| 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 | 36.9 | Very low | 32.6 | Very low | 251 Ų | 251 | 145.1 Ų | 145.1 | 100% | 1.236 | 85% | 0.851 | S | S | * | * | 0 | 140.2 | 0 | -85 | 165.3 | 125.9 | 0 | 0 | 108.6 | |||||
| 2 | S | 31.9 | Very low | 32.3 | Very low | 122 Ų | 122 | 149.2 Ų | 149.2 | 85% | 0.853 | 85% | 0.851 | S | S | * | * | trans | -46.1 | 135.7 | -165.2 | -103.8 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 3 | S | 33.2 | Very low | 32 | Very low | 115 Ų | 115 | 152.8 Ų | 152.8 | 80% | 0.804 | 85% | 0.851 | S | S | * | * | 10.8 | 151.7 | 121 | -167.2 | 0 | 0 | 0 | 0 | 123.5 | |||||
| 4 | S | 33.6 | Very low | 31.8 | Very low | 114 Ų | 114 | 154.7 Ų | 154.7 | 80% | 0.797 | 85% | 0.846 | S | S | * | * | trans | 117.6 | 137.4 | 142.3 | -170.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 5 | A | 34.2 | Very low | 31.4 | Very low | 76 Ų | 76 | 157.6 Ų | 157.6 | 63% | 0.628 | 85% | 0.851 | S | S | * | * | cis | -171 | 140 | -3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 6 | V | 32.1 | Very low | 31.2 | Very low | 144 Ų | 144 | 154.7 Ų | 154.7 | 87% | 0.873 | 84% | 0.839 | S | S | * | * | 80.4 | 131.6 | 101 | -175.8 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 7 | R | 32.4 | Very low | 30.9 | Very low | 235 Ų | 235 | 157.3 Ų | 157.3 | 89% | 0.887 | 83% | 0.834 | S | S | * | * | trans | -55.6 | 155.6 | 169.5 | -79.4 | 170.4 | 159.2 | 165.2 | -6.2 | 114.4 | ||||
| 8 | E | 30.2 | Very low | 30.8 | Very low | 197 Ų | 197 | 157.9 Ų | 157.9 | 92% | 0.921 | 83% | 0.829 | S | S | * | * | trans | -161 | 151.7 | 133.6 | -120.6 | 175.1 | -169.7 | 0 | 0 | 114.7 | ||||
| 9 | S | 30.6 | Very low | 30.8 | Very low | 104 Ų | 104 | 154.7 Ų | 154.7 | 73% | 0.727 | 83% | 0.827 | S | S | * | * | trans | -95.9 | 152.7 | -173.6 | 53.3 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 10 | V | 32.3 | Very low | 30.6 | Very low | 150 Ų | 150 | 153.4 Ų | 153.4 | 91% | 0.909 | 83% | 0.831 | S | S | * | * | trans | -139.7 | 124.6 | 158.4 | -177.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 11 | A | 30.9 | Very low | 30.4 | Very low | 88 Ų | 88 | 154 Ų | 154 | 73% | 0.727 | 83% | 0.83 | S | S | * | * | trans | -129 | 162.1 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 12 | K | 29.8 | Very low | 30.2 | Very low | 194 Ų | 194 | 149.5 Ų | 149.5 | 84% | 0.843 | 81% | 0.806 | S | S | * | * | trans | 103.4 | 138.8 | 173.9 | -64.6 | 173.6 | -180 | 172 | 0 | 113.4 | ||||
| 13 | K | 28.3 | Very low | 30.1 | Very low | 196 Ų | 196 | 151.6 Ų | 151.6 | 85% | 0.852 | 80% | 0.803 | S | S | * | * | cis | -165.8 | 160.4 | 28.6 | -133.3 | 165 | -174.3 | -176.5 | 0 | 112.2 | ||||
| 14 | K | 29.3 | Very low | 30 | Very low | 180 Ų | 180 | 154.6 Ų | 154.6 | 78% | 0.783 | 80% | 0.804 | S | S | * | * | trans | -52.5 | 155.4 | 177.1 | -73.3 | 172.6 | 166.8 | 178.9 | 0 | 117.4 | ||||
| 15 | H | 25.7 | Very low | 29.8 | Very low | 198 Ų | 198 | 157.3 Ų | 157.3 | 92% | 0.917 | 81% | 0.809 | S | S | * | * | trans | -135.4 | 147.3 | 144.2 | -109.7 | 45.5 | 0 | 0 | 0 | 111.4 | ||||
| 16 | V | 27.6 | Very low | 29.9 | Very low | 111 Ų | 111 | 161.4 Ų | 161.4 | 67% | 0.673 | 82% | 0.821 | S | S | * | * | trans | -131.1 | 159.7 | -167.5 | 173.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 17 | R | 25.8 | Very low | 29.8 | Very low | 199 Ų | 199 | 162.3 Ų | 162.3 | 75% | 0.751 | 82% | 0.821 | S | S | * | * | trans | 89.6 | 138.5 | 153.8 | -117.2 | 168.4 | 169.5 | -162 | 0.3 | 115.1 | ||||
| 18 | F | 30 | Very low | 30.2 | Very low | 168 Ų | 168 | 158.5 Ų | 158.5 | 74% | 0.737 | 82% | 0.818 | S | S | * | * | cis | -152.9 | 164.9 | 29.7 | -89.4 | -89.5 | 0 | 0 | 0 | 112.9 | ||||
| 19 | A | 29.9 | Very low | 30.3 | Very low | 97 Ų | 97 | 157.9 Ų | 157.9 | 80% | 0.802 | 82% | 0.815 | S | S | * | * | trans | -81.6 | 159.1 | 165.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 20 | S | 26.6 | Very low | 30.6 | Very low | 128 Ų | 128 | 162.5 Ų | 162.5 | 90% | 0.895 | 83% | 0.825 | S | S | * | * | trans | -133.4 | 149.8 | 151.2 | 82.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 21 | M | 27.7 | Very low | 30.8 | Very low | 167 Ų | 167 | 164.4 Ų | 164.4 | 82% | 0.823 | 82% | 0.824 | S | S | * | * | trans | -126.6 | 169.8 | -169.5 | -169.6 | 168.9 | 154.5 | 0 | 0 | 108.3 | ||||
| 22 | E | 31.7 | Very low | 31 | Very low | 157 Ų | 157 | 168.2 Ų | 168.2 | 73% | 0.734 | 83% | 0.827 | S | S | * | * | trans | 89.1 | 134 | 168.2 | -59.1 | 170.9 | -174.7 | 0 | 0 | 115.1 | ||||
| 23 | E | 30 | Very low | 31.3 | Very low | 165 Ų | 165 | 167 Ų | 167 | 77% | 0.771 | 83% | 0.83 | S | S | * | * | cis | -163.1 | 176.8 | 10.2 | -120.1 | 169.5 | -153 | 0 | 0 | 111.4 | ||||
| 24 | E | 31.5 | Very low | 31.9 | Very low | 178 Ų | 178 | 161.9 Ų | 161.9 | 83% | 0.832 | 82% | 0.815 | S | S | * | * | trans | -69.9 | 154.1 | -158.2 | -60 | 165.8 | 154.5 | 0 | 0 | 118.4 | ||||
| 25 | D | 29 | Very low | 32.5 | Very low | 171 Ų | 171 | 160.5 Ų | 160.5 | 91% | 0.914 | 82% | 0.816 | S | S | * | * | trans | -166.1 | 128.5 | 130.5 | -112.5 | -16.1 | 0 | 0 | 0 | 111.2 | ||||
| 26 | D | 36.3 | Very low | 33.1 | Very low | 163 Ų | 163 | 158.5 Ų | 158.5 | 87% | 0.872 | 80% | 0.804 | S | S | * | * | trans | -69.2 | 135.9 | 177.2 | -77.6 | -44.7 | 0 | 0 | 0 | 112.1 | ||||
| 27 | N | 30.9 | Very low | 33.9 | Very low | 163 Ų | 163 | 158.8 Ų | 158.8 | 87% | 0.872 | 80% | 0.802 | S | S | * | * | trans | -160.4 | 126.3 | 142.1 | -131.1 | -2.2 | 0 | 0 | 0 | 112.4 | ||||
| 28 | D | 39.5 | Very low | 34.9 | Very low | 155 Ų | 155 | 157.4 Ų | 157.4 | 83% | 0.829 | 80% | 0.802 | S | S | * | * | trans | -67.2 | 120 | 174.4 | -69.3 | -55.3 | 0 | 0 | 0 | 111.9 | ||||
| 29 | E | 33.5 | Very low | 35.8 | Very low | 183 Ų | 183 | 159 Ų | 159 | 86% | 0.855 | 80% | 0.803 | S | S | * | * | trans | -146.4 | 118.1 | 148.8 | -72.5 | -162.4 | 167.3 | 0 | 0 | 111.6 | E31 | E29-E31 PolarHBondContact O-N 3.45Š| ||
| 30 | Q | 35.6 | Very low | 36.4 | Very low | 201 Ų | 201 | 161.1 Ų | 161.1 | 94% | 0.939 | 79% | 0.794 | S | S | * | * | trans | -69.6 | 111.4 | 167.6 | -76 | 171.8 | -19 | 0 | 0 | 109.6 | E32 | Q30-E32 PolarHBondContact O-N 3.43Š| ||
| 31 | E | 36.1 | Very low | 37.4 | Very low | 190 Ų | 190 | 161.1 Ų | 161.1 | 89% | 0.888 | 78% | 0.78 | S | S | * | * | trans | -86.3 | 110.8 | 167.1 | -87.9 | -167.2 | 158.7 | 0 | 0 | 111.8 | E29 | E29-E31 PolarHBondContact O-N 3.45Š| ||
| 32 | E | 36.4 | Very low | 38.4 | Very low | 168 Ų | 168 | 156 Ų | 156 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | trans | -69.7 | 120.9 | 176.3 | -161.3 | 179.3 | -165.9 | 0 | 0 | 111 | Q30 T34 | Q30-E32 PolarHBondContact O-N 3.43Å; E32-T34 PolarHBondContact O-N 2.77Å | ||
| 33 | N | 35.1 | Very low | 39.2 | Very low | 169 Ų | 169 | 150.1 Ų | 150.1 | 90% | 0.904 | 75% | 0.745 | S | S | * | * | trans | -67.5 | 93.8 | 172.5 | -84.1 | -62 | 0 | 0 | 0 | 110.5 | ||||
| 34 | T | 41.4 | Very low | 40.1 | Very low | 88 Ų | 88 | 150.3 Ų | 150.3 | 54% | 0.54 | 74% | 0.739 | S | S | . | * | trans | -78 | 146.5 | -179.4 | 59.7 | 0 | 0 | 0 | 0 | 113.3 | E32 F36 | E32-T34 PolarHBondContact O-N 2.77Å; T34-F36 PolarHBondContact O-N 3.35Å | ||
| 35 | L | 41.1 | Very low | 40.9 | Very low | 152 Ų | 152 | 151.6 Ų | 151.6 | 80% | 0.796 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.6 | -4.2 | -174 | -157.7 | 136.7 | 0 | 0 | 0 | 115.5 | ||
| 36 | F | 39.3 | Very low | 41.7 | Very low | 155 Ų | 155 | 148.8 Ų | 148.8 | 68% | 0.68 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -80.9 | -24.2 | -175.3 | -82.1 | -86.3 | 0 | 0 | 0 | 114.5 | T34 R39 | T34-F36 PolarHBondContact O-N 3.35Å; F36-R39 PolarHBondContact O-N 2.9Å |
| 37 | D | 45 | Very low | 42.3 | Very low | 117 Ų | 117 | 148.7 Ų | 148.7 | 63% | 0.626 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -75.3 | -33.3 | 178.8 | -92.9 | -28.8 | 0 | 0 | 0 | 113.4 | R39 K40 E41 | D37-R39 VanDerWaalsContact C-N 3.25Å; D37-R39 PolarHBondContact O-N 3.18Å; D37-K40 PolarHBondContact O-N 2.95Å; D37-E41 PolarHBondContact O-N 3.32Å |
| 38 | K | 46.6 | Very low | 43.2 | Very low | 171 Ų | 171 | 144.7 Ų | 144.7 | 74% | 0.743 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -62.1 | -30.7 | 174 | -85.5 | -176.5 | 176.7 | 173.4 | 0 | 113 | A42 | K38-A42 WeakPolarHBondContact O-CB 3.47Å; K38-A42 PolarHBondContact O-N 3.46Å; K38-A42 VanDerWaalsContact O-N 3.08Å |
| 39 | R | 48.5 | Very low | 43.7 | Very low | 201 Ų | 201 | 140 Ų | 140 | 76% | 0.758 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -72.2 | -33.5 | 179.1 | -151.9 | -179.2 | -144.1 | -166 | 7.1 | 111.9 | F36 D37 G43 | F36-R39 PolarHBondContact O-N 2.9Å; D37-R39 VanDerWaalsContact C-N 3.25Å; D37-R39 PolarHBondContact O-N 3.18Å; R39-G43 PolarHBondContact O-N 2.97Å; R39-G43 VanDerWaalsContact O-N 3.09Å |
| 40 | K | 43.2 | Very low | 44.3 | Very low | 142 Ų | 142 | 136.5 Ų | 136.5 | 62% | 0.617 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -74.1 | -30.6 | 179.7 | -144.8 | 174.4 | -175.3 | 177.9 | 0 | 111.8 | D37 R44 | D37-K40 PolarHBondContact O-N 2.95Å; K40-R44 PolarHBondContact O-N 3.27Å |
| 41 | E | 46.3 | Very low | 44.7 | Very low | 127 Ų | 127 | 135.3 Ų | 135.3 | 59% | 0.593 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -75.3 | -41.4 | 170.7 | -74 | -163.6 | 136.3 | 0 | 0 | 113.3 | D37 G43 R44 R45 | D37-E41 PolarHBondContact O-N 3.32Å; E41-G43 VanDerWaalsContact C-N 3.32Å; E41-G43 PolarHBondContact O-N 3.25Å; E41-R44 PolarHBondContact O-N 3.36Å; E41-R44 VanDerWaalsContact O-N 3.14Å; E41-R45 PolarHBondContact O-N 2.69Å |
| 42 | A | 49 | Very low | 45.1 | Very low | 59 Ų | 59 | 132.4 Ų | 132.4 | 49% | 0.488 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -60.5 | -41.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | K38 R44 R45 L46 | K38-A42 WeakPolarHBondContact O-CB 3.47Å; K38-A42 PolarHBondContact O-N 3.46Å; K38-A42 VanDerWaalsContact O-N 3.08Å; A42-R44 VanDerWaalsContact C-N 3.33Å; A42-R44 PolarHBondContact O-N 3.48Å; A42-R45 PolarHBondContact O-N 2.67Å; A42-L46 WeakPolarHBondContact O-CB 3.33Å; A42-L46 PolarHBondContact O-N 2.96Å |
| 43 | G | 48.7 | Very low | 45.3 | Very low | 34 Ų | 34 | 127.2 Ų | 127.2 | 35% | 0.351 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -64.6 | -32.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | R39 E41 K47 | R39-G43 PolarHBondContact O-N 2.97Å; R39-G43 VanDerWaalsContact O-N 3.09Å; E41-G43 VanDerWaalsContact C-N 3.32Å; E41-G43 PolarHBondContact O-N 3.25Å; G43-K47 PolarHBondContact O-N 3.05Å; G43-K47 VanDerWaalsContact O-N 3.09Å |
| 44 | R | 48.5 | Very low | 45.5 | Very low | 169 Ų | 169 | 127.7 Ų | 127.7 | 64% | 0.638 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -73 | -40.7 | 175.6 | -101.3 | -175.6 | -79.4 | -161.4 | 1.1 | 112.3 | K40 E41 A42 K47 S48 | K40-R44 PolarHBondContact O-N 3.27Å; E41-R44 PolarHBondContact O-N 3.36Å; E41-R44 VanDerWaalsContact O-N 3.14Å; A42-R44 VanDerWaalsContact C-N 3.33Å; A42-R44 PolarHBondContact O-N 3.48Å; R44-K47 PolarHBondContact O-N 2.75Å; R44-S48 PolarHBondContact O-N 3.32Å |
| 45 | R | 47.8 | Very low | 45.2 | Very low | 205 Ų | 205 | 132.4 Ų | 132.4 | 77% | 0.774 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -63.9 | -41 | 174.1 | -75.3 | -171.8 | 176.3 | -163.6 | 0.2 | 112 | E41 A42 S48 A49 | E41-R45 PolarHBondContact O-N 2.69Å; A42-R45 PolarHBondContact O-N 2.67Å; R45-S48 WeakPolarHBondContact O-CB 3.48Å; R45-S48 PolarHBondContact O-N 2.96Å; R45-A49 PolarHBondContact O-N 2.92Å |
| 46 | L | 46.5 | Very low | 45.1 | Very low | 112 Ų | 112 | 130.6 Ų | 130.6 | 59% | 0.586 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -65.7 | -41.4 | 176.8 | -172.3 | 65.6 | 0 | 0 | 0 | 112.3 | A42 S48 A49 L50 | A42-L46 WeakPolarHBondContact O-CB 3.33Å; A42-L46 PolarHBondContact O-N 2.96Å; L46-S48 VanDerWaalsContact C-N 3.31Å; L46-S48 PolarHBondContact O-N 3.2Å; L46-A49 PolarHBondContact O-N 2.96Å; L46-L50 HydrophobicContact CD1-CD1 4.47Å; L46-L50 HydrophobicContact CG-CD1 4.19Å; L46-L50 WeakPolarHBondContact O-CB 3.5Å; L46-L50 PolarHBondContact O-N 3.26Å |
| 47 | K | 49.3 | Very low | 45.2 | Very low | 161 Ų | 161 | 130.1 Ų | 130.1 | 70% | 0.7 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -64.8 | -33.4 | 173.9 | -86.3 | -177.2 | 176.2 | 179.1 | 0 | 112.9 | G43 R44 K51 | G43-K47 PolarHBondContact O-N 3.05Å; G43-K47 VanDerWaalsContact O-N 3.09Å; R44-K47 PolarHBondContact O-N 2.75Å; K47-K51 WeakPolarHBondContact O-CB 3.41Å; K47-K51 PolarHBondContact O-N 3.43Å |
| 48 | S | 48.9 | Very low | 44.4 | Very low | 79 Ų | 79 | 134 Ų | 134 | 55% | 0.552 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -68.4 | -45.5 | 174.2 | -170.3 | 0 | 0 | 0 | 0 | 111.6 | R44 R45 L46 L50 K51 L52 | R44-S48 PolarHBondContact O-N 3.32Å; R45-S48 WeakPolarHBondContact O-CB 3.48Å; R45-S48 PolarHBondContact O-N 2.96Å; L46-S48 VanDerWaalsContact C-N 3.31Å; L46-S48 PolarHBondContact O-N 3.2Å; S48-L50 PolarHBondContact O-N 2.93Å; S48-K51 PolarHBondContact O-N 2.88Å; S48-L52 PolarHBondContact O-N 3.24Å |
| 49 | A | 50.9 | Low | 44.1 | Very low | 58 Ų | 58 | 132 Ų | 132 | 48% | 0.479 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -63.5 | -39.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | R45 L46 L52 A53 | R45-A49 PolarHBondContact O-N 2.92Å; L46-A49 PolarHBondContact O-N 2.96Å; A49-L52 WeakPolarHBondContact O-CB 3.49Å; A49-L52 PolarHBondContact O-N 3.47Å; A49-A53 PolarHBondContact O-N 3.24Å |
| 50 | L | 46.6 | Very low | 43.1 | Very low | 109 Ų | 109 | 126.6 Ų | 126.6 | 57% | 0.571 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -67.8 | -35.3 | 174.3 | -101 | 144.5 | 0 | 0 | 0 | 112.8 | L46 S48 L52 A53 K54 | L46-L50 HydrophobicContact CD1-CD1 4.47Å; L46-L50 HydrophobicContact CG-CD1 4.19Å; L46-L50 WeakPolarHBondContact O-CB 3.5Å; L46-L50 PolarHBondContact O-N 3.26Å; S48-L50 PolarHBondContact O-N 2.93Å; L50-L52 VanDerWaalsContact C-N 3.31Å; L50-A53 PolarHBondContact O-N 3.02Å; L50-K54 WeakPolarHBondContact O-CB 3.32Å; L50-K54 PolarHBondContact O-N 3.37Å |
| 51 | K | 42.4 | Very low | 42.3 | Very low | 175 Ų | 175 | 123.6 Ų | 123.6 | 76% | 0.761 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -66.3 | -34.3 | 171.7 | -100.6 | -175.4 | 175 | -178.1 | 0 | 112 | K47 S48 K55 | K47-K51 WeakPolarHBondContact O-CB 3.41Å; K47-K51 PolarHBondContact O-N 3.43Å; S48-K51 PolarHBondContact O-N 2.88Å; K51-K55 PolarHBondContact O-N 3.16Å |
| 52 | L | 44.5 | Very low | 42.1 | Very low | 130 Ų | 130 | 124.8 Ų | 124.8 | 68% | 0.681 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -69.5 | -44.4 | 175.8 | -145.3 | 83 | 0 | 0 | 0 | 111.3 | S48 A49 L50 K54 K55 T56 | S48-L52 PolarHBondContact O-N 3.24Å; A49-L52 WeakPolarHBondContact O-CB 3.49Å; A49-L52 PolarHBondContact O-N 3.47Å; L50-L52 VanDerWaalsContact C-N 3.31Å; L52-K54 VanDerWaalsContact C-N 3.31Å; L52-K54 PolarHBondContact O-N 3.14Å; L52-K55 PolarHBondContact O-N 3.31Å; L52-T56 PolarHBondContact O-OG1 3.3Å |
| 53 | A | 41 | Very low | 41.2 | Very low | 59 Ų | 59 | 129.6 Ų | 129.6 | 49% | 0.488 | 70% | 0.7 | S | S | . | * | H | α-helix | trans | -66 | -31.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | A49 L50 K55 T56 | A49-A53 PolarHBondContact O-N 3.24Å; L50-A53 PolarHBondContact O-N 3.02Å; A53-K55 VanDerWaalsContact C-N 3.31Å; A53-T56 PolarHBondContact O-N 2.86Å; A53-T56 PolarHBondContact O-OG1 2.9Å |
| 54 | K | 39.1 | Very low | 40.8 | Very low | 178 Ų | 178 | 139.5 Ų | 139.5 | 77% | 0.774 | 73% | 0.727 | S | S | * | * | H | α-helix | trans | -77.6 | -15.4 | 177.3 | -139.6 | 173.1 | -172.1 | 178.2 | 0 | 113.4 | L50 L52 T56 | L50-K54 WeakPolarHBondContact O-CB 3.32Å; L50-K54 PolarHBondContact O-N 3.37Å; L52-K54 VanDerWaalsContact C-N 3.31Å; L52-K54 PolarHBondContact O-N 3.14Å; K54-T56 VanDerWaalsContact C-N 3.34Å |
| 55 | K | 35.8 | Very low | 39.9 | Very low | 188 Ų | 188 | 137.7 Ų | 137.7 | 82% | 0.817 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | -13.9 | 175.7 | -144.4 | 177.9 | -177.3 | -175.2 | 0 | 112.5 | K51 L52 A53 I57 | K51-K55 PolarHBondContact O-N 3.16Å; L52-K55 PolarHBondContact O-N 3.31Å; A53-K55 VanDerWaalsContact C-N 3.31Å; K55-I57 VanDerWaalsContact C-N 3.33Å |
| 56 | T | 40 | Very low | 38.9 | Very low | 114 Ų | 114 | 137.2 Ų | 137.2 | 70% | 0.699 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | 2.2 | -179.4 | -25.5 | 0 | 0 | 0 | 0 | 113.9 | L52 A53 K54 | L52-T56 PolarHBondContact O-OG1 3.3Å; A53-T56 PolarHBondContact O-N 2.86Å; A53-T56 PolarHBondContact O-OG1 2.9Å; K54-T56 VanDerWaalsContact C-N 3.34Å |
| 57 | I | 40.5 | Very low | 38.1 | Very low | 144 Ų | 144 | 138.4 Ų | 138.4 | 74% | 0.738 | 75% | 0.749 | S | S | * | * | trans | -130.3 | 82.8 | 179.9 | -51.4 | 177.5 | 0 | 0 | 0 | 109.7 | K55 | K55-I57 VanDerWaalsContact C-N 3.33Š| ||
| 58 | K | 28.6 | Very low | 37.3 | Very low | 198 Ų | 198 | 137 Ų | 137 | 86% | 0.861 | 75% | 0.754 | S | S | * | * | trans | -157.5 | 132.8 | 154.6 | -132 | -179.2 | -179.2 | -174.3 | 0 | 109.6 | ||||
| 59 | P | 39.3 | Very low | 36.8 | Very low | 131 Ų | 131 | 136.6 Ų | 136.6 | 85% | 0.851 | 76% | 0.762 | S | S | * | * | trans | -91.8 | 146.9 | -175.3 | 35.2 | -30.8 | 0 | 0 | 0 | 111.6 | ||||
| 60 | G | 28.2 | Very low | 35.9 | Very low | 87 Ų | 87 | 137 Ų | 137 | 90% | 0.897 | 77% | 0.772 | S | S | * | * | trans | 129.9 | 122 | 162.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 61 | G | 27 | Very low | 35.3 | Very low | 79 Ų | 79 | 135.6 Ų | 135.6 | 81% | 0.814 | 78% | 0.784 | S | S | * | * | trans | 136.4 | 90.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 62 | D | 41.1 | Very low | 35.4 | Very low | 152 Ų | 152 | 132 Ų | 132 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | trans | -39.5 | 123.3 | 176.1 | -154 | 2.2 | 0 | 0 | 0 | 114.7 | ||||
| 63 | N | 29.7 | Very low | 36.2 | Very low | 159 Ų | 159 | 128 Ų | 128 | 85% | 0.85 | 77% | 0.771 | S | S | * | * | trans | -156.4 | 113.8 | 149.8 | -112.2 | -13.5 | 0 | 0 | 0 | 109.9 | V65 | N63-V65 PolarHBondContact O-N 3.42Š| ||
| 64 | R | 40.4 | Very low | 37.7 | Very low | 243 Ų | 243 | 128.4 Ų | 128.4 | 92% | 0.917 | 78% | 0.775 | S | S | * | * | trans | -45.2 | 106.4 | -180 | -71.5 | 176.6 | 172.6 | -160.8 | -2.4 | 112.5 | ||||
| 65 | V | 30.4 | Very low | 39.7 | Very low | 130 Ų | 130 | 123.9 Ų | 123.9 | 79% | 0.788 | 77% | 0.765 | S | S | * | * | trans | -103.8 | 115.3 | 150.2 | -179 | 0 | 0 | 0 | 0 | 106 | N63 V67 | N63-V65 PolarHBondContact O-N 3.42Å; V65-V67 PolarHBondContact O-N 2.91Å | ||
| 66 | K | 26 | Very low | 42 | Very low | 195 Ų | 195 | 116.1 Ų | 116.1 | 85% | 0.848 | 74% | 0.737 | S | S | * | * | trans | -50.9 | 108.4 | 168 | -100.5 | 179.4 | 172.3 | 177.4 | 0 | 107.6 | V68 | K66-V68 VanDerWaalsContact C-N 3.26Å; K66-V68 PolarHBondContact O-N 3.49Å | ||
| 67 | V | 30.8 | Very low | 44.2 | Very low | 138 Ų | 138 | 115.2 Ų | 115.2 | 84% | 0.836 | 72% | 0.721 | S | S | * | * | trans | -66.7 | 93.7 | 164.3 | 177.8 | 0 | 0 | 0 | 0 | 106 | V65 G69 | V65-V67 PolarHBondContact O-N 2.91Å; V67-G69 PolarHBondContact O-N 3.25Å | ||
| 68 | V | 31.9 | Very low | 46.7 | Very low | 130 Ų | 130 | 114.8 Ų | 114.8 | 79% | 0.788 | 71% | 0.71 | S | S | * | * | trans | -72.4 | 104.9 | 160.7 | 177.4 | 0 | 0 | 0 | 0 | 105.3 | K66 G70 | K66-V68 VanDerWaalsContact C-N 3.26Å; K66-V68 PolarHBondContact O-N 3.49Å; V68-G70 PolarHBondContact O-N 3.26Å | ||
| 69 | G | 38.5 | Very low | 49.6 | Very low | 71 Ų | 71 | 108.9 Ų | 108.9 | 73% | 0.732 | 69% | 0.687 | S | S | * | * | trans | -58 | 120.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | V67 | V67-G69 PolarHBondContact O-N 3.25Š| ||
| 70 | G | 32.1 | Very low | 52.2 | Low | 67 Ų | 67 | 103.3 Ų | 103.3 | 69% | 0.691 | 65% | 0.65 | S | S | * | * | trans | -142.5 | 45.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | V68 S72 | V68-G70 PolarHBondContact O-N 3.26Å; G70-S72 PolarHBondContact O-N 2.91Å | ||
| 71 | G | 33.6 | Very low | 55.3 | Low | 79 Ų | 79 | 99.4 Ų | 99.4 | 81% | 0.814 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.5 | 19 | -174.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 72 | S | 46 | Very low | 58.5 | Low | 99 Ų | 99 | 101.4 Ų | 101.4 | 69% | 0.692 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | -8.8 | 178.4 | -161.7 | 0 | 0 | 0 | 0 | 113.8 | G70 | G70-S72 PolarHBondContact O-N 2.91Š|
