| 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 | 35.6 | Very low | 31.9 | Very low | 242 Ų | 242 | 135.2 Ų | 135.2 | 100% | 1.192 | 84% | 0.835 | S | S | * | * | 0 | 88.8 | 0 | -70.1 | 173.7 | 176.1 | 0 | 0 | 105.4 | |||||
| 2 | T | 30.5 | Very low | 32.5 | Very low | 154 Ų | 154 | 133.7 Ų | 133.7 | 95% | 0.945 | 83% | 0.829 | S | S | * | * | -150.4 | 154.1 | 82 | 18.3 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 3 | S | 25.9 | Very low | 32.3 | Very low | 101 Ų | 101 | 134 Ų | 134 | 71% | 0.706 | 82% | 0.822 | S | S | * | * | trans | -109.4 | 144.3 | -162.8 | 48.1 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 4 | L | 27.5 | Very low | 32.4 | Very low | 150 Ų | 150 | 136 Ų | 136 | 79% | 0.785 | 82% | 0.824 | S | S | * | * | trans | 75.8 | 156.8 | 147 | -70.4 | 161 | 0 | 0 | 0 | 119.5 | ||||
| 5 | P | 34.7 | Very low | 32.5 | Very low | 121 Ų | 121 | 141 Ų | 141 | 79% | 0.786 | 83% | 0.831 | S | S | * | * | cis | -132.2 | 166.8 | 12.7 | 30.8 | -8.4 | 0 | 0 | 0 | 117.9 | ||||
| 6 | I | 34.9 | Very low | 32.4 | Very low | 155 Ų | 155 | 139.6 Ų | 139.6 | 80% | 0.795 | 83% | 0.83 | S | S | * | * | trans | -75.2 | 136.3 | 165.8 | -69.4 | 161.4 | 0 | 0 | 0 | 109 | ||||
| 7 | G | 27.9 | Very low | 32.3 | Very low | 76 Ų | 76 | 135.8 Ų | 135.8 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | trans | -138.6 | 118.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 8 | T | 30.6 | Very low | 32.3 | Very low | 133 Ų | 133 | 137.5 Ų | 137.5 | 82% | 0.816 | 83% | 0.83 | S | S | * | * | trans | -79.7 | 168.9 | 170 | 39.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 9 | P | 40.2 | Very low | 32.2 | Very low | 134 Ų | 134 | 136.2 Ų | 136.2 | 87% | 0.87 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -93.6 | 145.2 | -147.4 | 36.7 | -32.9 | 0 | 0 | 0 | 113.9 | ||
| 10 | G | 35.5 | Very low | 32.3 | Very low | 66 Ų | 66 | 135.9 Ų | 135.9 | 68% | 0.68 | 83% | 0.825 | S | S | * | * | trans | 144.9 | 84.9 | 168.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 11 | D | 27.5 | Very low | 32.2 | Very low | 155 Ų | 155 | 134.7 Ų | 134.7 | 83% | 0.829 | 83% | 0.83 | S | S | * | * | trans | -154.8 | 127.9 | 151.4 | -94.2 | -31.8 | 0 | 0 | 0 | 110.1 | D13 | D11-D13 PolarHBondContact O-N 3.48Š| ||
| 12 | P | 38.9 | Very low | 31.9 | Very low | 117 Ų | 117 | 126.2 Ų | 126.2 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | trans | -99.4 | 70.9 | -176.3 | 38.9 | -30.8 | 0 | 0 | 0 | 110.8 | ||||
| 13 | D | 30 | Very low | 31.7 | Very low | 138 Ų | 138 | 124.4 Ų | 124.4 | 74% | 0.738 | 80% | 0.798 | S | S | * | * | trans | -138.2 | 81.8 | 176.7 | -81.3 | -41.5 | 0 | 0 | 0 | 111.3 | D11 | D11-D13 PolarHBondContact O-N 3.48Š| ||
| 14 | L | 33.6 | Very low | 32 | Very low | 162 Ų | 162 | 126 Ų | 126 | 85% | 0.848 | 80% | 0.804 | S | S | * | * | trans | -142.1 | 38.5 | 165.8 | -150.8 | 83 | 0 | 0 | 0 | 112 | ||||
| 15 | F | 34.6 | Very low | 32.1 | Very low | 211 Ų | 211 | 125.1 Ų | 125.1 | 93% | 0.925 | 81% | 0.807 | S | S | * | * | trans | -151.6 | 70.4 | 167.5 | -96 | -79.1 | 0 | 0 | 0 | 110.4 | ||||
| 16 | S | 30 | Very low | 31.8 | Very low | 118 Ų | 118 | 123.6 Ų | 123.6 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -114.1 | 96.1 | 166.3 | 47.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 17 | G | 32.1 | Very low | 31.4 | Very low | 76 Ų | 76 | 123.6 Ų | 123.6 | 78% | 0.784 | 81% | 0.807 | S | S | * | * | trans | -173.6 | 29.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 18 | L | 30.8 | Very low | 31.4 | Very low | 166 Ų | 166 | 129.5 Ų | 129.5 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | trans | -129.6 | 129.6 | 171.3 | -91.3 | 139.3 | 0 | 0 | 0 | 110.1 | ||||
| 19 | P | 31.8 | Very low | 31.2 | Very low | 113 Ų | 113 | 128.7 Ų | 128.7 | 73% | 0.734 | 81% | 0.814 | S | S | * | * | trans | -76.9 | 153.6 | -178.6 | 31.2 | -32.8 | 0 | 0 | 0 | 111.8 | ||||
| 20 | P | 33.7 | Very low | 30.6 | Very low | 129 Ų | 129 | 127.3 Ų | 127.3 | 84% | 0.838 | 81% | 0.814 | S | S | * | * | trans | -82.2 | 137 | -174.3 | 32.4 | -32.4 | 0 | 0 | 0 | 111.9 | ||||
| 21 | A | 31 | Very low | 30.1 | Very low | 111 Ų | 111 | 133.5 Ų | 133.5 | 92% | 0.917 | 83% | 0.825 | S | S | * | * | trans | -89.6 | 108.9 | 166.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 22 | G | 27.3 | Very low | 30 | Very low | 64 Ų | 64 | 130.8 Ų | 130.8 | 66% | 0.66 | 82% | 0.824 | S | S | * | * | trans | -111.6 | 128 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 23 | S | 27.5 | Very low | 29.4 | Very low | 117 Ų | 117 | 131.2 Ų | 131.2 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | trans | 41.5 | 126.8 | 146.4 | 57.4 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 24 | T | 30.9 | Very low | 29.3 | Very low | 135 Ų | 135 | 134 Ų | 134 | 83% | 0.828 | 84% | 0.838 | S | S | * | * | trans | -49.7 | 158.8 | 161.3 | 21.1 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 25 | P | 31.4 | Very low | 29 | Very low | 131 Ų | 131 | 130.1 Ų | 130.1 | 85% | 0.851 | 84% | 0.837 | S | S | * | * | -141.2 | 172.7 | 99.3 | 34.4 | -17.1 | 0 | 0 | 0 | 115.3 | |||||
| 26 | A | 27.8 | Very low | 28.6 | Very low | 89 Ų | 89 | 128.4 Ų | 128.4 | 74% | 0.736 | 84% | 0.838 | S | S | * | * | trans | -91.8 | 161.7 | -169.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 27 | N | 27.1 | Very low | 28.6 | Very low | 155 Ų | 155 | 125.8 Ų | 125.8 | 83% | 0.829 | 83% | 0.829 | S | S | * | * | trans | 66.1 | 117.8 | 155.2 | -80.8 | -0.9 | 0 | 0 | 0 | 121.3 | ||||
| 28 | Q | 26.8 | Very low | 28.4 | Very low | 199 Ų | 199 | 127.3 Ų | 127.3 | 93% | 0.93 | 83% | 0.828 | S | S | * | * | -171.8 | 148 | 109 | -98.2 | 171.7 | 24.1 | 0 | 0 | 112.2 | |||||
| 29 | S | 25.5 | Very low | 28.4 | Very low | 117 Ų | 117 | 125.2 Ų | 125.2 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -79.1 | 145.3 | -174.4 | 43.7 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 30 | A | 27.6 | Very low | 28.5 | Very low | 105 Ų | 105 | 125.7 Ų | 125.7 | 87% | 0.868 | 82% | 0.823 | S | S | * | * | trans | -162.3 | 138.9 | 147.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 31 | E | 26.3 | Very low | 28.6 | Very low | 195 Ų | 195 | 126 Ų | 126 | 91% | 0.911 | 82% | 0.816 | S | S | * | * | trans | -80.8 | 164.2 | -171.4 | -69.3 | 168 | 122.3 | 0 | 0 | 115.6 | ||||
| 32 | A | 24.8 | Very low | 28.7 | Very low | 99 Ų | 99 | 125.5 Ų | 125.5 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | 75.5 | 110.3 | 147.3 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 33 | S | 26.3 | Very low | 29.2 | Very low | 126 Ų | 126 | 134.2 Ų | 134.2 | 88% | 0.881 | 82% | 0.816 | S | S | * | * | -175.6 | 147.2 | 97.9 | -155.1 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 34 | E | 27.3 | Very low | 29.9 | Very low | 196 Ų | 196 | 134.8 Ų | 134.8 | 92% | 0.916 | 82% | 0.815 | S | S | * | * | trans | -64.7 | 146.8 | -174.4 | -64.8 | 170.9 | 124.2 | 0 | 0 | 114 | ||||
| 35 | G | 27.5 | Very low | 30.6 | Very low | 80 Ų | 80 | 132.4 Ų | 132.4 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -171.5 | 87.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 36 | N | 27.2 | Very low | 31.3 | Very low | 175 Ų | 175 | 130.5 Ų | 130.5 | 94% | 0.936 | 81% | 0.805 | S | S | * | * | trans | -50.9 | 134.4 | -176.7 | -156.3 | 12.1 | 0 | 0 | 0 | 115.2 | ||||
| 37 | G | 29.9 | Very low | 32.4 | Very low | 63 Ų | 63 | 129 Ų | 129 | 65% | 0.649 | 79% | 0.787 | S | S | * | * | trans | 158.8 | 54.5 | 170.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | V39 | G37-V39 PolarHBondContact O-N 3.21Š| ||
| 38 | S | 27.5 | Very low | 33.6 | Very low | 109 Ų | 109 | 125.1 Ų | 125.1 | 76% | 0.762 | 77% | 0.768 | S | S | * | * | trans | -71.5 | 90.5 | 169.2 | 61.9 | 0 | 0 | 0 | 0 | 110.5 | T40 | S38-T40 PolarHBondContact O-N 3.29Š| ||
| 39 | V | 31.7 | Very low | 35 | Very low | 122 Ų | 122 | 121.1 Ų | 121.1 | 74% | 0.739 | 76% | 0.76 | S | S | * | * | trans | -78.4 | 93.5 | 159.9 | 179 | 0 | 0 | 0 | 0 | 107 | G37 I41 | G37-V39 PolarHBondContact O-N 3.21Å; V39-I41 VanDerWaalsContact C-N 3.26Å; V39-I41 HydrophobicContact CG1-CG1 4.07Å; V39-I41 PolarHBondContact O-N 3.37Å | ||
| 40 | T | 32.3 | Very low | 36.5 | Very low | 122 Ų | 122 | 122.5 Ų | 122.5 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | -66.7 | 89.7 | 166.6 | -44.9 | 0 | 0 | 0 | 0 | 107.6 | S38 P42 | S38-T40 PolarHBondContact O-N 3.29Å; T40-P42 WeakPolarHBondContact O-CD 3.41Å | ||
| 41 | I | 35.9 | Very low | 38.3 | Very low | 136 Ų | 136 | 121.2 Ų | 121.2 | 70% | 0.697 | 73% | 0.727 | S | S | * | * | trans | -62 | 121.4 | 167.4 | -59.6 | -175 | 0 | 0 | 0 | 106 | V39 R43 | V39-I41 VanDerWaalsContact C-N 3.26Å; V39-I41 HydrophobicContact CG1-CG1 4.07Å; V39-I41 PolarHBondContact O-N 3.37Å; I41-R43 PolarHBondContact O-N 3.43Å; I41-R43 VanDerWaalsContact O-N 3.11Å | ||
| 42 | P | 34.2 | Very low | 40.2 | Very low | 101 Ų | 101 | 113.1 Ų | 113.1 | 66% | 0.656 | 69% | 0.692 | S | S | * | * | trans | -59.5 | 124.1 | 174.6 | -14 | 26.9 | 0 | 0 | 0 | 106.9 | T40 T44 | T40-P42 WeakPolarHBondContact O-CD 3.41Å; P42-T44 PolarHBondContact O-N 2.82Å | ||
| 43 | R | 36.9 | Very low | 42.4 | Very low | 246 Ų | 246 | 112.6 Ų | 112.6 | 93% | 0.928 | 68% | 0.675 | S | S | * | * | trans | -58.6 | 89.4 | 160.2 | -87.3 | 176.4 | 158.9 | 163.3 | -5.9 | 106.4 | I41 A45 | I41-R43 PolarHBondContact O-N 3.43Å; I41-R43 VanDerWaalsContact O-N 3.11Å; R43-A45 VanDerWaalsContact C-N 3.34Å; R43-A45 PolarHBondContact O-N 3.06Å | ||
| 44 | T | 42.9 | Very low | 45 | Very low | 129 Ų | 129 | 111.2 Ų | 111.2 | 79% | 0.791 | 66% | 0.655 | S | S | * | * | trans | -54.3 | 110.7 | 152.4 | 30.5 | 0 | 0 | 0 | 0 | 104.6 | P42 A46 | P42-T44 PolarHBondContact O-N 2.82Å; T44-A46 PolarHBondContact O-N 3.41Å | ||
| 45 | A | 46.2 | Very low | 47.5 | Very low | 85 Ų | 85 | 103.6 Ų | 103.6 | 70% | 0.702 | 62% | 0.62 | S | S | * | * | trans | -50.6 | 112.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 107 | R43 V47 | R43-A45 VanDerWaalsContact C-N 3.34Å; R43-A45 PolarHBondContact O-N 3.06Å; A45-V47 VanDerWaalsContact C-N 3.31Å; A45-V47 PolarHBondContact O-N 3.29Å | ||
| 46 | A | 44.7 | Very low | 50.2 | Low | 92 Ų | 92 | 100.2 Ų | 100.2 | 76% | 0.76 | 58% | 0.583 | S | S | * | * | trans | -61.9 | 101.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 106.2 | T44 T48 | T44-A46 PolarHBondContact O-N 3.41Å; A46-T48 PolarHBondContact O-N 2.9Å | ||
| 47 | V | 50.8 | Low | 52.9 | Low | 58 Ų | 58 | 95.5 Ų | 95.5 | 35% | 0.352 | 56% | 0.555 | S | S | . | * | trans | -60.7 | 105.7 | 174.4 | 174.3 | 0 | 0 | 0 | 0 | 106.1 | A45 Q51 P310 | A45-V47 VanDerWaalsContact C-N 3.31Å; A45-V47 PolarHBondContact O-N 3.29Å; V47-Q51 HydrophobicContact CG1-CB 4.39Å; V47-P310 HydrophobicContact CB-CB 4.44Å; V47-P310 HydrophobicContact CG1-CB 4.13Å | ||
| 48 | T | 52.7 | Low | 55.6 | Low | 72 Ų | 72 | 99.4 Ų | 99.4 | 44% | 0.442 | 56% | 0.557 | S | S | . | * | trans | -69.2 | 143.9 | 178.2 | 53.4 | 0 | 0 | 0 | 0 | 109.1 | A46 F50 Q51 | A46-T48 PolarHBondContact O-N 2.9Å; T48-F50 PolarHBondContact O-N 2.94Å; T48-Q51 PolarHBondContact O-N 3.25Å | ||
| 49 | P | 55.8 | Low | 58.7 | Low | 116 Ų | 116 | 97.1 Ų | 97.1 | 75% | 0.753 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -48.8 | -22.5 | 174.1 | -26.7 | 32.5 | 0 | 0 | 0 | 114.3 | Q51 S52 | P49-Q51 VanDerWaalsContact C-N 3.32Å; P49-Q51 PolarHBondContact O-N 2.9Å; P49-S52 PolarHBondContact O-OG 3.44Å |
| 50 | F | 58.8 | Low | 61.5 | Low | 146 Ų | 146 | 95.7 Ų | 95.7 | 64% | 0.64 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.3 | -33.4 | 175.2 | -164.9 | -101.3 | 0 | 0 | 0 | 114.4 | T48 Q54 | T48-F50 PolarHBondContact O-N 2.94Å; F50-Q54 PolarHBondContact O-N 2.61Å; F50-Q54 VanDerWaalsContact O-N 3.11Å |
| 51 | Q | 63.9 | Low | 64.4 | Low | 78 Ų | 78 | 92.5 Ų | 92.5 | 36% | 0.364 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -77.3 | -35.2 | -173.5 | -70.6 | -179.1 | -39.6 | 0 | 0 | 113.2 | V47 T48 P49 Q54 L55 Y311 | V47-Q51 HydrophobicContact CG1-CB 4.39Å; T48-Q51 PolarHBondContact O-N 3.25Å; P49-Q51 VanDerWaalsContact C-N 3.32Å; P49-Q51 PolarHBondContact O-N 2.9Å; Q51-Q54 WeakPolarHBondContact O-CB 3.4Å; Q51-Q54 PolarHBondContact O-N 2.86Å; Q51-L55 PolarHBondContact O-N 3.29Å; Q51-Y311 HydrophobicContact CB-CD2 3.69Å; Q51-Y311 HydrophobicContact CB-CE2 3.87Å; Q51-Y311 VanDerWaalsContact O-CE2 3.28Å; Q51-Y311 WeakPolarHBondContact O-CE2 3.31Å |
| 52 | S | 66.9 | Low | 67.1 | Low | 24 Ų | 24 | 90.3 Ų | 90.3 | 17% | 0.168 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -70.1 | -36.6 | 175.9 | 61.6 | 0 | 0 | 0 | 0 | 112.4 | P49 Q54 L55 V56 P310 Y311 | P49-S52 PolarHBondContact O-OG 3.44Å; S52-Q54 VanDerWaalsContact C-N 3.31Å; S52-L55 PolarHBondContact O-N 3.47Å; S52-V56 PolarHBondContact O-N 3.2Å; S52-P310 WeakPolarHBondContact CB-O 3.21Å; S52-Y311 WeakPolarHBondContact CA-O 3.16Å; S52-Y311 VanDerWaalsContact CB-O 3.23Å; S52-Y311 WeakPolarHBondContact CB-O 3.17Å |
| 53 | L | 72.1 | Confident | 69.9 | Low | 89 Ų | 89 | 85.7 Ų | 85.7 | 47% | 0.466 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.8 | -41.5 | 171.2 | -171.6 | 62.9 | 0 | 0 | 0 | 110.8 | L55 V56 H57 | L53-L55 PolarHBondContact O-N 2.83Å; L53-V56 PolarHBondContact O-N 3.46Å; L53-H57 PolarHBondContact O-CD2 3.06Å; L53-H57 VanDerWaalsContact O-CD2 3.23Å; L53-H57 PolarHBondContact O-N 2.81Å |
| 54 | Q | 79.2 | Confident | 72.7 | Confident | 97 Ų | 97 | 76.5 Ų | 76.5 | 45% | 0.453 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -59.3 | -43.5 | 178.5 | -167.2 | 172.6 | -4.4 | 0 | 0 | 112.3 | F50 Q51 S52 V56 H57 Q58 | F50-Q54 PolarHBondContact O-N 2.61Å; F50-Q54 VanDerWaalsContact O-N 3.11Å; Q51-Q54 WeakPolarHBondContact O-CB 3.4Å; Q51-Q54 PolarHBondContact O-N 2.86Å; S52-Q54 VanDerWaalsContact C-N 3.31Å; Q54-V56 PolarHBondContact O-N 3.29Å; Q54-H57 PolarHBondContact O-N 2.89Å; Q54-Q58 VanDerWaalsContact O-CG 3.29Å; Q54-Q58 WeakPolarHBondContact O-CG 3.27Å; Q54-Q58 PolarHBondContact O-N 3.27Å |
| 55 | L | 81 | Confident | 75.2 | Confident | 36 Ų | 36 | 75 Ų | 75 | 19% | 0.188 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -62.2 | -43.4 | 177.8 | -175.3 | 66.7 | 0 | 0 | 0 | 112.5 | Q51 S52 L53 H57 Q58 L59 Y311 L315 | Q51-L55 PolarHBondContact O-N 3.29Å; S52-L55 PolarHBondContact O-N 3.47Å; L53-L55 PolarHBondContact O-N 2.83Å; L55-H57 VanDerWaalsContact C-N 3.31Å; L55-H57 PolarHBondContact O-N 2.82Å; L55-Q58 PolarHBondContact O-N 2.86Å; L55-L59 PolarHBondContact O-N 3.46Å; L55-L59 VanDerWaalsContact O-N 3.17Å; L55-Y311 HydrophobicContact CB-CE1 4.37Å; L55-Y311 HydrophobicContact CD1-CE1 4.26Å; L55-Y311 HydrophobicContact CD2-CD1 4.18Å; L55-Y311 HydrophobicContact CD2-CE1 3.77Å; L55-Y311 HydrophobicContact CG-CE1 4.36Å; L55-L315 HydrophobicContact CD2-CB 4.17Å; L55-L315 HydrophobicContact CD2-CD2 3.56Å; L55-L315 HydrophobicContact CG-CD2 3.98Å |
| 56 | V | 83.5 | Confident | 77.5 | Confident | 8 Ų | 8 | 72.7 Ų | 72.7 | 5% | 0.048 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 176 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | S52 L53 Q54 L59 K60 I63 F122 L315 L318 | S52-V56 PolarHBondContact O-N 3.2Å; L53-V56 PolarHBondContact O-N 3.46Å; Q54-V56 PolarHBondContact O-N 3.29Å; V56-L59 CarbonylContact O-C 3.49Å; V56-L59 PolarHBondContact O-N 3.02Å; V56-K60 PolarHBondContact O-N 3.41Å; V56-K60 VanDerWaalsContact O-N 3.11Å; V56-I63 HydrophobicContact CG1-CD1 4.32Å; V56-F122 HydrophobicContact CG1-CE1 3.81Å; V56-F122 HydrophobicContact CG1-CZ 4.29Å; V56-L315 HydrophobicContact CG2-CB 4.12Å; V56-L318 HydrophobicContact CG1-CD1 3.52Å; V56-L318 HydrophobicContact CG2-CD1 4.13Å |
| 57 | H | 84.4 | Confident | 79.9 | Confident | 76 Ų | 76 | 68.4 Ų | 68.4 | 35% | 0.352 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66.9 | -37.9 | 176.7 | -86.2 | -90.8 | 0 | 0 | 0 | 113.2 | L53 Q54 L55 L59 K60 | L53-H57 PolarHBondContact O-CD2 3.06Å; L53-H57 VanDerWaalsContact O-CD2 3.23Å; L53-H57 PolarHBondContact O-N 2.81Å; Q54-H57 PolarHBondContact O-N 2.89Å; L55-H57 VanDerWaalsContact C-N 3.31Å; L55-H57 PolarHBondContact O-N 2.82Å; H57-L59 VanDerWaalsContact C-N 3.28Å; H57-L59 PolarHBondContact O-N 2.92Å; H57-K60 WeakPolarHBondContact O-CB 3.18Å; H57-K60 PolarHBondContact O-N 3.27Å |
| 58 | Q | 87.5 | Confident | 82 | Confident | 145 Ų | 145 | 68.3 Ų | 68.3 | 68% | 0.678 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -61.7 | -37.9 | 175.1 | -68.8 | -65 | -33.7 | 0 | 0 | 111.8 | Q54 L55 K60 | Q54-Q58 VanDerWaalsContact O-CG 3.29Å; Q54-Q58 WeakPolarHBondContact O-CG 3.27Å; Q54-Q58 PolarHBondContact O-N 3.27Å; L55-Q58 PolarHBondContact O-N 2.86Å; Q58-K60 VanDerWaalsContact C-N 3.34Å |
| 59 | L | 90.6 | Very high | 84.1 | Confident | 62 Ų | 62 | 69.2 Ų | 69.2 | 33% | 0.325 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.7 | 9.2 | 179.8 | -62.9 | 176.5 | 0 | 0 | 0 | 113.7 | L55 V56 H57 G61 L62 I63 L315 | L55-L59 PolarHBondContact O-N 3.46Å; L55-L59 VanDerWaalsContact O-N 3.17Å; V56-L59 CarbonylContact O-C 3.49Å; V56-L59 PolarHBondContact O-N 3.02Å; H57-L59 VanDerWaalsContact C-N 3.28Å; H57-L59 PolarHBondContact O-N 2.92Å; L59-G61 VanDerWaalsContact C-N 3.31Å; L59-G61 PolarHBondContact O-N 3.4Å; L59-L62 WeakPolarHBondContact O-CB 3.22Å; L59-L62 PolarHBondContact O-N 3.22Å; L59-I63 HydrophobicContact CB-CD1 4.14Å; L59-I63 HydrophobicContact CB-CG1 4.43Å; L59-I63 WeakPolarHBondContact O-CG1 3.39Å; L59-I63 PolarHBondContact O-N 3.14Å; L59-L315 HydrophobicContact CD1-CD1 3.81Å; L59-L315 HydrophobicContact CD1-CD2 3.66Å; L59-L315 HydrophobicContact CD1-CG 4.41Å |
| 60 | K | 91.1 | Very high | 86 | Confident | 91 Ų | 91 | 63.9 Ų | 63.9 | 40% | 0.396 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -50.2 | -48.1 | -176.2 | 175.5 | 172.9 | 179.8 | 173.7 | 0 | 112.9 | V56 H57 Q58 L62 I63 V64 F122 | V56-K60 PolarHBondContact O-N 3.41Å; V56-K60 VanDerWaalsContact O-N 3.11Å; H57-K60 WeakPolarHBondContact O-CB 3.18Å; H57-K60 PolarHBondContact O-N 3.27Å; Q58-K60 VanDerWaalsContact C-N 3.34Å; K60-L62 VanDerWaalsContact C-N 3.34Å; K60-L62 PolarHBondContact O-N 2.79Å; K60-I63 PolarHBondContact O-N 3Å; K60-V64 HydrophobicContact CG-CG2 4.19Å; K60-V64 WeakPolarHBondContact O-CB 3.43Å; K60-V64 VanDerWaalsContact O-CG2 3.27Å; K60-V64 WeakPolarHBondContact O-CG2 3.23Å; K60-V64 PolarHBondContact O-N 3.21Å; K60-F122 HydrophobicContact CB-CD1 4.17Å; K60-F122 HydrophobicContact CB-CE1 3.63Å; K60-F122 HydrophobicContact CB-CZ 4.12Å; K60-F122 HydrophobicContact CD-CD1 3.81Å; K60-F122 HydrophobicContact CD-CE1 4.16Å; K60-F122 HydrophobicContact CD-CG 4.29Å; K60-F122 HydrophobicContact CG-CD1 3.74Å; K60-F122 HydrophobicContact CG-CE1 3.6Å; K60-F122 HydrophobicContact CG-CE2 4.45Å; K60-F122 HydrophobicContact CG-CG 4.24Å; K60-F122 HydrophobicContact CG-CZ 3.99Å |
| 61 | G | 92.7 | Very high | 87.8 | Confident | 56 Ų | 56 | 58.3 Ų | 58.3 | 58% | 0.577 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -59.7 | -43 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L59 M65 | L59-G61 VanDerWaalsContact C-N 3.31Å; L59-G61 PolarHBondContact O-N 3.4Å; G61-M65 WeakPolarHBondContact O-CB 3.41Å; G61-M65 PolarHBondContact O-N 3.07Å |
| 62 | L | 93.9 | Very high | 89.3 | Confident | 89 Ų | 89 | 58.8 Ų | 58.8 | 47% | 0.466 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -65.8 | -47.1 | 177.3 | -179 | 69.1 | 0 | 0 | 0 | 111.3 | L59 K60 M65 L66 | L59-L62 WeakPolarHBondContact O-CB 3.22Å; L59-L62 PolarHBondContact O-N 3.22Å; K60-L62 VanDerWaalsContact C-N 3.34Å; K60-L62 PolarHBondContact O-N 2.79Å; L62-M65 HydrophobicContact CD1-CE 3.71Å; L62-M65 WeakPolarHBondContact O-CB 3.31Å; L62-M65 PolarHBondContact O-N 3.43Å; L62-L66 HydrophobicContact CG-CD1 4.15Å; L62-L66 WeakPolarHBondContact O-CB 3.46Å; L62-L66 VanDerWaalsContact O-CG 3.28Å; L62-L66 WeakPolarHBondContact O-CG 3.32Å; L62-L66 PolarHBondContact O-N 2.78Å |
| 63 | I | 93.5 | Very high | 90.7 | Very high | 5 Ų | 5 | 59.7 Ų | 59.7 | 3% | 0.026 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -62.9 | -47 | -179.3 | -64.3 | 167.6 | 0 | 0 | 0 | 110.3 | V56 L59 K60 M65 L66 Y67 L118 F122 L315 L318 | V56-I63 HydrophobicContact CG1-CD1 4.32Å; L59-I63 HydrophobicContact CB-CD1 4.14Å; L59-I63 HydrophobicContact CB-CG1 4.43Å; L59-I63 WeakPolarHBondContact O-CG1 3.39Å; L59-I63 PolarHBondContact O-N 3.14Å; K60-I63 PolarHBondContact O-N 3Å; I63-M65 VanDerWaalsContact C-N 3.31Å; I63-M65 PolarHBondContact O-N 3.35Å; I63-L66 PolarHBondContact O-N 3.43Å; I63-Y67 HydrophobicContact CG2-CD2 3.8Å; I63-Y67 HydrophobicContact CG2-CE2 3.83Å; I63-Y67 WeakPolarHBondContact O-CD2 3.46Å; I63-Y67 PolarHBondContact O-N 2.8Å; I63-L118 HydrophobicContact CG2-CD1 4.05Å; I63-F122 HydrophobicContact CB-CE2 4.24Å; I63-F122 HydrophobicContact CB-CZ 3.87Å; I63-F122 HydrophobicContact CD1-CZ 4Å; I63-F122 HydrophobicContact CG2-CE2 3.79Å; I63-F122 HydrophobicContact CG2-CZ 3.78Å; I63-L315 HydrophobicContact CD1-CD1 3.99Å; I63-L318 HydrophobicContact CD1-CD1 4.43Å |
| 64 | V | 94.1 | Very high | 91.8 | Very high | 52 Ų | 52 | 55.4 Ų | 55.4 | 32% | 0.315 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.3 | -42.7 | 177.7 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | K60 S68 L118 F122 | K60-V64 HydrophobicContact CG-CG2 4.19Å; K60-V64 WeakPolarHBondContact O-CB 3.43Å; K60-V64 VanDerWaalsContact O-CG2 3.27Å; K60-V64 WeakPolarHBondContact O-CG2 3.23Å; K60-V64 PolarHBondContact O-N 3.21Å; V64-S68 VanDerWaalsContact O-CB 3.24Å; V64-S68 WeakPolarHBondContact O-CB 3.19Å; V64-S68 PolarHBondContact O-N 3.49Å; V64-S68 PolarHBondContact O-OG 2.91Å; V64-L118 HydrophobicContact CG2-CD2 4.46Å; V64-F122 HydrophobicContact CG2-CD2 4.12Å; V64-F122 HydrophobicContact CG2-CE2 3.88Å |
| 65 | M | 95.3 | Very high | 92.6 | Very high | 99 Ų | 99 | 53 Ų | 53 | 49% | 0.488 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -59.9 | -48.1 | 174.8 | -178.8 | -168.7 | 75.5 | 0 | 0 | 111.6 | G61 L62 I63 Y67 S68 I69 | G61-M65 WeakPolarHBondContact O-CB 3.41Å; G61-M65 PolarHBondContact O-N 3.07Å; L62-M65 HydrophobicContact CD1-CE 3.71Å; L62-M65 WeakPolarHBondContact O-CB 3.31Å; L62-M65 PolarHBondContact O-N 3.43Å; I63-M65 VanDerWaalsContact C-N 3.31Å; I63-M65 PolarHBondContact O-N 3.35Å; M65-Y67 PolarHBondContact O-N 3.08Å; M65-S68 PolarHBondContact O-N 3.08Å; M65-I69 HydrophobicContact CG-CD1 4.24Å; M65-I69 WeakPolarHBondContact O-CG1 3.37Å; M65-I69 PolarHBondContact O-N 3.39Å |
| 66 | L | 95.2 | Very high | 93.3 | Very high | 35 Ų | 35 | 55.3 Ų | 55.3 | 18% | 0.183 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -61.5 | -43.9 | -179.5 | -73.7 | 176.7 | 0 | 0 | 0 | 112.7 | L62 I63 I69 V70 W322 | L62-L66 HydrophobicContact CG-CD1 4.15Å; L62-L66 WeakPolarHBondContact O-CB 3.46Å; L62-L66 VanDerWaalsContact O-CG 3.28Å; L62-L66 WeakPolarHBondContact O-CG 3.32Å; L62-L66 PolarHBondContact O-N 2.78Å; I63-L66 PolarHBondContact O-N 3.43Å; L66-I69 PolarHBondContact O-N 3.45Å; L66-V70 WeakPolarHBondContact O-CG2 3.27Å; L66-V70 PolarHBondContact O-N 3.48Å; L66-W322 HydrophobicContact CB-CZ2 4.37Å; L66-W322 HydrophobicContact CD2-CH2 4.45Å; L66-W322 HydrophobicContact CD2-CZ2 3.85Å; L66-W322 HydrophobicContact CG-CZ2 4.5Å; L66-W322 PolarHBondContact O-NE1 3.02Å; L66-W322 VanDerWaalsContact O-NE1 3.17Å |
| 67 | Y | 95.2 | Very high | 93.7 | Very high | 3 Ų | 3 | 55.7 Ų | 55.7 | 1% | 0.012 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -69.6 | -36.4 | 175.3 | -85.1 | -106.3 | 0 | 0 | 0 | 112.3 | I63 M65 I69 V70 V71 V114 L118 L318 H321 W322 | I63-Y67 HydrophobicContact CG2-CD2 3.8Å; I63-Y67 HydrophobicContact CG2-CE2 3.83Å; I63-Y67 WeakPolarHBondContact O-CD2 3.46Å; I63-Y67 PolarHBondContact O-N 2.8Å; M65-Y67 PolarHBondContact O-N 3.08Å; Y67-I69 VanDerWaalsContact C-N 3.31Å; Y67-I69 PolarHBondContact O-N 2.86Å; Y67-V70 WeakPolarHBondContact O-CB 3.28Å; Y67-V70 PolarHBondContact O-N 3.03Å; Y67-V70 VanDerWaalsContact O-N 3.11Å; Y67-V71 WeakPolarHBondContact O-CG2 3.33Å; Y67-V71 PolarHBondContact O-N 3.36Å; Y67-V114 HydrophobicContact CD1-CG1 3.58Å; Y67-V114 HydrophobicContact CE1-CG1 4.23Å; Y67-L118 HydrophobicContact CD1-CB 4.28Å; Y67-L118 HydrophobicContact CD1-CD1 4.03Å; Y67-L118 HydrophobicContact CD2-CD1 3.88Å; Y67-L118 HydrophobicContact CE2-CD1 4.31Å; Y67-L118 HydrophobicContact CG-CD1 3.72Å; Y67-L118 HydrophobicContact CG-CD2 4.23Å; Y67-L118 HydrophobicContact CG-CG 4.42Å; Y67-L318 PolarHBondContact OH-O 3.37Å; Y67-H321 AromaticContact CE1-ND1 3.77Å; Y67-H321 AromaticContact CZ-ND1 3.73Å; Y67-H321 PolarHBondContact OH-ND1 3.2Å; Y67-W322 HydrophobicContact CD2-CB 4.27Å; Y67-W322 AromaticContact CD2-CD1 3.69Å; Y67-W322 HydrophobicContact CD2-CG 4.29Å; Y67-W322 HydrophobicContact CE2-CB 3.52Å; Y67-W322 AromaticContact CE2-CD1 3.83Å; Y67-W322 HydrophobicContact CE2-CG 4Å; Y67-W322 WeakPolarHBondContact OH-CA 3.41Å; Y67-W322 PolarHBondContact OH-N 3.02Å |
| 68 | S | 95.6 | Very high | 94.2 | Very high | 56 Ų | 56 | 52.1 Ų | 52.1 | 39% | 0.392 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63 | -39.5 | 176.2 | -61 | 0 | 0 | 0 | 0 | 111.4 | V64 M65 V70 V71 V72 | V64-S68 VanDerWaalsContact O-CB 3.24Å; V64-S68 WeakPolarHBondContact O-CB 3.19Å; V64-S68 PolarHBondContact O-N 3.49Å; V64-S68 PolarHBondContact O-OG 2.91Å; M65-S68 PolarHBondContact O-N 3.08Å; S68-V70 VanDerWaalsContact C-N 3.31Å; S68-V70 PolarHBondContact O-N 3.18Å; S68-V71 PolarHBondContact O-N 2.95Å; S68-V72 WeakPolarHBondContact O-CB 3.4Å; S68-V72 VanDerWaalsContact O-CG2 3.31Å; S68-V72 WeakPolarHBondContact O-CG2 3.46Å; S68-V72 PolarHBondContact O-N 3.13Å |
| 69 | I | 95.9 | Very high | 94.6 | Very high | 90 Ų | 90 | 47.8 Ų | 47.8 | 46% | 0.462 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -58.9 | -45.7 | 172.4 | -68.5 | 164.8 | 0 | 0 | 0 | 110.1 | M65 L66 Y67 V71 V72 V73 | M65-I69 HydrophobicContact CG-CD1 4.24Å; M65-I69 WeakPolarHBondContact O-CG1 3.37Å; M65-I69 PolarHBondContact O-N 3.39Å; L66-I69 PolarHBondContact O-N 3.45Å; Y67-I69 VanDerWaalsContact C-N 3.31Å; Y67-I69 PolarHBondContact O-N 2.86Å; I69-V71 PolarHBondContact O-N 2.91Å; I69-V72 PolarHBondContact O-N 3.47Å; I69-V73 HydrophobicContact CG2-CG2 4.05Å; I69-V73 VanDerWaalsContact O-CB 3.26Å; I69-V73 WeakPolarHBondContact O-CB 3.38Å; I69-V73 VanDerWaalsContact O-CG2 3.26Å; I69-V73 WeakPolarHBondContact O-CG2 3.23Å; I69-V73 PolarHBondContact O-N 3.22Å |
| 70 | V | 95.3 | Very high | 94.6 | Very high | 4 Ų | 4 | 47.8 Ų | 47.8 | 2% | 0.024 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.4 | -46.5 | 178.8 | 171.6 | 0 | 0 | 0 | 0 | 111.5 | L66 Y67 S68 G74 M325 C329 | L66-V70 WeakPolarHBondContact O-CG2 3.27Å; L66-V70 PolarHBondContact O-N 3.48Å; Y67-V70 WeakPolarHBondContact O-CB 3.28Å; Y67-V70 PolarHBondContact O-N 3.03Å; Y67-V70 VanDerWaalsContact O-N 3.11Å; S68-V70 VanDerWaalsContact C-N 3.31Å; S68-V70 PolarHBondContact O-N 3.18Å; V70-G74 WeakPolarHBondContact O-CA 3.19Å; V70-G74 PolarHBondContact O-N 3.35Å; V70-M325 HydrophobicContact CG1-CB 4.25Å; V70-C329 VanDerWaalsContact CA-SG 3.59Å; V70-C329 PolarHBondContact O-SG 3.39Å; V70-C329 VanDerWaalsContact O-SG 3.4Å |
| 71 | V | 96.5 | Very high | 94.6 | Very high | 30 Ų | 30 | 43.7 Ų | 43.7 | 18% | 0.182 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62.6 | -49 | 179 | 172.9 | 0 | 0 | 0 | 0 | 111 | Y67 S68 I69 L75 V114 P115 | Y67-V71 WeakPolarHBondContact O-CG2 3.33Å; Y67-V71 PolarHBondContact O-N 3.36Å; S68-V71 PolarHBondContact O-N 2.95Å; I69-V71 PolarHBondContact O-N 2.91Å; V71-L75 HydrophobicContact CG1-CD1 3.65Å; V71-L75 HydrophobicContact CG1-CG 4.35Å; V71-L75 WeakPolarHBondContact O-CB 3.14Å; V71-L75 WeakPolarHBondContact O-CG 2.86Å; V71-L75 PolarHBondContact O-N 3.48Å; V71-V114 HydrophobicContact CG2-CB 4.11Å; V71-V114 HydrophobicContact CG2-CG1 3.63Å; V71-P115 HydrophobicContact CG2-CG 4.07Å |
| 72 | V | 96.4 | Very high | 94.6 | Very high | 88 Ų | 88 | 43.6 Ų | 43.6 | 53% | 0.533 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.6 | -51.4 | -177.7 | 171.1 | 0 | 0 | 0 | 0 | 111 | S68 I69 V76 | S68-V72 WeakPolarHBondContact O-CB 3.4Å; S68-V72 VanDerWaalsContact O-CG2 3.31Å; S68-V72 WeakPolarHBondContact O-CG2 3.46Å; S68-V72 PolarHBondContact O-N 3.13Å; I69-V72 PolarHBondContact O-N 3.47Å; V72-V76 HydrophobicContact CG1-CG2 4.46Å; V72-V76 VanDerWaalsContact O-CB 3.28Å; V72-V76 WeakPolarHBondContact O-CB 3.44Å; V72-V76 VanDerWaalsContact O-CG2 3.23Å; V72-V76 WeakPolarHBondContact O-CG2 3.36Å; V72-V76 PolarHBondContact O-N 3.13Å |
| 73 | V | 95.6 | Very high | 94.4 | Very high | 42 Ų | 42 | 43.5 Ų | 43.5 | 26% | 0.255 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -67.3 | -44.4 | -177.4 | 174.4 | 0 | 0 | 0 | 0 | 110.8 | I69 G77 C329 F333 | I69-V73 HydrophobicContact CG2-CG2 4.05Å; I69-V73 VanDerWaalsContact O-CB 3.26Å; I69-V73 WeakPolarHBondContact O-CB 3.38Å; I69-V73 VanDerWaalsContact O-CG2 3.26Å; I69-V73 WeakPolarHBondContact O-CG2 3.23Å; I69-V73 PolarHBondContact O-N 3.22Å; V73-G77 WeakPolarHBondContact O-CA 3.38Å; V73-G77 PolarHBondContact O-N 3.49Å; V73-C329 HydrophobicContact CB-CB 4.4Å; V73-C329 HydrophobicContact CG1-CB 3.75Å; V73-F333 HydrophobicContact CG1-CE2 3.44Å; V73-F333 VanDerWaalsContact CG1-CE2 3.44Å; V73-F333 HydrophobicContact CG1-CZ 3.78Å |
| 74 | G | 95.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.9 | -48.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | V70 N78 | V70-G74 WeakPolarHBondContact O-CA 3.19Å; V70-G74 PolarHBondContact O-N 3.35Å; G74-N78 VanDerWaalsContact O-CB 3.22Å; G74-N78 WeakPolarHBondContact O-CB 3.28Å; G74-N78 PolarHBondContact O-N 3.44Å; G74-N78 VanDerWaalsContact O-N 3.1Å; G74-N78 PolarHBondContact O-ND2 3.41Å |
