 HydrophobicContact CD1-CD1 4.31Å; L395-I399 HydrophobicContact CG-CD1 4.03Å; L395-I399 VanDerWaalsContact O-CG1 3.28Å; L395-I399 WeakPolarHBondContact O-CG1 3.47Å; L395-I399 PolarHBondContact O-N 2.9Å; L395-L461 HydrophobicContact CD1-CD2 3.72Å |
| 396 | T | 90.7 | Very high | 88.7 | Confident | 72 Ų | 72 | 54.3 Ų | 54.3 | 44% | 0.442 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62 | -45.2 | -180 | -56 | 0 | 0 | 0 | 0 | 111.2 | L392 F393 T398 I399 L400 | L392-T396 VanDerWaalsContact O-CB 3.28Å; L392-T396 WeakPolarHBondContact O-CB 3.28Å; L392-T396 PolarHBondContact O-N 2.88Å; L392-T396 PolarHBondContact O-OG1 3.24Å; F393-T396 PolarHBondContact O-N 2.94Å; T396-T398 VanDerWaalsContact C-N 3.34Å; T396-T398 PolarHBondContact O-N 3.22Å; T396-I399 PolarHBondContact O-N 3.31Å; T396-L400 HydrophobicContact CG2-CD1 4.02Å; T396-L400 HydrophobicContact CG2-CG 4.43Å; T396-L400 WeakPolarHBondContact O-CB 3.21Å; T396-L400 VanDerWaalsContact O-CG 3.27Å; T396-L400 WeakPolarHBondContact O-CG 3.38Å; T396-L400 PolarHBondContact O-N 2.9Å |
| 397 | I | 92.2 | Very high | 88.5 | Confident | 74 Ų | 74 | 59.5 Ų | 59.5 | 38% | 0.379 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.9 | -45 | 176.1 | -72.7 | 175.6 | 0 | 0 | 0 | 110.9 | F393 L395 I399 L400 L401 | F393-I397 HydrophobicContact CD1-CD1 3.93Å; F393-I397 HydrophobicContact CD2-CD1 4.06Å; F393-I397 HydrophobicContact CE1-CD1 3.41Å; F393-I397 VanDerWaalsContact CE1-CD1 3.41Å; F393-I397 HydrophobicContact CE2-CD1 3.57Å; F393-I397 HydrophobicContact CE2-CG1 4.49Å; F393-I397 HydrophobicContact CG-CD1 4.23Å; F393-I397 HydrophobicContact CZ-CD1 3.23Å; F393-I397 WeakPolarHBondContact O-CG1 3.5Å; F393-I397 PolarHBondContact O-N 3.17Å; L395-I397 PolarHBondContact O-N 2.95Å; I397-I399 VanDerWaalsContact C-N 3.34Å; I397-I399 PolarHBondContact O-N 2.64Å; I397-L400 PolarHBondContact O-N 3.4Å; I397-L401 WeakPolarHBondContact O-CB 3.44Å; I397-L401 PolarHBondContact O-N 2.81Å |
| 398 | T | 91.1 | Very high | 88.3 | Confident | 14 Ų | 14 | 61.6 Ų | 61.6 | 9% | 0.086 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.1 | -43 | -179.3 | -59.1 | 0 | 0 | 0 | 0 | 111.3 | F394 L395 T396 S402 V413 V458 L461 | F394-T398 WeakPolarHBondContact O-CB 3.48Å; F394-T398 PolarHBondContact O-N 3.04Å; F394-T398 PolarHBondContact O-OG1 3.22Å; L395-T398 PolarHBondContact O-N 3.38Å; T396-T398 VanDerWaalsContact C-N 3.34Å; T396-T398 PolarHBondContact O-N 3.22Å; T398-S402 VanDerWaalsContact O-CB 3.25Å; T398-S402 WeakPolarHBondContact O-CB 3.43Å; T398-S402 PolarHBondContact O-N 2.82Å; T398-S402 PolarHBondContact O-OG 2.97Å; T398-V413 HydrophobicContact CG2-CG1 3.9Å; T398-V458 HydrophobicContact CG2-CG1 4.11Å; T398-V458 VanDerWaalsContact OG1-CG2 3.31Å; T398-V458 WeakPolarHBondContact OG1-CG2 3.45Å; T398-L461 HydrophobicContact CG2-CD2 4.18Å |
| 399 | I | 88.8 | Confident | 88.1 | Confident | 25 Ų | 25 | 61.6 Ų | 61.6 | 13% | 0.128 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.7 | -51.6 | 175.9 | -66 | 165.1 | 0 | 0 | 0 | 110.2 | L238 A241 L395 T396 I397 L401 S402 M403 | L238-I399 HydrophobicContact CD1-CD1 4.11Å; L238-I399 HydrophobicContact CD1-CG2 4.47Å; A241-I399 HydrophobicContact CB-CD1 3.58Å; A241-I399 HydrophobicContact CB-CG1 4.13Å; L395-I399 HydrophobicContact CD1-CD1 4.31Å; L395-I399 HydrophobicContact CG-CD1 4.03Å; L395-I399 VanDerWaalsContact O-CG1 3.28Å; L395-I399 WeakPolarHBondContact O-CG1 3.47Å; L395-I399 PolarHBondContact O-N 2.9Å; T396-I399 PolarHBondContact O-N 3.31Å; I397-I399 VanDerWaalsContact C-N 3.34Å; I397-I399 PolarHBondContact O-N 2.64Å; I399-L401 VanDerWaalsContact C-N 3.31Å; I399-L401 PolarHBondContact O-N 2.76Å; I399-S402 PolarHBondContact O-N 2.9Å; I399-S402 PolarHBondContact O-OG 2.81Å; I399-M403 HydrophobicContact CG2-CE 3.81Å; I399-M403 HydrophobicContact CG2-SD 4.22Å; I399-M403 WeakPolarHBondContact O-CG 3.49Å; I399-M403 PolarHBondContact O-N 3.45Å |
| 400 | L | 89.2 | Confident | 87.8 | Confident | 77 Ų | 77 | 59.5 Ų | 59.5 | 40% | 0.403 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -59.3 | -42.2 | 179.9 | -70.9 | 175 | 0 | 0 | 0 | 112.3 | T396 I397 M403 K404 | T396-L400 HydrophobicContact CG2-CD1 4.02Å; T396-L400 HydrophobicContact CG2-CG 4.43Å; T396-L400 WeakPolarHBondContact O-CB 3.21Å; T396-L400 VanDerWaalsContact O-CG 3.27Å; T396-L400 WeakPolarHBondContact O-CG 3.38Å; T396-L400 PolarHBondContact O-N 2.9Å; I397-L400 PolarHBondContact O-N 3.4Å; L400-M403 HydrophobicContact CD2-CE 4.12Å; L400-M403 PolarHBondContact O-N 3.31Å; L400-K404 WeakPolarHBondContact O-CB 3.25Å; L400-K404 WeakPolarHBondContact O-CG 3.4Å; L400-K404 PolarHBondContact O-N 3.13Å |
| 401 | L | 88.9 | Confident | 87.7 | Confident | 74 Ų | 74 | 61.2 Ų | 61.2 | 39% | 0.387 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -68 | -42.1 | 179 | -172.9 | 66.5 | 0 | 0 | 0 | 111.2 | I397 I399 M403 V405 L408 | I397-L401 WeakPolarHBondContact O-CB 3.44Å; I397-L401 PolarHBondContact O-N 2.81Å; I399-L401 VanDerWaalsContact C-N 3.31Å; I399-L401 PolarHBondContact O-N 2.76Å; L401-M403 VanDerWaalsContact C-N 3.32Å; L401-M403 PolarHBondContact O-N 3.07Å; L401-V405 HydrophobicContact CD1-CB 4.29Å; L401-V405 HydrophobicContact CD1-CG2 3.61Å; L401-V405 WeakPolarHBondContact O-CB 3.44Å; L401-V405 PolarHBondContact O-N 3.21Å; L401-L408 HydrophobicContact CB-CD2 4.5Å; L401-L408 HydrophobicContact CD1-CD2 4.25Å; L401-L408 HydrophobicContact CD2-CD2 3.21Å; L401-L408 HydrophobicContact CG-CD2 3.37Å |
| 402 | S | 84.7 | Confident | 87.7 | Confident | 17 Ų | 17 | 65.5 Ų | 65.5 | 12% | 0.119 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -63.9 | -36.9 | 177.6 | 73.5 | 0 | 0 | 0 | 0 | 112.5 | T398 I399 K532 | T398-S402 VanDerWaalsContact O-CB 3.25Å; T398-S402 WeakPolarHBondContact O-CB 3.43Å; T398-S402 PolarHBondContact O-N 2.82Å; T398-S402 PolarHBondContact O-OG 2.97Å; I399-S402 PolarHBondContact O-N 2.9Å; I399-S402 PolarHBondContact O-OG 2.81Å; S402-K532 WeakPolarHBondContact O-CE 3.47Å; S402-K532 PolarHBondContact O-NZ 3.34Å |
| 403 | M | 84.3 | Confident | 87.8 | Confident | 86 Ų | 86 | 63.6 Ų | 63.6 | 42% | 0.424 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -76.2 | -44.6 | 177.6 | -68.4 | -170 | -54.5 | 0 | 0 | 112.8 | Y235 I399 L400 L401 | Y235-M403 HydrophobicContact CE1-SD 4.42Å; I399-M403 HydrophobicContact CG2-CE 3.81Å; I399-M403 HydrophobicContact CG2-SD 4.22Å; I399-M403 WeakPolarHBondContact O-CG 3.49Å; I399-M403 PolarHBondContact O-N 3.45Å; L400-M403 HydrophobicContact CD2-CE 4.12Å; L400-M403 PolarHBondContact O-N 3.31Å; L401-M403 VanDerWaalsContact C-N 3.32Å; L401-M403 PolarHBondContact O-N 3.07Å |
| 404 | K | 86.6 | Confident | 87.8 | Confident | 168 Ų | 168 | 57.9 Ų | 57.9 | 73% | 0.73 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -77.6 | -36.6 | -176.1 | -71.7 | -177.2 | 176 | -176.8 | 0 | 113.1 | L400 | L400-K404 WeakPolarHBondContact O-CB 3.25Å; L400-K404 WeakPolarHBondContact O-CG 3.4Å; L400-K404 PolarHBondContact O-N 3.13Å |
| 405 | V | 86.5 | Confident | 87.8 | Confident | 59 Ų | 59 | 58.5 Ų | 58.5 | 36% | 0.358 | 29% | 0.294 | S | S | . | . | trans | -104.9 | 91.1 | -172.3 | -173.9 | 0 | 0 | 0 | 0 | 109.9 | L401 K407 L408 K532 | L401-V405 HydrophobicContact CD1-CB 4.29Å; L401-V405 HydrophobicContact CD1-CG2 3.61Å; L401-V405 WeakPolarHBondContact O-CB 3.44Å; L401-V405 PolarHBondContact O-N 3.21Å; V405-K407 PolarHBondContact O-N 3.12Å; V405-L408 HydrophobicContact CB-CB 4.09Å; V405-L408 HydrophobicContact CG1-CB 3.78Å; V405-L408 PolarHBondContact O-N 3.43Å; V405-L408 VanDerWaalsContact O-N 3.08Å; V405-K532 PolarHBondContact O-NZ 3.08Å | ||
| 406 | T | 78.5 | Confident | 87.9 | Confident | 90 Ų | 90 | 64.4 Ų | 64.4 | 55% | 0.552 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -35.7 | -178.3 | 53.7 | 0 | 0 | 0 | 0 | 113.2 | L408 K532 M535 | T406-L408 VanDerWaalsContact C-N 3.33Å; T406-L408 PolarHBondContact O-N 3.43Å; T406-K532 PolarHBondContact O-NZ 3.24Å; T406-M535 WeakPolarHBondContact O-CG 3.34Å |
| 407 | K | 82.1 | Confident | 88.2 | Confident | 177 Ų | 177 | 61 Ų | 61 | 77% | 0.77 | 30% | 0.298 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | -21.3 | 178.4 | -63.3 | -175.7 | -179.4 | -179 | 0 | 114.7 | V405 G409 M535 | V405-K407 PolarHBondContact O-N 3.12Å; K407-G409 PolarHBondContact O-N 2.87Å; K407-M535 VanDerWaalsContact O-SD 3.37Å |
| 408 | L | 82.3 | Confident | 88.3 | Confident | 44 Ų | 44 | 57.5 Ų | 57.5 | 23% | 0.23 | 28% | 0.28 | C | S | . | . | trans | -80.1 | 110.1 | -177.7 | -175.8 | 70.1 | 0 | 0 | 0 | 109.9 | L401 V405 T406 H412 V413 K532 | L401-L408 HydrophobicContact CB-CD2 4.5Å; L401-L408 HydrophobicContact CD1-CD2 4.25Å; L401-L408 HydrophobicContact CD2-CD2 3.21Å; L401-L408 HydrophobicContact CG-CD2 3.37Å; V405-L408 HydrophobicContact CB-CB 4.09Å; V405-L408 HydrophobicContact CG1-CB 3.78Å; V405-L408 PolarHBondContact O-N 3.43Å; V405-L408 VanDerWaalsContact O-N 3.08Å; T406-L408 VanDerWaalsContact C-N 3.33Å; T406-L408 PolarHBondContact O-N 3.43Å; L408-H412 HydrophobicContact CD1-CB 3.86Å; L408-V413 HydrophobicContact CD1-CG2 4.44Å; L408-V413 HydrophobicContact CD2-CG2 3.62Å; L408-V413 HydrophobicContact CG-CG2 3.85Å; L408-K532 WeakPolarHBondContact O-CD 3.4Å; L408-K532 WeakPolarHBondContact O-CE 3.49Å; L408-K532 PolarHBondContact O-NZ 3.22Å | ||
| 409 | G | 83.4 | Confident | 88.5 | Confident | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 29% | 0.292 | C | S | . | . | trans | -79 | 157.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | K407 R411 H412 V413 E530 | K407-G409 PolarHBondContact O-N 2.87Å; G409-R411 PolarHBondContact O-N 2.86Å; G409-H412 WeakPolarHBondContact O-CB 3.3Å; G409-H412 PolarHBondContact O-N 3.04Å; G409-H412 VanDerWaalsContact O-N 3.11Å; G409-V413 WeakPolarHBondContact O-CG2 3.2Å; G409-V413 PolarHBondContact O-N 3.35Å; G409-E530 VanDerWaalsContact CA-CD 3.47Å; G409-E530 WeakPolarHBondContact CA-OE1 3.45Å; G409-E530 WeakPolarHBondContact CA-OE2 3.17Å | ||
| 410 | C | 86 | Confident | 88.9 | Confident | 5 Ų | 5 | 58.9 Ų | 58.9 | 3% | 0.034 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.2 | -39.2 | 174 | -55.6 | 0 | 0 | 0 | 0 | 110.8 | Y237 H412 V413 L414 E530 T531 K532 | Y237-C410 WeakPolarHBondContact CE2-SG 3.23Å; Y237-C410 WeakPolarHBondContact OH-CB 3.48Å; Y237-C410 PolarHBondContact OH-SG 2.93Å; C410-H412 VanDerWaalsContact C-N 3.35Å; C410-V413 PolarHBondContact O-N 3.09Å; C410-L414 WeakPolarHBondContact O-CB 3.29Å; C410-L414 PolarHBondContact O-N 3.07Å; C410-E530 WeakPolarHBondContact CB-OE1 3.49Å; C410-E530 PolarHBondContact N-OE1 3.2Å; C410-E530 PolarHBondContact N-OE2 3.02Å; C410-T531 WeakPolarHBondContact CB-OG1 3.42Å; C410-K532 WeakPolarHBondContact SG-CA 3.4Å; C410-K532 WeakPolarHBondContact SG-CB 3.38Å; C410-K532 PolarHBondContact SG-N 2.98Å |
| 411 | R | 88.8 | Confident | 89.2 | Confident | 77 Ų | 77 | 55.2 Ų | 55.2 | 29% | 0.291 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -65.4 | -39.7 | 174.5 | 179.9 | -177.9 | 159.2 | 162.9 | -3.6 | 111.4 | G409 L414 L415 I525 E530 | G409-R411 PolarHBondContact O-N 2.86Å; R411-L414 PolarHBondContact O-N 3.36Å; R411-L415 HydrophobicContact CG-CD1 4.01Å; R411-L415 HydrophobicContact CG-CG 4.34Å; R411-L415 WeakPolarHBondContact O-CB 3.3Å; R411-L415 VanDerWaalsContact O-CG 3.26Å; R411-L415 WeakPolarHBondContact O-CG 3.38Å; R411-L415 PolarHBondContact O-N 3.34Å; R411-I525 PolarHBondContact NH1-O 3.28Å; R411-I525 PolarHBondContact NH2-O 3.19Å; R411-E530 VanDerWaalsContact CB-OE2 3.31Å; R411-E530 WeakPolarHBondContact CB-OE2 3.5Å; R411-E530 PolarHBondContact N-OE2 3.47Å |
| 412 | H | 90.4 | Very high | 89.5 | Confident | 106 Ų | 106 | 52.6 Ų | 52.6 | 49% | 0.491 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.4 | -42.8 | 179.2 | -60.7 | 80.4 | 0 | 0 | 0 | 111.3 | L408 G409 C410 L415 F416 E530 | L408-H412 HydrophobicContact CD1-CB 3.86Å; G409-H412 WeakPolarHBondContact O-CB 3.3Å; G409-H412 PolarHBondContact O-N 3.04Å; G409-H412 VanDerWaalsContact O-N 3.11Å; C410-H412 VanDerWaalsContact C-N 3.35Å; H412-L415 PolarHBondContact O-N 2.98Å; H412-F416 VanDerWaalsContact O-CB 3.31Å; H412-F416 WeakPolarHBondContact O-CB 3.35Å; H412-F416 PolarHBondContact O-N 3.13Å; H412-E530 IonicContact ND1-OE2 3.44Å; H412-E530 PolarHBondContact ND1-OE2 3.2Å |
| 413 | V | 91.9 | Very high | 90.1 | Very high | 16 Ų | 16 | 56.6 Ų | 56.6 | 10% | 0.097 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63 | -42.3 | 175.1 | 175.5 | 0 | 0 | 0 | 0 | 111.2 | T398 L408 G409 C410 F416 S417 V458 T462 | T398-V413 HydrophobicContact CG2-CG1 3.9Å; L408-V413 HydrophobicContact CD1-CG2 4.44Å; L408-V413 HydrophobicContact CD2-CG2 3.62Å; L408-V413 HydrophobicContact CG-CG2 3.85Å; G409-V413 WeakPolarHBondContact O-CG2 3.2Å; G409-V413 PolarHBondContact O-N 3.35Å; C410-V413 PolarHBondContact O-N 3.09Å; V413-F416 PolarHBondContact O-N 3.22Å; V413-S417 PolarHBondContact O-N 3.41Å; V413-S417 PolarHBondContact O-OG 3.17Å; V413-S417 VanDerWaalsContact O-OG 3.1Å; V413-V458 HydrophobicContact CG1-CG1 3.35Å; V413-T462 HydrophobicContact CB-CG2 4.06Å; V413-T462 HydrophobicContact CG1-CG2 3.68Å |
| 414 | L | 92.3 | Very high | 90.5 | Very high | 1 Ų | 1 | 53.2 Ų | 53.2 | 1% | 0.005 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.5 | -48.1 | 176 | -179.7 | 147.8 | 0 | 0 | 0 | 111.9 | C410 R411 F416 S417 L418 Y459 T462 V463 I528 | C410-L414 WeakPolarHBondContact O-CB 3.29Å; C410-L414 PolarHBondContact O-N 3.07Å; R411-L414 PolarHBondContact O-N 3.36Å; L414-F416 VanDerWaalsContact C-N 3.34Å; L414-F416 PolarHBondContact O-N 3.5Å; L414-S417 PolarHBondContact O-OG 3.23Å; L414-L418 VanDerWaalsContact O-CB 3.3Å; L414-L418 WeakPolarHBondContact O-CB 3.32Å; L414-L418 PolarHBondContact O-N 3.46Å; L414-Y459 HydrophobicContact CD1-CD2 4.46Å; L414-Y459 HydrophobicContact CD1-CE2 4.2Å; L414-Y459 HydrophobicContact CD2-CE2 4.41Å; L414-Y459 HydrophobicContact CG-CD2 4.02Å; L414-Y459 HydrophobicContact CG-CE2 3.95Å; L414-T462 HydrophobicContact CB-CG2 4.4Å; L414-V463 HydrophobicContact CD1-CG2 4.17Å; L414-I528 HydrophobicContact CD1-CD1 3.93Å; L414-I528 HydrophobicContact CD1-CG2 4.49Å; L414-I528 HydrophobicContact CD2-CD1 4.23Å |
| 415 | L | 93.6 | Very high | 90.8 | Very high | 36 Ų | 36 | 45.4 Ų | 45.4 | 19% | 0.188 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -67.2 | -36.8 | -179.8 | -67.5 | 175.6 | 0 | 0 | 0 | 111.8 | R411 H412 A419 L521 I525 | R411-L415 HydrophobicContact CG-CD1 4.01Å; R411-L415 HydrophobicContact CG-CG 4.34Å; R411-L415 WeakPolarHBondContact O-CB 3.3Å; R411-L415 VanDerWaalsContact O-CG 3.26Å; R411-L415 WeakPolarHBondContact O-CG 3.38Å; R411-L415 PolarHBondContact O-N 3.34Å; H412-L415 PolarHBondContact O-N 2.98Å; L415-A419 WeakPolarHBondContact O-CB 3.06Å; L415-A419 PolarHBondContact O-N 2.99Å; L415-L521 HydrophobicContact CD2-CD1 3.77Å; L415-I525 HydrophobicContact CD1-CG1 4.07Å; L415-I525 HydrophobicContact CD2-CD1 4.46Å; L415-I525 HydrophobicContact CD2-CG1 3.57Å; L415-I525 HydrophobicContact CG-CG1 4.49Å |
| 416 | F | 94.4 | Very high | 91.2 | Very high | 135 Ų | 135 | 44.1 Ų | 44.1 | 59% | 0.592 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -64.3 | -48.1 | 176.5 | 173.3 | -98.3 | 0 | 0 | 0 | 112.3 | H412 V413 L414 L418 A419 T420 I454 | H412-F416 VanDerWaalsContact O-CB 3.31Å; H412-F416 WeakPolarHBondContact O-CB 3.35Å; H412-F416 PolarHBondContact O-N 3.13Å; V413-F416 PolarHBondContact O-N 3.22Å; L414-F416 VanDerWaalsContact C-N 3.34Å; L414-F416 PolarHBondContact O-N 3.5Å; F416-L418 VanDerWaalsContact C-N 3.33Å; F416-L418 PolarHBondContact O-N 3.38Å; F416-A419 PolarHBondContact O-N 2.84Å; F416-T420 WeakPolarHBondContact O-CB 3.3Å; F416-T420 PolarHBondContact O-N 3.03Å; F416-T420 PolarHBondContact O-OG1 3.11Å; F416-I454 HydrophobicContact CE1-CD1 4.37Å |