| 73 | G | 60.7 | Low | 61.1 | Low | 47 Ų | 47 | 94.3 Ų | 94.3 | 49% | 0.485 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -76.3 | -47.8 | -167.3 | 0 | 0 | 0 | 0 | 0 | 116 | R77 | G73-R77 WeakPolarHBondContact O-CD 3.5Å; G73-R77 WeakPolarHBondContact O-CG 3.32Å |
| 74 | A | 72.7 | Confident | 64.3 | Low | 68 Ų | 68 | 86.8 Ų | 86.8 | 56% | 0.562 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -90.1 | -46.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | G76 R77 W78 | A74-G76 VanDerWaalsContact C-N 3.34Å; A74-G76 PolarHBondContact O-N 3.41Å; A74-R77 PolarHBondContact O-N 3.38Å; A74-W78 PolarHBondContact O-N 2.94Å; A74-W78 VanDerWaalsContact O-N 3.12Å |
| 75 | C | 80.1 | Confident | 67 | Low | 83 Ų | 83 | 76.1 Ų | 76.1 | 56% | 0.561 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.9 | -41.9 | -179.1 | -176.7 | 0 | 0 | 0 | 0 | 111.6 | R77 W78 M79 | C75-R77 PolarHBondContact O-N 3.26Å; C75-W78 PolarHBondContact O-N 2.72Å; C75-M79 WeakPolarHBondContact O-CG 3.29Å; C75-M79 PolarHBondContact O-N 3.5Å |
| 76 | G | 83.6 | Confident | 70.1 | Confident | 24 Ų | 24 | 70.4 Ų | 70.4 | 25% | 0.247 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -60.3 | -45.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | A74 W78 M79 V80 | A74-G76 VanDerWaalsContact C-N 3.34Å; A74-G76 PolarHBondContact O-N 3.41Å; G76-W78 PolarHBondContact O-N 2.86Å; G76-M79 PolarHBondContact O-N 2.97Å; G76-V80 WeakPolarHBondContact O-CG2 3.18Å; G76-V80 PolarHBondContact O-N 3.48Å |
| 77 | R | 88.1 | Confident | 73.5 | Confident | 95 Ų | 95 | 61.1 Ų | 61.1 | 36% | 0.358 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -59.8 | -44.9 | 177.3 | -67.8 | 169.7 | 85.1 | -179.5 | 8.4 | 111.7 | G73 A74 C75 M79 V80 T81 T195 W196 | G73-R77 WeakPolarHBondContact O-CD 3.5Å; G73-R77 WeakPolarHBondContact O-CG 3.32Å; A74-R77 PolarHBondContact O-N 3.38Å; C75-R77 PolarHBondContact O-N 3.26Å; R77-M79 PolarHBondContact O-N 2.99Å; R77-V80 PolarHBondContact O-N 2.97Å; R77-T81 PolarHBondContact O-N 2.92Å; R77-T81 PolarHBondContact O-OG1 3.08Å; R77-T195 HydrophobicContact CB-CG2 3.81Å; R77-T195 HydrophobicContact CG-CG2 3.88Å; R77-T195 PolarHBondContact NE-O 2.97Å; R77-T195 PolarHBondContact NH2-O 2.95Å; R77-W196 HydrophobicContact CB-CZ2 4.1Å |
| 78 | W | 91.1 | Very high | 76.6 | Confident | 135 Ų | 135 | 54.6 Ų | 54.6 | 51% | 0.511 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64 | -39.4 | 175.9 | -78.4 | 109.7 | 0 | 0 | 0 | 113 | A74 C75 G76 T81 L82 W196 H203 | A74-W78 PolarHBondContact O-N 2.94Å; A74-W78 VanDerWaalsContact O-N 3.12Å; C75-W78 PolarHBondContact O-N 2.72Å; G76-W78 PolarHBondContact O-N 2.86Å; W78-T81 PolarHBondContact O-N 3.5Å; W78-L82 WeakPolarHBondContact O-CG 3.46Å; W78-L82 PolarHBondContact O-N 3.31Å; W78-W196 HydrophobicContact CD2-CH2 4.25Å; W78-W196 HydrophobicContact CD2-CZ2 4.08Å; W78-W196 AromaticContact CE2-CH2 3.74Å; W78-W196 HydrophobicContact CE3-CZ2 4.45Å; W78-W196 HydrophobicContact CG-CZ2 4.44Å; W78-W196 AromaticContact CZ2-CH2 3.99Å; W78-W196 HydrophobicContact CZ2-CH2 3.99Å; W78-W196 HydrophobicContact CZ2-CZ2 4.39Å; W78-W196 AromaticContact NE1-CH2 3.78Å; W78-H203 AromaticContact CH2-CE1 3.58Å; W78-H203 AromaticContact CZ3-CE1 3.84Å |
| 79 | M | 91.1 | Very high | 79.6 | Confident | 75 Ų | 75 | 50.9 Ų | 50.9 | 37% | 0.369 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.8 | -40.2 | 175.5 | -68.6 | -179.6 | 68.5 | 0 | 0 | 112.2 | C75 G76 R77 L82 A83 L287 | C75-M79 WeakPolarHBondContact O-CG 3.29Å; C75-M79 PolarHBondContact O-N 3.5Å; G76-M79 PolarHBondContact O-N 2.97Å; R77-M79 PolarHBondContact O-N 2.99Å; M79-L82 PolarHBondContact O-N 3.26Å; M79-A83 WeakPolarHBondContact O-CB 3.47Å; M79-A83 PolarHBondContact O-N 3.46Å; M79-L287 HydrophobicContact CB-CD2 3.83Å; M79-L287 HydrophobicContact CE-CD2 3.99Å |
| 80 | V | 92.4 | Very high | 82.3 | Confident | 13 Ų | 13 | 47.5 Ų | 47.5 | 8% | 0.079 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -60.8 | -46.1 | 173.8 | 172.6 | 0 | 0 | 0 | 0 | 110.4 | G76 R77 L82 A83 L84 L191 T195 L287 | G76-V80 WeakPolarHBondContact O-CG2 3.18Å; G76-V80 PolarHBondContact O-N 3.48Å; R77-V80 PolarHBondContact O-N 2.97Å; V80-L82 PolarHBondContact O-N 3.38Å; V80-A83 PolarHBondContact O-N 2.84Å; V80-L84 HydrophobicContact CG1-CD1 3.89Å; V80-L84 HydrophobicContact CG1-CG 4.42Å; V80-L84 WeakPolarHBondContact O-CB 3.5Å; V80-L84 WeakPolarHBondContact O-CG 3.44Å; V80-L84 PolarHBondContact O-N 3.27Å; V80-L191 HydrophobicContact CG1-CD2 4.04Å; V80-L191 HydrophobicContact CG1-CG 4.17Å; V80-T195 HydrophobicContact CG1-CG2 4.49Å; V80-L287 HydrophobicContact CG2-CD1 4.23Å |
| 81 | T | 94.2 | Very high | 85.2 | Confident | 5 Ų | 5 | 44.4 Ų | 44.4 | 3% | 0.031 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62 | -41.9 | 176.7 | -61.5 | 0 | 0 | 0 | 0 | 112.5 | R77 W78 L84 C85 I192 W196 | R77-T81 PolarHBondContact O-N 2.92Å; R77-T81 PolarHBondContact O-OG1 3.08Å; W78-T81 PolarHBondContact O-N 3.5Å; T81-L84 PolarHBondContact O-N 3.39Å; T81-C85 WeakPolarHBondContact O-CB 3.5Å; T81-C85 PolarHBondContact O-N 3.18Å; T81-C85 PolarHBondContact O-SG 3.01Å; T81-C85 VanDerWaalsContact O-SG 3.32Å; T81-I192 HydrophobicContact CG2-CD1 3.96Å; T81-I192 WeakPolarHBondContact OG1-CD1 3.44Å; T81-W196 PolarHBondContact OG1-NE1 2.88Å |
| 82 | L | 94.6 | Very high | 87.9 | Confident | 122 Ų | 122 | 40.7 Ų | 40.7 | 64% | 0.639 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -64.1 | -41.4 | 176.5 | -73.1 | 171.9 | 0 | 0 | 0 | 112 | W78 M79 V80 G86 | W78-L82 WeakPolarHBondContact O-CG 3.46Å; W78-L82 PolarHBondContact O-N 3.31Å; M79-L82 PolarHBondContact O-N 3.26Å; V80-L82 PolarHBondContact O-N 3.38Å; L82-G86 PolarHBondContact O-N 2.85Å |
| 83 | A | 95.7 | Very high | 90 | Very high | 3 Ų | 3 | 36.5 Ų | 36.5 | 3% | 0.025 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.9 | -41.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | M79 V80 G86 S87 F284 L287 | M79-A83 WeakPolarHBondContact O-CB 3.47Å; M79-A83 PolarHBondContact O-N 3.46Å; V80-A83 PolarHBondContact O-N 2.84Å; A83-G86 PolarHBondContact O-N 3.49Å; A83-S87 WeakPolarHBondContact O-CB 3.44Å; A83-S87 PolarHBondContact O-N 3.3Å; A83-S87 PolarHBondContact O-OG 2.78Å; A83-F284 HydrophobicContact CB-CD1 4.43Å; A83-F284 HydrophobicContact CB-CE1 3.98Å; A83-F284 HydrophobicContact CB-CE2 4.28Å; A83-F284 HydrophobicContact CB-CZ 3.9Å; A83-L287 HydrophobicContact CB-CD1 3.88Å |
| 84 | L | 96.2 | Very high | 91.4 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.7 | -49 | 175.4 | -77 | 171.5 | 0 | 0 | 0 | 112.1 | V80 T81 G86 S87 F88 L147 L191 I192 L207 F284 | V80-L84 HydrophobicContact CG1-CD1 3.89Å; V80-L84 HydrophobicContact CG1-CG 4.42Å; V80-L84 WeakPolarHBondContact O-CB 3.5Å; V80-L84 WeakPolarHBondContact O-CG 3.44Å; V80-L84 PolarHBondContact O-N 3.27Å; T81-L84 PolarHBondContact O-N 3.39Å; L84-G86 VanDerWaalsContact C-N 3.32Å; L84-G86 PolarHBondContact O-N 3.44Å; L84-S87 WeakPolarHBondContact CA-OG 3.46Å; L84-S87 PolarHBondContact O-N 3.36Å; L84-S87 VanDerWaalsContact O-N 3.1Å; L84-S87 PolarHBondContact O-OG 3.05Å; L84-F88 PolarHBondContact O-N 3.12Å; L84-L147 HydrophobicContact CD2-CD1 3.71Å; L84-L191 HydrophobicContact CD1-CB 4.23Å; L84-L191 HydrophobicContact CD1-CD2 4.14Å; L84-L191 HydrophobicContact CD1-CG 4.07Å; L84-L191 HydrophobicContact CD2-CD2 4.23Å; L84-L191 HydrophobicContact CG-CD2 4.42Å; L84-I192 HydrophobicContact CD1-CB 4.04Å; L84-I192 HydrophobicContact CD1-CD1 3.87Å; L84-L207 VanDerWaalsContact C-CD1 3.4Å; L84-L207 HydrophobicContact CB-CD1 3.72Å; L84-L207 WeakPolarHBondContact O-CD1 3.35Å; L84-F284 HydrophobicContact CD2-CE1 4.46Å; L84-F284 HydrophobicContact CD2-CZ 4.07Å; L84-F284 HydrophobicContact CG-CZ 4.34Å |
| 85 | C | 96.5 | Very high | 92.1 | Very high | 19 Ų | 19 | 33.8 Ų | 33.8 | 13% | 0.128 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -58.7 | -43.8 | 174.7 | -71.8 | 0 | 0 | 0 | 0 | 111.7 | T81 S87 F88 L89 S210 | T81-C85 WeakPolarHBondContact O-CB 3.5Å; T81-C85 PolarHBondContact O-N 3.18Å; T81-C85 PolarHBondContact O-SG 3.01Å; T81-C85 VanDerWaalsContact O-SG 3.32Å; C85-S87 VanDerWaalsContact C-N 3.31Å; C85-S87 PolarHBondContact O-N 2.76Å; C85-F88 PolarHBondContact O-N 3.41Å; C85-L89 WeakPolarHBondContact O-CB 3.47Å; C85-L89 PolarHBondContact O-N 3.35Å; C85-S210 WeakPolarHBondContact CB-OG 3.45Å; C85-S210 VanDerWaalsContact O-CB 3.25Å; C85-S210 WeakPolarHBondContact O-CB 3.44Å |
| 86 | G | 96.6 | Very high | 92.5 | Very high | 11 Ų | 11 | 31.3 Ų | 31.3 | 11% | 0.113 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.3 | -40.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L82 A83 L84 L89 G90 F276 | L82-G86 PolarHBondContact O-N 2.85Å; A83-G86 PolarHBondContact O-N 3.49Å; L84-G86 VanDerWaalsContact C-N 3.32Å; L84-G86 PolarHBondContact O-N 3.44Å; G86-L89 PolarHBondContact O-N 3.06Å; G86-G90 PolarHBondContact O-N 3.04Å; G86-F276 VanDerWaalsContact O-CE1 3.26Å; G86-F276 WeakPolarHBondContact O-CE1 3.23Å; G86-F276 WeakPolarHBondContact O-CZ 3.23Å |
| 87 | S | 96.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -67.1 | -41.6 | 177.2 | 71 | 0 | 0 | 0 | 0 | 113 | A83 L84 C85 G90 L91 | A83-S87 WeakPolarHBondContact O-CB 3.44Å; A83-S87 PolarHBondContact O-N 3.3Å; A83-S87 PolarHBondContact O-OG 2.78Å; L84-S87 WeakPolarHBondContact CA-OG 3.46Å; L84-S87 PolarHBondContact O-N 3.36Å; L84-S87 VanDerWaalsContact O-N 3.1Å; L84-S87 PolarHBondContact O-OG 3.05Å; C85-S87 VanDerWaalsContact C-N 3.31Å; C85-S87 PolarHBondContact O-N 2.76Å; S87-G90 CarbonylContact O-C 3.58Å; S87-G90 PolarHBondContact O-N 3.18Å; S87-L91 WeakPolarHBondContact O-CB 3.27Å; S87-L91 PolarHBondContact O-N 3.06Å |
| 88 | F | 95.8 | Very high | 92.4 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -69.2 | -34.9 | 176.4 | -91.2 | -120.1 | 0 | 0 | 0 | 112 | L84 C85 G90 L91 G92 L184 D185 L207 H208 F211 | L84-F88 PolarHBondContact O-N 3.12Å; C85-F88 PolarHBondContact O-N 3.41Å; F88-G90 VanDerWaalsContact C-N 3.33Å; F88-L91 WeakPolarHBondContact O-CB 3.34Å; F88-L91 PolarHBondContact O-N 2.88Å; F88-G92 PolarHBondContact O-N 3.2Å; F88-L184 HydrophobicContact CE2-CG 4.46Å; F88-D185 WeakPolarHBondContact CE1-OD1 3.27Å; F88-D185 WeakPolarHBondContact CZ-OD1 3.18Å; F88-L207 HydrophobicContact CB-CD1 3.92Å; F88-L207 HydrophobicContact CB-CG 4.33Å; F88-L207 HydrophobicContact CD1-CD1 4.1Å; F88-L207 HydrophobicContact CD1-CD2 4.29Å; F88-L207 HydrophobicContact CD1-CG 3.67Å; F88-L207 HydrophobicContact CD2-CD1 3.48Å; F88-L207 VanDerWaalsContact CD2-CD1 3.48Å; F88-L207 HydrophobicContact CD2-CD2 4.25Å; F88-L207 HydrophobicContact CD2-CG 3.87Å; F88-L207 HydrophobicContact CE1-CD2 3.95Å; F88-L207 HydrophobicContact CE1-CG 3.85Å; F88-L207 HydrophobicContact CE2-CD1 3.98Å; F88-L207 HydrophobicContact CE2-CD2 3.92Å; F88-L207 HydrophobicContact CE2-CG 4.05Å; F88-L207 HydrophobicContact CG-CD1 3.55Å; F88-L207 HydrophobicContact CG-CD2 4.43Å; F88-L207 HydrophobicContact CG-CG 3.67Å; F88-L207 HydrophobicContact CZ-CD1 4.47Å; F88-L207 HydrophobicContact CZ-CD2 3.76Å; F88-L207 HydrophobicContact CZ-CG 4.03Å; F88-H208 AromaticContact CE1-CE1 3.96Å; F88-F211 HydrophobicContact CB-CB 4.21Å; F88-F211 HydrophobicContact CD1-CB 4.09Å; F88-F211 VanDerWaalsContact O-CA 3.3Å; F88-F211 WeakPolarHBondContact O-CA 3.41Å |
| 89 | L | 95.3 | Very high | 91.8 | Very high | 53 Ų | 53 | 21.9 Ų | 21.9 | 28% | 0.277 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -60 | -45.8 | 169.6 | -168.5 | 159.6 | 0 | 0 | 0 | 110.7 | C85 G86 G92 M93 S210 G214 F276 | C85-L89 WeakPolarHBondContact O-CB 3.47Å; C85-L89 PolarHBondContact O-N 3.35Å; G86-L89 PolarHBondContact O-N 3.06Å; L89-G92 PolarHBondContact O-N 3.25Å; L89-M93 HydrophobicContact CD2-CE 3.5Å; L89-M93 VanDerWaalsContact CD2-CE 3.5Å; L89-M93 HydrophobicContact CD2-CG 4.11Å; L89-M93 HydrophobicContact CD2-SD 3.79Å; L89-M93 WeakPolarHBondContact O-CG 3.45Å; L89-M93 PolarHBondContact O-N 2.87Å; L89-S210 VanDerWaalsContact CA-O 3.29Å; L89-S210 WeakPolarHBondContact CA-O 3.33Å; L89-G214 WeakPolarHBondContact O-CA 3.44Å; L89-F276 HydrophobicContact CD2-CE1 4.12Å; L89-F276 HydrophobicContact CD2-CZ 4.04Å |
| 90 | G | 94.1 | Very high | 91 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -61.6 | -41.6 | 174 | 0 | 0 | 0 | 0 | 0 | 113.7 | G86 S87 F88 M93 G94 | G86-G90 PolarHBondContact O-N 3.04Å; S87-G90 CarbonylContact O-C 3.58Å; S87-G90 PolarHBondContact O-N 3.18Å; F88-G90 VanDerWaalsContact C-N 3.33Å; G90-M93 PolarHBondContact O-N 3.3Å; G90-G94 PolarHBondContact O-N 3.05Å |
| 91 | L | 93.3 | Very high | 90.5 | Very high | 2 Ų | 2 | 20.6 Ų | 20.6 | 1% | 0.01 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -57.7 | -51.4 | 173.9 | 178.3 | 65 | 0 | 0 | 0 | 110.9 | S87 F88 M93 G94 I95 M181 L184 D185 F211 | S87-L91 WeakPolarHBondContact O-CB 3.27Å; S87-L91 PolarHBondContact O-N 3.06Å; F88-L91 WeakPolarHBondContact O-CB 3.34Å; F88-L91 PolarHBondContact O-N 2.88Å; L91-M93 VanDerWaalsContact C-N 3.33Å; L91-M93 PolarHBondContact O-N 3.16Å; L91-G94 PolarHBondContact O-N 3.32Å; L91-I95 HydrophobicContact CD1-CD1 4.26Å; L91-I95 HydrophobicContact CG-CD1 4.25Å; L91-I95 WeakPolarHBondContact O-CG1 3.34Å; L91-I95 PolarHBondContact O-N 3.49Å; L91-M181 HydrophobicContact CD1-CB 3.47Å; L91-M181 VanDerWaalsContact CD1-CB 3.47Å; L91-M181 HydrophobicContact CD1-CE 4.25Å; L91-M181 HydrophobicContact CD1-CG 3.31Å; L91-M181 HydrophobicContact CD1-SD 3.66Å; L91-L184 HydrophobicContact CB-CD2 4.06Å; L91-L184 HydrophobicContact CD1-CD2 4.47Å; L91-L184 HydrophobicContact CD2-CD2 4.4Å; L91-D185 HydrophobicContact CD2-CB 4.46Å; L91-F211 HydrophobicContact CB-CD2 4.35Å; L91-F211 HydrophobicContact CD2-CD2 3.95Å; L91-F211 HydrophobicContact CD2-CE2 4.06Å; L91-F211 HydrophobicContact CG-CD2 3.99Å; L91-F211 HydrophobicContact CG-CE2 3.94Å |
| 92 | G | 90.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -58.8 | -43 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | F88 L89 G94 I95 S96 A215 | F88-G92 PolarHBondContact O-N 3.2Å; L89-G92 PolarHBondContact O-N 3.25Å; G92-G94 PolarHBondContact O-N 2.98Å; G92-I95 PolarHBondContact O-N 3.49Å; G92-S96 WeakPolarHBondContact O-CB 3.16Å; G92-S96 PolarHBondContact O-N 3.42Å; G92-A215 WeakPolarHBondContact O-CA 3.22Å |
| 93 | M | 91 | Very high | 89.1 | Confident | 12 Ų | 12 | 22.4 Ų | 22.4 | 6% | 0.059 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -62.2 | -44.3 | 176 | -72.3 | -170.3 | -59.8 | 0 | 0 | 112.4 | L89 G90 L91 S96 V97 G214 S218 I221 I273 F276 | L89-M93 HydrophobicContact CD2-CE 3.5Å; L89-M93 VanDerWaalsContact CD2-CE 3.5Å; L89-M93 HydrophobicContact CD2-CG 4.11Å; L89-M93 HydrophobicContact CD2-SD 3.79Å; L89-M93 WeakPolarHBondContact O-CG 3.45Å; L89-M93 PolarHBondContact O-N 2.87Å; G90-M93 PolarHBondContact O-N 3.3Å; L91-M93 VanDerWaalsContact C-N 3.33Å; L91-M93 PolarHBondContact O-N 3.16Å; M93-S96 PolarHBondContact O-N 3.08Å; M93-V97 WeakPolarHBondContact O-CB 3.39Å; M93-V97 PolarHBondContact O-N 3.44Å; M93-G214 VanDerWaalsContact CG-O 3.26Å; M93-G214 WeakPolarHBondContact CG-O 3.43Å; M93-S218 WeakPolarHBondContact O-CB 3.27Å; M93-S218 PolarHBondContact O-OG 3.16Å; M93-I221 HydrophobicContact SD-CD1 3.84Å; M93-I273 HydrophobicContact CB-CD1 4.07Å; M93-I273 HydrophobicContact CB-CG1 4.12Å; M93-I273 HydrophobicContact CB-CG2 4.14Å; M93-I273 HydrophobicContact CE-CG2 4.4Å; M93-I273 HydrophobicContact SD-CG1 4.38Å; M93-F276 HydrophobicContact CE-CD1 3.34Å; M93-F276 HydrophobicContact CE-CE1 3.63Å; M93-F276 HydrophobicContact CE-CG 3.96Å; M93-F276 HydrophobicContact CE-CZ 4.44Å |
| 94 | G | 89.6 | Confident | 88.2 | Confident | 0 Ų | 0 | 23.5 Ų | 23.5 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -70.9 | -26.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | G90 L91 G92 R123 | G90-G94 PolarHBondContact O-N 3.05Å; L91-G94 PolarHBondContact O-N 3.32Å; G92-G94 PolarHBondContact O-N 2.98Å; G94-R123 PolarHBondContact O-NH1 3.42Å; G94-R123 PolarHBondContact O-NH2 2.95Å; G94-R123 VanDerWaalsContact O-NH2 3.14Å |
| 95 | I | 88.2 | Confident | 87.4 | Confident | 58 Ų | 58 | 23.5 Ų | 23.5 | 30% | 0.297 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -72.5 | -53.9 | 169.4 | -64.9 | 167.8 | 0 | 0 | 0 | 110.1 | L91 G92 V97 L98 M181 F211 | L91-I95 HydrophobicContact CD1-CD1 4.26Å; L91-I95 HydrophobicContact CG-CD1 4.25Å; L91-I95 WeakPolarHBondContact O-CG1 3.34Å; L91-I95 PolarHBondContact O-N 3.49Å; G92-I95 PolarHBondContact O-N 3.49Å; I95-V97 PolarHBondContact O-N 3.42Å; I95-L98 PolarHBondContact O-N 2.96Å; I95-M181 HydrophobicContact CG1-SD 4.35Å; I95-F211 HydrophobicContact CD1-CE2 3.53Å; I95-F211 HydrophobicContact CD1-CZ 3.78Å |
| 96 | S | 87.1 | Confident | 86.6 | Confident | 30 Ų | 30 | 22.8 Ų | 22.8 | 21% | 0.21 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -70.5 | -28.4 | -170.8 | -174.5 | 0 | 0 | 0 | 0 | 113.7 | G92 M93 L98 G99 P100 A215 P219 | G92-S96 WeakPolarHBondContact O-CB 3.16Å; G92-S96 PolarHBondContact O-N 3.42Å; M93-S96 PolarHBondContact O-N 3.08Å; S96-L98 PolarHBondContact O-N 3.31Å; S96-L98 VanDerWaalsContact O-N 3.12Å; S96-G99 PolarHBondContact O-N 3.45Å; S96-P100 WeakPolarHBondContact O-CD 3.38Å; S96-A215 WeakPolarHBondContact CB-O 3.09Å; S96-A215 PolarHBondContact OG-O 3.21Å; S96-P219 VanDerWaalsContact OG-CD 3.31Å; S96-P219 WeakPolarHBondContact OG-CD 3.36Å; S96-P219 VanDerWaalsContact OG-CG 3.31Å; S96-P219 WeakPolarHBondContact OG-CG 3.45Å |
| 97 | V | 86.4 | Confident | 85.7 | Confident | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 15% | 0.151 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -27 | -178 | 72 | 0 | 0 | 0 | 0 | 112.7 | M93 I95 G99 P100 T101 M158 S218 A269 Y270 I273 | M93-V97 WeakPolarHBondContact O-CB 3.39Å; M93-V97 PolarHBondContact O-N 3.44Å; I95-V97 PolarHBondContact O-N 3.42Å; V97-G99 VanDerWaalsContact C-N 3.29Å; V97-G99 PolarHBondContact O-N 3.35Å; V97-P100 VanDerWaalsContact O-CD 3.3Å; V97-P100 WeakPolarHBondContact O-CD 3.49Å; V97-P100 WeakPolarHBondContact O-CG 3.16Å; V97-T101 HydrophobicContact CG2-CG2 3.92Å; V97-T101 WeakPolarHBondContact O-CB 3.44Å; V97-T101 VanDerWaalsContact O-CG2 3.31Å; V97-T101 WeakPolarHBondContact O-CG2 3.39Å; V97-T101 PolarHBondContact O-N 3.21Å; V97-T101 PolarHBondContact O-OG1 3.08Å; V97-M158 HydrophobicContact CG1-CE 3.94Å; V97-S218 WeakPolarHBondContact CA-OG 3.41Å; V97-S218 WeakPolarHBondContact CB-OG 3.34Å; V97-S218 PolarHBondContact N-OG 3.32Å; V97-A269 HydrophobicContact CG2-CB 3.9Å; V97-Y270 HydrophobicContact CG1-CD1 4.13Å; V97-Y270 HydrophobicContact CG1-CE1 3.6Å; V97-Y270 HydrophobicContact CG2-CE2 4.45Å; V97-I273 HydrophobicContact CB-CD1 3.75Å; V97-I273 HydrophobicContact CG1-CD1 4.08Å; V97-I273 HydrophobicContact CG2-CD1 3.82Å |
| 98 | L | 83.6 | Confident | 85 | Confident | 4 Ų | 4 | 26.4 Ų | 26.4 | 2% | 0.021 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.3 | -33.2 | -176.7 | -173.2 | 58.2 | 0 | 0 | 0 | 111.8 | I95 S96 F102 L105 F120 M174 | I95-L98 PolarHBondContact O-N 2.96Å; S96-L98 PolarHBondContact O-N 3.31Å; S96-L98 VanDerWaalsContact O-N 3.12Å; L98-F102 HydrophobicContact CD1-CD2 4.46Å; L98-F102 WeakPolarHBondContact O-CA 3.49Å; L98-F102 VanDerWaalsContact O-CB 3.25Å; L98-F102 WeakPolarHBondContact O-CB 3.39Å; L98-F102 PolarHBondContact O-N 3.17Å; L98-L105 HydrophobicContact CD1-CD2 3.71Å; L98-F120 HydrophobicContact CB-CE1 4.48Å; L98-F120 HydrophobicContact CD2-CD1 3.57Å; L98-F120 HydrophobicContact CD2-CE1 3.23Å; L98-F120 HydrophobicContact CD2-CZ 3.99Å; L98-F120 HydrophobicContact CG-CD1 4.45Å; L98-F120 HydrophobicContact CG-CE1 3.63Å; L98-F120 HydrophobicContact CG-CZ 4.01Å; L98-M174 HydrophobicContact CD1-CE 3.73Å |
| 99 | G | 79.3 | Confident | 84.3 | Confident | 52 Ų | 52 | 26.9 Ų | 26.9 | 54% | 0.536 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -57.9 | -64.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | S96 V97 T101 F102 | S96-G99 PolarHBondContact O-N 3.45Å; V97-G99 VanDerWaalsContact C-N 3.29Å; V97-G99 PolarHBondContact O-N 3.35Å; G99-T101 VanDerWaalsContact C-N 3.27Å; G99-T101 PolarHBondContact O-N 3.47Å; G99-F102 WeakPolarHBondContact O-CB 3.05Å; G99-F102 PolarHBondContact O-N 3.18Å |