| 75 | L | 96.1 | Very high | 93.9 | Very high | 47 Ų | 47 | 41.7 Ų | 41.7 | 25% | 0.246 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.7 | -52.7 | 178.8 | -70.6 | 175.6 | 0 | 0 | 0 | 112.1 | V71 G77 C79 V107 C110 A111 | V71-L75 HydrophobicContact CG1-CD1 3.65Å; V71-L75 HydrophobicContact CG1-CG 4.35Å; V71-L75 WeakPolarHBondContact O-CB 3.14Å; V71-L75 WeakPolarHBondContact O-CG 2.86Å; V71-L75 PolarHBondContact O-N 3.48Å; L75-G77 PolarHBondContact O-N 2.99Å; L75-C79 WeakPolarHBondContact O-CB 3.15Å; L75-C79 PolarHBondContact O-N 3.31Å; L75-C79 PolarHBondContact O-SG 3.36Å; L75-V107 HydrophobicContact CD2-CG1 4.1Å; L75-C110 HydrophobicContact CD2-CB 3.84Å; L75-C110 HydrophobicContact CG-CB 3.9Å; L75-A111 HydrophobicContact CD2-CB 3.83Å |
| 76 | V | 94.9 | Very high | 93.7 | Very high | 84 Ų | 84 | 40.2 Ų | 40.2 | 51% | 0.509 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.5 | -48.6 | -176.5 | 173.9 | 0 | 0 | 0 | 0 | 110.3 | V72 L80 | V72-V76 HydrophobicContact CG1-CG2 4.46Å; V72-V76 VanDerWaalsContact O-CB 3.28Å; V72-V76 WeakPolarHBondContact O-CB 3.44Å; V72-V76 VanDerWaalsContact O-CG2 3.23Å; V72-V76 WeakPolarHBondContact O-CG2 3.36Å; V72-V76 PolarHBondContact O-N 3.13Å; V76-L80 HydrophobicContact CG1-CD1 3.87Å; V76-L80 HydrophobicContact CG1-CG 4.46Å; V76-L80 WeakPolarHBondContact O-CB 3.18Å; V76-L80 WeakPolarHBondContact O-CG 3.34Å; V76-L80 PolarHBondContact O-N 3.14Å |
| 77 | G | 92.9 | Very high | 93.3 | Very high | 16 Ų | 16 | 47.3 Ų | 47.3 | 17% | 0.165 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.6 | -48.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V73 L75 L80 L81 | V73-G77 WeakPolarHBondContact O-CA 3.38Å; V73-G77 PolarHBondContact O-N 3.49Å; L75-G77 PolarHBondContact O-N 2.99Å; G77-L80 PolarHBondContact O-N 3.1Å; G77-L81 WeakPolarHBondContact O-CB 3.49Å; G77-L81 PolarHBondContact O-N 3.49Å |
| 78 | N | 95.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -74 | -35.4 | -177.9 | -70.9 | -65.8 | 0 | 0 | 0 | 112.3 | G74 L81 V82 A103 D106 V107 A328 P332 | G74-N78 VanDerWaalsContact O-CB 3.22Å; G74-N78 WeakPolarHBondContact O-CB 3.28Å; G74-N78 PolarHBondContact O-N 3.44Å; G74-N78 VanDerWaalsContact O-N 3.1Å; G74-N78 PolarHBondContact O-ND2 3.41Å; N78-L81 WeakPolarHBondContact O-CB 3.41Å; N78-L81 PolarHBondContact O-N 2.89Å; N78-V82 WeakPolarHBondContact O-CG2 3.43Å; N78-V82 PolarHBondContact O-N 3.33Å; N78-A103 HydrophobicContact CB-CB 4.09Å; N78-D106 HydrophobicContact CB-CB 4.48Å; N78-V107 HydrophobicContact CB-CG2 3.65Å; N78-A328 PolarHBondContact ND2-O 3Å; N78-P332 HydrophobicContact CB-CG 4.44Å; N78-P332 WeakPolarHBondContact OD1-CG 3.38Å |
| 79 | C | 94.8 | Very high | 92.3 | Very high | 54 Ų | 54 | 55.9 Ų | 55.9 | 37% | 0.365 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.7 | -45.4 | 170.7 | -74.7 | 0 | 0 | 0 | 0 | 111.6 | L75 L81 V82 L83 | L75-C79 WeakPolarHBondContact O-CB 3.15Å; L75-C79 PolarHBondContact O-N 3.31Å; L75-C79 PolarHBondContact O-SG 3.36Å; C79-L81 VanDerWaalsContact C-N 3.3Å; C79-L81 PolarHBondContact O-N 3.31Å; C79-V82 PolarHBondContact O-N 3.23Å; C79-L83 WeakPolarHBondContact O-CB 3Å; C79-L83 WeakPolarHBondContact O-CG 3.46Å; C79-L83 PolarHBondContact O-N 3.41Å |
| 80 | L | 91.6 | Very high | 91.6 | Very high | 63 Ų | 63 | 57.7 Ų | 57.7 | 33% | 0.33 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.9 | -41.1 | 175.1 | -73.8 | 172.2 | 0 | 0 | 0 | 111.7 | V76 G77 L83 V84 | V76-L80 HydrophobicContact CG1-CD1 3.87Å; V76-L80 HydrophobicContact CG1-CG 4.46Å; V76-L80 WeakPolarHBondContact O-CB 3.18Å; V76-L80 WeakPolarHBondContact O-CG 3.34Å; V76-L80 PolarHBondContact O-N 3.14Å; G77-L80 PolarHBondContact O-N 3.1Å; L80-L83 PolarHBondContact O-N 2.97Å; L80-V84 WeakPolarHBondContact O-CG2 3.31Å; L80-V84 PolarHBondContact O-N 2.99Å |
| 81 | L | 90.6 | Very high | 91 | Very high | 4 Ų | 4 | 57.9 Ų | 57.9 | 2% | 0.021 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59.9 | -48.4 | 176.8 | -170.5 | 55.6 | 0 | 0 | 0 | 111.5 | G77 N78 C79 I85 I99 A103 Y335 F342 | G77-L81 WeakPolarHBondContact O-CB 3.49Å; G77-L81 PolarHBondContact O-N 3.49Å; N78-L81 WeakPolarHBondContact O-CB 3.41Å; N78-L81 PolarHBondContact O-N 2.89Å; C79-L81 VanDerWaalsContact C-N 3.3Å; C79-L81 PolarHBondContact O-N 3.31Å; L81-I85 HydrophobicContact CD1-CD1 4.08Å; L81-I85 HydrophobicContact CG-CD1 4.06Å; L81-I85 WeakPolarHBondContact O-CB 3.34Å; L81-I85 WeakPolarHBondContact O-CD1 3.41Å; L81-I85 VanDerWaalsContact O-CG1 3.24Å; L81-I85 WeakPolarHBondContact O-CG1 3.5Å; L81-I85 PolarHBondContact O-N 2.82Å; L81-I85 VanDerWaalsContact O-N 3.08Å; L81-I99 HydrophobicContact CD1-CG2 4.23Å; L81-I99 HydrophobicContact CD2-CG2 3.71Å; L81-I99 HydrophobicContact CG-CG2 4.06Å; L81-A103 HydrophobicContact CB-CB 4.4Å; L81-A103 HydrophobicContact CD2-CB 4.11Å; L81-A103 HydrophobicContact CG-CB 4.37Å; L81-Y335 HydrophobicContact CD2-CD2 3.7Å; L81-Y335 HydrophobicContact CD2-CE2 4.33Å; L81-Y335 HydrophobicContact CD2-CG 4.45Å; L81-F342 HydrophobicContact CD1-CD2 4.15Å; L81-F342 HydrophobicContact CD1-CE2 3.37Å; L81-F342 HydrophobicContact CD1-CZ 3.64Å |
| 82 | V | 92.9 | Very high | 90.6 | Very high | 55 Ų | 55 | 61 Ų | 61 | 33% | 0.333 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60.1 | -46.8 | 175.1 | 173.6 | 0 | 0 | 0 | 0 | 111.2 | N78 C79 V84 I85 A86 A103 | N78-V82 WeakPolarHBondContact O-CG2 3.43Å; N78-V82 PolarHBondContact O-N 3.33Å; C79-V82 PolarHBondContact O-N 3.23Å; V82-V84 PolarHBondContact O-N 3.17Å; V82-I85 PolarHBondContact O-N 2.9Å; V82-A86 WeakPolarHBondContact O-CB 3.24Å; V82-A86 PolarHBondContact O-N 2.92Å; V82-A103 HydrophobicContact CG2-CB 3.58Å |
| 83 | L | 90.9 | Very high | 90.2 | Very high | 86 Ų | 86 | 59.7 Ų | 59.7 | 45% | 0.45 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.4 | -45.7 | -178.9 | -73.1 | 170.5 | 0 | 0 | 0 | 112.5 | C79 L80 A86 R87 | C79-L83 WeakPolarHBondContact O-CB 3Å; C79-L83 WeakPolarHBondContact O-CG 3.46Å; C79-L83 PolarHBondContact O-N 3.41Å; L80-L83 PolarHBondContact O-N 2.97Å; L83-A86 PolarHBondContact O-N 2.81Å; L83-R87 WeakPolarHBondContact O-CB 3.46Å; L83-R87 VanDerWaalsContact O-CG 3.23Å; L83-R87 WeakPolarHBondContact O-CG 3.26Å; L83-R87 PolarHBondContact O-N 3.01Å; L83-R87 VanDerWaalsContact O-N 3.07Å |
| 84 | V | 88.1 | Confident | 89.8 | Confident | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.1 | -45.1 | 178.2 | 170.4 | 0 | 0 | 0 | 0 | 110.4 | L80 V82 A86 R87 V88 L91 F342 E345 L346 M349 | L80-V84 WeakPolarHBondContact O-CG2 3.31Å; L80-V84 PolarHBondContact O-N 2.99Å; V82-V84 PolarHBondContact O-N 3.17Å; V84-A86 VanDerWaalsContact C-N 3.34Å; V84-A86 PolarHBondContact O-N 3.27Å; V84-R87 PolarHBondContact O-N 3.3Å; V84-V88 HydrophobicContact CG1-CG2 4.25Å; V84-V88 WeakPolarHBondContact O-CB 3.48Å; V84-V88 VanDerWaalsContact O-CG2 3.31Å; V84-V88 WeakPolarHBondContact O-CG2 3.26Å; V84-V88 PolarHBondContact O-N 2.9Å; V84-V88 VanDerWaalsContact O-N 3.08Å; V84-L91 HydrophobicContact CG1-CD1 3.82Å; V84-F342 HydrophobicContact CB-CD2 4.17Å; V84-F342 HydrophobicContact CB-CE2 3.51Å; V84-F342 HydrophobicContact CB-CZ 4.13Å; V84-F342 HydrophobicContact CG1-CD2 3.53Å; V84-F342 HydrophobicContact CG1-CE2 3.43Å; V84-F342 VanDerWaalsContact CG1-CE2 3.43Å; V84-F342 HydrophobicContact CG1-CG 4.48Å; V84-F342 HydrophobicContact CG1-CZ 4.32Å; V84-F342 HydrophobicContact CG2-CE2 3.94Å; V84-F342 HydrophobicContact CG2-CZ 4.06Å; V84-E345 HydrophobicContact CG1-CB 4.26Å; V84-L346 HydrophobicContact CG2-CD1 4.34Å; V84-M349 HydrophobicContact CG2-CE 4.5Å; V84-M349 HydrophobicContact CG2-SD 3.71Å |
| 85 | I | 88.9 | Confident | 89.4 | Confident | 19 Ų | 19 | 58.8 Ų | 58.8 | 10% | 0.097 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 178.8 | -68.4 | 165.1 | 0 | 0 | 0 | 110.5 | L81 V82 R87 H92 N96 I99 | L81-I85 HydrophobicContact CD1-CD1 4.08Å; L81-I85 HydrophobicContact CG-CD1 4.06Å; L81-I85 WeakPolarHBondContact O-CB 3.34Å; L81-I85 WeakPolarHBondContact O-CD1 3.41Å; L81-I85 VanDerWaalsContact O-CG1 3.24Å; L81-I85 WeakPolarHBondContact O-CG1 3.5Å; L81-I85 PolarHBondContact O-N 2.82Å; L81-I85 VanDerWaalsContact O-N 3.08Å; V82-I85 PolarHBondContact O-N 2.9Å; I85-R87 PolarHBondContact O-N 2.95Å; I85-H92 PolarHBondContact O-CD2 3.23Å; I85-H92 PolarHBondContact O-NE2 2.83Å; I85-N96 HydrophobicContact CG2-CB 4.48Å; I85-I99 HydrophobicContact CD1-CB 4.36Å; I85-I99 HydrophobicContact CD1-CG2 3.95Å |
| 86 | A | 89.3 | Confident | 89.1 | Confident | 68 Ų | 68 | 57.1 Ų | 57.1 | 56% | 0.562 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -68.3 | -32.5 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | V82 L83 V84 | V82-A86 WeakPolarHBondContact O-CB 3.24Å; V82-A86 PolarHBondContact O-N 2.92Å; L83-A86 PolarHBondContact O-N 2.81Å; V84-A86 VanDerWaalsContact C-N 3.34Å; V84-A86 PolarHBondContact O-N 3.27Å |
| 87 | R | 87.8 | Confident | 88.9 | Confident | 185 Ų | 185 | 57.2 Ų | 57.2 | 70% | 0.698 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -84.8 | -33.1 | -177.3 | -71.1 | -71.3 | -173.2 | 84.6 | 0.9 | 113 | L83 V84 I85 R89 M349 | L83-R87 WeakPolarHBondContact O-CB 3.46Å; L83-R87 VanDerWaalsContact O-CG 3.23Å; L83-R87 WeakPolarHBondContact O-CG 3.26Å; L83-R87 PolarHBondContact O-N 3.01Å; L83-R87 VanDerWaalsContact O-N 3.07Å; V84-R87 PolarHBondContact O-N 3.3Å; I85-R87 PolarHBondContact O-N 2.95Å; R87-R89 PolarHBondContact O-N 2.92Å; R87-M349 HydrophobicContact CB-CE 3.29Å; R87-M349 HydrophobicContact CG-CE 3.53Å |
| 88 | V | 84.6 | Confident | 88.9 | Confident | 15 Ų | 15 | 56.5 Ų | 56.5 | 9% | 0.091 | 27% | 0.27 | C | S | . | . | trans | -98 | 96.9 | -171.7 | -171.9 | 0 | 0 | 0 | 0 | 109.9 | V84 R90 L91 E345 | V84-V88 HydrophobicContact CG1-CG2 4.25Å; V84-V88 WeakPolarHBondContact O-CB 3.48Å; V84-V88 VanDerWaalsContact O-CG2 3.31Å; V84-V88 WeakPolarHBondContact O-CG2 3.26Å; V84-V88 PolarHBondContact O-N 2.9Å; V84-V88 VanDerWaalsContact O-N 3.08Å; V88-R90 HydrophobicContact CG1-CB 4.25Å; V88-R90 HydrophobicContact CG1-CG 3.58Å; V88-R90 PolarHBondContact O-N 2.9Å; V88-L91 HydrophobicContact CB-CB 4.47Å; V88-L91 HydrophobicContact CB-CD1 3.93Å; V88-L91 HydrophobicContact CB-CG 4Å; V88-L91 HydrophobicContact CG1-CD1 4.26Å; V88-L91 HydrophobicContact CG1-CG 3.93Å; V88-L91 HydrophobicContact CG2-CD1 4.44Å; V88-L91 WeakPolarHBondContact O-CB 3.06Å; V88-L91 PolarHBondContact O-N 3.42Å; V88-E345 HydrophobicContact CG1-CG 4.09Å; V88-E345 HydrophobicContact CG2-CB 3.97Å; V88-E345 HydrophobicContact CG2-CG 3.9Å | ||
| 89 | R | 84.8 | Confident | 88.8 | Confident | 223 Ų | 223 | 56.9 Ų | 56.9 | 84% | 0.842 | 27% | 0.272 | S | S | * | . | G | 310 helix | trans | -52.1 | -32 | 178.4 | -76.6 | -169.2 | 177 | 126.1 | -1.5 | 114.2 | R87 L91 H92 | R87-R89 PolarHBondContact O-N 2.92Å; R89-L91 PolarHBondContact O-N 2.82Å; R89-H92 WeakPolarHBondContact O-CB 3.36Å; R89-H92 PolarHBondContact O-N 2.96Å |
| 90 | R | 82.4 | Confident | 88.7 | Confident | 128 Ų | 128 | 55.1 Ų | 55.1 | 48% | 0.483 | 26% | 0.263 | S | S | . | . | G | 310 helix | trans | -61.7 | -22.7 | 177.2 | 94.5 | -161.4 | 174 | 152 | -1.6 | 113.1 | V88 S341 E344 E345 | V88-R90 HydrophobicContact CG1-CB 4.25Å; V88-R90 HydrophobicContact CG1-CG 3.58Å; V88-R90 PolarHBondContact O-N 2.9Å; R90-S341 VanDerWaalsContact NH2-CB 3.29Å; R90-S341 PolarHBondContact NH2-O 3.36Å; R90-E344 IonicContact NH1-OE2 3.28Å; R90-E344 IonicContact NH2-OE2 2.94Å; R90-E344 PolarHBondContact NH2-OE2 3.31Å; R90-E345 IonicContact CZ-OE1 3.72Å; R90-E345 IonicContact NE-OE1 2.75Å; R90-E345 IonicContact NH1-OE1 3.17Å; R90-E345 VanDerWaalsContact NH2-CG 3.33Å; R90-E345 IonicContact NH2-OE1 2.82Å; R90-E345 PolarHBondContact NH2-OE1 2.88Å |
| 91 | L | 82.7 | Confident | 88.9 | Confident | 8 Ų | 8 | 52.7 Ų | 52.7 | 4% | 0.042 | 25% | 0.25 | C | C | . | . | G | 310 helix | trans | -88.6 | -4.9 | 177.9 | -60.2 | -178.3 | 0 | 0 | 0 | 112.5 | V84 V88 R89 N93 N96 | V84-L91 HydrophobicContact CG1-CD1 3.82Å; V88-L91 HydrophobicContact CB-CB 4.47Å; V88-L91 HydrophobicContact CB-CD1 3.93Å; V88-L91 HydrophobicContact CB-CG 4Å; V88-L91 HydrophobicContact CG1-CD1 4.26Å; V88-L91 HydrophobicContact CG1-CG 3.93Å; V88-L91 HydrophobicContact CG2-CD1 4.44Å; V88-L91 WeakPolarHBondContact O-CB 3.06Å; V88-L91 PolarHBondContact O-N 3.42Å; R89-L91 PolarHBondContact O-N 2.82Å; L91-N93 VanDerWaalsContact C-N 3.28Å; L91-N93 PolarHBondContact O-N 3.21Å; L91-N96 WeakPolarHBondContact O-CB 3.32Å; L91-N96 PolarHBondContact O-ND2 2.86Å |
| 92 | H | 87.9 | Confident | 89.1 | Confident | 97 Ų | 97 | 52.5 Ų | 52.5 | 45% | 0.449 | 25% | 0.249 | S | C | . | . | trans | -75.4 | 76.9 | -178.7 | -66.1 | -176.4 | 0 | 0 | 0 | 112.3 | I85 R89 | I85-H92 PolarHBondContact O-CD2 3.23Å; I85-H92 PolarHBondContact O-NE2 2.83Å; R89-H92 WeakPolarHBondContact O-CB 3.36Å; R89-H92 PolarHBondContact O-N 2.96Å | ||
| 93 | N | 86.9 | Confident | 89.2 | Confident | 59 Ų | 59 | 49.9 Ų | 49.9 | 32% | 0.316 | 23% | 0.233 | S | C | . | . | S | Bend | trans | -127.7 | 169 | 172.1 | 65 | 61 | 0 | 0 | 0 | 110.3 | L91 T95 N96 F97 | L91-N93 VanDerWaalsContact C-N 3.28Å; L91-N93 PolarHBondContact O-N 3.21Å; N93-T95 VanDerWaalsContact C-N 3.34Å; N93-T95 PolarHBondContact O-N 3.29Å; N93-T95 PolarHBondContact OD1-N 3.4Å; N93-T95 VanDerWaalsContact OD1-N 3.17Å; N93-N96 PolarHBondContact ND2-ND2 3.33Å; N93-N96 PolarHBondContact O-N 3.47Å; N93-N96 PolarHBondContact OD1-N 2.86Å; N93-F97 WeakPolarHBondContact O-CB 3.29Å; N93-F97 PolarHBondContact O-N 3.48Å |
| 94 | V | 88.3 | Confident | 89.5 | Confident | 15 Ų | 15 | 49.9 Ų | 49.9 | 9% | 0.091 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -52.6 | -47 | -176.7 | 167.3 | 0 | 0 | 0 | 0 | 113.1 | F97 L98 I171 L173 S176 | V94-F97 WeakPolarHBondContact O-CB 3.38Å; V94-F97 PolarHBondContact O-N 3.5Å; V94-L98 HydrophobicContact CG1-CD1 4.22Å; V94-L98 WeakPolarHBondContact O-CG 3.32Å; V94-L98 PolarHBondContact O-N 3.1Å; V94-I171 HydrophobicContact CG1-CG2 4.46Å; V94-I171 WeakPolarHBondContact CG2-O 3.3Å; V94-L173 HydrophobicContact CG2-CD2 4.31Å; V94-L173 HydrophobicContact CG2-CG 4.45Å; V94-S176 WeakPolarHBondContact CG1-OG 3.45Å; V94-S176 WeakPolarHBondContact CG2-OG 3.11Å |
| 95 | T | 86.6 | Confident | 89.9 | Confident | 9 Ų | 9 | 49.9 Ų | 49.9 | 6% | 0.055 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -67.4 | -43.6 | -177.7 | -61.5 | 0 | 0 | 0 | 0 | 112.2 | N93 F97 L98 I99 I155 D158 R159 | N93-T95 VanDerWaalsContact C-N 3.34Å; N93-T95 PolarHBondContact O-N 3.29Å; N93-T95 PolarHBondContact OD1-N 3.4Å; N93-T95 VanDerWaalsContact OD1-N 3.17Å; T95-F97 VanDerWaalsContact C-N 3.28Å; T95-F97 PolarHBondContact O-N 2.9Å; T95-L98 CarbonylContact O-C 3.59Å; T95-L98 PolarHBondContact O-N 3.48Å; T95-I99 HydrophobicContact CG2-CD1 3.84Å; T95-I99 HydrophobicContact CG2-CG1 4.36Å; T95-I99 VanDerWaalsContact O-CG1 3.26Å; T95-I99 WeakPolarHBondContact O-CG1 3.2Å; T95-I99 PolarHBondContact O-N 3.17Å; T95-I155 HydrophobicContact CG2-CG2 3.95Å; T95-D158 PolarHBondContact OG1-OD2 3.12Å; T95-R159 PolarHBondContact OG1-NE 3.26Å; T95-R159 PolarHBondContact OG1-NH2 2.93Å |
| 96 | N | 88.8 | Confident | 90.2 | Very high | 12 Ų | 12 | 49 Ų | 49 | 6% | 0.064 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -68.6 | -30.2 | 177.7 | -71.6 | -18.9 | 0 | 0 | 0 | 112 | I85 L91 N93 I99 G100 | I85-N96 HydrophobicContact CG2-CB 4.48Å; L91-N96 WeakPolarHBondContact O-CB 3.32Å; L91-N96 PolarHBondContact O-ND2 2.86Å; N93-N96 PolarHBondContact ND2-ND2 3.33Å; N93-N96 PolarHBondContact O-N 3.47Å; N93-N96 PolarHBondContact OD1-N 2.86Å; N96-I99 PolarHBondContact O-N 2.92Å; N96-G100 PolarHBondContact O-N 3.04Å |
| 97 | F | 91.9 | Very high | 90.6 | Very high | 85 Ų | 85 | 47.1 Ų | 47.1 | 37% | 0.373 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -62.5 | -44.7 | 169.5 | 179.3 | -101.5 | 0 | 0 | 0 | 111.6 | N93 V94 T95 G100 N101 L173 A177 V180 | N93-F97 WeakPolarHBondContact O-CB 3.29Å; N93-F97 PolarHBondContact O-N 3.48Å; V94-F97 WeakPolarHBondContact O-CB 3.38Å; V94-F97 PolarHBondContact O-N 3.5Å; T95-F97 VanDerWaalsContact C-N 3.28Å; T95-F97 PolarHBondContact O-N 2.9Å; F97-G100 PolarHBondContact O-N 2.91Å; F97-N101 PolarHBondContact O-N 3.45Å; F97-L173 HydrophobicContact CB-CD2 4.08Å; F97-L173 HydrophobicContact CG-CD2 4.41Å; F97-A177 HydrophobicContact CE1-CB 4.46Å; F97-A177 HydrophobicContact CZ-CB 4.37Å; F97-V180 HydrophobicContact CD1-CG2 4.37Å; F97-V180 HydrophobicContact CE1-CB 4.39Å; F97-V180 HydrophobicContact CE1-CG2 3.72Å |
| 98 | L | 92.6 | Very high | 91 | Very high | 1 Ų | 1 | 41.2 Ų | 41.2 | 1% | 0.005 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.3 | -38.1 | 174.5 | -66.6 | 171.9 | 0 | 0 | 0 | 112.5 | V94 T95 G100 N101 L102 T151 T154 I155 V180 | V94-L98 HydrophobicContact CG1-CD1 4.22Å; V94-L98 WeakPolarHBondContact O-CG 3.32Å; V94-L98 PolarHBondContact O-N 3.1Å; T95-L98 CarbonylContact O-C 3.59Å; T95-L98 PolarHBondContact O-N 3.48Å; L98-G100 VanDerWaalsContact C-N 3.28Å; L98-G100 PolarHBondContact O-N 3.06Å; L98-N101 WeakPolarHBondContact O-CB 3.1Å; L98-N101 PolarHBondContact O-N 3.4Å; L98-N101 VanDerWaalsContact O-N 3.16Å; L98-L102 PolarHBondContact O-N 3.33Å; L98-T151 HydrophobicContact CB-CG2 4.09Å; L98-T151 WeakPolarHBondContact O-CG2 3.27Å; L98-T154 HydrophobicContact CD1-CG2 3.77Å; L98-T154 HydrophobicContact CD2-CG2 4.26Å; L98-I155 HydrophobicContact CB-CD1 3.9Å; L98-I155 HydrophobicContact CB-CG1 3.51Å; L98-I155 HydrophobicContact CD1-CG1 3.79Å; L98-I155 HydrophobicContact CG-CG1 4.29Å; L98-V180 HydrophobicContact CD2-CG2 3.82Å |
| 99 | I | 91.9 | Very high | 91.5 | Very high | 9 Ų | 9 | 40.6 Ų | 40.6 | 5% | 0.046 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.2 | -38.7 | 172.8 | -68.1 | 166.4 | 0 | 0 | 0 | 110.4 | L81 I85 T95 N96 L102 A103 I155 Y335 | L81-I99 HydrophobicContact CD1-CG2 4.23Å; L81-I99 HydrophobicContact CD2-CG2 3.71Å; L81-I99 HydrophobicContact CG-CG2 4.06Å; I85-I99 HydrophobicContact CD1-CB 4.36Å; I85-I99 HydrophobicContact CD1-CG2 3.95Å; T95-I99 HydrophobicContact CG2-CD1 3.84Å; T95-I99 HydrophobicContact CG2-CG1 4.36Å; T95-I99 VanDerWaalsContact O-CG1 3.26Å; T95-I99 WeakPolarHBondContact O-CG1 3.2Å; T95-I99 PolarHBondContact O-N 3.17Å; N96-I99 PolarHBondContact O-N 2.92Å; I99-L102 WeakPolarHBondContact O-CB 3.18Å; I99-L102 PolarHBondContact O-N 2.83Å; I99-A103 WeakPolarHBondContact O-CB 3.22Å; I99-A103 PolarHBondContact O-N 3.06Å; I99-I155 HydrophobicContact CG1-CD1 4.06Å; I99-Y335 HydrophobicContact CD1-CD1 3.83Å; I99-Y335 HydrophobicContact CD1-CE1 3.45Å; I99-Y335 VanDerWaalsContact CD1-CE1 3.45Å; I99-Y335 HydrophobicContact CG1-CD1 4.44Å; I99-Y335 HydrophobicContact CG1-CE1 3.75Å; I99-Y335 HydrophobicContact CG1-CE2 4.46Å; I99-Y335 HydrophobicContact CG2-CD1 4.46Å; I99-Y335 HydrophobicContact CG2-CD2 4.03Å; I99-Y335 HydrophobicContact CG2-CE1 4.32Å; I99-Y335 HydrophobicContact CG2-CE2 3.89Å; I99-Y335 HydrophobicContact CG2-CG 4.34Å |
| 100 | G | 93.6 | Very high | 92 | Very high | 16 Ų | 16 | 30 Ų | 30 | 17% | 0.165 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -62 | -40.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | N96 F97 L98 A103 L104 | N96-G100 PolarHBondContact O-N 3.04Å; F97-G100 PolarHBondContact O-N 2.91Å; L98-G100 VanDerWaalsContact C-N 3.28Å; L98-G100 PolarHBondContact O-N 3.06Å; G100-A103 PolarHBondContact O-N 3.22Å; G100-L104 PolarHBondContact O-N 3.39Å |
| 101 | N | 95.9 | Very high | 92.6 | Very high | 12 Ų | 12 | 26.6 Ų | 26.6 | 6% | 0.064 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63 | -43.3 | 173.7 | -176.2 | 67.5 | 0 | 0 | 0 | 112.2 | F97 L98 L104 S105 T151 V180 W184 | F97-N101 PolarHBondContact O-N 3.45Å; L98-N101 WeakPolarHBondContact O-CB 3.1Å; L98-N101 PolarHBondContact O-N 3.4Å; L98-N101 VanDerWaalsContact O-N 3.16Å; N101-L104 PolarHBondContact O-N 2.91Å; N101-S105 PolarHBondContact O-N 3.33Å; N101-S105 PolarHBondContact O-OG 2.98Å; N101-T151 PolarHBondContact ND2-OG1 3.44Å; N101-V180 HydrophobicContact CB-CG1 4.43Å; N101-V180 HydrophobicContact CB-CG2 4.15Å; N101-V180 VanDerWaalsContact OD1-CG1 3.26Å; N101-V180 WeakPolarHBondContact OD1-CG1 3.25Å; N101-W184 PolarHBondContact OD1-NE1 3.42Å |
| 102 | L | 94.6 | Very high | 93.1 | Very high | 1 Ų | 1 | 27.7 Ų | 27.7 | 1% | 0.005 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -59.9 | -45.9 | 175 | -178.3 | 67.7 | 0 | 0 | 0 | 111.5 | L98 I99 L104 S105 D106 T151 L152 Y335 | L98-L102 PolarHBondContact O-N 3.33Å; I99-L102 WeakPolarHBondContact O-CB 3.18Å; I99-L102 PolarHBondContact O-N 2.83Å; L102-L104 VanDerWaalsContact C-N 3.29Å; L102-L104 PolarHBondContact O-N 3.06Å; L102-S105 PolarHBondContact O-N 3.47Å; L102-S105 PolarHBondContact O-OG 2.89Å; L102-D106 PolarHBondContact O-N 3.26Å; L102-T151 HydrophobicContact CB-CG2 4Å; L102-L152 HydrophobicContact CD1-CG 4.26Å; L102-L152 HydrophobicContact CD2-CD2 3.74Å; L102-L152 HydrophobicContact CD2-CG 4.29Å; L102-Y335 HydrophobicContact CD2-CE2 4.23Å |
| 103 | A | 95.6 | Very high | 93.4 | Very high | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.4 | -36.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | N78 L81 V82 I99 G100 D106 V107 | N78-A103 HydrophobicContact CB-CB 4.09Å; L81-A103 HydrophobicContact CB-CB 4.4Å; L81-A103 HydrophobicContact CD2-CB 4.11Å; L81-A103 HydrophobicContact CG-CB 4.37Å; V82-A103 HydrophobicContact CG2-CB 3.58Å; I99-A103 WeakPolarHBondContact O-CB 3.22Å; I99-A103 PolarHBondContact O-N 3.06Å; G100-A103 PolarHBondContact O-N 3.22Å; A103-D106 PolarHBondContact O-N 2.96Å; A103-V107 WeakPolarHBondContact O-CB 3.41Å; A103-V107 WeakPolarHBondContact O-CG2 2.94Å; A103-V107 PolarHBondContact O-N 3.5Å |
| 104 | L | 95.9 | Very high | 93.7 | Very high | 86 Ų | 86 | 20.3 Ų | 20.3 | 45% | 0.45 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -67 | -42.3 | 176 | -178.1 | 64 | 0 | 0 | 0 | 112.2 | G100 N101 L102 V107 L108 | G100-L104 PolarHBondContact O-N 3.39Å; N101-L104 PolarHBondContact O-N 2.91Å; L102-L104 VanDerWaalsContact C-N 3.29Å; L102-L104 PolarHBondContact O-N 3.06Å; L104-V107 PolarHBondContact O-N 3.16Å; L104-L108 HydrophobicContact CG-CD1 4.46Å; L104-L108 WeakPolarHBondContact O-CG 3.39Å; L104-L108 PolarHBondContact O-N 3.02Å |
| 105 | S | 96.8 | Very high | 94 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.7 | -40.1 | 175.5 | 53.6 | 0 | 0 | 0 | 0 | 112.1 | N101 L102 L108 M109 S148 | N101-S105 PolarHBondContact O-N 3.33Å; N101-S105 PolarHBondContact O-OG 2.98Å; L102-S105 PolarHBondContact O-N 3.47Å; L102-S105 PolarHBondContact O-OG 2.89Å; S105-L108 PolarHBondContact O-N 3.24Å; S105-M109 PolarHBondContact O-N 2.88Å; S105-S148 PolarHBondContact OG-OG 3.04Å; S105-S148 VanDerWaalsContact OG-OG 3.1Å |
| 106 | D | 96 | Very high | 94.3 | Very high | 1 Ų | 1 | 23.2 Ų | 23.2 | 1% | 0.005 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.6 | -38.7 | 176.4 | -73.5 | -19 | 0 | 0 | 0 | 112.2 | N78 L102 A103 M109 C110 A328 N331 | N78-D106 HydrophobicContact CB-CB 4.48Å; L102-D106 PolarHBondContact O-N 3.26Å; A103-D106 PolarHBondContact O-N 2.96Å; D106-M109 PolarHBondContact O-N 3.45Å; D106-C110 WeakPolarHBondContact O-CB 3.31Å; D106-C110 PolarHBondContact O-N 2.81Å; D106-C110 PolarHBondContact O-SG 3.01Å; D106-A328 HydrophobicContact CB-CB 3.98Å; D106-N331 PolarHBondContact OD2-ND2 2.89Å |
| 107 | V | 96.8 | Very high | 94.5 | Very high | 28 Ų | 28 | 23.8 Ų | 23.8 | 17% | 0.17 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.4 | -45.6 | 174.3 | 167.4 | 0 | 0 | 0 | 0 | 110.7 | L75 N78 A103 L104 M109 C110 A111 | L75-V107 HydrophobicContact CD2-CG1 4.1Å; N78-V107 HydrophobicContact CB-CG2 3.65Å; A103-V107 WeakPolarHBondContact O-CB 3.41Å; A103-V107 WeakPolarHBondContact O-CG2 2.94Å; A103-V107 PolarHBondContact O-N 3.5Å; L104-V107 PolarHBondContact O-N 3.16Å; V107-M109 VanDerWaalsContact C-N 3.35Å; V107-M109 PolarHBondContact O-N 3.42Å; V107-C110 PolarHBondContact O-N 3.18Å; V107-A111 WeakPolarHBondContact O-CB 3.47Å; V107-A111 PolarHBondContact O-N 3.44Å |
| 108 | L | 95.8 | Very high | 94.5 | Very high | 60 Ų | 60 | 20.8 Ų | 20.8 | 31% | 0.314 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -61 | -44.4 | 177.5 | -75.3 | 166 | 0 | 0 | 0 | 111.5 | L104 S105 A112 T144 W184 | L104-L108 HydrophobicContact CG-CD1 4.46Å; L104-L108 WeakPolarHBondContact O-CG 3.39Å; L104-L108 PolarHBondContact O-N 3.02Å; S105-L108 PolarHBondContact O-N 3.24Å; L108-A112 WeakPolarHBondContact O-CB 3.43Å; L108-A112 PolarHBondContact O-N 3.33Å; L108-T144 HydrophobicContact CB-CG2 3.9Å; L108-W184 HydrophobicContact CD1-CH2 3.61Å; L108-W184 HydrophobicContact CD1-CZ2 4.36Å; L108-W184 HydrophobicContact CD1-CZ3 4.49Å |
| 109 | M | 94.9 | Very high | 94.5 | Very high | 2 Ų | 2 | 22.7 Ų | 22.7 | 1% | 0.01 | 15% | 0.146 | C | C | . | . | I | π-helix | trans | -59.9 | -49.5 | 175.5 | -177.9 | -173.6 | -70.4 | 0 | 0 | 111.8 | S105 D106 V107 C113 V114 T144 V145 M325 | S105-M109 PolarHBondContact O-N 2.88Å; D106-M109 PolarHBondContact O-N 3.45Å; V107-M109 VanDerWaalsContact C-N 3.35Å; V107-M109 PolarHBondContact O-N 3.42Å; M109-C113 WeakPolarHBondContact O-CB 3.44Å; M109-C113 PolarHBondContact O-N 2.7Å; M109-V114 HydrophobicContact CG-CG2 4.21Å; M109-V114 WeakPolarHBondContact O-CG2 3.26Å; M109-V114 PolarHBondContact O-N 3.21Å; M109-T144 WeakPolarHBondContact CE-OG1 3.27Å; M109-V145 HydrophobicContact CE-CB 4.32Å; M109-V145 HydrophobicContact CE-CG2 3.37Å; M109-M325 HydrophobicContact CG-SD 3.9Å; M109-M325 HydrophobicContact SD-SD 3.5Å |
| 110 | C | 95.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 15% | 0.151 | C | C | . | . | I | π-helix | trans | -72.4 | -30.9 | -176.8 | -64.8 | 0 | 0 | 0 | 0 | 113.4 | L75 D106 V107 P115 | L75-C110 HydrophobicContact CD2-CB 3.84Å; L75-C110 HydrophobicContact CG-CB 3.9Å; D106-C110 WeakPolarHBondContact O-CB 3.31Å; D106-C110 PolarHBondContact O-N 2.81Å; D106-C110 PolarHBondContact O-SG 3.01Å; V107-C110 PolarHBondContact O-N 3.18Å; C110-P115 VanDerWaalsContact O-CD 3.29Å; C110-P115 WeakPolarHBondContact O-CD 3.15Å; C110-P115 WeakPolarHBondContact O-CG 3.47Å |
| 111 | A | 95.1 | Very high | 94.2 | Very high | 58 Ų | 58 | 24.8 Ų | 24.8 | 48% | 0.479 | 16% | 0.155 | S | C | . | . | I | π-helix | trans | -81.5 | -41.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L75 V107 | L75-A111 HydrophobicContact CD2-CB 3.83Å; V107-A111 WeakPolarHBondContact O-CB 3.47Å; V107-A111 PolarHBondContact O-N 3.44Å |
| 112 | A | 92.8 | Very high | 93.9 | Very high | 31 Ų | 31 | 25 Ų | 25 | 26% | 0.256 | 16% | 0.155 | S | C | . | . | I | π-helix | trans | -104.4 | -56.2 | -172.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L108 L116 L140 | L108-A112 WeakPolarHBondContact O-CB 3.43Å; L108-A112 PolarHBondContact O-N 3.33Å; A112-L116 WeakPolarHBondContact O-CB 3.24Å; A112-L116 VanDerWaalsContact O-CD1 3.28Å; A112-L116 WeakPolarHBondContact O-CD1 3.45Å; A112-L116 VanDerWaalsContact O-CG 3.25Å; A112-L116 WeakPolarHBondContact O-CG 3.4Å; A112-L140 HydrophobicContact CB-CD2 4.12Å |
| 113 | C | 94.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 17% | 0.171 | C | C | . | . | I | π-helix | trans | -74.2 | -53.7 | -167.8 | -51.2 | 0 | 0 | 0 | 0 | 112.1 | M109 L116 T117 V137 Q141 | M109-C113 WeakPolarHBondContact O-CB 3.44Å; M109-C113 PolarHBondContact O-N 2.7Å; C113-L116 PolarHBondContact O-N 3.09Å; C113-T117 WeakPolarHBondContact O-CB 3.29Å; C113-T117 PolarHBondContact O-N 3.03Å; C113-T117 PolarHBondContact O-OG1 2.92Å; C113-V137 HydrophobicContact CB-CG1 4.48Å; C113-Q141 HydrophobicContact CB-CB 4.09Å; C113-Q141 HydrophobicContact CB-CG 4.41Å |
| 114 | V | 94.3 | Very high | 93.1 | Very high | 1 Ų | 1 | 33.2 Ų | 33.2 | 1% | 0.006 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.6 | -47.3 | -173 | 178.5 | 0 | 0 | 0 | 0 | 113 | Y67 V71 M109 L118 M325 | Y67-V114 HydrophobicContact CD1-CG1 3.58Å; Y67-V114 HydrophobicContact CE1-CG1 4.23Å; V71-V114 HydrophobicContact CG2-CB 4.11Å; V71-V114 HydrophobicContact CG2-CG1 3.63Å; M109-V114 HydrophobicContact CG-CG2 4.21Å; M109-V114 WeakPolarHBondContact O-CG2 3.26Å; M109-V114 PolarHBondContact O-N 3.21Å; V114-L118 WeakPolarHBondContact O-CB 3.5Å; V114-L118 PolarHBondContact O-N 3.28Å; V114-M325 HydrophobicContact CG2-CB 4.17Å; V114-M325 HydrophobicContact CG2-CG 3.98Å; V114-M325 HydrophobicContact CG2-SD 3.84Å |
| 115 | P | 93.9 | Very high | 92.5 | Very high | 48 Ų | 48 | 36 Ų | 36 | 31% | 0.312 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -68.1 | -39 | 180 | -19.6 | 33.9 | 0 | 0 | 0 | 112.9 | V71 C110 L118 A119 | V71-P115 HydrophobicContact CG2-CG 4.07Å; C110-P115 VanDerWaalsContact O-CD 3.29Å; C110-P115 WeakPolarHBondContact O-CD 3.15Å; C110-P115 WeakPolarHBondContact O-CG 3.47Å; P115-L118 PolarHBondContact O-N 3.04Å; P115-A119 WeakPolarHBondContact O-CB 3.12Å; P115-A119 PolarHBondContact O-N 3.21Å |
| 116 | L | 93.6 | Very high | 92.1 | Very high | 36 Ų | 36 | 36.4 Ų | 36.4 | 19% | 0.188 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -71 | -41.1 | -179.2 | -69.7 | 173.6 | 0 | 0 | 0 | 111.5 | A112 C113 L118 A119 Y120 W127 F129 V137 | A112-L116 WeakPolarHBondContact O-CB 3.24Å; A112-L116 VanDerWaalsContact O-CD1 3.28Å; A112-L116 WeakPolarHBondContact O-CD1 3.45Å; A112-L116 VanDerWaalsContact O-CG 3.25Å; A112-L116 WeakPolarHBondContact O-CG 3.4Å; C113-L116 PolarHBondContact O-N 3.09Å; L116-L118 VanDerWaalsContact C-N 3.34Å; L116-A119 PolarHBondContact O-N 2.92Å; L116-Y120 WeakPolarHBondContact O-CB 3.49Å; L116-Y120 PolarHBondContact O-N 3.45Å; L116-W127 HydrophobicContact CB-CH2 4.23Å; L116-F129 HydrophobicContact CD2-CD1 4.02Å; L116-F129 HydrophobicContact CD2-CD2 4.15Å; L116-F129 HydrophobicContact CD2-CE1 4.09Å; L116-F129 HydrophobicContact CD2-CE2 4.22Å; L116-F129 HydrophobicContact CD2-CG 4.07Å; L116-F129 HydrophobicContact CD2-CZ 4.2Å; L116-V137 HydrophobicContact CB-CG2 4.18Å; L116-V137 HydrophobicContact CD1-CG2 3.42Å; L116-V137 VanDerWaalsContact CD1-CG2 3.42Å; L116-V137 HydrophobicContact CG-CG2 4.43Å |