| 417 | S | 95.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.3 | -38.8 | 179.5 | 57.6 | 0 | 0 | 0 | 0 | 111.6 | V413 L414 T421 Y459 | V413-S417 PolarHBondContact O-N 3.41Å; V413-S417 PolarHBondContact O-OG 3.17Å; V413-S417 VanDerWaalsContact O-OG 3.1Å; L414-S417 PolarHBondContact O-OG 3.23Å; S417-T421 WeakPolarHBondContact O-CB 3.46Å; S417-T421 PolarHBondContact O-N 3.39Å; S417-T421 PolarHBondContact O-OG1 3.13Å; S417-Y459 WeakPolarHBondContact OG-CA 3.3Å; S417-Y459 WeakPolarHBondContact OG-CB 3.34Å |
| 418 | L | 94.7 | Very high | 92.3 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66.6 | -47.9 | 176 | -173.6 | 57.9 | 0 | 0 | 0 | 112.4 | L414 F416 T420 T421 I422 Y459 L517 T520 L521 | L414-L418 VanDerWaalsContact O-CB 3.3Å; L414-L418 WeakPolarHBondContact O-CB 3.32Å; L414-L418 PolarHBondContact O-N 3.46Å; F416-L418 VanDerWaalsContact C-N 3.33Å; F416-L418 PolarHBondContact O-N 3.38Å; L418-T420 VanDerWaalsContact C-N 3.31Å; L418-T420 PolarHBondContact O-N 3.44Å; L418-T421 WeakPolarHBondContact O-CB 3.48Å; L418-T421 PolarHBondContact O-N 3.07Å; L418-I422 HydrophobicContact CG-CD1 4.25Å; L418-I422 WeakPolarHBondContact O-CG1 3.24Å; L418-I422 PolarHBondContact O-N 3.4Å; L418-Y459 HydrophobicContact CD1-CE1 4.27Å; L418-L517 HydrophobicContact CD1-CB 4.46Å; L418-L517 HydrophobicContact CD1-CD2 3.65Å; L418-T520 HydrophobicContact CD1-CG2 4.48Å; L418-T520 HydrophobicContact CD2-CG2 3.91Å; L418-L521 HydrophobicContact CB-CD1 4.34Å; L418-L521 VanDerWaalsContact CD2-CA 3.41Å; L418-L521 HydrophobicContact CD2-CB 3.78Å; L418-L521 HydrophobicContact CD2-CD1 3.82Å; L418-L521 HydrophobicContact CD2-CG 4.44Å; L418-L521 HydrophobicContact CG-CB 4.21Å; L418-L521 HydrophobicContact CG-CD1 4.06Å |
| 419 | A | 96.3 | Very high | 92.6 | Very high | 40 Ų | 40 | 31.9 Ų | 31.9 | 33% | 0.331 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -61.3 | -40 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L415 F416 T421 I422 V423 | L415-A419 WeakPolarHBondContact O-CB 3.06Å; L415-A419 PolarHBondContact O-N 2.99Å; F416-A419 PolarHBondContact O-N 2.84Å; A419-T421 VanDerWaalsContact C-N 3.33Å; A419-T421 PolarHBondContact O-N 2.89Å; A419-I422 PolarHBondContact O-N 2.9Å; A419-V423 WeakPolarHBondContact O-CG2 3.48Å; A419-V423 PolarHBondContact O-N 3.14Å |
| 420 | T | 96.3 | Very high | 93.1 | Very high | 28 Ų | 28 | 37.3 Ų | 37.3 | 17% | 0.172 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.4 | -41.8 | 175.8 | -56.4 | 0 | 0 | 0 | 0 | 111.2 | F416 L418 V423 C424 F450 I454 | F416-T420 WeakPolarHBondContact O-CB 3.3Å; F416-T420 PolarHBondContact O-N 3.03Å; F416-T420 PolarHBondContact O-OG1 3.11Å; L418-T420 VanDerWaalsContact C-N 3.31Å; L418-T420 PolarHBondContact O-N 3.44Å; T420-V423 PolarHBondContact O-N 2.87Å; T420-C424 PolarHBondContact O-N 3.19Å; T420-C424 VanDerWaalsContact O-N 3.08Å; T420-C424 PolarHBondContact O-SG 3.37Å; T420-F450 HydrophobicContact CG2-CE1 3.63Å; T420-F450 HydrophobicContact CG2-CZ 4.46Å; T420-I454 HydrophobicContact CG2-CD1 3.71Å |
| 421 | T | 95.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.1 | -45.2 | 176.9 | -54.2 | 0 | 0 | 0 | 0 | 110.9 | V364 S417 L418 A419 V423 C424 F425 A451 L517 | V364-T421 HydrophobicContact CG1-CG2 4.43Å; V364-T421 HydrophobicContact CG2-CG2 3.86Å; S417-T421 WeakPolarHBondContact O-CB 3.46Å; S417-T421 PolarHBondContact O-N 3.39Å; S417-T421 PolarHBondContact O-OG1 3.13Å; L418-T421 WeakPolarHBondContact O-CB 3.48Å; L418-T421 PolarHBondContact O-N 3.07Å; A419-T421 VanDerWaalsContact C-N 3.33Å; A419-T421 PolarHBondContact O-N 2.89Å; T421-V423 PolarHBondContact O-N 2.83Å; T421-C424 WeakPolarHBondContact O-CB 3.49Å; T421-C424 PolarHBondContact O-N 3.19Å; T421-F425 HydrophobicContact CG2-CD2 3.86Å; T421-F425 HydrophobicContact CG2-CE2 3.79Å; T421-F425 WeakPolarHBondContact O-CD2 3.43Å; T421-F425 PolarHBondContact O-N 3.39Å; T421-A451 HydrophobicContact CG2-CB 4.32Å; T421-L517 HydrophobicContact CG2-CD1 3.92Å; T421-L517 HydrophobicContact CG2-CD2 4.24Å |
| 422 | I | 95.9 | Very high | 93.1 | Very high | 20 Ų | 20 | 35.3 Ų | 35.3 | 10% | 0.103 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -56.7 | -50 | 175.1 | -69.6 | 165.2 | 0 | 0 | 0 | 111 | L418 A419 C424 F425 A426 E514 L517 V518 L521 | L418-I422 HydrophobicContact CG-CD1 4.25Å; L418-I422 WeakPolarHBondContact O-CG1 3.24Å; L418-I422 PolarHBondContact O-N 3.4Å; A419-I422 PolarHBondContact O-N 2.9Å; I422-C424 VanDerWaalsContact C-N 3.25Å; I422-C424 PolarHBondContact O-N 2.89Å; I422-F425 PolarHBondContact O-N 3.3Å; I422-F425 VanDerWaalsContact O-N 3.14Å; I422-A426 WeakPolarHBondContact O-CB 3.32Å; I422-A426 PolarHBondContact O-N 3.44Å; I422-E514 VanDerWaalsContact CG2-OE1 3.28Å; I422-E514 WeakPolarHBondContact CG2-OE1 3.41Å; I422-L517 HydrophobicContact CD1-CB 4.18Å; I422-L517 HydrophobicContact CG1-CB 3.57Å; I422-L517 HydrophobicContact CG1-CD1 4.34Å; I422-L517 HydrophobicContact CG1-CG 4.5Å; I422-V518 HydrophobicContact CD1-CG2 4.4Å; I422-V518 HydrophobicContact CG2-CG2 4.26Å; I422-L521 HydrophobicContact CD1-CB 3.89Å; I422-L521 HydrophobicContact CD1-CD2 3.79Å; I422-L521 HydrophobicContact CD1-CG 4.33Å |
| 423 | V | 96.7 | Very high | 93 | Very high | 101 Ų | 101 | 35.9 Ų | 35.9 | 61% | 0.612 | 21% | 0.205 | S | C | * | . | H | α-helix | trans | -58.7 | -38.6 | 179 | 172.2 | 0 | 0 | 0 | 0 | 111.8 | A419 T420 T421 A427 | A419-V423 WeakPolarHBondContact O-CG2 3.48Å; A419-V423 PolarHBondContact O-N 3.14Å; T420-V423 PolarHBondContact O-N 2.87Å; T421-V423 PolarHBondContact O-N 2.83Å; V423-A427 WeakPolarHBondContact O-CB 3.4Å; V423-A427 PolarHBondContact O-N 2.99Å |
| 424 | C | 94.1 | Very high | 92.9 | Very high | 15 Ų | 15 | 37.9 Ų | 37.9 | 10% | 0.101 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.2 | -45.4 | 175.9 | -68.7 | 0 | 0 | 0 | 0 | 112.7 | T420 T421 I422 A427 V428 I447 A451 | T420-C424 PolarHBondContact O-N 3.19Å; T420-C424 VanDerWaalsContact O-N 3.08Å; T420-C424 PolarHBondContact O-SG 3.37Å; T421-C424 WeakPolarHBondContact O-CB 3.49Å; T421-C424 PolarHBondContact O-N 3.19Å; I422-C424 VanDerWaalsContact C-N 3.25Å; I422-C424 PolarHBondContact O-N 2.89Å; C424-A427 PolarHBondContact O-N 3.34Å; C424-V428 WeakPolarHBondContact O-CG2 3.45Å; C424-V428 PolarHBondContact O-N 3.44Å; C424-I447 HydrophobicContact CB-CG2 3.58Å; C424-I447 WeakPolarHBondContact O-CG2 3.48Å; C424-A451 HydrophobicContact CB-CB 3.63Å |
| 425 | F | 92.1 | Very high | 92.4 | Very high | 3 Ų | 3 | 40.9 Ų | 40.9 | 1% | 0.013 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -69.7 | -35.7 | 178.4 | -84.8 | -83.6 | 0 | 0 | 0 | 112.6 | V364 S367 T421 I422 A427 V428 T429 A451 V513 E514 L517 | V364-F425 HydrophobicContact CB-CE2 4.41Å; V364-F425 HydrophobicContact CB-CZ 4.5Å; V364-F425 HydrophobicContact CG1-CE2 4Å; V364-F425 HydrophobicContact CG1-CZ 4.17Å; V364-F425 HydrophobicContact CG2-CE2 3.86Å; V364-F425 HydrophobicContact CG2-CZ 4.28Å; S367-F425 VanDerWaalsContact OG-CZ 3.25Å; S367-F425 WeakPolarHBondContact OG-CZ 3.43Å; T421-F425 HydrophobicContact CG2-CD2 3.86Å; T421-F425 HydrophobicContact CG2-CE2 3.79Å; T421-F425 WeakPolarHBondContact O-CD2 3.43Å; T421-F425 PolarHBondContact O-N 3.39Å; I422-F425 PolarHBondContact O-N 3.3Å; I422-F425 VanDerWaalsContact O-N 3.14Å; F425-A427 PolarHBondContact O-N 3.01Å; F425-V428 PolarHBondContact O-N 3.25Å; F425-T429 WeakPolarHBondContact O-CB 3.36Å; F425-T429 PolarHBondContact O-N 3.21Å; F425-T429 PolarHBondContact O-OG1 2.85Å; F425-A451 HydrophobicContact CD2-CB 4.39Å; F425-A451 HydrophobicContact CE2-CB 4.02Å; F425-V513 HydrophobicContact CD1-CB 4.38Å; F425-V513 HydrophobicContact CD1-CG1 3.91Å; F425-V513 HydrophobicContact CD2-CG1 4.31Å; F425-V513 HydrophobicContact CE1-CB 4.33Å; F425-V513 HydrophobicContact CE1-CG1 3.73Å; F425-V513 HydrophobicContact CE2-CG1 4.17Å; F425-V513 HydrophobicContact CG-CG1 4.21Å; F425-V513 HydrophobicContact CZ-CG1 3.87Å; F425-E514 WeakPolarHBondContact CB-OE2 3.31Å; F425-L517 HydrophobicContact CD2-CD1 3.73Å; F425-L517 HydrophobicContact CE2-CD1 4.25Å; F425-L517 HydrophobicContact CG-CD1 4.27Å |
| 426 | A | 94.2 | Very high | 91.8 | Very high | 32 Ų | 32 | 43.9 Ų | 43.9 | 26% | 0.264 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -58.1 | -46.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | I422 V428 T429 I430 E514 | I422-A426 WeakPolarHBondContact O-CB 3.32Å; I422-A426 PolarHBondContact O-N 3.44Å; A426-V428 PolarHBondContact O-N 3.41Å; A426-T429 PolarHBondContact O-N 3Å; A426-I430 VanDerWaalsContact O-CG1 3.28Å; A426-I430 WeakPolarHBondContact O-CG1 3.48Å; A426-I430 PolarHBondContact O-N 3.47Å; A426-E514 PolarHBondContact N-OE2 3.39Å |
| 427 | A | 93.2 | Very high | 90.8 | Very high | 36 Ų | 36 | 39.3 Ų | 39.3 | 30% | 0.298 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -61.3 | -43.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V423 C424 F425 I430 I431 I447 | V423-A427 WeakPolarHBondContact O-CB 3.4Å; V423-A427 PolarHBondContact O-N 2.99Å; C424-A427 PolarHBondContact O-N 3.34Å; F425-A427 PolarHBondContact O-N 3.01Å; A427-I430 PolarHBondContact O-N 3.09Å; A427-I431 WeakPolarHBondContact O-CG1 3.28Å; A427-I431 PolarHBondContact O-N 2.95Å; A427-I431 VanDerWaalsContact O-N 3.1Å; A427-I447 HydrophobicContact CB-CD1 4.37Å |
| 428 | V | 90.3 | Very high | 90 | Very high | 3 Ų | 3 | 46 Ų | 46 | 2% | 0.018 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.3 | -42.7 | 176.7 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | C424 F425 A426 I430 I431 L432 I447 V448 | C424-V428 WeakPolarHBondContact O-CG2 3.45Å; C424-V428 PolarHBondContact O-N 3.44Å; F425-V428 PolarHBondContact O-N 3.25Å; A426-V428 PolarHBondContact O-N 3.41Å; V428-I430 VanDerWaalsContact C-N 3.32Å; V428-I430 PolarHBondContact O-N 3.36Å; V428-I431 PolarHBondContact O-N 3.47Å; V428-L432 HydrophobicContact CG1-CD1 3.8Å; V428-L432 HydrophobicContact CG1-CG 4.34Å; V428-L432 VanDerWaalsContact O-CG 3.31Å; V428-L432 WeakPolarHBondContact O-CG 3.43Å; V428-L432 PolarHBondContact O-N 3.09Å; V428-I447 HydrophobicContact CG2-CB 4.05Å; V428-I447 HydrophobicContact CG2-CG2 3.66Å; V428-V448 HydrophobicContact CG1-CG2 4.26Å; V428-V448 HydrophobicContact CG2-CG2 3.73Å |
| 429 | T | 90.1 | Very high | 89.4 | Confident | 15 Ų | 15 | 49.8 Ų | 49.8 | 9% | 0.092 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61.4 | -41 | 178 | -56.2 | 0 | 0 | 0 | 0 | 111.4 | F425 A426 L432 L433 V507 C510 I511 | F425-T429 WeakPolarHBondContact O-CB 3.36Å; F425-T429 PolarHBondContact O-N 3.21Å; F425-T429 PolarHBondContact O-OG1 2.85Å; A426-T429 PolarHBondContact O-N 3Å; T429-L432 PolarHBondContact O-N 2.72Å; T429-L433 HydrophobicContact CG2-CD1 4.07Å; T429-L433 HydrophobicContact CG2-CG 4.48Å; T429-L433 WeakPolarHBondContact O-CB 3.49Å; T429-L433 VanDerWaalsContact O-CG 3.32Å; T429-L433 WeakPolarHBondContact O-CG 3.41Å; T429-L433 PolarHBondContact O-N 3.39Å; T429-V507 HydrophobicContact CG2-CG1 4.43Å; T429-C510 WeakPolarHBondContact OG1-CB 3.46Å; T429-I511 HydrophobicContact CG2-CG1 3.89Å |
| 430 | I | 92.3 | Very high | 88.8 | Confident | 115 Ų | 115 | 52.7 Ų | 52.7 | 59% | 0.59 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -63.1 | -44.7 | 175.5 | -68.8 | 164.1 | 0 | 0 | 0 | 111.1 | A426 A427 V428 L432 L433 A434 | A426-I430 VanDerWaalsContact O-CG1 3.28Å; A426-I430 WeakPolarHBondContact O-CG1 3.48Å; A426-I430 PolarHBondContact O-N 3.47Å; A427-I430 PolarHBondContact O-N 3.09Å; V428-I430 VanDerWaalsContact C-N 3.32Å; V428-I430 PolarHBondContact O-N 3.36Å; I430-L432 VanDerWaalsContact C-N 3.31Å; I430-L432 PolarHBondContact O-N 3.01Å; I430-L433 PolarHBondContact O-N 3.12Å; I430-A434 WeakPolarHBondContact O-CB 3.29Å; I430-A434 PolarHBondContact O-N 2.74Å |
| 431 | I | 89.5 | Confident | 88.1 | Confident | 24 Ų | 24 | 52.8 Ų | 52.8 | 12% | 0.123 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.1 | -40.3 | 178.1 | -65.5 | 164.8 | 0 | 0 | 0 | 111 | A427 V428 A434 G435 Q436 L443 T444 I447 | A427-I431 WeakPolarHBondContact O-CG1 3.28Å; A427-I431 PolarHBondContact O-N 2.95Å; A427-I431 VanDerWaalsContact O-N 3.1Å; V428-I431 PolarHBondContact O-N 3.47Å; I431-A434 PolarHBondContact O-N 2.99Å; I431-G435 PolarHBondContact O-N 3.42Å; I431-Q436 PolarHBondContact O-N 3.41Å; I431-L443 HydrophobicContact CD1-CD2 4.3Å; I431-T444 HydrophobicContact CB-CG2 4.09Å; I431-T444 HydrophobicContact CD1-CG2 3.84Å; I431-T444 HydrophobicContact CG2-CG2 3.56Å; I431-I447 HydrophobicContact CD1-CD1 4.34Å |
| 432 | L | 86 | Confident | 87.5 | Confident | 15 Ų | 15 | 62 Ų | 62 | 8% | 0.079 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.1 | -44.9 | 176.7 | -71.6 | 165.1 | 0 | 0 | 0 | 111.6 | F370 V428 T429 I430 A434 G435 V437 A506 V507 C510 | F370-L432 HydrophobicContact CZ-CD1 4.34Å; F370-L432 HydrophobicContact CZ-CD2 3.99Å; V428-L432 HydrophobicContact CG1-CD1 3.8Å; V428-L432 HydrophobicContact CG1-CG 4.34Å; V428-L432 VanDerWaalsContact O-CG 3.31Å; V428-L432 WeakPolarHBondContact O-CG 3.43Å; V428-L432 PolarHBondContact O-N 3.09Å; T429-L432 PolarHBondContact O-N 2.72Å; I430-L432 VanDerWaalsContact C-N 3.31Å; I430-L432 PolarHBondContact O-N 3.01Å; L432-A434 VanDerWaalsContact C-N 3.31Å; L432-A434 PolarHBondContact O-N 3.04Å; L432-G435 PolarHBondContact O-N 3.21Å; L432-G435 VanDerWaalsContact O-N 3.11Å; L432-V437 HydrophobicContact CD2-CG1 4.32Å; L432-V437 HydrophobicContact CD2-CG2 3.49Å; L432-V437 VanDerWaalsContact CD2-CG2 3.49Å; L432-V437 HydrophobicContact CG-CG2 4.35Å; L432-A506 HydrophobicContact CD2-CB 4.32Å; L432-V507 HydrophobicContact CB-CG2 3.84Å; L432-C510 HydrophobicContact CD1-CB 4.2Å; L432-C510 WeakPolarHBondContact CD1-SG 3.39Å |
| 433 | L | 89.1 | Confident | 87.1 | Confident | 119 Ų | 119 | 65.3 Ų | 65.3 | 62% | 0.623 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -65 | -33.2 | 176.9 | -75.6 | 171 | 0 | 0 | 0 | 112.9 | T429 I430 G435 V507 | T429-L433 HydrophobicContact CG2-CD1 4.07Å; T429-L433 HydrophobicContact CG2-CG 4.48Å; T429-L433 WeakPolarHBondContact O-CB 3.49Å; T429-L433 VanDerWaalsContact O-CG 3.32Å; T429-L433 WeakPolarHBondContact O-CG 3.41Å; T429-L433 PolarHBondContact O-N 3.39Å; I430-L433 PolarHBondContact O-N 3.12Å; L433-G435 PolarHBondContact O-N 3.27Å; L433-V507 HydrophobicContact CD2-CG1 3.7Å; L433-V507 HydrophobicContact CD2-CG2 4.41Å; L433-V507 HydrophobicContact CG-CG1 3.93Å |
| 434 | A | 89.3 | Confident | 86.6 | Confident | 58 Ų | 58 | 60.7 Ų | 60.7 | 48% | 0.479 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -9.7 | 175 | 0 | 0 | 0 | 0 | 0 | 113.3 | I430 I431 L432 Q436 | I430-A434 WeakPolarHBondContact O-CB 3.29Å; I430-A434 PolarHBondContact O-N 2.74Å; I431-A434 PolarHBondContact O-N 2.99Å; L432-A434 VanDerWaalsContact C-N 3.31Å; L432-A434 PolarHBondContact O-N 3.04Å; A434-Q436 HydrophobicContact CB-CG 4.22Å; A434-Q436 PolarHBondContact O-N 2.75Å |
| 435 | G | 82.5 | Confident | 86.1 | Confident | 63 Ų | 63 | 60.4 Ų | 60.4 | 65% | 0.649 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.1 | 12.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | I431 L432 L433 V437 | I431-G435 PolarHBondContact O-N 3.42Å; L432-G435 PolarHBondContact O-N 3.21Å; L432-G435 VanDerWaalsContact O-N 3.11Å; L433-G435 PolarHBondContact O-N 3.27Å; G435-V437 VanDerWaalsContact C-N 3.34Å; G435-V437 PolarHBondContact O-N 3.46Å |
| 436 | Q | 81 | Confident | 86 | Confident | 99 Ų | 99 | 62.1 Ų | 62.1 | 46% | 0.463 | 37% | 0.369 | S | S | . | . | trans | -96 | 22.4 | -174.1 | -61.7 | -176.7 | -26.5 | 0 | 0 | 113.2 | I431 A434 V438 A439 Y440 | I431-Q436 PolarHBondContact O-N 3.41Å; A434-Q436 HydrophobicContact CB-CG 4.22Å; A434-Q436 PolarHBondContact O-N 2.75Å; Q436-V438 VanDerWaalsContact C-N 3.29Å; Q436-V438 PolarHBondContact O-N 2.96Å; Q436-A439 PolarHBondContact O-N 3.43Å; Q436-Y440 HydrophobicContact CB-CD2 3.63Å; Q436-Y440 HydrophobicContact CB-CE2 3.81Å; Q436-Y440 HydrophobicContact CG-CE2 4.45Å; Q436-Y440 WeakPolarHBondContact O-CD2 3.23Å; Q436-Y440 PolarHBondContact O-N 2.7Å; Q436-Y440 VanDerWaalsContact OE1-CE2 3.22Å | ||