| 100 | P | 75 | Confident | 83.4 | Confident | 61 Ų | 61 | 32.3 Ų | 32.3 | 40% | 0.396 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -68.2 | -22.5 | -177.3 | 26.9 | -34.8 | 0 | 0 | 0 | 114.1 | S96 V97 P219 A222 | S96-P100 WeakPolarHBondContact O-CD 3.38Å; V97-P100 VanDerWaalsContact O-CD 3.3Å; V97-P100 WeakPolarHBondContact O-CD 3.49Å; V97-P100 WeakPolarHBondContact O-CG 3.16Å; P100-P219 HydrophobicContact CG-CB 4.34Å; P100-A222 HydrophobicContact CB-CB 4.48Å; P100-A222 HydrophobicContact CG-CB 4.14Å |
| 101 | T | 81.4 | Confident | 82.4 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -96.5 | -2.1 | -179.5 | 61.3 | 0 | 0 | 0 | 0 | 112.9 | V97 G99 E103 D104 L105 Y270 | V97-T101 HydrophobicContact CG2-CG2 3.92Å; V97-T101 WeakPolarHBondContact O-CB 3.44Å; V97-T101 VanDerWaalsContact O-CG2 3.31Å; V97-T101 WeakPolarHBondContact O-CG2 3.39Å; V97-T101 PolarHBondContact O-N 3.21Å; V97-T101 PolarHBondContact O-OG1 3.08Å; G99-T101 VanDerWaalsContact C-N 3.27Å; G99-T101 PolarHBondContact O-N 3.47Å; T101-E103 VanDerWaalsContact C-N 3.34Å; T101-E103 PolarHBondContact O-N 3.28Å; T101-D104 WeakPolarHBondContact O-CB 3.15Å; T101-D104 PolarHBondContact O-N 3.03Å; T101-D104 VanDerWaalsContact O-N 3.08Å; T101-L105 WeakPolarHBondContact O-CD1 3.46Å; T101-L105 PolarHBondContact O-N 3.5Å; T101-Y270 HydrophobicContact CG2-CE2 3.88Å; T101-Y270 WeakPolarHBondContact OG1-CE2 3.48Å; T101-Y270 PolarHBondContact OG1-OH 2.87Å |
| 102 | F | 81.6 | Confident | 81.3 | Confident | 24 Ų | 24 | 42.2 Ų | 42.2 | 11% | 0.105 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.1 | -42.2 | -171.5 | -169 | -128.5 | 0 | 0 | 0 | 112.9 | L98 G99 D104 L105 A106 I113 I116 F120 | L98-F102 HydrophobicContact CD1-CD2 4.46Å; L98-F102 WeakPolarHBondContact O-CA 3.49Å; L98-F102 VanDerWaalsContact O-CB 3.25Å; L98-F102 WeakPolarHBondContact O-CB 3.39Å; L98-F102 PolarHBondContact O-N 3.17Å; G99-F102 WeakPolarHBondContact O-CB 3.05Å; G99-F102 PolarHBondContact O-N 3.18Å; F102-D104 VanDerWaalsContact C-N 3.32Å; F102-D104 PolarHBondContact O-N 3.12Å; F102-L105 PolarHBondContact O-N 3.43Å; F102-A106 PolarHBondContact O-N 3.18Å; F102-I113 HydrophobicContact CD1-CG2 3.93Å; F102-I113 HydrophobicContact CE1-CG2 3.37Å; F102-I113 HydrophobicContact CZ-CG2 4.26Å; F102-I116 HydrophobicContact CD2-CG2 4.41Å; F102-I116 HydrophobicContact CE1-CG2 4.21Å; F102-I116 HydrophobicContact CE2-CG2 3.48Å; F102-I116 VanDerWaalsContact CE2-CG2 3.48Å; F102-I116 HydrophobicContact CZ-CG2 3.33Å; F102-F120 HydrophobicContact CD1-CE2 4.32Å; F102-F120 AromaticContact CD2-CE2 3.76Å; F102-F120 HydrophobicContact CD2-CE2 3.76Å; F102-F120 AromaticContact CD2-CZ 3.74Å; F102-F120 HydrophobicContact CD2-CZ 3.74Å; F102-F120 AromaticContact CE1-CE2 3.86Å; F102-F120 HydrophobicContact CE1-CE2 3.86Å; F102-F120 HydrophobicContact CE1-CZ 4.47Å; F102-F120 HydrophobicContact CE2-CD2 4.11Å; F102-F120 AromaticContact CE2-CE2 3.27Å; F102-F120 HydrophobicContact CE2-CE2 3.27Å; F102-F120 AromaticContact CE2-CZ 3.76Å; F102-F120 HydrophobicContact CE2-CZ 3.76Å; F102-F120 HydrophobicContact CG-CE2 4.29Å; F102-F120 HydrophobicContact CG-CZ 4.16Å; F102-F120 HydrophobicContact CZ-CD2 4.16Å; F102-F120 AromaticContact CZ-CE2 3.35Å; F102-F120 HydrophobicContact CZ-CE2 3.35Å; F102-F120 HydrophobicContact CZ-CZ 4.16Å |
| 103 | E | 77.3 | Confident | 80 | Confident | 141 Ų | 141 | 46 Ų | 46 | 66% | 0.659 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -63.4 | -40.1 | 176.9 | -64.8 | -172.3 | 169.7 | 0 | 0 | 111.4 | T101 A106 A107 I113 | T101-E103 VanDerWaalsContact C-N 3.34Å; T101-E103 PolarHBondContact O-N 3.28Å; E103-A106 WeakPolarHBondContact O-CB 3.42Å; E103-A106 PolarHBondContact O-N 2.96Å; E103-A107 PolarHBondContact O-N 3.26Å; E103-I113 HydrophobicContact CG-CD1 4.19Å |
| 104 | D | 76.9 | Confident | 78.7 | Confident | 26 Ų | 26 | 50.2 Ų | 50.2 | 14% | 0.139 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -66.6 | -38.8 | 177.5 | -57.8 | -44.4 | 0 | 0 | 0 | 111.6 | T101 F102 A107 N108 T263 S266 M267 | T101-D104 WeakPolarHBondContact O-CB 3.15Å; T101-D104 PolarHBondContact O-N 3.03Å; T101-D104 VanDerWaalsContact O-N 3.08Å; F102-D104 VanDerWaalsContact C-N 3.32Å; F102-D104 PolarHBondContact O-N 3.12Å; D104-A107 PolarHBondContact O-N 2.93Å; D104-N108 WeakPolarHBondContact O-CB 3.27Å; D104-N108 PolarHBondContact O-N 3.48Å; D104-T263 HydrophobicContact CB-CG2 4.16Å; D104-T263 WeakPolarHBondContact OD1-CA 3.44Å; D104-T263 VanDerWaalsContact OD1-CG2 3.24Å; D104-T263 WeakPolarHBondContact OD1-CG2 3.36Å; D104-S266 WeakPolarHBondContact OD2-CB 3.3Å; D104-S266 PolarHBondContact OD2-OG 3.32Å; D104-M267 HydrophobicContact CB-CE 4.5Å |
| 105 | L | 79.7 | Confident | 77.6 | Confident | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.6 | -42.3 | 173.4 | -93 | 75 | 0 | 0 | 0 | 111.6 | L98 T101 F102 A107 N108 V109 I161 L170 M174 M267 Y270 | L98-L105 HydrophobicContact CD1-CD2 3.71Å; T101-L105 WeakPolarHBondContact O-CD1 3.46Å; T101-L105 PolarHBondContact O-N 3.5Å; F102-L105 PolarHBondContact O-N 3.43Å; L105-A107 VanDerWaalsContact C-N 3.34Å; L105-A107 PolarHBondContact O-N 2.91Å; L105-N108 PolarHBondContact O-N 3.22Å; L105-V109 WeakPolarHBondContact O-CG2 3.49Å; L105-V109 PolarHBondContact O-N 3.43Å; L105-I161 HydrophobicContact CD2-CG2 4.12Å; L105-L170 HydrophobicContact CD2-CD2 4.11Å; L105-L170 HydrophobicContact CG-CD2 4.43Å; L105-M174 HydrophobicContact CD2-CE 3.64Å; L105-M267 HydrophobicContact CB-CE 4.33Å; L105-M267 HydrophobicContact CD1-CE 3.51Å; L105-M267 HydrophobicContact CG-CE 3.8Å; L105-Y270 HydrophobicContact CD1-CE2 3.72Å; L105-Y270 WeakPolarHBondContact CD1-OH 3.26Å |
| 106 | A | 79.6 | Confident | 77.1 | Confident | 5 Ų | 5 | 51.8 Ų | 51.8 | 4% | 0.041 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61 | -43.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | F102 E103 V109 H110 K111 I113 I116 | F102-A106 PolarHBondContact O-N 3.18Å; E103-A106 WeakPolarHBondContact O-CB 3.42Å; E103-A106 PolarHBondContact O-N 2.96Å; A106-V109 PolarHBondContact O-N 3.45Å; A106-H110 PolarHBondContact O-N 3.25Å; A106-K111 PolarHBondContact O-N 3.43Å; A106-K111 VanDerWaalsContact O-O 3.13Å; A106-I113 HydrophobicContact CB-CG1 4.03Å; A106-I116 HydrophobicContact CB-CG2 4.09Å |
| 107 | A | 78.4 | Confident | 76.7 | Confident | 50 Ų | 50 | 52.8 Ų | 52.8 | 41% | 0.413 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | E103 D104 L105 V109 H110 T263 | E103-A107 PolarHBondContact O-N 3.26Å; D104-A107 PolarHBondContact O-N 2.93Å; L105-A107 VanDerWaalsContact C-N 3.34Å; L105-A107 PolarHBondContact O-N 2.91Å; A107-V109 PolarHBondContact O-N 2.9Å; A107-H110 PolarHBondContact O-N 3.43Å; A107-H110 PolarHBondContact O-ND1 3.46Å; A107-T263 HydrophobicContact CB-CG2 3.96Å |
| 108 | N | 80.5 | Confident | 76.5 | Confident | 37 Ų | 37 | 56.1 Ų | 56.1 | 20% | 0.198 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.7 | -28.7 | -179.1 | -165.8 | 36 | 0 | 0 | 0 | 113.1 | D104 L105 P162 C164 M267 | D104-N108 WeakPolarHBondContact O-CB 3.27Å; D104-N108 PolarHBondContact O-N 3.48Å; L105-N108 PolarHBondContact O-N 3.22Å; N108-P162 PolarHBondContact ND2-O 2.82Å; N108-C164 PolarHBondContact ND2-O 3Å; N108-M267 HydrophobicContact CB-CE 3.77Å; N108-M267 HydrophobicContact CB-SD 4.47Å |
| 109 | V | 82.4 | Confident | 76.6 | Confident | 9 Ų | 9 | 56 Ų | 56 | 6% | 0.055 | 31% | 0.314 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.7 | 0.1 | -178 | 175.9 | 0 | 0 | 0 | 0 | 112.4 | L105 A106 A107 K111 I116 C164 A167 L170 | L105-V109 WeakPolarHBondContact O-CG2 3.49Å; L105-V109 PolarHBondContact O-N 3.43Å; A106-V109 PolarHBondContact O-N 3.45Å; A107-V109 PolarHBondContact O-N 2.9Å; V109-K111 VanDerWaalsContact C-N 3.26Å; V109-K111 HydrophobicContact CG1-CG 4.32Å; V109-K111 PolarHBondContact O-N 3.41Å; V109-I116 HydrophobicContact CB-CD1 4.18Å; V109-I116 HydrophobicContact CG1-CD1 4.41Å; V109-I116 HydrophobicContact CG2-CD1 4.28Å; V109-C164 WeakPolarHBondContact CG2-O 3.41Å; V109-A167 HydrophobicContact CG1-CB 3.27Å; V109-A167 VanDerWaalsContact CG1-N 3.27Å; V109-L170 HydrophobicContact CG2-CD2 3.77Å |
| 110 | H | 75.3 | Confident | 76.8 | Confident | 167 Ų | 167 | 57.7 Ų | 57.7 | 77% | 0.773 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.4 | 36 | -179.5 | -53.2 | -55.6 | 0 | 0 | 0 | 113.7 | A106 A107 | A106-H110 PolarHBondContact O-N 3.25Å; A107-H110 PolarHBondContact O-N 3.43Å; A107-H110 PolarHBondContact O-ND1 3.46Å |
| 111 | K | 73.7 | Confident | 77.4 | Confident | 87 Ų | 87 | 59 Ų | 59 | 38% | 0.378 | 31% | 0.313 | S | S | . | . | trans | -125.2 | 151.1 | 177.1 | -73.7 | -164.9 | -179 | -174.2 | 0 | 111.5 | A106 V109 N115 Y118 A167 | A106-K111 PolarHBondContact O-N 3.43Å; A106-K111 VanDerWaalsContact O-O 3.13Å; V109-K111 VanDerWaalsContact C-N 3.26Å; V109-K111 HydrophobicContact CG1-CG 4.32Å; V109-K111 PolarHBondContact O-N 3.41Å; K111-N115 HydrophobicContact CB-CB 4.36Å; K111-N115 HydrophobicContact CD-CB 4.31Å; K111-Y118 PolarHBondContact NZ-OH 2.9Å; K111-A167 HydrophobicContact CD-CB 3.74Å | ||
| 112 | N | 69.4 | Low | 77.8 | Confident | 124 Ų | 124 | 59.5 Ų | 59.5 | 66% | 0.663 | 32% | 0.318 | S | S | * | . | trans | -63.1 | 150.1 | 169.9 | -73.8 | -22.7 | 0 | 0 | 0 | 111 | S114 N115 I116 | N112-S114 VanDerWaalsContact C-N 3.3Å; N112-S114 PolarHBondContact O-N 3.37Å; N112-N115 CarbonylContact O-C 3.52Å; N112-N115 WeakPolarHBondContact O-CA 3.21Å; N112-N115 WeakPolarHBondContact O-CB 3.45Å; N112-N115 PolarHBondContact O-N 2.66Å; N112-I116 PolarHBondContact O-N 2.7Å | ||
| 113 | I | 64.6 | Low | 78.3 | Confident | 78 Ų | 78 | 59.5 Ų | 59.5 | 40% | 0.4 | 32% | 0.318 | S | S | . | . | G | 310 helix | trans | -53.4 | -43.9 | -178.8 | -61.4 | 174.6 | 0 | 0 | 0 | 111.8 | F102 E103 A106 N115 I116 S117 | F102-I113 HydrophobicContact CD1-CG2 3.93Å; F102-I113 HydrophobicContact CE1-CG2 3.37Å; F102-I113 HydrophobicContact CZ-CG2 4.26Å; E103-I113 HydrophobicContact CG-CD1 4.19Å; A106-I113 HydrophobicContact CB-CG1 4.03Å; I113-N115 PolarHBondContact O-N 3.46Å; I113-I116 WeakPolarHBondContact O-CG2 3.5Å; I113-I116 PolarHBondContact O-N 2.9Å; I113-S117 PolarHBondContact O-N 3.2Å; I113-S117 PolarHBondContact O-OG 2.92Å |
| 114 | S | 62.1 | Low | 78.9 | Confident | 102 Ų | 102 | 53.9 Ų | 53.9 | 71% | 0.713 | 30% | 0.295 | S | S | * | . | G | 310 helix | trans | -61.2 | -29.5 | 176.5 | 178.3 | 0 | 0 | 0 | 0 | 113.1 | N112 I116 | N112-S114 VanDerWaalsContact C-N 3.3Å; N112-S114 PolarHBondContact O-N 3.37Å; S114-I116 VanDerWaalsContact C-N 3.3Å; S114-I116 PolarHBondContact O-N 3.43Å |
| 115 | N | 67.9 | Low | 79.6 | Confident | 90 Ų | 90 | 55.3 Ų | 55.3 | 48% | 0.481 | 31% | 0.311 | S | S | . | . | G | 310 helix | trans | -88.2 | 9.4 | 177.9 | -67.2 | -13.8 | 0 | 0 | 0 | 113 | K111 N112 I113 Y118 | K111-N115 HydrophobicContact CB-CB 4.36Å; K111-N115 HydrophobicContact CD-CB 4.31Å; N112-N115 CarbonylContact O-C 3.52Å; N112-N115 WeakPolarHBondContact O-CA 3.21Å; N112-N115 WeakPolarHBondContact O-CB 3.45Å; N112-N115 PolarHBondContact O-N 2.66Å; I113-N115 PolarHBondContact O-N 3.46Å; N115-Y118 WeakPolarHBondContact O-CE1 3.46Å |
| 116 | I | 76.4 | Confident | 80.3 | Confident | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 31% | 0.314 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -125.3 | -6.5 | 176.9 | -144.6 | -175.8 | 0 | 0 | 0 | 113 | F102 A106 V109 N112 I113 S114 Y118 I119 L170 | F102-I116 HydrophobicContact CD2-CG2 4.41Å; F102-I116 HydrophobicContact CE1-CG2 4.21Å; F102-I116 HydrophobicContact CE2-CG2 3.48Å; F102-I116 VanDerWaalsContact CE2-CG2 3.48Å; F102-I116 HydrophobicContact CZ-CG2 3.33Å; A106-I116 HydrophobicContact CB-CG2 4.09Å; V109-I116 HydrophobicContact CB-CD1 4.18Å; V109-I116 HydrophobicContact CG1-CD1 4.41Å; V109-I116 HydrophobicContact CG2-CD1 4.28Å; N112-I116 PolarHBondContact O-N 2.7Å; I113-I116 WeakPolarHBondContact O-CG2 3.5Å; I113-I116 PolarHBondContact O-N 2.9Å; S114-I116 VanDerWaalsContact C-N 3.3Å; S114-I116 PolarHBondContact O-N 3.43Å; I116-Y118 PolarHBondContact O-N 3.42Å; I116-Y118 VanDerWaalsContact O-N 3.1Å; I116-I119 HydrophobicContact CD1-CD1 3.59Å; I116-I119 HydrophobicContact CG1-CD1 3.42Å; I116-I119 VanDerWaalsContact CG1-CD1 3.42Å; I116-I119 HydrophobicContact CG1-CG1 4.12Å; I116-I119 WeakPolarHBondContact O-CB 3.23Å; I116-I119 WeakPolarHBondContact O-CG1 3.48Å; I116-I119 PolarHBondContact O-N 2.89Å; I116-L170 HydrophobicContact CD1-CD2 4.22Å |
| 117 | S | 78.4 | Confident | 81 | Confident | 51 Ų | 51 | 57.3 Ų | 57.3 | 36% | 0.357 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -20.7 | 178 | -54.6 | 0 | 0 | 0 | 0 | 114.6 | I113 I119 F120 | I113-S117 PolarHBondContact O-N 3.2Å; I113-S117 PolarHBondContact O-OG 2.92Å; S117-I119 PolarHBondContact O-N 2.8Å; S117-I119 VanDerWaalsContact O-N 3.17Å; S117-F120 WeakPolarHBondContact O-CB 3.39Å; S117-F120 PolarHBondContact O-N 3.32Å; S117-F120 VanDerWaalsContact O-N 3.07Å |
| 118 | Y | 82.4 | Confident | 81.7 | Confident | 71 Ų | 71 | 56.7 Ų | 56.7 | 28% | 0.278 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.8 | -12.9 | 173.8 | 61.1 | -103.7 | 0 | 0 | 0 | 113.5 | K111 N115 I116 F120 V121 G122 A167 L168 T171 | K111-Y118 PolarHBondContact NZ-OH 2.9Å; N115-Y118 WeakPolarHBondContact O-CE1 3.46Å; I116-Y118 PolarHBondContact O-N 3.42Å; I116-Y118 VanDerWaalsContact O-N 3.1Å; Y118-F120 VanDerWaalsContact C-N 3.31Å; Y118-V121 PolarHBondContact O-N 3.25Å; Y118-G122 PolarHBondContact O-N 2.64Å; Y118-A167 WeakPolarHBondContact OH-CB 3.46Å; Y118-L168 HydrophobicContact CE2-CD2 4.27Å; Y118-T171 HydrophobicContact CD2-CG2 4.05Å; Y118-T171 WeakPolarHBondContact CD2-OG1 3.47Å; Y118-T171 HydrophobicContact CE2-CG2 4.47Å; Y118-T171 WeakPolarHBondContact CE2-OG1 3.14Å |
| 119 | I | 86.5 | Confident | 82.4 | Confident | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -58.9 | -43.4 | 167.4 | -71.1 | 175.6 | 0 | 0 | 0 | 111.2 | I116 S117 V121 G122 R123 L170 T171 M174 | I116-I119 HydrophobicContact CD1-CD1 3.59Å; I116-I119 HydrophobicContact CG1-CD1 3.42Å; I116-I119 VanDerWaalsContact CG1-CD1 3.42Å; I116-I119 HydrophobicContact CG1-CG1 4.12Å; I116-I119 WeakPolarHBondContact O-CB 3.23Å; I116-I119 WeakPolarHBondContact O-CG1 3.48Å; I116-I119 PolarHBondContact O-N 2.89Å; S117-I119 PolarHBondContact O-N 2.8Å; S117-I119 VanDerWaalsContact O-N 3.17Å; I119-V121 VanDerWaalsContact C-N 3.29Å; I119-V121 PolarHBondContact O-N 2.91Å; I119-G122 PolarHBondContact O-N 2.82Å; I119-R123 WeakPolarHBondContact O-CB 3.29Å; I119-R123 PolarHBondContact O-N 3.44Å; I119-L170 HydrophobicContact CD1-CB 4.45Å; I119-L170 HydrophobicContact CD1-CD2 3.42Å; I119-L170 VanDerWaalsContact CD1-CD2 3.42Å; I119-L170 HydrophobicContact CD1-CG 3.63Å; I119-L170 HydrophobicContact CG1-CG 4.43Å; I119-T171 WeakPolarHBondContact CG1-OG1 3.37Å; I119-M174 HydrophobicContact CG2-CB 3.84Å; I119-M174 HydrophobicContact CG2-CE 4.2Å; I119-M174 HydrophobicContact CG2-CG 3.52Å; I119-M174 HydrophobicContact CG2-SD 4.06Å |
| 120 | F | 84.3 | Confident | 83 | Confident | 88 Ų | 88 | 55.9 Ų | 55.9 | 39% | 0.386 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.3 | -41.2 | 178.4 | -66.8 | -74.1 | 0 | 0 | 0 | 110.9 | L98 F102 S117 Y118 R123 A124 | L98-F120 HydrophobicContact CB-CE1 4.48Å; L98-F120 HydrophobicContact CD2-CD1 3.57Å; L98-F120 HydrophobicContact CD2-CE1 3.23Å; L98-F120 HydrophobicContact CD2-CZ 3.99Å; L98-F120 HydrophobicContact CG-CD1 4.45Å; L98-F120 HydrophobicContact CG-CE1 3.63Å; L98-F120 HydrophobicContact CG-CZ 4.01Å; F102-F120 HydrophobicContact CD1-CE2 4.32Å; F102-F120 AromaticContact CD2-CE2 3.76Å; F102-F120 HydrophobicContact CD2-CE2 3.76Å; F102-F120 AromaticContact CD2-CZ 3.74Å; F102-F120 HydrophobicContact CD2-CZ 3.74Å; F102-F120 AromaticContact CE1-CE2 3.86Å; F102-F120 HydrophobicContact CE1-CE2 3.86Å; F102-F120 HydrophobicContact CE1-CZ 4.47Å; F102-F120 HydrophobicContact CE2-CD2 4.11Å; F102-F120 AromaticContact CE2-CE2 3.27Å; F102-F120 HydrophobicContact CE2-CE2 3.27Å; F102-F120 AromaticContact CE2-CZ 3.76Å; F102-F120 HydrophobicContact CE2-CZ 3.76Å; F102-F120 HydrophobicContact CG-CE2 4.29Å; F102-F120 HydrophobicContact CG-CZ 4.16Å; F102-F120 HydrophobicContact CZ-CD2 4.16Å; F102-F120 AromaticContact CZ-CE2 3.35Å; F102-F120 HydrophobicContact CZ-CE2 3.35Å; F102-F120 HydrophobicContact CZ-CZ 4.16Å; S117-F120 WeakPolarHBondContact O-CB 3.39Å; S117-F120 PolarHBondContact O-N 3.32Å; S117-F120 VanDerWaalsContact O-N 3.07Å; Y118-F120 VanDerWaalsContact C-N 3.31Å; F120-R123 PolarHBondContact O-N 2.96Å; F120-A124 VanDerWaalsContact O-CB 3.3Å; F120-A124 WeakPolarHBondContact O-CB 3.48Å; F120-A124 PolarHBondContact O-N 3.3Å |
| 121 | V | 87 | Confident | 83.9 | Confident | 89 Ų | 89 | 48 Ų | 48 | 54% | 0.539 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.4 | -47.8 | 175.3 | -178.2 | 0 | 0 | 0 | 0 | 111 | Y118 I119 R123 A124 A125 | Y118-V121 PolarHBondContact O-N 3.25Å; I119-V121 VanDerWaalsContact C-N 3.29Å; I119-V121 PolarHBondContact O-N 2.91Å; V121-R123 PolarHBondContact O-N 3.48Å; V121-A124 PolarHBondContact O-N 3.44Å; V121-A125 VanDerWaalsContact O-CB 3.31Å; V121-A125 WeakPolarHBondContact O-CB 3.12Å; V121-A125 PolarHBondContact O-N 2.96Å |
| 122 | G | 89.3 | Confident | 84.8 | Confident | 10 Ų | 10 | 48 Ų | 48 | 10% | 0.103 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.6 | -43.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y118 I119 G126 S175 | Y118-G122 PolarHBondContact O-N 2.64Å; I119-G122 PolarHBondContact O-N 2.82Å; G122-G126 PolarHBondContact O-N 3.1Å; G122-S175 WeakPolarHBondContact CA-OG 3.37Å; G122-S175 WeakPolarHBondContact O-CA 2.89Å; G122-S175 WeakPolarHBondContact O-CB 3.33Å; G122-S175 PolarHBondContact O-OG 3.16Å |
| 123 | R | 91.2 | Very high | 85.9 | Confident | 24 Ų | 24 | 46 Ų | 46 | 9% | 0.091 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.8 | -48.3 | 174.9 | -179.4 | -173.7 | 178.1 | 138.7 | 7.4 | 111.6 | G94 I119 F120 V121 G126 Y127 M174 G178 M181 | G94-R123 PolarHBondContact O-NH1 3.42Å; G94-R123 PolarHBondContact O-NH2 2.95Å; G94-R123 VanDerWaalsContact O-NH2 3.14Å; I119-R123 WeakPolarHBondContact O-CB 3.29Å; I119-R123 PolarHBondContact O-N 3.44Å; F120-R123 PolarHBondContact O-N 2.96Å; V121-R123 PolarHBondContact O-N 3.48Å; R123-G126 CarbonylContact O-C 3.59Å; R123-G126 PolarHBondContact O-N 3.46Å; R123-Y127 PolarHBondContact O-N 2.9Å; R123-M174 WeakPolarHBondContact CA-O 3.29Å; R123-M174 HydrophobicContact CB-CB 4.39Å; R123-G178 WeakPolarHBondContact O-CA 3.25Å; R123-M181 VanDerWaalsContact NH2-CE 3.3Å; R123-M181 PolarHBondContact NH2-SD 3.15Å |
| 124 | A | 90 | Very high | 87.2 | Confident | 23 Ų | 23 | 42.3 Ų | 42.3 | 19% | 0.19 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -69.1 | -38.6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | F120 V121 G126 Y127 I128 M451 | F120-A124 VanDerWaalsContact O-CB 3.3Å; F120-A124 WeakPolarHBondContact O-CB 3.48Å; F120-A124 PolarHBondContact O-N 3.3Å; V121-A124 PolarHBondContact O-N 3.44Å; A124-G126 VanDerWaalsContact C-N 3.33Å; A124-G126 PolarHBondContact O-N 3.21Å; A124-Y127 WeakPolarHBondContact O-CB 3.46Å; A124-Y127 PolarHBondContact O-N 3.48Å; A124-I128 WeakPolarHBondContact O-CG1 3.5Å; A124-I128 PolarHBondContact O-N 3.28Å; A124-M451 HydrophobicContact CB-CE 3.48Å; A124-M451 VanDerWaalsContact CB-CE 3.48Å; A124-M451 HydrophobicContact CB-CG 4.05Å; A124-M451 HydrophobicContact CB-SD 3.39Å; A124-M451 WeakPolarHBondContact CB-SD 3.19Å |
| 125 | A | 91.8 | Very high | 88.4 | Confident | 57 Ų | 57 | 37.5 Ų | 37.5 | 47% | 0.471 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -60.7 | -43.3 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | V121 Y127 I128 G129 | V121-A125 VanDerWaalsContact O-CB 3.31Å; V121-A125 WeakPolarHBondContact O-CB 3.12Å; V121-A125 PolarHBondContact O-N 2.96Å; A125-Y127 VanDerWaalsContact C-N 3.35Å; A125-I128 PolarHBondContact O-N 2.81Å; A125-G129 PolarHBondContact O-N 3.01Å |
| 126 | G | 94.8 | Very high | 89.5 | Confident | 7 Ų | 7 | 37.1 Ų | 37.1 | 7% | 0.072 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -58.4 | -45.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | G122 R123 A124 G129 G130 G178 I179 | G122-G126 PolarHBondContact O-N 3.1Å; R123-G126 CarbonylContact O-C 3.59Å; R123-G126 PolarHBondContact O-N 3.46Å; A124-G126 VanDerWaalsContact C-N 3.33Å; A124-G126 PolarHBondContact O-N 3.21Å; G126-G129 PolarHBondContact O-N 3.18Å; G126-G130 PolarHBondContact O-N 3.48Å; G126-G178 VanDerWaalsContact C-C 3.45Å; G126-I179 WeakPolarHBondContact O-CA 3.22Å; G126-I179 VanDerWaalsContact O-CG1 3.29Å; G126-I179 WeakPolarHBondContact O-CG1 3.39Å; G126-I179 PolarHBondContact O-N 3.21Å |