| 117 | T | 91.7 | Very high | 91.9 | Very high | 24 Ų | 24 | 36.3 Ų | 36.3 | 15% | 0.147 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.7 | -39.4 | 174.6 | -57.1 | 0 | 0 | 0 | 0 | 111.4 | C113 Y120 A121 Q141 | C113-T117 WeakPolarHBondContact O-CB 3.29Å; C113-T117 PolarHBondContact O-N 3.03Å; C113-T117 PolarHBondContact O-OG1 2.92Å; T117-Y120 PolarHBondContact O-N 3.35Å; T117-A121 PolarHBondContact O-N 3.04Å; T117-Q141 PolarHBondContact OG1-OE1 3.45Å |
| 118 | L | 92.6 | Very high | 91.6 | Very high | 23 Ų | 23 | 37.5 Ų | 37.5 | 12% | 0.12 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.1 | -42.1 | 174.5 | -175.7 | 69.9 | 0 | 0 | 0 | 111.9 | I63 V64 Y67 V114 P115 L116 A121 F122 | I63-L118 HydrophobicContact CG2-CD1 4.05Å; V64-L118 HydrophobicContact CG2-CD2 4.46Å; Y67-L118 HydrophobicContact CD1-CB 4.28Å; Y67-L118 HydrophobicContact CD1-CD1 4.03Å; Y67-L118 HydrophobicContact CD2-CD1 3.88Å; Y67-L118 HydrophobicContact CE2-CD1 4.31Å; Y67-L118 HydrophobicContact CG-CD1 3.72Å; Y67-L118 HydrophobicContact CG-CD2 4.23Å; Y67-L118 HydrophobicContact CG-CG 4.42Å; V114-L118 WeakPolarHBondContact O-CB 3.5Å; V114-L118 PolarHBondContact O-N 3.28Å; P115-L118 PolarHBondContact O-N 3.04Å; L116-L118 VanDerWaalsContact C-N 3.34Å; L118-A121 PolarHBondContact O-N 3.36Å; L118-F122 HydrophobicContact CD1-CD2 3.93Å; L118-F122 HydrophobicContact CD1-CE2 3.6Å; L118-F122 HydrophobicContact CG-CD2 4.27Å; L118-F122 HydrophobicContact CG-CE2 4.38Å; L118-F122 WeakPolarHBondContact O-CD2 3.39Å; L118-F122 PolarHBondContact O-N 3.14Å |
| 119 | A | 92.7 | Very high | 91.4 | Very high | 40 Ų | 40 | 37.9 Ų | 37.9 | 33% | 0.331 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -65.6 | -40.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | P115 L116 A121 F122 E123 F129 | P115-A119 WeakPolarHBondContact O-CB 3.12Å; P115-A119 PolarHBondContact O-N 3.21Å; L116-A119 PolarHBondContact O-N 2.92Å; A119-A121 VanDerWaalsContact C-N 3.33Å; A119-A121 PolarHBondContact O-N 3.12Å; A119-F122 PolarHBondContact O-N 3.36Å; A119-E123 VanDerWaalsContact O-CB 3.29Å; A119-E123 WeakPolarHBondContact O-CB 3.33Å; A119-E123 PolarHBondContact O-N 2.96Å; A119-F129 HydrophobicContact CB-CE2 3.97Å; A119-F129 HydrophobicContact CB-CZ 3.54Å |
| 120 | Y | 91.1 | Very high | 91.2 | Very high | 40 Ų | 40 | 39.2 Ų | 39.2 | 16% | 0.157 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -57.5 | -43.3 | 171.4 | 174.2 | -124.3 | 0 | 0 | 0 | 112.3 | L116 T117 F122 W127 E212 | L116-Y120 WeakPolarHBondContact O-CB 3.49Å; L116-Y120 PolarHBondContact O-N 3.45Å; T117-Y120 PolarHBondContact O-N 3.35Å; Y120-F122 PolarHBondContact O-N 3.48Å; Y120-W127 HydrophobicContact CD2-CB 3.88Å; Y120-W127 AromaticContact CD2-CE3 3.97Å; Y120-W127 HydrophobicContact CD2-CE3 3.97Å; Y120-W127 HydrophobicContact CE2-CB 3.96Å; Y120-W127 AromaticContact CG-CE3 3.86Å; Y120-W127 HydrophobicContact CG-CE3 3.86Å; Y120-W127 HydrophobicContact CG-CZ3 4.45Å; Y120-E212 PolarHBondContact OH-OE1 3.03Å |
| 121 | A | 88.2 | Confident | 90.9 | Very high | 30 Ų | 30 | 40.5 Ų | 40.5 | 25% | 0.248 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.5 | -20.4 | -178 | 0 | 0 | 0 | 0 | 0 | 114.7 | T117 L118 A119 L318 | T117-A121 PolarHBondContact O-N 3.04Å; L118-A121 PolarHBondContact O-N 3.36Å; A119-A121 VanDerWaalsContact C-N 3.33Å; A119-A121 PolarHBondContact O-N 3.12Å; A121-L318 HydrophobicContact CB-CD2 3.97Å |
| 122 | F | 89.8 | Confident | 90.8 | Very high | 15 Ų | 15 | 40.6 Ų | 40.6 | 7% | 0.066 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -118.5 | -2.9 | -176.8 | -72.5 | -63 | 0 | 0 | 0 | 114.7 | V56 K60 I63 V64 L118 A119 Y120 P124 | V56-F122 HydrophobicContact CG1-CE1 3.81Å; V56-F122 HydrophobicContact CG1-CZ 4.29Å; K60-F122 HydrophobicContact CB-CD1 4.17Å; K60-F122 HydrophobicContact CB-CE1 3.63Å; K60-F122 HydrophobicContact CB-CZ 4.12Å; K60-F122 HydrophobicContact CD-CD1 3.81Å; K60-F122 HydrophobicContact CD-CE1 4.16Å; K60-F122 HydrophobicContact CD-CG 4.29Å; K60-F122 HydrophobicContact CG-CD1 3.74Å; K60-F122 HydrophobicContact CG-CE1 3.6Å; K60-F122 HydrophobicContact CG-CE2 4.45Å; K60-F122 HydrophobicContact CG-CG 4.24Å; K60-F122 HydrophobicContact CG-CZ 3.99Å; I63-F122 HydrophobicContact CB-CE2 4.24Å; I63-F122 HydrophobicContact CB-CZ 3.87Å; I63-F122 HydrophobicContact CD1-CZ 4Å; I63-F122 HydrophobicContact CG2-CE2 3.79Å; I63-F122 HydrophobicContact CG2-CZ 3.78Å; V64-F122 HydrophobicContact CG2-CD2 4.12Å; V64-F122 HydrophobicContact CG2-CE2 3.88Å; L118-F122 HydrophobicContact CD1-CD2 3.93Å; L118-F122 HydrophobicContact CD1-CE2 3.6Å; L118-F122 HydrophobicContact CG-CD2 4.27Å; L118-F122 HydrophobicContact CG-CE2 4.38Å; L118-F122 WeakPolarHBondContact O-CD2 3.39Å; L118-F122 PolarHBondContact O-N 3.14Å; A119-F122 PolarHBondContact O-N 3.36Å; Y120-F122 PolarHBondContact O-N 3.48Å; F122-P124 WeakPolarHBondContact O-CD 3.43Å |
| 123 | E | 89.4 | Confident | 90.8 | Very high | 72 Ų | 72 | 42.6 Ų | 42.6 | 34% | 0.336 | 26% | 0.257 | S | S | . | . | trans | -82.8 | 117.3 | 176.2 | 178.5 | 50.4 | -130.7 | 0 | 0 | 109.7 | A119 R125 G126 V128 | A119-E123 VanDerWaalsContact O-CB 3.29Å; A119-E123 WeakPolarHBondContact O-CB 3.33Å; A119-E123 PolarHBondContact O-N 2.96Å; E123-R125 HydrophobicContact CG-CB 4.34Å; E123-R125 PolarHBondContact O-N 3.48Å; E123-R125 PolarHBondContact OE1-N 3.25Å; E123-G126 WeakPolarHBondContact CB-O 3.49Å; E123-G126 VanDerWaalsContact CG-O 3.23Å; E123-G126 WeakPolarHBondContact CG-O 3.11Å; E123-G126 PolarHBondContact O-N 3.35Å; E123-V128 HydrophobicContact CG-CG1 3.82Å; E123-V128 HydrophobicContact CG-CG2 4.12Å | ||
| 124 | P | 83.6 | Confident | 90.8 | Very high | 102 Ų | 102 | 42.6 Ų | 42.6 | 66% | 0.662 | 26% | 0.257 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | -28.3 | -178.7 | -25.1 | 35 | 0 | 0 | 0 | 113.8 | F122 G126 | F122-P124 WeakPolarHBondContact O-CD 3.43Å; P124-G126 VanDerWaalsContact C-N 3.27Å |
| 125 | R | 84.1 | Confident | 90.7 | Very high | 146 Ų | 146 | 46.6 Ų | 46.6 | 55% | 0.551 | 28% | 0.276 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.5 | 1.3 | 176.5 | -57.1 | -175.8 | -170.7 | -166.1 | 3.3 | 113.2 | E123 V128 D207 R209 | E123-R125 HydrophobicContact CG-CB 4.34Å; E123-R125 PolarHBondContact O-N 3.48Å; E123-R125 PolarHBondContact OE1-N 3.25Å; R125-V128 HydrophobicContact CB-CG1 3.89Å; R125-D207 IonicContact NH1-OD2 3.16Å; R125-R209 PolarHBondContact O-N 3.35Å |
| 126 | G | 87.3 | Confident | 90.7 | Very high | 7 Ų | 7 | 48.7 Ų | 48.7 | 7% | 0.072 | 28% | 0.284 | C | S | . | . | B | Isolated β-bridge | trans | 72.3 | -131.9 | -177 | 0 | 0 | 0 | 0 | 0 | 113.1 | E123 P124 V128 R209 | E123-G126 WeakPolarHBondContact CB-O 3.49Å; E123-G126 VanDerWaalsContact CG-O 3.23Å; E123-G126 WeakPolarHBondContact CG-O 3.11Å; E123-G126 PolarHBondContact O-N 3.35Å; P124-G126 VanDerWaalsContact C-N 3.27Å; G126-V128 PolarHBondContact O-N 2.92Å; G126-V128 VanDerWaalsContact O-N 3.11Å; G126-R209 CarbonylContact C-O 3.36Å; G126-R209 WeakPolarHBondContact CA-O 3.35Å |
| 127 | W | 91.1 | Very high | 90.7 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 28% | 0.275 | C | S | . | . | trans | -80.2 | 93.1 | -172.6 | -171.4 | -86.7 | 0 | 0 | 0 | 112.2 | L116 Y120 F129 G130 L133 C134 V137 F138 H200 R209 C211 | L116-W127 HydrophobicContact CB-CH2 4.23Å; Y120-W127 HydrophobicContact CD2-CB 3.88Å; Y120-W127 AromaticContact CD2-CE3 3.97Å; Y120-W127 HydrophobicContact CD2-CE3 3.97Å; Y120-W127 HydrophobicContact CE2-CB 3.96Å; Y120-W127 AromaticContact CG-CE3 3.86Å; Y120-W127 HydrophobicContact CG-CE3 3.86Å; Y120-W127 HydrophobicContact CG-CZ3 4.45Å; W127-F129 AromaticContact CD2-CD2 4Å; W127-F129 HydrophobicContact CD2-CD2 4Å; W127-F129 AromaticContact CE2-CD2 3.85Å; W127-F129 HydrophobicContact CE3-CD2 4.17Å; W127-F129 HydrophobicContact CH2-CD2 4.09Å; W127-F129 HydrophobicContact CZ2-CB 3.89Å; W127-F129 AromaticContact CZ2-CD2 3.89Å; W127-F129 HydrophobicContact CZ2-CD2 3.89Å; W127-F129 HydrophobicContact CZ2-CG 4.32Å; W127-F129 HydrophobicContact CZ3-CD2 4.22Å; W127-G130 PolarHBondContact NE1-O 2.82Å; W127-L133 HydrophobicContact CZ2-CB 3.89Å; W127-L133 WeakPolarHBondContact CZ2-O 3.44Å; W127-C134 HydrophobicContact CD2-CB 4.25Å; W127-C134 VanDerWaalsContact CE2-CA 3.49Å; W127-C134 HydrophobicContact CG-CB 4.35Å; W127-C134 VanDerWaalsContact CZ2-CA 3.45Å; W127-C134 HydrophobicContact CZ2-CB 4.21Å; W127-C134 VanDerWaalsContact CZ2-N 3.31Å; W127-V137 HydrophobicContact CH2-CB 3.94Å; W127-V137 HydrophobicContact CH2-CG1 4.22Å; W127-V137 HydrophobicContact CH2-CG2 3.97Å; W127-V137 HydrophobicContact CZ2-CG2 4.5Å; W127-F138 HydrophobicContact CE3-CE2 4.36Å; W127-F138 HydrophobicContact CZ3-CE2 4.12Å; W127-H200 AromaticContact CD1-CD2 3.64Å; W127-H200 AromaticContact CD1-NE2 3.76Å; W127-R209 PolarHBondContact N-O 3.09Å; W127-R209 VanDerWaalsContact O-CB 3.24Å; W127-R209 WeakPolarHBondContact O-CB 3.33Å; W127-R209 WeakPolarHBondContact O-CD 3.34Å; W127-C211 HydrophobicContact CB-CB 3.71Å; W127-C211 HydrophobicContact CD2-CB 3.82Å; W127-C211 HydrophobicContact CE3-CB 4.07Å; W127-C211 HydrophobicContact CG-CB 3.64Å | ||
| 128 | V | 91.4 | Very high | 90.7 | Very high | 52 Ų | 52 | 48.4 Ų | 48.4 | 32% | 0.315 | 28% | 0.279 | S | S | . | . | trans | -90.3 | -4.2 | -178.7 | -62.7 | 0 | 0 | 0 | 0 | 114.6 | E123 R125 G126 G130 | E123-V128 HydrophobicContact CG-CG1 3.82Å; E123-V128 HydrophobicContact CG-CG2 4.12Å; R125-V128 HydrophobicContact CB-CG1 3.89Å; G126-V128 PolarHBondContact O-N 2.92Å; G126-V128 VanDerWaalsContact O-N 3.11Å; V128-G130 VanDerWaalsContact C-N 3.27Å; V128-G130 PolarHBondContact O-N 3.4Å | ||
| 129 | F | 90.8 | Very high | 90.8 | Very high | 69 Ų | 69 | 49.8 Ų | 49.8 | 30% | 0.303 | 28% | 0.284 | S | S | . | . | S | Bend | trans | -82.6 | 1 | -173.7 | -49.5 | -71 | 0 | 0 | 0 | 114.3 | L116 A119 W127 L133 | L116-F129 HydrophobicContact CD2-CD1 4.02Å; L116-F129 HydrophobicContact CD2-CD2 4.15Å; L116-F129 HydrophobicContact CD2-CE1 4.09Å; L116-F129 HydrophobicContact CD2-CE2 4.22Å; L116-F129 HydrophobicContact CD2-CG 4.07Å; L116-F129 HydrophobicContact CD2-CZ 4.2Å; A119-F129 HydrophobicContact CB-CE2 3.97Å; A119-F129 HydrophobicContact CB-CZ 3.54Å; W127-F129 AromaticContact CD2-CD2 4Å; W127-F129 HydrophobicContact CD2-CD2 4Å; W127-F129 AromaticContact CE2-CD2 3.85Å; W127-F129 HydrophobicContact CE3-CD2 4.17Å; W127-F129 HydrophobicContact CH2-CD2 4.09Å; W127-F129 HydrophobicContact CZ2-CB 3.89Å; W127-F129 AromaticContact CZ2-CD2 3.89Å; W127-F129 HydrophobicContact CZ2-CD2 3.89Å; W127-F129 HydrophobicContact CZ2-CG 4.32Å; W127-F129 HydrophobicContact CZ3-CD2 4.22Å; F129-L133 HydrophobicContact CB-CB 4.09Å; F129-L133 HydrophobicContact CB-CD1 3.86Å |
| 130 | G | 90.8 | Very high | 90.9 | Very high | 30 Ų | 30 | 49.2 Ų | 49.2 | 31% | 0.309 | 28% | 0.276 | S | S | . | . | trans | 83 | 162 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | W127 V128 G132 L133 C134 | W127-G130 PolarHBondContact NE1-O 2.82Å; V128-G130 VanDerWaalsContact C-N 3.27Å; V128-G130 PolarHBondContact O-N 3.4Å; G130-G132 PolarHBondContact O-N 3.46Å; G130-L133 PolarHBondContact O-N 3.11Å; G130-C134 PolarHBondContact O-N 2.74Å; G130-C134 VanDerWaalsContact O-N 3.13Å | ||
| 131 | G | 90.8 | Very high | 91.1 | Very high | 26 Ų | 26 | 49 Ų | 49 | 27% | 0.268 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -61.5 | -36.6 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | L133 C134 H135 | G131-L133 PolarHBondContact O-N 3.42Å; G131-C134 WeakPolarHBondContact O-CB 3.26Å; G131-C134 PolarHBondContact O-N 3.28Å; G131-H135 PolarHBondContact O-CD2 3.45Å; G131-H135 PolarHBondContact O-N 3.08Å |
| 132 | G | 92.4 | Very high | 91.3 | Very high | 61 Ų | 61 | 48.7 Ų | 48.7 | 63% | 0.629 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -61.2 | -45.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | G130 L136 | G130-G132 PolarHBondContact O-N 3.46Å; G132-L136 VanDerWaalsContact O-CB 3.3Å; G132-L136 WeakPolarHBondContact O-CB 3.45Å; G132-L136 PolarHBondContact O-N 3.41Å |
| 133 | L | 92.8 | Very high | 91.6 | Very high | 72 Ų | 72 | 48.2 Ų | 48.2 | 38% | 0.377 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -71.4 | -31.4 | 175.9 | -74.1 | 175.8 | 0 | 0 | 0 | 112 | W127 F129 G130 G131 L136 V137 | W127-L133 HydrophobicContact CZ2-CB 3.89Å; W127-L133 WeakPolarHBondContact CZ2-O 3.44Å; F129-L133 HydrophobicContact CB-CB 4.09Å; F129-L133 HydrophobicContact CB-CD1 3.86Å; G130-L133 PolarHBondContact O-N 3.11Å; G131-L133 PolarHBondContact O-N 3.42Å; L133-L136 HydrophobicContact CD2-CD2 4.22Å; L133-L136 PolarHBondContact O-N 3.18Å; L133-V137 WeakPolarHBondContact O-CB 3.42Å; L133-V137 WeakPolarHBondContact O-CG2 3.49Å; L133-V137 PolarHBondContact O-N 2.95Å |
| 134 | C | 93.8 | Very high | 91.9 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -56.8 | -58.4 | 174.1 | 164.5 | 0 | 0 | 0 | 0 | 110.5 | W127 G130 G131 L136 V137 F138 H200 C211 | W127-C134 HydrophobicContact CD2-CB 4.25Å; W127-C134 VanDerWaalsContact CE2-CA 3.49Å; W127-C134 HydrophobicContact CG-CB 4.35Å; W127-C134 VanDerWaalsContact CZ2-CA 3.45Å; W127-C134 HydrophobicContact CZ2-CB 4.21Å; W127-C134 VanDerWaalsContact CZ2-N 3.31Å; G130-C134 PolarHBondContact O-N 2.74Å; G130-C134 VanDerWaalsContact O-N 3.13Å; G131-C134 WeakPolarHBondContact O-CB 3.26Å; G131-C134 PolarHBondContact O-N 3.28Å; C134-L136 VanDerWaalsContact C-N 3.32Å; C134-L136 PolarHBondContact O-N 2.86Å; C134-V137 PolarHBondContact O-N 3.33Å; C134-F138 WeakPolarHBondContact O-CB 3.44Å; C134-F138 WeakPolarHBondContact O-CD2 3.29Å; C134-F138 PolarHBondContact O-N 3.02Å; C134-F138 VanDerWaalsContact O-N 3.11Å; C134-H200 HydrophobicContact CB-CB 4.41Å; C134-C211 WeakPolarHBondContact CA-SG 3.3Å; C134-C211 HydrophobicContact CB-CB 3.86Å; C134-C211 WeakPolarHBondContact CB-SG 3.39Å; C134-C211 WeakPolarHBondContact SG-CB 3.36Å; C134-C211 CovalentContact SG-SG 2.01Å; C134-C211 PolarHBondContact SG-SG 2.89Å |
| 135 | H | 93.9 | Very high | 92.4 | Very high | 86 Ų | 86 | 40.2 Ų | 40.2 | 40% | 0.398 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.3 | -38.7 | 178.9 | -68 | -74.7 | 0 | 0 | 0 | 112.2 | G131 F139 T198 | G131-H135 PolarHBondContact O-CD2 3.45Å; G131-H135 PolarHBondContact O-N 3.08Å; H135-F139 WeakPolarHBondContact O-CB 3.39Å; H135-F139 PolarHBondContact O-N 3.26Å; H135-T198 PolarHBondContact CE1-O 3.39Å |
| 136 | L | 93.4 | Very high | 92.9 | Very high | 91 Ų | 91 | 34.4 Ų | 34.4 | 48% | 0.476 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -64.3 | -46.7 | 179.8 | -179 | 63 | 0 | 0 | 0 | 112.2 | G132 L133 C134 F139 L140 | G132-L136 VanDerWaalsContact O-CB 3.3Å; G132-L136 WeakPolarHBondContact O-CB 3.45Å; G132-L136 PolarHBondContact O-N 3.41Å; L133-L136 HydrophobicContact CD2-CD2 4.22Å; L133-L136 PolarHBondContact O-N 3.18Å; C134-L136 VanDerWaalsContact C-N 3.32Å; C134-L136 PolarHBondContact O-N 2.86Å; L136-F139 PolarHBondContact O-N 3.43Å; L136-L140 WeakPolarHBondContact O-CB 3.39Å; L136-L140 PolarHBondContact O-N 3.06Å |
| 137 | V | 93.5 | Very high | 93.4 | Very high | 3 Ų | 3 | 34 Ų | 34 | 2% | 0.018 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -69.8 | -45.5 | -177.3 | 170.3 | 0 | 0 | 0 | 0 | 111.1 | C113 L116 W127 L133 C134 F139 L140 Q141 | C113-V137 HydrophobicContact CB-CG1 4.48Å; L116-V137 HydrophobicContact CB-CG2 4.18Å; L116-V137 HydrophobicContact CD1-CG2 3.42Å; L116-V137 VanDerWaalsContact CD1-CG2 3.42Å; L116-V137 HydrophobicContact CG-CG2 4.43Å; W127-V137 HydrophobicContact CH2-CB 3.94Å; W127-V137 HydrophobicContact CH2-CG1 4.22Å; W127-V137 HydrophobicContact CH2-CG2 3.97Å; W127-V137 HydrophobicContact CZ2-CG2 4.5Å; L133-V137 WeakPolarHBondContact O-CB 3.42Å; L133-V137 WeakPolarHBondContact O-CG2 3.49Å; L133-V137 PolarHBondContact O-N 2.95Å; C134-V137 PolarHBondContact O-N 3.33Å; V137-F139 PolarHBondContact O-N 2.86Å; V137-L140 PolarHBondContact O-N 2.78Å; V137-Q141 VanDerWaalsContact O-CB 3.23Å; V137-Q141 WeakPolarHBondContact O-CB 3.02Å; V137-Q141 PolarHBondContact O-N 3.1Å |
| 138 | F | 91.9 | Very high | 93.5 | Very high | 51 Ų | 51 | 34.1 Ų | 34.1 | 22% | 0.224 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -67.7 | -22.7 | 178.8 | -82 | -104.9 | 0 | 0 | 0 | 112.9 | W127 C134 P142 T198 C211 | W127-F138 HydrophobicContact CE3-CE2 4.36Å; W127-F138 HydrophobicContact CZ3-CE2 4.12Å; C134-F138 WeakPolarHBondContact O-CB 3.44Å; C134-F138 WeakPolarHBondContact O-CD2 3.29Å; C134-F138 PolarHBondContact O-N 3.02Å; C134-F138 VanDerWaalsContact O-N 3.11Å; F138-P142 WeakPolarHBondContact O-CD 3.31Å; F138-P142 WeakPolarHBondContact O-CG 3.44Å; F138-T198 HydrophobicContact CB-CG2 4.04Å; F138-T198 HydrophobicContact CD1-CG2 4.46Å; F138-T198 HydrophobicContact CG-CG2 4.19Å; F138-C211 WeakPolarHBondContact CD2-SG 3.22Å; F138-C211 HydrophobicContact CE2-CB 4.09Å; F138-C211 WeakPolarHBondContact CE2-SG 3.39Å; F138-C211 WeakPolarHBondContact CZ-O 3.3Å |
| 139 | F | 94.9 | Very high | 93.6 | Very high | 53 Ų | 53 | 31.9 Ų | 31.9 | 23% | 0.232 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -82.2 | -48.7 | 168.2 | 175.2 | -108.4 | 0 | 0 | 0 | 112.7 | H135 L136 V137 Q141 P142 V143 A188 A191 L192 A195 | H135-F139 WeakPolarHBondContact O-CB 3.39Å; H135-F139 PolarHBondContact O-N 3.26Å; L136-F139 PolarHBondContact O-N 3.43Å; V137-F139 PolarHBondContact O-N 2.86Å; F139-Q141 VanDerWaalsContact C-N 3.34Å; F139-Q141 PolarHBondContact O-N 2.89Å; F139-P142 VanDerWaalsContact O-CD 3.28Å; F139-P142 WeakPolarHBondContact O-CD 3.4Å; F139-P142 VanDerWaalsContact O-CG 3.31Å; F139-P142 WeakPolarHBondContact O-CG 3.36Å; F139-V143 HydrophobicContact CD1-CG2 4.39Å; F139-V143 HydrophobicContact CD2-CG2 4.2Å; F139-V143 HydrophobicContact CE1-CG2 4.06Å; F139-V143 HydrophobicContact CE2-CG2 3.87Å; F139-V143 HydrophobicContact CG-CG2 4.47Å; F139-V143 HydrophobicContact CZ-CG2 3.8Å; F139-V143 VanDerWaalsContact O-CG2 3.22Å; F139-V143 WeakPolarHBondContact O-CG2 3.16Å; F139-V143 PolarHBondContact O-N 3.41Å; F139-A188 HydrophobicContact CE2-CB 4.44Å; F139-A188 HydrophobicContact CZ-CB 3.86Å; F139-A191 HydrophobicContact CD2-CB 4.04Å; F139-A191 HydrophobicContact CE2-CB 4.03Å; F139-L192 HydrophobicContact CE2-CD2 3.94Å; F139-L192 HydrophobicContact CE2-CG 4.37Å; F139-A195 HydrophobicContact CB-CB 3.96Å; F139-A195 HydrophobicContact CD2-CB 3.76Å; F139-A195 HydrophobicContact CG-CB 4.29Å |
| 140 | L | 95.1 | Very high | 93.7 | Very high | 28 Ų | 28 | 30.1 Ų | 30.1 | 15% | 0.147 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -68 | -34.6 | -173 | -175 | 64.1 | 0 | 0 | 0 | 112.2 | A112 L136 V137 V143 T144 | A112-L140 HydrophobicContact CB-CD2 4.12Å; L136-L140 WeakPolarHBondContact O-CB 3.39Å; L136-L140 PolarHBondContact O-N 3.06Å; V137-L140 PolarHBondContact O-N 2.78Å; L140-V143 PolarHBondContact O-N 3.16Å; L140-T144 HydrophobicContact CD1-CG2 3.99Å; L140-T144 HydrophobicContact CG-CG2 4.13Å; L140-T144 WeakPolarHBondContact O-CG2 3.41Å; L140-T144 PolarHBondContact O-N 3.39Å; L140-T144 PolarHBondContact O-OG1 3.2Å |
| 141 | Q | 93.8 | Very high | 93.9 | Very high | 34 Ų | 34 | 28.7 Ų | 28.7 | 16% | 0.159 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -57.1 | -60.6 | 178 | 179.6 | 169.8 | -22.8 | 0 | 0 | 112.1 | C113 T117 V137 F139 V143 T144 V145 H321 M325 | C113-Q141 HydrophobicContact CB-CB 4.09Å; C113-Q141 HydrophobicContact CB-CG 4.41Å; T117-Q141 PolarHBondContact OG1-OE1 3.45Å; V137-Q141 VanDerWaalsContact O-CB 3.23Å; V137-Q141 WeakPolarHBondContact O-CB 3.02Å; V137-Q141 PolarHBondContact O-N 3.1Å; F139-Q141 VanDerWaalsContact C-N 3.34Å; F139-Q141 PolarHBondContact O-N 2.89Å; Q141-V143 VanDerWaalsContact C-N 3.32Å; Q141-V143 PolarHBondContact O-N 2.84Å; Q141-T144 PolarHBondContact O-N 3.49Å; Q141-T144 PolarHBondContact O-OG1 3Å; Q141-V145 VanDerWaalsContact O-CG2 3.26Å; Q141-V145 WeakPolarHBondContact O-CG2 3.15Å; Q141-V145 PolarHBondContact O-N 3.34Å; Q141-H321 PolarHBondContact NE2-NE2 3.21Å; Q141-M325 HydrophobicContact CG-CE 4.01Å |
| 142 | P | 93.3 | Very high | 93.9 | Very high | 25 Ų | 25 | 27.9 Ų | 27.9 | 16% | 0.162 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.6 | -36.8 | 176.3 | 21.5 | -30.9 | 0 | 0 | 0 | 112.9 | F138 F139 T144 V145 Y146 A191 | F138-P142 WeakPolarHBondContact O-CD 3.31Å; F138-P142 WeakPolarHBondContact O-CG 3.44Å; F139-P142 VanDerWaalsContact O-CD 3.28Å; F139-P142 WeakPolarHBondContact O-CD 3.4Å; F139-P142 VanDerWaalsContact O-CG 3.31Å; F139-P142 WeakPolarHBondContact O-CG 3.36Å; P142-T144 PolarHBondContact O-N 3.41Å; P142-V145 WeakPolarHBondContact O-CB 3.42Å; P142-V145 PolarHBondContact O-N 3.06Å; P142-Y146 HydrophobicContact CB-CE2 3.85Å; P142-Y146 WeakPolarHBondContact O-CD1 3.33Å; P142-Y146 WeakPolarHBondContact O-CD2 3.16Å; P142-Y146 PolarHBondContact O-N 3.04Å; P142-A191 HydrophobicContact CB-CB 4.21Å; P142-A191 HydrophobicContact CG-CB 3.99Å |
| 143 | V | 96.7 | Very high | 93.8 | Very high | 4 Ų | 4 | 25.9 Ų | 25.9 | 2% | 0.024 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -58 | -49.8 | 177.5 | 170.6 | 0 | 0 | 0 | 0 | 111.8 | F139 L140 Q141 V145 Y146 V147 W184 A191 | F139-V143 HydrophobicContact CD1-CG2 4.39Å; F139-V143 HydrophobicContact CD2-CG2 4.2Å; F139-V143 HydrophobicContact CE1-CG2 4.06Å; F139-V143 HydrophobicContact CE2-CG2 3.87Å; F139-V143 HydrophobicContact CG-CG2 4.47Å; F139-V143 HydrophobicContact CZ-CG2 3.8Å; F139-V143 VanDerWaalsContact O-CG2 3.22Å; F139-V143 WeakPolarHBondContact O-CG2 3.16Å; F139-V143 PolarHBondContact O-N 3.41Å; L140-V143 PolarHBondContact O-N 3.16Å; Q141-V143 VanDerWaalsContact C-N 3.32Å; Q141-V143 PolarHBondContact O-N 2.84Å; V143-V145 VanDerWaalsContact C-N 3.26Å; V143-V145 PolarHBondContact O-N 3.41Å; V143-Y146 PolarHBondContact O-N 3.35Å; V143-V147 HydrophobicContact CG1-CG2 4.21Å; V143-V147 WeakPolarHBondContact O-CB 3.38Å; V143-V147 VanDerWaalsContact O-CG2 3.25Å; V143-V147 WeakPolarHBondContact O-CG2 3.43Å; V143-V147 PolarHBondContact O-N 2.91Å; V143-W184 HydrophobicContact CG1-CE3 4.04Å; V143-W184 HydrophobicContact CG1-CZ3 3.95Å; V143-A191 HydrophobicContact CG2-CB 3.5Å; V143-A191 VanDerWaalsContact CG2-CB 3.5Å |
| 144 | T | 95.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -62.8 | -33.7 | -179 | 52.1 | 0 | 0 | 0 | 0 | 112.4 | L108 M109 L140 Q141 P142 S148 | L108-T144 HydrophobicContact CB-CG2 3.9Å; M109-T144 WeakPolarHBondContact CE-OG1 3.27Å; L140-T144 HydrophobicContact CD1-CG2 3.99Å; L140-T144 HydrophobicContact CG-CG2 4.13Å; L140-T144 WeakPolarHBondContact O-CG2 3.41Å; L140-T144 PolarHBondContact O-N 3.39Å; L140-T144 PolarHBondContact O-OG1 3.2Å; Q141-T144 PolarHBondContact O-N 3.49Å; Q141-T144 PolarHBondContact O-OG1 3Å; P142-T144 PolarHBondContact O-N 3.41Å; T144-S148 WeakPolarHBondContact O-CB 3.27Å; T144-S148 PolarHBondContact O-N 3.39Å; T144-S148 VanDerWaalsContact O-N 3.13Å; T144-S148 PolarHBondContact O-OG 3.41Å |
| 145 | V | 93.2 | Very high | 93.4 | Very high | 7 Ų | 7 | 24.3 Ų | 24.3 | 4% | 0.042 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -65.9 | -50.4 | 173.7 | -179.8 | 0 | 0 | 0 | 0 | 111 | M109 Q141 P142 V143 V147 S148 V149 F287 W291 | M109-V145 HydrophobicContact CE-CB 4.32Å; M109-V145 HydrophobicContact CE-CG2 3.37Å; Q141-V145 VanDerWaalsContact O-CG2 3.26Å; Q141-V145 WeakPolarHBondContact O-CG2 3.15Å; Q141-V145 PolarHBondContact O-N 3.34Å; P142-V145 WeakPolarHBondContact O-CB 3.42Å; P142-V145 PolarHBondContact O-N 3.06Å; V143-V145 VanDerWaalsContact C-N 3.26Å; V143-V145 PolarHBondContact O-N 3.41Å; V145-V147 VanDerWaalsContact C-N 3.34Å; V145-V147 PolarHBondContact O-N 3.01Å; V145-S148 WeakPolarHBondContact O-CB 3.45Å; V145-S148 PolarHBondContact O-N 3.3Å; V145-S148 VanDerWaalsContact O-N 3.09Å; V145-V149 WeakPolarHBondContact O-CG2 3.26Å; V145-V149 PolarHBondContact O-N 2.95Å; V145-F287 HydrophobicContact CG1-CZ 4.13Å; V145-W291 HydrophobicContact CB-CH2 3.93Å; V145-W291 HydrophobicContact CB-CZ2 4.17Å; V145-W291 HydrophobicContact CG1-CD2 4.31Å; V145-W291 HydrophobicContact CG1-CE3 4.12Å; V145-W291 HydrophobicContact CG1-CH2 3.42Å; V145-W291 VanDerWaalsContact CG1-CH2 3.42Å; V145-W291 HydrophobicContact CG1-CZ2 3.56Å; V145-W291 HydrophobicContact CG1-CZ3 3.68Å; V145-W291 HydrophobicContact CG2-CH2 3.15Å; V145-W291 HydrophobicContact CG2-CZ2 3.49Å; V145-W291 VanDerWaalsContact CG2-CZ2 3.49Å; V145-W291 HydrophobicContact CG2-CZ3 4.07Å |
| 146 | Y | 95.1 | Very high | 92.9 | Very high | 23 Ų | 23 | 20.3 Ų | 20.3 | 9% | 0.09 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -65.1 | -39.7 | -178.2 | -58.3 | -20.7 | 0 | 0 | 0 | 111.5 | P142 V143 S148 V149 F150 S187 L190 A191 L229 T233 | P142-Y146 HydrophobicContact CB-CE2 3.85Å; P142-Y146 WeakPolarHBondContact O-CD1 3.33Å; P142-Y146 WeakPolarHBondContact O-CD2 3.16Å; P142-Y146 PolarHBondContact O-N 3.04Å; V143-Y146 PolarHBondContact O-N 3.35Å; Y146-S148 VanDerWaalsContact C-N 3.25Å; Y146-S148 PolarHBondContact O-N 3.07Å; Y146-V149 PolarHBondContact O-N 2.92Å; Y146-F150 WeakPolarHBondContact O-CD2 3.49Å; Y146-F150 WeakPolarHBondContact O-CG 3.27Å; Y146-F150 PolarHBondContact O-N 2.84Å; Y146-S187 WeakPolarHBondContact CB-OG 3.15Å; Y146-L190 HydrophobicContact CD2-CB 4.06Å; Y146-L190 HydrophobicContact CE2-CB 4.1Å; Y146-A191 HydrophobicContact CE2-CB 4.2Å; Y146-L229 HydrophobicContact CE1-CD2 4.44Å; Y146-L229 HydrophobicContact CE2-CD2 3.99Å; Y146-L229 WeakPolarHBondContact OH-CD1 3.45Å; Y146-T233 HydrophobicContact CD1-CG2 3.7Å; Y146-T233 HydrophobicContact CE1-CG2 3.97Å; Y146-T233 HydrophobicContact CG-CG2 4.16Å |
| 147 | V | 96.8 | Very high | 92.5 | Very high | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -56.5 | -44.1 | 172.3 | 170.1 | 0 | 0 | 0 | 0 | 110.2 | V143 V145 T151 I183 W184 S187 | V143-V147 HydrophobicContact CG1-CG2 4.21Å; V143-V147 WeakPolarHBondContact O-CB 3.38Å; V143-V147 VanDerWaalsContact O-CG2 3.25Å; V143-V147 WeakPolarHBondContact O-CG2 3.43Å; V143-V147 PolarHBondContact O-N 2.91Å; V145-V147 VanDerWaalsContact C-N 3.34Å; V145-V147 PolarHBondContact O-N 3.01Å; V147-T151 WeakPolarHBondContact O-CB 3.45Å; V147-T151 PolarHBondContact O-N 3.31Å; V147-T151 PolarHBondContact O-OG1 3.42Å; V147-I183 HydrophobicContact CB-CG2 4.22Å; V147-I183 HydrophobicContact CG1-CG2 4.08Å; V147-I183 HydrophobicContact CG2-CG2 4.19Å; V147-W184 HydrophobicContact CG1-CD2 4.47Å; V147-W184 HydrophobicContact CG1-CZ2 4.06Å; V147-W184 HydrophobicContact CG2-CD2 3.72Å; V147-W184 HydrophobicContact CG2-CE3 3.85Å; V147-W184 HydrophobicContact CG2-CG 4.14Å; V147-W184 HydrophobicContact CG2-CH2 4.42Å; V147-W184 HydrophobicContact CG2-CZ2 4.33Å; V147-W184 HydrophobicContact CG2-CZ3 4.2Å; V147-S187 WeakPolarHBondContact CG2-OG 3.39Å; V147-S187 PolarHBondContact N-OG 2.83Å |
| 148 | S | 94.4 | Very high | 92.1 | Very high | 1 Ų | 1 | 20 Ų | 20 | 1% | 0.007 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63 | -48.7 | 179.7 | -59.3 | 0 | 0 | 0 | 0 | 111.9 | S105 T144 V145 Y146 T151 L152 | S105-S148 PolarHBondContact OG-OG 3.04Å; S105-S148 VanDerWaalsContact OG-OG 3.1Å; T144-S148 WeakPolarHBondContact O-CB 3.27Å; T144-S148 PolarHBondContact O-N 3.39Å; T144-S148 VanDerWaalsContact O-N 3.13Å; T144-S148 PolarHBondContact O-OG 3.41Å; V145-S148 WeakPolarHBondContact O-CB 3.45Å; V145-S148 PolarHBondContact O-N 3.3Å; V145-S148 VanDerWaalsContact O-N 3.09Å; Y146-S148 VanDerWaalsContact C-N 3.25Å; Y146-S148 PolarHBondContact O-N 3.07Å; S148-T151 PolarHBondContact O-N 3.41Å; S148-L152 WeakPolarHBondContact O-CB 3.4Å; S148-L152 WeakPolarHBondContact O-CG 3.36Å; S148-L152 PolarHBondContact O-N 3.3Å |
| 149 | V | 92.3 | Very high | 91.6 | Very high | 6 Ų | 6 | 20.3 Ų | 20.3 | 4% | 0.036 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -58.3 | -52.2 | 177.2 | 171.5 | 0 | 0 | 0 | 0 | 111.8 | V145 Y146 T151 L152 T153 T233 P237 F287 | V145-V149 WeakPolarHBondContact O-CG2 3.26Å; V145-V149 PolarHBondContact O-N 2.95Å; Y146-V149 PolarHBondContact O-N 2.92Å; V149-T151 VanDerWaalsContact C-N 3.28Å; V149-T151 PolarHBondContact O-N 3.4Å; V149-L152 PolarHBondContact O-N 3.02Å; V149-T153 WeakPolarHBondContact O-CB 3.34Å; V149-T153 PolarHBondContact O-N 2.64Å; V149-T153 PolarHBondContact O-OG1 3.47Å; V149-T233 WeakPolarHBondContact CG1-O 3.26Å; V149-T233 WeakPolarHBondContact CG2-O 3.41Å; V149-P237 HydrophobicContact CG1-CB 3.86Å; V149-P237 HydrophobicContact CG1-CG 3.43Å; V149-P237 VanDerWaalsContact CG1-CG 3.43Å; V149-F287 HydrophobicContact CG2-CD1 4.39Å; V149-F287 HydrophobicContact CG2-CE1 3.37Å; V149-F287 HydrophobicContact CG2-CE2 4.44Å; V149-F287 HydrophobicContact CG2-CZ 3.4Å |
| 150 | F | 94.2 | Very high | 91 | Very high | 32 Ų | 32 | 19.5 Ų | 19.5 | 14% | 0.14 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -68.5 | -32.3 | -177.2 | -65.5 | -45.5 | 0 | 0 | 0 | 111.6 | Y146 T153 T154 I183 L186 L190 T233 | Y146-F150 WeakPolarHBondContact O-CD2 3.49Å; Y146-F150 WeakPolarHBondContact O-CG 3.27Å; Y146-F150 PolarHBondContact O-N 2.84Å; F150-T153 PolarHBondContact O-N 3.35Å; F150-T154 WeakPolarHBondContact O-CB 3.49Å; F150-T154 PolarHBondContact O-N 2.89Å; F150-T154 PolarHBondContact O-OG1 3.03Å; F150-I183 HydrophobicContact CB-CB 4.46Å; F150-I183 HydrophobicContact CB-CD1 4.43Å; F150-I183 HydrophobicContact CB-CG1 3.98Å; F150-I183 HydrophobicContact CB-CG2 3.81Å; F150-I183 HydrophobicContact CD2-CG2 4.46Å; F150-L186 HydrophobicContact CD2-CD2 4.3Å; F150-L186 HydrophobicContact CE1-CD2 4.4Å; F150-L186 HydrophobicContact CE2-CD2 3.84Å; F150-L186 HydrophobicContact CE2-CG 4Å; F150-L186 HydrophobicContact CZ-CD2 3.9Å; F150-L186 HydrophobicContact CZ-CG 4.34Å; F150-L190 HydrophobicContact CE2-CD1 3.85Å; F150-L190 HydrophobicContact CZ-CD1 3.69Å; F150-T233 HydrophobicContact CZ-CG2 4.06Å |