| 437 | V | 73.4 | Confident | 85.8 | Confident | 40 Ų | 40 | 62.1 Ų | 62.1 | 24% | 0.242 | 36% | 0.364 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | -40.8 | -173.5 | -172.3 | 0 | 0 | 0 | 0 | 112.3 | L432 G435 Y440 A441 | L432-V437 HydrophobicContact CD2-CG1 4.32Å; L432-V437 HydrophobicContact CD2-CG2 3.49Å; L432-V437 VanDerWaalsContact CD2-CG2 3.49Å; L432-V437 HydrophobicContact CG-CG2 4.35Å; G435-V437 VanDerWaalsContact C-N 3.34Å; G435-V437 PolarHBondContact O-N 3.46Å; V437-Y440 CarbonylContact O-C 3.55Å; V437-Y440 PolarHBondContact O-N 3.36Å; V437-A441 WeakPolarHBondContact O-CA 3.15Å; V437-A441 WeakPolarHBondContact O-CB 3.29Å; V437-A441 PolarHBondContact O-N 3.38Å |
| 438 | V | 76.9 | Confident | 85.5 | Confident | 139 Ų | 139 | 60.6 Ų | 60.6 | 84% | 0.842 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.7 | -42.3 | -179 | -177.7 | 0 | 0 | 0 | 0 | 111.1 | Q436 Y440 | Q436-V438 VanDerWaalsContact C-N 3.29Å; Q436-V438 PolarHBondContact O-N 2.96Å; V438-Y440 VanDerWaalsContact C-N 3.33Å; V438-Y440 PolarHBondContact O-N 3.03Å |
| 439 | A | 82.2 | Confident | 85.4 | Confident | 80 Ų | 80 | 60.6 Ų | 60.6 | 66% | 0.661 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -34.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q436 | Q436-A439 PolarHBondContact O-N 3.43Š|
| 440 | Y | 84.6 | Confident | 85.4 | Confident | 102 Ų | 102 | 63.5 Ų | 63.5 | 40% | 0.4 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.4 | 24.2 | -178.2 | -62.7 | -74.2 | 0 | 0 | 0 | 113.4 | Q436 V437 V438 Y442 L443 T444 | Q436-Y440 HydrophobicContact CB-CD2 3.63Å; Q436-Y440 HydrophobicContact CB-CE2 3.81Å; Q436-Y440 HydrophobicContact CG-CE2 4.45Å; Q436-Y440 WeakPolarHBondContact O-CD2 3.23Å; Q436-Y440 PolarHBondContact O-N 2.7Å; Q436-Y440 VanDerWaalsContact OE1-CE2 3.22Å; V437-Y440 CarbonylContact O-C 3.55Å; V437-Y440 PolarHBondContact O-N 3.36Å; V438-Y440 VanDerWaalsContact C-N 3.33Å; V438-Y440 PolarHBondContact O-N 3.03Å; Y440-Y442 VanDerWaalsContact C-N 3.32Å; Y440-Y442 PolarHBondContact O-N 3.33Å; Y440-L443 HydrophobicContact CD1-CD2 3.95Å; Y440-L443 WeakPolarHBondContact O-CB 3.31Å; Y440-L443 PolarHBondContact O-N 3.39Å; Y440-T444 WeakPolarHBondContact O-CG2 3.31Å; Y440-T444 PolarHBondContact O-N 3.39Å; Y440-T444 PolarHBondContact O-OG1 3.01Å |
| 441 | A | 81.7 | Confident | 85.4 | Confident | 30 Ų | 30 | 58 Ų | 58 | 25% | 0.248 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -54.6 | -48.1 | -174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | V437 L443 T444 Y445 | V437-A441 WeakPolarHBondContact O-CA 3.15Å; V437-A441 WeakPolarHBondContact O-CB 3.29Å; V437-A441 PolarHBondContact O-N 3.38Å; A441-L443 VanDerWaalsContact C-N 3.33Å; A441-L443 PolarHBondContact O-N 2.91Å; A441-T444 PolarHBondContact O-N 2.96Å; A441-T444 PolarHBondContact O-OG1 2.87Å; A441-Y445 WeakPolarHBondContact O-CB 3.07Å; A441-Y445 PolarHBondContact O-N 3.33Å |
| 442 | Y | 83.5 | Confident | 85.4 | Confident | 194 Ų | 194 | 57.4 Ų | 57.4 | 76% | 0.761 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -62.4 | -37.1 | 177.3 | -62 | -67.9 | 0 | 0 | 0 | 113.5 | Y440 G446 | Y440-Y442 VanDerWaalsContact C-N 3.32Å; Y440-Y442 PolarHBondContact O-N 3.33Å; Y442-G446 PolarHBondContact O-N 3.27Å |
| 443 | L | 87.3 | Confident | 85.7 | Confident | 88 Ų | 88 | 56.7 Ų | 56.7 | 46% | 0.461 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -69.8 | -46.5 | 178.4 | 179.4 | 63.7 | 0 | 0 | 0 | 110.7 | I431 Y440 A441 Y445 G446 I447 | I431-L443 HydrophobicContact CD1-CD2 4.3Å; Y440-L443 HydrophobicContact CD1-CD2 3.95Å; Y440-L443 WeakPolarHBondContact O-CB 3.31Å; Y440-L443 PolarHBondContact O-N 3.39Å; A441-L443 VanDerWaalsContact C-N 3.33Å; A441-L443 PolarHBondContact O-N 2.91Å; L443-Y445 VanDerWaalsContact C-N 3.28Å; L443-Y445 PolarHBondContact O-N 2.93Å; L443-G446 PolarHBondContact O-N 3.32Å; L443-I447 HydrophobicContact CD1-CD1 4.01Å; L443-I447 HydrophobicContact CD1-CG1 4.32Å; L443-I447 HydrophobicContact CG-CD1 3.86Å; L443-I447 VanDerWaalsContact O-CG1 3.27Å; L443-I447 WeakPolarHBondContact O-CG1 3.35Å; L443-I447 PolarHBondContact O-N 3.29Å |
| 444 | T | 85.5 | Confident | 85.9 | Confident | 4 Ų | 4 | 51.4 Ų | 51.4 | 3% | 0.025 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.4 | -41.8 | 175.8 | 60.3 | 0 | 0 | 0 | 0 | 111.2 | Q374 I431 Y440 A441 I447 V448 | Q374-T444 PolarHBondContact NE2-OG1 2.88Å; I431-T444 HydrophobicContact CB-CG2 4.09Å; I431-T444 HydrophobicContact CD1-CG2 3.84Å; I431-T444 HydrophobicContact CG2-CG2 3.56Å; Y440-T444 WeakPolarHBondContact O-CG2 3.31Å; Y440-T444 PolarHBondContact O-N 3.39Å; Y440-T444 PolarHBondContact O-OG1 3.01Å; A441-T444 PolarHBondContact O-N 2.96Å; A441-T444 PolarHBondContact O-OG1 2.87Å; T444-I447 PolarHBondContact O-N 3.2Å; T444-V448 WeakPolarHBondContact O-CG2 3.12Å; T444-V448 PolarHBondContact O-N 3.46Å |
| 445 | Y | 84.5 | Confident | 86.1 | Confident | 10 Ų | 10 | 48.6 Ų | 48.6 | 4% | 0.039 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.4 | -51.4 | 175.1 | 178.8 | -94.3 | 0 | 0 | 0 | 112 | L371 F376 M377 H383 L386 A441 L443 I447 V448 M449 | L371-Y445 HydrophobicContact CD2-CD2 3.39Å; L371-Y445 HydrophobicContact CD2-CE2 3.9Å; L371-Y445 HydrophobicContact CD2-CG 4.25Å; L371-Y445 HydrophobicContact CG-CD2 4.03Å; F376-Y445 HydrophobicContact CB-CD1 4.44Å; F376-Y445 HydrophobicContact CB-CD2 4.05Å; F376-Y445 HydrophobicContact CB-CE1 4.38Å; F376-Y445 HydrophobicContact CB-CE2 3.98Å; F376-Y445 HydrophobicContact CB-CG 4.29Å; F376-Y445 HydrophobicContact CD1-CD1 4.02Å; F376-Y445 HydrophobicContact CD1-CD2 4.49Å; F376-Y445 AromaticContact CD1-CE1 3.24Å; F376-Y445 HydrophobicContact CD1-CE1 3.24Å; F376-Y445 AromaticContact CD1-CE2 3.81Å; F376-Y445 HydrophobicContact CD1-CE2 3.81Å; F376-Y445 AromaticContact CD1-CZ 3.13Å; F376-Y445 WeakPolarHBondContact CD1-OH 3.43Å; F376-Y445 HydrophobicContact CE1-CD1 4.37Å; F376-Y445 AromaticContact CE1-CE1 3.44Å; F376-Y445 HydrophobicContact CE1-CE1 3.44Å; F376-Y445 VanDerWaalsContact CE1-CE1 3.44Å; F376-Y445 AromaticContact CE1-CZ 3.66Å; F376-Y445 WeakPolarHBondContact CE1-OH 3.38Å; F376-Y445 HydrophobicContact CG-CD1 4.15Å; F376-Y445 AromaticContact CG-CE1 3.84Å; F376-Y445 HydrophobicContact CG-CE1 3.84Å; F376-Y445 HydrophobicContact CG-CE2 4.24Å; F376-Y445 HydrophobicContact CG-CG 4.49Å; F376-Y445 AromaticContact CG-CZ 3.9Å; F376-Y445 HydrophobicContact CZ-CE1 4.22Å; M377-Y445 HydrophobicContact CE-CE2 3.83Å; M377-Y445 HydrophobicContact CG-CE2 4.24Å; M377-Y445 HydrophobicContact SD-CE2 4.09Å; H383-Y445 AromaticContact ND1-CZ 3.97Å; H383-Y445 PolarHBondContact ND1-OH 2.95Å; L386-Y445 HydrophobicContact CD2-CE1 4.48Å; A441-Y445 WeakPolarHBondContact O-CB 3.07Å; A441-Y445 PolarHBondContact O-N 3.33Å; L443-Y445 VanDerWaalsContact C-N 3.28Å; L443-Y445 PolarHBondContact O-N 2.93Å; Y445-I447 VanDerWaalsContact C-N 3.31Å; Y445-I447 PolarHBondContact O-N 3.45Å; Y445-V448 PolarHBondContact O-N 3.41Å; Y445-M449 HydrophobicContact CD1-CG 3.94Å; Y445-M449 HydrophobicContact CD2-CG 4.29Å; Y445-M449 HydrophobicContact CE1-CG 3.47Å; Y445-M449 VanDerWaalsContact CE1-CG 3.47Å; Y445-M449 HydrophobicContact CE1-SD 4.41Å; Y445-M449 HydrophobicContact CE2-CG 3.87Å; Y445-M449 HydrophobicContact CE2-SD 4.2Å; Y445-M449 HydrophobicContact CG-CG 4.31Å; Y445-M449 VanDerWaalsContact CZ-CG 3.42Å; Y445-M449 VanDerWaalsContact O-CB 3.3Å; Y445-M449 WeakPolarHBondContact O-CB 3.24Å; Y445-M449 WeakPolarHBondContact O-CG 3.13Å; Y445-M449 PolarHBondContact O-N 2.94Å |
| 446 | G | 88.2 | Confident | 86.4 | Confident | 38 Ų | 38 | 45.8 Ų | 45.8 | 39% | 0.392 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59 | -40.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y442 L443 F450 | Y442-G446 PolarHBondContact O-N 3.27Å; L443-G446 PolarHBondContact O-N 3.32Å; G446-F450 WeakPolarHBondContact O-CB 3.48Å; G446-F450 PolarHBondContact O-N 3.26Å |
| 447 | I | 90.1 | Very high | 87 | Confident | 32 Ų | 32 | 41 Ų | 41 | 16% | 0.164 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.3 | -47.9 | 178.9 | -65.8 | 166.4 | 0 | 0 | 0 | 111.2 | C424 A427 V428 I431 L443 T444 Y445 M449 F450 A451 | C424-I447 HydrophobicContact CB-CG2 3.58Å; C424-I447 WeakPolarHBondContact O-CG2 3.48Å; A427-I447 HydrophobicContact CB-CD1 4.37Å; V428-I447 HydrophobicContact CG2-CB 4.05Å; V428-I447 HydrophobicContact CG2-CG2 3.66Å; I431-I447 HydrophobicContact CD1-CD1 4.34Å; L443-I447 HydrophobicContact CD1-CD1 4.01Å; L443-I447 HydrophobicContact CD1-CG1 4.32Å; L443-I447 HydrophobicContact CG-CD1 3.86Å; L443-I447 VanDerWaalsContact O-CG1 3.27Å; L443-I447 WeakPolarHBondContact O-CG1 3.35Å; L443-I447 PolarHBondContact O-N 3.29Å; T444-I447 PolarHBondContact O-N 3.2Å; Y445-I447 VanDerWaalsContact C-N 3.31Å; Y445-I447 PolarHBondContact O-N 3.45Å; I447-M449 VanDerWaalsContact C-N 3.33Å; I447-M449 PolarHBondContact O-N 2.92Å; I447-F450 PolarHBondContact O-N 3.18Å; I447-A451 WeakPolarHBondContact O-CB 3.39Å; I447-A451 PolarHBondContact O-N 3.37Å |
| 448 | V | 88.1 | Confident | 87.9 | Confident | 5 Ų | 5 | 39.6 Ų | 39.6 | 3% | 0.03 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64.3 | -40.7 | 178 | 175.6 | 0 | 0 | 0 | 0 | 110.7 | L371 V428 T444 Y445 F450 A451 F452 | L371-V448 HydrophobicContact CD1-CB 4.48Å; L371-V448 HydrophobicContact CD1-CG2 4.28Å; L371-V448 HydrophobicContact CD2-CB 3.83Å; L371-V448 HydrophobicContact CD2-CG1 3.81Å; V428-V448 HydrophobicContact CG1-CG2 4.26Å; V428-V448 HydrophobicContact CG2-CG2 3.73Å; T444-V448 WeakPolarHBondContact O-CG2 3.12Å; T444-V448 PolarHBondContact O-N 3.46Å; Y445-V448 PolarHBondContact O-N 3.41Å; V448-F450 VanDerWaalsContact C-N 3.33Å; V448-F450 PolarHBondContact O-N 3.2Å; V448-A451 PolarHBondContact O-N 3.11Å; V448-F452 VanDerWaalsContact O-CB 3.28Å; V448-F452 WeakPolarHBondContact O-CB 3.49Å; V448-F452 PolarHBondContact O-N 3.15Å |
| 449 | M | 87.3 | Confident | 88.7 | Confident | 2 Ų | 2 | 33 Ų | 33 | 1% | 0.01 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.3 | -43 | 174.9 | -77.5 | -62.3 | -70.8 | 0 | 0 | 112.3 | L368 M377 H383 L386 A387 Y445 I447 N453 | L368-M449 HydrophobicContact CD1-SD 4.35Å; M377-M449 HydrophobicContact CE-SD 4.38Å; H383-M449 VanDerWaalsContact CE1-CE 3.47Å; H383-M449 WeakPolarHBondContact CE1-CE 3.41Å; H383-M449 PolarHBondContact CE1-SD 3.47Å; H383-M449 WeakPolarHBondContact ND1-CE 3.47Å; H383-M449 PolarHBondContact ND1-SD 2.94Å; H383-M449 VanDerWaalsContact ND1-SD 3.4Å; L386-M449 HydrophobicContact CD2-CE 4.39Å; L386-M449 HydrophobicContact CG-CE 4.43Å; A387-M449 HydrophobicContact CB-CE 3.95Å; Y445-M449 HydrophobicContact CD1-CG 3.94Å; Y445-M449 HydrophobicContact CD2-CG 4.29Å; Y445-M449 HydrophobicContact CE1-CG 3.47Å; Y445-M449 VanDerWaalsContact CE1-CG 3.47Å; Y445-M449 HydrophobicContact CE1-SD 4.41Å; Y445-M449 HydrophobicContact CE2-CG 3.87Å; Y445-M449 HydrophobicContact CE2-SD 4.2Å; Y445-M449 HydrophobicContact CG-CG 4.31Å; Y445-M449 VanDerWaalsContact CZ-CG 3.42Å; Y445-M449 VanDerWaalsContact O-CB 3.3Å; Y445-M449 WeakPolarHBondContact O-CB 3.24Å; Y445-M449 WeakPolarHBondContact O-CG 3.13Å; Y445-M449 PolarHBondContact O-N 2.94Å; I447-M449 VanDerWaalsContact C-N 3.33Å; I447-M449 PolarHBondContact O-N 2.92Å; M449-N453 WeakPolarHBondContact O-CB 3.42Å; M449-N453 PolarHBondContact O-N 2.83Å; M449-N453 PolarHBondContact O-ND2 3Å |
| 450 | F | 91.6 | Very high | 89.3 | Confident | 76 Ų | 76 | 29.9 Ų | 29.9 | 33% | 0.333 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -62.5 | -48 | 175.7 | -176.5 | -90.5 | 0 | 0 | 0 | 111.2 | F394 T420 G446 I447 V448 N453 I454 | F394-F450 AromaticContact CE1-CE2 3.98Å; F394-F450 HydrophobicContact CE1-CE2 3.98Å; F394-F450 HydrophobicContact CE2-CD2 4.38Å; F394-F450 HydrophobicContact CE2-CE2 4.38Å; F394-F450 AromaticContact CZ-CD2 3.69Å; F394-F450 HydrophobicContact CZ-CD2 3.69Å; F394-F450 AromaticContact CZ-CE2 3.41Å; F394-F450 HydrophobicContact CZ-CE2 3.41Å; F394-F450 VanDerWaalsContact CZ-CE2 3.41Å; F394-F450 HydrophobicContact CZ-CZ 4.14Å; T420-F450 HydrophobicContact CG2-CE1 3.63Å; T420-F450 HydrophobicContact CG2-CZ 4.46Å; G446-F450 WeakPolarHBondContact O-CB 3.48Å; G446-F450 PolarHBondContact O-N 3.26Å; I447-F450 PolarHBondContact O-N 3.18Å; V448-F450 VanDerWaalsContact C-N 3.33Å; V448-F450 PolarHBondContact O-N 3.2Å; F450-N453 PolarHBondContact O-N 3.21Å; F450-I454 HydrophobicContact CE1-CD1 4.43Å; F450-I454 WeakPolarHBondContact O-CG2 3.29Å; F450-I454 PolarHBondContact O-N 3.38Å |
| 451 | A | 92.2 | Very high | 89.6 | Confident | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -60.4 | -45.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | T421 C424 F425 I447 V448 N453 I454 S455 | T421-A451 HydrophobicContact CG2-CB 4.32Å; C424-A451 HydrophobicContact CB-CB 3.63Å; F425-A451 HydrophobicContact CD2-CB 4.39Å; F425-A451 HydrophobicContact CE2-CB 4.02Å; I447-A451 WeakPolarHBondContact O-CB 3.39Å; I447-A451 PolarHBondContact O-N 3.37Å; V448-A451 PolarHBondContact O-N 3.11Å; A451-N453 PolarHBondContact O-N 3.17Å; A451-I454 VanDerWaalsContact O-CG2 3.31Å; A451-I454 WeakPolarHBondContact O-CG2 2.97Å; A451-S455 WeakPolarHBondContact O-CB 3.28Å; A451-S455 PolarHBondContact O-N 3.35Å |
| 452 | F | 89.6 | Confident | 90.1 | Very high | 12 Ų | 12 | 23.6 Ų | 23.6 | 5% | 0.053 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -60.6 | -46.3 | 176.6 | 173 | -100 | 0 | 0 | 0 | 111.3 | N365 L368 V448 G456 | N365-F452 HydrophobicContact CB-CE2 4.37Å; N365-F452 WeakPolarHBondContact OD1-CE2 3.3Å; L368-F452 HydrophobicContact CB-CD2 4.48Å; L368-F452 HydrophobicContact CD1-CG 4.39Å; L368-F452 HydrophobicContact CD2-CD2 4.23Å; L368-F452 HydrophobicContact CD2-CE1 4.2Å; L368-F452 HydrophobicContact CD2-CE2 3.89Å; L368-F452 HydrophobicContact CD2-CZ 3.88Å; V448-F452 VanDerWaalsContact O-CB 3.28Å; V448-F452 WeakPolarHBondContact O-CB 3.49Å; V448-F452 PolarHBondContact O-N 3.15Å; F452-G456 PolarHBondContact O-N 3.36Å |
| 453 | N | 91.5 | Very high | 90.6 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -74.6 | -35.2 | -176.5 | -75.1 | -69.3 | 0 | 0 | 0 | 112.9 | A387 L390 F394 M449 F450 A451 S457 | A387-N453 WeakPolarHBondContact CA-OD1 3.17Å; A387-N453 PolarHBondContact O-OD1 3.19Å; L390-N453 HydrophobicContact CB-CB 3.94Å; F394-N453 HydrophobicContact CD2-CB 4.15Å; F394-N453 HydrophobicContact CE2-CB 3.95Å; M449-N453 WeakPolarHBondContact O-CB 3.42Å; M449-N453 PolarHBondContact O-N 2.83Å; M449-N453 PolarHBondContact O-ND2 3Å; F450-N453 PolarHBondContact O-N 3.21Å; A451-N453 PolarHBondContact O-N 3.17Å; N453-S457 WeakPolarHBondContact O-CB 3.39Å; N453-S457 PolarHBondContact O-N 3.36Å; N453-S457 PolarHBondContact O-OG 2.93Å |
| 454 | I | 93.5 | Very high | 90.9 | Very high | 7 Ų | 7 | 10.5 Ų | 10.5 | 4% | 0.036 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -69.6 | -40.5 | 174.4 | -164.2 | 173.1 | 0 | 0 | 0 | 111.6 | F394 F416 T420 F450 A451 V458 Y459 | F394-I454 HydrophobicContact CD2-CB 4.29Å; F394-I454 HydrophobicContact CE2-CB 4.28Å; F416-I454 HydrophobicContact CE1-CD1 4.37Å; T420-I454 HydrophobicContact CG2-CD1 3.71Å; F450-I454 HydrophobicContact CE1-CD1 4.43Å; F450-I454 WeakPolarHBondContact O-CG2 3.29Å; F450-I454 PolarHBondContact O-N 3.38Å; A451-I454 VanDerWaalsContact O-CG2 3.31Å; A451-I454 WeakPolarHBondContact O-CG2 2.97Å; I454-V458 HydrophobicContact CG1-CB 4.36Å; I454-V458 HydrophobicContact CG1-CG2 4.1Å; I454-V458 WeakPolarHBondContact O-CB 3.49Å; I454-V458 PolarHBondContact O-N 2.76Å; I454-Y459 PolarHBondContact O-N 3.39Å |