| 127 | Y | 94.6 | Very high | 90.1 | Very high | 39 Ų | 39 | 40 Ų | 40 | 15% | 0.153 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.2 | -50.7 | 177.4 | -170.4 | -86.3 | 0 | 0 | 0 | 112.3 | R123 A124 A125 G129 G130 S131 G178 M181 D185 V443 A447 | R123-Y127 PolarHBondContact O-N 2.9Å; A124-Y127 WeakPolarHBondContact O-CB 3.46Å; A124-Y127 PolarHBondContact O-N 3.48Å; A125-Y127 VanDerWaalsContact C-N 3.35Å; Y127-G129 PolarHBondContact O-N 3.26Å; Y127-G130 PolarHBondContact O-N 3.1Å; Y127-S131 PolarHBondContact O-N 3.41Å; Y127-S131 PolarHBondContact O-OG 3.35Å; Y127-S131 VanDerWaalsContact O-OG 3.07Å; Y127-G178 VanDerWaalsContact CA-O 3.22Å; Y127-G178 WeakPolarHBondContact CA-O 3.48Å; Y127-M181 HydrophobicContact CD2-CB 3.84Å; Y127-M181 HydrophobicContact CE2-CB 4Å; Y127-D185 WeakPolarHBondContact OH-CB 3.45Å; Y127-D185 PolarHBondContact OH-OD2 2.81Å; Y127-V443 HydrophobicContact CE1-CG1 3.77Å; Y127-A447 HydrophobicContact CD1-CB 3.76Å; Y127-A447 HydrophobicContact CE1-CB 3.89Å |
| 128 | I | 93.8 | Very high | 90.6 | Very high | 37 Ų | 37 | 38.3 Ų | 38.3 | 19% | 0.19 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.7 | -48.8 | 177.1 | -70.1 | 168.6 | 0 | 0 | 0 | 110.9 | A124 A125 G130 S131 L132 V444 A447 M451 | A124-I128 WeakPolarHBondContact O-CG1 3.5Å; A124-I128 PolarHBondContact O-N 3.28Å; A125-I128 PolarHBondContact O-N 2.81Å; I128-G130 VanDerWaalsContact C-N 3.33Å; I128-G130 PolarHBondContact O-N 3.12Å; I128-S131 PolarHBondContact O-N 3.27Å; I128-L132 WeakPolarHBondContact O-CG 3.47Å; I128-L132 PolarHBondContact O-N 3.48Å; I128-V444 HydrophobicContact CG2-CG1 3.93Å; I128-V444 HydrophobicContact CG2-CG2 4.24Å; I128-A447 HydrophobicContact CG1-CB 4Å; I128-M451 HydrophobicContact CD1-SD 3.83Å |
| 129 | G | 94.1 | Very high | 90.7 | Very high | 30 Ų | 30 | 39.6 Ų | 39.6 | 31% | 0.309 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -61.9 | -40.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A125 G126 Y127 L132 V133 | A125-G129 PolarHBondContact O-N 3.01Å; G126-G129 PolarHBondContact O-N 3.18Å; Y127-G129 PolarHBondContact O-N 3.26Å; G129-L132 PolarHBondContact O-N 2.87Å; G129-V133 WeakPolarHBondContact O-CB 3.42Å; G129-V133 WeakPolarHBondContact O-CG2 3.39Å; G129-V133 PolarHBondContact O-N 3.35Å |
| 130 | G | 94.9 | Very high | 90.7 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.5 | -37.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | G126 Y127 I128 G134 I179 V183 | G126-G130 PolarHBondContact O-N 3.48Å; Y127-G130 PolarHBondContact O-N 3.1Å; I128-G130 VanDerWaalsContact C-N 3.33Å; I128-G130 PolarHBondContact O-N 3.12Å; G130-G134 VanDerWaalsContact O-CA 3.28Å; G130-G134 WeakPolarHBondContact O-CA 3.36Å; G130-G134 PolarHBondContact O-N 2.76Å; G130-I179 WeakPolarHBondContact CA-O 3.21Å; G130-V183 VanDerWaalsContact O-CG2 3.23Å; G130-V183 WeakPolarHBondContact O-CG2 3.48Å; G130-V183 PolarHBondContact O-N 3.34Å |
| 131 | S | 94.4 | Very high | 90.8 | Very high | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -66.5 | -43.3 | 176 | -61.3 | 0 | 0 | 0 | 0 | 111.6 | Y127 I128 G134 G135 G182 T186 A440 V443 | Y127-S131 PolarHBondContact O-N 3.41Å; Y127-S131 PolarHBondContact O-OG 3.35Å; Y127-S131 VanDerWaalsContact O-OG 3.07Å; I128-S131 PolarHBondContact O-N 3.27Å; S131-G134 PolarHBondContact O-N 3.45Å; S131-G135 PolarHBondContact O-N 3.42Å; S131-G182 VanDerWaalsContact OG-CA 3.25Å; S131-G182 WeakPolarHBondContact OG-CA 3.48Å; S131-G182 PolarHBondContact OG-O 2.8Å; S131-T186 VanDerWaalsContact CA-OG1 3.31Å; S131-T186 WeakPolarHBondContact CA-OG1 3.44Å; S131-T186 WeakPolarHBondContact CB-OG1 3.42Å; S131-T186 PolarHBondContact O-OG1 3.05Å; S131-A440 WeakPolarHBondContact O-CB 3.41Å; S131-V443 VanDerWaalsContact OG-CG1 3.28Å; S131-V443 WeakPolarHBondContact OG-CG1 3.36Å |
| 132 | L | 93.5 | Very high | 91 | Very high | 89 Ų | 89 | 43.5 Ų | 43.5 | 47% | 0.466 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62.5 | -52.5 | 175.4 | -66.1 | 174.5 | 0 | 0 | 0 | 112 | I128 G129 G134 G135 I136 V444 | I128-L132 WeakPolarHBondContact O-CG 3.47Å; I128-L132 PolarHBondContact O-N 3.48Å; G129-L132 PolarHBondContact O-N 2.87Å; L132-G134 VanDerWaalsContact C-N 3.31Å; L132-G134 PolarHBondContact O-N 3.25Å; L132-G135 PolarHBondContact O-N 3.29Å; L132-I136 PolarHBondContact O-N 2.96Å; L132-V444 HydrophobicContact CD2-CG2 3.82Å; L132-V444 HydrophobicContact CG-CG2 3.88Å |
| 133 | V | 92.9 | Very high | 91 | Very high | 82 Ų | 82 | 44.5 Ų | 44.5 | 50% | 0.497 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -65.2 | -38.2 | 179.3 | 173.8 | 0 | 0 | 0 | 0 | 110.9 | G129 G135 I136 L137 | G129-V133 WeakPolarHBondContact O-CB 3.42Å; G129-V133 WeakPolarHBondContact O-CG2 3.39Å; G129-V133 PolarHBondContact O-N 3.35Å; V133-G135 VanDerWaalsContact C-N 3.33Å; V133-G135 PolarHBondContact O-N 2.89Å; V133-I136 PolarHBondContact O-N 3.43Å; V133-L137 VanDerWaalsContact O-CB 3.27Å; V133-L137 WeakPolarHBondContact O-CB 3.21Å; V133-L137 PolarHBondContact O-N 2.74Å |
| 134 | G | 90.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.7 | -39.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G130 S131 L132 I136 L137 F138 | G130-G134 VanDerWaalsContact O-CA 3.28Å; G130-G134 WeakPolarHBondContact O-CA 3.36Å; G130-G134 PolarHBondContact O-N 2.76Å; S131-G134 PolarHBondContact O-N 3.45Å; L132-G134 VanDerWaalsContact C-N 3.31Å; L132-G134 PolarHBondContact O-N 3.25Å; G134-I136 PolarHBondContact O-N 3.41Å; G134-L137 PolarHBondContact O-N 3.46Å; G134-F138 WeakPolarHBondContact O-CB 3.23Å; G134-F138 PolarHBondContact O-N 3.5Å |
| 135 | G | 88.4 | Confident | 91.3 | Very high | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.9 | -45.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113 | S131 L132 V133 G436 | S131-G135 PolarHBondContact O-N 3.42Å; L132-G135 PolarHBondContact O-N 3.29Å; V133-G135 VanDerWaalsContact C-N 3.33Å; V133-G135 PolarHBondContact O-N 2.89Å; G135-G436 WeakPolarHBondContact CA-O 2.97Å; G135-G436 WeakPolarHBondContact O-CA 3.37Å |
| 136 | I | 89.7 | Confident | 91.4 | Very high | 82 Ų | 82 | 44 Ų | 44 | 42% | 0.421 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -66.1 | -49.8 | 176.3 | -60.3 | 165.9 | 0 | 0 | 0 | 110.2 | L132 V133 G134 F138 E139 L140 H437 | L132-I136 PolarHBondContact O-N 2.96Å; V133-I136 PolarHBondContact O-N 3.43Å; G134-I136 PolarHBondContact O-N 3.41Å; I136-F138 VanDerWaalsContact C-N 3.27Å; I136-F138 PolarHBondContact O-N 2.73Å; I136-E139 PolarHBondContact O-N 3.34Å; I136-E139 VanDerWaalsContact O-N 3.12Å; I136-L140 HydrophobicContact CG2-CD1 3.88Å; I136-L140 WeakPolarHBondContact O-CG 3.29Å; I136-L140 PolarHBondContact O-N 2.87Å; I136-H437 WeakPolarHBondContact CG1-NE2 3.41Å |
| 137 | L | 89.9 | Confident | 91.4 | Very high | 62 Ų | 62 | 43.6 Ų | 43.6 | 33% | 0.325 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -67.7 | -29.4 | -173.1 | -166.8 | 58.2 | 0 | 0 | 0 | 112.2 | V133 G134 E139 L140 T141 L146 | V133-L137 VanDerWaalsContact O-CB 3.27Å; V133-L137 WeakPolarHBondContact O-CB 3.21Å; V133-L137 PolarHBondContact O-N 2.74Å; G134-L137 PolarHBondContact O-N 3.46Å; L137-E139 PolarHBondContact O-N 2.99Å; L137-L140 PolarHBondContact O-N 3.46Å; L137-T141 HydrophobicContact CD1-CG2 3.52Å; L137-T141 HydrophobicContact CG-CG2 4.16Å; L137-T141 WeakPolarHBondContact O-CB 3.28Å; L137-T141 PolarHBondContact O-N 3.39Å; L137-T141 PolarHBondContact O-OG1 2.92Å; L137-L146 HydrophobicContact CB-CD1 4.25Å; L137-L146 HydrophobicContact CB-CD2 4.18Å; L137-L146 HydrophobicContact CD2-CD1 3.32Å; L137-L146 HydrophobicContact CG-CD1 3.63Å; L137-L146 HydrophobicContact CG-CD2 4.2Å |
| 138 | F | 88.5 | Confident | 91.5 | Very high | 14 Ų | 14 | 41.8 Ų | 41.8 | 6% | 0.061 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.7 | -29.8 | 175.3 | -168.3 | -85.8 | 0 | 0 | 0 | 112.6 | G134 I136 P143 L146 G187 V190 L191 | G134-F138 WeakPolarHBondContact O-CB 3.23Å; G134-F138 PolarHBondContact O-N 3.5Å; I136-F138 VanDerWaalsContact C-N 3.27Å; I136-F138 PolarHBondContact O-N 2.73Å; F138-P143 HydrophobicContact CD2-CB 4.28Å; F138-P143 HydrophobicContact CE1-CG 4.03Å; F138-P143 HydrophobicContact CE2-CB 3.57Å; F138-P143 HydrophobicContact CE2-CG 3.96Å; F138-P143 HydrophobicContact CZ-CB 3.71Å; F138-P143 HydrophobicContact CZ-CG 3.7Å; F138-L146 VanDerWaalsContact CA-CD2 3.43Å; F138-L146 HydrophobicContact CB-CD2 3.87Å; F138-L146 HydrophobicContact CD2-CD2 4.1Å; F138-L146 HydrophobicContact CG-CD2 4.44Å; F138-G187 VanDerWaalsContact CD2-CA 3.4Å; F138-G187 WeakPolarHBondContact CE2-O 3.43Å; F138-V190 HydrophobicContact CD1-CB 4.43Å; F138-V190 HydrophobicContact CD1-CG1 3.98Å; F138-V190 HydrophobicContact CE1-CB 3.92Å; F138-V190 HydrophobicContact CE1-CG1 3.33Å; F138-V190 HydrophobicContact CE2-CB 4.47Å; F138-V190 HydrophobicContact CZ-CB 3.93Å; F138-V190 HydrophobicContact CZ-CG1 3.76Å; F138-L191 HydrophobicContact CE2-CB 4.15Å; F138-L191 HydrophobicContact CZ-CB 4.04Å |
| 139 | E | 84.5 | Confident | 91.6 | Very high | 98 Ų | 98 | 43.6 Ų | 43.6 | 46% | 0.458 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -82.9 | -28.8 | 176.6 | -66.1 | -177.1 | -170.3 | 0 | 0 | 112.3 | I136 L137 T435 G436 H437 | I136-E139 PolarHBondContact O-N 3.34Å; I136-E139 VanDerWaalsContact O-N 3.12Å; L137-E139 PolarHBondContact O-N 2.99Å; E139-T435 VanDerWaalsContact OE1-CB 3.27Å; E139-T435 WeakPolarHBondContact OE1-CB 3.36Å; E139-T435 PolarHBondContact OE1-OG1 3.34Å; E139-G436 PolarHBondContact OE1-N 3.18Å; E139-H437 VanDerWaalsContact CD-CE1 3.41Å; E139-H437 IonicContact OE1-CE1 3.34Å; E139-H437 IonicContact OE1-CG 2.75Å; E139-H437 IonicContact OE1-ND1 2.84Å; E139-H437 PolarHBondContact OE1-ND1 3.46Å; E139-H437 IonicContact OE2-CE1 3.5Å; E139-H437 PolarHBondContact OE2-CE1 3.3Å; E139-H437 IonicContact OE2-ND1 3.57Å; E139-H437 PolarHBondContact OE2-ND1 3.01Å |
| 140 | L | 85.9 | Confident | 91.7 | Very high | 136 Ų | 136 | 42.4 Ų | 42.4 | 71% | 0.712 | 23% | 0.23 | S | C | * | . | H | α-helix | trans | -87.8 | -23.7 | -177.6 | -61.8 | 177.7 | 0 | 0 | 0 | 114 | I136 L137 | I136-L140 HydrophobicContact CG2-CD1 3.88Å; I136-L140 WeakPolarHBondContact O-CG 3.29Å; I136-L140 PolarHBondContact O-N 2.87Å; L137-L140 PolarHBondContact O-N 3.46Å |
| 141 | T | 87.9 | Confident | 91.8 | Very high | 56 Ų | 56 | 42.5 Ų | 42.5 | 34% | 0.344 | 23% | 0.23 | S | C | . | . | S | Bend | trans | -125.7 | 166.5 | -170.8 | 64 | 0 | 0 | 0 | 0 | 112.6 | L137 P143 | L137-T141 HydrophobicContact CD1-CG2 3.52Å; L137-T141 HydrophobicContact CG-CG2 4.16Å; L137-T141 WeakPolarHBondContact O-CB 3.28Å; L137-T141 PolarHBondContact O-N 3.39Å; L137-T141 PolarHBondContact O-OG1 2.92Å; T141-P143 WeakPolarHBondContact O-CD 3.38Å |
| 142 | N | 89.9 | Confident | 91.9 | Very high | 68 Ų | 68 | 46.1 Ų | 46.1 | 36% | 0.364 | 25% | 0.249 | S | C | . | . | trans | -66.5 | 124.2 | 174.4 | -174.2 | -74.9 | 0 | 0 | 0 | 110 | H144 V145 L146 Y288 | N142-H144 VanDerWaalsContact C-N 3.28Å; N142-H144 PolarHBondContact O-N 3.48Å; N142-H144 WeakPolarHBondContact OD1-CB 3.2Å; N142-H144 PolarHBondContact OD1-N 3.03Å; N142-V145 HydrophobicContact CB-CB 4.27Å; N142-V145 HydrophobicContact CB-CG2 4.03Å; N142-V145 PolarHBondContact O-N 3.16Å; N142-V145 VanDerWaalsContact O-N 3.08Å; N142-L146 PolarHBondContact O-N 2.93Å; N142-Y288 HydrophobicContact CB-CD2 4.48Å; N142-Y288 HydrophobicContact CB-CE2 4.24Å | ||
| 143 | P | 89.6 | Confident | 92 | Very high | 31 Ų | 31 | 45 Ų | 45 | 20% | 0.201 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -54 | -39.1 | -177.6 | -32.6 | 38.6 | 0 | 0 | 0 | 114.4 | F138 T141 L146 L147 L191 | F138-P143 HydrophobicContact CD2-CB 4.28Å; F138-P143 HydrophobicContact CE1-CG 4.03Å; F138-P143 HydrophobicContact CE2-CB 3.57Å; F138-P143 HydrophobicContact CE2-CG 3.96Å; F138-P143 HydrophobicContact CZ-CB 3.71Å; F138-P143 HydrophobicContact CZ-CG 3.7Å; T141-P143 WeakPolarHBondContact O-CD 3.38Å; P143-L146 PolarHBondContact O-N 3.42Å; P143-L147 WeakPolarHBondContact O-CB 3.14Å; P143-L147 VanDerWaalsContact O-CG 3.27Å; P143-L147 WeakPolarHBondContact O-CG 3.31Å; P143-L147 PolarHBondContact O-N 3.09Å; P143-L191 HydrophobicContact CB-CD1 3.94Å; P143-L191 HydrophobicContact CB-CD2 4.38Å |
| 144 | H | 92.6 | Very high | 92.2 | Very high | 40 Ų | 40 | 41.2 Ų | 41.2 | 19% | 0.185 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -69.4 | -38.9 | -179.5 | -59.9 | -53.5 | 0 | 0 | 0 | 112.1 | N142 G148 | N142-H144 VanDerWaalsContact C-N 3.28Å; N142-H144 PolarHBondContact O-N 3.48Å; N142-H144 WeakPolarHBondContact OD1-CB 3.2Å; N142-H144 PolarHBondContact OD1-N 3.03Å; H144-G148 PolarHBondContact O-N 2.7Å |
| 145 | V | 94.5 | Very high | 92.5 | Very high | 40 Ų | 40 | 41.2 Ų | 41.2 | 24% | 0.242 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -67.1 | -45.2 | 175.9 | 178.1 | 0 | 0 | 0 | 0 | 110.2 | N142 L147 G148 V149 Y288 | N142-V145 HydrophobicContact CB-CB 4.27Å; N142-V145 HydrophobicContact CB-CG2 4.03Å; N142-V145 PolarHBondContact O-N 3.16Å; N142-V145 VanDerWaalsContact O-N 3.08Å; V145-L147 PolarHBondContact O-N 3.35Å; V145-G148 PolarHBondContact O-N 3.46Å; V145-V149 HydrophobicContact CG1-CG2 4.28Å; V145-V149 WeakPolarHBondContact O-CG2 3.41Å; V145-V149 PolarHBondContact O-N 3.47Å; V145-Y288 HydrophobicContact CG2-CD1 3.78Å; V145-Y288 HydrophobicContact CG2-CD2 3.35Å; V145-Y288 HydrophobicContact CG2-CE1 3.94Å; V145-Y288 HydrophobicContact CG2-CE2 3.52Å; V145-Y288 HydrophobicContact CG2-CG 3.47Å; V145-Y288 VanDerWaalsContact CG2-CG 3.47Å |
| 146 | L | 94.8 | Very high | 92.8 | Very high | 12 Ų | 12 | 47.5 Ų | 47.5 | 6% | 0.063 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -57.7 | -51.4 | 178.6 | 176.5 | 56.7 | 0 | 0 | 0 | 111.9 | L137 F138 N142 P143 V149 S150 V183 | L137-L146 HydrophobicContact CB-CD1 4.25Å; L137-L146 HydrophobicContact CB-CD2 4.18Å; L137-L146 HydrophobicContact CD2-CD1 3.32Å; L137-L146 HydrophobicContact CG-CD1 3.63Å; L137-L146 HydrophobicContact CG-CD2 4.2Å; F138-L146 VanDerWaalsContact CA-CD2 3.43Å; F138-L146 HydrophobicContact CB-CD2 3.87Å; F138-L146 HydrophobicContact CD2-CD2 4.1Å; F138-L146 HydrophobicContact CG-CD2 4.44Å; N142-L146 PolarHBondContact O-N 2.93Å; P143-L146 PolarHBondContact O-N 3.42Å; L146-V149 PolarHBondContact O-N 3.05Å; L146-S150 WeakPolarHBondContact O-CB 3.42Å; L146-S150 PolarHBondContact O-N 2.82Å; L146-V183 HydrophobicContact CD1-CG1 3.7Å; L146-V183 HydrophobicContact CD2-CG1 4.26Å; L146-V183 HydrophobicContact CG-CG1 3.87Å |
| 147 | L | 94.9 | Very high | 93 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.7 | -38.5 | 177.9 | -64.5 | -174.9 | 0 | 0 | 0 | 111.6 | L84 P143 V145 S150 M151 L184 L191 F284 | L84-L147 HydrophobicContact CD2-CD1 3.71Å; P143-L147 WeakPolarHBondContact O-CB 3.14Å; P143-L147 VanDerWaalsContact O-CG 3.27Å; P143-L147 WeakPolarHBondContact O-CG 3.31Å; P143-L147 PolarHBondContact O-N 3.09Å; V145-L147 PolarHBondContact O-N 3.35Å; L147-S150 PolarHBondContact O-N 3.01Å; L147-M151 WeakPolarHBondContact O-CB 3.49Å; L147-M151 WeakPolarHBondContact O-CG 3.26Å; L147-M151 PolarHBondContact O-N 3.4Å; L147-L184 HydrophobicContact CD2-CD1 4.01Å; L147-L191 HydrophobicContact CD1-CB 4.42Å; L147-L191 HydrophobicContact CD1-CD2 3.56Å; L147-F284 HydrophobicContact CB-CD1 4.31Å; L147-F284 HydrophobicContact CB-CD2 4.45Å; L147-F284 HydrophobicContact CB-CE1 4.18Å; L147-F284 HydrophobicContact CB-CE2 4.31Å; L147-F284 HydrophobicContact CB-CG 4.45Å; L147-F284 HydrophobicContact CB-CZ 4.18Å; L147-F284 HydrophobicContact CD1-CE1 4.08Å; L147-F284 HydrophobicContact CD1-CZ 4.16Å |
| 148 | G | 95.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -59.5 | -46.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | H144 V145 M151 L152 S281 | H144-G148 PolarHBondContact O-N 2.7Å; V145-G148 PolarHBondContact O-N 3.46Å; G148-M151 PolarHBondContact O-N 3.14Å; G148-L152 WeakPolarHBondContact O-CB 3.26Å; G148-L152 PolarHBondContact O-N 3.23Å; G148-S281 PolarHBondContact O-OG 2.9Å |
| 149 | V | 96.3 | Very high | 93.5 | Very high | 75 Ų | 75 | 42.8 Ų | 42.8 | 46% | 0.455 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -65.5 | -42.9 | 176.5 | 171.2 | 0 | 0 | 0 | 0 | 111.2 | V145 L146 M151 L152 L153 F285 | V145-V149 HydrophobicContact CG1-CG2 4.28Å; V145-V149 WeakPolarHBondContact O-CG2 3.41Å; V145-V149 PolarHBondContact O-N 3.47Å; L146-V149 PolarHBondContact O-N 3.05Å; V149-M151 VanDerWaalsContact C-N 3.35Å; V149-M151 PolarHBondContact O-N 3.3Å; V149-L152 WeakPolarHBondContact O-CB 3.46Å; V149-L152 PolarHBondContact O-N 3.5Å; V149-L153 WeakPolarHBondContact O-CB 3.33Å; V149-L153 PolarHBondContact O-N 3.06Å; V149-F285 HydrophobicContact CG2-CE1 4.25Å; V149-F285 HydrophobicContact CG2-CZ 3.97Å |
| 150 | S | 96.4 | Very high | 93.8 | Very high | 6 Ų | 6 | 39 Ų | 39 | 4% | 0.042 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -58.6 | -46 | 174.6 | 166.3 | 0 | 0 | 0 | 0 | 111.7 | L146 L147 L152 L153 T154 S180 | L146-S150 WeakPolarHBondContact O-CB 3.42Å; L146-S150 PolarHBondContact O-N 2.82Å; L147-S150 PolarHBondContact O-N 3.01Å; S150-L152 VanDerWaalsContact C-N 3.32Å; S150-L152 PolarHBondContact O-N 3.46Å; S150-L153 PolarHBondContact O-N 3.37Å; S150-T154 PolarHBondContact O-N 3.02Å; S150-T154 PolarHBondContact O-OG1 2.99Å; S150-S180 VanDerWaalsContact O-CB 3.29Å; S150-S180 WeakPolarHBondContact O-CB 3.37Å; S150-S180 VanDerWaalsContact OG-C 3.26Å; S150-S180 WeakPolarHBondContact OG-CA 3.44Å; S150-S180 WeakPolarHBondContact OG-CB 3.48Å; S150-S180 PolarHBondContact OG-O 2.86Å |
| 151 | M | 96.1 | Very high | 94.1 | Very high | 1 Ų | 1 | 32.6 Ų | 32.6 | 1% | 0.005 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.4 | -37.2 | 177.6 | -69.1 | -61.4 | -72.9 | 0 | 0 | 112.4 | L147 G148 V149 T154 A155 L184 L277 I280 F284 | L147-M151 WeakPolarHBondContact O-CB 3.49Å; L147-M151 WeakPolarHBondContact O-CG 3.26Å; L147-M151 PolarHBondContact O-N 3.4Å; G148-M151 PolarHBondContact O-N 3.14Å; V149-M151 VanDerWaalsContact C-N 3.35Å; V149-M151 PolarHBondContact O-N 3.3Å; M151-T154 PolarHBondContact O-N 2.92Å; M151-A155 WeakPolarHBondContact O-CB 3.31Å; M151-A155 PolarHBondContact O-N 3.46Å; M151-L184 HydrophobicContact CG-CD1 4.37Å; M151-L184 HydrophobicContact SD-CD1 3.96Å; M151-L184 HydrophobicContact SD-CD2 3.49Å; M151-L184 WeakPolarHBondContact SD-CD2 3.49Å; M151-L184 HydrophobicContact SD-CG 4.29Å; M151-L277 HydrophobicContact CE-CB 4.29Å; M151-L277 HydrophobicContact CE-CD2 3.22Å; M151-L277 HydrophobicContact CE-CG 4.35Å; M151-L277 HydrophobicContact SD-CD2 4.29Å; M151-I280 HydrophobicContact CE-CB 3.96Å; M151-I280 HydrophobicContact CE-CG2 3.8Å; M151-F284 HydrophobicContact CG-CD2 4.35Å; M151-F284 HydrophobicContact CG-CE2 4.27Å |
| 152 | L | 96.8 | Very high | 94.1 | Very high | 76 Ų | 76 | 30.6 Ų | 30.6 | 40% | 0.398 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -63.9 | -44.9 | 174.9 | -174.7 | 62.3 | 0 | 0 | 0 | 111.5 | G148 V149 S150 T154 A155 F156 L278 S281 | G148-L152 WeakPolarHBondContact O-CB 3.26Å; G148-L152 PolarHBondContact O-N 3.23Å; V149-L152 WeakPolarHBondContact O-CB 3.46Å; V149-L152 PolarHBondContact O-N 3.5Å; S150-L152 VanDerWaalsContact C-N 3.32Å; S150-L152 PolarHBondContact O-N 3.46Å; L152-T154 VanDerWaalsContact C-N 3.32Å; L152-T154 PolarHBondContact O-N 2.91Å; L152-A155 PolarHBondContact O-N 3.25Å; L152-F156 PolarHBondContact O-N 2.95Å; L152-L278 HydrophobicContact CD1-CD1 3.47Å; L152-L278 VanDerWaalsContact CD1-CD1 3.47Å; L152-S281 WeakPolarHBondContact CB-OG 3.37Å; L152-S281 PolarHBondContact N-OG 3.39Å |
| 153 | L | 96.4 | Very high | 93.9 | Very high | 66 Ų | 66 | 34.7 Ų | 34.7 | 35% | 0.346 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -63.6 | -40.9 | 178.1 | -173.5 | 58.3 | 0 | 0 | 0 | 111.2 | V149 S150 F156 G157 V176 | V149-L153 WeakPolarHBondContact O-CB 3.33Å; V149-L153 PolarHBondContact O-N 3.06Å; S150-L153 PolarHBondContact O-N 3.37Å; L153-F156 PolarHBondContact O-N 3.31Å; L153-G157 PolarHBondContact O-N 3.36Å; L153-V176 HydrophobicContact CD1-CG1 3.51Å; L153-V176 HydrophobicContact CD2-CG1 3.88Å; L153-V176 HydrophobicContact CG-CG1 3.64Å |