| 151 | T | 94.1 | Very high | 90.4 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -65.2 | -48.2 | 172.7 | -60.1 | 0 | 0 | 0 | 0 | 110.9 | L98 N101 L102 V147 S148 V149 T153 T154 I155 | L98-T151 HydrophobicContact CB-CG2 4.09Å; L98-T151 WeakPolarHBondContact O-CG2 3.27Å; N101-T151 PolarHBondContact ND2-OG1 3.44Å; L102-T151 HydrophobicContact CB-CG2 4Å; V147-T151 WeakPolarHBondContact O-CB 3.45Å; V147-T151 PolarHBondContact O-N 3.31Å; V147-T151 PolarHBondContact O-OG1 3.42Å; S148-T151 PolarHBondContact O-N 3.41Å; V149-T151 VanDerWaalsContact C-N 3.28Å; V149-T151 PolarHBondContact O-N 3.4Å; T151-T153 VanDerWaalsContact C-N 3.31Å; T151-T153 PolarHBondContact O-N 3.48Å; T151-T154 PolarHBondContact O-N 2.93Å; T151-T154 VanDerWaalsContact O-N 3.17Å; T151-I155 HydrophobicContact CG2-CD1 3.99Å; T151-I155 HydrophobicContact CG2-CG1 4.47Å; T151-I155 VanDerWaalsContact O-CG1 3.27Å; T151-I155 WeakPolarHBondContact O-CG1 3.28Å; T151-I155 PolarHBondContact O-N 2.86Å |
| 152 | L | 90.1 | Very high | 89.7 | Confident | 8 Ų | 8 | 20.3 Ų | 20.3 | 4% | 0.042 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -59.5 | -41.9 | 176 | -73.5 | 174.4 | 0 | 0 | 0 | 112.1 | L102 S148 V149 I155 A156 V283 V284 F287 | L102-L152 HydrophobicContact CD1-CG 4.26Å; L102-L152 HydrophobicContact CD2-CD2 3.74Å; L102-L152 HydrophobicContact CD2-CG 4.29Å; S148-L152 WeakPolarHBondContact O-CB 3.4Å; S148-L152 WeakPolarHBondContact O-CG 3.36Å; S148-L152 PolarHBondContact O-N 3.3Å; V149-L152 PolarHBondContact O-N 3.02Å; L152-I155 PolarHBondContact O-N 3.35Å; L152-A156 WeakPolarHBondContact O-CB 3.49Å; L152-A156 PolarHBondContact O-N 3.48Å; L152-V283 HydrophobicContact CD1-CG1 4.26Å; L152-V283 HydrophobicContact CD2-CB 4.43Å; L152-V283 HydrophobicContact CD2-CG1 3.44Å; L152-V283 VanDerWaalsContact CD2-CG1 3.44Å; L152-V284 HydrophobicContact CB-CG2 4.15Å; L152-V284 HydrophobicContact CD1-CG2 4.49Å; L152-F287 HydrophobicContact CD1-CB 4.24Å; L152-F287 HydrophobicContact CD1-CD2 4.24Å; L152-F287 HydrophobicContact CD1-CG 4.19Å |
| 153 | T | 90.1 | Very high | 88.8 | Confident | 19 Ų | 19 | 20.2 Ų | 20.2 | 12% | 0.117 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -62 | -45.4 | 175.1 | -53.5 | 0 | 0 | 0 | 0 | 111.1 | V149 F150 T151 I155 A156 L157 P237 | V149-T153 WeakPolarHBondContact O-CB 3.34Å; V149-T153 PolarHBondContact O-N 2.64Å; V149-T153 PolarHBondContact O-OG1 3.47Å; F150-T153 PolarHBondContact O-N 3.35Å; T151-T153 VanDerWaalsContact C-N 3.31Å; T151-T153 PolarHBondContact O-N 3.48Å; T153-I155 PolarHBondContact O-N 2.88Å; T153-A156 PolarHBondContact O-N 2.95Å; T153-L157 HydrophobicContact CG2-CD1 4.29Å; T153-L157 WeakPolarHBondContact O-CG 3.24Å; T153-L157 PolarHBondContact O-N 3.29Å; T153-P237 WeakPolarHBondContact OG1-CB 3.34Å |
| 154 | T | 90.4 | Very high | 87.9 | Confident | 38 Ų | 38 | 20.8 Ų | 20.8 | 23% | 0.233 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -63.4 | -41.1 | 177.7 | -57.7 | 0 | 0 | 0 | 0 | 111.5 | L98 F150 T151 L157 D158 | L98-T154 HydrophobicContact CD1-CG2 3.77Å; L98-T154 HydrophobicContact CD2-CG2 4.26Å; F150-T154 WeakPolarHBondContact O-CB 3.49Å; F150-T154 PolarHBondContact O-N 2.89Å; F150-T154 PolarHBondContact O-OG1 3.03Å; T151-T154 PolarHBondContact O-N 2.93Å; T151-T154 VanDerWaalsContact O-N 3.17Å; T154-L157 PolarHBondContact O-N 2.89Å; T154-D158 WeakPolarHBondContact O-CB 3.33Å; T154-D158 PolarHBondContact O-N 3.28Å |
| 155 | I | 88.6 | Confident | 87.1 | Confident | 1 Ų | 1 | 24.4 Ų | 24.4 | 1% | 0.005 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.2 | -46.4 | 174 | -66.5 | 165.4 | 0 | 0 | 0 | 110.1 | T95 L98 I99 T151 L152 T153 L157 D158 R159 L280 | T95-I155 HydrophobicContact CG2-CG2 3.95Å; L98-I155 HydrophobicContact CB-CD1 3.9Å; L98-I155 HydrophobicContact CB-CG1 3.51Å; L98-I155 HydrophobicContact CD1-CG1 3.79Å; L98-I155 HydrophobicContact CG-CG1 4.29Å; I99-I155 HydrophobicContact CG1-CD1 4.06Å; T151-I155 HydrophobicContact CG2-CD1 3.99Å; T151-I155 HydrophobicContact CG2-CG1 4.47Å; T151-I155 VanDerWaalsContact O-CG1 3.27Å; T151-I155 WeakPolarHBondContact O-CG1 3.28Å; T151-I155 PolarHBondContact O-N 2.86Å; L152-I155 PolarHBondContact O-N 3.35Å; T153-I155 PolarHBondContact O-N 2.88Å; I155-L157 VanDerWaalsContact C-N 3.32Å; I155-L157 PolarHBondContact O-N 3.28Å; I155-D158 PolarHBondContact O-N 2.92Å; I155-R159 HydrophobicContact CG2-CG 4.25Å; I155-R159 WeakPolarHBondContact O-CB 3.45Å; I155-R159 WeakPolarHBondContact O-CG 3.11Å; I155-R159 PolarHBondContact O-N 3.37Å; I155-L280 HydrophobicContact CG2-CD1 4.23Å; I155-L280 HydrophobicContact CG2-CD2 3.35Å; I155-L280 HydrophobicContact CG2-CG 4.38Å |
| 156 | A | 84.1 | Confident | 86.1 | Confident | 2 Ų | 2 | 27 Ų | 27 | 2% | 0.017 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61.1 | -40.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L152 T153 R159 Y160 I241 | L152-A156 WeakPolarHBondContact O-CB 3.49Å; L152-A156 PolarHBondContact O-N 3.48Å; T153-A156 PolarHBondContact O-N 2.95Å; A156-R159 PolarHBondContact O-N 3.36Å; A156-Y160 WeakPolarHBondContact O-CB 3.48Å; A156-Y160 PolarHBondContact O-N 3.44Å; A156-I241 HydrophobicContact CB-CD1 4.29Å; A156-I241 HydrophobicContact CB-CG1 3.69Å |
| 157 | L | 84.8 | Confident | 85.1 | Confident | 81 Ų | 81 | 34.4 Ų | 34.4 | 42% | 0.424 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -67.3 | -45.6 | 176.5 | -70.7 | 174.1 | 0 | 0 | 0 | 112.8 | T153 T154 I155 R159 Y160 V161 | T153-L157 HydrophobicContact CG2-CD1 4.29Å; T153-L157 WeakPolarHBondContact O-CG 3.24Å; T153-L157 PolarHBondContact O-N 3.29Å; T154-L157 PolarHBondContact O-N 2.89Å; I155-L157 VanDerWaalsContact C-N 3.32Å; I155-L157 PolarHBondContact O-N 3.28Å; L157-R159 PolarHBondContact O-N 3.02Å; L157-Y160 WeakPolarHBondContact O-CB 3.5Å; L157-Y160 PolarHBondContact O-N 3.34Å; L157-V161 WeakPolarHBondContact O-CG2 3.4Å; L157-V161 PolarHBondContact O-N 2.91Å |
| 158 | D | 85.4 | Confident | 84 | Confident | 7 Ų | 7 | 43.1 Ų | 43.1 | 4% | 0.037 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -53 | -46.6 | 173.4 | 171.2 | 76.4 | 0 | 0 | 0 | 110.3 | T95 T154 I155 V161 V162 I171 | T95-D158 PolarHBondContact OG1-OD2 3.12Å; T154-D158 WeakPolarHBondContact O-CB 3.33Å; T154-D158 PolarHBondContact O-N 3.28Å; I155-D158 PolarHBondContact O-N 2.92Å; D158-V161 PolarHBondContact O-N 3.3Å; D158-V162 WeakPolarHBondContact O-CB 3.34Å; D158-V162 VanDerWaalsContact O-CG2 3.29Å; D158-V162 WeakPolarHBondContact O-CG2 3.48Å; D158-V162 PolarHBondContact O-N 3.07Å; D158-I171 HydrophobicContact CB-CD1 4.45Å |
| 159 | R | 81.1 | Confident | 83 | Confident | 58 Ų | 58 | 54.8 Ų | 54.8 | 22% | 0.219 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -70.8 | -39.3 | -175.8 | -65.4 | -79.9 | 114.7 | 167.5 | 4.4 | 111.2 | T95 I155 A156 L157 V162 L163 F277 L280 | T95-R159 PolarHBondContact OG1-NE 3.26Å; T95-R159 PolarHBondContact OG1-NH2 2.93Å; I155-R159 HydrophobicContact CG2-CG 4.25Å; I155-R159 WeakPolarHBondContact O-CB 3.45Å; I155-R159 WeakPolarHBondContact O-CG 3.11Å; I155-R159 PolarHBondContact O-N 3.37Å; A156-R159 PolarHBondContact O-N 3.36Å; L157-R159 PolarHBondContact O-N 3.02Å; R159-V162 PolarHBondContact O-N 3.41Å; R159-L163 VanDerWaalsContact O-CB 3.31Å; R159-L163 WeakPolarHBondContact O-CB 3.33Å; R159-L163 WeakPolarHBondContact O-CG 3.34Å; R159-L163 PolarHBondContact O-N 3.31Å; R159-F277 HydrophobicContact CB-CD2 4.43Å; R159-L280 HydrophobicContact CB-CD1 3.42Å; R159-L280 VanDerWaalsContact CB-CD1 3.42Å; R159-L280 HydrophobicContact CG-CD1 3.28Å |
| 160 | Y | 80.8 | Confident | 82.1 | Confident | 35 Ų | 35 | 64.3 Ų | 64.3 | 14% | 0.137 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -57 | -50.3 | 170.2 | 171.2 | -98.7 | 0 | 0 | 0 | 111.8 | A156 L157 V162 L163 V164 R247 V248 | A156-Y160 WeakPolarHBondContact O-CB 3.48Å; A156-Y160 PolarHBondContact O-N 3.44Å; L157-Y160 WeakPolarHBondContact O-CB 3.5Å; L157-Y160 PolarHBondContact O-N 3.34Å; Y160-V162 PolarHBondContact O-N 3.4Å; Y160-L163 PolarHBondContact O-N 3.04Å; Y160-V164 HydrophobicContact CD2-CG2 3.76Å; Y160-V164 HydrophobicContact CE2-CB 4.18Å; Y160-V164 HydrophobicContact CE2-CG1 4.48Å; Y160-V164 HydrophobicContact CE2-CG2 3.5Å; Y160-V164 HydrophobicContact CG-CG2 4.5Å; Y160-V164 WeakPolarHBondContact O-CB 3.44Å; Y160-V164 WeakPolarHBondContact O-CG2 3.29Å; Y160-V164 PolarHBondContact O-N 2.87Å; Y160-R247 HydrophobicContact CE2-CB 3.82Å; Y160-V248 HydrophobicContact CD2-CG2 3.77Å; Y160-V248 HydrophobicContact CE2-CG2 4.38Å |
| 161 | V | 83 | Confident | 81.3 | Confident | 47 Ų | 47 | 65.8 Ų | 65.8 | 29% | 0.285 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -61.5 | -47.2 | -179.5 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | L157 D158 L163 H165 | L157-V161 WeakPolarHBondContact O-CG2 3.4Å; L157-V161 PolarHBondContact O-N 2.91Å; D158-V161 PolarHBondContact O-N 3.3Å; V161-L163 VanDerWaalsContact C-N 3.29Å; V161-L163 PolarHBondContact O-N 2.67Å; V161-H165 CarbonylContact O-C 3.6Å; V161-H165 WeakPolarHBondContact O-CA 3.21Å; V161-H165 WeakPolarHBondContact O-CB 3.39Å; V161-H165 PolarHBondContact O-N 2.89Å |
| 162 | V | 80 | Confident | 80.9 | Confident | 32 Ų | 32 | 68.2 Ų | 68.2 | 19% | 0.194 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.8 | -34.6 | -179.9 | 170 | 0 | 0 | 0 | 0 | 112.4 | D158 R159 Y160 | D158-V162 WeakPolarHBondContact O-CB 3.34Å; D158-V162 VanDerWaalsContact O-CG2 3.29Å; D158-V162 WeakPolarHBondContact O-CG2 3.48Å; D158-V162 PolarHBondContact O-N 3.07Å; R159-V162 PolarHBondContact O-N 3.41Å; Y160-V162 PolarHBondContact O-N 3.4Å |
| 163 | L | 74.7 | Confident | 80.7 | Confident | 23 Ų | 23 | 72 Ų | 72 | 12% | 0.12 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -84.7 | -41.6 | -177.4 | -69 | 178.5 | 0 | 0 | 0 | 113.2 | R159 Y160 V161 V248 R273 F277 | R159-L163 VanDerWaalsContact O-CB 3.31Å; R159-L163 WeakPolarHBondContact O-CB 3.33Å; R159-L163 WeakPolarHBondContact O-CG 3.34Å; R159-L163 PolarHBondContact O-N 3.31Å; Y160-L163 PolarHBondContact O-N 3.04Å; V161-L163 VanDerWaalsContact C-N 3.29Å; V161-L163 PolarHBondContact O-N 2.67Å; L163-V248 HydrophobicContact CB-CG2 4.5Å; L163-V248 HydrophobicContact CD1-CG1 4.16Å; L163-R273 HydrophobicContact CD2-CB 3.59Å; L163-R273 HydrophobicContact CD2-CG 3.6Å; L163-F277 HydrophobicContact CD1-CB 3.71Å; L163-F277 HydrophobicContact CD1-CD2 4.07Å; L163-F277 HydrophobicContact CD1-CG 4.03Å |
| 164 | V | 76.3 | Confident | 80.6 | Confident | 16 Ų | 16 | 80.9 Ų | 80.9 | 10% | 0.097 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -85.7 | -38.1 | -175.8 | -179.4 | 0 | 0 | 0 | 0 | 111.5 | Y160 P166 V248 K251 R255 | Y160-V164 HydrophobicContact CD2-CG2 3.76Å; Y160-V164 HydrophobicContact CE2-CB 4.18Å; Y160-V164 HydrophobicContact CE2-CG1 4.48Å; Y160-V164 HydrophobicContact CE2-CG2 3.5Å; Y160-V164 HydrophobicContact CG-CG2 4.5Å; Y160-V164 WeakPolarHBondContact O-CB 3.44Å; Y160-V164 WeakPolarHBondContact O-CG2 3.29Å; Y160-V164 PolarHBondContact O-N 2.87Å; V164-P166 VanDerWaalsContact C-CD 3.45Å; V164-P166 VanDerWaalsContact O-CD 3.27Å; V164-P166 WeakPolarHBondContact O-CD 3.48Å; V164-V248 HydrophobicContact CG2-CG2 3.64Å; V164-K251 HydrophobicContact CG1-CG 4.37Å; V164-R255 PolarHBondContact O-NH2 2.89Å |
| 165 | H | 78.8 | Confident | 80.6 | Confident | 77 Ų | 77 | 83.9 Ų | 83.9 | 36% | 0.356 | 38% | 0.383 | S | S | . | . | trans | -121.4 | 65.2 | -172.9 | -54.3 | 99.7 | 0 | 0 | 0 | 112.4 | V161 L167 R168 | V161-H165 CarbonylContact O-C 3.6Å; V161-H165 WeakPolarHBondContact O-CA 3.21Å; V161-H165 WeakPolarHBondContact O-CB 3.39Å; V161-H165 PolarHBondContact O-N 2.89Å; H165-L167 PolarHBondContact O-N 2.95Å; H165-L167 VanDerWaalsContact O-N 3.09Å; H165-R168 HydrophobicContact CB-CB 4.2Å; H165-R168 HydrophobicContact CB-CG 4.09Å; H165-R168 PolarHBondContact O-N 3.2Å | ||
| 166 | P | 73.1 | Confident | 80.6 | Confident | 62 Ų | 62 | 84 Ų | 84 | 40% | 0.403 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65 | -18.2 | -174.7 | 28.9 | -37.5 | 0 | 0 | 0 | 114.3 | V164 R255 | V164-P166 VanDerWaalsContact C-CD 3.45Å; V164-P166 VanDerWaalsContact O-CD 3.27Å; V164-P166 WeakPolarHBondContact O-CD 3.48Å; P166-R255 VanDerWaalsContact CG-NH2 3.26Å |
| 167 | L | 73.2 | Confident | 81 | Confident | 178 Ų | 178 | 85.7 Ų | 85.7 | 93% | 0.932 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.6 | -8.3 | 178.1 | -61 | 175.3 | 0 | 0 | 0 | 113 | H165 | H165-L167 PolarHBondContact O-N 2.95Å; H165-L167 VanDerWaalsContact O-N 3.09Å |
| 168 | R | 75.3 | Confident | 81.4 | Confident | 182 Ų | 182 | 90.1 Ų | 90.1 | 69% | 0.687 | 41% | 0.411 | S | S | * | . | S | Bend | trans | -75.6 | 145.9 | 173 | -83.8 | -161 | 176.7 | -153.1 | 1.7 | 110.4 | H165 R170 | H165-R168 HydrophobicContact CB-CB 4.2Å; H165-R168 HydrophobicContact CB-CG 4.09Å; H165-R168 PolarHBondContact O-N 3.2Å; R168-R170 PolarHBondContact O-N 2.93Å |
| 169 | R | 72.1 | Confident | 81.8 | Confident | 247 Ų | 247 | 91.5 Ų | 91.5 | 93% | 0.932 | 42% | 0.423 | S | S | * | . | P | Polyproline II helix | trans | -55.8 | 126.6 | 176.4 | -161.9 | 173.6 | -171.6 | 155.2 | 2.2 | 109.3 | ||
| 170 | R | 73.9 | Confident | 82.5 | Confident | 205 Ų | 205 | 89.4 Ų | 89.4 | 77% | 0.774 | 42% | 0.417 | S | S | * | . | P | Polyproline II helix | trans | -64.4 | 144.9 | 178.8 | -65.1 | -171.1 | -178.7 | -165.2 | 3.1 | 110.1 | R168 S172 | R168-R170 PolarHBondContact O-N 2.93Å; R170-S172 PolarHBondContact O-N 3.17Å |
| 171 | I | 77.8 | Confident | 83.3 | Confident | 64 Ų | 64 | 93.2 Ų | 93.2 | 33% | 0.328 | 44% | 0.439 | S | S | . | . | P | Polyproline II helix | trans | -58.2 | 131 | 169.5 | -58.3 | 176.4 | 0 | 0 | 0 | 107.3 | V94 D158 I175 S176 | V94-I171 HydrophobicContact CG1-CG2 4.46Å; V94-I171 WeakPolarHBondContact CG2-O 3.3Å; D158-I171 HydrophobicContact CB-CD1 4.45Å; I171-I175 HydrophobicContact CG2-CB 3.96Å; I171-I175 HydrophobicContact CG2-CG2 3.89Å; I171-S176 WeakPolarHBondContact CG2-OG 3.31Å |
| 172 | S | 85.7 | Confident | 84 | Confident | 51 Ų | 51 | 92.8 Ų | 92.8 | 36% | 0.357 | 44% | 0.444 | S | S | . | . | P | Polyproline II helix | trans | -85.7 | 154.3 | 176.6 | 72.9 | 0 | 0 | 0 | 0 | 110.1 | R170 R174 I175 S176 | R170-S172 PolarHBondContact O-N 3.17Å; S172-R174 PolarHBondContact O-N 3.27Å; S172-R174 VanDerWaalsContact O-N 3.14Å; S172-I175 PolarHBondContact O-N 2.64Å; S172-I175 WeakPolarHBondContact OG-CG1 3.44Å; S172-I175 PolarHBondContact OG-N 3.01Å; S172-S176 PolarHBondContact O-N 3.24Å; S172-S176 PolarHBondContact O-OG 3.15Å |
| 173 | L | 85.3 | Confident | 84.8 | Confident | 88 Ų | 88 | 91.9 Ų | 91.9 | 46% | 0.461 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -55 | -31.9 | 174.9 | -77.9 | 164.7 | 0 | 0 | 0 | 112.7 | V94 F97 S176 A177 | V94-L173 HydrophobicContact CG2-CD2 4.31Å; V94-L173 HydrophobicContact CG2-CG 4.45Å; F97-L173 HydrophobicContact CB-CD2 4.08Å; F97-L173 HydrophobicContact CG-CD2 4.41Å; L173-S176 PolarHBondContact O-N 2.86Å; L173-A177 PolarHBondContact O-N 2.94Å |
| 174 | R | 89.1 | Confident | 85.9 | Confident | 205 Ų | 205 | 93.9 Ų | 93.9 | 77% | 0.774 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -64 | -46.6 | 175.5 | -64.7 | -176.8 | -175.3 | 170.5 | 0.5 | 111.7 | S172 S176 A177 Y178 | S172-R174 PolarHBondContact O-N 3.27Å; S172-R174 VanDerWaalsContact O-N 3.14Å; R174-S176 VanDerWaalsContact C-N 3.29Å; R174-S176 PolarHBondContact O-N 3.36Å; R174-A177 WeakPolarHBondContact O-CB 3.46Å; R174-A177 PolarHBondContact O-N 3.47Å; R174-Y178 WeakPolarHBondContact O-CD2 3.5Å; R174-Y178 PolarHBondContact O-N 3.5Å; R174-Y178 VanDerWaalsContact O-N 3.12Å |
| 175 | I | 88.9 | Confident | 86.9 | Confident | 100 Ų | 100 | 95.9 Ų | 95.9 | 51% | 0.513 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -63.3 | -40.1 | 176.6 | -64.3 | 167.4 | 0 | 0 | 0 | 109.9 | I171 S172 A177 Y178 A179 | I171-I175 HydrophobicContact CG2-CB 3.96Å; I171-I175 HydrophobicContact CG2-CG2 3.89Å; S172-I175 PolarHBondContact O-N 2.64Å; S172-I175 WeakPolarHBondContact OG-CG1 3.44Å; S172-I175 PolarHBondContact OG-N 3.01Å; I175-A177 VanDerWaalsContact C-N 3.33Å; I175-A177 PolarHBondContact O-N 2.84Å; I175-Y178 PolarHBondContact O-N 3.26Å; I175-A179 WeakPolarHBondContact O-CB 3.47Å; I175-A179 PolarHBondContact O-N 2.92Å |
| 176 | S | 89.7 | Confident | 87.8 | Confident | 5 Ų | 5 | 96.1 Ų | 96.1 | 4% | 0.035 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -63.1 | -36.6 | 175.6 | -53.5 | 0 | 0 | 0 | 0 | 113 | V94 I171 S172 L173 R174 A179 V180 | V94-S176 WeakPolarHBondContact CG1-OG 3.45Å; V94-S176 WeakPolarHBondContact CG2-OG 3.11Å; I171-S176 WeakPolarHBondContact CG2-OG 3.31Å; S172-S176 PolarHBondContact O-N 3.24Å; S172-S176 PolarHBondContact O-OG 3.15Å; L173-S176 PolarHBondContact O-N 2.86Å; R174-S176 VanDerWaalsContact C-N 3.29Å; R174-S176 PolarHBondContact O-N 3.36Å; S176-A179 PolarHBondContact O-N 3.3Å; S176-V180 WeakPolarHBondContact O-CG2 3.28Å; S176-V180 PolarHBondContact O-N 3.05Å |
| 177 | A | 92.4 | Very high | 88.9 | Confident | 37 Ų | 37 | 93.2 Ų | 93.2 | 31% | 0.306 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.6 | -45.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | F97 L173 R174 I175 A179 V180 L181 | F97-A177 HydrophobicContact CE1-CB 4.46Å; F97-A177 HydrophobicContact CZ-CB 4.37Å; L173-A177 PolarHBondContact O-N 2.94Å; R174-A177 WeakPolarHBondContact O-CB 3.46Å; R174-A177 PolarHBondContact O-N 3.47Å; I175-A177 VanDerWaalsContact C-N 3.33Å; I175-A177 PolarHBondContact O-N 2.84Å; A177-A179 VanDerWaalsContact C-N 3.31Å; A177-A179 PolarHBondContact O-N 3.47Å; A177-V180 PolarHBondContact O-N 3.32Å; A177-L181 WeakPolarHBondContact O-CG 3.39Å; A177-L181 PolarHBondContact O-N 2.91Å |
| 178 | Y | 93.9 | Very high | 90.1 | Very high | 174 Ų | 174 | 86 Ų | 86 | 68% | 0.682 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -62.3 | -38.4 | 173.2 | -68.5 | -61.7 | 0 | 0 | 0 | 112.5 | R174 I175 L181 G182 | R174-Y178 WeakPolarHBondContact O-CD2 3.5Å; R174-Y178 PolarHBondContact O-N 3.5Å; R174-Y178 VanDerWaalsContact O-N 3.12Å; I175-Y178 PolarHBondContact O-N 3.26Å; Y178-L181 PolarHBondContact O-N 3.16Å; Y178-G182 PolarHBondContact O-N 3.33Å |
| 179 | A | 93.4 | Very high | 91.1 | Very high | 36 Ų | 36 | 81.6 Ų | 81.6 | 30% | 0.298 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.2 | -43.4 | 175 | 0 | 0 | 0 | 0 | 0 | 111.5 | I175 S176 A177 G182 I183 | I175-A179 WeakPolarHBondContact O-CB 3.47Å; I175-A179 PolarHBondContact O-N 2.92Å; S176-A179 PolarHBondContact O-N 3.3Å; A177-A179 VanDerWaalsContact C-N 3.31Å; A177-A179 PolarHBondContact O-N 3.47Å; A179-G182 PolarHBondContact O-N 2.93Å; A179-I183 WeakPolarHBondContact O-CG1 3.5Å; A179-I183 PolarHBondContact O-N 3.32Å |
| 180 | V | 96.3 | Very high | 92.2 | Very high | 14 Ų | 14 | 72.2 Ų | 72.2 | 9% | 0.085 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -60.5 | -47.5 | 174.9 | 167.5 | 0 | 0 | 0 | 0 | 111.1 | F97 L98 N101 S176 A177 G182 I183 W184 | F97-V180 HydrophobicContact CD1-CG2 4.37Å; F97-V180 HydrophobicContact CE1-CB 4.39Å; F97-V180 HydrophobicContact CE1-CG2 3.72Å; L98-V180 HydrophobicContact CD2-CG2 3.82Å; N101-V180 HydrophobicContact CB-CG1 4.43Å; N101-V180 HydrophobicContact CB-CG2 4.15Å; N101-V180 VanDerWaalsContact OD1-CG1 3.26Å; N101-V180 WeakPolarHBondContact OD1-CG1 3.25Å; S176-V180 WeakPolarHBondContact O-CG2 3.28Å; S176-V180 PolarHBondContact O-N 3.05Å; A177-V180 PolarHBondContact O-N 3.32Å; V180-G182 VanDerWaalsContact C-N 3.3Å; V180-G182 PolarHBondContact O-N 3.08Å; V180-I183 WeakPolarHBondContact O-CB 3.38Å; V180-I183 PolarHBondContact O-N 3.08Å; V180-I183 VanDerWaalsContact O-N 3.12Å; V180-W184 VanDerWaalsContact O-CD1 3.25Å; V180-W184 PolarHBondContact O-N 2.82Å |
| 181 | L | 96.3 | Very high | 93.2 | Very high | 115 Ų | 115 | 62.5 Ų | 62.5 | 60% | 0.602 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -58.3 | -43 | 176 | -69.1 | 172.5 | 0 | 0 | 0 | 111.9 | A177 Y178 W184 A185 | A177-L181 WeakPolarHBondContact O-CG 3.39Å; A177-L181 PolarHBondContact O-N 2.91Å; Y178-L181 PolarHBondContact O-N 3.16Å; L181-W184 PolarHBondContact O-N 3.43Å; L181-A185 WeakPolarHBondContact O-CB 3.48Å; L181-A185 PolarHBondContact O-N 2.83Å |
| 182 | G | 97.1 | Very high | 93.9 | Very high | 38 Ų | 38 | 63.4 Ų | 63.4 | 39% | 0.392 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.1 | -38.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y178 A179 V180 A185 L186 | Y178-G182 PolarHBondContact O-N 3.33Å; A179-G182 PolarHBondContact O-N 2.93Å; V180-G182 VanDerWaalsContact C-N 3.3Å; V180-G182 PolarHBondContact O-N 3.08Å; G182-A185 PolarHBondContact O-N 2.95Å; G182-L186 WeakPolarHBondContact O-CB 3.39Å; G182-L186 PolarHBondContact O-N 3.38Å |
| 183 | I | 97.3 | Very high | 94.2 | Very high | 12 Ų | 12 | 63.2 Ų | 63.2 | 6% | 0.062 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.7 | -47.1 | 175.8 | -73 | 164.3 | 0 | 0 | 0 | 110.6 | V147 F150 A179 V180 S187 | V147-I183 HydrophobicContact CB-CG2 4.22Å; V147-I183 HydrophobicContact CG1-CG2 4.08Å; V147-I183 HydrophobicContact CG2-CG2 4.19Å; F150-I183 HydrophobicContact CB-CB 4.46Å; F150-I183 HydrophobicContact CB-CD1 4.43Å; F150-I183 HydrophobicContact CB-CG1 3.98Å; F150-I183 HydrophobicContact CB-CG2 3.81Å; F150-I183 HydrophobicContact CD2-CG2 4.46Å; A179-I183 WeakPolarHBondContact O-CG1 3.5Å; A179-I183 PolarHBondContact O-N 3.32Å; V180-I183 WeakPolarHBondContact O-CB 3.38Å; V180-I183 PolarHBondContact O-N 3.08Å; V180-I183 VanDerWaalsContact O-N 3.12Å; I183-S187 VanDerWaalsContact O-CB 3.22Å; I183-S187 WeakPolarHBondContact O-CB 3.34Å; I183-S187 PolarHBondContact O-N 3.1Å; I183-S187 PolarHBondContact O-OG 3.48Å |
| 184 | W | 98 | Very high | 94.4 | Very high | 66 Ų | 66 | 59.6 Ų | 59.6 | 25% | 0.25 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63 | -45.7 | 177.3 | -82 | 94 | 0 | 0 | 0 | 111.7 | N101 L108 V143 V147 V180 L181 S187 A188 | N101-W184 PolarHBondContact OD1-NE1 3.42Å; L108-W184 HydrophobicContact CD1-CH2 3.61Å; L108-W184 HydrophobicContact CD1-CZ2 4.36Å; L108-W184 HydrophobicContact CD1-CZ3 4.49Å; V143-W184 HydrophobicContact CG1-CE3 4.04Å; V143-W184 HydrophobicContact CG1-CZ3 3.95Å; V147-W184 HydrophobicContact CG1-CD2 4.47Å; V147-W184 HydrophobicContact CG1-CZ2 4.06Å; V147-W184 HydrophobicContact CG2-CD2 3.72Å; V147-W184 HydrophobicContact CG2-CE3 3.85Å; V147-W184 HydrophobicContact CG2-CG 4.14Å; V147-W184 HydrophobicContact CG2-CH2 4.42Å; V147-W184 HydrophobicContact CG2-CZ2 4.33Å; V147-W184 HydrophobicContact CG2-CZ3 4.2Å; V180-W184 VanDerWaalsContact O-CD1 3.25Å; V180-W184 PolarHBondContact O-N 2.82Å; L181-W184 PolarHBondContact O-N 3.43Å; W184-S187 PolarHBondContact O-N 3.02Å; W184-A188 WeakPolarHBondContact O-CB 3.33Å; W184-A188 PolarHBondContact O-N 3.48Å |
| 185 | A | 97.8 | Very high | 94.5 | Very high | 58 Ų | 58 | 50.6 Ų | 50.6 | 48% | 0.479 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.6 | -47.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | L181 G182 S187 A188 V189 | L181-A185 WeakPolarHBondContact O-CB 3.48Å; L181-A185 PolarHBondContact O-N 2.83Å; G182-A185 PolarHBondContact O-N 2.95Å; A185-S187 VanDerWaalsContact C-N 3.34Å; A185-S187 PolarHBondContact O-N 3.45Å; A185-A188 PolarHBondContact O-N 2.88Å; A185-V189 VanDerWaalsContact O-CG2 3.3Å; A185-V189 WeakPolarHBondContact O-CG2 3.49Å; A185-V189 PolarHBondContact O-N 3.3Å |
| 186 | L | 96.8 | Very high | 94.6 | Very high | 82 Ų | 82 | 50.9 Ų | 50.9 | 43% | 0.429 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.7 | -43.5 | 177.1 | 179 | 62 | 0 | 0 | 0 | 111.3 | F150 G182 V189 L190 | F150-L186 HydrophobicContact CD2-CD2 4.3Å; F150-L186 HydrophobicContact CE1-CD2 4.4Å; F150-L186 HydrophobicContact CE2-CD2 3.84Å; F150-L186 HydrophobicContact CE2-CG 4Å; F150-L186 HydrophobicContact CZ-CD2 3.9Å; F150-L186 HydrophobicContact CZ-CG 4.34Å; G182-L186 WeakPolarHBondContact O-CB 3.39Å; G182-L186 PolarHBondContact O-N 3.38Å; L186-V189 PolarHBondContact O-N 2.98Å; L186-L190 HydrophobicContact CD1-CD1 4.2Å; L186-L190 HydrophobicContact CD1-CG 4.2Å; L186-L190 HydrophobicContact CG-CD1 4.1Å; L186-L190 HydrophobicContact CG-CG 4.48Å; L186-L190 WeakPolarHBondContact O-CB 3.47Å; L186-L190 VanDerWaalsContact O-CG 3.29Å; L186-L190 WeakPolarHBondContact O-CG 3.22Å; L186-L190 PolarHBondContact O-N 3.33Å |
| 187 | S | 97.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.9 | -43.4 | 178.3 | -59.5 | 0 | 0 | 0 | 0 | 111.8 | Y146 V147 I183 W184 A185 L190 A191 | Y146-S187 WeakPolarHBondContact CB-OG 3.15Å; V147-S187 WeakPolarHBondContact CG2-OG 3.39Å; V147-S187 PolarHBondContact N-OG 2.83Å; I183-S187 VanDerWaalsContact O-CB 3.22Å; I183-S187 WeakPolarHBondContact O-CB 3.34Å; I183-S187 PolarHBondContact O-N 3.1Å; I183-S187 PolarHBondContact O-OG 3.48Å; W184-S187 PolarHBondContact O-N 3.02Å; A185-S187 VanDerWaalsContact C-N 3.34Å; A185-S187 PolarHBondContact O-N 3.45Å; S187-L190 PolarHBondContact O-N 3.3Å; S187-A191 WeakPolarHBondContact O-CB 3.34Å; S187-A191 PolarHBondContact O-N 3.06Å |
| 188 | A | 97 | Very high | 94.6 | Very high | 27 Ų | 27 | 50.9 Ų | 50.9 | 22% | 0.223 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59 | -52 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111 | F139 W184 A185 L190 A191 L192 | F139-A188 HydrophobicContact CE2-CB 4.44Å; F139-A188 HydrophobicContact CZ-CB 3.86Å; W184-A188 WeakPolarHBondContact O-CB 3.33Å; W184-A188 PolarHBondContact O-N 3.48Å; A185-A188 PolarHBondContact O-N 2.88Å; A188-L190 VanDerWaalsContact C-N 3.31Å; A188-L190 PolarHBondContact O-N 2.98Å; A188-A191 CarbonylContact O-C 3.58Å; A188-A191 PolarHBondContact O-N 2.9Å; A188-L192 WeakPolarHBondContact O-CG 3.39Å; A188-L192 PolarHBondContact O-N 2.78Å |
| 189 | V | 96.4 | Very high | 94.3 | Very high | 89 Ų | 89 | 48 Ų | 48 | 54% | 0.539 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.4 | -42.4 | 179.9 | 169.6 | 0 | 0 | 0 | 0 | 111.9 | A185 L186 A191 L192 P193 | A185-V189 VanDerWaalsContact O-CG2 3.3Å; A185-V189 WeakPolarHBondContact O-CG2 3.49Å; A185-V189 PolarHBondContact O-N 3.3Å; L186-V189 PolarHBondContact O-N 2.98Å; V189-A191 VanDerWaalsContact C-N 3.3Å; V189-A191 PolarHBondContact O-N 2.98Å; V189-L192 PolarHBondContact O-N 3.1Å; V189-P193 WeakPolarHBondContact O-CD 3.32Å |
| 190 | L | 95.1 | Very high | 94.2 | Very high | 51 Ų | 51 | 48.8 Ų | 48.8 | 27% | 0.267 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -67.4 | -29.4 | 177.1 | -70.1 | 176.1 | 0 | 0 | 0 | 112.9 | Y146 F150 L186 S187 A188 Y225 L229 T233 | Y146-L190 HydrophobicContact CD2-CB 4.06Å; Y146-L190 HydrophobicContact CE2-CB 4.1Å; F150-L190 HydrophobicContact CE2-CD1 3.85Å; F150-L190 HydrophobicContact CZ-CD1 3.69Å; L186-L190 HydrophobicContact CD1-CD1 4.2Å; L186-L190 HydrophobicContact CD1-CG 4.2Å; L186-L190 HydrophobicContact CG-CD1 4.1Å; L186-L190 HydrophobicContact CG-CG 4.48Å; L186-L190 WeakPolarHBondContact O-CB 3.47Å; L186-L190 VanDerWaalsContact O-CG 3.29Å; L186-L190 WeakPolarHBondContact O-CG 3.22Å; L186-L190 PolarHBondContact O-N 3.33Å; S187-L190 PolarHBondContact O-N 3.3Å; A188-L190 VanDerWaalsContact C-N 3.31Å; A188-L190 PolarHBondContact O-N 2.98Å; L190-Y225 VanDerWaalsContact O-CE2 3.25Å; L190-Y225 WeakPolarHBondContact O-CE2 3.25Å; L190-Y225 PolarHBondContact O-OH 2.84Å; L190-L229 HydrophobicContact CB-CD2 4.16Å; L190-T233 HydrophobicContact CD1-CG2 4.3Å |
| 191 | A | 94.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -85 | -16.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | F139 P142 V143 Y146 S187 A188 V189 A194 A195 | F139-A191 HydrophobicContact CD2-CB 4.04Å; F139-A191 HydrophobicContact CE2-CB 4.03Å; P142-A191 HydrophobicContact CB-CB 4.21Å; P142-A191 HydrophobicContact CG-CB 3.99Å; V143-A191 HydrophobicContact CG2-CB 3.5Å; V143-A191 VanDerWaalsContact CG2-CB 3.5Å; Y146-A191 HydrophobicContact CE2-CB 4.2Å; S187-A191 WeakPolarHBondContact O-CB 3.34Å; S187-A191 PolarHBondContact O-N 3.06Å; A188-A191 CarbonylContact O-C 3.58Å; A188-A191 PolarHBondContact O-N 2.9Å; V189-A191 VanDerWaalsContact C-N 3.3Å; V189-A191 PolarHBondContact O-N 2.98Å; A191-A194 PolarHBondContact O-N 3.04Å; A191-A195 PolarHBondContact O-N 3.32Å; A191-A195 VanDerWaalsContact O-N 3.12Å |
| 192 | L | 92.9 | Very high | 93.3 | Very high | 84 Ų | 84 | 51 Ų | 51 | 44% | 0.44 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -57.1 | -45.2 | -177.6 | -78.8 | 176.1 | 0 | 0 | 0 | 113.8 | F139 A188 V189 A194 A195 V196 | F139-L192 HydrophobicContact CE2-CD2 3.94Å; F139-L192 HydrophobicContact CE2-CG 4.37Å; A188-L192 WeakPolarHBondContact O-CG 3.39Å; A188-L192 PolarHBondContact O-N 2.78Å; V189-L192 PolarHBondContact O-N 3.1Å; L192-A194 PolarHBondContact O-N 3.35Å; L192-A195 PolarHBondContact O-N 2.96Å; L192-A195 VanDerWaalsContact O-N 3.11Å; L192-V196 WeakPolarHBondContact O-CG2 3.07Å; L192-V196 PolarHBondContact O-N 3.38Å |
| 193 | P | 91.8 | Very high | 92.7 | Very high | 46 Ų | 46 | 52.8 Ų | 52.8 | 30% | 0.299 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -57.3 | -47.3 | 179.5 | -26.2 | 35.7 | 0 | 0 | 0 | 112.5 | V189 A195 V196 H197 W215 Y225 | V189-P193 WeakPolarHBondContact O-CD 3.32Å; P193-A195 VanDerWaalsContact C-N 3.3Å; P193-A195 PolarHBondContact O-N 2.78Å; P193-V196 PolarHBondContact O-N 3.03Å; P193-H197 PolarHBondContact O-CD2 3.33Å; P193-H197 PolarHBondContact O-N 2.93Å; P193-W215 HydrophobicContact CB-CH2 4.04Å; P193-W215 HydrophobicContact CB-CZ2 4.39Å; P193-Y225 HydrophobicContact CB-CD2 4.15Å; P193-Y225 HydrophobicContact CB-CE2 3.84Å; P193-Y225 HydrophobicContact CG-CD2 4.27Å; P193-Y225 HydrophobicContact CG-CE2 3.83Å |