| 455 | S | 92.9 | Very high | 91.2 | Very high | 0 Ų | 0 | 10.5 Ų | 10.5 | 0% | 0 | 6% | 0.061 | C | C | . | . | I | π-helix | trans | -64 | -52.4 | 175.1 | 178.9 | 0 | 0 | 0 | 0 | 110.7 | A451 S457 Y459 H460 | A451-S455 WeakPolarHBondContact O-CB 3.28Å; A451-S455 PolarHBondContact O-N 3.35Å; S455-S457 VanDerWaalsContact C-N 3.32Å; S455-S457 PolarHBondContact O-N 3.38Å; S455-Y459 VanDerWaalsContact O-CB 3.32Å; S455-Y459 WeakPolarHBondContact O-CB 3.34Å; S455-Y459 PolarHBondContact O-N 3.01Å; S455-H460 PolarHBondContact O-N 3.17Å |
| 456 | G | 90.1 | Very high | 91.6 | Very high | 3 Ų | 3 | 10.1 Ų | 10.1 | 3% | 0.031 | 6% | 0.059 | C | C | . | . | I | π-helix | trans | -66.7 | -29.2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | R391 F452 H460 | R391-G456 VanDerWaalsContact CZ-C 3.49Å; R391-G456 PolarHBondContact NH1-O 3.34Å; R391-G456 PolarHBondContact NH2-O 3.35Å; F452-G456 PolarHBondContact O-N 3.36Å; G456-H460 WeakPolarHBondContact O-CB 3.34Å |
| 457 | S | 91.6 | Very high | 91.8 | Very high | 0 Ų | 0 | 8.3 Ų | 8.3 | 0% | 0 | 4% | 0.041 | C | C | . | . | I | π-helix | trans | -89.6 | -74.9 | 175.3 | 56.9 | 0 | 0 | 0 | 0 | 111.3 | Q244 F394 N453 S455 L461 | Q244-S457 PolarHBondContact NE2-O 3.13Å; Q244-S457 PolarHBondContact OE1-O 3.42Å; Q244-S457 VanDerWaalsContact OE1-O 3.13Å; F394-S457 WeakPolarHBondContact CB-OG 3.32Å; N453-S457 WeakPolarHBondContact O-CB 3.39Å; N453-S457 PolarHBondContact O-N 3.36Å; N453-S457 PolarHBondContact O-OG 2.93Å; S455-S457 VanDerWaalsContact C-N 3.32Å; S455-S457 PolarHBondContact O-N 3.38Å; S457-L461 WeakPolarHBondContact O-CB 3.24Å; S457-L461 PolarHBondContact O-N 3.39Å |
| 458 | V | 93.2 | Very high | 91.9 | Very high | 9 Ų | 9 | 7 Ų | 7 | 6% | 0.055 | 3% | 0.034 | C | C | . | . | I | π-helix | trans | -68.6 | -51.4 | -168.1 | -173.3 | 0 | 0 | 0 | 0 | 111.5 | F394 T398 V413 I454 L461 T462 | F394-V458 HydrophobicContact CB-CG2 3.94Å; T398-V458 HydrophobicContact CG2-CG1 4.11Å; T398-V458 VanDerWaalsContact OG1-CG2 3.31Å; T398-V458 WeakPolarHBondContact OG1-CG2 3.45Å; V413-V458 HydrophobicContact CG1-CG1 3.35Å; I454-V458 HydrophobicContact CG1-CB 4.36Å; I454-V458 HydrophobicContact CG1-CG2 4.1Å; I454-V458 WeakPolarHBondContact O-CB 3.49Å; I454-V458 PolarHBondContact O-N 2.76Å; V458-L461 PolarHBondContact O-N 2.93Å; V458-T462 WeakPolarHBondContact O-CG2 3.45Å; V458-T462 PolarHBondContact O-N 2.78Å; V458-T462 VanDerWaalsContact O-N 3.13Å; V458-T462 PolarHBondContact O-OG1 2.98Å |
| 459 | Y | 94.1 | Very high | 92 | Very high | 0 Ų | 0 | 6.8 Ų | 6.8 | 0% | 0 | 3% | 0.033 | C | C | . | . | I | π-helix | trans | -67.4 | -50.8 | -175.1 | 177.4 | -138.3 | 0 | 0 | 0 | 111.3 | S357 S360 I361 L414 S417 L418 I454 S455 L461 T462 V463 T520 | S357-Y459 WeakPolarHBondContact CA-OH 3.41Å; S357-Y459 VanDerWaalsContact CB-OH 3.24Å; S357-Y459 WeakPolarHBondContact CB-OH 3.49Å; S357-Y459 PolarHBondContact O-OH 3.01Å; S360-Y459 WeakPolarHBondContact OG-CE1 3.29Å; S360-Y459 PolarHBondContact OG-OH 3Å; I361-Y459 HydrophobicContact CD1-CD1 3.97Å; I361-Y459 HydrophobicContact CD1-CE1 3.93Å; I361-Y459 HydrophobicContact CG1-CD1 3.49Å; I361-Y459 VanDerWaalsContact CG1-CD1 3.49Å; I361-Y459 HydrophobicContact CG1-CE1 3.3Å; I361-Y459 HydrophobicContact CG1-CG 4.49Å; L414-Y459 HydrophobicContact CD1-CD2 4.46Å; L414-Y459 HydrophobicContact CD1-CE2 4.2Å; L414-Y459 HydrophobicContact CD2-CE2 4.41Å; L414-Y459 HydrophobicContact CG-CD2 4.02Å; L414-Y459 HydrophobicContact CG-CE2 3.95Å; S417-Y459 WeakPolarHBondContact OG-CA 3.3Å; S417-Y459 WeakPolarHBondContact OG-CB 3.34Å; L418-Y459 HydrophobicContact CD1-CE1 4.27Å; I454-Y459 PolarHBondContact O-N 3.39Å; S455-Y459 VanDerWaalsContact O-CB 3.32Å; S455-Y459 WeakPolarHBondContact O-CB 3.34Å; S455-Y459 PolarHBondContact O-N 3.01Å; Y459-L461 PolarHBondContact O-N 3.09Å; Y459-T462 PolarHBondContact O-N 3.32Å; Y459-T462 VanDerWaalsContact O-N 3.13Å; Y459-T462 PolarHBondContact O-OG1 3.37Å; Y459-V463 HydrophobicContact CD2-CG2 3.91Å; Y459-V463 HydrophobicContact CE2-CG2 3.52Å; Y459-V463 WeakPolarHBondContact O-CG2 3.27Å; Y459-V463 PolarHBondContact O-N 2.9Å; Y459-T520 WeakPolarHBondContact OH-CG2 3.47Å |
| 460 | H | 93.7 | Very high | 92.2 | Very high | 16 Ų | 16 | 7 Ų | 7 | 7% | 0.074 | 4% | 0.035 | C | C | . | . | H | α-helix | trans | -55.9 | -38.4 | 175.1 | -171.3 | -123 | 0 | 0 | 0 | 112.8 | Q244 I361 S455 G456 T462 V463 L464 E487 | Q244-H460 PolarHBondContact NE2-ND1 3.06Å; I361-H460 HydrophobicContact CD1-CB 4Å; S455-H460 PolarHBondContact O-N 3.17Å; G456-H460 WeakPolarHBondContact O-CB 3.34Å; H460-T462 PolarHBondContact O-N 2.92Å; H460-V463 PolarHBondContact O-N 3.21Å; H460-L464 VanDerWaalsContact CE1-CD1 3.48Å; H460-L464 WeakPolarHBondContact CE1-CD1 3.25Å; H460-L464 WeakPolarHBondContact O-CG 3.29Å; H460-L464 PolarHBondContact O-N 3.02Å; H460-E487 IonicContact CD2-OE1 3.14Å; H460-E487 IonicContact CD2-OE2 3.59Å; H460-E487 IonicContact CE1-OE2 3.7Å; H460-E487 IonicContact NE2-OE1 2.72Å; H460-E487 PolarHBondContact NE2-OE1 2.96Å; H460-E487 IonicContact NE2-OE2 3.47Å; H460-E487 PolarHBondContact NE2-OE2 3.44Å |
| 461 | L | 92.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 3.4 Ų | 3.4 | 0% | 0 | 2% | 0.019 | C | C | . | . | H | α-helix | trans | -62.4 | -48.1 | 179.1 | 176.6 | 61.9 | 0 | 0 | 0 | 110.2 | Y237 I240 A241 L395 T398 S457 V458 Y459 L464 H465 | Y237-L461 HydrophobicContact CD1-CD1 4.32Å; Y237-L461 HydrophobicContact CD1-CD2 3.97Å; Y237-L461 HydrophobicContact CD1-CG 3.98Å; Y237-L461 HydrophobicContact CE1-CD2 4.42Å; Y237-L461 HydrophobicContact CE1-CG 4.19Å; I240-L461 HydrophobicContact CB-CD1 3.77Å; I240-L461 HydrophobicContact CG2-CD1 3.61Å; A241-L461 HydrophobicContact CB-CD1 4.01Å; A241-L461 HydrophobicContact CB-CD2 4.44Å; L395-L461 HydrophobicContact CD1-CD2 3.72Å; T398-L461 HydrophobicContact CG2-CD2 4.18Å; S457-L461 WeakPolarHBondContact O-CB 3.24Å; S457-L461 PolarHBondContact O-N 3.39Å; V458-L461 PolarHBondContact O-N 2.93Å; Y459-L461 PolarHBondContact O-N 3.09Å; L461-L464 PolarHBondContact O-N 3.45Å; L461-H465 VanDerWaalsContact O-CB 3.25Å; L461-H465 WeakPolarHBondContact O-CB 3.29Å; L461-H465 PolarHBondContact O-N 3.29Å |
| 462 | T | 92.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 3.4 Ų | 3.4 | 0% | 0 | 2% | 0.019 | C | C | . | . | H | α-helix | trans | -67.1 | -35 | -179.3 | 53.8 | 0 | 0 | 0 | 0 | 112.8 | Y237 V413 L414 V458 Y459 H460 T466 | Y237-T462 HydrophobicContact CE1-CG2 4.48Å; V413-T462 HydrophobicContact CB-CG2 4.06Å; V413-T462 HydrophobicContact CG1-CG2 3.68Å; L414-T462 HydrophobicContact CB-CG2 4.4Å; V458-T462 WeakPolarHBondContact O-CG2 3.45Å; V458-T462 PolarHBondContact O-N 2.78Å; V458-T462 VanDerWaalsContact O-N 3.13Å; V458-T462 PolarHBondContact O-OG1 2.98Å; Y459-T462 PolarHBondContact O-N 3.32Å; Y459-T462 VanDerWaalsContact O-N 3.13Å; Y459-T462 PolarHBondContact O-OG1 3.37Å; H460-T462 PolarHBondContact O-N 2.92Å; T462-T466 WeakPolarHBondContact O-CB 3.42Å; T462-T466 PolarHBondContact O-N 2.99Å; T462-T466 PolarHBondContact O-OG1 3.43Å |
| 463 | V | 93.7 | Very high | 92.2 | Very high | 0 Ų | 0 | 2.9 Ų | 2.9 | 0% | 0 | 2% | 0.016 | C | C | . | . | H | α-helix | trans | -65.7 | -51.8 | 175.2 | 171.9 | 0 | 0 | 0 | 0 | 110.3 | L354 V358 I361 L414 Y459 H460 H465 T466 V467 | L354-V463 HydrophobicContact CD2-CG1 4.14Å; V358-V463 HydrophobicContact CG2-CG1 3.87Å; I361-V463 HydrophobicContact CD1-CB 4.35Å; I361-V463 HydrophobicContact CD1-CG2 4.15Å; L414-V463 HydrophobicContact CD1-CG2 4.17Å; Y459-V463 HydrophobicContact CD2-CG2 3.91Å; Y459-V463 HydrophobicContact CE2-CG2 3.52Å; Y459-V463 WeakPolarHBondContact O-CG2 3.27Å; Y459-V463 PolarHBondContact O-N 2.9Å; H460-V463 PolarHBondContact O-N 3.21Å; V463-H465 VanDerWaalsContact C-N 3.31Å; V463-H465 PolarHBondContact O-N 3.44Å; V463-T466 WeakPolarHBondContact O-CA 3.39Å; V463-T466 WeakPolarHBondContact O-CB 3.39Å; V463-T466 PolarHBondContact O-N 3.04Å; V463-V467 WeakPolarHBondContact O-CG2 3.45Å; V463-V467 PolarHBondContact O-N 2.98Å |
| 464 | L | 93.1 | Very high | 92 | Very high | 7 Ų | 7 | 3.1 Ų | 3.1 | 4% | 0.037 | 2% | 0.018 | C | C | . | . | H | α-helix | trans | -63.5 | -36 | 178 | -69.3 | -178.8 | 0 | 0 | 0 | 112.7 | I240 H460 L461 T466 V467 A468 F480 | I240-L464 HydrophobicContact CG2-CB 3.69Å; I240-L464 HydrophobicContact CG2-CD1 4.13Å; H460-L464 VanDerWaalsContact CE1-CD1 3.48Å; H460-L464 WeakPolarHBondContact CE1-CD1 3.25Å; H460-L464 WeakPolarHBondContact O-CG 3.29Å; H460-L464 PolarHBondContact O-N 3.02Å; L461-L464 PolarHBondContact O-N 3.45Å; L464-T466 VanDerWaalsContact C-N 3.32Å; L464-V467 WeakPolarHBondContact O-CB 3.49Å; L464-V467 PolarHBondContact O-N 2.71Å; L464-A468 PolarHBondContact O-N 2.72Å; L464-F480 HydrophobicContact CB-CE1 4.29Å; L464-F480 HydrophobicContact CD2-CD1 4.12Å; L464-F480 HydrophobicContact CD2-CE1 4.12Å |
| 465 | H | 92.1 | Very high | 92 | Very high | 4 Ų | 4 | 2.8 Ų | 2.8 | 2% | 0.019 | 2% | 0.016 | C | C | . | . | H | α-helix | trans | -63.7 | -39.9 | 172 | -177.8 | 80.2 | 0 | 0 | 0 | 112.1 | Y237 I240 L461 V463 V467 A468 V469 | Y237-H465 HydrophobicContact CD1-CB 4.48Å; Y237-H465 AromaticContact CD2-CE1 3.69Å; Y237-H465 AromaticContact CD2-ND1 3.9Å; Y237-H465 HydrophobicContact CE1-CB 3.87Å; Y237-H465 AromaticContact CE1-CG 3.74Å; Y237-H465 AromaticContact CE2-CD2 3.52Å; Y237-H465 AromaticContact CE2-CE1 3.41Å; Y237-H465 VanDerWaalsContact CE2-CE1 3.41Å; Y237-H465 WeakPolarHBondContact CE2-CE1 3.45Å; Y237-H465 AromaticContact CE2-CG 3.76Å; Y237-H465 AromaticContact CE2-ND1 3.71Å; Y237-H465 AromaticContact CE2-NE2 3.26Å; Y237-H465 VanDerWaalsContact CE2-NE2 3.26Å; Y237-H465 WeakPolarHBondContact CE2-NE2 3.27Å; Y237-H465 AromaticContact CZ-CD2 3.29Å; Y237-H465 AromaticContact CZ-CE1 3.9Å; Y237-H465 AromaticContact CZ-CG 3.4Å; Y237-H465 VanDerWaalsContact CZ-CG 3.4Å; Y237-H465 AromaticContact CZ-ND1 3.81Å; Y237-H465 AromaticContact CZ-NE2 3.61Å; Y237-H465 PolarHBondContact OH-CD2 3.5Å; I240-H465 HydrophobicContact CD1-CB 3.82Å; L461-H465 VanDerWaalsContact O-CB 3.25Å; L461-H465 WeakPolarHBondContact O-CB 3.29Å; L461-H465 PolarHBondContact O-N 3.29Å; V463-H465 VanDerWaalsContact C-N 3.31Å; V463-H465 PolarHBondContact O-N 3.44Å; H465-V467 VanDerWaalsContact C-N 3.34Å; H465-A468 WeakPolarHBondContact O-CB 3.42Å; H465-A468 PolarHBondContact O-N 3.02Å; H465-V469 WeakPolarHBondContact O-CG2 3.17Å; H465-V469 PolarHBondContact O-N 3.24Å; H465-V469 VanDerWaalsContact O-N 3.11Å |
| 466 | T | 92 | Very high | 92 | Very high | 2 Ų | 2 | 2.8 Ų | 2.8 | 1% | 0.012 | 2% | 0.016 | C | C | . | . | H | α-helix | trans | -64.5 | -40.5 | 176.2 | -58.9 | 0 | 0 | 0 | 0 | 110.9 | L354 T462 V463 L464 A468 V469 V470 I528 T531 | L354-T466 HydrophobicContact CD1-CG2 4.43Å; L354-T466 HydrophobicContact CD2-CG2 3.85Å; T462-T466 WeakPolarHBondContact O-CB 3.42Å; T462-T466 PolarHBondContact O-N 2.99Å; T462-T466 PolarHBondContact O-OG1 3.43Å; V463-T466 WeakPolarHBondContact O-CA 3.39Å; V463-T466 WeakPolarHBondContact O-CB 3.39Å; V463-T466 PolarHBondContact O-N 3.04Å; L464-T466 VanDerWaalsContact C-N 3.32Å; T466-A468 PolarHBondContact O-N 3.32Å; T466-V469 PolarHBondContact O-N 3.44Å; T466-V470 HydrophobicContact CG2-CG2 3.89Å; T466-V470 VanDerWaalsContact O-CB 3.29Å; T466-V470 WeakPolarHBondContact O-CB 3.34Å; T466-V470 WeakPolarHBondContact O-CG2 3.48Å; T466-V470 PolarHBondContact O-N 3.38Å; T466-I528 HydrophobicContact CG2-CG2 4.11Å; T466-T531 HydrophobicContact CG2-CG2 4.05Å |
| 467 | V | 93.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 2.6 Ų | 2.6 | 0% | 0 | 2% | 0.015 | C | C | . | . | H | α-helix | trans | -56.6 | -49.3 | 170.9 | 175.9 | 0 | 0 | 0 | 0 | 110.5 | L354 V463 L464 H465 V469 V470 Y471 A479 F480 F483 | L354-V467 HydrophobicContact CD1-CG2 4.08Å; L354-V467 HydrophobicContact CD2-CG2 4.35Å; V463-V467 WeakPolarHBondContact O-CG2 3.45Å; V463-V467 PolarHBondContact O-N 2.98Å; L464-V467 WeakPolarHBondContact O-CB 3.49Å; L464-V467 PolarHBondContact O-N 2.71Å; H465-V467 VanDerWaalsContact C-N 3.34Å; V467-V469 VanDerWaalsContact C-N 3.27Å; V467-V469 PolarHBondContact O-N 2.78Å; V467-V470 PolarHBondContact O-N 2.91Å; V467-Y471 HydrophobicContact CB-CD2 4.47Å; V467-Y471 HydrophobicContact CG1-CD2 3.9Å; V467-Y471 HydrophobicContact CG1-CE2 4.32Å; V467-Y471 VanDerWaalsContact O-CD2 3.3Å; V467-Y471 WeakPolarHBondContact O-CD2 3.21Å; V467-Y471 PolarHBondContact O-N 3.44Å; V467-A479 HydrophobicContact CG1-CB 4.04Å; V467-F480 HydrophobicContact CB-CD1 4.47Å; V467-F480 HydrophobicContact CB-CE1 4.16Å; V467-F480 HydrophobicContact CG1-CD1 3.91Å; V467-F480 HydrophobicContact CG1-CE1 3.97Å; V467-F480 HydrophobicContact CG1-CG 4.29Å; V467-F480 HydrophobicContact CG1-CZ 4.43Å; V467-F483 HydrophobicContact CB-CD2 4.28Å; V467-F483 HydrophobicContact CG1-CD2 3.74Å; V467-F483 HydrophobicContact CG1-CE2 4.08Å; V467-F483 HydrophobicContact CG2-CD2 3.44Å; V467-F483 VanDerWaalsContact CG2-CD2 3.44Å; V467-F483 HydrophobicContact CG2-CE2 3.78Å; V467-F483 HydrophobicContact CG2-CG 4.02Å |
| 468 | A | 92.2 | Very high | 92.3 | Very high | 4 Ų | 4 | 2.7 Ų | 2.7 | 3% | 0.033 | 2% | 0.015 | C | C | . | . | H | α-helix | trans | -56.7 | -39.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | T228 I240 L464 H465 T466 R476 F480 L540 | T228-A468 HydrophobicContact CG2-CB 3.97Å; I240-A468 HydrophobicContact CD1-CB 4.21Å; L464-A468 PolarHBondContact O-N 2.72Å; H465-A468 WeakPolarHBondContact O-CB 3.42Å; H465-A468 PolarHBondContact O-N 3.02Å; T466-A468 PolarHBondContact O-N 3.32Å; A468-R476 PolarHBondContact O-NE 3.35Å; A468-F480 HydrophobicContact CB-CE2 4.46Å; A468-F480 HydrophobicContact CB-CZ 3.89Å; A468-L540 WeakPolarHBondContact O-CD2 3.46Å |
| 469 | V | 90 | Very high | 92.4 | Very high | 1 Ų | 1 | 2.3 Ų | 2.3 | 1% | 0.006 | 1% | 0.013 | C | C | . | . | H | α-helix | trans | -84.7 | -31.8 | -175.5 | 174.5 | 0 | 0 | 0 | 0 | 113 | H465 T466 V467 T531 P541 | H465-V469 WeakPolarHBondContact O-CG2 3.17Å; H465-V469 PolarHBondContact O-N 3.24Å; H465-V469 VanDerWaalsContact O-N 3.11Å; T466-V469 PolarHBondContact O-N 3.44Å; V467-V469 VanDerWaalsContact C-N 3.27Å; V467-V469 PolarHBondContact O-N 2.78Å; V469-T531 HydrophobicContact CB-CG2 4.12Å; V469-T531 HydrophobicContact CG1-CG2 3.94Å; V469-P541 WeakPolarHBondContact O-CD 3.38Å |
| 470 | V | 90.9 | Very high | 92.4 | Very high | 7 Ų | 7 | 2.3 Ų | 2.3 | 4% | 0.042 | 1% | 0.013 | C | C | . | . | H | α-helix | trans | -77.9 | -41.4 | -177.4 | 169.6 | 0 | 0 | 0 | 0 | 111.5 | L347 T466 V467 | L347-V470 HydrophobicContact CD1-CG1 3.75Å; T466-V470 HydrophobicContact CG2-CG2 3.89Å; T466-V470 VanDerWaalsContact O-CB 3.29Å; T466-V470 WeakPolarHBondContact O-CB 3.34Å; T466-V470 WeakPolarHBondContact O-CG2 3.48Å; T466-V470 PolarHBondContact O-N 3.38Å; V467-V470 PolarHBondContact O-N 2.91Å |
| 471 | Y | 92.2 | Very high | 92.4 | Very high | 0 Ų | 0 | 1.5 Ų | 1.5 | 0% | 0 | 1% | 0.009 | C | C | . | . | S | Bend | trans | -92.6 | 137 | -173.7 | -64.3 | -85.4 | 0 | 0 | 0 | 112.4 | L341 L347 T351 L354 V467 R476 A479 F483 | L341-Y471 HydrophobicContact CB-CE1 4.27Å; L341-Y471 HydrophobicContact CD2-CD1 3.57Å; L341-Y471 HydrophobicContact CD2-CE1 3.56Å; L347-Y471 HydrophobicContact CD1-CD1 3.85Å; L347-Y471 HydrophobicContact CD1-CE1 3.54Å; L347-Y471 HydrophobicContact CD2-CD1 4.43Å; L347-Y471 HydrophobicContact CD2-CE1 4.24Å; L347-Y471 HydrophobicContact CG-CD1 4.48Å; L347-Y471 HydrophobicContact CG-CE1 3.96Å; T351-Y471 VanDerWaalsContact CA-OH 3.24Å; T351-Y471 WeakPolarHBondContact CA-OH 3.41Å; T351-Y471 WeakPolarHBondContact CB-OH 3.49Å; T351-Y471 PolarHBondContact OG1-OH 3.27Å; L354-Y471 HydrophobicContact CD1-CE2 3.82Å; V467-Y471 HydrophobicContact CB-CD2 4.47Å; V467-Y471 HydrophobicContact CG1-CD2 3.9Å; V467-Y471 HydrophobicContact CG1-CE2 4.32Å; V467-Y471 VanDerWaalsContact O-CD2 3.3Å; V467-Y471 WeakPolarHBondContact O-CD2 3.21Å; V467-Y471 PolarHBondContact O-N 3.44Å; Y471-R476 PolarHBondContact O-NE 3.33Å; Y471-R476 PolarHBondContact O-NH2 3.25Å; Y471-A479 HydrophobicContact CD1-CB 3.87Å; Y471-A479 HydrophobicContact CD2-CB 3.71Å; Y471-A479 HydrophobicContact CE1-CB 4.41Å; Y471-A479 HydrophobicContact CE2-CB 4.3Å; Y471-A479 HydrophobicContact CG-CB 3.5Å; Y471-F483 HydrophobicContact CD2-CE2 4.25Å; Y471-F483 AromaticContact CE2-CE2 3.42Å; Y471-F483 HydrophobicContact CE2-CE2 3.42Å; Y471-F483 VanDerWaalsContact CE2-CE2 3.42Å; Y471-F483 AromaticContact CE2-CZ 3.93Å; Y471-F483 HydrophobicContact CE2-CZ 3.93Å; Y471-F483 AromaticContact CZ-CE2 3.69Å; Y471-F483 AromaticContact CZ-CZ 3.88Å; Y471-F483 VanDerWaalsContact OH-CZ 3.3Å; Y471-F483 WeakPolarHBondContact OH-CZ 3.43Å |