| 154 | T | 95.7 | Very high | 93.8 | Very high | 3 Ų | 3 | 33.3 Ų | 33.3 | 2% | 0.018 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.8 | -48.5 | 173.2 | -47.8 | 0 | 0 | 0 | 0 | 110.5 | S150 M151 L152 F156 G157 M158 V177 S180 M181 L277 | S150-T154 PolarHBondContact O-N 3.02Å; S150-T154 PolarHBondContact O-OG1 2.99Å; M151-T154 PolarHBondContact O-N 2.92Å; L152-T154 VanDerWaalsContact C-N 3.32Å; L152-T154 PolarHBondContact O-N 2.91Å; T154-F156 PolarHBondContact O-N 2.97Å; T154-G157 PolarHBondContact O-N 2.88Å; T154-M158 VanDerWaalsContact O-CG 3.27Å; T154-M158 WeakPolarHBondContact O-CG 3.43Å; T154-M158 PolarHBondContact O-N 3.5Å; T154-V177 HydrophobicContact CG2-CG1 4.21Å; T154-S180 VanDerWaalsContact OG1-CB 3.23Å; T154-S180 WeakPolarHBondContact OG1-CB 3.23Å; T154-S180 PolarHBondContact OG1-OG 3.47Å; T154-M181 HydrophobicContact CG2-CE 3.79Å; T154-M181 HydrophobicContact CG2-CG 4.3Å; T154-L277 HydrophobicContact CG2-CD1 3.69Å |
| 155 | A | 96.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -59.1 | -45.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | M151 L152 G157 M158 F159 G274 L277 L278 | M151-A155 WeakPolarHBondContact O-CB 3.31Å; M151-A155 PolarHBondContact O-N 3.46Å; L152-A155 PolarHBondContact O-N 3.25Å; A155-G157 PolarHBondContact O-N 3.48Å; A155-M158 PolarHBondContact O-N 3.32Å; A155-F159 HydrophobicContact CB-CE2 4.49Å; A155-F159 WeakPolarHBondContact O-CD2 3.4Å; A155-F159 WeakPolarHBondContact O-CG 3.43Å; A155-F159 PolarHBondContact O-N 3.12Å; A155-G274 WeakPolarHBondContact CB-O 3.23Å; A155-L277 HydrophobicContact CB-CB 3.93Å; A155-L278 HydrophobicContact CB-CB 4.07Å |
| 156 | F | 95.6 | Very high | 92.9 | Very high | 132 Ų | 132 | 43.7 Ų | 43.7 | 58% | 0.579 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -58.8 | -47 | 175.1 | 175.2 | -98.3 | 0 | 0 | 0 | 111.8 | L152 L153 T154 M158 F159 A160 | L152-F156 PolarHBondContact O-N 2.95Å; L153-F156 PolarHBondContact O-N 3.31Å; T154-F156 PolarHBondContact O-N 2.97Å; F156-M158 VanDerWaalsContact C-N 3.33Å; F156-M158 PolarHBondContact O-N 2.89Å; F156-F159 PolarHBondContact O-N 3.16Å; F156-A160 WeakPolarHBondContact O-CB 3.41Å; F156-A160 PolarHBondContact O-N 2.94Å |
| 157 | G | 94.8 | Very high | 92.4 | Very high | 1 Ų | 1 | 43.4 Ų | 43.4 | 1% | 0.01 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.4 | -42.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L153 T154 A155 F159 A160 I161 | L153-G157 PolarHBondContact O-N 3.36Å; T154-G157 PolarHBondContact O-N 2.88Å; A155-G157 PolarHBondContact O-N 3.48Å; G157-F159 VanDerWaalsContact C-N 3.34Å; G157-F159 PolarHBondContact O-N 2.98Å; G157-A160 PolarHBondContact O-N 3.3Å; G157-A160 VanDerWaalsContact O-N 3.12Å; G157-I161 VanDerWaalsContact O-CG1 3.26Å; G157-I161 WeakPolarHBondContact O-CG1 3.47Å; G157-I161 PolarHBondContact O-N 3.2Å |
| 158 | M | 93.5 | Very high | 92 | Very high | 2 Ų | 2 | 49.8 Ų | 49.8 | 1% | 0.01 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.8 | -40.8 | 174.7 | -64.6 | -57.9 | -80.6 | 0 | 0 | 112.1 | V97 T154 A155 F156 A160 I161 P162 Y270 I273 L277 | V97-M158 HydrophobicContact CG1-CE 3.94Å; T154-M158 VanDerWaalsContact O-CG 3.27Å; T154-M158 WeakPolarHBondContact O-CG 3.43Å; T154-M158 PolarHBondContact O-N 3.5Å; A155-M158 PolarHBondContact O-N 3.32Å; F156-M158 VanDerWaalsContact C-N 3.33Å; F156-M158 PolarHBondContact O-N 2.89Å; M158-A160 VanDerWaalsContact C-N 3.34Å; M158-A160 PolarHBondContact O-N 2.63Å; M158-I161 HydrophobicContact SD-CD1 4.08Å; M158-P162 VanDerWaalsContact O-CD 3.31Å; M158-P162 WeakPolarHBondContact O-CD 3.37Å; M158-Y270 HydrophobicContact CE-CD1 3.47Å; M158-Y270 VanDerWaalsContact CE-CD1 3.47Å; M158-Y270 HydrophobicContact CE-CE1 4.05Å; M158-Y270 HydrophobicContact CE-CG 4.41Å; M158-Y270 WeakPolarHBondContact O-CB 3.44Å; M158-Y270 HydrophobicContact SD-CD1 3.96Å; M158-Y270 HydrophobicContact SD-CE1 4.41Å; M158-I273 HydrophobicContact CE-CB 3.91Å; M158-I273 HydrophobicContact CE-CD1 4.17Å; M158-I273 HydrophobicContact CE-CG2 3.66Å; M158-L277 HydrophobicContact CG-CD1 3.86Å |
| 159 | F | 94.1 | Very high | 91.7 | Very high | 56 Ų | 56 | 55.4 Ų | 55.4 | 25% | 0.246 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.1 | -33.6 | 173.8 | -66.4 | -47.1 | 0 | 0 | 0 | 113.2 | A155 F156 G157 F163 I271 G274 L278 | A155-F159 HydrophobicContact CB-CE2 4.49Å; A155-F159 WeakPolarHBondContact O-CD2 3.4Å; A155-F159 WeakPolarHBondContact O-CG 3.43Å; A155-F159 PolarHBondContact O-N 3.12Å; F156-F159 PolarHBondContact O-N 3.16Å; G157-F159 VanDerWaalsContact C-N 3.34Å; G157-F159 PolarHBondContact O-N 2.98Å; F159-F163 WeakPolarHBondContact O-CD2 3.42Å; F159-F163 WeakPolarHBondContact O-CE2 3.4Å; F159-I271 HydrophobicContact CD1-CB 4.5Å; F159-I271 HydrophobicContact CD1-CD1 3.83Å; F159-I271 HydrophobicContact CD1-CG2 4.18Å; F159-I271 HydrophobicContact CE1-CG2 3.96Å; F159-I271 WeakPolarHBondContact CE1-O 3.47Å; F159-G274 VanDerWaalsContact CZ-C 3.41Å; F159-L278 HydrophobicContact CE2-CD2 4.38Å |
| 160 | A | 92.3 | Very high | 91.4 | Very high | 18 Ų | 18 | 51.9 Ų | 51.9 | 15% | 0.149 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -75.8 | -33.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | F156 G157 M158 F163 C164 I173 | F156-A160 WeakPolarHBondContact O-CB 3.41Å; F156-A160 PolarHBondContact O-N 2.94Å; G157-A160 PolarHBondContact O-N 3.3Å; G157-A160 VanDerWaalsContact O-N 3.12Å; M158-A160 VanDerWaalsContact C-N 3.34Å; M158-A160 PolarHBondContact O-N 2.63Å; A160-F163 PolarHBondContact O-N 3.43Å; A160-F163 VanDerWaalsContact O-N 3.08Å; A160-C164 PolarHBondContact O-N 2.92Å; A160-C164 PolarHBondContact O-SG 3.43Å; A160-I173 HydrophobicContact CB-CD1 4.25Å; A160-I173 HydrophobicContact CB-CG1 4.45Å; A160-I173 HydrophobicContact CB-CG2 4.13Å |
| 161 | I | 91 | Very high | 91.1 | Very high | 1 Ų | 1 | 52.5 Ų | 52.5 | 1% | 0.005 | 25% | 0.252 | C | S | . | . | G | 310 helix | trans | -50.7 | -50 | -174.2 | -76 | 161.1 | 0 | 0 | 0 | 113.4 | L105 G157 M158 F163 C164 L170 I173 M174 Y270 | L105-I161 HydrophobicContact CD2-CG2 4.12Å; G157-I161 VanDerWaalsContact O-CG1 3.26Å; G157-I161 WeakPolarHBondContact O-CG1 3.47Å; G157-I161 PolarHBondContact O-N 3.2Å; M158-I161 HydrophobicContact SD-CD1 4.08Å; I161-F163 PolarHBondContact O-N 3.1Å; I161-C164 WeakPolarHBondContact O-CB 3.36Å; I161-C164 PolarHBondContact O-N 3.32Å; I161-L170 HydrophobicContact CB-CD1 4.3Å; I161-L170 HydrophobicContact CG1-CD1 4.06Å; I161-L170 HydrophobicContact CG2-CD1 4.02Å; I161-I173 HydrophobicContact CG1-CG2 3.9Å; I161-M174 HydrophobicContact CD1-CE 3.51Å; I161-M174 HydrophobicContact CD1-SD 3.68Å; I161-M174 HydrophobicContact CG1-CE 3.78Å; I161-M174 HydrophobicContact CG1-SD 4.26Å; I161-M174 HydrophobicContact CG2-CE 3.9Å; I161-Y270 HydrophobicContact CB-CD1 4.16Å; I161-Y270 HydrophobicContact CB-CE1 4.33Å; I161-Y270 HydrophobicContact CD1-CD1 3.99Å; I161-Y270 HydrophobicContact CD1-CE1 3.86Å; I161-Y270 HydrophobicContact CG2-CD1 3.91Å; I161-Y270 HydrophobicContact CG2-CD2 4.29Å; I161-Y270 HydrophobicContact CG2-CE1 3.71Å; I161-Y270 HydrophobicContact CG2-CE2 4.09Å; I161-Y270 HydrophobicContact CG2-CG 4.2Å |
| 162 | P | 87.4 | Confident | 90.9 | Very high | 14 Ų | 14 | 54.3 Ų | 54.3 | 9% | 0.091 | 27% | 0.27 | C | S | . | . | G | 310 helix | trans | -59.1 | -28.8 | -179.7 | -29.3 | 38.2 | 0 | 0 | 0 | 115 | N108 M158 M267 Y270 I271 | N108-P162 PolarHBondContact ND2-O 2.82Å; M158-P162 VanDerWaalsContact O-CD 3.31Å; M158-P162 WeakPolarHBondContact O-CD 3.37Å; P162-M267 HydrophobicContact CB-CB 4.07Å; P162-M267 HydrophobicContact CB-SD 4.12Å; P162-M267 HydrophobicContact CG-CB 4.27Å; P162-Y270 HydrophobicContact CG-CD2 4.32Å; P162-Y270 HydrophobicContact CG-CG 4.27Å; P162-I271 HydrophobicContact CG-CD1 4.12Å |
| 163 | F | 87.3 | Confident | 90.7 | Very high | 154 Ų | 154 | 51.5 Ų | 51.5 | 68% | 0.675 | 26% | 0.256 | S | S | * | . | G | 310 helix | trans | -90.9 | -4.9 | -174.9 | -55.1 | -73.3 | 0 | 0 | 0 | 113.2 | F159 A160 I161 K165 I271 | F159-F163 WeakPolarHBondContact O-CD2 3.42Å; F159-F163 WeakPolarHBondContact O-CE2 3.4Å; A160-F163 PolarHBondContact O-N 3.43Å; A160-F163 VanDerWaalsContact O-N 3.08Å; I161-F163 PolarHBondContact O-N 3.1Å; F163-K165 PolarHBondContact O-N 2.86Å; F163-I271 HydrophobicContact CE2-CD1 4.24Å |
| 164 | C | 85.7 | Confident | 90.5 | Very high | 3 Ų | 3 | 48.5 Ų | 48.5 | 2% | 0.02 | 24% | 0.24 | C | C | . | . | trans | -77.4 | 109.4 | -178.3 | -66.4 | 0 | 0 | 0 | 0 | 111.5 | N108 V109 A160 I161 F169 L170 | N108-C164 PolarHBondContact ND2-O 3Å; V109-C164 WeakPolarHBondContact CG2-O 3.41Å; A160-C164 PolarHBondContact O-N 2.92Å; A160-C164 PolarHBondContact O-SG 3.43Å; I161-C164 WeakPolarHBondContact O-CB 3.36Å; I161-C164 PolarHBondContact O-N 3.32Å; C164-F169 HydrophobicContact CB-CD1 4.24Å; C164-F169 VanDerWaalsContact SG-CD1 3.56Å; C164-L170 HydrophobicContact CB-CB 3.87Å; C164-L170 HydrophobicContact CB-CD1 3.93Å; C164-L170 HydrophobicContact CB-CG 4.36Å | ||
| 165 | K | 83.8 | Confident | 90.5 | Very high | 154 Ų | 154 | 49.8 Ų | 49.8 | 67% | 0.67 | 25% | 0.249 | S | C | * | . | trans | -92.9 | -11.5 | 175.6 | -60.4 | -176.4 | -178.9 | 178.7 | 0 | 114.1 | F163 | F163-K165 PolarHBondContact O-N 2.86Š| ||
| 166 | Q | 85.9 | Confident | 90.4 | Very high | 143 Ų | 143 | 52.2 Ų | 52.2 | 67% | 0.668 | 26% | 0.264 | S | S | * | . | S | Bend | trans | -110.6 | 130.8 | 179.8 | -70.9 | -173.9 | -0.6 | 0 | 0 | 110.8 | L168 F169 L170 | Q166-L168 PolarHBondContact O-N 2.83Å; Q166-F169 HydrophobicContact CB-CB 4.08Å; Q166-F169 PolarHBondContact O-N 2.82Å; Q166-L170 WeakPolarHBondContact O-CB 3.47Å; Q166-L170 PolarHBondContact O-N 2.89Å |
| 167 | A | 83.8 | Confident | 90.4 | Very high | 6 Ų | 6 | 46 Ų | 46 | 5% | 0.05 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64.9 | -41 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | V109 K111 Y118 L170 T171 | V109-A167 HydrophobicContact CG1-CB 3.27Å; V109-A167 VanDerWaalsContact CG1-N 3.27Å; K111-A167 HydrophobicContact CD-CB 3.74Å; Y118-A167 WeakPolarHBondContact OH-CB 3.46Å; A167-L170 PolarHBondContact O-N 3.45Å; A167-T171 PolarHBondContact O-N 3.18Å; A167-T171 PolarHBondContact O-OG1 3.31Å; A167-T171 VanDerWaalsContact O-OG1 3.08Å |
| 168 | L | 86.5 | Confident | 90.4 | Very high | 135 Ų | 135 | 45.9 Ų | 45.9 | 71% | 0.707 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -68.3 | -40.2 | 178.6 | -66.6 | 176.6 | 0 | 0 | 0 | 111.5 | Y118 Q166 T171 G172 | Y118-L168 HydrophobicContact CE2-CD2 4.27Å; Q166-L168 PolarHBondContact O-N 2.83Å; L168-T171 PolarHBondContact O-N 3.32Å; L168-G172 PolarHBondContact O-N 3.27Å |
| 169 | F | 89.6 | Confident | 90.5 | Very high | 117 Ų | 117 | 49.2 Ų | 49.2 | 51% | 0.513 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 175.9 | -175.2 | -109.4 | 0 | 0 | 0 | 111.4 | C164 Q166 T171 G172 I173 | C164-F169 HydrophobicContact CB-CD1 4.24Å; C164-F169 VanDerWaalsContact SG-CD1 3.56Å; Q166-F169 HydrophobicContact CB-CB 4.08Å; Q166-F169 PolarHBondContact O-N 2.82Å; F169-T171 VanDerWaalsContact C-N 3.33Å; F169-T171 PolarHBondContact O-N 2.71Å; F169-G172 WeakPolarHBondContact O-CA 3.31Å; F169-G172 PolarHBondContact O-N 3.29Å; F169-G172 VanDerWaalsContact O-N 3.1Å; F169-I173 HydrophobicContact CD1-CG1 4.42Å; F169-I173 HydrophobicContact CE1-CD1 4.4Å; F169-I173 HydrophobicContact CE1-CG1 4.05Å; F169-I173 HydrophobicContact CZ-CD1 4.08Å; F169-I173 HydrophobicContact CZ-CG1 4.17Å; F169-I173 PolarHBondContact O-N 2.77Å |
| 170 | L | 89.5 | Confident | 90.6 | Very high | 1 Ų | 1 | 46.7 Ų | 46.7 | 1% | 0.005 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59.2 | -42 | 174.3 | 179.5 | 56.5 | 0 | 0 | 0 | 112.1 | L105 V109 I116 I119 I161 C164 Q166 A167 G172 I173 M174 | L105-L170 HydrophobicContact CD2-CD2 4.11Å; L105-L170 HydrophobicContact CG-CD2 4.43Å; V109-L170 HydrophobicContact CG2-CD2 3.77Å; I116-L170 HydrophobicContact CD1-CD2 4.22Å; I119-L170 HydrophobicContact CD1-CB 4.45Å; I119-L170 HydrophobicContact CD1-CD2 3.42Å; I119-L170 VanDerWaalsContact CD1-CD2 3.42Å; I119-L170 HydrophobicContact CD1-CG 3.63Å; I119-L170 HydrophobicContact CG1-CG 4.43Å; I161-L170 HydrophobicContact CB-CD1 4.3Å; I161-L170 HydrophobicContact CG1-CD1 4.06Å; I161-L170 HydrophobicContact CG2-CD1 4.02Å; C164-L170 HydrophobicContact CB-CB 3.87Å; C164-L170 HydrophobicContact CB-CD1 3.93Å; C164-L170 HydrophobicContact CB-CG 4.36Å; Q166-L170 WeakPolarHBondContact O-CB 3.47Å; Q166-L170 PolarHBondContact O-N 2.89Å; A167-L170 PolarHBondContact O-N 3.45Å; L170-G172 VanDerWaalsContact C-N 3.35Å; L170-I173 PolarHBondContact O-N 3.02Å; L170-M174 HydrophobicContact CD1-CE 4.03Å; L170-M174 HydrophobicContact CD1-CG 4.21Å; L170-M174 WeakPolarHBondContact O-CB 3.43Å; L170-M174 WeakPolarHBondContact O-CG 3.42Å; L170-M174 PolarHBondContact O-N 3.46Å |
| 171 | T | 90.2 | Very high | 90.7 | Very high | 20 Ų | 20 | 45.9 Ų | 45.9 | 12% | 0.123 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.8 | -42.2 | 172.9 | -59.9 | 0 | 0 | 0 | 0 | 112 | Y118 I119 A167 L168 F169 I173 M174 S175 | Y118-T171 HydrophobicContact CD2-CG2 4.05Å; Y118-T171 WeakPolarHBondContact CD2-OG1 3.47Å; Y118-T171 HydrophobicContact CE2-CG2 4.47Å; Y118-T171 WeakPolarHBondContact CE2-OG1 3.14Å; I119-T171 WeakPolarHBondContact CG1-OG1 3.37Å; A167-T171 PolarHBondContact O-N 3.18Å; A167-T171 PolarHBondContact O-OG1 3.31Å; A167-T171 VanDerWaalsContact O-OG1 3.08Å; L168-T171 PolarHBondContact O-N 3.32Å; F169-T171 VanDerWaalsContact C-N 3.33Å; F169-T171 PolarHBondContact O-N 2.71Å; T171-I173 PolarHBondContact O-N 3.5Å; T171-M174 PolarHBondContact O-N 2.89Å; T171-S175 PolarHBondContact O-N 3.37Å; T171-S175 PolarHBondContact O-OG 3.24Å |
| 172 | G | 92.3 | Very high | 90.9 | Very high | 38 Ų | 38 | 45.8 Ų | 45.8 | 39% | 0.392 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -58.1 | -47 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L168 F169 L170 M174 S175 V176 | L168-G172 PolarHBondContact O-N 3.27Å; F169-G172 WeakPolarHBondContact O-CA 3.31Å; F169-G172 PolarHBondContact O-N 3.29Å; F169-G172 VanDerWaalsContact O-N 3.1Å; L170-G172 VanDerWaalsContact C-N 3.35Å; G172-M174 VanDerWaalsContact C-N 3.34Å; G172-M174 PolarHBondContact O-N 3.48Å; G172-S175 WeakPolarHBondContact O-CB 2.98Å; G172-S175 PolarHBondContact O-N 3.14Å; G172-V176 WeakPolarHBondContact O-CG2 3.47Å; G172-V176 PolarHBondContact O-N 3.43Å |
| 173 | I | 93.4 | Very high | 91.3 | Very high | 18 Ų | 18 | 45.6 Ų | 45.6 | 9% | 0.092 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.2 | -43 | 175 | -64.7 | -62.2 | 0 | 0 | 0 | 111.2 | A160 I161 F169 L170 T171 S175 V176 V177 | A160-I173 HydrophobicContact CB-CD1 4.25Å; A160-I173 HydrophobicContact CB-CG1 4.45Å; A160-I173 HydrophobicContact CB-CG2 4.13Å; I161-I173 HydrophobicContact CG1-CG2 3.9Å; F169-I173 HydrophobicContact CD1-CG1 4.42Å; F169-I173 HydrophobicContact CE1-CD1 4.4Å; F169-I173 HydrophobicContact CE1-CG1 4.05Å; F169-I173 HydrophobicContact CZ-CD1 4.08Å; F169-I173 HydrophobicContact CZ-CG1 4.17Å; F169-I173 PolarHBondContact O-N 2.77Å; L170-I173 PolarHBondContact O-N 3.02Å; T171-I173 PolarHBondContact O-N 3.5Å; I173-S175 VanDerWaalsContact C-N 3.33Å; I173-S175 PolarHBondContact O-N 2.95Å; I173-V176 WeakPolarHBondContact O-CB 3.16Å; I173-V176 PolarHBondContact O-N 2.76Å; I173-V177 WeakPolarHBondContact O-CG2 3.49Å; I173-V177 PolarHBondContact O-N 3Å |
| 174 | M | 92.1 | Very high | 91.6 | Very high | 2 Ų | 2 | 38.4 Ų | 38.4 | 1% | 0.01 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.2 | -34.3 | 178.5 | -71.1 | -81.7 | -166.5 | 0 | 0 | 112.5 | L98 L105 I119 R123 I161 L170 T171 G172 G178 | L98-M174 HydrophobicContact CD1-CE 3.73Å; L105-M174 HydrophobicContact CD2-CE 3.64Å; I119-M174 HydrophobicContact CG2-CB 3.84Å; I119-M174 HydrophobicContact CG2-CE 4.2Å; I119-M174 HydrophobicContact CG2-CG 3.52Å; I119-M174 HydrophobicContact CG2-SD 4.06Å; R123-M174 WeakPolarHBondContact CA-O 3.29Å; R123-M174 HydrophobicContact CB-CB 4.39Å; I161-M174 HydrophobicContact CD1-CE 3.51Å; I161-M174 HydrophobicContact CD1-SD 3.68Å; I161-M174 HydrophobicContact CG1-CE 3.78Å; I161-M174 HydrophobicContact CG1-SD 4.26Å; I161-M174 HydrophobicContact CG2-CE 3.9Å; L170-M174 HydrophobicContact CD1-CE 4.03Å; L170-M174 HydrophobicContact CD1-CG 4.21Å; L170-M174 WeakPolarHBondContact O-CB 3.43Å; L170-M174 WeakPolarHBondContact O-CG 3.42Å; L170-M174 PolarHBondContact O-N 3.46Å; T171-M174 PolarHBondContact O-N 2.89Å; G172-M174 VanDerWaalsContact C-N 3.34Å; G172-M174 PolarHBondContact O-N 3.48Å; M174-G178 PolarHBondContact O-N 3.37Å |
| 175 | S | 94.5 | Very high | 92 | Very high | 31 Ų | 31 | 38.8 Ų | 38.8 | 22% | 0.217 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.7 | -43.4 | 170.6 | -68.6 | 0 | 0 | 0 | 0 | 111.8 | G122 T171 G172 I173 G178 I179 | G122-S175 WeakPolarHBondContact CA-OG 3.37Å; G122-S175 WeakPolarHBondContact O-CA 2.89Å; G122-S175 WeakPolarHBondContact O-CB 3.33Å; G122-S175 PolarHBondContact O-OG 3.16Å; T171-S175 PolarHBondContact O-N 3.37Å; T171-S175 PolarHBondContact O-OG 3.24Å; G172-S175 WeakPolarHBondContact O-CB 2.98Å; G172-S175 PolarHBondContact O-N 3.14Å; I173-S175 VanDerWaalsContact C-N 3.33Å; I173-S175 PolarHBondContact O-N 2.95Å; S175-G178 CarbonylContact O-C 3.59Å; S175-G178 WeakPolarHBondContact O-CA 3.12Å; S175-G178 PolarHBondContact O-N 3.12Å; S175-G178 VanDerWaalsContact O-N 3.12Å; S175-I179 WeakPolarHBondContact O-CG1 3.38Å; S175-I179 PolarHBondContact O-N 3.47Å |
| 176 | V | 94.9 | Very high | 92.5 | Very high | 51 Ų | 51 | 31.5 Ų | 31.5 | 31% | 0.309 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -62 | -43.7 | 176.1 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | L153 G172 I173 G178 I179 S180 | L153-V176 HydrophobicContact CD1-CG1 3.51Å; L153-V176 HydrophobicContact CD2-CG1 3.88Å; L153-V176 HydrophobicContact CG-CG1 3.64Å; G172-V176 WeakPolarHBondContact O-CG2 3.47Å; G172-V176 PolarHBondContact O-N 3.43Å; I173-V176 WeakPolarHBondContact O-CB 3.16Å; I173-V176 PolarHBondContact O-N 2.76Å; V176-G178 VanDerWaalsContact C-N 3.3Å; V176-G178 PolarHBondContact O-N 3.34Å; V176-I179 PolarHBondContact O-N 3.08Å; V176-S180 PolarHBondContact O-N 2.93Å; V176-S180 VanDerWaalsContact O-N 3.1Å; V176-S180 PolarHBondContact O-OG 2.92Å |
| 177 | V | 95.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.2 | -40 | 172 | 170.7 | 0 | 0 | 0 | 0 | 111.1 | T154 I173 S180 M181 | T154-V177 HydrophobicContact CG2-CG1 4.21Å; I173-V177 WeakPolarHBondContact O-CG2 3.49Å; I173-V177 PolarHBondContact O-N 3Å; V177-S180 PolarHBondContact O-N 2.75Å; V177-S180 PolarHBondContact O-OG 2.94Å; V177-M181 HydrophobicContact CG1-CE 3.56Å; V177-M181 HydrophobicContact CG1-CG 4.38Å; V177-M181 HydrophobicContact CG1-SD 3.87Å; V177-M181 WeakPolarHBondContact O-CB 3.47Å; V177-M181 WeakPolarHBondContact O-CG 3.49Å; V177-M181 PolarHBondContact O-N 3.36Å |
| 178 | G | 94.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57.3 | -50.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | R123 G126 Y127 M174 S175 V176 S180 M181 G182 | R123-G178 WeakPolarHBondContact O-CA 3.25Å; G126-G178 VanDerWaalsContact C-C 3.45Å; Y127-G178 VanDerWaalsContact CA-O 3.22Å; Y127-G178 WeakPolarHBondContact CA-O 3.48Å; M174-G178 PolarHBondContact O-N 3.37Å; S175-G178 CarbonylContact O-C 3.59Å; S175-G178 WeakPolarHBondContact O-CA 3.12Å; S175-G178 PolarHBondContact O-N 3.12Å; S175-G178 VanDerWaalsContact O-N 3.12Å; V176-G178 VanDerWaalsContact C-N 3.3Å; V176-G178 PolarHBondContact O-N 3.34Å; G178-S180 PolarHBondContact O-N 3.27Å; G178-M181 WeakPolarHBondContact O-CB 3.31Å; G178-M181 PolarHBondContact O-N 3.33Å; G178-G182 PolarHBondContact O-N 3.25Å |
| 179 | I | 96 | Very high | 93.5 | Very high | 72 Ų | 72 | 18 Ų | 18 | 37% | 0.369 | 10% | 0.104 | S | C | . | . | H | α-helix | trans | -55.8 | -50.7 | 179.5 | -68.7 | 166.6 | 0 | 0 | 0 | 110.9 | G126 G130 S175 V176 M181 G182 V183 | G126-I179 WeakPolarHBondContact O-CA 3.22Å; G126-I179 VanDerWaalsContact O-CG1 3.29Å; G126-I179 WeakPolarHBondContact O-CG1 3.39Å; G126-I179 PolarHBondContact O-N 3.21Å; G130-I179 WeakPolarHBondContact CA-O 3.21Å; S175-I179 WeakPolarHBondContact O-CG1 3.38Å; S175-I179 PolarHBondContact O-N 3.47Å; V176-I179 PolarHBondContact O-N 3.08Å; I179-M181 VanDerWaalsContact C-N 3.33Å; I179-M181 PolarHBondContact O-N 3.02Å; I179-G182 PolarHBondContact O-N 3.44Å; I179-V183 WeakPolarHBondContact O-CG2 3.39Å; I179-V183 PolarHBondContact O-N 2.92Å |