| 194 | A | 88.9 | Confident | 91.7 | Very high | 13 Ų | 13 | 61.4 Ų | 61.4 | 11% | 0.107 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -58.9 | -41.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A191 L192 H197 T198 Y225 | A191-A194 PolarHBondContact O-N 3.04Å; L192-A194 PolarHBondContact O-N 3.35Å; A194-H197 CarbonylContact O-C 3.56Å; A194-H197 PolarHBondContact O-N 2.91Å; A194-T198 PolarHBondContact O-N 2.94Å; A194-T198 VanDerWaalsContact O-N 3.07Å; A194-T198 PolarHBondContact O-OG1 3.25Å; A194-Y225 HydrophobicContact CB-CE1 3.98Å |
| 195 | A | 91.1 | Very high | 90.5 | Very high | 16 Ų | 16 | 63.5 Ų | 63.5 | 13% | 0.132 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -68.7 | -37.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | F139 A191 L192 P193 H197 T198 | F139-A195 HydrophobicContact CB-CB 3.96Å; F139-A195 HydrophobicContact CD2-CB 3.76Å; F139-A195 HydrophobicContact CG-CB 4.29Å; A191-A195 PolarHBondContact O-N 3.32Å; A191-A195 VanDerWaalsContact O-N 3.12Å; L192-A195 PolarHBondContact O-N 2.96Å; L192-A195 VanDerWaalsContact O-N 3.11Å; P193-A195 VanDerWaalsContact C-N 3.3Å; P193-A195 PolarHBondContact O-N 2.78Å; A195-H197 VanDerWaalsContact C-N 3.32Å; A195-T198 WeakPolarHBondContact O-CB 3.34Å; A195-T198 PolarHBondContact O-N 3.46Å |
| 196 | V | 91 | Very high | 89.3 | Confident | 105 Ų | 105 | 68 Ų | 68 | 64% | 0.636 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -67.6 | -35.4 | 175.7 | 170.9 | 0 | 0 | 0 | 0 | 111 | L192 P193 T198 | L192-V196 WeakPolarHBondContact O-CG2 3.07Å; L192-V196 PolarHBondContact O-N 3.38Å; P193-V196 PolarHBondContact O-N 3.03Å; V196-T198 VanDerWaalsContact C-N 3.28Å |
| 197 | H | 91.1 | Very high | 88.6 | Confident | 37 Ų | 37 | 68.1 Ų | 68.1 | 17% | 0.171 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | 7 | 175.2 | -72 | -72.1 | 0 | 0 | 0 | 113.6 | P193 A194 A195 Y199 E213 F214 W215 | P193-H197 PolarHBondContact O-CD2 3.33Å; P193-H197 PolarHBondContact O-N 2.93Å; A194-H197 CarbonylContact O-C 3.56Å; A194-H197 PolarHBondContact O-N 2.91Å; A195-H197 VanDerWaalsContact C-N 3.32Å; H197-Y199 VanDerWaalsContact O-CD2 3.23Å; H197-Y199 WeakPolarHBondContact O-CD2 3.25Å; H197-Y199 WeakPolarHBondContact O-CE2 3.47Å; H197-E213 HydrophobicContact CB-CG 4.46Å; H197-E213 CarbonylContact O-C 3.55Å; H197-E213 WeakPolarHBondContact O-CA 3.45Å; H197-F214 PolarHBondContact O-N 2.89Å; H197-W215 HydrophobicContact CB-CD2 4.26Å; H197-W215 HydrophobicContact CB-CG 4.43Å; H197-W215 HydrophobicContact CB-CZ2 4.37Å; H197-W215 AromaticContact CD2-CD2 3.84Å; H197-W215 AromaticContact CD2-CE2 3.74Å; H197-W215 AromaticContact CD2-CE3 3.75Å; H197-W215 AromaticContact CD2-CH2 3.54Å; H197-W215 AromaticContact CD2-CZ2 3.62Å; H197-W215 AromaticContact CD2-CZ3 3.6Å; H197-W215 AromaticContact CG-CD2 3.86Å; H197-W215 AromaticContact CG-CE2 3.85Å; H197-W215 AromaticContact NE2-CE3 3.72Å; H197-W215 AromaticContact NE2-CH2 3.97Å; H197-W215 AromaticContact NE2-CZ3 3.57Å |
| 198 | T | 91.5 | Very high | 88.1 | Confident | 5 Ų | 5 | 70 Ų | 70 | 3% | 0.031 | 37% | 0.371 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.8 | 128.9 | 172.2 | -61.3 | 0 | 0 | 0 | 0 | 109.7 | H135 F138 A194 A195 V196 | H135-T198 PolarHBondContact CE1-O 3.39Å; F138-T198 HydrophobicContact CB-CG2 4.04Å; F138-T198 HydrophobicContact CD1-CG2 4.46Å; F138-T198 HydrophobicContact CG-CG2 4.19Å; A194-T198 PolarHBondContact O-N 2.94Å; A194-T198 VanDerWaalsContact O-N 3.07Å; A194-T198 PolarHBondContact O-OG1 3.25Å; A195-T198 WeakPolarHBondContact O-CB 3.34Å; A195-T198 PolarHBondContact O-N 3.46Å; V196-T198 VanDerWaalsContact C-N 3.28Å |
| 199 | Y | 89 | Confident | 87.7 | Confident | 115 Ų | 115 | 72.3 Ų | 72.3 | 45% | 0.451 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 137.5 | 179 | -66.4 | -93.1 | 0 | 0 | 0 | 111.2 | H197 C211 E212 F214 | H197-Y199 VanDerWaalsContact O-CD2 3.23Å; H197-Y199 WeakPolarHBondContact O-CD2 3.25Å; H197-Y199 WeakPolarHBondContact O-CE2 3.47Å; Y199-C211 WeakPolarHBondContact O-CA 3.47Å; Y199-E212 PolarHBondContact N-O 3.34Å; Y199-E212 PolarHBondContact O-N 3.42Å; Y199-F214 HydrophobicContact CD2-CB 3.77Å; Y199-F214 HydrophobicContact CE2-CB 4.12Å; Y199-F214 HydrophobicContact CE2-CD1 4.48Å; Y199-F214 WeakPolarHBondContact CE2-O 3.34Å |
| 200 | H | 90.3 | Very high | 87.2 | Confident | 52 Ų | 52 | 70.7 Ų | 70.7 | 24% | 0.241 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.6 | 108 | 169.5 | 178.2 | -87.9 | 0 | 0 | 0 | 109.3 | W127 C134 L210 | W127-H200 AromaticContact CD1-CD2 3.64Å; W127-H200 AromaticContact CD1-NE2 3.76Å; C134-H200 HydrophobicContact CB-CB 4.41Å; H200-L210 WeakPolarHBondContact CA-O 3.38Å |
| 201 | V | 88 | Confident | 87 | Confident | 67 Ų | 67 | 68.3 Ų | 68.3 | 41% | 0.406 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.6 | 143.3 | -174.7 | -63.1 | 0 | 0 | 0 | 0 | 112 | L203 R209 L210 | V201-L203 HydrophobicContact CG2-CD1 4.23Å; V201-R209 CarbonylContact O-C 3.49Å; V201-R209 WeakPolarHBondContact O-CA 3.47Å; V201-L210 HydrophobicContact CG2-CB 3.91Å; V201-L210 PolarHBondContact N-O 3.31Å; V201-L210 PolarHBondContact O-N 3.19Å |
| 202 | E | 85.9 | Confident | 86.6 | Confident | 108 Ų | 108 | 73.4 Ų | 73.4 | 51% | 0.505 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.2 | 116.3 | 176.1 | -53.7 | -165.9 | 141.6 | 0 | 0 | 110.1 | K204 R209 | E202-K204 PolarHBondContact O-N 3.34Å; E202-R209 HydrophobicContact CG-CG 4.1Å; E202-R209 IonicContact OE1-CZ 3.06Å; E202-R209 IonicContact OE1-NE 3.56Å; E202-R209 PolarHBondContact OE1-NE 3.46Å; E202-R209 IonicContact OE1-NH2 3.65Å |
| 203 | L | 83.9 | Confident | 86.4 | Confident | 75 Ų | 75 | 73.6 Ų | 73.6 | 39% | 0.393 | 37% | 0.372 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.8 | 95.1 | 175.1 | -73.3 | 95.2 | 0 | 0 | 0 | 109.9 | V201 H206 D207 V208 L210 | V201-L203 HydrophobicContact CG2-CD1 4.23Å; L203-H206 PolarHBondContact O-N 2.87Å; L203-H206 VanDerWaalsContact O-N 3.15Å; L203-D207 PolarHBondContact O-N 3.23Å; L203-V208 PolarHBondContact N-O 3.13Å; L203-V208 PolarHBondContact O-N 2.88Å; L203-L210 HydrophobicContact CD1-CD1 3.41Å; L203-L210 VanDerWaalsContact CD1-CD1 3.41Å; L203-L210 HydrophobicContact CD1-CG 3.73Å |
| 204 | K | 76.1 | Confident | 86.1 | Confident | 194 Ų | 194 | 77.7 Ų | 77.7 | 84% | 0.843 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.2 | -35.1 | -179.8 | -67.5 | -174.7 | 177.6 | 178.6 | 0 | 116.6 | E202 H206 | E202-K204 PolarHBondContact O-N 3.34Å; K204-H206 VanDerWaalsContact C-N 3.25Å; K204-H206 PolarHBondContact O-N 3.44Å |
| 205 | P | 72.8 | Confident | 85.8 | Confident | 110 Ų | 110 | 77.8 Ų | 77.8 | 71% | 0.714 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | -13.9 | -178.8 | 20.9 | -25.5 | 0 | 0 | 0 | 114.5 | ||
| 206 | H | 74.1 | Confident | 85.3 | Confident | 153 Ų | 153 | 78.8 Ų | 78.8 | 71% | 0.708 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -133.5 | 4.1 | -178.5 | -66 | 77.9 | 0 | 0 | 0 | 114.2 | L203 K204 V208 | L203-H206 PolarHBondContact O-N 2.87Å; L203-H206 VanDerWaalsContact O-N 3.15Å; K204-H206 VanDerWaalsContact C-N 3.25Å; K204-H206 PolarHBondContact O-N 3.44Å; H206-V208 HydrophobicContact CB-CG2 3.88Å; H206-V208 PolarHBondContact O-N 3.38Å |
| 207 | D | 82 | Confident | 84.7 | Confident | 83 Ų | 83 | 79.7 Ų | 79.7 | 44% | 0.444 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.8 | 37.7 | -173.7 | -164.8 | 37.9 | 0 | 0 | 0 | 113.1 | R125 L203 | R125-D207 IonicContact NH1-OD2 3.16Å; L203-D207 PolarHBondContact O-N 3.23Å |
| 208 | V | 85.3 | Confident | 84.4 | Confident | 41 Ų | 41 | 81.9 Ų | 81.9 | 25% | 0.248 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 128.2 | 178.2 | 177.4 | 0 | 0 | 0 | 0 | 109.2 | L203 H206 L210 | L203-V208 PolarHBondContact N-O 3.13Å; L203-V208 PolarHBondContact O-N 2.88Å; H206-V208 HydrophobicContact CB-CG2 3.88Å; H206-V208 PolarHBondContact O-N 3.38Å; V208-L210 HydrophobicContact CG1-CD2 4.04Å; V208-L210 HydrophobicContact CG1-CG 4.35Å |
| 209 | R | 88.8 | Confident | 84 | Confident | 75 Ų | 75 | 85.7 Ų | 85.7 | 28% | 0.283 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 123.4 | 175.2 | -58.1 | -173.2 | 175.7 | 131.3 | 12.1 | 109.5 | R125 G126 W127 V201 E202 | R125-R209 PolarHBondContact O-N 3.35Å; G126-R209 CarbonylContact C-O 3.36Å; G126-R209 WeakPolarHBondContact CA-O 3.35Å; W127-R209 PolarHBondContact N-O 3.09Å; W127-R209 VanDerWaalsContact O-CB 3.24Å; W127-R209 WeakPolarHBondContact O-CB 3.33Å; W127-R209 WeakPolarHBondContact O-CD 3.34Å; V201-R209 CarbonylContact O-C 3.49Å; V201-R209 WeakPolarHBondContact O-CA 3.47Å; E202-R209 HydrophobicContact CG-CG 4.1Å; E202-R209 IonicContact OE1-CZ 3.06Å; E202-R209 IonicContact OE1-NE 3.56Å; E202-R209 PolarHBondContact OE1-NE 3.46Å; E202-R209 IonicContact OE1-NH2 3.65Å |
| 210 | L | 87.4 | Confident | 83.9 | Confident | 55 Ų | 55 | 89.6 Ų | 89.6 | 29% | 0.288 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.2 | 141.2 | 177.3 | -61.9 | 175.1 | 0 | 0 | 0 | 109.9 | H200 V201 L203 V208 | H200-L210 WeakPolarHBondContact CA-O 3.38Å; V201-L210 HydrophobicContact CG2-CB 3.91Å; V201-L210 PolarHBondContact N-O 3.31Å; V201-L210 PolarHBondContact O-N 3.19Å; L203-L210 HydrophobicContact CD1-CD1 3.41Å; L203-L210 VanDerWaalsContact CD1-CD1 3.41Å; L203-L210 HydrophobicContact CD1-CG 3.73Å; V208-L210 HydrophobicContact CG1-CD2 4.04Å; V208-L210 HydrophobicContact CG1-CG 4.35Å |
| 211 | C | 90.1 | Very high | 83.8 | Confident | 0 Ų | 0 | 92.1 Ų | 92.1 | 0% | 0 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.6 | 94.5 | 170.6 | 176.9 | 0 | 0 | 0 | 0 | 107.1 | W127 C134 F138 Y199 | W127-C211 HydrophobicContact CB-CB 3.71Å; W127-C211 HydrophobicContact CD2-CB 3.82Å; W127-C211 HydrophobicContact CE3-CB 4.07Å; W127-C211 HydrophobicContact CG-CB 3.64Å; C134-C211 WeakPolarHBondContact CA-SG 3.3Å; C134-C211 HydrophobicContact CB-CB 3.86Å; C134-C211 WeakPolarHBondContact CB-SG 3.39Å; C134-C211 WeakPolarHBondContact SG-CB 3.36Å; C134-C211 CovalentContact SG-SG 2.01Å; C134-C211 PolarHBondContact SG-SG 2.89Å; F138-C211 WeakPolarHBondContact CD2-SG 3.22Å; F138-C211 HydrophobicContact CE2-CB 4.09Å; F138-C211 WeakPolarHBondContact CE2-SG 3.39Å; F138-C211 WeakPolarHBondContact CZ-O 3.3Å; Y199-C211 WeakPolarHBondContact O-CA 3.47Å |
| 212 | E | 86.4 | Confident | 83.8 | Confident | 108 Ų | 108 | 90.9 Ų | 90.9 | 51% | 0.505 | 45% | 0.447 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143 | 156.9 | -174.3 | -68.5 | -164.4 | 177.4 | 0 | 0 | 112.7 | Y120 Y199 | Y120-E212 PolarHBondContact OH-OE1 3.03Å; Y199-E212 PolarHBondContact N-O 3.34Å; Y199-E212 PolarHBondContact O-N 3.42Å |
| 213 | E | 88 | Confident | 83.9 | Confident | 87 Ų | 87 | 89.2 Ų | 89.2 | 41% | 0.407 | 44% | 0.44 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.3 | 120.1 | 175.4 | -178.7 | -176.3 | -168.3 | 0 | 0 | 110.1 | H197 W215 | H197-E213 HydrophobicContact CB-CG 4.46Å; H197-E213 CarbonylContact O-C 3.55Å; H197-E213 WeakPolarHBondContact O-CA 3.45Å; E213-W215 VanDerWaalsContact CD-NE1 3.31Å; E213-W215 VanDerWaalsContact CG-NE1 3.29Å; E213-W215 PolarHBondContact OE1-NE1 2.74Å |
| 214 | F | 85.4 | Confident | 84.2 | Confident | 133 Ų | 133 | 91 Ų | 91 | 58% | 0.583 | 45% | 0.449 | S | S | * | . | trans | -127.9 | 116.5 | -179.2 | -175.1 | -104.1 | 0 | 0 | 0 | 111.5 | H197 Y199 G216 | H197-F214 PolarHBondContact O-N 2.89Å; Y199-F214 HydrophobicContact CD2-CB 3.77Å; Y199-F214 HydrophobicContact CE2-CB 4.12Å; Y199-F214 HydrophobicContact CE2-CD1 4.48Å; Y199-F214 WeakPolarHBondContact CE2-O 3.34Å; F214-G216 VanDerWaalsContact CE1-CA 3.42Å | ||
| 215 | W | 83.4 | Confident | 84.9 | Confident | 15 Ų | 15 | 83.6 Ų | 83.6 | 6% | 0.057 | 42% | 0.416 | C | S | . | . | trans | -101.5 | 22.3 | -178.7 | -71.9 | 74.7 | 0 | 0 | 0 | 113.9 | P193 H197 E213 S217 Q218 Q221 R222 Y225 | P193-W215 HydrophobicContact CB-CH2 4.04Å; P193-W215 HydrophobicContact CB-CZ2 4.39Å; H197-W215 HydrophobicContact CB-CD2 4.26Å; H197-W215 HydrophobicContact CB-CG 4.43Å; H197-W215 HydrophobicContact CB-CZ2 4.37Å; H197-W215 AromaticContact CD2-CD2 3.84Å; H197-W215 AromaticContact CD2-CE2 3.74Å; H197-W215 AromaticContact CD2-CE3 3.75Å; H197-W215 AromaticContact CD2-CH2 3.54Å; H197-W215 AromaticContact CD2-CZ2 3.62Å; H197-W215 AromaticContact CD2-CZ3 3.6Å; H197-W215 AromaticContact CG-CD2 3.86Å; H197-W215 AromaticContact CG-CE2 3.85Å; H197-W215 AromaticContact NE2-CE3 3.72Å; H197-W215 AromaticContact NE2-CH2 3.97Å; H197-W215 AromaticContact NE2-CZ3 3.57Å; E213-W215 VanDerWaalsContact CD-NE1 3.31Å; E213-W215 VanDerWaalsContact CG-NE1 3.29Å; E213-W215 PolarHBondContact OE1-NE1 2.74Å; W215-S217 PolarHBondContact O-N 2.88Å; W215-Q218 WeakPolarHBondContact O-CA 3.22Å; W215-Q218 WeakPolarHBondContact O-CB 3.44Å; W215-Q218 PolarHBondContact O-N 3.49Å; W215-Q221 HydrophobicContact CE3-CB 4.26Å; W215-Q221 HydrophobicContact CZ3-CB 4.02Å; W215-R222 HydrophobicContact CB-CB 3.9Å; W215-R222 HydrophobicContact CB-CG 4.18Å; W215-R222 HydrophobicContact CD2-CB 3.63Å; W215-R222 HydrophobicContact CD2-CG 3.88Å; W215-R222 HydrophobicContact CE3-CB 3.94Å; W215-R222 HydrophobicContact CG-CB 3.62Å; W215-R222 HydrophobicContact CG-CG 3.63Å; W215-Y225 HydrophobicContact CH2-CD1 4.12Å; W215-Y225 HydrophobicContact CH2-CG 4.17Å; W215-Y225 AromaticContact CZ2-CD1 3.74Å; W215-Y225 HydrophobicContact CZ2-CD1 3.74Å; W215-Y225 HydrophobicContact CZ2-CE1 4.2Å; W215-Y225 HydrophobicContact CZ2-CG 4.26Å | ||
| 216 | G | 80.3 | Confident | 85.7 | Confident | 37 Ų | 37 | 80 Ų | 80 | 38% | 0.381 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 46 | -127.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | F214 Q218 | F214-G216 VanDerWaalsContact CE1-CA 3.42Å; G216-Q218 VanDerWaalsContact C-N 3.35Å |
| 217 | S | 78.9 | Confident | 86.4 | Confident | 123 Ų | 123 | 78.7 Ų | 78.7 | 86% | 0.86 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.2 | 9 | 175.4 | 56.5 | 0 | 0 | 0 | 0 | 114.2 | W215 E219 | W215-S217 PolarHBondContact O-N 2.88Å; S217-E219 PolarHBondContact O-N 2.91Å |
| 218 | Q | 85.6 | Confident | 86.9 | Confident | 84 Ų | 84 | 76.8 Ų | 76.8 | 39% | 0.393 | 39% | 0.385 | S | S | . | . | trans | -99.4 | 40.5 | -172.2 | -59.9 | -179.1 | 6.3 | 0 | 0 | 112.9 | W215 G216 R220 Q221 R222 | W215-Q218 WeakPolarHBondContact O-CA 3.22Å; W215-Q218 WeakPolarHBondContact O-CB 3.44Å; W215-Q218 PolarHBondContact O-N 3.49Å; G216-Q218 VanDerWaalsContact C-N 3.35Å; Q218-R220 PolarHBondContact O-N 2.94Å; Q218-R220 VanDerWaalsContact O-N 3.14Å; Q218-Q221 HydrophobicContact CB-CB 4.32Å; Q218-Q221 HydrophobicContact CB-CG 4.41Å; Q218-Q221 WeakPolarHBondContact O-CB 3.35Å; Q218-Q221 PolarHBondContact O-N 2.81Å; Q218-R222 PolarHBondContact O-N 2.92Å; Q218-R222 VanDerWaalsContact O-N 3.15Å | ||
| 219 | E | 82.8 | Confident | 87.2 | Confident | 85 Ų | 85 | 75.9 Ų | 75.9 | 40% | 0.397 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -54.2 | -37.5 | -177.9 | -73.1 | -57.2 | 127.9 | 0 | 0 | 113.5 | S217 Q221 R222 Q223 | S217-E219 PolarHBondContact O-N 2.91Å; E219-Q221 VanDerWaalsContact C-N 3.3Å; E219-Q221 PolarHBondContact O-N 3.31Å; E219-R222 PolarHBondContact O-N 3.01Å; E219-R222 IonicContact OE1-NE 3.98Å; E219-R222 IonicContact OE2-CZ 3.27Å; E219-R222 IonicContact OE2-NE 3.9Å; E219-R222 PolarHBondContact OE2-NE 3.47Å; E219-R222 IonicContact OE2-NH2 3.61Å; E219-R222 PolarHBondContact OE2-NH2 3.39Å; E219-Q223 WeakPolarHBondContact O-CB 3.21Å; E219-Q223 WeakPolarHBondContact O-CG 3.49Å; E219-Q223 PolarHBondContact O-N 2.98Å |
| 220 | R | 86.8 | Confident | 87.3 | Confident | 197 Ų | 197 | 73.7 Ų | 73.7 | 74% | 0.743 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -61 | -38.9 | 176.2 | -178.2 | 174.4 | 177.5 | 164.9 | 0.2 | 112.3 | Q218 L224 | Q218-R220 PolarHBondContact O-N 2.94Å; Q218-R220 VanDerWaalsContact O-N 3.14Å; R220-L224 HydrophobicContact CG-CD1 4.15Å; R220-L224 WeakPolarHBondContact O-CB 3.19Å; R220-L224 VanDerWaalsContact O-CG 3.24Å; R220-L224 WeakPolarHBondContact O-CG 3.4Å; R220-L224 PolarHBondContact O-N 2.95Å |
| 221 | Q | 88.4 | Confident | 87.5 | Confident | 104 Ų | 104 | 75.4 Ų | 75.4 | 49% | 0.486 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -71.9 | -42 | 179.5 | -63.8 | -173.6 | -1 | 0 | 0 | 110.9 | W215 Q218 E219 Q223 L224 Y225 | W215-Q221 HydrophobicContact CE3-CB 4.26Å; W215-Q221 HydrophobicContact CZ3-CB 4.02Å; Q218-Q221 HydrophobicContact CB-CB 4.32Å; Q218-Q221 HydrophobicContact CB-CG 4.41Å; Q218-Q221 WeakPolarHBondContact O-CB 3.35Å; Q218-Q221 PolarHBondContact O-N 2.81Å; E219-Q221 VanDerWaalsContact C-N 3.3Å; E219-Q221 PolarHBondContact O-N 3.31Å; Q221-Q223 VanDerWaalsContact C-N 3.32Å; Q221-Q223 PolarHBondContact O-N 2.66Å; Q221-L224 PolarHBondContact O-N 3.46Å; Q221-Y225 VanDerWaalsContact O-CB 3.31Å; Q221-Y225 WeakPolarHBondContact O-CB 3.45Å; Q221-Y225 PolarHBondContact O-N 3.17Å |
| 222 | R | 87.6 | Confident | 87.4 | Confident | 41 Ų | 41 | 76.7 Ų | 76.7 | 16% | 0.155 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -55.6 | -47.2 | 172.9 | -171.2 | -175.1 | 68.7 | 78.8 | -5.2 | 111.7 | W215 Q218 E219 Y225 A226 D302 | W215-R222 HydrophobicContact CB-CB 3.9Å; W215-R222 HydrophobicContact CB-CG 4.18Å; W215-R222 HydrophobicContact CD2-CB 3.63Å; W215-R222 HydrophobicContact CD2-CG 3.88Å; W215-R222 HydrophobicContact CE3-CB 3.94Å; W215-R222 HydrophobicContact CG-CB 3.62Å; W215-R222 HydrophobicContact CG-CG 3.63Å; Q218-R222 PolarHBondContact O-N 2.92Å; Q218-R222 VanDerWaalsContact O-N 3.15Å; E219-R222 PolarHBondContact O-N 3.01Å; E219-R222 IonicContact OE1-NE 3.98Å; E219-R222 IonicContact OE2-CZ 3.27Å; E219-R222 IonicContact OE2-NE 3.9Å; E219-R222 PolarHBondContact OE2-NE 3.47Å; E219-R222 IonicContact OE2-NH2 3.61Å; E219-R222 PolarHBondContact OE2-NH2 3.39Å; R222-Y225 PolarHBondContact O-N 3.22Å; R222-A226 WeakPolarHBondContact O-CB 3.41Å; R222-A226 PolarHBondContact O-N 3.4Å; R222-D302 IonicContact CZ-OD1 2.94Å; R222-D302 VanDerWaalsContact CZ-OD1 3.28Å; R222-D302 VanDerWaalsContact NH1-CG 3.29Å; R222-D302 IonicContact NH1-OD1 2.85Å; R222-D302 PolarHBondContact NH1-OD1 3.12Å; R222-D302 IonicContact NH1-OD2 3.33Å; R222-D302 PolarHBondContact NH1-OD2 3.11Å; R222-D302 IonicContact NH2-OD1 3.8Å; R222-D302 PolarHBondContact NH2-OD1 3.37Å |
| 223 | Q | 87.4 | Confident | 87.5 | Confident | 73 Ų | 73 | 71.8 Ų | 71.8 | 34% | 0.341 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -64 | -48.6 | 177.7 | -73.4 | 177.4 | -14.2 | 0 | 0 | 111.8 | E219 Q221 Y225 A226 W227 | E219-Q223 WeakPolarHBondContact O-CB 3.21Å; E219-Q223 WeakPolarHBondContact O-CG 3.49Å; E219-Q223 PolarHBondContact O-N 2.98Å; Q221-Q223 VanDerWaalsContact C-N 3.32Å; Q221-Q223 PolarHBondContact O-N 2.66Å; Q223-Y225 PolarHBondContact O-N 2.9Å; Q223-A226 PolarHBondContact O-N 3.26Å; Q223-W227 WeakPolarHBondContact O-CB 3.44Å; Q223-W227 PolarHBondContact O-N 3.21Å |
| 224 | L | 90.4 | Very high | 87.5 | Confident | 112 Ų | 112 | 68.9 Ų | 68.9 | 59% | 0.586 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -58.2 | -40.2 | 177.4 | -74.5 | 171.6 | 0 | 0 | 0 | 111.8 | R220 Q221 G228 | R220-L224 HydrophobicContact CG-CD1 4.15Å; R220-L224 WeakPolarHBondContact O-CB 3.19Å; R220-L224 VanDerWaalsContact O-CG 3.24Å; R220-L224 WeakPolarHBondContact O-CG 3.4Å; R220-L224 PolarHBondContact O-N 2.95Å; Q221-L224 PolarHBondContact O-N 3.46Å; L224-G228 PolarHBondContact O-N 3.32Å |
| 225 | Y | 91 | Very high | 87.7 | Confident | 40 Ų | 40 | 66.6 Ų | 66.6 | 16% | 0.157 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63 | -50.9 | 174.5 | 174.6 | -114.2 | 0 | 0 | 0 | 111.7 | L190 P193 A194 W215 Q221 R222 Q223 W227 G228 L229 | L190-Y225 VanDerWaalsContact O-CE2 3.25Å; L190-Y225 WeakPolarHBondContact O-CE2 3.25Å; L190-Y225 PolarHBondContact O-OH 2.84Å; P193-Y225 HydrophobicContact CB-CD2 4.15Å; P193-Y225 HydrophobicContact CB-CE2 3.84Å; P193-Y225 HydrophobicContact CG-CD2 4.27Å; P193-Y225 HydrophobicContact CG-CE2 3.83Å; A194-Y225 HydrophobicContact CB-CE1 3.98Å; W215-Y225 HydrophobicContact CH2-CD1 4.12Å; W215-Y225 HydrophobicContact CH2-CG 4.17Å; W215-Y225 AromaticContact CZ2-CD1 3.74Å; W215-Y225 HydrophobicContact CZ2-CD1 3.74Å; W215-Y225 HydrophobicContact CZ2-CE1 4.2Å; W215-Y225 HydrophobicContact CZ2-CG 4.26Å; Q221-Y225 VanDerWaalsContact O-CB 3.31Å; Q221-Y225 WeakPolarHBondContact O-CB 3.45Å; Q221-Y225 PolarHBondContact O-N 3.17Å; R222-Y225 PolarHBondContact O-N 3.22Å; Q223-Y225 PolarHBondContact O-N 2.9Å; Y225-W227 PolarHBondContact O-N 2.83Å; Y225-G228 PolarHBondContact O-N 3.24Å; Y225-L229 HydrophobicContact CD1-CD1 4.02Å; Y225-L229 HydrophobicContact CD2-CD1 4.26Å; Y225-L229 HydrophobicContact CD2-CG 4.24Å; Y225-L229 HydrophobicContact CE1-CD1 3.46Å; Y225-L229 VanDerWaalsContact CE1-CD1 3.46Å; Y225-L229 HydrophobicContact CE1-CG 4.43Å; Y225-L229 HydrophobicContact CE2-CD1 3.72Å; Y225-L229 HydrophobicContact CE2-CD2 4.12Å; Y225-L229 HydrophobicContact CE2-CG 3.88Å; Y225-L229 HydrophobicContact CG-CD1 4.4Å; Y225-L229 WeakPolarHBondContact O-CG 3.25Å; Y225-L229 PolarHBondContact O-N 3.11Å |
| 226 | A | 89.1 | Confident | 88 | Confident | 35 Ų | 35 | 70.4 Ų | 70.4 | 29% | 0.289 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.2 | -44.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | R222 Q223 L229 L230 | R222-A226 WeakPolarHBondContact O-CB 3.41Å; R222-A226 PolarHBondContact O-N 3.4Å; Q223-A226 PolarHBondContact O-N 3.26Å; A226-L229 PolarHBondContact O-N 2.99Å; A226-L230 WeakPolarHBondContact O-CB 3.49Å; A226-L230 PolarHBondContact O-N 3.41Å |
| 227 | W | 90.1 | Very high | 88.3 | Confident | 125 Ų | 125 | 69.2 Ų | 69.2 | 47% | 0.473 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66 | -40 | 175.4 | -77.7 | 111.4 | 0 | 0 | 0 | 112.5 | Q223 Y225 L230 L231 L299 | Q223-W227 WeakPolarHBondContact O-CB 3.44Å; Q223-W227 PolarHBondContact O-N 3.21Å; Y225-W227 PolarHBondContact O-N 2.83Å; W227-L230 HydrophobicContact CE3-CD2 3.85Å; W227-L230 HydrophobicContact CZ3-CD2 3.79Å; W227-L230 PolarHBondContact O-N 2.84Å; W227-L231 WeakPolarHBondContact O-CB 3.49Å; W227-L231 PolarHBondContact O-N 3.18Å; W227-L299 HydrophobicContact CH2-CD1 3.36Å; W227-L299 HydrophobicContact CH2-CD2 4.14Å; W227-L299 HydrophobicContact CH2-CG 4.41Å; W227-L299 HydrophobicContact CZ2-CD1 3.26Å; W227-L299 HydrophobicContact CZ3-CD1 4.27Å |
| 228 | G | 91.9 | Very high | 88.7 | Confident | 43 Ų | 43 | 65.6 Ų | 65.6 | 44% | 0.443 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.3 | -43.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L224 Y225 L231 G232 | L224-G228 PolarHBondContact O-N 3.32Å; Y225-G228 PolarHBondContact O-N 3.24Å; G228-L231 PolarHBondContact O-N 3.33Å; G228-G232 PolarHBondContact O-N 2.83Å |
| 229 | L | 91.4 | Very high | 88.8 | Confident | 22 Ų | 22 | 65.8 Ų | 65.8 | 12% | 0.115 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -63.9 | -49.4 | 173.5 | -71.3 | 176.3 | 0 | 0 | 0 | 111.5 | Y146 L190 Y225 A226 L231 G232 T233 | Y146-L229 HydrophobicContact CE1-CD2 4.44Å; Y146-L229 HydrophobicContact CE2-CD2 3.99Å; Y146-L229 WeakPolarHBondContact OH-CD1 3.45Å; L190-L229 HydrophobicContact CB-CD2 4.16Å; Y225-L229 HydrophobicContact CD1-CD1 4.02Å; Y225-L229 HydrophobicContact CD2-CD1 4.26Å; Y225-L229 HydrophobicContact CD2-CG 4.24Å; Y225-L229 HydrophobicContact CE1-CD1 3.46Å; Y225-L229 VanDerWaalsContact CE1-CD1 3.46Å; Y225-L229 HydrophobicContact CE1-CG 4.43Å; Y225-L229 HydrophobicContact CE2-CD1 3.72Å; Y225-L229 HydrophobicContact CE2-CD2 4.12Å; Y225-L229 HydrophobicContact CE2-CG 3.88Å; Y225-L229 HydrophobicContact CG-CD1 4.4Å; Y225-L229 WeakPolarHBondContact O-CG 3.25Å; Y225-L229 PolarHBondContact O-N 3.11Å; A226-L229 PolarHBondContact O-N 2.99Å; L229-L231 VanDerWaalsContact C-N 3.26Å; L229-L231 PolarHBondContact O-N 3.21Å; L229-G232 PolarHBondContact O-N 3.31Å; L229-T233 HydrophobicContact CD2-CG2 4.37Å; L229-T233 WeakPolarHBondContact O-CB 3.42Å; L229-T233 PolarHBondContact O-N 3.44Å; L229-T233 PolarHBondContact O-OG1 3.03Å |
| 230 | L | 90.5 | Very high | 88.9 | Confident | 28 Ų | 28 | 63.3 Ų | 63.3 | 15% | 0.147 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -55.5 | -43 | 177.3 | -178.2 | 67.8 | 0 | 0 | 0 | 111.8 | A226 W227 Y234 L235 H295 | A226-L230 WeakPolarHBondContact O-CB 3.49Å; A226-L230 PolarHBondContact O-N 3.41Å; W227-L230 HydrophobicContact CE3-CD2 3.85Å; W227-L230 HydrophobicContact CZ3-CD2 3.79Å; W227-L230 PolarHBondContact O-N 2.84Å; L230-Y234 HydrophobicContact CD1-CD1 4.11Å; L230-Y234 HydrophobicContact CD1-CG 4.36Å; L230-Y234 VanDerWaalsContact O-CB 3.26Å; L230-Y234 WeakPolarHBondContact O-CB 3.41Å; L230-Y234 PolarHBondContact O-N 3.26Å; L230-L235 PolarHBondContact O-N 3.31Å; L230-H295 HydrophobicContact CD1-CB 3.91Å |
| 231 | L | 91.1 | Very high | 88.6 | Confident | 92 Ų | 92 | 54.2 Ų | 54.2 | 48% | 0.482 | 29% | 0.291 | S | S | . | . | I | π-helix | trans | -68.1 | -49.2 | 177.6 | -175.7 | 61.8 | 0 | 0 | 0 | 111.6 | W227 G228 L229 L235 L236 | W227-L231 WeakPolarHBondContact O-CB 3.49Å; W227-L231 PolarHBondContact O-N 3.18Å; G228-L231 PolarHBondContact O-N 3.33Å; L229-L231 VanDerWaalsContact C-N 3.26Å; L229-L231 PolarHBondContact O-N 3.21Å; L231-L235 HydrophobicContact CD1-CB 4.11Å; L231-L235 HydrophobicContact CD1-CD1 4.06Å; L231-L236 HydrophobicContact CD1-CG 4.32Å; L231-L236 HydrophobicContact CG-CD1 4.35Å; L231-L236 HydrophobicContact CG-CG 4.35Å; L231-L236 WeakPolarHBondContact O-CB 3.41Å; L231-L236 WeakPolarHBondContact O-CG 3.45Å; L231-L236 PolarHBondContact O-N 2.92Å |
| 232 | G | 88.4 | Confident | 88.4 | Confident | 26 Ų | 26 | 54.3 Ų | 54.3 | 27% | 0.268 | 29% | 0.294 | S | S | . | . | I | π-helix | trans | -72.8 | -39.5 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | G228 L229 P237 | G228-G232 PolarHBondContact O-N 2.83Å; L229-G232 PolarHBondContact O-N 3.31Å; G232-P237 WeakPolarHBondContact O-CD 3.39Å |
| 233 | T | 88.3 | Confident | 88.3 | Confident | 6 Ų | 6 | 56.1 Ų | 56.1 | 4% | 0.037 | 31% | 0.307 | C | S | . | . | I | π-helix | trans | -108.6 | -0.6 | -171.5 | 73 | 0 | 0 | 0 | 0 | 113.2 | Y146 V149 F150 L190 L229 | Y146-T233 HydrophobicContact CD1-CG2 3.7Å; Y146-T233 HydrophobicContact CE1-CG2 3.97Å; Y146-T233 HydrophobicContact CG-CG2 4.16Å; V149-T233 WeakPolarHBondContact CG1-O 3.26Å; V149-T233 WeakPolarHBondContact CG2-O 3.41Å; F150-T233 HydrophobicContact CZ-CG2 4.06Å; L190-T233 HydrophobicContact CD1-CG2 4.3Å; L229-T233 HydrophobicContact CD2-CG2 4.37Å; L229-T233 WeakPolarHBondContact O-CB 3.42Å; L229-T233 PolarHBondContact O-N 3.44Å; L229-T233 PolarHBondContact O-OG1 3.03Å |
| 234 | Y | 88.4 | Confident | 88 | Confident | 25 Ų | 25 | 53.1 Ų | 53.1 | 10% | 0.098 | 29% | 0.293 | C | S | . | . | I | π-helix | trans | -132.2 | -61.9 | 176.9 | -174.5 | -96.7 | 0 | 0 | 0 | 112.5 | L230 L238 A288 W291 H295 | L230-Y234 HydrophobicContact CD1-CD1 4.11Å; L230-Y234 HydrophobicContact CD1-CG 4.36Å; L230-Y234 VanDerWaalsContact O-CB 3.26Å; L230-Y234 WeakPolarHBondContact O-CB 3.41Å; L230-Y234 PolarHBondContact O-N 3.26Å; Y234-L238 HydrophobicContact CD1-CD1 3.99Å; Y234-L238 HydrophobicContact CD2-CD1 4.4Å; Y234-L238 HydrophobicContact CE1-CD1 3.6Å; Y234-L238 HydrophobicContact CE2-CD1 4.07Å; Y234-L238 HydrophobicContact CG-CD1 4.35Å; Y234-L238 WeakPolarHBondContact O-CB 3.44Å; Y234-L238 WeakPolarHBondContact O-CG 3.29Å; Y234-L238 PolarHBondContact O-N 3.17Å; Y234-A288 HydrophobicContact CE2-CB 3.96Å; Y234-A288 PolarHBondContact OH-O 2.91Å; Y234-W291 HydrophobicContact CE2-CB 4.3Å; Y234-H295 AromaticContact CD2-CD2 3.71Å; Y234-H295 AromaticContact CD2-NE2 3.79Å |
| 235 | L | 90.3 | Very high | 87.6 | Confident | 85 Ų | 85 | 51.1 Ų | 51.1 | 45% | 0.445 | 28% | 0.278 | S | S | . | . | I | π-helix | trans | -69.7 | -47.1 | -173.3 | -64.6 | 176.7 | 0 | 0 | 0 | 113.8 | L230 L231 L238 L239 | L230-L235 PolarHBondContact O-N 3.31Å; L231-L235 HydrophobicContact CD1-CB 4.11Å; L231-L235 HydrophobicContact CD1-CD1 4.06Å; L235-L238 PolarHBondContact O-N 3.06Å; L235-L239 WeakPolarHBondContact O-CB 3.19Å; L235-L239 PolarHBondContact O-N 3.5Å |
| 236 | L | 89.3 | Confident | 87.1 | Confident | 96 Ų | 96 | 52.8 Ų | 52.8 | 50% | 0.503 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.7 | -47.5 | 179.5 | -77.3 | 174.8 | 0 | 0 | 0 | 112.8 | L231 L238 L239 A240 | L231-L236 HydrophobicContact CD1-CG 4.32Å; L231-L236 HydrophobicContact CG-CD1 4.35Å; L231-L236 HydrophobicContact CG-CG 4.35Å; L231-L236 WeakPolarHBondContact O-CB 3.41Å; L231-L236 WeakPolarHBondContact O-CG 3.45Å; L231-L236 PolarHBondContact O-N 2.92Å; L236-L238 PolarHBondContact O-N 3.45Å; L236-L239 PolarHBondContact O-N 3.17Å; L236-A240 WeakPolarHBondContact O-CB 3.15Å; L236-A240 PolarHBondContact O-N 2.96Å |
| 237 | P | 86.4 | Confident | 86.8 | Confident | 11 Ų | 11 | 58.2 Ų | 58.2 | 7% | 0.071 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -52.4 | -49.4 | 171.2 | -31.8 | 37.6 | 0 | 0 | 0 | 113.2 | V149 T153 G232 L239 A240 I241 | V149-P237 HydrophobicContact CG1-CB 3.86Å; V149-P237 HydrophobicContact CG1-CG 3.43Å; V149-P237 VanDerWaalsContact CG1-CG 3.43Å; T153-P237 WeakPolarHBondContact OG1-CB 3.34Å; G232-P237 WeakPolarHBondContact O-CD 3.39Å; P237-L239 PolarHBondContact O-N 2.93Å; P237-A240 PolarHBondContact O-N 3.43Å; P237-I241 WeakPolarHBondContact O-CD1 3.31Å; P237-I241 WeakPolarHBondContact O-CG1 3.23Å; P237-I241 PolarHBondContact O-N 3.43Å; P237-I241 VanDerWaalsContact O-N 3.07Å |