| 472 | P | 90.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 2.5 Ų | 2.5 | 0% | 0 | 1% | 0.013 | C | C | . | . | trans | -73.4 | 157.6 | -179.8 | 27.2 | -28.3 | 0 | 0 | 0 | 112 | V474 V475 R476 P541 T543 F544 L547 | P472-V474 HydrophobicContact CB-CG2 4.01Å; P472-V474 HydrophobicContact CG-CG2 3.85Å; P472-V474 PolarHBondContact O-N 3.13Å; P472-V474 VanDerWaalsContact O-N 3.11Å; P472-V475 HydrophobicContact CG-CG2 3.84Å; P472-V475 CarbonylContact O-C 3.56Å; P472-V475 PolarHBondContact O-N 3.25Å; P472-R476 WeakPolarHBondContact O-CB 3.38Å; P472-R476 PolarHBondContact O-N 2.72Å; P472-P541 CarbonylContact C-O 3.58Å; P472-P541 WeakPolarHBondContact CA-O 3.01Å; P472-P541 HydrophobicContact CB-CB 4.04Å; P472-P541 HydrophobicContact CB-CG 4.35Å; P472-T543 WeakPolarHBondContact CB-O 3.5Å; P472-F544 HydrophobicContact CG-CD1 4.21Å; P472-F544 HydrophobicContact CG-CD2 4.38Å; P472-F544 HydrophobicContact CG-CE1 4.15Å; P472-F544 HydrophobicContact CG-CE2 4.3Å; P472-F544 HydrophobicContact CG-CG 4.33Å; P472-F544 HydrophobicContact CG-CZ 4.19Å; P472-L547 HydrophobicContact CG-CD1 4.21Å | ||
| 473 | T | 89.9 | Confident | 92.8 | Very high | 0 Ų | 0 | 2.6 Ų | 2.6 | 0% | 0 | 1% | 0.014 | C | C | . | . | G | 310 helix | trans | -52 | -35.3 | -178.3 | -58.1 | 0 | 0 | 0 | 0 | 113.9 | E229 R288 W289 V292 V475 R476 P541 N542 | E229-T473 WeakPolarHBondContact OE1-CG2 3.37Å; R288-T473 HydrophobicContact CB-CG2 4.06Å; W289-T473 HydrophobicContact CB-CG2 4.38Å; V292-T473 HydrophobicContact CG2-CG2 4.33Å; T473-V475 PolarHBondContact O-N 3.3Å; T473-R476 PolarHBondContact OG1-NH1 3.48Å; T473-R476 PolarHBondContact OG1-NH2 3.15Å; T473-P541 PolarHBondContact N-O 3.2Å; T473-P541 PolarHBondContact OG1-O 2.62Å; T473-N542 PolarHBondContact N-O 2.9Å; T473-N542 PolarHBondContact OG1-OD1 2.97Å |
| 474 | V | 89.2 | Confident | 92.8 | Very high | 5 Ų | 5 | 2.6 Ų | 2.6 | 3% | 0.03 | 1% | 0.014 | C | C | . | . | G | 310 helix | trans | -58.9 | -26.3 | 176.7 | -71.7 | 0 | 0 | 0 | 0 | 115.2 | V292 D331 Y336 P472 N542 F544 | V292-V474 HydrophobicContact CG1-CG1 3.28Å; D331-V474 HydrophobicContact CB-CG1 4.31Å; Y336-V474 HydrophobicContact CD2-CB 3.97Å; Y336-V474 HydrophobicContact CE1-CG2 4.39Å; Y336-V474 HydrophobicContact CE2-CB 3.66Å; Y336-V474 HydrophobicContact CE2-CG1 3.83Å; Y336-V474 HydrophobicContact CE2-CG2 4.29Å; P472-V474 HydrophobicContact CB-CG2 4.01Å; P472-V474 HydrophobicContact CG-CG2 3.85Å; P472-V474 PolarHBondContact O-N 3.13Å; P472-V474 VanDerWaalsContact O-N 3.11Å; V474-N542 PolarHBondContact N-O 2.92Å; V474-F544 HydrophobicContact CG2-CD2 3.91Å; V474-F544 HydrophobicContact CG2-CE2 3.75Å |
| 475 | V | 92 | Very high | 93 | Very high | 0 Ų | 0 | 2.4 Ų | 2.4 | 0% | 0 | 1% | 0.013 | C | C | . | . | G | 310 helix | trans | -132.3 | 10.3 | -176.5 | -61.3 | 0 | 0 | 0 | 0 | 113.3 | D174 Y336 D340 L341 P472 T473 G477 I478 A479 F544 | D174-V475 WeakPolarHBondContact OD2-CA 3.37Å; Y336-V475 HydrophobicContact CD1-CG1 3.75Å; Y336-V475 HydrophobicContact CG-CG1 3.7Å; D340-V475 HydrophobicContact CB-CG1 4.34Å; L341-V475 HydrophobicContact CD2-CG2 4.44Å; P472-V475 HydrophobicContact CG-CG2 3.84Å; P472-V475 CarbonylContact O-C 3.56Å; P472-V475 PolarHBondContact O-N 3.25Å; T473-V475 PolarHBondContact O-N 3.3Å; V475-G477 VanDerWaalsContact C-N 3.35Å; V475-G477 PolarHBondContact O-N 2.72Å; V475-I478 PolarHBondContact O-N 2.81Å; V475-A479 WeakPolarHBondContact O-CB 3.3Å; V475-A479 PolarHBondContact O-N 2.83Å; V475-F544 HydrophobicContact CG1-CE2 3.91Å; V475-F544 HydrophobicContact CG1-CZ 3.94Å; V475-F544 HydrophobicContact CG2-CE2 4.32Å; V475-F544 HydrophobicContact CG2-CZ 3.83Å |
| 476 | R | 92.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 5.4 Ų | 5.4 | 0% | 0 | 3% | 0.026 | C | C | . | . | H | α-helix | trans | -65.6 | -38.7 | -174.1 | -173.8 | 176.9 | -64.4 | 106 | 8.1 | 111.6 | T225 E229 A468 Y471 P472 T473 A479 F480 P541 | T225-R476 HydrophobicContact CG2-CB 4.12Å; T225-R476 HydrophobicContact CG2-CG 4.16Å; E229-R476 IonicContact OE2-CZ 3.59Å; E229-R476 IonicContact OE2-NH1 3.87Å; E229-R476 PolarHBondContact OE2-NH1 3.49Å; A468-R476 PolarHBondContact O-NE 3.35Å; Y471-R476 PolarHBondContact O-NE 3.33Å; Y471-R476 PolarHBondContact O-NH2 3.25Å; P472-R476 WeakPolarHBondContact O-CB 3.38Å; P472-R476 PolarHBondContact O-N 2.72Å; T473-R476 PolarHBondContact OG1-NH1 3.48Å; T473-R476 PolarHBondContact OG1-NH2 3.15Å; R476-A479 PolarHBondContact O-N 2.84Å; R476-F480 HydrophobicContact CG-CD2 3.9Å; R476-F480 HydrophobicContact CG-CE2 3.72Å; R476-F480 VanDerWaalsContact O-CD2 3.3Å; R476-F480 WeakPolarHBondContact O-CD2 3.15Å; R476-F480 PolarHBondContact O-N 2.65Å; R476-P541 PolarHBondContact NH2-O 3.14Å |
| 477 | G | 93.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 6.3 Ų | 6.3 | 0% | 0 | 3% | 0.03 | C | C | . | . | H | α-helix | trans | -66.6 | -43.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | G170 D174 T221 T225 V475 A479 F480 G481 | G170-G477 VanDerWaalsContact CA-C 3.46Å; G170-G477 WeakPolarHBondContact CA-O 3.3Å; D174-G477 PolarHBondContact OD1-N 3.39Å; D174-G477 VanDerWaalsContact OD2-CA 3.27Å; D174-G477 WeakPolarHBondContact OD2-CA 3.47Å; D174-G477 PolarHBondContact OD2-N 2.88Å; T221-G477 WeakPolarHBondContact CG2-O 3.29Å; T225-G477 VanDerWaalsContact OG1-CA 3.24Å; T225-G477 WeakPolarHBondContact OG1-CA 3.4Å; V475-G477 VanDerWaalsContact C-N 3.35Å; V475-G477 PolarHBondContact O-N 2.72Å; G477-A479 VanDerWaalsContact C-N 3.29Å; G477-A479 PolarHBondContact O-N 3.2Å; G477-F480 PolarHBondContact O-N 3.2Å; G477-G481 PolarHBondContact O-N 3.31Å |
| 478 | I | 94.4 | Very high | 93.2 | Very high | 2 Ų | 2 | 6.4 Ų | 6.4 | 1% | 0.01 | 3% | 0.031 | C | C | . | . | H | α-helix | trans | -57.2 | -43 | 172.2 | -66.5 | 173.1 | 0 | 0 | 0 | 111 | D174 L338 L341 V475 G481 F482 | D174-I478 HydrophobicContact CB-CG1 4.46Å; D174-I478 PolarHBondContact OD2-N 3.42Å; L338-I478 HydrophobicContact CD2-CG2 3.48Å; L338-I478 VanDerWaalsContact CD2-CG2 3.48Å; L338-I478 HydrophobicContact CG-CG2 4.24Å; L341-I478 HydrophobicContact CD1-CG2 4.33Å; L341-I478 HydrophobicContact CG-CG2 4.49Å; V475-I478 PolarHBondContact O-N 2.81Å; I478-G481 PolarHBondContact O-N 2.8Å; I478-F482 VanDerWaalsContact O-CB 3.3Å; I478-F482 WeakPolarHBondContact O-CB 3.24Å; I478-F482 PolarHBondContact O-N 3.29Å |
| 479 | A | 95.2 | Very high | 93.3 | Very high | 0 Ų | 0 | 9.4 Ų | 9.4 | 0% | 0 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -63.9 | -50.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L341 V467 Y471 V475 R476 G477 G481 F482 F483 | L341-A479 HydrophobicContact CD2-CB 3.7Å; V467-A479 HydrophobicContact CG1-CB 4.04Å; Y471-A479 HydrophobicContact CD1-CB 3.87Å; Y471-A479 HydrophobicContact CD2-CB 3.71Å; Y471-A479 HydrophobicContact CE1-CB 4.41Å; Y471-A479 HydrophobicContact CE2-CB 4.3Å; Y471-A479 HydrophobicContact CG-CB 3.5Å; V475-A479 WeakPolarHBondContact O-CB 3.3Å; V475-A479 PolarHBondContact O-N 2.83Å; R476-A479 PolarHBondContact O-N 2.84Å; G477-A479 VanDerWaalsContact C-N 3.29Å; G477-A479 PolarHBondContact O-N 3.2Å; A479-G481 VanDerWaalsContact C-N 3.31Å; A479-G481 PolarHBondContact O-N 3.27Å; A479-F482 PolarHBondContact O-N 3.25Å; A479-F483 HydrophobicContact CB-CE2 4.42Å; A479-F483 WeakPolarHBondContact O-CD2 3.35Å; A479-F483 PolarHBondContact O-N 3.22Å |
| 480 | F | 94.5 | Very high | 93.5 | Very high | 0 Ų | 0 | 9.7 Ų | 9.7 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -56.9 | -46.7 | 175.5 | -83.9 | -59.1 | 0 | 0 | 0 | 111.7 | T221 M224 T228 L464 V467 A468 R476 G477 F482 F483 I484 | T221-F480 HydrophobicContact CG2-CB 4.12Å; M224-F480 HydrophobicContact CB-CD1 4.21Å; M224-F480 HydrophobicContact CB-CD2 4.1Å; M224-F480 HydrophobicContact CB-CE1 4.31Å; M224-F480 HydrophobicContact CB-CE2 4.18Å; M224-F480 HydrophobicContact CB-CG 4.11Å; M224-F480 HydrophobicContact CB-CZ 4.28Å; T228-F480 HydrophobicContact CG2-CE2 4.38Å; T228-F480 HydrophobicContact CG2-CZ 4.09Å; L464-F480 HydrophobicContact CB-CE1 4.29Å; L464-F480 HydrophobicContact CD2-CD1 4.12Å; L464-F480 HydrophobicContact CD2-CE1 4.12Å; V467-F480 HydrophobicContact CB-CD1 4.47Å; V467-F480 HydrophobicContact CB-CE1 4.16Å; V467-F480 HydrophobicContact CG1-CD1 3.91Å; V467-F480 HydrophobicContact CG1-CE1 3.97Å; V467-F480 HydrophobicContact CG1-CG 4.29Å; V467-F480 HydrophobicContact CG1-CZ 4.43Å; A468-F480 HydrophobicContact CB-CE2 4.46Å; A468-F480 HydrophobicContact CB-CZ 3.89Å; R476-F480 HydrophobicContact CG-CD2 3.9Å; R476-F480 HydrophobicContact CG-CE2 3.72Å; R476-F480 VanDerWaalsContact O-CD2 3.3Å; R476-F480 WeakPolarHBondContact O-CD2 3.15Å; R476-F480 PolarHBondContact O-N 2.65Å; G477-F480 PolarHBondContact O-N 3.2Å; F480-F482 PolarHBondContact O-N 2.75Å; F480-F483 PolarHBondContact O-N 3.15Å; F480-I484 WeakPolarHBondContact O-CB 3.3Å; F480-I484 WeakPolarHBondContact O-CD1 3.29Å; F480-I484 VanDerWaalsContact O-CG1 3.25Å; F480-I484 WeakPolarHBondContact O-CG1 3.25Å; F480-I484 PolarHBondContact O-N 2.95Å |
| 481 | G | 94.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 9.7 Ų | 9.7 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -56.9 | -48.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A166 G477 I478 A479 I484 S485 | A166-G481 VanDerWaalsContact O-CA 3.29Å; A166-G481 WeakPolarHBondContact O-CA 3.21Å; G477-G481 PolarHBondContact O-N 3.31Å; I478-G481 PolarHBondContact O-N 2.8Å; A479-G481 VanDerWaalsContact C-N 3.31Å; A479-G481 PolarHBondContact O-N 3.27Å; G481-I484 PolarHBondContact O-N 2.98Å; G481-S485 WeakPolarHBondContact O-CB 3.5Å; G481-S485 PolarHBondContact O-N 3.49Å; G481-S485 PolarHBondContact O-OG 3.45Å |
| 482 | F | 96.4 | Very high | 93.3 | Very high | 21 Ų | 21 | 10.5 Ų | 10.5 | 9% | 0.092 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -59.4 | -49 | 178.3 | -177.1 | -107.7 | 0 | 0 | 0 | 112.8 | L338 L341 F342 T351 L355 I478 A479 F480 S485 F486 | L338-F482 HydrophobicContact CD2-CB 3.88Å; L338-F482 HydrophobicContact CD2-CD2 3.73Å; L338-F482 HydrophobicContact CD2-CG 4.13Å; L341-F482 HydrophobicContact CD1-CB 3.75Å; L341-F482 HydrophobicContact CD1-CD1 3.7Å; L341-F482 HydrophobicContact CD1-CD2 4.26Å; L341-F482 HydrophobicContact CD1-CE1 4.31Å; L341-F482 HydrophobicContact CD1-CG 3.65Å; F342-F482 HydrophobicContact CE2-CZ 4.31Å; F342-F482 HydrophobicContact CZ-CZ 4.32Å; T351-F482 HydrophobicContact CG2-CE1 4.07Å; L355-F482 HydrophobicContact CD1-CE1 4.02Å; L355-F482 HydrophobicContact CD1-CZ 4.26Å; L355-F482 HydrophobicContact CD2-CD1 4.32Å; L355-F482 HydrophobicContact CD2-CE1 3.62Å; L355-F482 HydrophobicContact CD2-CZ 4.17Å; L355-F482 HydrophobicContact CG-CE1 4.06Å; I478-F482 VanDerWaalsContact O-CB 3.3Å; I478-F482 WeakPolarHBondContact O-CB 3.24Å; I478-F482 PolarHBondContact O-N 3.29Å; A479-F482 PolarHBondContact O-N 3.25Å; F480-F482 PolarHBondContact O-N 2.75Å; F482-S485 WeakPolarHBondContact O-CB 3.33Å; F482-S485 PolarHBondContact O-N 3.33Å; F482-F486 HydrophobicContact CD1-CD2 4.47Å; F482-F486 HydrophobicContact CD2-CD2 4.04Å; F482-F486 AromaticContact CD2-CE2 3.77Å; F482-F486 HydrophobicContact CD2-CE2 3.77Å; F482-F486 HydrophobicContact CE1-CD2 4.25Å; F482-F486 HydrophobicContact CE1-CE2 4.17Å; F482-F486 AromaticContact CE2-CD2 3.83Å; F482-F486 HydrophobicContact CE2-CD2 3.83Å; F482-F486 AromaticContact CE2-CE2 3.18Å; F482-F486 HydrophobicContact CE2-CE2 3.18Å; F482-F486 AromaticContact CE2-CZ 3.98Å; F482-F486 HydrophobicContact CE2-CZ 3.98Å; F482-F486 HydrophobicContact CG-CD2 4.38Å; F482-F486 HydrophobicContact CG-CE2 4.5Å; F482-F486 AromaticContact CZ-CD2 3.93Å; F482-F486 HydrophobicContact CZ-CD2 3.93Å; F482-F486 AromaticContact CZ-CE2 3.41Å; F482-F486 HydrophobicContact CZ-CE2 3.41Å; F482-F486 VanDerWaalsContact CZ-CE2 3.41Å; F482-F486 AromaticContact CZ-CZ 3.91Å; F482-F486 HydrophobicContact CZ-CZ 3.91Å; F482-F486 WeakPolarHBondContact O-CD2 3.5Å; F482-F486 PolarHBondContact O-N 3.44Å |
| 483 | F | 96.2 | Very high | 93.3 | Very high | 1 Ų | 1 | 15.7 Ų | 15.7 | 0% | 0.004 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -66.9 | -43.4 | -179.9 | -72.9 | -62.9 | 0 | 0 | 0 | 112.3 | T351 L354 L355 V358 V467 Y471 A479 F480 S485 F486 E487 | T351-F483 HydrophobicContact CG2-CZ 4.13Å; L354-F483 HydrophobicContact CB-CD1 4.13Å; L354-F483 HydrophobicContact CB-CE1 3.35Å; L354-F483 HydrophobicContact CB-CE2 4.46Å; L354-F483 HydrophobicContact CB-CZ 3.56Å; L354-F483 HydrophobicContact CD1-CE2 4.26Å; L354-F483 HydrophobicContact CD1-CZ 3.92Å; L354-F483 HydrophobicContact CG-CZ 4.4Å; L355-F483 HydrophobicContact CD2-CD1 4.17Å; L355-F483 HydrophobicContact CD2-CE1 4.1Å; L355-F483 HydrophobicContact CG-CE1 4.02Å; V358-F483 WeakPolarHBondContact CG1-O 3.36Å; V358-F483 HydrophobicContact CG2-CB 4.16Å; V358-F483 HydrophobicContact CG2-CD1 4.04Å; V358-F483 HydrophobicContact CG2-CG 4.45Å; V467-F483 HydrophobicContact CB-CD2 4.28Å; V467-F483 HydrophobicContact CG1-CD2 3.74Å; V467-F483 HydrophobicContact CG1-CE2 4.08Å; V467-F483 HydrophobicContact CG2-CD2 3.44Å; V467-F483 VanDerWaalsContact CG2-CD2 3.44Å; V467-F483 HydrophobicContact CG2-CE2 3.78Å; V467-F483 HydrophobicContact CG2-CG 4.02Å; Y471-F483 HydrophobicContact CD2-CE2 4.25Å; Y471-F483 AromaticContact CE2-CE2 3.42Å; Y471-F483 HydrophobicContact CE2-CE2 3.42Å; Y471-F483 VanDerWaalsContact CE2-CE2 3.42Å; Y471-F483 AromaticContact CE2-CZ 3.93Å; Y471-F483 HydrophobicContact CE2-CZ 3.93Å; Y471-F483 AromaticContact CZ-CE2 3.69Å; Y471-F483 AromaticContact CZ-CZ 3.88Å; Y471-F483 VanDerWaalsContact OH-CZ 3.3Å; Y471-F483 WeakPolarHBondContact OH-CZ 3.43Å; A479-F483 HydrophobicContact CB-CE2 4.42Å; A479-F483 WeakPolarHBondContact O-CD2 3.35Å; A479-F483 PolarHBondContact O-N 3.22Å; F480-F483 PolarHBondContact O-N 3.15Å; F483-S485 VanDerWaalsContact C-N 3.28Å; F483-S485 PolarHBondContact O-N 2.98Å; F483-F486 PolarHBondContact O-N 3.11Å; F483-E487 PolarHBondContact O-N 3.48Å |
| 484 | I | 93.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -60.2 | -41.7 | 175.8 | -68.2 | 166.5 | 0 | 0 | 0 | 110.5 | A166 Q220 F480 G481 F486 E487 D488 | A166-I484 HydrophobicContact CB-CB 4.41Å; A166-I484 HydrophobicContact CB-CG2 4.18Å; Q220-I484 HydrophobicContact CG-CD1 4.06Å; F480-I484 WeakPolarHBondContact O-CB 3.3Å; F480-I484 WeakPolarHBondContact O-CD1 3.29Å; F480-I484 VanDerWaalsContact O-CG1 3.25Å; F480-I484 WeakPolarHBondContact O-CG1 3.25Å; F480-I484 PolarHBondContact O-N 2.95Å; G481-I484 PolarHBondContact O-N 2.98Å; I484-F486 PolarHBondContact O-N 3.28Å; I484-E487 VanDerWaalsContact O-CB 3.26Å; I484-E487 WeakPolarHBondContact O-CB 3.48Å; I484-E487 PolarHBondContact O-N 2.8Å; I484-E487 VanDerWaalsContact O-N 3.17Å; I484-D488 PolarHBondContact O-N 2.86Å |