| 180 | S | 96.1 | Very high | 93.7 | Very high | 2 Ų | 2 | 12.5 Ų | 12.5 | 1% | 0.014 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -61.9 | -42.7 | 179.7 | 57.7 | 0 | 0 | 0 | 0 | 111.8 | S150 T154 V176 V177 G178 G182 V183 L184 | S150-S180 VanDerWaalsContact O-CB 3.29Å; S150-S180 WeakPolarHBondContact O-CB 3.37Å; S150-S180 VanDerWaalsContact OG-C 3.26Å; S150-S180 WeakPolarHBondContact OG-CA 3.44Å; S150-S180 WeakPolarHBondContact OG-CB 3.48Å; S150-S180 PolarHBondContact OG-O 2.86Å; T154-S180 VanDerWaalsContact OG1-CB 3.23Å; T154-S180 WeakPolarHBondContact OG1-CB 3.23Å; T154-S180 PolarHBondContact OG1-OG 3.47Å; V176-S180 PolarHBondContact O-N 2.93Å; V176-S180 VanDerWaalsContact O-N 3.1Å; V176-S180 PolarHBondContact O-OG 2.92Å; V177-S180 PolarHBondContact O-N 2.75Å; V177-S180 PolarHBondContact O-OG 2.94Å; G178-S180 PolarHBondContact O-N 3.27Å; S180-G182 PolarHBondContact O-N 2.91Å; S180-V183 PolarHBondContact O-N 3.18Å; S180-L184 WeakPolarHBondContact O-CB 2.88Å; S180-L184 PolarHBondContact O-N 3.04Å |
| 181 | M | 94.6 | Very high | 93.8 | Very high | 1 Ų | 1 | 13 Ų | 13 | 1% | 0.005 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -61 | -40 | 176.5 | -72.9 | -178.8 | 172.9 | 0 | 0 | 113.3 | L91 I95 R123 Y127 T154 V177 G178 I179 L184 D185 | L91-M181 HydrophobicContact CD1-CB 3.47Å; L91-M181 VanDerWaalsContact CD1-CB 3.47Å; L91-M181 HydrophobicContact CD1-CE 4.25Å; L91-M181 HydrophobicContact CD1-CG 3.31Å; L91-M181 HydrophobicContact CD1-SD 3.66Å; I95-M181 HydrophobicContact CG1-SD 4.35Å; R123-M181 VanDerWaalsContact NH2-CE 3.3Å; R123-M181 PolarHBondContact NH2-SD 3.15Å; Y127-M181 HydrophobicContact CD2-CB 3.84Å; Y127-M181 HydrophobicContact CE2-CB 4Å; T154-M181 HydrophobicContact CG2-CE 3.79Å; T154-M181 HydrophobicContact CG2-CG 4.3Å; V177-M181 HydrophobicContact CG1-CE 3.56Å; V177-M181 HydrophobicContact CG1-CG 4.38Å; V177-M181 HydrophobicContact CG1-SD 3.87Å; V177-M181 WeakPolarHBondContact O-CB 3.47Å; V177-M181 WeakPolarHBondContact O-CG 3.49Å; V177-M181 PolarHBondContact O-N 3.36Å; G178-M181 WeakPolarHBondContact O-CB 3.31Å; G178-M181 PolarHBondContact O-N 3.33Å; I179-M181 VanDerWaalsContact C-N 3.33Å; I179-M181 PolarHBondContact O-N 3.02Å; M181-L184 WeakPolarHBondContact O-CB 3.28Å; M181-L184 PolarHBondContact O-N 3.45Å; M181-D185 PolarHBondContact O-N 2.97Å |
| 182 | G | 94.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -65.8 | -40.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | S131 G178 I179 S180 L184 D185 T186 | S131-G182 VanDerWaalsContact OG-CA 3.25Å; S131-G182 WeakPolarHBondContact OG-CA 3.48Å; S131-G182 PolarHBondContact OG-O 2.8Å; G178-G182 PolarHBondContact O-N 3.25Å; I179-G182 PolarHBondContact O-N 3.44Å; S180-G182 PolarHBondContact O-N 2.91Å; G182-L184 VanDerWaalsContact C-N 3.32Å; G182-L184 PolarHBondContact O-N 3.46Å; G182-D185 PolarHBondContact O-N 2.86Å; G182-T186 WeakPolarHBondContact O-CB 3.4Å; G182-T186 PolarHBondContact O-N 3.48Å; G182-T186 PolarHBondContact O-OG1 3.21Å |
| 183 | V | 95.9 | Very high | 93.8 | Very high | 10 Ų | 10 | 10.3 Ų | 10.3 | 6% | 0.061 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -61 | -42.9 | 172.7 | 173.8 | 0 | 0 | 0 | 0 | 110.7 | G130 L146 I179 S180 G187 | G130-V183 VanDerWaalsContact O-CG2 3.23Å; G130-V183 WeakPolarHBondContact O-CG2 3.48Å; G130-V183 PolarHBondContact O-N 3.34Å; L146-V183 HydrophobicContact CD1-CG1 3.7Å; L146-V183 HydrophobicContact CD2-CG1 4.26Å; L146-V183 HydrophobicContact CG-CG1 3.87Å; I179-V183 WeakPolarHBondContact O-CG2 3.39Å; I179-V183 PolarHBondContact O-N 2.92Å; S180-V183 PolarHBondContact O-N 3.18Å; V183-G187 PolarHBondContact O-N 2.9Å |
| 184 | L | 95.3 | Very high | 93.5 | Very high | 2 Ų | 2 | 14.5 Ų | 14.5 | 1% | 0.01 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -64.9 | -46.4 | 179.7 | 175.3 | 66.2 | 0 | 0 | 0 | 111.9 | F88 L91 L147 M151 S180 M181 G182 G188 | F88-L184 HydrophobicContact CE2-CG 4.46Å; L91-L184 HydrophobicContact CB-CD2 4.06Å; L91-L184 HydrophobicContact CD1-CD2 4.47Å; L91-L184 HydrophobicContact CD2-CD2 4.4Å; L147-L184 HydrophobicContact CD2-CD1 4.01Å; M151-L184 HydrophobicContact CG-CD1 4.37Å; M151-L184 HydrophobicContact SD-CD1 3.96Å; M151-L184 HydrophobicContact SD-CD2 3.49Å; M151-L184 WeakPolarHBondContact SD-CD2 3.49Å; M151-L184 HydrophobicContact SD-CG 4.29Å; S180-L184 WeakPolarHBondContact O-CB 2.88Å; S180-L184 PolarHBondContact O-N 3.04Å; M181-L184 WeakPolarHBondContact O-CB 3.28Å; M181-L184 PolarHBondContact O-N 3.45Å; G182-L184 VanDerWaalsContact C-N 3.32Å; G182-L184 PolarHBondContact O-N 3.46Å; L184-G188 VanDerWaalsContact O-CA 3.29Å; L184-G188 WeakPolarHBondContact O-CA 3.19Å; L184-G188 PolarHBondContact O-N 2.95Å |
| 185 | D | 93.7 | Very high | 93.4 | Very high | 12 Ų | 12 | 15.3 Ų | 15.3 | 6% | 0.064 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -65.4 | -47.2 | -178.7 | -171.4 | 39.6 | 0 | 0 | 0 | 110.5 | F88 L91 Y127 M181 G182 N189 V443 | F88-D185 WeakPolarHBondContact CE1-OD1 3.27Å; F88-D185 WeakPolarHBondContact CZ-OD1 3.18Å; L91-D185 HydrophobicContact CD2-CB 4.46Å; Y127-D185 WeakPolarHBondContact OH-CB 3.45Å; Y127-D185 PolarHBondContact OH-OD2 2.81Å; M181-D185 PolarHBondContact O-N 2.97Å; G182-D185 PolarHBondContact O-N 2.86Å; D185-N189 WeakPolarHBondContact O-CB 3.38Å; D185-N189 VanDerWaalsContact O-CG 3.24Å; D185-N189 PolarHBondContact O-N 3.07Å; D185-N189 VanDerWaalsContact O-N 3.15Å; D185-N189 PolarHBondContact O-ND2 3.29Å; D185-N189 PolarHBondContact OD1-ND2 3.2Å; D185-V443 VanDerWaalsContact OD2-CG1 3.24Å; D185-V443 WeakPolarHBondContact OD2-CG1 3.33Å |
| 186 | T | 93.1 | Very high | 93 | Very high | 0 Ų | 0 | 14.9 Ų | 14.9 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -61.5 | -54.8 | 177.5 | -56.3 | 0 | 0 | 0 | 0 | 111.6 | S131 G182 V190 A439 A440 | S131-T186 VanDerWaalsContact CA-OG1 3.31Å; S131-T186 WeakPolarHBondContact CA-OG1 3.44Å; S131-T186 WeakPolarHBondContact CB-OG1 3.42Å; S131-T186 PolarHBondContact O-OG1 3.05Å; G182-T186 WeakPolarHBondContact O-CB 3.4Å; G182-T186 PolarHBondContact O-N 3.48Å; G182-T186 PolarHBondContact O-OG1 3.21Å; T186-V190 WeakPolarHBondContact O-CG2 3.26Å; T186-V190 PolarHBondContact O-N 3.24Å; T186-A439 HydrophobicContact CG2-CB 3.92Å; T186-A440 HydrophobicContact CG2-CB 3.99Å |
| 187 | G | 92.8 | Very high | 92.5 | Very high | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -71 | -33.3 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | F138 V183 V190 L191 | F138-G187 VanDerWaalsContact CD2-CA 3.4Å; F138-G187 WeakPolarHBondContact CE2-O 3.43Å; V183-G187 PolarHBondContact O-N 2.9Å; G187-V190 PolarHBondContact O-N 3.46Å; G187-L191 WeakPolarHBondContact O-CB 3.31Å; G187-L191 PolarHBondContact O-N 2.96Å |
| 188 | G | 92.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -67.9 | -42.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L184 L191 I192 | L184-G188 VanDerWaalsContact O-CA 3.29Å; L184-G188 WeakPolarHBondContact O-CA 3.19Å; L184-G188 PolarHBondContact O-N 2.95Å; G188-L191 PolarHBondContact O-N 3.41Å; G188-I192 PolarHBondContact O-N 3.34Å |
| 189 | N | 93.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.5 | -43.4 | 173.9 | -71.1 | -40.4 | 0 | 0 | 0 | 111.2 | D185 I192 L193 M204 H208 I425 | D185-N189 WeakPolarHBondContact O-CB 3.38Å; D185-N189 VanDerWaalsContact O-CG 3.24Å; D185-N189 PolarHBondContact O-N 3.07Å; D185-N189 VanDerWaalsContact O-N 3.15Å; D185-N189 PolarHBondContact O-ND2 3.29Å; D185-N189 PolarHBondContact OD1-ND2 3.2Å; N189-I192 VanDerWaalsContact O-CG2 3.28Å; N189-I192 WeakPolarHBondContact O-CG2 3.33Å; N189-L193 WeakPolarHBondContact O-CD1 3.33Å; N189-L193 VanDerWaalsContact O-CG 3.23Å; N189-L193 WeakPolarHBondContact O-CG 3.11Å; N189-L193 PolarHBondContact O-N 3.43Å; N189-M204 HydrophobicContact CB-CE 4.43Å; N189-H208 PolarHBondContact OD1-NE2 3.38Å; N189-I425 HydrophobicContact CB-CD1 4.34Å |
| 190 | V | 92.2 | Very high | 90.6 | Very high | 2 Ų | 2 | 25.8 Ų | 25.8 | 1% | 0.012 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -68.3 | -40.5 | 176.6 | -179.8 | 0 | 0 | 0 | 0 | 111.8 | F138 T186 G187 I192 L193 N194 V434 A439 | F138-V190 HydrophobicContact CD1-CB 4.43Å; F138-V190 HydrophobicContact CD1-CG1 3.98Å; F138-V190 HydrophobicContact CE1-CB 3.92Å; F138-V190 HydrophobicContact CE1-CG1 3.33Å; F138-V190 HydrophobicContact CE2-CB 4.47Å; F138-V190 HydrophobicContact CZ-CB 3.93Å; F138-V190 HydrophobicContact CZ-CG1 3.76Å; T186-V190 WeakPolarHBondContact O-CG2 3.26Å; T186-V190 PolarHBondContact O-N 3.24Å; G187-V190 PolarHBondContact O-N 3.46Å; V190-I192 PolarHBondContact O-N 3.32Å; V190-L193 PolarHBondContact O-N 3.48Å; V190-N194 WeakPolarHBondContact O-CB 3.31Å; V190-N194 PolarHBondContact O-N 3.4Å; V190-V434 HydrophobicContact CG2-CG1 4.37Å; V190-A439 HydrophobicContact CG2-CB 3.3Å |
| 191 | L | 92.8 | Very high | 90.3 | Very high | 11 Ų | 11 | 26.2 Ų | 26.2 | 6% | 0.058 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -66.3 | -37.5 | -178.6 | -174.8 | 59.2 | 0 | 0 | 0 | 112.1 | V80 L84 F138 P143 L147 G187 G188 N194 T195 | V80-L191 HydrophobicContact CG1-CD2 4.04Å; V80-L191 HydrophobicContact CG1-CG 4.17Å; L84-L191 HydrophobicContact CD1-CB 4.23Å; L84-L191 HydrophobicContact CD1-CD2 4.14Å; L84-L191 HydrophobicContact CD1-CG 4.07Å; L84-L191 HydrophobicContact CD2-CD2 4.23Å; L84-L191 HydrophobicContact CG-CD2 4.42Å; F138-L191 HydrophobicContact CE2-CB 4.15Å; F138-L191 HydrophobicContact CZ-CB 4.04Å; P143-L191 HydrophobicContact CB-CD1 3.94Å; P143-L191 HydrophobicContact CB-CD2 4.38Å; L147-L191 HydrophobicContact CD1-CB 4.42Å; L147-L191 HydrophobicContact CD1-CD2 3.56Å; G187-L191 WeakPolarHBondContact O-CB 3.31Å; G187-L191 PolarHBondContact O-N 2.96Å; G188-L191 PolarHBondContact O-N 3.41Å; L191-N194 PolarHBondContact O-N 3.06Å; L191-T195 VanDerWaalsContact O-CB 3.31Å; L191-T195 WeakPolarHBondContact O-CB 3.26Å; L191-T195 PolarHBondContact O-N 3.42Å; L191-T195 PolarHBondContact O-OG1 3.26Å |
| 192 | I | 92.4 | Very high | 90.1 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -68.4 | -38.1 | 177.9 | -162 | 69.2 | 0 | 0 | 0 | 111.6 | T81 L84 G188 N189 V190 T195 W196 H203 M204 L207 | T81-I192 HydrophobicContact CG2-CD1 3.96Å; T81-I192 WeakPolarHBondContact OG1-CD1 3.44Å; L84-I192 HydrophobicContact CD1-CB 4.04Å; L84-I192 HydrophobicContact CD1-CD1 3.87Å; G188-I192 PolarHBondContact O-N 3.34Å; N189-I192 VanDerWaalsContact O-CG2 3.28Å; N189-I192 WeakPolarHBondContact O-CG2 3.33Å; V190-I192 PolarHBondContact O-N 3.32Å; I192-T195 PolarHBondContact O-N 3.43Å; I192-W196 PolarHBondContact O-N 3.37Å; I192-W196 VanDerWaalsContact O-N 3.12Å; I192-H203 HydrophobicContact CD1-CB 4.05Å; I192-H203 HydrophobicContact CG1-CB 3.95Å; I192-M204 HydrophobicContact CG2-CE 3.27Å; I192-M204 HydrophobicContact CG2-SD 3.72Å; I192-L207 HydrophobicContact CB-CD2 4.27Å; I192-L207 HydrophobicContact CG2-CD2 3.87Å |
| 193 | L | 88.7 | Confident | 90 | Very high | 2 Ų | 2 | 28.8 Ų | 28.8 | 1% | 0.01 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.9 | -52.3 | 173.1 | -62.3 | 168.1 | 0 | 0 | 0 | 109.9 | N189 V190 T195 W196 G197 M204 I425 E429 V434 | N189-L193 WeakPolarHBondContact O-CD1 3.33Å; N189-L193 VanDerWaalsContact O-CG 3.23Å; N189-L193 WeakPolarHBondContact O-CG 3.11Å; N189-L193 PolarHBondContact O-N 3.43Å; V190-L193 PolarHBondContact O-N 3.48Å; L193-T195 PolarHBondContact O-N 2.81Å; L193-T195 VanDerWaalsContact O-N 3.16Å; L193-W196 PolarHBondContact O-N 3.38Å; L193-W196 VanDerWaalsContact O-N 3.14Å; L193-G197 WeakPolarHBondContact O-CA 3.21Å; L193-G197 PolarHBondContact O-N 3.38Å; L193-M204 HydrophobicContact CD1-CE 4.18Å; L193-M204 HydrophobicContact CD2-CE 3.47Å; L193-M204 VanDerWaalsContact CD2-CE 3.47Å; L193-M204 HydrophobicContact CG-CE 3.59Å; L193-I425 HydrophobicContact CD1-CG2 3.66Å; L193-I425 HydrophobicContact CD2-CG2 4.2Å; L193-I425 HydrophobicContact CG-CG2 4.38Å; L193-E429 HydrophobicContact CD2-CB 4.31Å; L193-E429 HydrophobicContact CD2-CG 4.39Å; L193-E429 WeakPolarHBondContact CD2-OE2 3.07Å; L193-V434 HydrophobicContact CD1-CB 3.78Å; L193-V434 HydrophobicContact CD1-CG1 3.86Å; L193-V434 HydrophobicContact CD1-CG2 4.02Å |
| 194 | N | 88.7 | Confident | 89.8 | Confident | 106 Ų | 106 | 28.3 Ų | 28.3 | 57% | 0.567 | 15% | 0.151 | S | C | * | . | H | α-helix | trans | -60.4 | -30.5 | 177.9 | -72.5 | -15 | 0 | 0 | 0 | 113.3 | V190 L191 | V190-N194 WeakPolarHBondContact O-CB 3.31Å; V190-N194 PolarHBondContact O-N 3.4Å; L191-N194 PolarHBondContact O-N 3.06Å |
| 195 | T | 88.4 | Confident | 89.7 | Confident | 20 Ų | 20 | 28.4 Ų | 28.4 | 12% | 0.123 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -73.4 | -38.3 | 178.8 | -59.3 | 0 | 0 | 0 | 0 | 111.6 | R77 V80 L191 I192 L193 | R77-T195 HydrophobicContact CB-CG2 3.81Å; R77-T195 HydrophobicContact CG-CG2 3.88Å; R77-T195 PolarHBondContact NE-O 2.97Å; R77-T195 PolarHBondContact NH2-O 2.95Å; V80-T195 HydrophobicContact CG1-CG2 4.49Å; L191-T195 VanDerWaalsContact O-CB 3.31Å; L191-T195 WeakPolarHBondContact O-CB 3.26Å; L191-T195 PolarHBondContact O-N 3.42Å; L191-T195 PolarHBondContact O-OG1 3.26Å; I192-T195 PolarHBondContact O-N 3.43Å; L193-T195 PolarHBondContact O-N 2.81Å; L193-T195 VanDerWaalsContact O-N 3.16Å |
| 196 | W | 87.6 | Confident | 89.7 | Confident | 22 Ų | 22 | 28.8 Ų | 28.8 | 8% | 0.083 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -111.6 | -16.6 | -170.4 | -72 | 100.8 | 0 | 0 | 0 | 115.4 | R77 W78 T81 I192 L193 E198 Q199 H203 | R77-W196 HydrophobicContact CB-CZ2 4.1Å; W78-W196 HydrophobicContact CD2-CH2 4.25Å; W78-W196 HydrophobicContact CD2-CZ2 4.08Å; W78-W196 AromaticContact CE2-CH2 3.74Å; W78-W196 HydrophobicContact CE3-CZ2 4.45Å; W78-W196 HydrophobicContact CG-CZ2 4.44Å; W78-W196 AromaticContact CZ2-CH2 3.99Å; W78-W196 HydrophobicContact CZ2-CH2 3.99Å; W78-W196 HydrophobicContact CZ2-CZ2 4.39Å; W78-W196 AromaticContact NE1-CH2 3.78Å; T81-W196 PolarHBondContact OG1-NE1 2.88Å; I192-W196 PolarHBondContact O-N 3.37Å; I192-W196 VanDerWaalsContact O-N 3.12Å; L193-W196 PolarHBondContact O-N 3.38Å; L193-W196 VanDerWaalsContact O-N 3.14Å; W196-E198 PolarHBondContact O-N 2.95Å; W196-Q199 PolarHBondContact O-N 3.24Å; W196-H203 AromaticContact CD1-CD2 3.65Å; W196-H203 AromaticContact CD1-CG 3.67Å; W196-H203 AromaticContact CD2-CD2 3.26Å; W196-H203 AromaticContact CD2-CE1 3.99Å; W196-H203 AromaticContact CD2-CG 3.96Å; W196-H203 AromaticContact CD2-NE2 3.31Å; W196-H203 VanDerWaalsContact CD2-NE2 3.31Å; W196-H203 AromaticContact CE2-CD2 3.52Å; W196-H203 AromaticContact CE2-CE1 3.54Å; W196-H203 AromaticContact CE2-CG 3.81Å; W196-H203 AromaticContact CE2-ND1 3.82Å; W196-H203 AromaticContact CE2-NE2 3.37Å; W196-H203 AromaticContact CE3-CD2 3.72Å; W196-H203 AromaticContact CE3-NE2 3.41Å; W196-H203 HydrophobicContact CG-CB 4.31Å; W196-H203 AromaticContact CG-CD2 3.37Å; W196-H203 AromaticContact CG-CG 3.88Å; W196-H203 AromaticContact CG-NE2 3.98Å; W196-H203 AromaticContact CH2-CE1 3.81Å; W196-H203 AromaticContact CH2-NE2 3.63Å; W196-H203 AromaticContact CZ2-CE1 3.46Å; W196-H203 VanDerWaalsContact CZ2-CE1 3.46Å; W196-H203 WeakPolarHBondContact CZ2-CE1 3.27Å; W196-H203 AromaticContact CZ2-NE2 3.55Å; W196-H203 AromaticContact CZ3-NE2 3.56Å; W196-H203 AromaticContact NE1-CD2 3.72Å; W196-H203 AromaticContact NE1-CG 3.62Å; W196-H203 AromaticContact NE1-ND1 3.81Å; W196-H203 AromaticContact NE1-NE2 3.99Å |
| 197 | G | 84.2 | Confident | 89.7 | Confident | 28 Ų | 28 | 28.8 Ų | 28.8 | 29% | 0.289 | 16% | 0.156 | S | C | . | . | G | 310 helix | trans | 53.4 | -130.9 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | L193 Q199 S200 | L193-G197 WeakPolarHBondContact O-CA 3.21Å; L193-G197 PolarHBondContact O-N 3.38Å; G197-Q199 PolarHBondContact O-N 2.89Å; G197-S200 WeakPolarHBondContact O-CB 3.39Å; G197-S200 PolarHBondContact O-N 2.97Å; G197-S200 PolarHBondContact O-OG 3.47Å; G197-S200 VanDerWaalsContact O-OG 3.11Å |
| 198 | E | 77.4 | Confident | 89.7 | Confident | 190 Ų | 190 | 29.3 Ų | 29.3 | 89% | 0.888 | 16% | 0.158 | S | C | * | . | G | 310 helix | trans | -58.2 | -18.6 | -179.7 | -61.6 | -173.1 | 165.9 | 0 | 0 | 114.7 | W196 | W196-E198 PolarHBondContact O-N 2.95Š|
| 199 | Q | 83.4 | Confident | 89.7 | Confident | 131 Ų | 131 | 33 Ų | 33 | 61% | 0.612 | 17% | 0.174 | S | C | * | . | G | 310 helix | trans | -94.4 | 12.7 | 176.5 | -62.3 | -179.2 | -0.3 | 0 | 0 | 113.1 | W196 G197 G201 H203 | W196-Q199 PolarHBondContact O-N 3.24Å; G197-Q199 PolarHBondContact O-N 2.89Å; Q199-G201 VanDerWaalsContact C-N 3.29Å; Q199-G201 PolarHBondContact O-N 3.42Å; Q199-H203 PolarHBondContact O-CD2 3.04Å |
| 200 | S | 85.6 | Confident | 89.7 | Confident | 3 Ų | 3 | 33.8 Ų | 33.8 | 2% | 0.021 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -66.3 | -24.8 | -175.7 | 66.5 | 0 | 0 | 0 | 0 | 114.3 | G197 H203 M204 E429 | G197-S200 WeakPolarHBondContact O-CB 3.39Å; G197-S200 PolarHBondContact O-N 2.97Å; G197-S200 PolarHBondContact O-OG 3.47Å; G197-S200 VanDerWaalsContact O-OG 3.11Å; S200-H203 CarbonylContact O-C 3.53Å; S200-H203 PolarHBondContact O-N 3.28Å; S200-M204 WeakPolarHBondContact O-CB 3.18Å; S200-M204 PolarHBondContact O-N 3.43Å; S200-E429 PolarHBondContact OG-OE2 2.84Å |
| 201 | G | 88.1 | Confident | 89.7 | Confident | 11 Ų | 11 | 36.2 Ų | 36.2 | 11% | 0.113 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -47.7 | -61.4 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115 | Q199 H203 M204 Q205 | Q199-G201 VanDerWaalsContact C-N 3.29Å; Q199-G201 PolarHBondContact O-N 3.42Å; G201-H203 VanDerWaalsContact C-N 3.28Å; G201-H203 PolarHBondContact O-N 2.91Å; G201-M204 PolarHBondContact O-N 2.97Å; G201-Q205 WeakPolarHBondContact O-CG 3.39Å; G201-Q205 PolarHBondContact O-N 3.15Å; G201-Q205 VanDerWaalsContact O-N 3.08Å |
| 202 | P | 91.2 | Very high | 89.4 | Confident | 31 Ų | 31 | 36.4 Ų | 36.4 | 20% | 0.201 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.5 | -36.5 | 178.2 | -24.9 | 34 | 0 | 0 | 0 | 113.6 | Q205 A206 A373 A374 | P202-Q205 PolarHBondContact O-N 3.23Å; P202-A206 WeakPolarHBondContact O-CB 3.21Å; P202-A206 PolarHBondContact O-N 2.66Å; P202-A373 HydrophobicContact CG-CB 4.24Å; P202-A374 HydrophobicContact CG-CB 4.01Å |
| 203 | H | 92.9 | Very high | 89.2 | Confident | 24 Ų | 24 | 38.1 Ų | 38.1 | 11% | 0.111 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -73.3 | -36.2 | -178.9 | -62.5 | -68.7 | 0 | 0 | 0 | 112.3 | W78 I192 W196 Q199 S200 G201 A206 L207 | W78-H203 AromaticContact CH2-CE1 3.58Å; W78-H203 AromaticContact CZ3-CE1 3.84Å; I192-H203 HydrophobicContact CD1-CB 4.05Å; I192-H203 HydrophobicContact CG1-CB 3.95Å; W196-H203 AromaticContact CD1-CD2 3.65Å; W196-H203 AromaticContact CD1-CG 3.67Å; W196-H203 AromaticContact CD2-CD2 3.26Å; W196-H203 AromaticContact CD2-CE1 3.99Å; W196-H203 AromaticContact CD2-CG 3.96Å; W196-H203 AromaticContact CD2-NE2 3.31Å; W196-H203 VanDerWaalsContact CD2-NE2 3.31Å; W196-H203 AromaticContact CE2-CD2 3.52Å; W196-H203 AromaticContact CE2-CE1 3.54Å; W196-H203 AromaticContact CE2-CG 3.81Å; W196-H203 AromaticContact CE2-ND1 3.82Å; W196-H203 AromaticContact CE2-NE2 3.37Å; W196-H203 AromaticContact CE3-CD2 3.72Å; W196-H203 AromaticContact CE3-NE2 3.41Å; W196-H203 HydrophobicContact CG-CB 4.31Å; W196-H203 AromaticContact CG-CD2 3.37Å; W196-H203 AromaticContact CG-CG 3.88Å; W196-H203 AromaticContact CG-NE2 3.98Å; W196-H203 AromaticContact CH2-CE1 3.81Å; W196-H203 AromaticContact CH2-NE2 3.63Å; W196-H203 AromaticContact CZ2-CE1 3.46Å; W196-H203 VanDerWaalsContact CZ2-CE1 3.46Å; W196-H203 WeakPolarHBondContact CZ2-CE1 3.27Å; W196-H203 AromaticContact CZ2-NE2 3.55Å; W196-H203 AromaticContact CZ3-NE2 3.56Å; W196-H203 AromaticContact NE1-CD2 3.72Å; W196-H203 AromaticContact NE1-CG 3.62Å; W196-H203 AromaticContact NE1-ND1 3.81Å; W196-H203 AromaticContact NE1-NE2 3.99Å; Q199-H203 PolarHBondContact O-CD2 3.04Å; S200-H203 CarbonylContact O-C 3.53Å; S200-H203 PolarHBondContact O-N 3.28Å; G201-H203 VanDerWaalsContact C-N 3.28Å; G201-H203 PolarHBondContact O-N 2.91Å; H203-A206 PolarHBondContact O-N 3.31Å; H203-L207 WeakPolarHBondContact O-CB 3.35Å; H203-L207 PolarHBondContact O-N 3.29Å |