| 238 | L | 86.9 | Confident | 86.2 | Confident | 47 Ų | 47 | 52.4 Ų | 52.4 | 25% | 0.246 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.1 | -45.4 | 179.6 | -82.5 | 173.6 | 0 | 0 | 0 | 112.3 | Y234 L235 L236 I241 L242 V284 A288 | Y234-L238 HydrophobicContact CD1-CD1 3.99Å; Y234-L238 HydrophobicContact CD2-CD1 4.4Å; Y234-L238 HydrophobicContact CE1-CD1 3.6Å; Y234-L238 HydrophobicContact CE2-CD1 4.07Å; Y234-L238 HydrophobicContact CG-CD1 4.35Å; Y234-L238 WeakPolarHBondContact O-CB 3.44Å; Y234-L238 WeakPolarHBondContact O-CG 3.29Å; Y234-L238 PolarHBondContact O-N 3.17Å; L235-L238 PolarHBondContact O-N 3.06Å; L236-L238 PolarHBondContact O-N 3.45Å; L238-I241 PolarHBondContact O-N 3.38Å; L238-L242 WeakPolarHBondContact O-CB 3.48Å; L238-L242 PolarHBondContact O-N 3.44Å; L238-V284 HydrophobicContact CD2-CG1 3.95Å; L238-A288 HydrophobicContact CD1-CB 3.92Å; L238-A288 HydrophobicContact CD2-CB 3.68Å; L238-A288 HydrophobicContact CG-CB 4.23Å |
| 239 | L | 88.4 | Confident | 85.5 | Confident | 89 Ų | 89 | 52 Ų | 52 | 47% | 0.466 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -63.3 | -45.7 | 177.6 | -178.7 | 62.7 | 0 | 0 | 0 | 111.5 | L235 L236 P237 I241 L242 L243 | L235-L239 WeakPolarHBondContact O-CB 3.19Å; L235-L239 PolarHBondContact O-N 3.5Å; L236-L239 PolarHBondContact O-N 3.17Å; P237-L239 PolarHBondContact O-N 2.93Å; L239-I241 PolarHBondContact O-N 3.44Å; L239-L242 PolarHBondContact O-N 3.27Å; L239-L243 HydrophobicContact CD1-CD1 4.01Å; L239-L243 HydrophobicContact CD1-CG 3.98Å; L239-L243 HydrophobicContact CG-CD1 3.9Å; L239-L243 HydrophobicContact CG-CG 4.29Å; L239-L243 WeakPolarHBondContact O-CB 3.48Å; L239-L243 VanDerWaalsContact O-CG 3.25Å; L239-L243 WeakPolarHBondContact O-CG 3.39Å; L239-L243 PolarHBondContact O-N 3.06Å |
| 240 | A | 85 | Confident | 85 | Confident | 32 Ų | 32 | 54 Ų | 54 | 26% | 0.264 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -58 | -39 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L236 P237 S244 | L236-A240 WeakPolarHBondContact O-CB 3.15Å; L236-A240 PolarHBondContact O-N 2.96Å; P237-A240 PolarHBondContact O-N 3.43Å; A240-S244 VanDerWaalsContact O-CB 3.25Å; A240-S244 WeakPolarHBondContact O-CB 3.47Å; A240-S244 PolarHBondContact O-N 3.39Å; A240-S244 PolarHBondContact O-OG 2.83Å |
| 241 | I | 81.1 | Confident | 84.3 | Confident | 7 Ų | 7 | 57.2 Ų | 57.2 | 4% | 0.036 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -75.9 | -43.3 | -178 | -65.4 | 161.4 | 0 | 0 | 0 | 110.7 | A156 P237 L238 L239 L243 S244 Y245 V281 V284 | A156-I241 HydrophobicContact CB-CD1 4.29Å; A156-I241 HydrophobicContact CB-CG1 3.69Å; P237-I241 WeakPolarHBondContact O-CD1 3.31Å; P237-I241 WeakPolarHBondContact O-CG1 3.23Å; P237-I241 PolarHBondContact O-N 3.43Å; P237-I241 VanDerWaalsContact O-N 3.07Å; L238-I241 PolarHBondContact O-N 3.38Å; L239-I241 PolarHBondContact O-N 3.44Å; I241-L243 PolarHBondContact O-N 3.23Å; I241-S244 WeakPolarHBondContact O-CB 3.46Å; I241-S244 PolarHBondContact O-N 3.35Å; I241-Y245 WeakPolarHBondContact O-CB 3.24Å; I241-Y245 PolarHBondContact O-N 3.03Å; I241-V281 HydrophobicContact CG2-CG2 4.21Å; I241-V284 HydrophobicContact CB-CG1 4.42Å; I241-V284 HydrophobicContact CD1-CB 4.06Å; I241-V284 HydrophobicContact CD1-CG1 3.39Å; I241-V284 HydrophobicContact CD1-CG2 3.58Å; I241-V284 HydrophobicContact CG1-CG1 4.45Å; I241-V284 HydrophobicContact CG2-CB 4.4Å; I241-V284 HydrophobicContact CG2-CG1 4.17Å; I241-V284 HydrophobicContact CG2-CG2 4.45Å |
| 242 | L | 84.1 | Confident | 83.4 | Confident | 106 Ų | 106 | 54.2 Ų | 54.2 | 56% | 0.555 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -58.7 | -48.4 | 174.3 | -179 | 64.3 | 0 | 0 | 0 | 111.3 | L238 L239 S244 Y245 V246 | L238-L242 WeakPolarHBondContact O-CB 3.48Å; L238-L242 PolarHBondContact O-N 3.44Å; L239-L242 PolarHBondContact O-N 3.27Å; L242-S244 PolarHBondContact O-N 3.47Å; L242-Y245 WeakPolarHBondContact O-CB 3.38Å; L242-Y245 PolarHBondContact O-N 2.93Å; L242-Y245 VanDerWaalsContact O-N 3.07Å; L242-V246 WeakPolarHBondContact O-CG2 3.45Å; L242-V246 PolarHBondContact O-N 2.95Å |
| 243 | L | 84.9 | Confident | 82.7 | Confident | 79 Ų | 79 | 62.4 Ų | 62.4 | 41% | 0.414 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64 | -41.8 | 178.1 | -69.7 | 177.2 | 0 | 0 | 0 | 111.8 | L239 I241 Y245 V246 R247 | L239-L243 HydrophobicContact CD1-CD1 4.01Å; L239-L243 HydrophobicContact CD1-CG 3.98Å; L239-L243 HydrophobicContact CG-CD1 3.9Å; L239-L243 HydrophobicContact CG-CG 4.29Å; L239-L243 WeakPolarHBondContact O-CB 3.48Å; L239-L243 VanDerWaalsContact O-CG 3.25Å; L239-L243 WeakPolarHBondContact O-CG 3.39Å; L239-L243 PolarHBondContact O-N 3.06Å; I241-L243 PolarHBondContact O-N 3.23Å; L243-Y245 PolarHBondContact O-N 3.33Å; L243-V246 PolarHBondContact O-N 3.11Å; L243-R247 WeakPolarHBondContact O-CB 3.36Å; L243-R247 VanDerWaalsContact O-CG 3.32Å; L243-R247 WeakPolarHBondContact O-CG 3.44Å; L243-R247 PolarHBondContact O-N 2.9Å |
| 244 | S | 81.2 | Confident | 81.7 | Confident | 9 Ų | 9 | 67.3 Ų | 67.3 | 6% | 0.063 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -58.2 | -38.7 | 173 | -63.7 | 0 | 0 | 0 | 0 | 110.8 | A240 I241 L242 V248 | A240-S244 VanDerWaalsContact O-CB 3.25Å; A240-S244 WeakPolarHBondContact O-CB 3.47Å; A240-S244 PolarHBondContact O-N 3.39Å; A240-S244 PolarHBondContact O-OG 2.83Å; I241-S244 WeakPolarHBondContact O-CB 3.46Å; I241-S244 PolarHBondContact O-N 3.35Å; L242-S244 PolarHBondContact O-N 3.47Å; S244-V248 WeakPolarHBondContact O-CB 3.33Å; S244-V248 WeakPolarHBondContact O-CG2 3.47Å; S244-V248 PolarHBondContact O-N 2.89Å |
| 245 | Y | 80.9 | Confident | 80.6 | Confident | 70 Ų | 70 | 70.2 Ų | 70.2 | 28% | 0.275 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -69.9 | -46.1 | -179.5 | 172.2 | -87 | 0 | 0 | 0 | 114 | I241 L242 L243 R247 V248 S249 F277 V281 | I241-Y245 WeakPolarHBondContact O-CB 3.24Å; I241-Y245 PolarHBondContact O-N 3.03Å; L242-Y245 WeakPolarHBondContact O-CB 3.38Å; L242-Y245 PolarHBondContact O-N 2.93Å; L242-Y245 VanDerWaalsContact O-N 3.07Å; L243-Y245 PolarHBondContact O-N 3.33Å; Y245-R247 VanDerWaalsContact C-N 3.3Å; Y245-R247 PolarHBondContact O-N 3.29Å; Y245-V248 PolarHBondContact O-N 3.03Å; Y245-S249 VanDerWaalsContact O-CB 3.31Å; Y245-S249 WeakPolarHBondContact O-CB 3.23Å; Y245-S249 PolarHBondContact O-N 2.82Å; Y245-S249 PolarHBondContact O-OG 3.47Å; Y245-F277 VanDerWaalsContact CA-CZ 3.4Å; Y245-F277 AromaticContact CD2-CD1 3.98Å; Y245-F277 HydrophobicContact CD2-CD1 3.98Å; Y245-F277 AromaticContact CD2-CE1 3.4Å; Y245-F277 HydrophobicContact CD2-CE1 3.4Å; Y245-F277 VanDerWaalsContact CD2-CE1 3.4Å; Y245-F277 HydrophobicContact CD2-CZ 4.4Å; Y245-F277 HydrophobicContact CE2-CE1 4.43Å; Y245-F277 AromaticContact CG-CE1 3.88Å; Y245-F277 HydrophobicContact CG-CE1 3.88Å; Y245-V281 HydrophobicContact CD2-CG2 3.74Å; Y245-V281 HydrophobicContact CG-CG2 4.23Å |
| 246 | V | 81.8 | Confident | 79.1 | Confident | 76 Ų | 76 | 72.5 Ų | 72.5 | 46% | 0.461 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -58.6 | -47.2 | 175.3 | 175 | 0 | 0 | 0 | 0 | 109.8 | L242 L243 S249 V250 | L242-V246 WeakPolarHBondContact O-CG2 3.45Å; L242-V246 PolarHBondContact O-N 2.95Å; L243-V246 PolarHBondContact O-N 3.11Å; V246-S249 PolarHBondContact O-N 3.44Å; V246-V250 WeakPolarHBondContact O-CG2 3.26Å; V246-V250 PolarHBondContact O-N 3.07Å |
| 247 | R | 82.3 | Confident | 77.6 | Confident | 149 Ų | 149 | 70.5 Ų | 70.5 | 56% | 0.562 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -64.8 | -43.1 | -179.3 | -72.3 | -178 | 179.5 | 167.4 | 2.1 | 113.3 | Y160 L243 Y245 K251 | Y160-R247 HydrophobicContact CE2-CB 3.82Å; L243-R247 WeakPolarHBondContact O-CB 3.36Å; L243-R247 VanDerWaalsContact O-CG 3.32Å; L243-R247 WeakPolarHBondContact O-CG 3.44Å; L243-R247 PolarHBondContact O-N 2.9Å; Y245-R247 VanDerWaalsContact C-N 3.3Å; Y245-R247 PolarHBondContact O-N 3.29Å; R247-K251 WeakPolarHBondContact O-CB 3.45Å; R247-K251 PolarHBondContact O-N 3.28Å |
| 248 | V | 78.1 | Confident | 75.7 | Confident | 3 Ų | 3 | 76 Ų | 76 | 2% | 0.018 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -62.7 | -44 | 176.3 | 167.3 | 0 | 0 | 0 | 0 | 110.6 | Y160 L163 V164 S244 Y245 K251 L252 F277 | Y160-V248 HydrophobicContact CD2-CG2 3.77Å; Y160-V248 HydrophobicContact CE2-CG2 4.38Å; L163-V248 HydrophobicContact CB-CG2 4.5Å; L163-V248 HydrophobicContact CD1-CG1 4.16Å; V164-V248 HydrophobicContact CG2-CG2 3.64Å; S244-V248 WeakPolarHBondContact O-CB 3.33Å; S244-V248 WeakPolarHBondContact O-CG2 3.47Å; S244-V248 PolarHBondContact O-N 2.89Å; Y245-V248 PolarHBondContact O-N 3.03Å; V248-K251 PolarHBondContact O-N 3.3Å; V248-L252 HydrophobicContact CG1-CD1 3.58Å; V248-L252 HydrophobicContact CG1-CG 4.33Å; V248-L252 WeakPolarHBondContact O-CB 3.18Å; V248-L252 WeakPolarHBondContact O-CG 3.45Å; V248-L252 PolarHBondContact O-N 2.92Å; V248-F277 HydrophobicContact CB-CD1 4.29Å; V248-F277 HydrophobicContact CB-CE1 3.98Å; V248-F277 HydrophobicContact CB-CZ 4.25Å; V248-F277 HydrophobicContact CG1-CD1 3.91Å; V248-F277 HydrophobicContact CG1-CE1 4.12Å; V248-F277 HydrophobicContact CG1-CG 4.24Å; V248-F277 HydrophobicContact CG2-CE1 4.31Å; V248-F277 HydrophobicContact CG2-CE2 4.21Å; V248-F277 HydrophobicContact CG2-CZ 4.1Å |
| 249 | S | 77.4 | Confident | 74.4 | Confident | 34 Ų | 34 | 77.6 Ų | 77.6 | 24% | 0.238 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.9 | -45.1 | -180 | -60.4 | 0 | 0 | 0 | 0 | 111.9 | Y245 V246 R253 | Y245-S249 VanDerWaalsContact O-CB 3.31Å; Y245-S249 WeakPolarHBondContact O-CB 3.23Å; Y245-S249 PolarHBondContact O-N 2.82Å; Y245-S249 PolarHBondContact O-OG 3.47Å; V246-S249 PolarHBondContact O-N 3.44Å; S249-R253 WeakPolarHBondContact O-CB 3.32Å; S249-R253 PolarHBondContact O-N 2.87Å |
| 250 | V | 79.9 | Confident | 72.7 | Confident | 63 Ų | 63 | 75.4 Ų | 75.4 | 38% | 0.382 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -64 | -44.3 | 175.7 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | V246 L252 R253 N254 | V246-V250 WeakPolarHBondContact O-CG2 3.26Å; V246-V250 PolarHBondContact O-N 3.07Å; V250-L252 PolarHBondContact O-N 3.34Å; V250-R253 PolarHBondContact O-N 3.31Å; V250-N254 WeakPolarHBondContact O-CB 3.22Å; V250-N254 PolarHBondContact O-N 3.49Å |
| 251 | K | 76.6 | Confident | 71.5 | Confident | 97 Ų | 97 | 80.3 Ų | 80.3 | 42% | 0.422 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -67.1 | -37.3 | -179.1 | -168.1 | 67.6 | 173.4 | -177 | 0 | 112.5 | V164 R247 V248 N254 R255 | V164-K251 HydrophobicContact CG1-CG 4.37Å; R247-K251 WeakPolarHBondContact O-CB 3.45Å; R247-K251 PolarHBondContact O-N 3.28Å; V248-K251 PolarHBondContact O-N 3.3Å; K251-N254 PolarHBondContact O-N 3.34Å; K251-R255 HydrophobicContact CG-CG 4.47Å; K251-R255 WeakPolarHBondContact O-CB 3.42Å; K251-R255 WeakPolarHBondContact O-CG 2.99Å; K251-R255 PolarHBondContact O-N 3.28Å; K251-R255 VanDerWaalsContact O-N 3.07Å |
| 252 | L | 71.8 | Confident | 71 | Confident | 29 Ų | 29 | 83 Ų | 83 | 15% | 0.152 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -69 | -34.1 | 175.8 | -78.7 | 166.4 | 0 | 0 | 0 | 112.1 | V248 V250 R270 R274 | V248-L252 HydrophobicContact CG1-CD1 3.58Å; V248-L252 HydrophobicContact CG1-CG 4.33Å; V248-L252 WeakPolarHBondContact O-CB 3.18Å; V248-L252 WeakPolarHBondContact O-CG 3.45Å; V248-L252 PolarHBondContact O-N 2.92Å; V250-L252 PolarHBondContact O-N 3.34Å; L252-R270 HydrophobicContact CD2-CB 4.39Å; L252-R270 HydrophobicContact CD2-CG 4.09Å; L252-R274 HydrophobicContact CD1-CB 4.23Å |
| 253 | R | 72.7 | Confident | 70.2 | Confident | 197 Ų | 197 | 85.6 Ų | 85.6 | 74% | 0.743 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -67.3 | -39.1 | 173.6 | -169.2 | 174.4 | 73.4 | -175.3 | 5.2 | 112.1 | S249 V250 | S249-R253 WeakPolarHBondContact O-CB 3.32Å; S249-R253 PolarHBondContact O-N 2.87Å; V250-R253 PolarHBondContact O-N 3.31Å |
| 254 | N | 68.9 | Low | 69.6 | Low | 109 Ų | 109 | 84.9 Ų | 84.9 | 58% | 0.583 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -94.8 | -0.2 | -173.2 | -62.4 | 0.3 | 0 | 0 | 0 | 114.2 | V250 K251 | V250-N254 WeakPolarHBondContact O-CB 3.22Å; V250-N254 PolarHBondContact O-N 3.49Å; K251-N254 PolarHBondContact O-N 3.34Å |
| 255 | R | 64.5 | Low | 69.1 | Low | 86 Ų | 86 | 89.6 Ų | 89.6 | 33% | 0.325 | 48% | 0.484 | S | S | . | . | trans | -85.6 | 116.7 | 177.2 | -97 | -174.6 | 179.9 | -133.7 | -1 | 110.7 | V164 P166 K251 R270 | V164-R255 PolarHBondContact O-NH2 2.89Å; P166-R255 VanDerWaalsContact CG-NH2 3.26Å; K251-R255 HydrophobicContact CG-CG 4.47Å; K251-R255 WeakPolarHBondContact O-CB 3.42Å; K251-R255 WeakPolarHBondContact O-CG 2.99Å; K251-R255 PolarHBondContact O-N 3.28Å; K251-R255 VanDerWaalsContact O-N 3.07Å; R255-R270 PolarHBondContact O-NH1 3.29Å; R255-R270 PolarHBondContact O-NH2 3.28Å | ||
| 256 | V | 57.6 | Low | 68.6 | Low | 133 Ų | 133 | 86.6 Ų | 86.6 | 81% | 0.806 | 47% | 0.473 | S | S | * | . | trans | -85.6 | 118.2 | 156.2 | -174.5 | 0 | 0 | 0 | 0 | 106.4 | P258 | V256-P258 VanDerWaalsContact O-CD 3.24Å; V256-P258 WeakPolarHBondContact O-CD 3.33Å | ||
| 257 | V | 58.3 | Low | 68.2 | Low | 54 Ų | 54 | 86.5 Ų | 86.5 | 33% | 0.327 | 47% | 0.47 | S | S | . | . | trans | -79.4 | 113.6 | -176.9 | 178.2 | 0 | 0 | 0 | 0 | 108.5 | A266 | V257-A266 HydrophobicContact CB-CB 4.11Å; V257-A266 HydrophobicContact CG1-CB 4.47Å; V257-A266 HydrophobicContact CG2-CB 4.23Å | ||
| 258 | P | 46.8 | Very low | 67.8 | Low | 126 Ų | 126 | 88.5 Ų | 88.5 | 82% | 0.818 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.5 | 128.7 | 173.4 | -3.8 | 23.1 | 0 | 0 | 0 | 108.7 | V256 | V256-P258 VanDerWaalsContact O-CD 3.24Å; V256-P258 WeakPolarHBondContact O-CD 3.33Å |
| 259 | G | 59 | Low | 67.4 | Low | 81 Ų | 81 | 92.7 Ų | 92.7 | 84% | 0.835 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 98.2 | 9.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 260 | S | 53.7 | Low | 67.2 | Low | 43 Ų | 43 | 94.1 Ų | 94.1 | 30% | 0.301 | 50% | 0.5 | S | S | . | . | trans | -79 | 121.1 | 164.8 | 54.7 | 0 | 0 | 0 | 0 | 110.1 | T262 | S260-T262 PolarHBondContact O-N 2.69Š| ||
| 261 | V | 59.8 | Low | 66.9 | Low | 136 Ų | 136 | 93.8 Ų | 93.8 | 82% | 0.824 | 51% | 0.505 | S | S | * | . | S | Bend | trans | -60.8 | -27.4 | 179.8 | -174.6 | 0 | 0 | 0 | 0 | 111.5 | ||
| 262 | T | 70.3 | Confident | 66.8 | Low | 62 Ų | 62 | 97.6 Ų | 97.6 | 38% | 0.38 | 52% | 0.516 | S | S | . | . | S | Bend | trans | -139.4 | 145 | 174.7 | 43.9 | 0 | 0 | 0 | 0 | 111.5 | S260 S264 Q265 A266 | S260-T262 PolarHBondContact O-N 2.69Å; T262-S264 PolarHBondContact O-N 3.07Å; T262-Q265 PolarHBondContact O-N 3.04Å; T262-Q265 VanDerWaalsContact OG1-CG 3.28Å; T262-Q265 WeakPolarHBondContact OG1-CG 3.45Å; T262-Q265 PolarHBondContact OG1-OE1 2.97Å; T262-A266 PolarHBondContact O-N 3.33Å |
| 263 | Q | 68.6 | Low | 66.8 | Low | 161 Ų | 161 | 101.3 Ų | 101.3 | 75% | 0.752 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -59.1 | -35.8 | 179 | -167.8 | 171.4 | 2.9 | 0 | 0 | 111.8 | Q265 A266 D267 | Q263-Q265 PolarHBondContact O-N 2.89Å; Q263-A266 PolarHBondContact O-N 3.35Å; Q263-D267 VanDerWaalsContact O-CG 3.29Å; Q263-D267 PolarHBondContact O-N 3.13Å; Q263-D267 VanDerWaalsContact O-N 3.13Å |
| 264 | S | 71.1 | Confident | 66.9 | Low | 65 Ų | 65 | 98.2 Ų | 98.2 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.6 | -46.5 | 175.9 | 58.4 | 0 | 0 | 0 | 0 | 112.5 | T262 A266 D267 W268 | T262-S264 PolarHBondContact O-N 3.07Å; S264-A266 VanDerWaalsContact C-N 3.35Å; S264-A266 PolarHBondContact O-N 3.49Å; S264-D267 PolarHBondContact O-N 3.2Å; S264-D267 VanDerWaalsContact O-N 3.13Å; S264-W268 PolarHBondContact O-N 3.34Å |
| 265 | Q | 70.9 | Confident | 67.2 | Low | 108 Ų | 108 | 99 Ų | 99 | 51% | 0.505 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.8 | -39.9 | 179.6 | -74.7 | 174.2 | -17.4 | 0 | 0 | 112.6 | T262 Q263 D267 W268 D269 | T262-Q265 PolarHBondContact O-N 3.04Å; T262-Q265 VanDerWaalsContact OG1-CG 3.28Å; T262-Q265 WeakPolarHBondContact OG1-CG 3.45Å; T262-Q265 PolarHBondContact OG1-OE1 2.97Å; Q263-Q265 PolarHBondContact O-N 2.89Å; Q265-D267 VanDerWaalsContact C-N 3.31Å; Q265-D267 PolarHBondContact O-N 3.41Å; Q265-W268 PolarHBondContact O-N 3.37Å; Q265-D269 PolarHBondContact O-N 3.37Å; Q265-D269 VanDerWaalsContact O-N 3.1Å |
| 266 | A | 70.8 | Confident | 67.5 | Low | 6 Ų | 6 | 97.2 Ų | 97.2 | 5% | 0.05 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -63.7 | -38 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | V257 T262 Q263 S264 R270 | V257-A266 HydrophobicContact CB-CB 4.11Å; V257-A266 HydrophobicContact CG1-CB 4.47Å; V257-A266 HydrophobicContact CG2-CB 4.23Å; T262-A266 PolarHBondContact O-N 3.33Å; Q263-A266 PolarHBondContact O-N 3.35Å; S264-A266 VanDerWaalsContact C-N 3.35Å; S264-A266 PolarHBondContact O-N 3.49Å; A266-R270 VanDerWaalsContact O-CG 3.31Å; A266-R270 WeakPolarHBondContact O-CG 3.47Å; A266-R270 PolarHBondContact O-N 3.41Å |
| 267 | D | 73 | Confident | 68.3 | Low | 74 Ų | 74 | 91 Ų | 91 | 40% | 0.396 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -72.1 | -39.6 | 179.7 | -67.1 | -24.3 | 0 | 0 | 0 | 111.6 | Q263 S264 Q265 D269 R270 A271 | Q263-D267 VanDerWaalsContact O-CG 3.29Å; Q263-D267 PolarHBondContact O-N 3.13Å; Q263-D267 VanDerWaalsContact O-N 3.13Å; S264-D267 PolarHBondContact O-N 3.2Å; S264-D267 VanDerWaalsContact O-N 3.13Å; Q265-D267 VanDerWaalsContact C-N 3.31Å; Q265-D267 PolarHBondContact O-N 3.41Å; D267-D269 PolarHBondContact O-N 2.88Å; D267-R270 PolarHBondContact O-N 2.86Å; D267-A271 WeakPolarHBondContact O-CB 3.28Å; D267-A271 PolarHBondContact O-N 3.31Å |
| 268 | W | 73.4 | Confident | 69.1 | Low | 191 Ų | 191 | 90.1 Ų | 90.1 | 72% | 0.723 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -59 | -46.1 | 172.4 | -80.4 | 106.6 | 0 | 0 | 0 | 112.1 | S264 Q265 A271 R272 | S264-W268 PolarHBondContact O-N 3.34Å; Q265-W268 PolarHBondContact O-N 3.37Å; W268-A271 PolarHBondContact O-N 3.11Å; W268-R272 WeakPolarHBondContact O-CB 3.47Å; W268-R272 PolarHBondContact O-N 3.43Å |
| 269 | D | 71.2 | Confident | 70.4 | Confident | 91 Ų | 91 | 84.9 Ų | 84.9 | 49% | 0.487 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -66.3 | -38.7 | 177.9 | -90.2 | -15.3 | 0 | 0 | 0 | 112.7 | Q265 D267 R273 | Q265-D269 PolarHBondContact O-N 3.37Å; Q265-D269 VanDerWaalsContact O-N 3.1Å; D267-D269 PolarHBondContact O-N 2.88Å; D269-R273 WeakPolarHBondContact O-CB 3.03Å; D269-R273 VanDerWaalsContact O-CG 3.27Å; D269-R273 WeakPolarHBondContact O-CG 3.39Å; D269-R273 PolarHBondContact O-N 3.07Å |
| 270 | R | 73.3 | Confident | 71.1 | Confident | 64 Ų | 64 | 81.4 Ų | 81.4 | 24% | 0.242 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -63.7 | -45.9 | 173.1 | -76 | -178.3 | -138 | -173.3 | 9 | 111.4 | L252 R255 A266 D267 R272 R273 R274 | L252-R270 HydrophobicContact CD2-CB 4.39Å; L252-R270 HydrophobicContact CD2-CG 4.09Å; R255-R270 PolarHBondContact O-NH1 3.29Å; R255-R270 PolarHBondContact O-NH2 3.28Å; A266-R270 VanDerWaalsContact O-CG 3.31Å; A266-R270 WeakPolarHBondContact O-CG 3.47Å; A266-R270 PolarHBondContact O-N 3.41Å; D267-R270 PolarHBondContact O-N 2.86Å; R270-R272 VanDerWaalsContact C-N 3.35Å; R270-R272 PolarHBondContact O-N 2.95Å; R270-R273 PolarHBondContact O-N 3.05Å; R270-R274 WeakPolarHBondContact O-CB 3.35Å; R270-R274 PolarHBondContact O-N 2.91Å |
| 271 | A | 73.1 | Confident | 72.4 | Confident | 57 Ų | 57 | 80.8 Ų | 80.8 | 47% | 0.471 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -60.5 | -44.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | D267 W268 R274 R275 | D267-A271 WeakPolarHBondContact O-CB 3.28Å; D267-A271 PolarHBondContact O-N 3.31Å; W268-A271 PolarHBondContact O-N 3.11Å; A271-R274 PolarHBondContact O-N 3.01Å; A271-R275 WeakPolarHBondContact O-CB 3.22Å; A271-R275 PolarHBondContact O-N 3.36Å |
| 272 | R | 74 | Confident | 73.5 | Confident | 177 Ų | 177 | 77.8 Ų | 77.8 | 67% | 0.668 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -62.4 | -44.1 | 176.8 | -173.1 | 178.7 | -179.5 | -156.4 | 2.1 | 112.8 | W268 R270 R275 T276 | W268-R272 WeakPolarHBondContact O-CB 3.47Å; W268-R272 PolarHBondContact O-N 3.43Å; R270-R272 VanDerWaalsContact C-N 3.35Å; R270-R272 PolarHBondContact O-N 2.95Å; R272-R275 PolarHBondContact O-N 3.16Å; R272-T276 PolarHBondContact O-N 3.35Å; R272-T276 PolarHBondContact O-OG1 3.45Å |
| 273 | R | 72.6 | Confident | 74.1 | Confident | 107 Ų | 107 | 74.9 Ų | 74.9 | 40% | 0.404 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.5 | -45.9 | 176.6 | -76.9 | 173.3 | -172.7 | -104.2 | 3 | 111.8 | L163 D269 R270 T276 F277 | L163-R273 HydrophobicContact CD2-CB 3.59Å; L163-R273 HydrophobicContact CD2-CG 3.6Å; D269-R273 WeakPolarHBondContact O-CB 3.03Å; D269-R273 VanDerWaalsContact O-CG 3.27Å; D269-R273 WeakPolarHBondContact O-CG 3.39Å; D269-R273 PolarHBondContact O-N 3.07Å; R270-R273 PolarHBondContact O-N 3.05Å; R273-T276 PolarHBondContact O-N 2.89Å; R273-F277 PolarHBondContact O-N 3.47Å; R273-F277 VanDerWaalsContact O-N 3.1Å |
| 274 | R | 73.9 | Confident | 74.6 | Confident | 131 Ų | 131 | 67.8 Ų | 67.8 | 49% | 0.494 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | 175.9 | -174.3 | 173.2 | 179.4 | -117.9 | -2.6 | 111.2 | L252 R270 A271 T276 F277 C278 | L252-R274 HydrophobicContact CD1-CB 4.23Å; R270-R274 WeakPolarHBondContact O-CB 3.35Å; R270-R274 PolarHBondContact O-N 2.91Å; A271-R274 PolarHBondContact O-N 3.01Å; R274-T276 PolarHBondContact O-N 3.05Å; R274-F277 PolarHBondContact O-N 3.38Å; R274-C278 WeakPolarHBondContact O-CB 3.21Å; R274-C278 PolarHBondContact O-N 2.92Å; R274-C278 PolarHBondContact O-SG 3.3Å; R274-C278 VanDerWaalsContact O-SG 3.42Å |
| 275 | R | 75.1 | Confident | 75.3 | Confident | 127 Ų | 127 | 68 Ų | 68 | 48% | 0.479 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -58.3 | -46.8 | 177.4 | -178.9 | 173.4 | 178 | 170.2 | -2.1 | 112.2 | A271 R272 F277 C278 L279 L338 | A271-R275 WeakPolarHBondContact O-CB 3.22Å; A271-R275 PolarHBondContact O-N 3.36Å; R272-R275 PolarHBondContact O-N 3.16Å; R275-F277 VanDerWaalsContact C-N 3.29Å; R275-F277 PolarHBondContact O-N 2.91Å; R275-C278 PolarHBondContact O-N 3.17Å; R275-L279 PolarHBondContact O-N 2.93Å; R275-L338 HydrophobicContact CG-CD1 3.82Å; R275-L338 HydrophobicContact CG-CD2 4.25Å; R275-L338 HydrophobicContact CG-CG 4.32Å |
| 276 | T | 71.3 | Confident | 76.2 | Confident | 47 Ų | 47 | 64.8 Ų | 64.8 | 29% | 0.288 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.6 | -40.1 | 177.6 | -53 | 0 | 0 | 0 | 0 | 111.6 | R272 R273 R274 L279 | R272-T276 PolarHBondContact O-N 3.35Å; R272-T276 PolarHBondContact O-OG1 3.45Å; R273-T276 PolarHBondContact O-N 2.89Å; R274-T276 PolarHBondContact O-N 3.05Å; T276-L279 WeakPolarHBondContact O-CB 3.33Å |
| 277 | F | 73.3 | Confident | 76.9 | Confident | 2 Ų | 2 | 65.2 Ų | 65.2 | 1% | 0.009 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -76.5 | -38.7 | 179.9 | -179.9 | -100 | 0 | 0 | 0 | 113.2 | R159 L163 Y245 V248 R273 R274 R275 L279 L280 V281 | R159-F277 HydrophobicContact CB-CD2 4.43Å; L163-F277 HydrophobicContact CD1-CB 3.71Å; L163-F277 HydrophobicContact CD1-CD2 4.07Å; L163-F277 HydrophobicContact CD1-CG 4.03Å; Y245-F277 VanDerWaalsContact CA-CZ 3.4Å; Y245-F277 AromaticContact CD2-CD1 3.98Å; Y245-F277 HydrophobicContact CD2-CD1 3.98Å; Y245-F277 AromaticContact CD2-CE1 3.4Å; Y245-F277 HydrophobicContact CD2-CE1 3.4Å; Y245-F277 VanDerWaalsContact CD2-CE1 3.4Å; Y245-F277 HydrophobicContact CD2-CZ 4.4Å; Y245-F277 HydrophobicContact CE2-CE1 4.43Å; Y245-F277 AromaticContact CG-CE1 3.88Å; Y245-F277 HydrophobicContact CG-CE1 3.88Å; V248-F277 HydrophobicContact CB-CD1 4.29Å; V248-F277 HydrophobicContact CB-CE1 3.98Å; V248-F277 HydrophobicContact CB-CZ 4.25Å; V248-F277 HydrophobicContact CG1-CD1 3.91Å; V248-F277 HydrophobicContact CG1-CE1 4.12Å; V248-F277 HydrophobicContact CG1-CG 4.24Å; V248-F277 HydrophobicContact CG2-CE1 4.31Å; V248-F277 HydrophobicContact CG2-CE2 4.21Å; V248-F277 HydrophobicContact CG2-CZ 4.1Å; R273-F277 PolarHBondContact O-N 3.47Å; R273-F277 VanDerWaalsContact O-N 3.1Å; R274-F277 PolarHBondContact O-N 3.38Å; R275-F277 VanDerWaalsContact C-N 3.29Å; R275-F277 PolarHBondContact O-N 2.91Å; F277-L279 PolarHBondContact O-N 3.46Å; F277-L280 HydrophobicContact CD2-CD1 4.34Å; F277-L280 WeakPolarHBondContact O-CB 3.31Å; F277-L280 PolarHBondContact O-N 3Å; F277-V281 HydrophobicContact CE1-CG2 4.15Å; F277-V281 HydrophobicContact CZ-CG2 4.32Å; F277-V281 PolarHBondContact O-N 3.33Å; F277-V281 VanDerWaalsContact O-N 3.16Å |
| 278 | C | 76.6 | Confident | 77.6 | Confident | 37 Ų | 37 | 62.1 Ų | 62.1 | 25% | 0.25 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -57.4 | -36.6 | 170.1 | -78.1 | 0 | 0 | 0 | 0 | 111.4 | R274 R275 L280 V281 V282 | R274-C278 WeakPolarHBondContact O-CB 3.21Å; R274-C278 PolarHBondContact O-N 2.92Å; R274-C278 PolarHBondContact O-SG 3.3Å; R274-C278 VanDerWaalsContact O-SG 3.42Å; R275-C278 PolarHBondContact O-N 3.17Å; C278-L280 VanDerWaalsContact C-N 3.32Å; C278-L280 PolarHBondContact O-N 3.27Å; C278-V281 PolarHBondContact O-N 3.36Å; C278-V282 WeakPolarHBondContact O-CG2 3.42Å; C278-V282 PolarHBondContact O-N 3.42Å |
| 279 | L | 73.9 | Confident | 78.5 | Confident | 15 Ų | 15 | 57.2 Ų | 57.2 | 8% | 0.079 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -59 | -43.5 | 173.2 | 167.9 | 150.8 | 0 | 0 | 0 | 112.3 | R275 T276 F277 V281 V282 V283 I334 Y335 L338 | R275-L279 PolarHBondContact O-N 2.93Å; T276-L279 WeakPolarHBondContact O-CB 3.33Å; F277-L279 PolarHBondContact O-N 3.46Å; L279-V281 VanDerWaalsContact C-N 3.26Å; L279-V281 PolarHBondContact O-N 3.26Å; L279-V282 WeakPolarHBondContact O-CB 3.13Å; L279-V282 PolarHBondContact O-N 3.49Å; L279-V282 VanDerWaalsContact O-N 3.08Å; L279-V283 HydrophobicContact CD2-CG2 4.07Å; L279-V283 HydrophobicContact CG-CG2 4.37Å; L279-V283 WeakPolarHBondContact O-CG2 3.47Å; L279-V283 PolarHBondContact O-N 3.23Å; L279-I334 HydrophobicContact CD1-CG2 3.65Å; L279-I334 WeakPolarHBondContact CD1-O 3.31Å; L279-I334 HydrophobicContact CD2-CG2 4.34Å; L279-I334 HydrophobicContact CG-CG2 3.63Å; L279-Y335 HydrophobicContact CD2-CD1 4.35Å; L279-Y335 HydrophobicContact CD2-CE1 4.05Å; L279-L338 HydrophobicContact CB-CD1 4.25Å; L279-L338 HydrophobicContact CB-CD2 3.66Å; L279-L338 HydrophobicContact CB-CG 4.41Å; L279-L338 HydrophobicContact CD1-CB 3.23Å; L279-L338 HydrophobicContact CD1-CD1 4.07Å; L279-L338 HydrophobicContact CD1-CD2 3.34Å; L279-L338 HydrophobicContact CD1-CG 3.66Å; L279-L338 HydrophobicContact CG-CD2 4.08Å |
| 280 | L | 73.9 | Confident | 79.5 | Confident | 8 Ų | 8 | 53.1 Ų | 53.1 | 4% | 0.042 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64.5 | -38.2 | -179.3 | -59.8 | 167.3 | 0 | 0 | 0 | 111 | I155 R159 F277 C278 V283 V284 | I155-L280 HydrophobicContact CG2-CD1 4.23Å; I155-L280 HydrophobicContact CG2-CD2 3.35Å; I155-L280 HydrophobicContact CG2-CG 4.38Å; R159-L280 HydrophobicContact CB-CD1 3.42Å; R159-L280 VanDerWaalsContact CB-CD1 3.42Å; R159-L280 HydrophobicContact CG-CD1 3.28Å; F277-L280 HydrophobicContact CD2-CD1 4.34Å; F277-L280 WeakPolarHBondContact O-CB 3.31Å; F277-L280 PolarHBondContact O-N 3Å; C278-L280 VanDerWaalsContact C-N 3.32Å; C278-L280 PolarHBondContact O-N 3.27Å; L280-V283 PolarHBondContact O-N 3.23Å; L280-V284 WeakPolarHBondContact O-CB 3.43Å; L280-V284 WeakPolarHBondContact O-CG2 3.48Å; L280-V284 PolarHBondContact O-N 3.03Å; L280-V284 VanDerWaalsContact O-N 3.1Å |
| 281 | V | 79.6 | Confident | 80.4 | Confident | 30 Ų | 30 | 50.9 Ų | 50.9 | 18% | 0.182 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.8 | -44.2 | 172 | 176.2 | 0 | 0 | 0 | 0 | 110.7 | I241 Y245 F277 C278 L279 V284 V285 | I241-V281 HydrophobicContact CG2-CG2 4.21Å; Y245-V281 HydrophobicContact CD2-CG2 3.74Å; Y245-V281 HydrophobicContact CG-CG2 4.23Å; F277-V281 HydrophobicContact CE1-CG2 4.15Å; F277-V281 HydrophobicContact CZ-CG2 4.32Å; F277-V281 PolarHBondContact O-N 3.33Å; F277-V281 VanDerWaalsContact O-N 3.16Å; C278-V281 PolarHBondContact O-N 3.36Å; L279-V281 VanDerWaalsContact C-N 3.26Å; L279-V281 PolarHBondContact O-N 3.26Å; V281-V284 PolarHBondContact O-N 3.46Å; V281-V285 HydrophobicContact CG1-CG2 4.01Å; V281-V285 WeakPolarHBondContact O-CB 3.12Å; V281-V285 WeakPolarHBondContact O-CG2 3.4Å; V281-V285 PolarHBondContact O-N 3.35Å |
| 282 | V | 83.7 | Confident | 81.3 | Confident | 74 Ų | 74 | 52 Ų | 52 | 45% | 0.448 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60.5 | -47.8 | 177 | 170.5 | 0 | 0 | 0 | 0 | 111.2 | C278 L279 V284 V285 V286 I334 | C278-V282 WeakPolarHBondContact O-CG2 3.42Å; C278-V282 PolarHBondContact O-N 3.42Å; L279-V282 WeakPolarHBondContact O-CB 3.13Å; L279-V282 PolarHBondContact O-N 3.49Å; L279-V282 VanDerWaalsContact O-N 3.08Å; V282-V284 VanDerWaalsContact C-N 3.29Å; V282-V284 PolarHBondContact O-N 3.45Å; V282-V285 PolarHBondContact O-N 2.91Å; V282-V286 HydrophobicContact CG1-CG2 4.17Å; V282-V286 WeakPolarHBondContact O-CB 3.29Å; V282-V286 WeakPolarHBondContact O-CG2 3.46Å; V282-V286 PolarHBondContact O-N 3.44Å; V282-I334 HydrophobicContact CG1-CD1 4.46Å |
| 283 | V | 82.1 | Confident | 82.2 | Confident | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.006 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.1 | -46.1 | 177.9 | 176.3 | 0 | 0 | 0 | 0 | 111 | L152 L279 L280 V286 F287 N331 I334 | L152-V283 HydrophobicContact CD1-CG1 4.26Å; L152-V283 HydrophobicContact CD2-CB 4.43Å; L152-V283 HydrophobicContact CD2-CG1 3.44Å; L152-V283 VanDerWaalsContact CD2-CG1 3.44Å; L279-V283 HydrophobicContact CD2-CG2 4.07Å; L279-V283 HydrophobicContact CG-CG2 4.37Å; L279-V283 WeakPolarHBondContact O-CG2 3.47Å; L279-V283 PolarHBondContact O-N 3.23Å; L280-V283 PolarHBondContact O-N 3.23Å; V283-V286 PolarHBondContact O-N 2.86Å; V283-F287 WeakPolarHBondContact O-CB 3.38Å; V283-F287 PolarHBondContact O-N 3.28Å; V283-N331 WeakPolarHBondContact CG1-OD1 3.4Å; V283-I334 HydrophobicContact CG2-CB 4.06Å; V283-I334 HydrophobicContact CG2-CD1 3.94Å; V283-I334 HydrophobicContact CG2-CG2 3.39Å |