| 485 | S | 96 | Very high | 93.1 | Very high | 4 Ų | 4 | 16.6 Ų | 16.6 | 3% | 0.028 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -61.4 | -41.1 | 175.8 | -67.3 | 0 | 0 | 0 | 0 | 113.1 | I163 A166 I167 G481 F482 F483 E487 D488 L489 | I163-S485 PolarHBondContact O-OG 3.44Å; A166-S485 WeakPolarHBondContact CB-OG 3.36Å; I167-S485 WeakPolarHBondContact CG1-OG 3.18Å; G481-S485 WeakPolarHBondContact O-CB 3.5Å; G481-S485 PolarHBondContact O-N 3.49Å; G481-S485 PolarHBondContact O-OG 3.45Å; F482-S485 WeakPolarHBondContact O-CB 3.33Å; F482-S485 PolarHBondContact O-N 3.33Å; F483-S485 VanDerWaalsContact C-N 3.28Å; F483-S485 PolarHBondContact O-N 2.98Å; S485-E487 VanDerWaalsContact C-N 3.32Å; S485-D488 PolarHBondContact O-N 3.25Å; S485-L489 VanDerWaalsContact O-CB 3.27Å; S485-L489 WeakPolarHBondContact O-CB 3.2Å; S485-L489 PolarHBondContact O-N 3.18Å |
| 486 | F | 95.5 | Very high | 92.7 | Very high | 66 Ų | 66 | 18.4 Ų | 18.4 | 29% | 0.289 | 10% | 0.098 | S | C | . | . | H | α-helix | trans | -70.6 | -29.1 | 175.7 | -89.4 | -100.8 | 0 | 0 | 0 | 112.5 | L355 F482 F483 I484 G490 | L355-F486 HydrophobicContact CD2-CB 3.78Å; L355-F486 HydrophobicContact CD2-CD1 3.55Å; L355-F486 HydrophobicContact CD2-CD2 3.92Å; L355-F486 HydrophobicContact CD2-CE1 4.06Å; L355-F486 HydrophobicContact CD2-CE2 4.42Å; L355-F486 HydrophobicContact CD2-CG 3.44Å; L355-F486 VanDerWaalsContact CD2-CG 3.44Å; L355-F486 HydrophobicContact CD2-CZ 4.47Å; F482-F486 HydrophobicContact CD1-CD2 4.47Å; F482-F486 HydrophobicContact CD2-CD2 4.04Å; F482-F486 AromaticContact CD2-CE2 3.77Å; F482-F486 HydrophobicContact CD2-CE2 3.77Å; F482-F486 HydrophobicContact CE1-CD2 4.25Å; F482-F486 HydrophobicContact CE1-CE2 4.17Å; F482-F486 AromaticContact CE2-CD2 3.83Å; F482-F486 HydrophobicContact CE2-CD2 3.83Å; F482-F486 AromaticContact CE2-CE2 3.18Å; F482-F486 HydrophobicContact CE2-CE2 3.18Å; F482-F486 AromaticContact CE2-CZ 3.98Å; F482-F486 HydrophobicContact CE2-CZ 3.98Å; F482-F486 HydrophobicContact CG-CD2 4.38Å; F482-F486 HydrophobicContact CG-CE2 4.5Å; F482-F486 AromaticContact CZ-CD2 3.93Å; F482-F486 HydrophobicContact CZ-CD2 3.93Å; F482-F486 AromaticContact CZ-CE2 3.41Å; F482-F486 HydrophobicContact CZ-CE2 3.41Å; F482-F486 VanDerWaalsContact CZ-CE2 3.41Å; F482-F486 AromaticContact CZ-CZ 3.91Å; F482-F486 HydrophobicContact CZ-CZ 3.91Å; F482-F486 WeakPolarHBondContact O-CD2 3.5Å; F482-F486 PolarHBondContact O-N 3.44Å; F483-F486 PolarHBondContact O-N 3.11Å; I484-F486 PolarHBondContact O-N 3.28Å; F486-G490 PolarHBondContact O-N 3.26Å |
| 487 | E | 94.6 | Very high | 92.3 | Very high | 21 Ų | 21 | 22.6 Ų | 22.6 | 10% | 0.098 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -61.8 | -49.8 | 171.8 | -161.7 | -178.1 | 147.8 | 0 | 0 | 110.8 | V358 S362 H460 F483 I484 S485 G490 T491 | V358-E487 HydrophobicContact CG1-CB 3.34Å; V358-E487 HydrophobicContact CG1-CG 3.84Å; V358-E487 VanDerWaalsContact CG1-N 3.26Å; S362-E487 WeakPolarHBondContact CB-O 3.42Å; S362-E487 VanDerWaalsContact OG-C 3.32Å; S362-E487 VanDerWaalsContact OG-CA 3.29Å; S362-E487 WeakPolarHBondContact OG-CA 3.18Å; S362-E487 PolarHBondContact OG-O 3.44Å; H460-E487 IonicContact CD2-OE1 3.14Å; H460-E487 IonicContact CD2-OE2 3.59Å; H460-E487 IonicContact CE1-OE2 3.7Å; H460-E487 IonicContact NE2-OE1 2.72Å; H460-E487 PolarHBondContact NE2-OE1 2.96Å; H460-E487 IonicContact NE2-OE2 3.47Å; H460-E487 PolarHBondContact NE2-OE2 3.44Å; F483-E487 PolarHBondContact O-N 3.48Å; I484-E487 VanDerWaalsContact O-CB 3.26Å; I484-E487 WeakPolarHBondContact O-CB 3.48Å; I484-E487 PolarHBondContact O-N 2.8Å; I484-E487 VanDerWaalsContact O-N 3.17Å; S485-E487 VanDerWaalsContact C-N 3.32Å; E487-G490 PolarHBondContact O-N 3.36Å; E487-T491 PolarHBondContact O-N 3.03Å; E487-T491 PolarHBondContact O-OG1 2.79Å |
| 488 | D | 93.4 | Very high | 91.7 | Very high | 3 Ų | 3 | 22.8 Ų | 22.8 | 2% | 0.016 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -69.8 | -38.3 | -179.9 | -73.6 | -23.1 | 0 | 0 | 0 | 111.1 | L159 R162 I163 I484 S485 G490 T491 I492 | L159-D488 HydrophobicContact CD2-CB 4.24Å; R162-D488 VanDerWaalsContact CB-OD2 3.24Å; R162-D488 WeakPolarHBondContact CB-OD2 3.37Å; R162-D488 IonicContact CZ-OD1 2.65Å; R162-D488 IonicContact CZ-OD2 2.83Å; R162-D488 IonicContact NE-OD2 2.81Å; R162-D488 PolarHBondContact NE-OD2 2.9Å; R162-D488 IonicContact NH1-OD1 3.31Å; R162-D488 PolarHBondContact NH1-OD1 3.15Å; R162-D488 IonicContact NH1-OD2 3.12Å; R162-D488 PolarHBondContact NH1-OD2 3.23Å; R162-D488 IonicContact NH2-OD1 3.44Å; R162-D488 IonicContact NH2-OD2 3.15Å; I163-D488 HydrophobicContact CD1-CB 4.12Å; I163-D488 HydrophobicContact CG1-CB 3.69Å; I484-D488 PolarHBondContact O-N 2.86Å; S485-D488 PolarHBondContact O-N 3.25Å; D488-G490 PolarHBondContact O-N 3.37Å; D488-T491 WeakPolarHBondContact O-CB 3.39Å; D488-T491 PolarHBondContact O-N 3.44Å; D488-T491 VanDerWaalsContact O-N 3.14Å; D488-I492 WeakPolarHBondContact O-CG1 3.32Å; D488-I492 PolarHBondContact O-N 3.4Å |
| 489 | L | 94.4 | Very high | 90.8 | Very high | 67 Ų | 67 | 24.8 Ų | 24.8 | 35% | 0.351 | 13% | 0.13 | S | C | . | . | H | α-helix | trans | -62 | -44 | 174.6 | -177.9 | 62.7 | 0 | 0 | 0 | 111.6 | I163 S485 T491 I492 L493 | I163-L489 HydrophobicContact CD1-CB 4Å; I163-L489 HydrophobicContact CD1-CD1 4.47Å; S485-L489 VanDerWaalsContact O-CB 3.27Å; S485-L489 WeakPolarHBondContact O-CB 3.2Å; S485-L489 PolarHBondContact O-N 3.18Å; L489-T491 VanDerWaalsContact C-N 3.27Å; L489-T491 PolarHBondContact O-N 2.61Å; L489-I492 PolarHBondContact O-N 2.97Å; L489-L493 HydrophobicContact CD1-CD1 4.15Å; L489-L493 HydrophobicContact CD1-CG 4.29Å; L489-L493 HydrophobicContact CG-CD1 4.07Å; L489-L493 WeakPolarHBondContact O-CG 3.5Å; L489-L493 PolarHBondContact O-N 3.05Å |
| 490 | G | 92.6 | Very high | 90.1 | Very high | 7 Ų | 7 | 29.9 Ų | 29.9 | 7% | 0.072 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60 | -40.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | F486 E487 D488 I492 L493 I494 | F486-G490 PolarHBondContact O-N 3.26Å; E487-G490 PolarHBondContact O-N 3.36Å; D488-G490 PolarHBondContact O-N 3.37Å; G490-I492 PolarHBondContact O-N 3.1Å; G490-L493 PolarHBondContact O-N 3.05Å; G490-I494 WeakPolarHBondContact O-CB 3.19Å; G490-I494 VanDerWaalsContact O-CG1 3.3Å; G490-I494 WeakPolarHBondContact O-CG1 3.35Å; G490-I494 PolarHBondContact O-N 3.01Å |
| 491 | T | 90.3 | Very high | 89.3 | Confident | 6 Ų | 6 | 31.7 Ų | 31.7 | 4% | 0.037 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -65.7 | -39.8 | 179.2 | -57.5 | 0 | 0 | 0 | 0 | 111.2 | L159 E487 D488 L489 G495 | L159-T491 HydrophobicContact CD1-CG2 4.13Å; E487-T491 PolarHBondContact O-N 3.03Å; E487-T491 PolarHBondContact O-OG1 2.79Å; D488-T491 WeakPolarHBondContact O-CB 3.39Å; D488-T491 PolarHBondContact O-N 3.44Å; D488-T491 VanDerWaalsContact O-N 3.14Å; L489-T491 VanDerWaalsContact C-N 3.27Å; L489-T491 PolarHBondContact O-N 2.61Å; T491-G495 VanDerWaalsContact O-CA 3.29Å; T491-G495 WeakPolarHBondContact O-CA 3.28Å; T491-G495 PolarHBondContact O-N 3.38Å |
| 492 | I | 89.9 | Confident | 88.3 | Confident | 18 Ų | 18 | 32.7 Ų | 32.7 | 9% | 0.092 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64 | -53.9 | 174.8 | -65 | 165.2 | 0 | 0 | 0 | 110.7 | I156 L159 V160 I163 D488 L489 G490 S496 | I156-I492 HydrophobicContact CG1-CG2 4.22Å; L159-I492 HydrophobicContact CB-CD1 3.72Å; L159-I492 HydrophobicContact CB-CG1 3.83Å; L159-I492 HydrophobicContact CD1-CG1 3.72Å; L159-I492 HydrophobicContact CG-CG1 4.44Å; V160-I492 HydrophobicContact CG2-CD1 3.88Å; I163-I492 HydrophobicContact CD1-CD1 3.79Å; D488-I492 WeakPolarHBondContact O-CG1 3.32Å; D488-I492 PolarHBondContact O-N 3.4Å; L489-I492 PolarHBondContact O-N 2.97Å; G490-I492 PolarHBondContact O-N 3.1Å; I492-S496 WeakPolarHBondContact O-CB 3.47Å; I492-S496 PolarHBondContact O-N 2.91Å; I492-S496 PolarHBondContact O-OG 3.04Å |
| 493 | L | 90.9 | Very high | 86.9 | Confident | 108 Ų | 108 | 39 Ų | 39 | 57% | 0.565 | 19% | 0.192 | S | C | * | . | H | α-helix | trans | -69.5 | -49 | -172 | -67.4 | 175.5 | 0 | 0 | 0 | 112 | L489 G490 L497 | L489-L493 HydrophobicContact CD1-CD1 4.15Å; L489-L493 HydrophobicContact CD1-CG 4.29Å; L489-L493 HydrophobicContact CG-CD1 4.07Å; L489-L493 WeakPolarHBondContact O-CG 3.5Å; L489-L493 PolarHBondContact O-N 3.05Å; G490-L493 PolarHBondContact O-N 3.05Å; L493-L497 WeakPolarHBondContact O-CB 3.49Å; L493-L497 PolarHBondContact O-N 3.42Å; L493-L497 VanDerWaalsContact O-N 3.09Å |
| 494 | I | 88.7 | Confident | 85.8 | Confident | 24 Ų | 24 | 44 Ų | 44 | 12% | 0.123 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -70.1 | -41 | 179.8 | -59.5 | 175 | 0 | 0 | 0 | 109.7 | I359 A363 A366 G490 S496 L497 I498 | I359-I494 HydrophobicContact CG2-CD1 3.98Å; A363-I494 HydrophobicContact CB-CD1 3.79Å; A363-I494 HydrophobicContact CB-CG2 4.43Å; A366-I494 HydrophobicContact CB-CB 4.42Å; A366-I494 HydrophobicContact CB-CG2 4.07Å; G490-I494 WeakPolarHBondContact O-CB 3.19Å; G490-I494 VanDerWaalsContact O-CG1 3.3Å; G490-I494 WeakPolarHBondContact O-CG1 3.35Å; G490-I494 PolarHBondContact O-N 3.01Å; I494-S496 PolarHBondContact O-N 3.49Å; I494-L497 PolarHBondContact O-N 3.34Å; I494-I498 HydrophobicContact CG2-CD1 3.58Å; I494-I498 HydrophobicContact CG2-CG1 3.97Å; I494-I498 WeakPolarHBondContact O-CB 3.12Å; I494-I498 VanDerWaalsContact O-CG1 3.22Å; I494-I498 WeakPolarHBondContact O-CG1 3.12Å; I494-I498 PolarHBondContact O-N 2.84Å |
| 495 | G | 85 | Confident | 85 | Confident | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -58.4 | -47 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | T491 L497 I498 E499 | T491-G495 VanDerWaalsContact O-CA 3.29Å; T491-G495 WeakPolarHBondContact O-CA 3.28Å; T491-G495 PolarHBondContact O-N 3.38Å; G495-L497 VanDerWaalsContact C-N 3.34Å; G495-L497 PolarHBondContact O-N 3.18Å; G495-I498 PolarHBondContact O-N 3.44Å; G495-E499 PolarHBondContact O-N 3.26Å |
| 496 | S | 83.8 | Confident | 84 | Confident | 39 Ų | 39 | 53.6 Ų | 53.6 | 27% | 0.273 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -59.5 | -44.8 | 175.8 | -52.9 | 0 | 0 | 0 | 0 | 111.7 | F152 I492 I494 E499 E500 | F152-S496 WeakPolarHBondContact CE1-OG 3.24Å; F152-S496 WeakPolarHBondContact CZ-OG 3.39Å; I492-S496 WeakPolarHBondContact O-CB 3.47Å; I492-S496 PolarHBondContact O-N 2.91Å; I492-S496 PolarHBondContact O-OG 3.04Å; I494-S496 PolarHBondContact O-N 3.49Å; S496-E499 PolarHBondContact O-N 3.06Å; S496-E500 PolarHBondContact O-N 3.36Å |
| 497 | L | 85.1 | Confident | 83.4 | Confident | 87 Ų | 87 | 51.5 Ų | 51.5 | 46% | 0.455 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -65.1 | -43.8 | -179.6 | -177.2 | 64.6 | 0 | 0 | 0 | 111.4 | L493 I494 G495 I501 I512 | L493-L497 WeakPolarHBondContact O-CB 3.49Å; L493-L497 PolarHBondContact O-N 3.42Å; L493-L497 VanDerWaalsContact O-N 3.09Å; I494-L497 PolarHBondContact O-N 3.34Å; G495-L497 VanDerWaalsContact C-N 3.34Å; G495-L497 PolarHBondContact O-N 3.18Å; L497-I501 HydrophobicContact CD1-CD1 3.62Å; L497-I501 HydrophobicContact CD1-CG1 4.2Å; L497-I501 HydrophobicContact CD2-CD1 4.44Å; L497-I501 HydrophobicContact CG-CD1 3.71Å; L497-I501 HydrophobicContact CG-CG1 4.5Å; L497-I501 WeakPolarHBondContact O-CB 3.43Å; L497-I501 VanDerWaalsContact O-CG1 3.23Å; L497-I501 WeakPolarHBondContact O-CG1 3.09Å; L497-I501 PolarHBondContact O-N 3.26Å; L497-I512 HydrophobicContact CD2-CD1 4.44Å |
| 498 | I | 80.3 | Confident | 83 | Confident | 5 Ų | 5 | 53.9 Ų | 53.9 | 3% | 0.026 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.4 | -42.8 | 178 | -70.4 | -178.7 | 0 | 0 | 0 | 110.4 | A366 F370 I494 G495 E500 I501 T502 P509 V513 | A366-I498 HydrophobicContact CB-CD1 4.08Å; F370-I498 HydrophobicContact CB-CG2 4.34Å; I494-I498 HydrophobicContact CG2-CD1 3.58Å; I494-I498 HydrophobicContact CG2-CG1 3.97Å; I494-I498 WeakPolarHBondContact O-CB 3.12Å; I494-I498 VanDerWaalsContact O-CG1 3.22Å; I494-I498 WeakPolarHBondContact O-CG1 3.12Å; I494-I498 PolarHBondContact O-N 2.84Å; G495-I498 PolarHBondContact O-N 3.44Å; I498-E500 PolarHBondContact O-N 3.42Å; I498-I501 PolarHBondContact O-N 2.74Å; I498-T502 WeakPolarHBondContact O-CB 3.35Å; I498-T502 PolarHBondContact O-N 3.3Å; I498-T502 PolarHBondContact O-OG1 3.21Å; I498-P509 HydrophobicContact CB-CB 4.43Å; I498-P509 HydrophobicContact CD1-CB 4.34Å; I498-P509 HydrophobicContact CG1-CB 3.97Å; I498-P509 HydrophobicContact CG2-CB 3.98Å; I498-P509 HydrophobicContact CG2-CG 4.18Å; I498-V513 HydrophobicContact CD1-CG2 4.3Å |
| 499 | E | 75.8 | Confident | 82.6 | Confident | 43 Ų | 43 | 53.9 Ų | 53.9 | 20% | 0.201 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59.3 | -47.6 | -179.8 | -171.7 | -178.4 | 162.8 | 0 | 0 | 111.8 | G495 S496 R503 | G495-E499 PolarHBondContact O-N 3.26Å; S496-E499 PolarHBondContact O-N 3.06Å; E499-R503 IonicContact OE1-NH2 3.53Å; E499-R503 PolarHBondContact OE1-NH2 3.29Å |
| 500 | E | 79.1 | Confident | 82.2 | Confident | 108 Ų | 108 | 51 Ų | 51 | 51% | 0.505 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -69.8 | -41.4 | -179.7 | -71 | -58.3 | 144.1 | 0 | 0 | 112.4 | S496 I498 R503 | S496-E500 PolarHBondContact O-N 3.36Å; I498-E500 PolarHBondContact O-N 3.42Å; E500-R503 VanDerWaalsContact CD-NH1 3.33Å; E500-R503 IonicContact OE1-CZ 2.73Å; E500-R503 IonicContact OE1-NH1 2.95Å; E500-R503 PolarHBondContact OE1-NH1 3.23Å; E500-R503 IonicContact OE1-NH2 3.29Å; E500-R503 IonicContact OE2-NH1 2.96Å; E500-R503 PolarHBondContact OE2-NH1 2.91Å; E500-R503 VanDerWaalsContact OE2-NH1 3.14Å |
| 501 | I | 79.1 | Confident | 82.1 | Confident | 38 Ų | 38 | 54 Ų | 54 | 20% | 0.195 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -70.1 | -38 | 179.8 | -67 | 176.8 | 0 | 0 | 0 | 111.6 | L497 I498 R503 V504 W505 I508 P509 I512 | L497-I501 HydrophobicContact CD1-CD1 3.62Å; L497-I501 HydrophobicContact CD1-CG1 4.2Å; L497-I501 HydrophobicContact CD2-CD1 4.44Å; L497-I501 HydrophobicContact CG-CD1 3.71Å; L497-I501 HydrophobicContact CG-CG1 4.5Å; L497-I501 WeakPolarHBondContact O-CB 3.43Å; L497-I501 VanDerWaalsContact O-CG1 3.23Å; L497-I501 WeakPolarHBondContact O-CG1 3.09Å; L497-I501 PolarHBondContact O-N 3.26Å; I498-I501 PolarHBondContact O-N 2.74Å; I501-R503 PolarHBondContact O-N 3.05Å; I501-V504 PolarHBondContact O-N 3.49Å; I501-W505 PolarHBondContact O-N 2.8Å; I501-I508 HydrophobicContact CD1-CG2 4.31Å; I501-I508 HydrophobicContact CG2-CB 3.64Å; I501-I508 HydrophobicContact CG2-CD1 4.27Å; I501-I508 HydrophobicContact CG2-CG1 4.49Å; I501-I508 HydrophobicContact CG2-CG2 3.74Å; I501-P509 HydrophobicContact CB-CG 4.34Å; I501-P509 HydrophobicContact CG2-CG 3.97Å; I501-I512 HydrophobicContact CD1-CD1 4.12Å |
| 502 | T | 72.5 | Confident | 82 | Confident | 21 Ų | 21 | 56.3 Ų | 56.3 | 13% | 0.129 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.2 | -30.7 | -178.3 | -61.7 | 0 | 0 | 0 | 0 | 111.9 | F370 I498 V504 | F370-T502 HydrophobicContact CD2-CG2 3.47Å; F370-T502 VanDerWaalsContact CD2-CG2 3.47Å; F370-T502 HydrophobicContact CE2-CG2 3.82Å; I498-T502 WeakPolarHBondContact O-CB 3.35Å; I498-T502 PolarHBondContact O-N 3.3Å; I498-T502 PolarHBondContact O-OG1 3.21Å; T502-V504 PolarHBondContact O-N 3.46Å |
| 503 | R | 68.2 | Low | 82.1 | Confident | 153 Ų | 153 | 55.5 Ų | 55.5 | 58% | 0.577 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.2 | -26.8 | 174.1 | -67.4 | 178.2 | -172.3 | 157.3 | 6.2 | 112.9 | E499 E500 I501 | E499-R503 IonicContact OE1-NH2 3.53Å; E499-R503 PolarHBondContact OE1-NH2 3.29Å; E500-R503 VanDerWaalsContact CD-NH1 3.33Å; E500-R503 IonicContact OE1-CZ 2.73Å; E500-R503 IonicContact OE1-NH1 2.95Å; E500-R503 PolarHBondContact OE1-NH1 3.23Å; E500-R503 IonicContact OE1-NH2 3.29Å; E500-R503 IonicContact OE2-NH1 2.96Å; E500-R503 PolarHBondContact OE2-NH1 2.91Å; E500-R503 VanDerWaalsContact OE2-NH1 3.14Å; I501-R503 PolarHBondContact O-N 3.05Å |
| 504 | V | 73.9 | Confident | 82.2 | Confident | 107 Ų | 107 | 52 Ų | 52 | 65% | 0.648 | 26% | 0.259 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.9 | -51.6 | -177.3 | -164.9 | 0 | 0 | 0 | 0 | 111.3 | I501 T502 | I501-V504 PolarHBondContact O-N 3.49Å; T502-V504 PolarHBondContact O-N 3.46Å |