| 204 | M | 91.9 | Very high | 89.2 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.3 | -42.8 | 171.6 | -173.8 | 61.3 | 79.9 | 0 | 0 | 111 | N189 I192 L193 S200 G201 A206 L207 H208 P422 I425 | N189-M204 HydrophobicContact CB-CE 4.43Å; I192-M204 HydrophobicContact CG2-CE 3.27Å; I192-M204 HydrophobicContact CG2-SD 3.72Å; L193-M204 HydrophobicContact CD1-CE 4.18Å; L193-M204 HydrophobicContact CD2-CE 3.47Å; L193-M204 VanDerWaalsContact CD2-CE 3.47Å; L193-M204 HydrophobicContact CG-CE 3.59Å; S200-M204 WeakPolarHBondContact O-CB 3.18Å; S200-M204 PolarHBondContact O-N 3.43Å; G201-M204 PolarHBondContact O-N 2.97Å; M204-A206 PolarHBondContact O-N 3.04Å; M204-L207 WeakPolarHBondContact O-CB 3.49Å; M204-L207 PolarHBondContact O-N 3.24Å; M204-L207 HydrophobicContact SD-CD2 4.29Å; M204-H208 PolarHBondContact O-CD2 2.94Å; M204-H208 PolarHBondContact O-N 3.4Å; M204-P422 HydrophobicContact CG-CB 3.82Å; M204-I425 HydrophobicContact CE-CB 4.35Å; M204-I425 HydrophobicContact CE-CG2 3.73Å |
| 205 | Q | 92.9 | Very high | 89.1 | Confident | 3 Ų | 3 | 34.3 Ų | 34.3 | 1% | 0.014 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.7 | -42.5 | 173.6 | -66.3 | -66.8 | -1.1 | 0 | 0 | 111.9 | G201 P202 L207 H208 F209 A369 I370 A373 S423 | G201-Q205 WeakPolarHBondContact O-CG 3.39Å; G201-Q205 PolarHBondContact O-N 3.15Å; G201-Q205 VanDerWaalsContact O-N 3.08Å; P202-Q205 PolarHBondContact O-N 3.23Å; Q205-L207 VanDerWaalsContact C-N 3.31Å; Q205-L207 PolarHBondContact O-N 3.18Å; Q205-H208 PolarHBondContact O-N 3.41Å; Q205-F209 VanDerWaalsContact O-CB 3.31Å; Q205-F209 WeakPolarHBondContact O-CB 3.48Å; Q205-F209 PolarHBondContact O-N 2.94Å; Q205-A369 HydrophobicContact CG-CB 4.37Å; Q205-I370 HydrophobicContact CB-CG1 3.97Å; Q205-A373 HydrophobicContact CG-CB 3.78Å; Q205-S423 PolarHBondContact NE2-OG 2.97Å; Q205-S423 VanDerWaalsContact NE2-OG 3.07Å |
| 206 | A | 93.4 | Very high | 88.8 | Confident | 21 Ų | 21 | 40.6 Ų | 40.6 | 17% | 0.174 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.3 | -36.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | P202 H203 M204 F209 S210 I370 | P202-A206 WeakPolarHBondContact O-CB 3.21Å; P202-A206 PolarHBondContact O-N 2.66Å; H203-A206 PolarHBondContact O-N 3.31Å; M204-A206 PolarHBondContact O-N 3.04Å; A206-F209 PolarHBondContact O-N 3.32Å; A206-S210 PolarHBondContact O-N 3.36Å; A206-S210 PolarHBondContact O-OG 2.83Å; A206-I370 HydrophobicContact CB-CD1 4.17Å; A206-I370 HydrophobicContact CB-CG1 4.47Å |
| 207 | L | 93.8 | Very high | 88.6 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.5 | -52.3 | 175.3 | -172.5 | 65.4 | 0 | 0 | 0 | 111.3 | L84 F88 I192 H203 M204 Q205 S210 F211 | L84-L207 VanDerWaalsContact C-CD1 3.4Å; L84-L207 HydrophobicContact CB-CD1 3.72Å; L84-L207 WeakPolarHBondContact O-CD1 3.35Å; F88-L207 HydrophobicContact CB-CD1 3.92Å; F88-L207 HydrophobicContact CB-CG 4.33Å; F88-L207 HydrophobicContact CD1-CD1 4.1Å; F88-L207 HydrophobicContact CD1-CD2 4.29Å; F88-L207 HydrophobicContact CD1-CG 3.67Å; F88-L207 HydrophobicContact CD2-CD1 3.48Å; F88-L207 VanDerWaalsContact CD2-CD1 3.48Å; F88-L207 HydrophobicContact CD2-CD2 4.25Å; F88-L207 HydrophobicContact CD2-CG 3.87Å; F88-L207 HydrophobicContact CE1-CD2 3.95Å; F88-L207 HydrophobicContact CE1-CG 3.85Å; F88-L207 HydrophobicContact CE2-CD1 3.98Å; F88-L207 HydrophobicContact CE2-CD2 3.92Å; F88-L207 HydrophobicContact CE2-CG 4.05Å; F88-L207 HydrophobicContact CG-CD1 3.55Å; F88-L207 HydrophobicContact CG-CD2 4.43Å; F88-L207 HydrophobicContact CG-CG 3.67Å; F88-L207 HydrophobicContact CZ-CD1 4.47Å; F88-L207 HydrophobicContact CZ-CD2 3.76Å; F88-L207 HydrophobicContact CZ-CG 4.03Å; I192-L207 HydrophobicContact CB-CD2 4.27Å; I192-L207 HydrophobicContact CG2-CD2 3.87Å; H203-L207 WeakPolarHBondContact O-CB 3.35Å; H203-L207 PolarHBondContact O-N 3.29Å; M204-L207 WeakPolarHBondContact O-CB 3.49Å; M204-L207 PolarHBondContact O-N 3.24Å; M204-L207 HydrophobicContact SD-CD2 4.29Å; Q205-L207 VanDerWaalsContact C-N 3.31Å; Q205-L207 PolarHBondContact O-N 3.18Å; L207-S210 WeakPolarHBondContact O-CB 3.48Å; L207-S210 PolarHBondContact O-N 3.25Å; L207-F211 PolarHBondContact O-N 3.27Å |
| 208 | H | 92.6 | Very high | 88.4 | Confident | 10 Ų | 10 | 39.7 Ų | 39.7 | 5% | 0.046 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -73.2 | -26.4 | 178.7 | -76 | -75.1 | 0 | 0 | 0 | 114 | F88 N189 M204 Q205 S210 F211 A212 R366 F421 P422 | F88-H208 AromaticContact CE1-CE1 3.96Å; N189-H208 PolarHBondContact OD1-NE2 3.38Å; M204-H208 PolarHBondContact O-CD2 2.94Å; M204-H208 PolarHBondContact O-N 3.4Å; Q205-H208 PolarHBondContact O-N 3.41Å; H208-S210 VanDerWaalsContact C-N 3.33Å; H208-F211 WeakPolarHBondContact O-CB 3.31Å; H208-F211 PolarHBondContact O-N 2.64Å; H208-A212 PolarHBondContact O-N 3.21Å; H208-A212 VanDerWaalsContact O-N 3.11Å; H208-R366 WeakPolarHBondContact O-CD 3.21Å; H208-F421 AromaticContact CE1-CD1 3.42Å; H208-F421 VanDerWaalsContact CE1-CD1 3.42Å; H208-F421 WeakPolarHBondContact CE1-CD1 3.3Å; H208-F421 AromaticContact CE1-CE1 3.36Å; H208-F421 WeakPolarHBondContact CE1-CE1 3.44Å; H208-F421 AromaticContact NE2-CD1 3.62Å; H208-F421 AromaticContact NE2-CE1 3.66Å; H208-P422 HydrophobicContact CB-CG 4.42Å |
| 209 | F | 91.8 | Very high | 88.3 | Confident | 77 Ų | 77 | 32.8 Ų | 32.8 | 34% | 0.338 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -62.6 | -43.2 | 167.7 | 172.9 | -102.1 | 0 | 0 | 0 | 110.7 | Q205 A206 F211 A212 A213 R366 I370 | Q205-F209 VanDerWaalsContact O-CB 3.31Å; Q205-F209 WeakPolarHBondContact O-CB 3.48Å; Q205-F209 PolarHBondContact O-N 2.94Å; A206-F209 PolarHBondContact O-N 3.32Å; F209-F211 VanDerWaalsContact C-N 3.3Å; F209-F211 PolarHBondContact O-N 3.49Å; F209-A212 PolarHBondContact O-N 2.9Å; F209-A212 VanDerWaalsContact O-N 3.15Å; F209-A213 WeakPolarHBondContact O-CB 3.45Å; F209-A213 PolarHBondContact O-N 2.9Å; F209-R366 HydrophobicContact CB-CG 4.2Å; F209-I370 HydrophobicContact CB-CD1 4.09Å; F209-I370 HydrophobicContact CD1-CD1 4.25Å; F209-I370 HydrophobicContact CG-CD1 4.14Å |
| 210 | S | 93.8 | Very high | 88.1 | Confident | 17 Ų | 17 | 30.3 Ų | 30.3 | 12% | 0.119 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61 | -40 | 177.7 | -56.1 | 0 | 0 | 0 | 0 | 111.6 | C85 L89 A206 L207 H208 A213 G214 | C85-S210 WeakPolarHBondContact CB-OG 3.45Å; C85-S210 VanDerWaalsContact O-CB 3.25Å; C85-S210 WeakPolarHBondContact O-CB 3.44Å; L89-S210 VanDerWaalsContact CA-O 3.29Å; L89-S210 WeakPolarHBondContact CA-O 3.33Å; A206-S210 PolarHBondContact O-N 3.36Å; A206-S210 PolarHBondContact O-OG 2.83Å; L207-S210 WeakPolarHBondContact O-CB 3.48Å; L207-S210 PolarHBondContact O-N 3.25Å; H208-S210 VanDerWaalsContact C-N 3.33Å; S210-A213 PolarHBondContact O-N 2.97Å; S210-G214 PolarHBondContact O-N 3.42Å |
| 211 | F | 91.7 | Very high | 87.5 | Confident | 54 Ų | 54 | 31.8 Ų | 31.8 | 24% | 0.237 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -57.1 | -51.5 | 170.5 | 173.1 | -89.5 | 0 | 0 | 0 | 112.8 | F88 L91 I95 L207 H208 F209 A213 G214 A215 | F88-F211 HydrophobicContact CB-CB 4.21Å; F88-F211 HydrophobicContact CD1-CB 4.09Å; F88-F211 VanDerWaalsContact O-CA 3.3Å; F88-F211 WeakPolarHBondContact O-CA 3.41Å; L91-F211 HydrophobicContact CB-CD2 4.35Å; L91-F211 HydrophobicContact CD2-CD2 3.95Å; L91-F211 HydrophobicContact CD2-CE2 4.06Å; L91-F211 HydrophobicContact CG-CD2 3.99Å; L91-F211 HydrophobicContact CG-CE2 3.94Å; I95-F211 HydrophobicContact CD1-CE2 3.53Å; I95-F211 HydrophobicContact CD1-CZ 3.78Å; L207-F211 PolarHBondContact O-N 3.27Å; H208-F211 WeakPolarHBondContact O-CB 3.31Å; H208-F211 PolarHBondContact O-N 2.64Å; F209-F211 VanDerWaalsContact C-N 3.3Å; F209-F211 PolarHBondContact O-N 3.49Å; F211-A213 VanDerWaalsContact C-N 3.32Å; F211-A213 PolarHBondContact O-N 3.46Å; F211-G214 PolarHBondContact O-N 3.37Å; F211-A215 PolarHBondContact O-N 2.91Å |
| 212 | A | 86.3 | Confident | 86.6 | Confident | 14 Ų | 14 | 31.4 Ų | 31.4 | 12% | 0.116 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.7 | -40.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | H208 F209 G214 A215 F216 | H208-A212 PolarHBondContact O-N 3.21Å; H208-A212 VanDerWaalsContact O-N 3.11Å; F209-A212 PolarHBondContact O-N 2.9Å; F209-A212 VanDerWaalsContact O-N 3.15Å; A212-G214 PolarHBondContact O-N 2.9Å; A212-A215 PolarHBondContact O-N 3.36Å; A212-F216 PolarHBondContact O-N 3.19Å |
| 213 | A | 88.6 | Confident | 85.6 | Confident | 36 Ų | 36 | 37.5 Ų | 37.5 | 30% | 0.298 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -61.6 | -42 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | F209 S210 F211 F216 A217 | F209-A213 WeakPolarHBondContact O-CB 3.45Å; F209-A213 PolarHBondContact O-N 2.9Å; S210-A213 PolarHBondContact O-N 2.97Å; F211-A213 VanDerWaalsContact C-N 3.32Å; F211-A213 PolarHBondContact O-N 3.46Å; A213-F216 PolarHBondContact O-N 3.31Å; A213-A217 VanDerWaalsContact O-CB 3.32Å; A213-A217 WeakPolarHBondContact O-CB 3.49Å; A213-A217 PolarHBondContact O-N 2.94Å |
| 214 | G | 89.6 | Confident | 84.2 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.4 | -44.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | L89 M93 S210 F211 A212 F216 A217 S218 | L89-G214 WeakPolarHBondContact O-CA 3.44Å; M93-G214 VanDerWaalsContact CG-O 3.26Å; M93-G214 WeakPolarHBondContact CG-O 3.43Å; S210-G214 PolarHBondContact O-N 3.42Å; F211-G214 PolarHBondContact O-N 3.37Å; A212-G214 PolarHBondContact O-N 2.9Å; G214-F216 VanDerWaalsContact C-N 3.28Å; G214-F216 PolarHBondContact O-N 3.31Å; G214-A217 PolarHBondContact O-N 3.19Å; G214-S218 WeakPolarHBondContact O-CB 3.4Å; G214-S218 PolarHBondContact O-N 3.42Å; G214-S218 VanDerWaalsContact O-N 3.08Å |
| 215 | A | 86.4 | Confident | 82.6 | Confident | 29 Ų | 29 | 48 Ų | 48 | 24% | 0.24 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.3 | -37 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | G92 S96 F211 A212 P219 | G92-A215 WeakPolarHBondContact O-CA 3.22Å; S96-A215 WeakPolarHBondContact CB-O 3.09Å; S96-A215 PolarHBondContact OG-O 3.21Å; F211-A215 PolarHBondContact O-N 2.91Å; A212-A215 PolarHBondContact O-N 3.36Å; A215-P219 WeakPolarHBondContact O-CD 3.45Å |
| 216 | F | 80.9 | Confident | 81 | Confident | 152 Ų | 152 | 50.1 Ų | 50.1 | 67% | 0.667 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -73.4 | -38.2 | 174.7 | -176.4 | -101.2 | 0 | 0 | 0 | 113.2 | A212 A213 G214 I220 | A212-F216 PolarHBondContact O-N 3.19Å; A213-F216 PolarHBondContact O-N 3.31Å; G214-F216 VanDerWaalsContact C-N 3.28Å; G214-F216 PolarHBondContact O-N 3.31Å; F216-I220 HydrophobicContact CD1-CD1 4.11Å; F216-I220 HydrophobicContact CE1-CD1 3.7Å; F216-I220 HydrophobicContact CZ-CD1 4.15Å |
| 217 | A | 83.1 | Confident | 79.1 | Confident | 31 Ų | 31 | 51.3 Ų | 51.3 | 26% | 0.256 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -69.4 | -33.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | A213 G214 I220 I221 | A213-A217 VanDerWaalsContact O-CB 3.32Å; A213-A217 WeakPolarHBondContact O-CB 3.49Å; A213-A217 PolarHBondContact O-N 2.94Å; G214-A217 PolarHBondContact O-N 3.19Å; A217-I220 WeakPolarHBondContact O-CB 3.26Å; A217-I220 PolarHBondContact O-N 2.94Å; A217-I221 HydrophobicContact CB-CD1 4.41Å; A217-I221 WeakPolarHBondContact O-CG1 3.42Å; A217-I221 PolarHBondContact O-N 3.5Å |
| 218 | S | 82 | Confident | 76.7 | Confident | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63.6 | -45.7 | -170.9 | 170.5 | 0 | 0 | 0 | 0 | 115.4 | M93 V97 G214 I220 I221 A222 | M93-S218 WeakPolarHBondContact O-CB 3.27Å; M93-S218 PolarHBondContact O-OG 3.16Å; V97-S218 WeakPolarHBondContact CA-OG 3.41Å; V97-S218 WeakPolarHBondContact CB-OG 3.34Å; V97-S218 PolarHBondContact N-OG 3.32Å; G214-S218 WeakPolarHBondContact O-CB 3.4Å; G214-S218 PolarHBondContact O-N 3.42Å; G214-S218 VanDerWaalsContact O-N 3.08Å; S218-I220 PolarHBondContact O-N 3.32Å; S218-I221 WeakPolarHBondContact O-CB 3.18Å; S218-I221 PolarHBondContact O-N 3Å; S218-I221 VanDerWaalsContact O-N 3.17Å; S218-A222 PolarHBondContact O-N 2.99Å |
| 219 | P | 75.3 | Confident | 74.4 | Confident | 45 Ų | 45 | 61 Ų | 61 | 29% | 0.292 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.3 | -31.6 | 173.6 | -24.8 | 35.4 | 0 | 0 | 0 | 113.2 | S96 P100 A215 K223 | S96-P219 VanDerWaalsContact OG-CD 3.31Å; S96-P219 WeakPolarHBondContact OG-CD 3.36Å; S96-P219 VanDerWaalsContact OG-CG 3.31Å; S96-P219 WeakPolarHBondContact OG-CG 3.45Å; P100-P219 HydrophobicContact CG-CB 4.34Å; A215-P219 WeakPolarHBondContact O-CD 3.45Å; P219-K223 VanDerWaalsContact O-CB 3.23Å; P219-K223 WeakPolarHBondContact O-CB 3.45Å; P219-K223 PolarHBondContact O-N 3.46Å |
| 220 | I | 78.1 | Confident | 72.2 | Confident | 79 Ų | 79 | 60.3 Ų | 60.3 | 41% | 0.405 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -68.8 | -44.9 | 175.1 | -57.4 | 172 | 0 | 0 | 0 | 109.7 | F216 A217 S218 A222 K223 L224 | F216-I220 HydrophobicContact CD1-CD1 4.11Å; F216-I220 HydrophobicContact CE1-CD1 3.7Å; F216-I220 HydrophobicContact CZ-CD1 4.15Å; A217-I220 WeakPolarHBondContact O-CB 3.26Å; A217-I220 PolarHBondContact O-N 2.94Å; S218-I220 PolarHBondContact O-N 3.32Å; I220-A222 PolarHBondContact O-N 3.42Å; I220-K223 PolarHBondContact O-N 3.21Å; I220-L224 HydrophobicContact CG2-CB 4.15Å; I220-L224 WeakPolarHBondContact O-CA 3.48Å; I220-L224 WeakPolarHBondContact O-CB 3.37Å; I220-L224 PolarHBondContact O-N 3.14Å |
| 221 | I | 73.9 | Confident | 69.4 | Low | 34 Ų | 34 | 66.4 Ų | 66.4 | 17% | 0.174 | 37% | 0.371 | C | S | . | . | I | π-helix | trans | -58.9 | -48.5 | 175.5 | -70.4 | 168.2 | 0 | 0 | 0 | 110.2 | M93 A217 S218 K223 L225 A269 | M93-I221 HydrophobicContact SD-CD1 3.84Å; A217-I221 HydrophobicContact CB-CD1 4.41Å; A217-I221 WeakPolarHBondContact O-CG1 3.42Å; A217-I221 PolarHBondContact O-N 3.5Å; S218-I221 WeakPolarHBondContact O-CB 3.18Å; S218-I221 PolarHBondContact O-N 3Å; S218-I221 VanDerWaalsContact O-N 3.17Å; I221-K223 PolarHBondContact O-N 3.27Å; I221-L225 HydrophobicContact CB-CD1 4.41Å; I221-L225 HydrophobicContact CG2-CD1 3.92Å; I221-L225 WeakPolarHBondContact O-CB 3.19Å; I221-L225 PolarHBondContact O-N 2.87Å; I221-A269 HydrophobicContact CG2-CB 4.46Å |
| 222 | A | 68.9 | Low | 66.8 | Low | 3 Ų | 3 | 67.4 Ų | 67.4 | 3% | 0.025 | 40% | 0.397 | C | S | . | . | I | π-helix | trans | -61.3 | -44.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | P100 S218 I220 G227 A269 | P100-A222 HydrophobicContact CB-CB 4.48Å; P100-A222 HydrophobicContact CG-CB 4.14Å; S218-A222 PolarHBondContact O-N 2.99Å; I220-A222 PolarHBondContact O-N 3.42Å; A222-G227 PolarHBondContact O-N 2.99Å; A222-A269 HydrophobicContact CB-CB 4.09Å |
| 223 | K | 68.7 | Low | 64.4 | Low | 158 Ų | 158 | 71.4 Ų | 71.4 | 69% | 0.687 | 42% | 0.424 | S | S | * | . | I | π-helix | trans | -83.2 | -42 | -174.5 | -167.8 | 175 | -177.6 | 175.8 | 0 | 114.1 | P219 I220 I221 G227 | P219-K223 VanDerWaalsContact O-CB 3.23Å; P219-K223 WeakPolarHBondContact O-CB 3.45Å; P219-K223 PolarHBondContact O-N 3.46Å; I220-K223 PolarHBondContact O-N 3.21Å; I221-K223 PolarHBondContact O-N 3.27Å; K223-G227 CarbonylContact O-C 3.59Å; K223-G227 WeakPolarHBondContact O-CA 3.37Å; K223-G227 PolarHBondContact O-N 3.32Å |
| 224 | L | 63.5 | Low | 62 | Low | 137 Ų | 137 | 75.6 Ų | 75.6 | 72% | 0.717 | 45% | 0.446 | S | S | * | . | I | π-helix | trans | -82.2 | -36.6 | -172 | -154.1 | 101.5 | 0 | 0 | 0 | 112.4 | I220 | I220-L224 HydrophobicContact CG2-CB 4.15Å; I220-L224 WeakPolarHBondContact O-CA 3.48Å; I220-L224 WeakPolarHBondContact O-CB 3.37Å; I220-L224 PolarHBondContact O-N 3.14Å |
| 225 | L | 60.1 | Low | 59.6 | Low | 108 Ų | 108 | 81.8 Ų | 81.8 | 57% | 0.565 | 49% | 0.486 | S | S | * | . | I | π-helix | trans | -84.2 | -28.2 | 178.7 | -68.1 | 163.6 | 0 | 0 | 0 | 112.3 | I221 | I221-L225 HydrophobicContact CB-CD1 4.41Å; I221-L225 HydrophobicContact CG2-CD1 3.92Å; I221-L225 WeakPolarHBondContact O-CB 3.19Å; I221-L225 PolarHBondContact O-N 2.87Å |
| 226 | F | 58.9 | Low | 57.3 | Low | 48 Ų | 48 | 85 Ų | 85 | 21% | 0.211 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -138.2 | -9.4 | -168 | -54.2 | -65.5 | 0 | 0 | 0 | 116.1 | K265 W268 V272 | F226-K265 HydrophobicContact CB-CB 4.17Å; F226-K265 WeakPolarHBondContact CB-O 3.42Å; F226-K265 WeakPolarHBondContact CG-O 3.06Å; F226-K265 WeakPolarHBondContact O-CB 3.36Å; F226-W268 HydrophobicContact CD1-CB 3.83Å; F226-W268 HydrophobicContact CD1-CG 4.42Å; F226-W268 HydrophobicContact CD2-CB 4.06Å; F226-W268 HydrophobicContact CE1-CB 3.59Å; F226-W268 HydrophobicContact CE1-CG 4.21Å; F226-W268 HydrophobicContact CE2-CB 3.83Å; F226-W268 HydrophobicContact CG-CB 4.07Å; F226-W268 HydrophobicContact CZ-CB 3.6Å; F226-V272 HydrophobicContact CE2-CG2 4.05Å; F226-V272 HydrophobicContact CZ-CG2 4.02Å |
| 227 | G | 52.6 | Low | 55 | Low | 45 Ų | 45 | 86.8 Ų | 86.8 | 46% | 0.464 | 52% | 0.521 | S | S | . | . | trans | -94.2 | 7.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | A222 K223 D229 | A222-G227 PolarHBondContact O-N 2.99Å; K223-G227 CarbonylContact O-C 3.59Å; K223-G227 WeakPolarHBondContact O-CA 3.37Å; K223-G227 PolarHBondContact O-N 3.32Å; G227-D229 PolarHBondContact O-N 2.81Å | ||
| 228 | H | 44.2 | Very low | 53 | Low | 158 Ų | 158 | 91.3 Ų | 91.3 | 73% | 0.731 | 55% | 0.547 | S | S | * | . | trans | -86.9 | 102 | 179.2 | -138.9 | 98.5 | 0 | 0 | 0 | 111.1 | ||||
| 229 | D | 43.6 | Very low | 51 | Low | 57 Ų | 57 | 97.1 Ų | 97.1 | 31% | 0.305 | 58% | 0.583 | S | S | . | * | trans | -136.3 | 108.1 | 160.3 | -88.9 | -27.2 | 0 | 0 | 0 | 106.3 | G227 H258 K265 | G227-D229 PolarHBondContact O-N 2.81Å; D229-H258 WeakPolarHBondContact CB-NE2 3.48Å; D229-H258 IonicContact OD1-NE2 3.84Å; D229-H258 PolarHBondContact OD1-NE2 3.28Å; D229-H258 IonicContact OD2-CD2 3.48Å; D229-H258 IonicContact OD2-NE2 3.61Å; D229-H258 PolarHBondContact OD2-NE2 2.88Å; D229-K265 IonicContact OD1-NZ 2.76Å; D229-K265 PolarHBondContact OD1-NZ 2.94Å; D229-K265 IonicContact OD2-NZ 3.04Å; D229-K265 PolarHBondContact OD2-NZ 2.91Å | ||
| 230 | G | 45.8 | Very low | 49.4 | Very low | 61 Ų | 61 | 102.2 Ų | 102.2 | 63% | 0.629 | 61% | 0.608 | S | S | * | * | trans | -68.3 | 131.6 | -164.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 231 | N | 35.8 | Very low | 48 | Very low | 146 Ų | 146 | 104.2 Ų | 104.2 | 78% | 0.781 | 63% | 0.626 | S | S | * | * | -163 | 109.2 | 126.5 | -143.1 | 16.4 | 0 | 0 | 0 | 109 | S233 | N231-S233 PolarHBondContact O-N 2.95Š| |||
| 232 | G | 36 | Very low | 47 | Very low | 75 Ų | 75 | 107.8 Ų | 107.8 | 77% | 0.773 | 65% | 0.651 | S | S | * | * | trans | -66.7 | 82.9 | 160.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | T234 | G232-T234 VanDerWaalsContact C-N 3.31Å; G232-T234 PolarHBondContact O-N 3.33Å | ||
| 233 | S | 37.3 | Very low | 45.8 | Very low | 98 Ų | 98 | 114.7 Ų | 114.7 | 69% | 0.685 | 69% | 0.688 | S | S | * | * | trans | -72.9 | 93.5 | 169.3 | 56.2 | 0 | 0 | 0 | 0 | 108.1 | N231 | N231-S233 PolarHBondContact O-N 2.95Š| ||
| 234 | T | 36.6 | Very low | 44.8 | Very low | 123 Ų | 123 | 113.7 Ų | 113.7 | 76% | 0.755 | 69% | 0.694 | S | S | * | * | trans | -44.6 | 136.1 | 147.8 | 14.8 | 0 | 0 | 0 | 0 | 108.2 | G232 A236 | G232-T234 VanDerWaalsContact C-N 3.31Å; G232-T234 PolarHBondContact O-N 3.33Å; T234-A236 PolarHBondContact O-N 3.11Å | ||
| 235 | P | 39.3 | Very low | 44.1 | Very low | 130 Ų | 130 | 111.2 Ų | 111.2 | 84% | 0.844 | 69% | 0.685 | S | S | * | * | trans | -65.1 | 104.4 | -178.6 | 26.7 | -33.6 | 0 | 0 | 0 | 109.1 | K237 | P235-K237 PolarHBondContact O-N 3.4Š| ||
| 236 | A | 38.2 | Very low | 43.8 | Very low | 98 Ų | 98 | 113.8 Ų | 113.8 | 81% | 0.81 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 124.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | T234 | T234-A236 PolarHBondContact O-N 3.11Š|
| 237 | K | 32.7 | Very low | 43.5 | Very low | 189 Ų | 189 | 115.6 Ų | 115.6 | 82% | 0.822 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 145.2 | 170.6 | -104.4 | 175.3 | 172.1 | 176.2 | 0 | 111.3 | P235 T239 | P235-K237 PolarHBondContact O-N 3.4Å; K237-T239 PolarHBondContact O-N 3.02Å |
| 238 | P | 41.9 | Very low | 43.4 | Very low | 125 Ų | 125 | 116.5 Ų | 116.5 | 81% | 0.812 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 118.9 | 177.6 | 30.2 | -30.8 | 0 | 0 | 0 | 109.2 | ||
| 239 | T | 40.9 | Very low | 43.8 | Very low | 123 Ų | 123 | 114 Ų | 114 | 76% | 0.755 | 71% | 0.706 | S | S | * | * | trans | -129.4 | 110.1 | 164.3 | 37.3 | 0 | 0 | 0 | 0 | 109.3 | K237 | K237-T239 PolarHBondContact O-N 3.02Š| ||
| 240 | N | 40.2 | Very low | 44.2 | Very low | 152 Ų | 152 | 114.7 Ų | 114.7 | 81% | 0.813 | 72% | 0.715 | S | S | * | * | trans | 52.6 | 148.6 | 154.3 | -62.9 | -6.8 | 0 | 0 | 0 | 120.4 | ||||