| 284 | V | 80.6 | Confident | 83 | Confident | 11 Ų | 11 | 41.5 Ų | 41.5 | 7% | 0.067 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -69.1 | -41 | -178.7 | 170.3 | 0 | 0 | 0 | 0 | 111.7 | L152 L238 I241 L280 V281 V282 F287 A288 | L152-V284 HydrophobicContact CB-CG2 4.15Å; L152-V284 HydrophobicContact CD1-CG2 4.49Å; L238-V284 HydrophobicContact CD2-CG1 3.95Å; I241-V284 HydrophobicContact CB-CG1 4.42Å; I241-V284 HydrophobicContact CD1-CB 4.06Å; I241-V284 HydrophobicContact CD1-CG1 3.39Å; I241-V284 HydrophobicContact CD1-CG2 3.58Å; I241-V284 HydrophobicContact CG1-CG1 4.45Å; I241-V284 HydrophobicContact CG2-CB 4.4Å; I241-V284 HydrophobicContact CG2-CG1 4.17Å; I241-V284 HydrophobicContact CG2-CG2 4.45Å; L280-V284 WeakPolarHBondContact O-CB 3.43Å; L280-V284 WeakPolarHBondContact O-CG2 3.48Å; L280-V284 PolarHBondContact O-N 3.03Å; L280-V284 VanDerWaalsContact O-N 3.1Å; V281-V284 PolarHBondContact O-N 3.46Å; V282-V284 VanDerWaalsContact C-N 3.29Å; V282-V284 PolarHBondContact O-N 3.45Å; V284-F287 WeakPolarHBondContact O-CB 3.3Å; V284-F287 PolarHBondContact O-N 2.85Å; V284-A288 WeakPolarHBondContact O-CB 3.29Å; V284-A288 PolarHBondContact O-N 3.17Å |
| 285 | V | 85.6 | Confident | 83.8 | Confident | 71 Ų | 71 | 37.1 Ų | 37.1 | 43% | 0.43 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -65.1 | -43.4 | 177.2 | 167.7 | 0 | 0 | 0 | 0 | 110.1 | V281 V282 A288 V289 | V281-V285 HydrophobicContact CG1-CG2 4.01Å; V281-V285 WeakPolarHBondContact O-CB 3.12Å; V281-V285 WeakPolarHBondContact O-CG2 3.4Å; V281-V285 PolarHBondContact O-N 3.35Å; V282-V285 PolarHBondContact O-N 2.91Å; V285-A288 PolarHBondContact O-N 3.29Å; V285-V289 HydrophobicContact CG1-CG2 4.22Å; V285-V289 WeakPolarHBondContact O-CB 3.3Å; V285-V289 VanDerWaalsContact O-CG2 3.26Å; V285-V289 WeakPolarHBondContact O-CG2 3.48Å; V285-V289 PolarHBondContact O-N 3.26Å |
| 286 | V | 88.8 | Confident | 84.5 | Confident | 39 Ų | 39 | 34.2 Ų | 34.2 | 24% | 0.236 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59.4 | -48.5 | 174.8 | 170.1 | 0 | 0 | 0 | 0 | 110.1 | V282 V283 A288 V289 C290 Y330 I334 | V282-V286 HydrophobicContact CG1-CG2 4.17Å; V282-V286 WeakPolarHBondContact O-CB 3.29Å; V282-V286 WeakPolarHBondContact O-CG2 3.46Å; V282-V286 PolarHBondContact O-N 3.44Å; V283-V286 PolarHBondContact O-N 2.86Å; V286-A288 PolarHBondContact O-N 3.42Å; V286-V289 PolarHBondContact O-N 3.2Å; V286-C290 WeakPolarHBondContact O-CB 3.43Å; V286-C290 PolarHBondContact O-N 2.84Å; V286-C290 PolarHBondContact O-SG 2.87Å; V286-Y330 HydrophobicContact CG1-CD2 3.34Å; V286-Y330 HydrophobicContact CG1-CE2 4.11Å; V286-Y330 HydrophobicContact CG1-CG 3.68Å; V286-I334 HydrophobicContact CG2-CD1 4.33Å |
| 287 | F | 86.6 | Confident | 85.4 | Confident | 16 Ų | 16 | 32.2 Ų | 32.2 | 7% | 0.07 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -55 | -51.3 | 173.7 | -176.1 | -84.6 | 0 | 0 | 0 | 110.9 | V145 V149 L152 V283 V284 V289 C290 W291 | V145-F287 HydrophobicContact CG1-CZ 4.13Å; V149-F287 HydrophobicContact CG2-CD1 4.39Å; V149-F287 HydrophobicContact CG2-CE1 3.37Å; V149-F287 HydrophobicContact CG2-CE2 4.44Å; V149-F287 HydrophobicContact CG2-CZ 3.4Å; L152-F287 HydrophobicContact CD1-CB 4.24Å; L152-F287 HydrophobicContact CD1-CD2 4.24Å; L152-F287 HydrophobicContact CD1-CG 4.19Å; V283-F287 WeakPolarHBondContact O-CB 3.38Å; V283-F287 PolarHBondContact O-N 3.28Å; V284-F287 WeakPolarHBondContact O-CB 3.3Å; V284-F287 PolarHBondContact O-N 2.85Å; F287-V289 PolarHBondContact O-N 3.32Å; F287-C290 PolarHBondContact O-N 3.09Å; F287-C290 VanDerWaalsContact O-N 3.17Å; F287-W291 AromaticContact CD1-CD1 3.89Å; F287-W291 HydrophobicContact CD1-CG 4.38Å; F287-W291 AromaticContact CD2-CD1 3.9Å; F287-W291 AromaticContact CD2-NE1 3.81Å; F287-W291 AromaticContact CE1-CD1 3.66Å; F287-W291 HydrophobicContact CE1-CD2 4.38Å; F287-W291 AromaticContact CE1-CG 3.9Å; F287-W291 HydrophobicContact CE1-CG 3.9Å; F287-W291 AromaticContact CE2-CD1 3.7Å; F287-W291 AromaticContact CE2-NE1 3.3Å; F287-W291 VanDerWaalsContact CE2-NE1 3.3Å; F287-W291 AromaticContact CG-CD1 3.99Å; F287-W291 AromaticContact CZ-CD1 3.57Å; F287-W291 HydrophobicContact CZ-CD2 4.1Å; F287-W291 AromaticContact CZ-CE2 3.79Å; F287-W291 AromaticContact CZ-CG 4Å; F287-W291 HydrophobicContact CZ-CG 4Å; F287-W291 AromaticContact CZ-NE1 3.4Å; F287-W291 PolarHBondContact O-N 2.78Å |
| 288 | A | 87.6 | Confident | 86 | Confident | 8 Ų | 8 | 34.4 Ų | 34.4 | 7% | 0.066 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.1 | -43 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y234 L238 V284 V285 V286 C290 W291 L292 | Y234-A288 HydrophobicContact CE2-CB 3.96Å; Y234-A288 PolarHBondContact OH-O 2.91Å; L238-A288 HydrophobicContact CD1-CB 3.92Å; L238-A288 HydrophobicContact CD2-CB 3.68Å; L238-A288 HydrophobicContact CG-CB 4.23Å; V284-A288 WeakPolarHBondContact O-CB 3.29Å; V284-A288 PolarHBondContact O-N 3.17Å; V285-A288 PolarHBondContact O-N 3.29Å; V286-A288 PolarHBondContact O-N 3.42Å; A288-C290 VanDerWaalsContact C-N 3.31Å; A288-C290 PolarHBondContact O-N 3.21Å; A288-W291 PolarHBondContact O-N 2.84Å; A288-L292 VanDerWaalsContact O-CB 3.29Å; A288-L292 WeakPolarHBondContact O-CB 3.23Å; A288-L292 PolarHBondContact O-N 3.06Å |
| 289 | V | 91.7 | Very high | 86.5 | Confident | 89 Ų | 89 | 35 Ų | 35 | 54% | 0.539 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -63.9 | -37.9 | 176.6 | 170.2 | 0 | 0 | 0 | 0 | 111.3 | V285 V286 F287 W291 P293 | V285-V289 HydrophobicContact CG1-CG2 4.22Å; V285-V289 WeakPolarHBondContact O-CB 3.3Å; V285-V289 VanDerWaalsContact O-CG2 3.26Å; V285-V289 WeakPolarHBondContact O-CG2 3.48Å; V285-V289 PolarHBondContact O-N 3.26Å; V286-V289 PolarHBondContact O-N 3.2Å; F287-V289 PolarHBondContact O-N 3.32Å; V289-W291 VanDerWaalsContact C-N 3.34Å; V289-P293 WeakPolarHBondContact O-CD 3.38Å |
| 290 | C | 93.3 | Very high | 87.1 | Confident | 5 Ų | 5 | 37.7 Ų | 37.7 | 3% | 0.034 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.6 | -36 | 177.5 | -67.4 | 0 | 0 | 0 | 0 | 112.4 | V286 F287 A288 L323 A324 Y330 | V286-C290 WeakPolarHBondContact O-CB 3.43Å; V286-C290 PolarHBondContact O-N 2.84Å; V286-C290 PolarHBondContact O-SG 2.87Å; F287-C290 PolarHBondContact O-N 3.09Å; F287-C290 VanDerWaalsContact O-N 3.17Å; A288-C290 VanDerWaalsContact C-N 3.31Å; A288-C290 PolarHBondContact O-N 3.21Å; C290-L323 WeakPolarHBondContact CB-O 3.42Å; C290-L323 CarbonylContact O-C 3.58Å; C290-A324 WeakPolarHBondContact O-CA 3.45Å; C290-A324 PolarHBondContact O-N 2.87Å; C290-Y330 WeakPolarHBondContact SG-CE2 3.44Å |
| 291 | W | 91.1 | Very high | 87.5 | Confident | 17 Ų | 17 | 41.4 Ų | 41.4 | 6% | 0.064 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -88 | -23.8 | -176.5 | -78.5 | 77.6 | 0 | 0 | 0 | 113.8 | V145 Y234 F287 A288 V289 L294 H295 A324 S327 | V145-W291 HydrophobicContact CB-CH2 3.93Å; V145-W291 HydrophobicContact CB-CZ2 4.17Å; V145-W291 HydrophobicContact CG1-CD2 4.31Å; V145-W291 HydrophobicContact CG1-CE3 4.12Å; V145-W291 HydrophobicContact CG1-CH2 3.42Å; V145-W291 VanDerWaalsContact CG1-CH2 3.42Å; V145-W291 HydrophobicContact CG1-CZ2 3.56Å; V145-W291 HydrophobicContact CG1-CZ3 3.68Å; V145-W291 HydrophobicContact CG2-CH2 3.15Å; V145-W291 HydrophobicContact CG2-CZ2 3.49Å; V145-W291 VanDerWaalsContact CG2-CZ2 3.49Å; V145-W291 HydrophobicContact CG2-CZ3 4.07Å; Y234-W291 HydrophobicContact CE2-CB 4.3Å; F287-W291 AromaticContact CD1-CD1 3.89Å; F287-W291 HydrophobicContact CD1-CG 4.38Å; F287-W291 AromaticContact CD2-CD1 3.9Å; F287-W291 AromaticContact CD2-NE1 3.81Å; F287-W291 AromaticContact CE1-CD1 3.66Å; F287-W291 HydrophobicContact CE1-CD2 4.38Å; F287-W291 AromaticContact CE1-CG 3.9Å; F287-W291 HydrophobicContact CE1-CG 3.9Å; F287-W291 AromaticContact CE2-CD1 3.7Å; F287-W291 AromaticContact CE2-NE1 3.3Å; F287-W291 VanDerWaalsContact CE2-NE1 3.3Å; F287-W291 AromaticContact CG-CD1 3.99Å; F287-W291 AromaticContact CZ-CD1 3.57Å; F287-W291 HydrophobicContact CZ-CD2 4.1Å; F287-W291 AromaticContact CZ-CE2 3.79Å; F287-W291 AromaticContact CZ-CG 4Å; F287-W291 HydrophobicContact CZ-CG 4Å; F287-W291 AromaticContact CZ-NE1 3.4Å; F287-W291 PolarHBondContact O-N 2.78Å; A288-W291 PolarHBondContact O-N 2.84Å; V289-W291 VanDerWaalsContact C-N 3.34Å; W291-L294 HydrophobicContact CE3-CD2 4.31Å; W291-L294 HydrophobicContact CZ3-CD2 3.96Å; W291-L294 PolarHBondContact O-N 3.36Å; W291-H295 PolarHBondContact O-CD2 3.32Å; W291-H295 VanDerWaalsContact O-CD2 3.26Å; W291-H295 PolarHBondContact O-N 3.33Å; W291-H295 VanDerWaalsContact O-N 3.09Å; W291-A324 HydrophobicContact CD2-CB 3.97Å; W291-A324 HydrophobicContact CE3-CB 4.16Å; W291-A324 HydrophobicContact CG-CB 4.4Å; W291-A324 HydrophobicContact CH2-CB 4.18Å; W291-A324 HydrophobicContact CZ2-CB 4.07Å; W291-A324 HydrophobicContact CZ3-CB 4.27Å; W291-A324 PolarHBondContact NE1-O 3.43Å; W291-S327 PolarHBondContact NE1-OG 2.93Å; W291-S327 VanDerWaalsContact NE1-OG 3.08Å |
| 292 | L | 91.3 | Very high | 87.4 | Confident | 81 Ų | 81 | 41.4 Ų | 41.4 | 42% | 0.424 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -53.5 | -47.8 | -178.2 | 177.2 | 67.2 | 0 | 0 | 0 | 112.8 | A288 L294 H295 V296 | A288-L292 VanDerWaalsContact O-CB 3.29Å; A288-L292 WeakPolarHBondContact O-CB 3.23Å; A288-L292 PolarHBondContact O-N 3.06Å; L292-L294 VanDerWaalsContact C-N 3.29Å; L292-L294 PolarHBondContact O-N 3.21Å; L292-H295 PolarHBondContact O-N 2.95Å; L292-V296 HydrophobicContact CD1-CG2 3.82Å; L292-V296 HydrophobicContact CG-CG2 4.15Å; L292-V296 WeakPolarHBondContact O-CB 3.29Å; L292-V296 VanDerWaalsContact O-CG2 3.3Å; L292-V296 WeakPolarHBondContact O-CG2 3.36Å; L292-V296 PolarHBondContact O-N 2.82Å |
| 293 | P | 92.9 | Very high | 87.4 | Confident | 43 Ų | 43 | 43.5 Ų | 43.5 | 28% | 0.279 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.4 | -35.3 | -177.8 | -29.3 | 42.8 | 0 | 0 | 0 | 113 | V289 F297 C320 L323 | V289-P293 WeakPolarHBondContact O-CD 3.38Å; P293-F297 VanDerWaalsContact O-CB 3.23Å; P293-F297 WeakPolarHBondContact O-CB 3.35Å; P293-F297 PolarHBondContact O-N 3.23Å; P293-C320 HydrophobicContact CB-CB 4.45Å; P293-L323 HydrophobicContact CB-CD2 4.37Å; P293-L323 HydrophobicContact CG-CD2 3.71Å |
| 294 | L | 91.1 | Very high | 87.3 | Confident | 19 Ų | 19 | 47 Ų | 47 | 10% | 0.099 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -69.1 | -41.8 | 176.2 | -174.6 | 63.8 | 0 | 0 | 0 | 111.7 | W291 L292 F297 N298 C320 H321 A324 | W291-L294 HydrophobicContact CE3-CD2 4.31Å; W291-L294 HydrophobicContact CZ3-CD2 3.96Å; W291-L294 PolarHBondContact O-N 3.36Å; L292-L294 VanDerWaalsContact C-N 3.29Å; L292-L294 PolarHBondContact O-N 3.21Å; L294-F297 PolarHBondContact O-N 2.01Å; L294-N298 WeakPolarHBondContact O-CB 3.38Å; L294-N298 VanDerWaalsContact O-CG 3.27Å; L294-N298 PolarHBondContact O-N 2.98Å; L294-N298 PolarHBondContact O-ND2 3.44Å; L294-C320 HydrophobicContact CB-CB 4.34Å; L294-C320 HydrophobicContact CD1-CB 4.18Å; L294-H321 HydrophobicContact CD1-CB 4.49Å; L294-A324 HydrophobicContact CB-CB 4.3Å; L294-A324 HydrophobicContact CD2-CB 3.83Å |
| 295 | H | 89.4 | Confident | 87 | Confident | 40 Ų | 40 | 51 Ų | 51 | 19% | 0.185 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.6 | -42.2 | 174.8 | -73.5 | -58.2 | 0 | 0 | 0 | 112.3 | L230 Y234 W291 L292 N298 L299 | L230-H295 HydrophobicContact CD1-CB 3.91Å; Y234-H295 AromaticContact CD2-CD2 3.71Å; Y234-H295 AromaticContact CD2-NE2 3.79Å; W291-H295 PolarHBondContact O-CD2 3.32Å; W291-H295 VanDerWaalsContact O-CD2 3.26Å; W291-H295 PolarHBondContact O-N 3.33Å; W291-H295 VanDerWaalsContact O-N 3.09Å; L292-H295 PolarHBondContact O-N 2.95Å; H295-N298 PolarHBondContact O-N 2.78Å; H295-L299 VanDerWaalsContact O-CB 3.3Å; H295-L299 WeakPolarHBondContact O-CB 3.21Å; H295-L299 PolarHBondContact O-N 2.92Å |
| 296 | V | 89.7 | Confident | 86.5 | Confident | 65 Ų | 65 | 58.3 Ų | 58.3 | 39% | 0.394 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.6 | -43.6 | 175.5 | 171.7 | 0 | 0 | 0 | 0 | 110.5 | L292 L299 L300 | L292-V296 HydrophobicContact CD1-CG2 3.82Å; L292-V296 HydrophobicContact CG-CG2 4.15Å; L292-V296 WeakPolarHBondContact O-CB 3.29Å; L292-V296 VanDerWaalsContact O-CG2 3.3Å; L292-V296 WeakPolarHBondContact O-CG2 3.36Å; L292-V296 PolarHBondContact O-N 2.82Å; V296-L299 PolarHBondContact O-N 2.84Å; V296-L300 HydrophobicContact CG1-CD1 3.87Å; V296-L300 HydrophobicContact CG1-CG 4.25Å; V296-L300 WeakPolarHBondContact O-CB 3.26Å; V296-L300 VanDerWaalsContact O-CG 3.32Å; V296-L300 WeakPolarHBondContact O-CG 3.18Å; V296-L300 PolarHBondContact O-N 3.21Å |
| 297 | F | 89.9 | Confident | 85.9 | Confident | 5 Ų | 5 | 59.2 Ų | 59.2 | 2% | 0.022 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -59.3 | -48.8 | 176 | 179.8 | -90.4 | 0 | 0 | 0 | 111.8 | P293 L294 L299 L300 R301 I308 F313 V316 Q317 | P293-F297 VanDerWaalsContact O-CB 3.23Å; P293-F297 WeakPolarHBondContact O-CB 3.35Å; P293-F297 PolarHBondContact O-N 3.23Å; L294-F297 PolarHBondContact O-N 2.01Å; F297-L299 VanDerWaalsContact C-N 3.29Å; F297-L299 PolarHBondContact O-N 2.77Å; F297-L300 PolarHBondContact O-N 3.27Å; F297-R301 WeakPolarHBondContact O-CB 3.34Å; F297-R301 PolarHBondContact O-N 3.1Å; F297-I308 HydrophobicContact CD2-CD1 3.59Å; F297-I308 HydrophobicContact CE2-CD1 3.47Å; F297-I308 VanDerWaalsContact CE2-CD1 3.47Å; F297-I308 HydrophobicContact CZ-CD1 4.29Å; F297-F313 HydrophobicContact CE1-CE2 4.37Å; F297-F313 HydrophobicContact CE1-CZ 4.08Å; F297-F313 HydrophobicContact CE2-CD2 4.31Å; F297-F313 HydrophobicContact CE2-CE2 4.21Å; F297-F313 HydrophobicContact CZ-CD1 4.35Å; F297-F313 AromaticContact CZ-CD2 3.99Å; F297-F313 HydrophobicContact CZ-CD2 3.99Å; F297-F313 AromaticContact CZ-CE1 3.97Å; F297-F313 HydrophobicContact CZ-CE1 3.97Å; F297-F313 AromaticContact CZ-CE2 3.58Å; F297-F313 HydrophobicContact CZ-CE2 3.58Å; F297-F313 HydrophobicContact CZ-CG 4.35Å; F297-F313 AromaticContact CZ-CZ 3.58Å; F297-F313 HydrophobicContact CZ-CZ 3.58Å; F297-V316 HydrophobicContact CD2-CG1 3.73Å; F297-V316 HydrophobicContact CE2-CB 4.24Å; F297-V316 HydrophobicContact CE2-CG1 3.88Å; F297-Q317 HydrophobicContact CD1-CG 4.35Å; F297-Q317 HydrophobicContact CE1-CB 3.73Å; F297-Q317 HydrophobicContact CE1-CG 3.67Å; F297-Q317 HydrophobicContact CE2-CB 4.17Å; F297-Q317 HydrophobicContact CZ-CB 3.54Å; F297-Q317 HydrophobicContact CZ-CG 4.02Å |
| 298 | N | 86.9 | Confident | 85.3 | Confident | 48 Ų | 48 | 59.6 Ų | 59.6 | 26% | 0.257 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.3 | -38.6 | 178 | -71.3 | -21.3 | 0 | 0 | 0 | 111.8 | L294 H295 D302 | L294-N298 WeakPolarHBondContact O-CB 3.38Å; L294-N298 VanDerWaalsContact O-CG 3.27Å; L294-N298 PolarHBondContact O-N 2.98Å; L294-N298 PolarHBondContact O-ND2 3.44Å; H295-N298 PolarHBondContact O-N 2.78Å; N298-D302 VanDerWaalsContact O-CG 3.27Å; N298-D302 PolarHBondContact O-N 3.24Å; N298-D302 VanDerWaalsContact O-N 3.13Å |
| 299 | L | 85.9 | Confident | 84.9 | Confident | 50 Ų | 50 | 63.5 Ų | 63.5 | 26% | 0.262 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.6 | -44.5 | 177 | -179.8 | 62 | 0 | 0 | 0 | 112.2 | W227 H295 V296 F297 R301 D302 L303 | W227-L299 HydrophobicContact CH2-CD1 3.36Å; W227-L299 HydrophobicContact CH2-CD2 4.14Å; W227-L299 HydrophobicContact CH2-CG 4.41Å; W227-L299 HydrophobicContact CZ2-CD1 3.26Å; W227-L299 HydrophobicContact CZ3-CD1 4.27Å; H295-L299 VanDerWaalsContact O-CB 3.3Å; H295-L299 WeakPolarHBondContact O-CB 3.21Å; H295-L299 PolarHBondContact O-N 2.92Å; V296-L299 PolarHBondContact O-N 2.84Å; F297-L299 VanDerWaalsContact C-N 3.29Å; F297-L299 PolarHBondContact O-N 2.77Å; L299-R301 VanDerWaalsContact C-N 3.35Å; L299-D302 PolarHBondContact O-N 3.31Å; L299-L303 HydrophobicContact CD1-CD1 3.69Å; L299-L303 HydrophobicContact CD1-CG 3.92Å; L299-L303 HydrophobicContact CD2-CD1 4.43Å; L299-L303 HydrophobicContact CG-CD1 3.83Å; L299-L303 HydrophobicContact CG-CG 4.35Å; L299-L303 WeakPolarHBondContact O-CB 3.04Å; L299-L303 WeakPolarHBondContact O-CG 3.25Å; L299-L303 PolarHBondContact O-N 2.92Å |
| 300 | L | 86.3 | Confident | 84.1 | Confident | 72 Ų | 72 | 63 Ų | 63 | 38% | 0.377 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 176.9 | -74.3 | 173.8 | 0 | 0 | 0 | 111.1 | V296 F297 D302 L303 D304 I308 | V296-L300 HydrophobicContact CG1-CD1 3.87Å; V296-L300 HydrophobicContact CG1-CG 4.25Å; V296-L300 WeakPolarHBondContact O-CB 3.26Å; V296-L300 VanDerWaalsContact O-CG 3.32Å; V296-L300 WeakPolarHBondContact O-CG 3.18Å; V296-L300 PolarHBondContact O-N 3.21Å; F297-L300 PolarHBondContact O-N 3.27Å; L300-D302 PolarHBondContact O-N 2.87Å; L300-L303 PolarHBondContact O-N 3.07Å; L300-D304 CarbonylContact O-C 3.21Å; L300-D304 PolarHBondContact O-N 3.38Å; L300-D304 VanDerWaalsContact O-O 3.1Å; L300-I308 HydrophobicContact CB-CD1 4.34Å |
| 301 | R | 83.1 | Confident | 83.3 | Confident | 86 Ų | 86 | 67.2 Ų | 67.2 | 33% | 0.325 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -55.8 | -38.1 | 173.6 | -177.4 | -173 | 67.9 | -172.2 | -0.6 | 112.1 | F297 L299 F313 | F297-R301 WeakPolarHBondContact O-CB 3.34Å; F297-R301 PolarHBondContact O-N 3.1Å; L299-R301 VanDerWaalsContact C-N 3.35Å; R301-F313 HydrophobicContact CG-CE2 4.42Å; R301-F313 HydrophobicContact CG-CZ 4.26Å |
| 302 | D | 78.5 | Confident | 82.9 | Confident | 29 Ų | 29 | 67.6 Ų | 67.6 | 16% | 0.155 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -81.2 | -31 | -178 | -73.5 | -15.5 | 0 | 0 | 0 | 113.8 | R222 N298 L299 L300 | R222-D302 IonicContact CZ-OD1 2.94Å; R222-D302 VanDerWaalsContact CZ-OD1 3.28Å; R222-D302 VanDerWaalsContact NH1-CG 3.29Å; R222-D302 IonicContact NH1-OD1 2.85Å; R222-D302 PolarHBondContact NH1-OD1 3.12Å; R222-D302 IonicContact NH1-OD2 3.33Å; R222-D302 PolarHBondContact NH1-OD2 3.11Å; R222-D302 IonicContact NH2-OD1 3.8Å; R222-D302 PolarHBondContact NH2-OD1 3.37Å; N298-D302 VanDerWaalsContact O-CG 3.27Å; N298-D302 PolarHBondContact O-N 3.24Å; N298-D302 VanDerWaalsContact O-N 3.13Å; L299-D302 PolarHBondContact O-N 3.31Å; L300-D302 PolarHBondContact O-N 2.87Å |
| 303 | L | 83 | Confident | 82.5 | Confident | 119 Ų | 119 | 66.6 Ų | 66.6 | 62% | 0.623 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -91.4 | -43.3 | -177.4 | -68.3 | 179.1 | 0 | 0 | 0 | 113.4 | L299 L300 | L299-L303 HydrophobicContact CD1-CD1 3.69Å; L299-L303 HydrophobicContact CD1-CG 3.92Å; L299-L303 HydrophobicContact CD2-CD1 4.43Å; L299-L303 HydrophobicContact CG-CD1 3.83Å; L299-L303 HydrophobicContact CG-CG 4.35Å; L299-L303 WeakPolarHBondContact O-CB 3.04Å; L299-L303 WeakPolarHBondContact O-CG 3.25Å; L299-L303 PolarHBondContact O-N 2.92Å; L300-L303 PolarHBondContact O-N 3.07Å |
| 304 | D | 80.6 | Confident | 82.1 | Confident | 75 Ų | 75 | 65.6 Ų | 65.6 | 40% | 0.401 | 34% | 0.343 | S | S | . | . | trans | -147 | 90.9 | 180 | -174.7 | 7.9 | 0 | 0 | 0 | 110.7 | L300 R306 A307 | L300-D304 CarbonylContact O-C 3.21Å; L300-D304 PolarHBondContact O-N 3.38Å; L300-D304 VanDerWaalsContact O-O 3.1Å; D304-R306 PolarHBondContact O-N 3.36Å; D304-R306 WeakPolarHBondContact OD1-CB 3.41Å; D304-R306 PolarHBondContact OD1-N 2.65Å; D304-A307 HydrophobicContact CB-CB 4.12Å; D304-A307 WeakPolarHBondContact O-CB 3.44Å; D304-A307 PolarHBondContact O-N 2.95Å | ||
| 305 | P | 73.4 | Confident | 81.9 | Confident | 93 Ų | 93 | 65.8 Ų | 65.8 | 60% | 0.604 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.6 | -16 | 176.5 | -23.6 | 32.1 | 0 | 0 | 0 | 114.4 | ||
| 306 | R | 75.8 | Confident | 81.9 | Confident | 226 Ų | 226 | 66.3 Ų | 66.3 | 85% | 0.853 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.2 | -10 | -178.6 | -50.4 | -179.4 | -160.7 | -178.7 | 5.7 | 113.1 | D304 I308 | D304-R306 PolarHBondContact O-N 3.36Å; D304-R306 WeakPolarHBondContact OD1-CB 3.41Å; D304-R306 PolarHBondContact OD1-N 2.65Å; R306-I308 PolarHBondContact O-N 3.37Å |
| 307 | A | 75.3 | Confident | 81.9 | Confident | 58 Ų | 58 | 66.9 Ų | 66.9 | 48% | 0.479 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -69.5 | -20 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | D304 | D304-A307 HydrophobicContact CB-CB 4.12Å; D304-A307 WeakPolarHBondContact O-CB 3.44Å; D304-A307 PolarHBondContact O-N 2.95Å |
| 308 | I | 75 | Confident | 81.9 | Confident | 23 Ų | 23 | 67.9 Ų | 67.9 | 12% | 0.118 | 35% | 0.354 | C | S | . | . | S | Bend | trans | -108.5 | 128.7 | -179.9 | -55.1 | 179.1 | 0 | 0 | 0 | 108.2 | F297 L300 R306 P310 F313 | F297-I308 HydrophobicContact CD2-CD1 3.59Å; F297-I308 HydrophobicContact CE2-CD1 3.47Å; F297-I308 VanDerWaalsContact CE2-CD1 3.47Å; F297-I308 HydrophobicContact CZ-CD1 4.29Å; L300-I308 HydrophobicContact CB-CD1 4.34Å; R306-I308 PolarHBondContact O-N 3.37Å; I308-P310 WeakPolarHBondContact O-CD 3.25Å; I308-P310 VanDerWaalsContact O-N 3.14Å; I308-F313 HydrophobicContact CB-CD2 4.18Å; I308-F313 HydrophobicContact CD1-CD2 4.44Å; I308-F313 HydrophobicContact CD1-CE2 4.45Å; I308-F313 HydrophobicContact CG2-CB 4.3Å; I308-F313 HydrophobicContact CG2-CD2 3.92Å |
| 309 | D | 77.9 | Confident | 82.2 | Confident | 91 Ų | 91 | 69 Ų | 69 | 49% | 0.487 | 36% | 0.359 | S | S | . | . | trans | -54.3 | 120.3 | 174.9 | -174 | -16.9 | 0 | 0 | 0 | 109.5 | Y311 A312 F313 | D309-Y311 PolarHBondContact O-N 3.44Å; D309-Y311 VanDerWaalsContact OD1-CB 3.26Å; D309-Y311 WeakPolarHBondContact OD1-CB 3.37Å; D309-Y311 PolarHBondContact OD1-N 3.04Å; D309-A312 HydrophobicContact CB-CB 4.33Å; D309-A312 PolarHBondContact O-N 3.34Å; D309-F313 PolarHBondContact O-N 3.39Å | ||
| 310 | P | 75.4 | Confident | 82.6 | Confident | 79 Ų | 79 | 67.3 Ų | 67.3 | 51% | 0.513 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.4 | -29.4 | 177.1 | -26.6 | 34.5 | 0 | 0 | 0 | 112.9 | V47 S52 I308 | V47-P310 HydrophobicContact CB-CB 4.44Å; V47-P310 HydrophobicContact CG1-CB 4.13Å; S52-P310 WeakPolarHBondContact CB-O 3.21Å; I308-P310 WeakPolarHBondContact O-CD 3.25Å; I308-P310 VanDerWaalsContact O-N 3.14Å |
| 311 | Y | 76.4 | Confident | 82.9 | Confident | 92 Ų | 92 | 65 Ų | 65 | 36% | 0.361 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | -39.4 | 176.5 | -176.7 | -106.9 | 0 | 0 | 0 | 113 | Q51 S52 L55 D309 | Q51-Y311 HydrophobicContact CB-CD2 3.69Å; Q51-Y311 HydrophobicContact CB-CE2 3.87Å; Q51-Y311 VanDerWaalsContact O-CE2 3.28Å; Q51-Y311 WeakPolarHBondContact O-CE2 3.31Å; S52-Y311 WeakPolarHBondContact CA-O 3.16Å; S52-Y311 VanDerWaalsContact CB-O 3.23Å; S52-Y311 WeakPolarHBondContact CB-O 3.17Å; L55-Y311 HydrophobicContact CB-CE1 4.37Å; L55-Y311 HydrophobicContact CD1-CE1 4.26Å; L55-Y311 HydrophobicContact CD2-CD1 4.18Å; L55-Y311 HydrophobicContact CD2-CE1 3.77Å; L55-Y311 HydrophobicContact CG-CE1 4.36Å; D309-Y311 PolarHBondContact O-N 3.44Å; D309-Y311 VanDerWaalsContact OD1-CB 3.26Å; D309-Y311 WeakPolarHBondContact OD1-CB 3.37Å; D309-Y311 PolarHBondContact OD1-N 3.04Å |
| 312 | A | 82.2 | Confident | 83.5 | Confident | 25 Ų | 25 | 63.8 Ų | 63.8 | 21% | 0.207 | 33% | 0.334 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.9 | -12.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | D309 G314 L315 V316 | D309-A312 HydrophobicContact CB-CB 4.33Å; D309-A312 PolarHBondContact O-N 3.34Å; A312-G314 PolarHBondContact O-N 3.11Å; A312-L315 PolarHBondContact O-N 3.28Å; A312-L315 VanDerWaalsContact O-N 3.13Å; A312-V316 HydrophobicContact CB-CG2 4.08Å; A312-V316 WeakPolarHBondContact O-CG2 3.43Å; A312-V316 PolarHBondContact O-N 3.38Å |
| 313 | F | 84.5 | Confident | 84.3 | Confident | 61 Ų | 61 | 64.7 Ų | 64.7 | 27% | 0.268 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -48.5 | -55.3 | -170.1 | -174.2 | -88.2 | 0 | 0 | 0 | 114.1 | F297 R301 I308 D309 L315 V316 Q317 | F297-F313 HydrophobicContact CE1-CE2 4.37Å; F297-F313 HydrophobicContact CE1-CZ 4.08Å; F297-F313 HydrophobicContact CE2-CD2 4.31Å; F297-F313 HydrophobicContact CE2-CE2 4.21Å; F297-F313 HydrophobicContact CZ-CD1 4.35Å; F297-F313 AromaticContact CZ-CD2 3.99Å; F297-F313 HydrophobicContact CZ-CD2 3.99Å; F297-F313 AromaticContact CZ-CE1 3.97Å; F297-F313 HydrophobicContact CZ-CE1 3.97Å; F297-F313 AromaticContact CZ-CE2 3.58Å; F297-F313 HydrophobicContact CZ-CE2 3.58Å; F297-F313 HydrophobicContact CZ-CG 4.35Å; F297-F313 AromaticContact CZ-CZ 3.58Å; F297-F313 HydrophobicContact CZ-CZ 3.58Å; R301-F313 HydrophobicContact CG-CE2 4.42Å; R301-F313 HydrophobicContact CG-CZ 4.26Å; I308-F313 HydrophobicContact CB-CD2 4.18Å; I308-F313 HydrophobicContact CD1-CD2 4.44Å; I308-F313 HydrophobicContact CD1-CE2 4.45Å; I308-F313 HydrophobicContact CG2-CB 4.3Å; I308-F313 HydrophobicContact CG2-CD2 3.92Å; D309-F313 PolarHBondContact O-N 3.39Å; F313-L315 PolarHBondContact O-N 3.29Å; F313-V316 PolarHBondContact O-N 3.29Å; F313-Q317 WeakPolarHBondContact O-CB 3.32Å; F313-Q317 PolarHBondContact O-N 3.23Å |
| 314 | G | 83.1 | Confident | 84.8 | Confident | 21 Ų | 21 | 59 Ų | 59 | 22% | 0.216 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.4 | -37.7 | -178 | 0 | 0 | 0 | 0 | 0 | 113.3 | A312 L318 | A312-G314 PolarHBondContact O-N 3.11Å; G314-L318 WeakPolarHBondContact O-CB 3.49Å; G314-L318 WeakPolarHBondContact O-CG 3.33Å; G314-L318 PolarHBondContact O-N 3.42Å |
| 315 | L | 87.4 | Confident | 85.4 | Confident | 23 Ų | 23 | 55.5 Ų | 55.5 | 12% | 0.12 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66.7 | -47.6 | 176.1 | 177.8 | 65.2 | 0 | 0 | 0 | 111.1 | L55 V56 L59 I63 A312 F313 Q317 L318 L319 | L55-L315 HydrophobicContact CD2-CB 4.17Å; L55-L315 HydrophobicContact CD2-CD2 3.56Å; L55-L315 HydrophobicContact CG-CD2 3.98Å; V56-L315 HydrophobicContact CG2-CB 4.12Å; L59-L315 HydrophobicContact CD1-CD1 3.81Å; L59-L315 HydrophobicContact CD1-CD2 3.66Å; L59-L315 HydrophobicContact CD1-CG 4.41Å; I63-L315 HydrophobicContact CD1-CD1 3.99Å; A312-L315 PolarHBondContact O-N 3.28Å; A312-L315 VanDerWaalsContact O-N 3.13Å; F313-L315 PolarHBondContact O-N 3.29Å; L315-Q317 VanDerWaalsContact C-N 3.32Å; L315-Q317 PolarHBondContact O-N 3.45Å; L315-L318 PolarHBondContact O-N 3.13Å; L315-L319 HydrophobicContact CD1-CD1 4.08Å; L315-L319 HydrophobicContact CD1-CG 4.13Å; L315-L319 HydrophobicContact CD2-CD1 4.5Å; L315-L319 HydrophobicContact CG-CD1 3.93Å; L315-L319 HydrophobicContact CG-CG 4.36Å; L315-L319 WeakPolarHBondContact O-CB 3.38Å; L315-L319 VanDerWaalsContact O-CG 3.3Å; L315-L319 WeakPolarHBondContact O-CG 3.35Å; L315-L319 PolarHBondContact O-N 2.88Å |
| 316 | V | 89.9 | Confident | 86.4 | Confident | 52 Ų | 52 | 51.2 Ų | 51.2 | 32% | 0.315 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.5 | -44.6 | 178.9 | 174.2 | 0 | 0 | 0 | 0 | 110.1 | F297 A312 F313 L318 L319 C320 | F297-V316 HydrophobicContact CD2-CG1 3.73Å; F297-V316 HydrophobicContact CE2-CB 4.24Å; F297-V316 HydrophobicContact CE2-CG1 3.88Å; A312-V316 HydrophobicContact CB-CG2 4.08Å; A312-V316 WeakPolarHBondContact O-CG2 3.43Å; A312-V316 PolarHBondContact O-N 3.38Å; F313-V316 PolarHBondContact O-N 3.29Å; V316-L318 PolarHBondContact O-N 3.4Å; V316-L319 PolarHBondContact O-N 2.86Å; V316-C320 WeakPolarHBondContact O-CB 3.04Å; V316-C320 PolarHBondContact O-N 2.94Å; V316-C320 PolarHBondContact O-SG 2.85Å |
| 317 | Q | 89.6 | Confident | 87.2 | Confident | 76 Ų | 76 | 40.6 Ų | 40.6 | 36% | 0.355 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -57.4 | -48.1 | 175.1 | -172.8 | 176.2 | -16.4 | 0 | 0 | 111.8 | F297 F313 L315 L319 C320 H321 | F297-Q317 HydrophobicContact CD1-CG 4.35Å; F297-Q317 HydrophobicContact CE1-CB 3.73Å; F297-Q317 HydrophobicContact CE1-CG 3.67Å; F297-Q317 HydrophobicContact CE2-CB 4.17Å; F297-Q317 HydrophobicContact CZ-CB 3.54Å; F297-Q317 HydrophobicContact CZ-CG 4.02Å; F313-Q317 WeakPolarHBondContact O-CB 3.32Å; F313-Q317 PolarHBondContact O-N 3.23Å; L315-Q317 VanDerWaalsContact C-N 3.32Å; L315-Q317 PolarHBondContact O-N 3.45Å; Q317-L319 VanDerWaalsContact C-N 3.34Å; Q317-L319 PolarHBondContact O-N 2.93Å; Q317-C320 PolarHBondContact O-N 2.94Å; Q317-H321 VanDerWaalsContact O-CB 3.23Å; Q317-H321 WeakPolarHBondContact O-CB 3.16Å; Q317-H321 PolarHBondContact O-N 3.43Å |
| 318 | L | 90.6 | Very high | 88 | Confident | 26 Ų | 26 | 37.9 Ų | 37.9 | 14% | 0.136 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -64.1 | -36.9 | 179.5 | -81.9 | 170.3 | 0 | 0 | 0 | 112.9 | V56 I63 Y67 A121 G314 L315 V316 W322 | V56-L318 HydrophobicContact CG1-CD1 3.52Å; V56-L318 HydrophobicContact CG2-CD1 4.13Å; I63-L318 HydrophobicContact CD1-CD1 4.43Å; Y67-L318 PolarHBondContact OH-O 3.37Å; A121-L318 HydrophobicContact CB-CD2 3.97Å; G314-L318 WeakPolarHBondContact O-CB 3.49Å; G314-L318 WeakPolarHBondContact O-CG 3.33Å; G314-L318 PolarHBondContact O-N 3.42Å; L315-L318 PolarHBondContact O-N 3.13Å; V316-L318 PolarHBondContact O-N 3.4Å; L318-W322 VanDerWaalsContact O-CB 3.25Å; L318-W322 WeakPolarHBondContact O-CB 3.25Å; L318-W322 PolarHBondContact O-N 3.31Å |
| 319 | L | 92.5 | Very high | 88.8 | Confident | 71 Ų | 71 | 37.2 Ų | 37.2 | 37% | 0.372 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -72.7 | -41.9 | 177 | -69.6 | 176.1 | 0 | 0 | 0 | 111.9 | L315 V316 Q317 H321 W322 L323 | L315-L319 HydrophobicContact CD1-CD1 4.08Å; L315-L319 HydrophobicContact CD1-CG 4.13Å; L315-L319 HydrophobicContact CD2-CD1 4.5Å; L315-L319 HydrophobicContact CG-CD1 3.93Å; L315-L319 HydrophobicContact CG-CG 4.36Å; L315-L319 WeakPolarHBondContact O-CB 3.38Å; L315-L319 VanDerWaalsContact O-CG 3.3Å; L315-L319 WeakPolarHBondContact O-CG 3.35Å; L315-L319 PolarHBondContact O-N 2.88Å; V316-L319 PolarHBondContact O-N 2.86Å; Q317-L319 VanDerWaalsContact C-N 3.34Å; Q317-L319 PolarHBondContact O-N 2.93Å; L319-H321 VanDerWaalsContact C-N 3.34Å; L319-W322 WeakPolarHBondContact O-CB 3.37Å; L319-W322 PolarHBondContact O-N 3.15Å; L319-L323 WeakPolarHBondContact O-CB 3.43Å; L319-L323 PolarHBondContact O-N 3.49Å |