| 505 | W | 76 | Confident | 82.4 | Confident | 169 Ų | 169 | 55.4 Ų | 55.4 | 64% | 0.64 | 28% | 0.276 | S | S | * | . | trans | -144.5 | 109.5 | -177.8 | -73.5 | 96 | 0 | 0 | 0 | 112 | I501 V507 I508 P509 | I501-W505 PolarHBondContact O-N 2.8Å; W505-V507 PolarHBondContact O-N 3.31Å; W505-I508 HydrophobicContact CB-CD1 3.64Å; W505-I508 HydrophobicContact CB-CG1 3.85Å; W505-I508 HydrophobicContact CG-CD1 4.09Å; W505-I508 PolarHBondContact O-N 3.03Å; W505-P509 VanDerWaalsContact O-CD 3.28Å; W505-P509 WeakPolarHBondContact O-CD 3.45Å | ||
| 506 | A | 74.7 | Confident | 82.8 | Confident | 36 Ų | 36 | 56.9 Ų | 56.9 | 30% | 0.298 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -25.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | F370 L432 | F370-A506 HydrophobicContact CE2-CB 3.52Å; F370-A506 WeakPolarHBondContact CE2-O 3.45Å; F370-A506 HydrophobicContact CZ-CB 3.85Å; L432-A506 HydrophobicContact CD2-CB 4.32Å |
| 507 | V | 83.6 | Confident | 83.4 | Confident | 22 Ų | 22 | 55 Ų | 55 | 13% | 0.133 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -77.1 | -35.9 | -175.5 | -179.2 | 0 | 0 | 0 | 0 | 112.2 | T429 L432 L433 W505 C510 I511 | T429-V507 HydrophobicContact CG2-CG1 4.43Å; L432-V507 HydrophobicContact CB-CG2 3.84Å; L433-V507 HydrophobicContact CD2-CG1 3.7Å; L433-V507 HydrophobicContact CD2-CG2 4.41Å; L433-V507 HydrophobicContact CG-CG1 3.93Å; W505-V507 PolarHBondContact O-N 3.31Å; V507-C510 PolarHBondContact O-N 3.45Å; V507-I511 HydrophobicContact CG1-CD1 3.73Å; V507-I511 HydrophobicContact CG1-CG1 4.16Å; V507-I511 PolarHBondContact O-N 3.44Å |
| 508 | I | 85.8 | Confident | 83.9 | Confident | 71 Ų | 71 | 54 Ų | 54 | 36% | 0.364 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.3 | -44.8 | -170.6 | -62 | 176.7 | 0 | 0 | 0 | 112.2 | I501 W505 C510 I511 I512 | I501-I508 HydrophobicContact CD1-CG2 4.31Å; I501-I508 HydrophobicContact CG2-CB 3.64Å; I501-I508 HydrophobicContact CG2-CD1 4.27Å; I501-I508 HydrophobicContact CG2-CG1 4.49Å; I501-I508 HydrophobicContact CG2-CG2 3.74Å; W505-I508 HydrophobicContact CB-CD1 3.64Å; W505-I508 HydrophobicContact CB-CG1 3.85Å; W505-I508 HydrophobicContact CG-CD1 4.09Å; W505-I508 PolarHBondContact O-N 3.03Å; I508-C510 VanDerWaalsContact C-N 3.32Å; I508-C510 PolarHBondContact O-N 3.06Å; I508-I511 PolarHBondContact O-N 2.84Å; I508-I512 HydrophobicContact CG2-CD1 3.88Å; I508-I512 HydrophobicContact CG2-CG1 4.36Å; I508-I512 WeakPolarHBondContact O-CG1 3.3Å; I508-I512 PolarHBondContact O-N 3.33Å |
| 509 | P | 84.6 | Confident | 84.6 | Confident | 3 Ų | 3 | 58 Ų | 58 | 2% | 0.019 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -54.7 | -43.6 | 175.1 | -31.4 | 40.2 | 0 | 0 | 0 | 113.7 | I498 I501 W505 I511 I512 V513 | I498-P509 HydrophobicContact CB-CB 4.43Å; I498-P509 HydrophobicContact CD1-CB 4.34Å; I498-P509 HydrophobicContact CG1-CB 3.97Å; I498-P509 HydrophobicContact CG2-CB 3.98Å; I498-P509 HydrophobicContact CG2-CG 4.18Å; I501-P509 HydrophobicContact CB-CG 4.34Å; I501-P509 HydrophobicContact CG2-CG 3.97Å; W505-P509 VanDerWaalsContact O-CD 3.28Å; W505-P509 WeakPolarHBondContact O-CD 3.45Å; P509-I511 VanDerWaalsContact C-N 3.34Å; P509-I511 PolarHBondContact O-N 3.15Å; P509-I512 PolarHBondContact O-N 2.75Å; P509-V513 VanDerWaalsContact O-CG2 3.31Å; P509-V513 WeakPolarHBondContact O-CG2 3.45Å; P509-V513 PolarHBondContact O-N 3.25Å |
| 510 | C | 86.8 | Confident | 85.6 | Confident | 6 Ų | 6 | 56 Ų | 56 | 4% | 0.041 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.2 | -40 | 179 | -67 | 0 | 0 | 0 | 0 | 111.6 | T429 L432 V507 I508 V513 E514 | T429-C510 WeakPolarHBondContact OG1-CB 3.46Å; L432-C510 HydrophobicContact CD1-CB 4.2Å; L432-C510 WeakPolarHBondContact CD1-SG 3.39Å; V507-C510 PolarHBondContact O-N 3.45Å; I508-C510 VanDerWaalsContact C-N 3.32Å; I508-C510 PolarHBondContact O-N 3.06Å; C510-V513 PolarHBondContact O-N 3.44Å; C510-E514 VanDerWaalsContact O-CB 3.32Å; C510-E514 WeakPolarHBondContact O-CB 3.39Å; C510-E514 PolarHBondContact O-N 2.9Å |
| 511 | I | 89.5 | Confident | 86.4 | Confident | 70 Ų | 70 | 52.7 Ų | 52.7 | 36% | 0.359 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 175.3 | -65.1 | 174.2 | 0 | 0 | 0 | 111 | T429 V507 I508 P509 E514 I515 | T429-I511 HydrophobicContact CG2-CG1 3.89Å; V507-I511 HydrophobicContact CG1-CD1 3.73Å; V507-I511 HydrophobicContact CG1-CG1 4.16Å; V507-I511 PolarHBondContact O-N 3.44Å; I508-I511 PolarHBondContact O-N 2.84Å; P509-I511 VanDerWaalsContact C-N 3.34Å; P509-I511 PolarHBondContact O-N 3.15Å; I511-E514 WeakPolarHBondContact O-CB 3.21Å; I511-E514 PolarHBondContact O-N 3.41Å; I511-I515 HydrophobicContact CG2-CD1 3.82Å; I511-I515 HydrophobicContact CG2-CG1 4.41Å; I511-I515 VanDerWaalsContact O-CG1 3.27Å; I511-I515 WeakPolarHBondContact O-CG1 3.45Å; I511-I515 PolarHBondContact O-N 2.89Å |
| 512 | I | 89.6 | Confident | 87.1 | Confident | 55 Ų | 55 | 54.4 Ų | 54.4 | 28% | 0.282 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.8 | -46.7 | 177.7 | -66.6 | 169 | 0 | 0 | 0 | 110.4 | L497 I501 I508 P509 E514 I515 V516 | L497-I512 HydrophobicContact CD2-CD1 4.44Å; I501-I512 HydrophobicContact CD1-CD1 4.12Å; I508-I512 HydrophobicContact CG2-CD1 3.88Å; I508-I512 HydrophobicContact CG2-CG1 4.36Å; I508-I512 WeakPolarHBondContact O-CG1 3.3Å; I508-I512 PolarHBondContact O-N 3.33Å; P509-I512 PolarHBondContact O-N 2.75Å; I512-E514 VanDerWaalsContact C-N 3.34Å; I512-E514 PolarHBondContact O-N 3.31Å; I512-I515 PolarHBondContact O-N 3.23Å; I512-V516 WeakPolarHBondContact O-CG2 3.34Å; I512-V516 PolarHBondContact O-N 2.86Å |
| 513 | V | 91.1 | Very high | 88.2 | Confident | 1 Ų | 1 | 54.8 Ų | 54.8 | 1% | 0.006 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.8 | -44.2 | 177.2 | 174.5 | 0 | 0 | 0 | 0 | 110.7 | A363 V364 F425 I498 P509 C510 I515 V516 L517 | A363-V513 HydrophobicContact CB-CG1 4.41Å; A363-V513 HydrophobicContact CB-CG2 4.19Å; V364-V513 HydrophobicContact CG2-CG1 4.26Å; F425-V513 HydrophobicContact CD1-CB 4.38Å; F425-V513 HydrophobicContact CD1-CG1 3.91Å; F425-V513 HydrophobicContact CD2-CG1 4.31Å; F425-V513 HydrophobicContact CE1-CB 4.33Å; F425-V513 HydrophobicContact CE1-CG1 3.73Å; F425-V513 HydrophobicContact CE2-CG1 4.17Å; F425-V513 HydrophobicContact CG-CG1 4.21Å; F425-V513 HydrophobicContact CZ-CG1 3.87Å; I498-V513 HydrophobicContact CD1-CG2 4.3Å; P509-V513 VanDerWaalsContact O-CG2 3.31Å; P509-V513 WeakPolarHBondContact O-CG2 3.45Å; P509-V513 PolarHBondContact O-N 3.25Å; C510-V513 PolarHBondContact O-N 3.44Å; V513-I515 PolarHBondContact O-N 3.01Å; V513-V516 PolarHBondContact O-N 2.79Å; V513-L517 HydrophobicContact CG1-CD1 3.81Å; V513-L517 HydrophobicContact CG1-CG 4.26Å; V513-L517 VanDerWaalsContact O-CG 3.27Å; V513-L517 WeakPolarHBondContact O-CG 3.49Å; V513-L517 PolarHBondContact O-N 3.47Å |
| 514 | E | 92.2 | Very high | 89.3 | Confident | 35 Ų | 35 | 47.5 Ų | 47.5 | 16% | 0.164 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -58.8 | -47.4 | 177.3 | -169.9 | 71.3 | -176.9 | 0 | 0 | 111.8 | I422 F425 A426 C510 I511 I512 V516 L517 V518 | I422-E514 VanDerWaalsContact CG2-OE1 3.28Å; I422-E514 WeakPolarHBondContact CG2-OE1 3.41Å; F425-E514 WeakPolarHBondContact CB-OE2 3.31Å; A426-E514 PolarHBondContact N-OE2 3.39Å; C510-E514 VanDerWaalsContact O-CB 3.32Å; C510-E514 WeakPolarHBondContact O-CB 3.39Å; C510-E514 PolarHBondContact O-N 2.9Å; I511-E514 WeakPolarHBondContact O-CB 3.21Å; I511-E514 PolarHBondContact O-N 3.41Å; I512-E514 VanDerWaalsContact C-N 3.34Å; I512-E514 PolarHBondContact O-N 3.31Å; E514-V516 VanDerWaalsContact C-N 3.34Å; E514-V516 PolarHBondContact O-N 2.91Å; E514-L517 PolarHBondContact O-N 3.45Å; E514-V518 WeakPolarHBondContact O-CG2 3.4Å; E514-V518 PolarHBondContact O-N 3.28Å |
| 515 | I | 93.8 | Very high | 90.1 | Very high | 94 Ų | 94 | 45.6 Ų | 45.6 | 48% | 0.482 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -59.9 | -46.3 | 177.7 | -69.5 | 166 | 0 | 0 | 0 | 110.5 | I511 I512 V513 L517 V518 I519 | I511-I515 HydrophobicContact CG2-CD1 3.82Å; I511-I515 HydrophobicContact CG2-CG1 4.41Å; I511-I515 VanDerWaalsContact O-CG1 3.27Å; I511-I515 WeakPolarHBondContact O-CG1 3.45Å; I511-I515 PolarHBondContact O-N 2.89Å; I512-I515 PolarHBondContact O-N 3.23Å; V513-I515 PolarHBondContact O-N 3.01Å; I515-L517 VanDerWaalsContact C-N 3.35Å; I515-L517 PolarHBondContact O-N 2.91Å; I515-V518 PolarHBondContact O-N 2.96Å; I515-I519 HydrophobicContact CG2-CD1 3.75Å; I515-I519 HydrophobicContact CG2-CG1 4.47Å; I515-I519 WeakPolarHBondContact O-CB 3.38Å; I515-I519 VanDerWaalsContact O-CG1 3.27Å; I515-I519 WeakPolarHBondContact O-CG1 3.47Å; I515-I519 PolarHBondContact O-N 2.96Å |
| 516 | V | 94.2 | Very high | 90.7 | Very high | 32 Ų | 32 | 47 Ų | 47 | 19% | 0.194 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.5 | -45.9 | 177.9 | 171.8 | 0 | 0 | 0 | 0 | 110.4 | A363 I512 V513 E514 V518 I519 T520 | A363-V516 HydrophobicContact CB-CG1 4.4Å; I512-V516 WeakPolarHBondContact O-CG2 3.34Å; I512-V516 PolarHBondContact O-N 2.86Å; V513-V516 PolarHBondContact O-N 2.79Å; E514-V516 VanDerWaalsContact C-N 3.34Å; E514-V516 PolarHBondContact O-N 2.91Å; V516-V518 PolarHBondContact O-N 3.35Å; V516-I519 PolarHBondContact O-N 3.41Å; V516-T520 WeakPolarHBondContact O-CB 3.27Å; V516-T520 PolarHBondContact O-N 3.33Å; V516-T520 PolarHBondContact O-OG1 3.08Å |
| 517 | L | 95.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.8 | -41.7 | 179.6 | -69.8 | 169 | 0 | 0 | 0 | 112.7 | V364 L418 T421 I422 F425 V513 E514 I515 T520 L521 | V364-L517 HydrophobicContact CG2-CD1 4.12Å; V364-L517 HydrophobicContact CG2-CD2 3.8Å; V364-L517 HydrophobicContact CG2-CG 4.36Å; L418-L517 HydrophobicContact CD1-CB 4.46Å; L418-L517 HydrophobicContact CD1-CD2 3.65Å; T421-L517 HydrophobicContact CG2-CD1 3.92Å; T421-L517 HydrophobicContact CG2-CD2 4.24Å; I422-L517 HydrophobicContact CD1-CB 4.18Å; I422-L517 HydrophobicContact CG1-CB 3.57Å; I422-L517 HydrophobicContact CG1-CD1 4.34Å; I422-L517 HydrophobicContact CG1-CG 4.5Å; F425-L517 HydrophobicContact CD2-CD1 3.73Å; F425-L517 HydrophobicContact CE2-CD1 4.25Å; F425-L517 HydrophobicContact CG-CD1 4.27Å; V513-L517 HydrophobicContact CG1-CD1 3.81Å; V513-L517 HydrophobicContact CG1-CG 4.26Å; V513-L517 VanDerWaalsContact O-CG 3.27Å; V513-L517 WeakPolarHBondContact O-CG 3.49Å; V513-L517 PolarHBondContact O-N 3.47Å; E514-L517 PolarHBondContact O-N 3.45Å; I515-L517 VanDerWaalsContact C-N 3.35Å; I515-L517 PolarHBondContact O-N 2.91Å; L517-T520 WeakPolarHBondContact O-CB 3.31Å; L517-T520 PolarHBondContact O-N 3.47Å; L517-L521 PolarHBondContact O-N 3.09Å |
| 518 | V | 96.1 | Very high | 91.4 | Very high | 65 Ų | 65 | 50.1 Ų | 50.1 | 39% | 0.394 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65.2 | -44.1 | 177.4 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | I422 E514 I515 V516 T520 L521 V522 | I422-V518 HydrophobicContact CD1-CG2 4.4Å; I422-V518 HydrophobicContact CG2-CG2 4.26Å; E514-V518 WeakPolarHBondContact O-CG2 3.4Å; E514-V518 PolarHBondContact O-N 3.28Å; I515-V518 PolarHBondContact O-N 2.96Å; V516-V518 PolarHBondContact O-N 3.35Å; V518-T520 VanDerWaalsContact C-N 3.3Å; V518-T520 PolarHBondContact O-N 3.48Å; V518-L521 WeakPolarHBondContact O-CB 3.38Å; V518-L521 PolarHBondContact O-N 2.94Å; V518-V522 WeakPolarHBondContact O-CG2 3.22Å; V518-V522 PolarHBondContact O-N 3.42Å; V518-V522 VanDerWaalsContact O-N 3.08Å |
| 519 | I | 95.9 | Very high | 91.2 | Very high | 89 Ų | 89 | 49 Ų | 49 | 46% | 0.456 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -58.6 | -46.6 | 174.1 | -70.1 | 167.9 | 0 | 0 | 0 | 109.8 | V356 I515 V516 L521 V522 V523 | V356-I519 HydrophobicContact CG1-CG2 4.37Å; I515-I519 HydrophobicContact CG2-CD1 3.75Å; I515-I519 HydrophobicContact CG2-CG1 4.47Å; I515-I519 WeakPolarHBondContact O-CB 3.38Å; I515-I519 VanDerWaalsContact O-CG1 3.27Å; I515-I519 WeakPolarHBondContact O-CG1 3.47Å; I515-I519 PolarHBondContact O-N 2.96Å; V516-I519 PolarHBondContact O-N 3.41Å; I519-L521 VanDerWaalsContact C-N 3.29Å; I519-L521 PolarHBondContact O-N 3.29Å; I519-V522 PolarHBondContact O-N 3.26Å; I519-V523 HydrophobicContact CG2-CG2 4.26Å; I519-V523 WeakPolarHBondContact O-CB 3.43Å; I519-V523 VanDerWaalsContact O-CG2 3.3Å; I519-V523 WeakPolarHBondContact O-CG2 3.19Å; I519-V523 PolarHBondContact O-N 3.27Å |
| 520 | T | 95.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.7 | -38.1 | 177.5 | -59.6 | 0 | 0 | 0 | 0 | 112.4 | V356 S360 L418 Y459 V516 L517 V518 V523 S524 | V356-T520 HydrophobicContact CG1-CG2 4.28Å; V356-T520 WeakPolarHBondContact CG1-OG1 3.37Å; V356-T520 PolarHBondContact O-OG1 2.98Å; S360-T520 WeakPolarHBondContact CB-OG1 3.22Å; L418-T520 HydrophobicContact CD1-CG2 4.48Å; L418-T520 HydrophobicContact CD2-CG2 3.91Å; Y459-T520 WeakPolarHBondContact OH-CG2 3.47Å; V516-T520 WeakPolarHBondContact O-CB 3.27Å; V516-T520 PolarHBondContact O-N 3.33Å; V516-T520 PolarHBondContact O-OG1 3.08Å; L517-T520 WeakPolarHBondContact O-CB 3.31Å; L517-T520 PolarHBondContact O-N 3.47Å; V518-T520 VanDerWaalsContact C-N 3.3Å; V518-T520 PolarHBondContact O-N 3.48Å; T520-V523 PolarHBondContact O-N 2.84Å; T520-S524 WeakPolarHBondContact O-CB 3.23Å; T520-S524 PolarHBondContact O-N 2.83Å; T520-S524 PolarHBondContact O-OG 2.86Å |
| 521 | L | 95.3 | Very high | 91 | Very high | 40 Ų | 40 | 50.5 Ų | 50.5 | 21% | 0.209 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -63.4 | -47.5 | 178.1 | -178.4 | 69.6 | 0 | 0 | 0 | 110.7 | L415 L418 I422 L517 V518 I519 S524 I525 | L415-L521 HydrophobicContact CD2-CD1 3.77Å; L418-L521 HydrophobicContact CB-CD1 4.34Å; L418-L521 VanDerWaalsContact CD2-CA 3.41Å; L418-L521 HydrophobicContact CD2-CB 3.78Å; L418-L521 HydrophobicContact CD2-CD1 3.82Å; L418-L521 HydrophobicContact CD2-CG 4.44Å; L418-L521 HydrophobicContact CG-CB 4.21Å; L418-L521 HydrophobicContact CG-CD1 4.06Å; I422-L521 HydrophobicContact CD1-CB 3.89Å; I422-L521 HydrophobicContact CD1-CD2 3.79Å; I422-L521 HydrophobicContact CD1-CG 4.33Å; L517-L521 PolarHBondContact O-N 3.09Å; V518-L521 WeakPolarHBondContact O-CB 3.38Å; V518-L521 PolarHBondContact O-N 2.94Å; I519-L521 VanDerWaalsContact C-N 3.29Å; I519-L521 PolarHBondContact O-N 3.29Å; L521-S524 PolarHBondContact O-N 3.23Å; L521-I525 HydrophobicContact CD1-CD1 4.44Å; L521-I525 HydrophobicContact CG-CD1 4.17Å; L521-I525 VanDerWaalsContact O-CG1 3.26Å; L521-I525 WeakPolarHBondContact O-CG1 3.47Å; L521-I525 PolarHBondContact O-N 3.21Å |
| 522 | V | 95.2 | Very high | 90.4 | Very high | 73 Ų | 73 | 47.8 Ų | 47.8 | 44% | 0.442 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -60 | -52.5 | 176.6 | 176.1 | 0 | 0 | 0 | 0 | 109.9 | V518 I519 S524 I525 W526 | V518-V522 WeakPolarHBondContact O-CG2 3.22Å; V518-V522 PolarHBondContact O-N 3.42Å; V518-V522 VanDerWaalsContact O-N 3.08Å; I519-V522 PolarHBondContact O-N 3.26Å; V522-S524 VanDerWaalsContact C-N 3.29Å; V522-S524 PolarHBondContact O-N 3.28Å; V522-I525 PolarHBondContact O-N 3.17Å; V522-I525 VanDerWaalsContact O-N 3.16Å; V522-W526 PolarHBondContact O-N 3.31Å |
| 523 | V | 94.1 | Very high | 89.6 | Confident | 30 Ų | 30 | 48.6 Ų | 48.6 | 18% | 0.182 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -57.7 | -41.9 | 179.6 | 170.8 | 0 | 0 | 0 | 0 | 111.6 | A353 I519 T520 I525 W526 Y527 | A353-V523 HydrophobicContact CB-CG1 3.61Å; I519-V523 HydrophobicContact CG2-CG2 4.26Å; I519-V523 WeakPolarHBondContact O-CB 3.43Å; I519-V523 VanDerWaalsContact O-CG2 3.3Å; I519-V523 WeakPolarHBondContact O-CG2 3.19Å; I519-V523 PolarHBondContact O-N 3.27Å; T520-V523 PolarHBondContact O-N 2.84Å; V523-I525 PolarHBondContact O-N 3.42Å; V523-W526 PolarHBondContact O-N 3.33Å; V523-Y527 HydrophobicContact CG1-CD2 4.01Å; V523-Y527 WeakPolarHBondContact O-CB 3.14Å; V523-Y527 WeakPolarHBondContact O-CD2 3.32Å; V523-Y527 PolarHBondContact O-N 2.91Å |
| 524 | S | 91.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -65.3 | -36.3 | 179.6 | -63.8 | 0 | 0 | 0 | 0 | 112.9 | T520 L521 V522 W526 I528 | T520-S524 WeakPolarHBondContact O-CB 3.23Å; T520-S524 PolarHBondContact O-N 2.83Å; T520-S524 PolarHBondContact O-OG 2.86Å; L521-S524 PolarHBondContact O-N 3.23Å; V522-S524 VanDerWaalsContact C-N 3.29Å; V522-S524 PolarHBondContact O-N 3.28Å; S524-W526 VanDerWaalsContact C-N 3.33Å; S524-W526 PolarHBondContact O-N 3.27Å; S524-I528 WeakPolarHBondContact O-CB 3.42Å; S524-I528 PolarHBondContact O-N 2.61Å; S524-I528 WeakPolarHBondContact OG-CD1 3.48Å |
| 525 | I | 91 | Very high | 87 | Confident | 67 Ų | 67 | 53.1 Ų | 53.1 | 34% | 0.344 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.9 | -38.1 | 176.6 | -70.8 | 166.8 | 0 | 0 | 0 | 111.3 | R411 L415 L521 V522 V523 | R411-I525 PolarHBondContact NH1-O 3.28Å; R411-I525 PolarHBondContact NH2-O 3.19Å; L415-I525 HydrophobicContact CD1-CG1 4.07Å; L415-I525 HydrophobicContact CD2-CD1 4.46Å; L415-I525 HydrophobicContact CD2-CG1 3.57Å; L415-I525 HydrophobicContact CG-CG1 4.49Å; L521-I525 HydrophobicContact CD1-CD1 4.44Å; L521-I525 HydrophobicContact CG-CD1 4.17Å; L521-I525 VanDerWaalsContact O-CG1 3.26Å; L521-I525 WeakPolarHBondContact O-CG1 3.47Å; L521-I525 PolarHBondContact O-N 3.21Å; V522-I525 PolarHBondContact O-N 3.17Å; V522-I525 VanDerWaalsContact O-N 3.16Å; V523-I525 PolarHBondContact O-N 3.42Å |
| 526 | W | 87.9 | Confident | 86 | Confident | 198 Ų | 198 | 51.2 Ų | 51.2 | 75% | 0.75 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -88.7 | -38.8 | -174.4 | -67 | 105.3 | 0 | 0 | 0 | 113.6 | V522 V523 S524 | V522-W526 PolarHBondContact O-N 3.31Å; V523-W526 PolarHBondContact O-N 3.33Å; S524-W526 VanDerWaalsContact C-N 3.33Å; S524-W526 PolarHBondContact O-N 3.27Å |
| 527 | Y | 87.9 | Confident | 85.2 | Confident | 118 Ų | 118 | 57.7 Ų | 57.7 | 46% | 0.463 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -109.3 | -23.4 | -166.7 | -65.3 | -77 | 0 | 0 | 0 | 114.9 | M349 A353 V523 P529 | M349-Y527 HydrophobicContact CB-CD1 3.99Å; M349-Y527 HydrophobicContact CB-CE1 4.27Å; M349-Y527 HydrophobicContact CG-CE1 4.29Å; M349-Y527 HydrophobicContact SD-CD1 4.37Å; M349-Y527 HydrophobicContact SD-CE1 3.91Å; A353-Y527 HydrophobicContact CB-CG 4.47Å; V523-Y527 HydrophobicContact CG1-CD2 4.01Å; V523-Y527 WeakPolarHBondContact O-CB 3.14Å; V523-Y527 WeakPolarHBondContact O-CD2 3.32Å; V523-Y527 PolarHBondContact O-N 2.91Å; Y527-P529 VanDerWaalsContact O-CD 3.3Å; Y527-P529 WeakPolarHBondContact O-CD 3.32Å |
| 528 | I | 85.7 | Confident | 84.2 | Confident | 5 Ų | 5 | 61 Ų | 61 | 3% | 0.026 | 30% | 0.298 | C | S | . | . | P | Polyproline II helix | trans | -83.5 | 116.3 | -179.3 | -62.9 | 179.9 | 0 | 0 | 0 | 109.5 | A353 L414 T466 S524 | A353-I528 HydrophobicContact CB-CG1 4.3Å; L414-I528 HydrophobicContact CD1-CD1 3.93Å; L414-I528 HydrophobicContact CD1-CG2 4.49Å; L414-I528 HydrophobicContact CD2-CD1 4.23Å; T466-I528 HydrophobicContact CG2-CG2 4.11Å; S524-I528 WeakPolarHBondContact O-CB 3.42Å; S524-I528 PolarHBondContact O-N 2.61Å; S524-I528 WeakPolarHBondContact OG-CD1 3.48Å |
| 529 | P | 81.8 | Confident | 83.5 | Confident | 47 Ų | 47 | 61.5 Ų | 61.5 | 31% | 0.305 | 30% | 0.298 | S | S | . | . | P | Polyproline II helix | trans | -73.6 | 160.3 | 177.5 | 31.9 | -35 | 0 | 0 | 0 | 111.1 | Y527 T531 | Y527-P529 VanDerWaalsContact O-CD 3.3Å; Y527-P529 WeakPolarHBondContact O-CD 3.32Å; P529-T531 HydrophobicContact CG-CG2 4.41Å; P529-T531 PolarHBondContact O-N 3.09Å |
| 530 | E | 84.8 | Confident | 82.9 | Confident | 40 Ų | 40 | 57.5 Ų | 57.5 | 19% | 0.187 | 28% | 0.277 | C | S | . | . | P | Polyproline II helix | trans | -66.5 | 126.4 | 165.5 | -178.2 | 51 | -112.8 | 0 | 0 | 109.4 | G409 C410 R411 H412 K532 M535 T536 | G409-E530 VanDerWaalsContact CA-CD 3.47Å; G409-E530 WeakPolarHBondContact CA-OE1 3.45Å; G409-E530 WeakPolarHBondContact CA-OE2 3.17Å; C410-E530 WeakPolarHBondContact CB-OE1 3.49Å; C410-E530 PolarHBondContact N-OE1 3.2Å; C410-E530 PolarHBondContact N-OE2 3.02Å; R411-E530 VanDerWaalsContact CB-OE2 3.31Å; R411-E530 WeakPolarHBondContact CB-OE2 3.5Å; R411-E530 PolarHBondContact N-OE2 3.47Å; H412-E530 IonicContact ND1-OE2 3.44Å; H412-E530 PolarHBondContact ND1-OE2 3.2Å; E530-K532 WeakPolarHBondContact OE1-CB 3.48Å; E530-K532 PolarHBondContact OE1-N 3.31Å; E530-M535 VanDerWaalsContact CD-CE 3.41Å; E530-M535 HydrophobicContact CG-CE 3.63Å; E530-T536 HydrophobicContact CB-CG2 4.46Å; E530-T536 HydrophobicContact CG-CG2 4.26Å; E530-T536 WeakPolarHBondContact O-CG2 3.37Å |
| 531 | T | 82.7 | Confident | 82.5 | Confident | 1 Ų | 1 | 57.8 Ų | 57.8 | 1% | 0.006 | 28% | 0.279 | C | S | . | . | trans | -111.1 | -2.1 | -174.5 | 49.1 | 0 | 0 | 0 | 0 | 113.4 | C410 T466 V469 P529 Y533 | C410-T531 WeakPolarHBondContact CB-OG1 3.42Å; T466-T531 HydrophobicContact CG2-CG2 4.05Å; V469-T531 HydrophobicContact CB-CG2 4.12Å; V469-T531 HydrophobicContact CG1-CG2 3.94Å; P529-T531 HydrophobicContact CG-CG2 4.41Å; P529-T531 PolarHBondContact O-N 3.09Å; T531-Y533 PolarHBondContact O-N 3.45Å | ||
| 532 | K | 77.4 | Confident | 82 | Confident | 14 Ų | 14 | 57.1 Ų | 57.1 | 6% | 0.061 | 28% | 0.276 | C | S | . | . | trans | -65.1 | 121.7 | -178.3 | -167.9 | 162.8 | -174.5 | 170.7 | 0 | 111.5 | S402 V405 T406 L408 C410 E530 A534 M535 T536 | S402-K532 WeakPolarHBondContact O-CE 3.47Å; S402-K532 PolarHBondContact O-NZ 3.34Å; V405-K532 PolarHBondContact O-NZ 3.08Å; T406-K532 PolarHBondContact O-NZ 3.24Å; L408-K532 WeakPolarHBondContact O-CD 3.4Å; L408-K532 WeakPolarHBondContact O-CE 3.49Å; L408-K532 PolarHBondContact O-NZ 3.22Å; C410-K532 WeakPolarHBondContact SG-CA 3.4Å; C410-K532 WeakPolarHBondContact SG-CB 3.38Å; C410-K532 PolarHBondContact SG-N 2.98Å; E530-K532 WeakPolarHBondContact OE1-CB 3.48Å; E530-K532 PolarHBondContact OE1-N 3.31Å; K532-A534 VanDerWaalsContact C-N 3.33Å; K532-A534 HydrophobicContact CG-CB 4.21Å; K532-A534 PolarHBondContact O-N 2.89Å; K532-M535 HydrophobicContact CB-CB 4.4Å; K532-M535 HydrophobicContact CB-CE 3.91Å; K532-M535 HydrophobicContact CD-CE 4.13Å; K532-M535 HydrophobicContact CD-CG 4.5Å; K532-M535 PolarHBondContact O-N 3.42Å; K532-M535 VanDerWaalsContact O-N 3.15Å; K532-T536 PolarHBondContact O-N 3.21Å; K532-T536 PolarHBondContact O-OG1 3.06Å | ||
| 533 | Y | 71 | Confident | 81.5 | Confident | 72 Ų | 72 | 54.5 Ų | 54.5 | 28% | 0.282 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -55.8 | -45.6 | 176.7 | -179.1 | -100.7 | 0 | 0 | 0 | 112.4 | T531 M535 T536 K537 R538 L539 | T531-Y533 PolarHBondContact O-N 3.45Å; Y533-M535 PolarHBondContact O-N 3.4Å; Y533-M535 VanDerWaalsContact O-N 3.12Å; Y533-T536 PolarHBondContact O-N 3.44Å; Y533-K537 VanDerWaalsContact O-CA 3.23Å; Y533-K537 WeakPolarHBondContact O-CA 3.48Å; Y533-K537 PolarHBondContact O-N 2.59Å; Y533-R538 WeakPolarHBondContact CD2-O 3.49Å; Y533-L539 HydrophobicContact CE2-CD2 3.87Å |
| 534 | A | 64.7 | Low | 81 | Confident | 53 Ų | 53 | 54.2 Ų | 54.2 | 44% | 0.438 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.1 | -24.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | K532 | K532-A534 VanDerWaalsContact C-N 3.33Å; K532-A534 HydrophobicContact CG-CB 4.21Å; K532-A534 PolarHBondContact O-N 2.89Å |
| 535 | M | 64 | Low | 80.4 | Confident | 77 Ų | 77 | 57.2 Ų | 57.2 | 38% | 0.379 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -99 | -38.5 | 179.1 | -70.7 | -160.5 | -70.7 | 0 | 0 | 113.1 | T406 K407 E530 K532 Y533 | T406-M535 WeakPolarHBondContact O-CG 3.34Å; K407-M535 VanDerWaalsContact O-SD 3.37Å; E530-M535 VanDerWaalsContact CD-CE 3.41Å; E530-M535 HydrophobicContact CG-CE 3.63Å; K532-M535 HydrophobicContact CB-CB 4.4Å; K532-M535 HydrophobicContact CB-CE 3.91Å; K532-M535 HydrophobicContact CD-CE 4.13Å; K532-M535 HydrophobicContact CD-CG 4.5Å; K532-M535 PolarHBondContact O-N 3.42Å; K532-M535 VanDerWaalsContact O-N 3.15Å; Y533-M535 PolarHBondContact O-N 3.4Å; Y533-M535 VanDerWaalsContact O-N 3.12Å |
| 536 | T | 74.6 | Confident | 79.8 | Confident | 55 Ų | 55 | 58 Ų | 58 | 34% | 0.337 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -91.6 | -22.2 | -175.9 | 58.1 | 0 | 0 | 0 | 0 | 113.5 | E530 K532 Y533 R538 | E530-T536 HydrophobicContact CB-CG2 4.46Å; E530-T536 HydrophobicContact CG-CG2 4.26Å; E530-T536 WeakPolarHBondContact O-CG2 3.37Å; K532-T536 PolarHBondContact O-N 3.21Å; K532-T536 PolarHBondContact O-OG1 3.06Å; Y533-T536 PolarHBondContact O-N 3.44Å; T536-R538 PolarHBondContact O-N 2.95Å; T536-R538 WeakPolarHBondContact OG1-CB 3.38Å; T536-R538 PolarHBondContact OG1-N 2.89Å |
| 537 | K | 76.1 | Confident | 79.2 | Confident | 167 Ų | 167 | 50.4 Ų | 50.4 | 73% | 0.726 | 26% | 0.26 | S | S | * | . | trans | 50.4 | 20.3 | -164.1 | -60.7 | -175.4 | 177.3 | -178.1 | 0 | 113.5 | Y533 L539 | Y533-K537 VanDerWaalsContact O-CA 3.23Å; Y533-K537 WeakPolarHBondContact O-CA 3.48Å; Y533-K537 PolarHBondContact O-N 2.59Å; K537-L539 PolarHBondContact O-N 3.1Å | ||
| 538 | R | 75.6 | Confident | 78.2 | Confident | 69 Ų | 69 | 55.3 Ų | 55.3 | 26% | 0.26 | 29% | 0.287 | S | S | . | . | P | Polyproline II helix | trans | -74.7 | 120.1 | -174.6 | -171.9 | 175.8 | -179 | -162.9 | -5.2 | 110.6 | R236 Y533 T536 | R236-R538 PolarHBondContact NH1-O 3.33Å; R236-R538 PolarHBondContact NH2-O 3.15Å; Y533-R538 WeakPolarHBondContact CD2-O 3.49Å; T536-R538 PolarHBondContact O-N 2.95Å; T536-R538 WeakPolarHBondContact OG1-CB 3.38Å; T536-R538 PolarHBondContact OG1-N 2.89Å |
| 539 | L | 81.2 | Confident | 77.8 | Confident | 76 Ų | 76 | 57.8 Ų | 57.8 | 40% | 0.398 | 30% | 0.3 | S | S | . | . | P | Polyproline II helix | trans | -71.4 | 159.6 | 173.5 | -55.6 | 178.4 | 0 | 0 | 0 | 111 | E54 Y533 K537 | E54-L539 HydrophobicContact CB-CD2 4.31Å; E54-L539 HydrophobicContact CG-CD1 4.49Å; E54-L539 HydrophobicContact CG-CD2 3.64Å; E54-L539 HydrophobicContact CG-CG 4.42Å; Y533-L539 HydrophobicContact CE2-CD2 3.87Å; K537-L539 PolarHBondContact O-N 3.1Å |
| 540 | L | 83.5 | Confident | 77.6 | Confident | 5 Ų | 5 | 58.4 Ų | 58.4 | 3% | 0.026 | 30% | 0.3 | C | S | . | . | P | Polyproline II helix | trans | -68.6 | 126.2 | 173.9 | -84.7 | 130.1 | 0 | 0 | 0 | 108.3 | R236 A468 N542 | R236-L540 HydrophobicContact CG-CD1 4.43Å; R236-L540 VanDerWaalsContact NE-CD1 3.26Å; A468-L540 WeakPolarHBondContact O-CD2 3.46Å; L540-N542 PolarHBondContact O-N 3.15Å |
| 541 | P | 86.1 | Confident | 77.2 | Confident | 6 Ų | 6 | 59.4 Ų | 59.4 | 4% | 0.039 | 31% | 0.306 | C | S | . | . | P | Polyproline II helix | trans | -66.6 | 136 | 176 | 26.9 | -30.5 | 0 | 0 | 0 | 109.2 | V469 P472 T473 R476 D546 L547 | V469-P541 WeakPolarHBondContact O-CD 3.38Å; P472-P541 CarbonylContact C-O 3.58Å; P472-P541 WeakPolarHBondContact CA-O 3.01Å; P472-P541 HydrophobicContact CB-CB 4.04Å; P472-P541 HydrophobicContact CB-CG 4.35Å; T473-P541 PolarHBondContact N-O 3.2Å; T473-P541 PolarHBondContact OG1-O 2.62Å; R476-P541 PolarHBondContact NH2-O 3.14Å; P541-D546 HydrophobicContact CB-CB 4.07Å; P541-L547 HydrophobicContact CB-CD2 3.87Å; P541-L547 HydrophobicContact CB-CG 4.36Å; P541-L547 HydrophobicContact CG-CD2 3.96Å |
| 542 | N | 84.6 | Confident | 76.9 | Confident | 27 Ų | 27 | 62.8 Ų | 62.8 | 14% | 0.144 | 32% | 0.324 | C | S | . | . | trans | -98 | -40.5 | 177.2 | -65.7 | -48.8 | 0 | 0 | 0 | 110.7 | V292 T473 V474 L540 D546 | V292-N542 HydrophobicContact CG2-CB 3.83Å; T473-N542 PolarHBondContact N-O 2.9Å; T473-N542 PolarHBondContact OG1-OD1 2.97Å; V474-N542 PolarHBondContact N-O 2.92Å; L540-N542 PolarHBondContact O-N 3.15Å; N542-D546 WeakPolarHBondContact CA-OD2 3.38Å; N542-D546 WeakPolarHBondContact CB-OD2 3.35Å; N542-D546 PolarHBondContact N-OD2 2.89Å | ||
| 543 | T | 85 | Confident | 76.9 | Confident | 17 Ų | 17 | 65.9 Ų | 65.9 | 10% | 0.104 | 34% | 0.34 | C | S | . | . | S | Bend | trans | -124.7 | 170.4 | 180 | 71.9 | 0 | 0 | 0 | 0 | 111.6 | D331 P472 A545 D546 | D331-T543 WeakPolarHBondContact OD2-CB 3.42Å; D331-T543 VanDerWaalsContact OD2-CG2 3.23Å; D331-T543 WeakPolarHBondContact OD2-CG2 3.34Å; P472-T543 WeakPolarHBondContact CB-O 3.5Å; T543-A545 PolarHBondContact O-N 2.93Å; T543-A545 PolarHBondContact OG1-N 3.05Å; T543-D546 PolarHBondContact N-OD2 3.28Å; T543-D546 PolarHBondContact O-N 3.32Å; T543-D546 PolarHBondContact OG1-OD1 3.21Å; T543-D546 PolarHBondContact OG1-OD2 2.86Å |
| 544 | F | 82.9 | Confident | 77.3 | Confident | 24 Ų | 24 | 65.5 Ų | 65.5 | 11% | 0.105 | 34% | 0.344 | C | S | . | . | S | Bend | trans | -68 | -23.5 | 172.5 | -75.4 | -82.6 | 0 | 0 | 0 | 113.1 | Y336 D340 H343 L347 P472 V474 V475 D546 L547 | Y336-F544 AromaticContact CD1-CE2 3.76Å; Y336-F544 HydrophobicContact CD1-CE2 3.76Å; Y336-F544 AromaticContact CE1-CD2 3.78Å; Y336-F544 HydrophobicContact CE1-CD2 3.78Å; Y336-F544 AromaticContact CE1-CE2 3.43Å; Y336-F544 HydrophobicContact CE1-CE2 3.43Å; Y336-F544 VanDerWaalsContact CE1-CE2 3.43Å; D340-F544 HydrophobicContact CB-CE2 4.37Å; D340-F544 HydrophobicContact CB-CZ 3.9Å; H343-F544 HydrophobicContact CB-CD1 4.34Å; H343-F544 HydrophobicContact CB-CE1 3.95Å; L347-F544 HydrophobicContact CD2-CE1 3.83Å; P472-F544 HydrophobicContact CG-CD1 4.21Å; P472-F544 HydrophobicContact CG-CD2 4.38Å; P472-F544 HydrophobicContact CG-CE1 4.15Å; P472-F544 HydrophobicContact CG-CE2 4.3Å; P472-F544 HydrophobicContact CG-CG 4.33Å; P472-F544 HydrophobicContact CG-CZ 4.19Å; V474-F544 HydrophobicContact CG2-CD2 3.91Å; V474-F544 HydrophobicContact CG2-CE2 3.75Å; V475-F544 HydrophobicContact CG1-CE2 3.91Å; V475-F544 HydrophobicContact CG1-CZ 3.94Å; V475-F544 HydrophobicContact CG2-CE2 4.32Å; V475-F544 HydrophobicContact CG2-CZ 3.83Å; F544-D546 PolarHBondContact O-N 2.96Å; F544-L547 HydrophobicContact CD1-CD1 4.03Å; F544-L547 WeakPolarHBondContact O-CB 3.34Å; F544-L547 PolarHBondContact O-N 3.23Å |
| 545 | A | 79.1 | Confident | 78.2 | Confident | 64 Ų | 64 | 66.4 Ų | 66.4 | 53% | 0.529 | 34% | 0.337 | S | S | . | . | G | 310 helix | trans | -65.4 | -31.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | T543 L547 Q548 | T543-A545 PolarHBondContact O-N 2.93Å; T543-A545 PolarHBondContact OG1-N 3.05Å; A545-L547 PolarHBondContact O-N 3.37Å; A545-L547 VanDerWaalsContact O-N 3.15Å; A545-Q548 PolarHBondContact O-N 3.45Å |
| 546 | D | 78.4 | Confident | 79.3 | Confident | 83 Ų | 83 | 65.5 Ų | 65.5 | 44% | 0.444 | 33% | 0.334 | S | S | . | . | G | 310 helix | trans | -69.9 | -8.5 | 178 | -51 | -23.4 | 0 | 0 | 0 | 113.3 | P541 N542 T543 F544 | P541-D546 HydrophobicContact CB-CB 4.07Å; N542-D546 WeakPolarHBondContact CA-OD2 3.38Å; N542-D546 WeakPolarHBondContact CB-OD2 3.35Å; N542-D546 PolarHBondContact N-OD2 2.89Å; T543-D546 PolarHBondContact N-OD2 3.28Å; T543-D546 PolarHBondContact O-N 3.32Å; T543-D546 PolarHBondContact OG1-OD1 3.21Å; T543-D546 PolarHBondContact OG1-OD2 2.86Å; F544-D546 PolarHBondContact O-N 2.96Å |
| 547 | L | 75.1 | Confident | 79.6 | Confident | 38 Ų | 38 | 66.4 Ų | 66.4 | 20% | 0.199 | 33% | 0.334 | C | S | . | . | G | 310 helix | trans | -93.7 | -16 | 178.1 | -64.7 | 176.6 | 0 | 0 | 0 | 113.6 | P472 P541 F544 A545 | P472-L547 HydrophobicContact CG-CD1 4.21Å; P541-L547 HydrophobicContact CB-CD2 3.87Å; P541-L547 HydrophobicContact CB-CG 4.36Å; P541-L547 HydrophobicContact CG-CD2 3.96Å; F544-L547 HydrophobicContact CD1-CD1 4.03Å; F544-L547 WeakPolarHBondContact O-CB 3.34Å; F544-L547 PolarHBondContact O-N 3.23Å; A545-L547 PolarHBondContact O-N 3.37Å; A545-L547 VanDerWaalsContact O-N 3.15Å |
| 548 | Q | 68.2 | Low | 80 | Confident | 221 Ų | 221 | 57.3 Ų | 57.3 | 100% | 1.033 | 30% | 0.298 | S | S | * | . | trans | -82.1 | 0 | 175.9 | -64.8 | -177 | -12.6 | 0 | 0 | 109.6 | A545 | A545-Q548 PolarHBondContact O-N 3.45Š|
Retrieved 548 of 548 residues in 1408.5 ms
(Link to these results)