| 320 | C | 94.1 | Very high | 89.4 | Confident | 16 Ų | 16 | 36.8 Ų | 36.8 | 11% | 0.108 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.4 | -44.2 | 172.7 | -71.8 | 0 | 0 | 0 | 0 | 111.1 | P293 L294 V316 Q317 L323 A324 | P293-C320 HydrophobicContact CB-CB 4.45Å; L294-C320 HydrophobicContact CB-CB 4.34Å; L294-C320 HydrophobicContact CD1-CB 4.18Å; V316-C320 WeakPolarHBondContact O-CB 3.04Å; V316-C320 PolarHBondContact O-N 2.94Å; V316-C320 PolarHBondContact O-SG 2.85Å; Q317-C320 PolarHBondContact O-N 2.94Å; C320-L323 PolarHBondContact O-N 3.26Å; C320-A324 PolarHBondContact O-N 2.67Å |
| 321 | H | 93 | Very high | 90 | Very high | 22 Ų | 22 | 33.2 Ų | 33.2 | 10% | 0.102 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -63.4 | -43.9 | 175.1 | 180 | -91.3 | 0 | 0 | 0 | 111.6 | Y67 Q141 L294 Q317 L319 L323 A324 M325 | Y67-H321 AromaticContact CE1-ND1 3.77Å; Y67-H321 AromaticContact CZ-ND1 3.73Å; Y67-H321 PolarHBondContact OH-ND1 3.2Å; Q141-H321 PolarHBondContact NE2-NE2 3.21Å; L294-H321 HydrophobicContact CD1-CB 4.49Å; Q317-H321 VanDerWaalsContact O-CB 3.23Å; Q317-H321 WeakPolarHBondContact O-CB 3.16Å; Q317-H321 PolarHBondContact O-N 3.43Å; L319-H321 VanDerWaalsContact C-N 3.34Å; H321-L323 VanDerWaalsContact C-N 3.34Å; H321-L323 PolarHBondContact O-N 3.19Å; H321-A324 WeakPolarHBondContact O-CB 3.22Å; H321-A324 PolarHBondContact O-N 2.91Å; H321-M325 WeakPolarHBondContact NE2-CE 3.44Å; H321-M325 VanDerWaalsContact O-CG 3.31Å; H321-M325 WeakPolarHBondContact O-CG 3.35Å; H321-M325 PolarHBondContact O-N 2.88Å |
| 322 | W | 94.6 | Very high | 90.5 | Very high | 61 Ų | 61 | 29.5 Ų | 29.5 | 23% | 0.231 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -57.6 | -47.8 | 175.9 | 169.4 | 72.7 | 0 | 0 | 0 | 111.7 | L66 Y67 L318 L319 A324 M325 S326 | L66-W322 HydrophobicContact CB-CZ2 4.37Å; L66-W322 HydrophobicContact CD2-CH2 4.45Å; L66-W322 HydrophobicContact CD2-CZ2 3.85Å; L66-W322 HydrophobicContact CG-CZ2 4.5Å; L66-W322 PolarHBondContact O-NE1 3.02Å; L66-W322 VanDerWaalsContact O-NE1 3.17Å; Y67-W322 HydrophobicContact CD2-CB 4.27Å; Y67-W322 AromaticContact CD2-CD1 3.69Å; Y67-W322 HydrophobicContact CD2-CG 4.29Å; Y67-W322 HydrophobicContact CE2-CB 3.52Å; Y67-W322 AromaticContact CE2-CD1 3.83Å; Y67-W322 HydrophobicContact CE2-CG 4Å; Y67-W322 WeakPolarHBondContact OH-CA 3.41Å; Y67-W322 PolarHBondContact OH-N 3.02Å; L318-W322 VanDerWaalsContact O-CB 3.25Å; L318-W322 WeakPolarHBondContact O-CB 3.25Å; L318-W322 PolarHBondContact O-N 3.31Å; L319-W322 WeakPolarHBondContact O-CB 3.37Å; L319-W322 PolarHBondContact O-N 3.15Å; W322-A324 VanDerWaalsContact C-N 3.31Å; W322-A324 PolarHBondContact O-N 3.38Å; W322-M325 PolarHBondContact O-N 2.8Å; W322-S326 PolarHBondContact O-N 3.42Å |
| 323 | L | 95.5 | Very high | 90.6 | Very high | 49 Ų | 49 | 34.4 Ų | 34.4 | 26% | 0.257 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -62.3 | -41.7 | 179.9 | -176.7 | 64.4 | 0 | 0 | 0 | 110.9 | C290 P293 L319 C320 H321 M325 S326 | C290-L323 WeakPolarHBondContact CB-O 3.42Å; C290-L323 CarbonylContact O-C 3.58Å; P293-L323 HydrophobicContact CB-CD2 4.37Å; P293-L323 HydrophobicContact CG-CD2 3.71Å; L319-L323 WeakPolarHBondContact O-CB 3.43Å; L319-L323 PolarHBondContact O-N 3.49Å; C320-L323 PolarHBondContact O-N 3.26Å; H321-L323 VanDerWaalsContact C-N 3.34Å; H321-L323 PolarHBondContact O-N 3.19Å; L323-M325 PolarHBondContact O-N 2.8Å; L323-S326 WeakPolarHBondContact O-CB 3.23Å; L323-S326 PolarHBondContact O-N 2.86Å; L323-S326 PolarHBondContact O-OG 3.2Å |
| 324 | A | 93.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.1 | -46.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | C290 W291 L294 C320 H321 W322 S326 S327 | C290-A324 WeakPolarHBondContact O-CA 3.45Å; C290-A324 PolarHBondContact O-N 2.87Å; W291-A324 HydrophobicContact CD2-CB 3.97Å; W291-A324 HydrophobicContact CE3-CB 4.16Å; W291-A324 HydrophobicContact CG-CB 4.4Å; W291-A324 HydrophobicContact CH2-CB 4.18Å; W291-A324 HydrophobicContact CZ2-CB 4.07Å; W291-A324 HydrophobicContact CZ3-CB 4.27Å; W291-A324 PolarHBondContact NE1-O 3.43Å; L294-A324 HydrophobicContact CB-CB 4.3Å; L294-A324 HydrophobicContact CD2-CB 3.83Å; C320-A324 PolarHBondContact O-N 2.67Å; H321-A324 WeakPolarHBondContact O-CB 3.22Å; H321-A324 PolarHBondContact O-N 2.91Å; W322-A324 VanDerWaalsContact C-N 3.31Å; W322-A324 PolarHBondContact O-N 3.38Å; A324-S326 VanDerWaalsContact C-N 3.29Å; A324-S326 PolarHBondContact O-N 3.47Å; A324-S327 VanDerWaalsContact O-CB 3.3Å; A324-S327 WeakPolarHBondContact O-CB 3.48Å; A324-S327 PolarHBondContact O-N 2.85Å; A324-S327 VanDerWaalsContact O-N 3.16Å; A324-S327 PolarHBondContact O-OG 3.42Å |
| 325 | M | 93.4 | Very high | 90.2 | Very high | 1 Ų | 1 | 32.2 Ų | 32.2 | 1% | 0.005 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65.8 | -29.7 | 177.9 | -64.9 | -56.8 | 159.8 | 0 | 0 | 113.3 | V70 M109 V114 Q141 H321 W322 L323 S327 A328 | V70-M325 HydrophobicContact CG1-CB 4.25Å; M109-M325 HydrophobicContact CG-SD 3.9Å; M109-M325 HydrophobicContact SD-SD 3.5Å; V114-M325 HydrophobicContact CG2-CB 4.17Å; V114-M325 HydrophobicContact CG2-CG 3.98Å; V114-M325 HydrophobicContact CG2-SD 3.84Å; Q141-M325 HydrophobicContact CG-CE 4.01Å; H321-M325 WeakPolarHBondContact NE2-CE 3.44Å; H321-M325 VanDerWaalsContact O-CG 3.31Å; H321-M325 WeakPolarHBondContact O-CG 3.35Å; H321-M325 PolarHBondContact O-N 2.88Å; W322-M325 PolarHBondContact O-N 2.8Å; L323-M325 PolarHBondContact O-N 2.8Å; M325-S327 PolarHBondContact O-N 3.19Å; M325-S327 VanDerWaalsContact O-N 3.08Å; M325-A328 PolarHBondContact O-N 2.9Å |
| 326 | S | 94.5 | Very high | 89.7 | Confident | 3 Ų | 3 | 32.2 Ų | 32.2 | 2% | 0.021 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.5 | -17.8 | 176 | 81.7 | 0 | 0 | 0 | 0 | 112.9 | W322 L323 A324 A328 C329 Y330 | W322-S326 PolarHBondContact O-N 3.42Å; L323-S326 WeakPolarHBondContact O-CB 3.23Å; L323-S326 PolarHBondContact O-N 2.86Å; L323-S326 PolarHBondContact O-OG 3.2Å; A324-S326 VanDerWaalsContact C-N 3.29Å; A324-S326 PolarHBondContact O-N 3.47Å; S326-A328 PolarHBondContact O-N 2.9Å; S326-A328 VanDerWaalsContact O-N 3.15Å; S326-C329 VanDerWaalsContact O-CB 3.3Å; S326-C329 WeakPolarHBondContact O-CB 3.46Å; S326-C329 PolarHBondContact O-N 3.05Å; S326-Y330 VanDerWaalsContact O-CD2 3.29Å; S326-Y330 WeakPolarHBondContact O-CD2 3.3Å; S326-Y330 WeakPolarHBondContact O-CE2 3.38Å; S326-Y330 WeakPolarHBondContact OG-CE2 3.3Å; S326-Y330 PolarHBondContact OG-OH 3.41Å |
| 327 | S | 92.3 | Very high | 88.7 | Confident | 3 Ų | 3 | 38.7 Ų | 38.7 | 2% | 0.021 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -55.6 | -34.1 | 177.9 | 71.4 | 0 | 0 | 0 | 0 | 113.1 | W291 A324 M325 C329 Y330 | W291-S327 PolarHBondContact NE1-OG 2.93Å; W291-S327 VanDerWaalsContact NE1-OG 3.08Å; A324-S327 VanDerWaalsContact O-CB 3.3Å; A324-S327 WeakPolarHBondContact O-CB 3.48Å; A324-S327 PolarHBondContact O-N 2.85Å; A324-S327 VanDerWaalsContact O-N 3.16Å; A324-S327 PolarHBondContact O-OG 3.42Å; M325-S327 PolarHBondContact O-N 3.19Å; M325-S327 VanDerWaalsContact O-N 3.08Å; S327-C329 PolarHBondContact O-N 3.03Å; S327-Y330 PolarHBondContact O-N 2.94Å |
| 328 | A | 92 | Very high | 87.1 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.2 | -24.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | N78 D106 M325 S326 | N78-A328 PolarHBondContact ND2-O 3Å; D106-A328 HydrophobicContact CB-CB 3.98Å; M325-A328 PolarHBondContact O-N 2.9Å; S326-A328 PolarHBondContact O-N 2.9Å; S326-A328 VanDerWaalsContact O-N 3.15Å |
| 329 | C | 93.3 | Very high | 85.9 | Confident | 10 Ų | 10 | 38.6 Ų | 38.6 | 7% | 0.068 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -77.7 | -33.4 | -178.1 | -65 | 0 | 0 | 0 | 0 | 112.6 | V70 V73 S326 S327 F333 | V70-C329 VanDerWaalsContact CA-SG 3.59Å; V70-C329 PolarHBondContact O-SG 3.39Å; V70-C329 VanDerWaalsContact O-SG 3.4Å; V73-C329 HydrophobicContact CB-CB 4.4Å; V73-C329 HydrophobicContact CG1-CB 3.75Å; S326-C329 VanDerWaalsContact O-CB 3.3Å; S326-C329 WeakPolarHBondContact O-CB 3.46Å; S326-C329 PolarHBondContact O-N 3.05Å; S327-C329 PolarHBondContact O-N 3.03Å; C329-F333 WeakPolarHBondContact O-CD2 3.42Å; C329-F333 WeakPolarHBondContact O-CE2 3.4Å |
| 330 | Y | 90.4 | Very high | 84.6 | Confident | 82 Ų | 82 | 39.5 Ų | 39.5 | 32% | 0.322 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -75 | -28.4 | -172.9 | -51.4 | -62.8 | 0 | 0 | 0 | 112.6 | V286 C290 S326 S327 F333 I334 | V286-Y330 HydrophobicContact CG1-CD2 3.34Å; V286-Y330 HydrophobicContact CG1-CE2 4.11Å; V286-Y330 HydrophobicContact CG1-CG 3.68Å; C290-Y330 WeakPolarHBondContact SG-CE2 3.44Å; S326-Y330 VanDerWaalsContact O-CD2 3.29Å; S326-Y330 WeakPolarHBondContact O-CD2 3.3Å; S326-Y330 WeakPolarHBondContact O-CE2 3.38Å; S326-Y330 WeakPolarHBondContact OG-CE2 3.3Å; S326-Y330 PolarHBondContact OG-OH 3.41Å; S327-Y330 PolarHBondContact O-N 2.94Å; Y330-F333 PolarHBondContact O-N 3.16Å; Y330-I334 VanDerWaalsContact O-CG1 3.26Å; Y330-I334 WeakPolarHBondContact O-CG1 3.28Å; Y330-I334 PolarHBondContact O-N 3.28Å |
| 331 | N | 87.1 | Confident | 83.2 | Confident | 4 Ų | 4 | 40.3 Ų | 40.3 | 2% | 0.021 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -52.4 | -58.7 | -176.7 | -72 | -18.4 | 0 | 0 | 0 | 111.9 | D106 V283 F333 I334 Y335 | D106-N331 PolarHBondContact OD2-ND2 2.89Å; V283-N331 WeakPolarHBondContact CG1-OD1 3.4Å; N331-F333 VanDerWaalsContact C-N 3.35Å; N331-F333 PolarHBondContact O-N 3.18Å; N331-I334 PolarHBondContact O-N 2.91Å; N331-Y335 HydrophobicContact CB-CD2 4.47Å; N331-Y335 HydrophobicContact CB-CE2 4.15Å; N331-Y335 WeakPolarHBondContact O-CD2 3.23Å; N331-Y335 PolarHBondContact O-N 3.33Å |
| 332 | P | 86 | Confident | 81.9 | Confident | 13 Ų | 13 | 40 Ų | 40 | 8% | 0.084 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -54.4 | -42.5 | 177 | -28.2 | 34.1 | 0 | 0 | 0 | 114.8 | N78 Y335 A336 | N78-P332 HydrophobicContact CB-CG 4.44Å; N78-P332 WeakPolarHBondContact OD1-CG 3.38Å; P332-Y335 PolarHBondContact O-N 3.05Å; P332-A336 WeakPolarHBondContact O-CB 3.15Å; P332-A336 PolarHBondContact O-N 2.84Å |
| 333 | F | 85 | Confident | 80.8 | Confident | 128 Ų | 128 | 43.7 Ų | 43.7 | 56% | 0.561 | 20% | 0.201 | S | C | * | . | H | α-helix | trans | -67.4 | -41.4 | -179.6 | -64.3 | -72.9 | 0 | 0 | 0 | 112 | V73 C329 Y330 N331 Y335 A336 W337 | V73-F333 HydrophobicContact CG1-CE2 3.44Å; V73-F333 VanDerWaalsContact CG1-CE2 3.44Å; V73-F333 HydrophobicContact CG1-CZ 3.78Å; C329-F333 WeakPolarHBondContact O-CD2 3.42Å; C329-F333 WeakPolarHBondContact O-CE2 3.4Å; Y330-F333 PolarHBondContact O-N 3.16Å; N331-F333 VanDerWaalsContact C-N 3.35Å; N331-F333 PolarHBondContact O-N 3.18Å; F333-Y335 VanDerWaalsContact C-N 3.35Å; F333-A336 PolarHBondContact O-N 2.94Å; F333-W337 VanDerWaalsContact O-CB 3.29Å; F333-W337 WeakPolarHBondContact O-CB 3.23Å; F333-W337 PolarHBondContact O-N 3.13Å |
| 334 | I | 82.4 | Confident | 79.8 | Confident | 23 Ų | 23 | 46 Ų | 46 | 12% | 0.118 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.5 | -43.3 | 179 | -65 | 165.3 | 0 | 0 | 0 | 110 | L279 V282 V283 V286 Y330 N331 L338 | L279-I334 HydrophobicContact CD1-CG2 3.65Å; L279-I334 WeakPolarHBondContact CD1-O 3.31Å; L279-I334 HydrophobicContact CD2-CG2 4.34Å; L279-I334 HydrophobicContact CG-CG2 3.63Å; V282-I334 HydrophobicContact CG1-CD1 4.46Å; V283-I334 HydrophobicContact CG2-CB 4.06Å; V283-I334 HydrophobicContact CG2-CD1 3.94Å; V283-I334 HydrophobicContact CG2-CG2 3.39Å; V286-I334 HydrophobicContact CG2-CD1 4.33Å; Y330-I334 VanDerWaalsContact O-CG1 3.26Å; Y330-I334 WeakPolarHBondContact O-CG1 3.28Å; Y330-I334 PolarHBondContact O-N 3.28Å; N331-I334 PolarHBondContact O-N 2.91Å; I334-L338 PolarHBondContact O-N 3.28Å |
| 335 | Y | 77.9 | Confident | 78.8 | Confident | 13 Ų | 13 | 47.2 Ų | 47.2 | 5% | 0.051 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -68.2 | -40 | 175.8 | -66.4 | -60.1 | 0 | 0 | 0 | 112.6 | L81 I99 L102 L279 N331 P332 F333 H339 | L81-Y335 HydrophobicContact CD2-CD2 3.7Å; L81-Y335 HydrophobicContact CD2-CE2 4.33Å; L81-Y335 HydrophobicContact CD2-CG 4.45Å; I99-Y335 HydrophobicContact CD1-CD1 3.83Å; I99-Y335 HydrophobicContact CD1-CE1 3.45Å; I99-Y335 VanDerWaalsContact CD1-CE1 3.45Å; I99-Y335 HydrophobicContact CG1-CD1 4.44Å; I99-Y335 HydrophobicContact CG1-CE1 3.75Å; I99-Y335 HydrophobicContact CG1-CE2 4.46Å; I99-Y335 HydrophobicContact CG2-CD1 4.46Å; I99-Y335 HydrophobicContact CG2-CD2 4.03Å; I99-Y335 HydrophobicContact CG2-CE1 4.32Å; I99-Y335 HydrophobicContact CG2-CE2 3.89Å; I99-Y335 HydrophobicContact CG2-CG 4.34Å; L102-Y335 HydrophobicContact CD2-CE2 4.23Å; L279-Y335 HydrophobicContact CD2-CD1 4.35Å; L279-Y335 HydrophobicContact CD2-CE1 4.05Å; N331-Y335 HydrophobicContact CB-CD2 4.47Å; N331-Y335 HydrophobicContact CB-CE2 4.15Å; N331-Y335 WeakPolarHBondContact O-CD2 3.23Å; N331-Y335 PolarHBondContact O-N 3.33Å; P332-Y335 PolarHBondContact O-N 3.05Å; F333-Y335 VanDerWaalsContact C-N 3.35Å; Y335-H339 PolarHBondContact O-N 3.17Å; Y335-H339 VanDerWaalsContact O-N 3.14Å |
| 336 | A | 76 | Confident | 77.9 | Confident | 23 Ų | 23 | 49 Ų | 49 | 19% | 0.19 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.6 | -38.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | P332 F333 L338 F342 R343 | P332-A336 WeakPolarHBondContact O-CB 3.15Å; P332-A336 PolarHBondContact O-N 2.84Å; F333-A336 PolarHBondContact O-N 2.94Å; A336-L338 VanDerWaalsContact C-N 3.29Å; A336-L338 PolarHBondContact O-N 3.4Å; A336-F342 HydrophobicContact CB-CD1 4.01Å; A336-F342 HydrophobicContact CB-CE1 3.96Å; A336-R343 WeakPolarHBondContact O-CD 3.37Å; A336-R343 WeakPolarHBondContact O-CG 3.32Å |
| 337 | W | 69.6 | Low | 77.1 | Confident | 189 Ų | 189 | 57.5 Ų | 57.5 | 72% | 0.716 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -69.5 | -26.9 | -178.9 | -176.7 | 42.4 | 0 | 0 | 0 | 113.1 | F333 | F333-W337 VanDerWaalsContact O-CB 3.29Å; F333-W337 WeakPolarHBondContact O-CB 3.23Å; F333-W337 PolarHBondContact O-N 3.13Å |
| 338 | L | 56.1 | Low | 76.4 | Confident | 29 Ų | 29 | 62.6 Ų | 62.6 | 15% | 0.152 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -109.9 | -26.5 | -168.6 | -156.1 | 106.9 | 0 | 0 | 0 | 115.7 | R275 L279 I334 A336 D340 | R275-L338 HydrophobicContact CG-CD1 3.82Å; R275-L338 HydrophobicContact CG-CD2 4.25Å; R275-L338 HydrophobicContact CG-CG 4.32Å; L279-L338 HydrophobicContact CB-CD1 4.25Å; L279-L338 HydrophobicContact CB-CD2 3.66Å; L279-L338 HydrophobicContact CB-CG 4.41Å; L279-L338 HydrophobicContact CD1-CB 3.23Å; L279-L338 HydrophobicContact CD1-CD1 4.07Å; L279-L338 HydrophobicContact CD1-CD2 3.34Å; L279-L338 HydrophobicContact CD1-CG 3.66Å; L279-L338 HydrophobicContact CG-CD2 4.08Å; I334-L338 PolarHBondContact O-N 3.28Å; A336-L338 VanDerWaalsContact C-N 3.29Å; A336-L338 PolarHBondContact O-N 3.4Å; L338-D340 PolarHBondContact O-N 2.75Å |
| 339 | H | 65 | Low | 75.4 | Confident | 71 Ų | 71 | 64.7 Ų | 64.7 | 33% | 0.329 | 29% | 0.289 | S | S | . | . | trans | -89.3 | 95.9 | 173.9 | -123.2 | -86.9 | 0 | 0 | 0 | 108.5 | Y335 S341 F342 R343 | Y335-H339 PolarHBondContact O-N 3.17Å; Y335-H339 VanDerWaalsContact O-N 3.14Å; H339-S341 PolarHBondContact CE1-OG 3.42Å; H339-S341 PolarHBondContact ND1-OG 2.92Å; H339-S341 PolarHBondContact O-N 2.85Å; H339-S341 VanDerWaalsContact O-N 3.14Å; H339-F342 HydrophobicContact CB-CB 3.59Å; H339-F342 WeakPolarHBondContact O-CA 3.26Å; H339-F342 WeakPolarHBondContact O-CB 3.43Å; H339-F342 PolarHBondContact O-N 3.4Å; H339-R343 PolarHBondContact O-N 2.9Å | ||
| 340 | D | 64.9 | Low | 74.5 | Confident | 89 Ų | 89 | 69.4 Ų | 69.4 | 48% | 0.476 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -53.7 | -36.5 | 175 | -65.1 | -44.6 | 0 | 0 | 0 | 111.2 | L338 F342 R343 E344 | L338-D340 PolarHBondContact O-N 2.75Å; D340-F342 VanDerWaalsContact C-N 3.32Å; D340-F342 PolarHBondContact O-N 2.94Å; D340-R343 PolarHBondContact O-N 2.89Å; D340-E344 WeakPolarHBondContact O-CG 3.41Å; D340-E344 PolarHBondContact O-N 3.21Å |
| 341 | S | 63.9 | Low | 73.8 | Confident | 33 Ų | 33 | 70.9 Ų | 70.9 | 23% | 0.231 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -68.3 | -23.3 | 173.3 | 33 | 0 | 0 | 0 | 0 | 114.4 | R90 H339 E345 | R90-S341 VanDerWaalsContact NH2-CB 3.29Å; R90-S341 PolarHBondContact NH2-O 3.36Å; H339-S341 PolarHBondContact CE1-OG 3.42Å; H339-S341 PolarHBondContact ND1-OG 2.92Å; H339-S341 PolarHBondContact O-N 2.85Å; H339-S341 VanDerWaalsContact O-N 3.14Å; S341-E345 WeakPolarHBondContact O-CG 3.49Å; S341-E345 PolarHBondContact O-N 3.33Å |
| 342 | F | 65.8 | Low | 72.7 | Confident | 15 Ų | 15 | 73.8 Ų | 73.8 | 7% | 0.066 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -78 | -43.3 | 170 | -175.9 | -90.3 | 0 | 0 | 0 | 110.5 | L81 V84 A336 H339 D340 E344 E345 L346 | L81-F342 HydrophobicContact CD1-CD2 4.15Å; L81-F342 HydrophobicContact CD1-CE2 3.37Å; L81-F342 HydrophobicContact CD1-CZ 3.64Å; V84-F342 HydrophobicContact CB-CD2 4.17Å; V84-F342 HydrophobicContact CB-CE2 3.51Å; V84-F342 HydrophobicContact CB-CZ 4.13Å; V84-F342 HydrophobicContact CG1-CD2 3.53Å; V84-F342 HydrophobicContact CG1-CE2 3.43Å; V84-F342 VanDerWaalsContact CG1-CE2 3.43Å; V84-F342 HydrophobicContact CG1-CG 4.48Å; V84-F342 HydrophobicContact CG1-CZ 4.32Å; V84-F342 HydrophobicContact CG2-CE2 3.94Å; V84-F342 HydrophobicContact CG2-CZ 4.06Å; A336-F342 HydrophobicContact CB-CD1 4.01Å; A336-F342 HydrophobicContact CB-CE1 3.96Å; H339-F342 HydrophobicContact CB-CB 3.59Å; H339-F342 WeakPolarHBondContact O-CA 3.26Å; H339-F342 WeakPolarHBondContact O-CB 3.43Å; H339-F342 PolarHBondContact O-N 3.4Å; D340-F342 VanDerWaalsContact C-N 3.32Å; D340-F342 PolarHBondContact O-N 2.94Å; F342-E344 VanDerWaalsContact C-N 3.33Å; F342-E344 PolarHBondContact O-N 3Å; F342-E345 PolarHBondContact O-N 3.15Å; F342-L346 HydrophobicContact CD1-CB 4.48Å; F342-L346 HydrophobicContact CE1-CB 4.39Å; F342-L346 HydrophobicContact CE1-CD2 4.17Å; F342-L346 VanDerWaalsContact O-CB 3.27Å; F342-L346 WeakPolarHBondContact O-CB 3.49Å; F342-L346 PolarHBondContact O-N 2.96Å |
| 343 | R | 72.3 | Confident | 71.1 | Confident | 139 Ų | 139 | 83.6 Ų | 83.6 | 53% | 0.525 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.3 | -43.6 | 176.2 | -65 | 176.7 | 65.2 | -162.3 | 1 | 112.1 | A336 H339 D340 R347 | A336-R343 WeakPolarHBondContact O-CD 3.37Å; A336-R343 WeakPolarHBondContact O-CG 3.32Å; H339-R343 PolarHBondContact O-N 2.9Å; D340-R343 PolarHBondContact O-N 2.89Å; R343-R347 WeakPolarHBondContact O-CB 3.34Å; R343-R347 PolarHBondContact O-N 3.04Å |
| 344 | E | 73.8 | Confident | 69.5 | Low | 97 Ų | 97 | 82.2 Ų | 82.2 | 45% | 0.453 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -59.3 | -45.9 | 175.9 | -77.3 | 172.5 | -176.9 | 0 | 0 | 111.9 | R90 D340 F342 R347 K348 | R90-E344 IonicContact NH1-OE2 3.28Å; R90-E344 IonicContact NH2-OE2 2.94Å; R90-E344 PolarHBondContact NH2-OE2 3.31Å; D340-E344 WeakPolarHBondContact O-CG 3.41Å; D340-E344 PolarHBondContact O-N 3.21Å; F342-E344 VanDerWaalsContact C-N 3.33Å; F342-E344 PolarHBondContact O-N 3Å; E344-R347 PolarHBondContact O-N 2.98Å; E344-K348 WeakPolarHBondContact O-CB 3.38Å; E344-K348 VanDerWaalsContact O-CG 3.22Å; E344-K348 WeakPolarHBondContact O-CG 3.48Å; E344-K348 PolarHBondContact O-N 3.07Å |
| 345 | E | 73.6 | Confident | 67.9 | Low | 27 Ų | 27 | 91.1 Ų | 91.1 | 13% | 0.126 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -74 | -37.7 | -178.6 | -63.9 | -58.3 | 143.9 | 0 | 0 | 111.9 | V84 V88 R90 S341 F342 R347 K348 M349 | V84-E345 HydrophobicContact CG1-CB 4.26Å; V88-E345 HydrophobicContact CG1-CG 4.09Å; V88-E345 HydrophobicContact CG2-CB 3.97Å; V88-E345 HydrophobicContact CG2-CG 3.9Å; R90-E345 IonicContact CZ-OE1 3.72Å; R90-E345 IonicContact NE-OE1 2.75Å; R90-E345 IonicContact NH1-OE1 3.17Å; R90-E345 VanDerWaalsContact NH2-CG 3.33Å; R90-E345 IonicContact NH2-OE1 2.82Å; R90-E345 PolarHBondContact NH2-OE1 2.88Å; S341-E345 WeakPolarHBondContact O-CG 3.49Å; S341-E345 PolarHBondContact O-N 3.33Å; F342-E345 PolarHBondContact O-N 3.15Å; E345-R347 VanDerWaalsContact C-N 3.34Å; E345-K348 PolarHBondContact O-N 2.86Å; E345-K348 IonicContact OE1-NZ 2.81Å; E345-K348 PolarHBondContact OE1-NZ 3.31Å; E345-M349 WeakPolarHBondContact O-CB 3.37Å; E345-M349 WeakPolarHBondContact O-CG 3.33Å; E345-M349 PolarHBondContact O-N 2.94Å |
| 346 | L | 73.6 | Confident | 66.4 | Low | 38 Ų | 38 | 99.8 Ų | 99.8 | 20% | 0.199 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 171.8 | -175.7 | 68.2 | 0 | 0 | 0 | 110.4 | V84 F342 M349 L350 | V84-L346 HydrophobicContact CG2-CD1 4.34Å; F342-L346 HydrophobicContact CD1-CB 4.48Å; F342-L346 HydrophobicContact CE1-CB 4.39Å; F342-L346 HydrophobicContact CE1-CD2 4.17Å; F342-L346 VanDerWaalsContact O-CB 3.27Å; F342-L346 WeakPolarHBondContact O-CB 3.49Å; F342-L346 PolarHBondContact O-N 2.96Å; L346-M349 PolarHBondContact O-N 3.34Å; L346-L350 HydrophobicContact CD1-CD1 4.24Å; L346-L350 HydrophobicContact CD1-CG 4.43Å; L346-L350 HydrophobicContact CG-CD1 3.92Å; L346-L350 HydrophobicContact CG-CG 4.46Å; L346-L350 WeakPolarHBondContact O-CB 3.48Å; L346-L350 VanDerWaalsContact O-CG 3.27Å; L346-L350 WeakPolarHBondContact O-CG 3.45Å; L346-L350 PolarHBondContact O-N 3.37Å |
| 347 | R | 77.4 | Confident | 65 | Low | 181 Ų | 181 | 106.4 Ų | 106.4 | 68% | 0.683 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.8 | -43.2 | 176.1 | -172.4 | 176.6 | -173.6 | 178.3 | 3 | 111.2 | R343 E344 E345 L351 | R343-R347 WeakPolarHBondContact O-CB 3.34Å; R343-R347 PolarHBondContact O-N 3.04Å; E344-R347 PolarHBondContact O-N 2.98Å; E345-R347 VanDerWaalsContact C-N 3.34Å; R347-L351 HydrophobicContact CG-CD1 3.6Å; R347-L351 HydrophobicContact CG-CG 4.23Å; R347-L351 WeakPolarHBondContact O-CB 3.47Å; R347-L351 WeakPolarHBondContact O-CG 3.47Å; R347-L351 PolarHBondContact O-N 3.33Å |
| 348 | K | 77.8 | Confident | 63.7 | Low | 110 Ų | 110 | 103.1 Ų | 103.1 | 48% | 0.478 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.7 | -43.6 | 174.6 | -74.1 | 170.4 | -167.2 | 172.7 | 0 | 111.7 | E344 E345 S352 | E344-K348 WeakPolarHBondContact O-CB 3.38Å; E344-K348 VanDerWaalsContact O-CG 3.22Å; E344-K348 WeakPolarHBondContact O-CG 3.48Å; E344-K348 PolarHBondContact O-N 3.07Å; E345-K348 PolarHBondContact O-N 2.86Å; E345-K348 IonicContact OE1-NZ 2.81Å; E345-K348 PolarHBondContact OE1-NZ 3.31Å; K348-S352 WeakPolarHBondContact O-CB 3.24Å; K348-S352 PolarHBondContact O-N 3.42Å; K348-S352 PolarHBondContact O-OG 3.14Å |
| 349 | M | 70.8 | Confident | 62.9 | Low | 45 Ų | 45 | 107 Ų | 107 | 22% | 0.222 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -64.2 | -48.4 | 177.5 | -78.4 | -170.6 | 167.9 | 0 | 0 | 111.9 | V84 R87 E345 L346 L351 S352 W353 | V84-M349 HydrophobicContact CG2-CE 4.5Å; V84-M349 HydrophobicContact CG2-SD 3.71Å; R87-M349 HydrophobicContact CB-CE 3.29Å; R87-M349 HydrophobicContact CG-CE 3.53Å; E345-M349 WeakPolarHBondContact O-CB 3.37Å; E345-M349 WeakPolarHBondContact O-CG 3.33Å; E345-M349 PolarHBondContact O-N 2.94Å; L346-M349 PolarHBondContact O-N 3.34Å; M349-L351 VanDerWaalsContact C-N 3.34Å; M349-L351 PolarHBondContact O-N 3.27Å; M349-S352 PolarHBondContact O-N 2.92Å; M349-S352 PolarHBondContact O-OG 2.85Å; M349-W353 WeakPolarHBondContact O-CB 3.4Å; M349-W353 PolarHBondContact O-N 3.49Å |
| 350 | L | 75.3 | Confident | 61.6 | Low | 109 Ų | 109 | 113.2 Ų | 113.2 | 57% | 0.571 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.6 | -37.2 | 179.2 | -69 | 172.2 | 0 | 0 | 0 | 112.2 | L346 | L346-L350 HydrophobicContact CD1-CD1 4.24Å; L346-L350 HydrophobicContact CD1-CG 4.43Å; L346-L350 HydrophobicContact CG-CD1 3.92Å; L346-L350 HydrophobicContact CG-CG 4.46Å; L346-L350 WeakPolarHBondContact O-CB 3.48Å; L346-L350 VanDerWaalsContact O-CG 3.27Å; L346-L350 WeakPolarHBondContact O-CG 3.45Å; L346-L350 PolarHBondContact O-N 3.37Å |
| 351 | L | 75.3 | Confident | 60.4 | Low | 113 Ų | 113 | 112.4 Ų | 112.4 | 59% | 0.592 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -80.1 | -20.3 | 177.4 | -67.8 | 173.5 | 0 | 0 | 0 | 114 | R347 M349 P354 | R347-L351 HydrophobicContact CG-CD1 3.6Å; R347-L351 HydrophobicContact CG-CG 4.23Å; R347-L351 WeakPolarHBondContact O-CB 3.47Å; R347-L351 WeakPolarHBondContact O-CG 3.47Å; R347-L351 PolarHBondContact O-N 3.33Å; M349-L351 VanDerWaalsContact C-N 3.34Å; M349-L351 PolarHBondContact O-N 3.27Å; L351-P354 WeakPolarHBondContact O-CD 3.43Å |
| 352 | S | 64.1 | Low | 59.4 | Low | 64 Ų | 64 | 119.8 Ų | 119.8 | 45% | 0.448 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -94.7 | -17 | 176.7 | 58.8 | 0 | 0 | 0 | 0 | 113.6 | K348 M349 P354 R355 | K348-S352 WeakPolarHBondContact O-CB 3.24Å; K348-S352 PolarHBondContact O-N 3.42Å; K348-S352 PolarHBondContact O-OG 3.14Å; M349-S352 PolarHBondContact O-N 2.92Å; M349-S352 PolarHBondContact O-OG 2.85Å; S352-P354 VanDerWaalsContact C-N 3.29Å; S352-R355 PolarHBondContact O-N 2.85Å |
| 353 | W | 53 | Low | 57.8 | Low | 220 Ų | 220 | 124.2 Ų | 124.2 | 83% | 0.833 | 62% | 0.619 | S | S | * | * | G | 310 helix | trans | -53.1 | -34.3 | 174 | -163.5 | -86.5 | 0 | 0 | 0 | 114.2 | M349 R355 | M349-W353 WeakPolarHBondContact O-CB 3.4Å; M349-W353 PolarHBondContact O-N 3.49Å; W353-R355 VanDerWaalsContact C-N 3.33Å; W353-R355 PolarHBondContact O-N 3Å |
| 354 | P | 50.8 | Low | 56.1 | Low | 99 Ų | 99 | 125.4 Ų | 125.4 | 64% | 0.643 | 63% | 0.632 | S | S | * | * | G | 310 helix | trans | -76.7 | -10.7 | 177 | -15.4 | 31.1 | 0 | 0 | 0 | 115 | L351 S352 | L351-P354 WeakPolarHBondContact O-CD 3.43Å; S352-P354 VanDerWaalsContact C-N 3.29Å |
| 355 | R | 49.2 | Very low | 54.2 | Low | 210 Ų | 210 | 126.8 Ų | 126.8 | 79% | 0.792 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -99 | 6.8 | -168.7 | -70.2 | -171.2 | -175 | 175 | 1.4 | 115.6 | S352 W353 | S352-R355 PolarHBondContact O-N 2.85Å; W353-R355 VanDerWaalsContact C-N 3.33Å; W353-R355 PolarHBondContact O-N 3Å |
| 356 | K | 46.6 | Very low | 52.4 | Low | 195 Ų | 195 | 131.1 Ų | 131.1 | 85% | 0.848 | 68% | 0.676 | S | S | * | * | trans | -115.1 | 36.3 | -178.4 | -94.1 | -169.3 | 177.3 | -170.9 | 0 | 114.8 | ||||
| 357 | I | 47.1 | Very low | 50.6 | Low | 162 Ų | 162 | 134.6 Ų | 134.6 | 83% | 0.831 | 70% | 0.703 | S | S | * | * | trans | -121 | 81.3 | 158 | -51.2 | 174.2 | 0 | 0 | 0 | 106.9 | ||||
| 358 | V | 42 | Very low | 48.5 | Very low | 120 Ų | 120 | 131.8 Ų | 131.8 | 73% | 0.727 | 71% | 0.706 | S | S | * | * | trans | -112.6 | 122.4 | 161.6 | 179.2 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 359 | P | 39.3 | Very low | 46.3 | Very low | 111 Ų | 111 | 132.6 Ų | 132.6 | 72% | 0.721 | 72% | 0.719 | S | S | * | * | trans | -62.5 | 138.2 | 176.8 | -11.8 | 25.8 | 0 | 0 | 0 | 109 | G361 | P359-G361 VanDerWaalsContact C-N 3.26Å; P359-G361 PolarHBondContact O-N 2.91Å | ||
| 360 | H | 38.4 | Very low | 44.7 | Very low | 201 Ų | 201 | 141.2 Ų | 141.2 | 93% | 0.931 | 76% | 0.764 | S | S | * | * | trans | -61.4 | 90.2 | 165.4 | -105.5 | 40.1 | 0 | 0 | 0 | 108.9 | Q362 | H360-Q362 PolarHBondContact O-N 2.75Š| ||
| 361 | G | 37.8 | Very low | 43.2 | Very low | 72 Ų | 72 | 142.8 Ų | 142.8 | 74% | 0.742 | 77% | 0.774 | S | S | * | * | trans | -74.5 | 112.3 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | P359 S363 | P359-G361 VanDerWaalsContact C-N 3.26Å; P359-G361 PolarHBondContact O-N 2.91Å; G361-S363 PolarHBondContact O-N 3.11Å | ||
| 362 | Q | 43.3 | Very low | 41.5 | Very low | 187 Ų | 187 | 144.4 Ų | 144.4 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -54.5 | 127.1 | 168 | -69.7 | 178 | -17.7 | 0 | 0 | 109.5 | H360 | H360-Q362 PolarHBondContact O-N 2.75Š| ||
| 363 | S | 33.1 | Very low | 40.2 | Very low | 108 Ų | 108 | 148.8 Ų | 148.8 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -119.2 | 86.7 | 158.7 | -173.2 | 0 | 0 | 0 | 0 | 107.1 | G361 T365 | G361-S363 PolarHBondContact O-N 3.11Å; S363-T365 PolarHBondContact O-N 2.91Å | ||
| 364 | M | 35.5 | Very low | 39.5 | Very low | 164 Ų | 164 | 144.6 Ų | 144.6 | 81% | 0.808 | 80% | 0.8 | S | S | * | * | trans | -73.3 | 102.7 | 163.5 | -75.4 | -87.4 | -93.2 | 0 | 0 | 107.2 | V366 | M364-V366 PolarHBondContact O-N 3.19Š| ||
| 365 | T | 35.3 | Very low | 38.8 | Very low | 126 Ų | 126 | 147.5 Ų | 147.5 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | -65.8 | 106.3 | 160.6 | 28.3 | 0 | 0 | 0 | 0 | 108.5 | S363 | S363-T365 PolarHBondContact O-N 2.91Š| ||
| 366 | V | 36 | Very low | 38.1 | Very low | 119 Ų | 119 | 143.3 Ų | 143.3 | 72% | 0.721 | 81% | 0.811 | S | S | * | * | trans | -89.5 | 109.9 | 162.4 | 176.9 | 0 | 0 | 0 | 0 | 107.1 | M364 V368 | M364-V366 PolarHBondContact O-N 3.19Å; V366-V368 HydrophobicContact CG1-CG2 4.27Å; V366-V368 PolarHBondContact O-N 2.97Å | ||
| 367 | S | 35.6 | Very low | 37.5 | Very low | 110 Ų | 110 | 139.6 Ų | 139.6 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -69.8 | 118.6 | 164.7 | -57.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 368 | V | 32 | Very low | 36.7 | Very low | 123 Ų | 123 | 137.9 Ų | 137.9 | 75% | 0.745 | 81% | 0.807 | S | S | * | * | trans | -100.8 | 113.8 | 162.5 | 178.6 | 0 | 0 | 0 | 0 | 107 | V366 | V366-V368 HydrophobicContact CG1-CG2 4.27Å; V366-V368 PolarHBondContact O-N 2.97Å | ||
| 369 | V | 32.8 | Very low | 36.3 | Very low | 126 Ų | 126 | 139.4 Ų | 139.4 | 76% | 0.764 | 81% | 0.814 | S | S | * | * | trans | -103.7 | 128 | 165.8 | 169 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 370 | I | 36.3 | Very low | 36 | Very low | 226 Ų | 226 | 142 Ų | 142 | 100% | 1.159 | 82% | 0.822 | S | S | * | * | trans | 86.4 | 0 | -178.4 | -48.1 | 176.8 | 0 | 0 | 0 | 114.8 |
Retrieved 370 of 370 residues in 259.7 ms
(Link to these results)