| 241 | P | 50 | Low | 44.7 | Very low | 121 Ų | 121 | 116 Ų | 116 | 79% | 0.786 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 144.5 | -170.8 | 30.9 | -34 | 0 | 0 | 0 | 111.5 | ||
| 242 | P | 51.7 | Low | 45.6 | Very low | 109 Ų | 109 | 112.4 Ų | 112.4 | 71% | 0.708 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 137.8 | -176.8 | 33.8 | -30.2 | 0 | 0 | 0 | 112.2 | V244 | P242-V244 PolarHBondContact O-N 3.47Š|
| 243 | N | 44.5 | Very low | 46.4 | Very low | 147 Ų | 147 | 114.9 Ų | 114.9 | 79% | 0.786 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 125 | 155.6 | -75.4 | -18.3 | 0 | 0 | 0 | 108.9 | T245 | N243-T245 PolarHBondContact O-N 3.26Å; N243-T245 VanDerWaalsContact O-N 3.09Å |
| 244 | V | 47.5 | Very low | 47.3 | Very low | 137 Ų | 137 | 115.1 Ų | 115.1 | 83% | 0.83 | 68% | 0.677 | S | S | * | * | trans | -69.3 | 104.9 | -179 | -178.2 | 0 | 0 | 0 | 0 | 109.3 | P242 | P242-V244 PolarHBondContact O-N 3.47Š| ||
| 245 | T | 49.3 | Very low | 48.2 | Very low | 86 Ų | 86 | 117.2 Ų | 117.2 | 53% | 0.528 | 67% | 0.671 | S | S | . | * | trans | -112 | 155.8 | 172.5 | 41.3 | 0 | 0 | 0 | 0 | 110.3 | N243 T247 T248 | N243-T245 PolarHBondContact O-N 3.26Å; N243-T245 VanDerWaalsContact O-N 3.09Å; T245-T247 PolarHBondContact O-N 2.86Å; T245-T247 PolarHBondContact OG1-OG1 3.07Å; T245-T247 VanDerWaalsContact OG1-OG1 3.04Å; T245-T248 PolarHBondContact O-N 3.02Å; T245-T248 PolarHBondContact O-OG1 3.1Å | ||
| 246 | L | 52.4 | Low | 48.9 | Very low | 162 Ų | 162 | 118.4 Ų | 118.4 | 85% | 0.848 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.2 | -19 | -177.3 | -123.1 | 95.5 | 0 | 0 | 0 | 114.5 | T248 V249 | L246-T248 VanDerWaalsContact C-N 3.31Å; L246-T248 PolarHBondContact O-N 2.69Å; L246-V249 PolarHBondContact O-N 3.01Å |
| 247 | T | 52.4 | Low | 49.6 | Very low | 85 Ų | 85 | 118.5 Ų | 118.5 | 52% | 0.521 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -64.2 | -28.6 | 174.9 | 42.4 | 0 | 0 | 0 | 0 | 113.5 | T245 N251 | T245-T247 PolarHBondContact O-N 2.86Å; T245-T247 PolarHBondContact OG1-OG1 3.07Å; T245-T247 VanDerWaalsContact OG1-OG1 3.04Å; T247-N251 WeakPolarHBondContact O-CB 3.43Å; T247-N251 PolarHBondContact O-N 3.26Å; T247-N251 PolarHBondContact O-ND2 2.69Å |
| 248 | T | 51.4 | Low | 50.7 | Low | 65 Ų | 65 | 113.5 Ų | 113.5 | 40% | 0.399 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -68 | -35.1 | 177.5 | -54.9 | 0 | 0 | 0 | 0 | 111.9 | T245 L246 T252 | T245-T248 PolarHBondContact O-N 3.02Å; T245-T248 PolarHBondContact O-OG1 3.1Å; L246-T248 VanDerWaalsContact C-N 3.31Å; L246-T248 PolarHBondContact O-N 2.69Å; T248-T252 WeakPolarHBondContact O-CB 3.29Å; T248-T252 PolarHBondContact O-N 3.45Å; T248-T252 PolarHBondContact O-OG1 3.09Å |
| 249 | V | 51.7 | Low | 51.1 | Low | 105 Ų | 105 | 110 Ų | 110 | 64% | 0.636 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -71.8 | -43.8 | 178.4 | -175.9 | 0 | 0 | 0 | 0 | 110.6 | L246 N251 T252 M253 | L246-V249 PolarHBondContact O-N 3.01Å; V249-N251 PolarHBondContact O-N 3.17Å; V249-T252 PolarHBondContact O-N 3.45Å; V249-M253 WeakPolarHBondContact O-CB 3.36Å; V249-M253 PolarHBondContact O-N 3.18Å |
| 250 | S | 52.3 | Low | 51.7 | Low | 71 Ų | 71 | 110.1 Ų | 110.1 | 50% | 0.497 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -60.3 | -42.7 | 172.5 | -82 | 0 | 0 | 0 | 0 | 112.5 | T252 M253 I254 | S250-T252 VanDerWaalsContact C-N 3.28Å; S250-T252 PolarHBondContact O-N 2.92Å; S250-M253 PolarHBondContact O-N 3.4Å; S250-I254 WeakPolarHBondContact O-CB 3.3Å; S250-I254 WeakPolarHBondContact O-CG1 3.47Å; S250-I254 PolarHBondContact O-N 3.41Å |
| 251 | N | 56.2 | Low | 52.1 | Low | 88 Ų | 88 | 105.5 Ų | 105.5 | 47% | 0.471 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -68 | -27.3 | 177.4 | -75.8 | -18.2 | 0 | 0 | 0 | 113.1 | T247 V249 R255 | T247-N251 WeakPolarHBondContact O-CB 3.43Å; T247-N251 PolarHBondContact O-N 3.26Å; T247-N251 PolarHBondContact O-ND2 2.69Å; V249-N251 PolarHBondContact O-N 3.17Å; N251-R255 VanDerWaalsContact O-CB 3.3Å; N251-R255 WeakPolarHBondContact O-CB 3.4Å; N251-R255 VanDerWaalsContact O-CG 3.28Å; N251-R255 WeakPolarHBondContact O-CG 3.34Å; N251-R255 PolarHBondContact O-N 2.9Å; N251-R255 VanDerWaalsContact O-N 3.11Å; N251-R255 PolarHBondContact O-NE 3.42Å; N251-R255 VanDerWaalsContact O-NE 3.14Å |
| 252 | T | 55.8 | Low | 52.2 | Low | 72 Ų | 72 | 101.6 Ų | 101.6 | 44% | 0.442 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -79.9 | -38.1 | 176.2 | -50.6 | 0 | 0 | 0 | 0 | 111 | T248 V249 S250 R255 Y256 | T248-T252 WeakPolarHBondContact O-CB 3.29Å; T248-T252 PolarHBondContact O-N 3.45Å; T248-T252 PolarHBondContact O-OG1 3.09Å; V249-T252 PolarHBondContact O-N 3.45Å; S250-T252 VanDerWaalsContact C-N 3.28Å; S250-T252 PolarHBondContact O-N 2.92Å; T252-R255 PolarHBondContact O-N 3.09Å; T252-Y256 WeakPolarHBondContact O-CB 3.25Å; T252-Y256 PolarHBondContact O-N 3.38Å |
| 253 | M | 51.6 | Low | 52.3 | Low | 127 Ų | 127 | 97.8 Ų | 97.8 | 63% | 0.626 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -68.5 | -42 | 174.4 | -162.5 | -179.3 | -152 | 0 | 0 | 112 | V249 S250 Y256 I257 | V249-M253 WeakPolarHBondContact O-CB 3.36Å; V249-M253 PolarHBondContact O-N 3.18Å; S250-M253 PolarHBondContact O-N 3.4Å; M253-Y256 PolarHBondContact O-N 3.4Å; M253-I257 HydrophobicContact CG-CD1 4.1Å; M253-I257 WeakPolarHBondContact O-CB 3.41Å; M253-I257 VanDerWaalsContact O-CG1 3.26Å; M253-I257 WeakPolarHBondContact O-CG1 3.42Å; M253-I257 PolarHBondContact O-N 3.17Å |
| 254 | I | 57.4 | Low | 53.1 | Low | 102 Ų | 102 | 95.6 Ų | 95.6 | 52% | 0.523 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 173.6 | -69.2 | 167 | 0 | 0 | 0 | 110.1 | S250 Y256 I257 H258 | S250-I254 WeakPolarHBondContact O-CB 3.3Å; S250-I254 WeakPolarHBondContact O-CG1 3.47Å; S250-I254 PolarHBondContact O-N 3.41Å; I254-Y256 VanDerWaalsContact C-N 3.34Å; I254-Y256 PolarHBondContact O-N 2.94Å; I254-I257 PolarHBondContact O-N 3.05Å; I254-H258 WeakPolarHBondContact O-CB 3.47Å; I254-H258 PolarHBondContact O-N 2.69Å |
| 255 | R | 54.8 | Low | 53.9 | Low | 167 Ų | 167 | 92.2 Ų | 92.2 | 63% | 0.63 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.8 | -37.4 | 174.1 | -82.2 | -175.5 | -71.1 | -159.4 | 3.8 | 113.1 | N251 T252 A259 | N251-R255 VanDerWaalsContact O-CB 3.3Å; N251-R255 WeakPolarHBondContact O-CB 3.4Å; N251-R255 VanDerWaalsContact O-CG 3.28Å; N251-R255 WeakPolarHBondContact O-CG 3.34Å; N251-R255 PolarHBondContact O-N 2.9Å; N251-R255 VanDerWaalsContact O-N 3.11Å; N251-R255 PolarHBondContact O-NE 3.42Å; N251-R255 VanDerWaalsContact O-NE 3.14Å; T252-R255 PolarHBondContact O-N 3.09Å; R255-A259 WeakPolarHBondContact O-CB 3.44Å; R255-A259 PolarHBondContact O-N 3.23Å |
| 256 | Y | 53.1 | Low | 54.9 | Low | 155 Ų | 155 | 88.7 Ų | 88.7 | 61% | 0.608 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -67 | -44.1 | 175.4 | 177.8 | -97.1 | 0 | 0 | 0 | 112.2 | T252 M253 I254 H258 A259 K260 | T252-Y256 WeakPolarHBondContact O-CB 3.25Å; T252-Y256 PolarHBondContact O-N 3.38Å; M253-Y256 PolarHBondContact O-N 3.4Å; I254-Y256 VanDerWaalsContact C-N 3.34Å; I254-Y256 PolarHBondContact O-N 2.94Å; Y256-H258 VanDerWaalsContact C-N 3.35Å; Y256-A259 PolarHBondContact O-N 2.99Å; Y256-K260 HydrophobicContact CE1-CD 4.48Å; Y256-K260 VanDerWaalsContact O-CB 3.3Å; Y256-K260 WeakPolarHBondContact O-CB 3.28Å; Y256-K260 PolarHBondContact O-N 3.38Å |
| 257 | I | 54.2 | Low | 56 | Low | 100 Ų | 100 | 81.3 Ų | 81.3 | 51% | 0.513 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -66.1 | -39.7 | 176.2 | -67.8 | 166.1 | 0 | 0 | 0 | 110.5 | M253 I254 K260 S261 | M253-I257 HydrophobicContact CG-CD1 4.1Å; M253-I257 WeakPolarHBondContact O-CB 3.41Å; M253-I257 VanDerWaalsContact O-CG1 3.26Å; M253-I257 WeakPolarHBondContact O-CG1 3.42Å; M253-I257 PolarHBondContact O-N 3.17Å; I254-I257 PolarHBondContact O-N 3.05Å; I257-K260 PolarHBondContact O-N 3.46Å; I257-S261 VanDerWaalsContact O-CB 3.27Å; I257-S261 WeakPolarHBondContact O-CB 3.11Å; I257-S261 PolarHBondContact O-N 3.23Å |
| 258 | H | 54.8 | Low | 57.5 | Low | 84 Ų | 84 | 84 Ų | 84 | 39% | 0.389 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -65.8 | -46.1 | 176.4 | -156.6 | 134.3 | 0 | 0 | 0 | 111.2 | D229 I254 Y256 K260 S261 S262 | D229-H258 WeakPolarHBondContact CB-NE2 3.48Å; D229-H258 IonicContact OD1-NE2 3.84Å; D229-H258 PolarHBondContact OD1-NE2 3.28Å; D229-H258 IonicContact OD2-CD2 3.48Å; D229-H258 IonicContact OD2-NE2 3.61Å; D229-H258 PolarHBondContact OD2-NE2 2.88Å; I254-H258 WeakPolarHBondContact O-CB 3.47Å; I254-H258 PolarHBondContact O-N 2.69Å; Y256-H258 VanDerWaalsContact C-N 3.35Å; H258-K260 VanDerWaalsContact C-N 3.34Å; H258-K260 PolarHBondContact O-N 3.4Å; H258-S261 CarbonylContact O-C 3.51Å; H258-S261 PolarHBondContact O-N 2.87Å; H258-S261 VanDerWaalsContact O-N 3.11Å; H258-S262 PolarHBondContact O-N 2.96Å; H258-S262 PolarHBondContact O-OG 2.98Å |
| 259 | A | 51.6 | Low | 59.2 | Low | 52 Ų | 52 | 80.9 Ų | 80.9 | 43% | 0.43 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.4 | -37.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | R255 Y256 S261 S262 T263 | R255-A259 WeakPolarHBondContact O-CB 3.44Å; R255-A259 PolarHBondContact O-N 3.23Å; Y256-A259 PolarHBondContact O-N 2.99Å; A259-S261 VanDerWaalsContact C-N 3.34Å; A259-S262 PolarHBondContact O-OG 3.01Å; A259-S262 VanDerWaalsContact O-OG 3.12Å; A259-T263 WeakPolarHBondContact O-CB 3.36Å; A259-T263 WeakPolarHBondContact O-CG2 3.47Å; A259-T263 PolarHBondContact O-N 3.27Å; A259-T263 VanDerWaalsContact O-N 3.1Å; A259-T263 PolarHBondContact O-OG1 3.23Å |
| 260 | K | 52.5 | Low | 61 | Low | 126 Ų | 126 | 76 Ų | 76 | 55% | 0.548 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -70.7 | -29 | 173.3 | -167.5 | 174.9 | -179.2 | -178.2 | 0 | 112.7 | Y256 I257 H258 T263 | Y256-K260 HydrophobicContact CE1-CD 4.48Å; Y256-K260 VanDerWaalsContact O-CB 3.3Å; Y256-K260 WeakPolarHBondContact O-CB 3.28Å; Y256-K260 PolarHBondContact O-N 3.38Å; I257-K260 PolarHBondContact O-N 3.46Å; H258-K260 VanDerWaalsContact C-N 3.34Å; H258-K260 PolarHBondContact O-N 3.4Å; K260-T263 VanDerWaalsContact C-OG1 3.23Å; K260-T263 WeakPolarHBondContact CA-OG1 3.24Å; K260-T263 PolarHBondContact O-OG1 3.45Å |
| 261 | S | 49.6 | Very low | 62.9 | Low | 55 Ų | 55 | 74.3 Ų | 74.3 | 39% | 0.385 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -80.1 | -32.8 | 175.7 | -172.8 | 0 | 0 | 0 | 0 | 112.5 | I257 H258 A259 K265 | I257-S261 VanDerWaalsContact O-CB 3.27Å; I257-S261 WeakPolarHBondContact O-CB 3.11Å; I257-S261 PolarHBondContact O-N 3.23Å; H258-S261 CarbonylContact O-C 3.51Å; H258-S261 PolarHBondContact O-N 2.87Å; H258-S261 VanDerWaalsContact O-N 3.11Å; A259-S261 VanDerWaalsContact C-N 3.34Å; S261-K265 WeakPolarHBondContact O-CG 3.47Å; S261-K265 PolarHBondContact O-N 2.92Å |
| 262 | S | 51.8 | Low | 64.6 | Low | 39 Ų | 39 | 73 Ų | 73 | 27% | 0.273 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -75.7 | -38.8 | 177.5 | 71.8 | 0 | 0 | 0 | 0 | 111.7 | H258 A259 L264 K265 S266 | H258-S262 PolarHBondContact O-N 2.96Å; H258-S262 PolarHBondContact O-OG 2.98Å; A259-S262 PolarHBondContact O-OG 3.01Å; A259-S262 VanDerWaalsContact O-OG 3.12Å; S262-L264 PolarHBondContact O-N 3.32Å; S262-K265 PolarHBondContact O-N 3.39Å; S262-S266 PolarHBondContact O-N 3.22Å |
| 263 | T | 54.3 | Low | 66.3 | Low | 29 Ų | 29 | 69.6 Ų | 69.6 | 18% | 0.178 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -57 | -36 | 174.1 | 33.8 | 0 | 0 | 0 | 0 | 112.5 | D104 A107 A259 K260 M267 | D104-T263 HydrophobicContact CB-CG2 4.16Å; D104-T263 WeakPolarHBondContact OD1-CA 3.44Å; D104-T263 VanDerWaalsContact OD1-CG2 3.24Å; D104-T263 WeakPolarHBondContact OD1-CG2 3.36Å; A107-T263 HydrophobicContact CB-CG2 3.96Å; A259-T263 WeakPolarHBondContact O-CB 3.36Å; A259-T263 WeakPolarHBondContact O-CG2 3.47Å; A259-T263 PolarHBondContact O-N 3.27Å; A259-T263 VanDerWaalsContact O-N 3.1Å; A259-T263 PolarHBondContact O-OG1 3.23Å; K260-T263 VanDerWaalsContact C-OG1 3.23Å; K260-T263 WeakPolarHBondContact CA-OG1 3.24Å; K260-T263 PolarHBondContact O-OG1 3.45Å; T263-M267 WeakPolarHBondContact O-CG 3.38Å |
| 264 | L | 59.4 | Low | 68.4 | Low | 100 Ų | 100 | 63.6 Ų | 63.6 | 52% | 0.524 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -77.2 | -27.1 | 175.8 | -75.7 | 165.2 | 0 | 0 | 0 | 113.5 | S262 | S262-L264 PolarHBondContact O-N 3.32Å |
| 265 | K | 66.4 | Low | 70.2 | Confident | 66 Ų | 66 | 61.5 Ų | 61.5 | 29% | 0.287 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -70.8 | -51.7 | -179.7 | -74.7 | 173.8 | -172.4 | 168.6 | 0 | 110.8 | F226 D229 S261 S262 M267 W268 | F226-K265 HydrophobicContact CB-CB 4.17Å; F226-K265 WeakPolarHBondContact CB-O 3.42Å; F226-K265 WeakPolarHBondContact CG-O 3.06Å; F226-K265 WeakPolarHBondContact O-CB 3.36Å; D229-K265 IonicContact OD1-NZ 2.76Å; D229-K265 PolarHBondContact OD1-NZ 2.94Å; D229-K265 IonicContact OD2-NZ 3.04Å; D229-K265 PolarHBondContact OD2-NZ 2.91Å; S261-K265 WeakPolarHBondContact O-CG 3.47Å; S261-K265 PolarHBondContact O-N 2.92Å; S262-K265 PolarHBondContact O-N 3.39Å; K265-M267 PolarHBondContact O-N 2.93Å; K265-M267 VanDerWaalsContact O-N 3.15Å; K265-W268 WeakPolarHBondContact O-CB 3.43Å; K265-W268 PolarHBondContact O-N 3.41Å |
| 266 | S | 68.5 | Low | 72.1 | Confident | 12 Ų | 12 | 56.6 Ų | 56.6 | 8% | 0.084 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -54.8 | -34.1 | -179.6 | -178.3 | 0 | 0 | 0 | 0 | 112.9 | D104 S262 W268 A269 | D104-S266 WeakPolarHBondContact OD2-CB 3.3Å; D104-S266 PolarHBondContact OD2-OG 3.32Å; S262-S266 PolarHBondContact O-N 3.22Å; S266-W268 VanDerWaalsContact C-N 3.26Å; S266-W268 PolarHBondContact O-N 2.81Å; S266-A269 VanDerWaalsContact O-CB 3.31Å; S266-A269 WeakPolarHBondContact O-CB 3.34Å; S266-A269 PolarHBondContact O-N 3.49Å |
| 267 | M | 77.2 | Confident | 74.2 | Confident | 8 Ų | 8 | 49.2 Ų | 49.2 | 4% | 0.039 | 26% | 0.259 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -17.6 | 177 | -71.7 | -164.9 | 157.8 | 0 | 0 | 115.2 | D104 L105 N108 P162 T263 K265 A269 Y270 | D104-M267 HydrophobicContact CB-CE 4.5Å; L105-M267 HydrophobicContact CB-CE 4.33Å; L105-M267 HydrophobicContact CD1-CE 3.51Å; L105-M267 HydrophobicContact CG-CE 3.8Å; N108-M267 HydrophobicContact CB-CE 3.77Å; N108-M267 HydrophobicContact CB-SD 4.47Å; P162-M267 HydrophobicContact CB-CB 4.07Å; P162-M267 HydrophobicContact CB-SD 4.12Å; P162-M267 HydrophobicContact CG-CB 4.27Å; T263-M267 WeakPolarHBondContact O-CG 3.38Å; K265-M267 PolarHBondContact O-N 2.93Å; K265-M267 VanDerWaalsContact O-N 3.15Å; M267-A269 PolarHBondContact O-N 3.49Å; M267-Y270 WeakPolarHBondContact O-CB 3.39Å; M267-Y270 PolarHBondContact O-N 2.83Å; M267-Y270 VanDerWaalsContact O-N 3.14Å |
| 268 | W | 83.7 | Confident | 76.2 | Confident | 141 Ų | 141 | 47.4 Ų | 47.4 | 53% | 0.534 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -64.6 | -20.5 | 173.2 | -75 | 91.2 | 0 | 0 | 0 | 112.9 | F226 K265 S266 Y270 I271 V272 | F226-W268 HydrophobicContact CD1-CB 3.83Å; F226-W268 HydrophobicContact CD1-CG 4.42Å; F226-W268 HydrophobicContact CD2-CB 4.06Å; F226-W268 HydrophobicContact CE1-CB 3.59Å; F226-W268 HydrophobicContact CE1-CG 4.21Å; F226-W268 HydrophobicContact CE2-CB 3.83Å; F226-W268 HydrophobicContact CG-CB 4.07Å; F226-W268 HydrophobicContact CZ-CB 3.6Å; K265-W268 WeakPolarHBondContact O-CB 3.43Å; K265-W268 PolarHBondContact O-N 3.41Å; S266-W268 VanDerWaalsContact C-N 3.26Å; S266-W268 PolarHBondContact O-N 2.81Å; W268-Y270 PolarHBondContact O-N 3.35Å; W268-I271 HydrophobicContact CE3-CB 4.18Å; W268-I271 HydrophobicContact CE3-CG1 4.09Å; W268-I271 HydrophobicContact CE3-CG2 4.33Å; W268-I271 HydrophobicContact CZ3-CG2 4.42Å; W268-I271 WeakPolarHBondContact O-CB 3.46Å; W268-I271 PolarHBondContact O-N 3.28Å; W268-V272 WeakPolarHBondContact O-CG2 3.42Å; W268-V272 PolarHBondContact O-N 3.11Å |
| 269 | A | 87.1 | Confident | 78.2 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -55.9 | -37.9 | 172 | 0 | 0 | 0 | 0 | 0 | 111.8 | V97 I221 A222 S266 M267 I271 V272 I273 | V97-A269 HydrophobicContact CG2-CB 3.9Å; I221-A269 HydrophobicContact CG2-CB 4.46Å; A222-A269 HydrophobicContact CB-CB 4.09Å; S266-A269 VanDerWaalsContact O-CB 3.31Å; S266-A269 WeakPolarHBondContact O-CB 3.34Å; S266-A269 PolarHBondContact O-N 3.49Å; M267-A269 PolarHBondContact O-N 3.49Å; A269-I271 VanDerWaalsContact C-N 3.35Å; A269-I271 PolarHBondContact O-N 3.43Å; A269-V272 PolarHBondContact O-N 3.49Å; A269-I273 WeakPolarHBondContact O-CB 3.5Å; A269-I273 WeakPolarHBondContact O-CD1 3.02Å; A269-I273 VanDerWaalsContact O-CG1 3.22Å; A269-I273 WeakPolarHBondContact O-CG1 3.44Å; A269-I273 PolarHBondContact O-N 3.43Å |
| 270 | Y | 89.9 | Confident | 80.3 | Confident | 2 Ų | 2 | 46.9 Ų | 46.9 | 1% | 0.008 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.3 | -38.4 | 176.1 | -71.8 | -83.7 | 0 | 0 | 0 | 112.6 | V97 T101 L105 M158 I161 P162 M267 W268 G274 | V97-Y270 HydrophobicContact CG1-CD1 4.13Å; V97-Y270 HydrophobicContact CG1-CE1 3.6Å; V97-Y270 HydrophobicContact CG2-CE2 4.45Å; T101-Y270 HydrophobicContact CG2-CE2 3.88Å; T101-Y270 WeakPolarHBondContact OG1-CE2 3.48Å; T101-Y270 PolarHBondContact OG1-OH 2.87Å; L105-Y270 HydrophobicContact CD1-CE2 3.72Å; L105-Y270 WeakPolarHBondContact CD1-OH 3.26Å; M158-Y270 HydrophobicContact CE-CD1 3.47Å; M158-Y270 VanDerWaalsContact CE-CD1 3.47Å; M158-Y270 HydrophobicContact CE-CE1 4.05Å; M158-Y270 HydrophobicContact CE-CG 4.41Å; M158-Y270 WeakPolarHBondContact O-CB 3.44Å; M158-Y270 HydrophobicContact SD-CD1 3.96Å; M158-Y270 HydrophobicContact SD-CE1 4.41Å; I161-Y270 HydrophobicContact CB-CD1 4.16Å; I161-Y270 HydrophobicContact CB-CE1 4.33Å; I161-Y270 HydrophobicContact CD1-CD1 3.99Å; I161-Y270 HydrophobicContact CD1-CE1 3.86Å; I161-Y270 HydrophobicContact CG2-CD1 3.91Å; I161-Y270 HydrophobicContact CG2-CD2 4.29Å; I161-Y270 HydrophobicContact CG2-CE1 3.71Å; I161-Y270 HydrophobicContact CG2-CE2 4.09Å; I161-Y270 HydrophobicContact CG2-CG 4.2Å; P162-Y270 HydrophobicContact CG-CD2 4.32Å; P162-Y270 HydrophobicContact CG-CG 4.27Å; M267-Y270 WeakPolarHBondContact O-CB 3.39Å; M267-Y270 PolarHBondContact O-N 2.83Å; M267-Y270 VanDerWaalsContact O-N 3.14Å; W268-Y270 PolarHBondContact O-N 3.35Å; Y270-G274 PolarHBondContact O-N 3.44Å |
| 271 | I | 91.6 | Very high | 82.4 | Confident | 35 Ų | 35 | 40.9 Ų | 40.9 | 18% | 0.179 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -68.3 | -41.5 | 177.9 | -53.2 | -57.2 | 0 | 0 | 0 | 110.7 | F159 P162 F163 W268 A269 G274 S275 | F159-I271 HydrophobicContact CD1-CB 4.5Å; F159-I271 HydrophobicContact CD1-CD1 3.83Å; F159-I271 HydrophobicContact CD1-CG2 4.18Å; F159-I271 HydrophobicContact CE1-CG2 3.96Å; F159-I271 WeakPolarHBondContact CE1-O 3.47Å; P162-I271 HydrophobicContact CG-CD1 4.12Å; F163-I271 HydrophobicContact CE2-CD1 4.24Å; W268-I271 HydrophobicContact CE3-CB 4.18Å; W268-I271 HydrophobicContact CE3-CG1 4.09Å; W268-I271 HydrophobicContact CE3-CG2 4.33Å; W268-I271 HydrophobicContact CZ3-CG2 4.42Å; W268-I271 WeakPolarHBondContact O-CB 3.46Å; W268-I271 PolarHBondContact O-N 3.28Å; A269-I271 VanDerWaalsContact C-N 3.35Å; A269-I271 PolarHBondContact O-N 3.43Å; I271-G274 PolarHBondContact O-N 2.75Å; I271-S275 WeakPolarHBondContact O-CB 3.48Å; I271-S275 PolarHBondContact O-N 3.27Å; I271-S275 PolarHBondContact O-OG 2.91Å |
| 272 | V | 91.3 | Very high | 84.6 | Confident | 61 Ų | 61 | 42.9 Ų | 42.9 | 37% | 0.37 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.4 | -48.9 | 176.6 | 175.3 | 0 | 0 | 0 | 0 | 110.7 | F226 W268 A269 G274 S275 F276 | F226-V272 HydrophobicContact CE2-CG2 4.05Å; F226-V272 HydrophobicContact CZ-CG2 4.02Å; W268-V272 WeakPolarHBondContact O-CG2 3.42Å; W268-V272 PolarHBondContact O-N 3.11Å; A269-V272 PolarHBondContact O-N 3.49Å; V272-G274 PolarHBondContact O-N 3.34Å; V272-S275 PolarHBondContact O-N 3.47Å; V272-F276 PolarHBondContact O-N 2.81Å |
| 273 | I | 92.4 | Very high | 86.6 | Confident | 1 Ų | 1 | 43.9 Ų | 43.9 | 1% | 0.005 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.2 | -44 | 178 | -63.5 | 163.6 | 0 | 0 | 0 | 110.3 | M93 V97 M158 A269 S275 F276 L277 | M93-I273 HydrophobicContact CB-CD1 4.07Å; M93-I273 HydrophobicContact CB-CG1 4.12Å; M93-I273 HydrophobicContact CB-CG2 4.14Å; M93-I273 HydrophobicContact CE-CG2 4.4Å; M93-I273 HydrophobicContact SD-CG1 4.38Å; V97-I273 HydrophobicContact CB-CD1 3.75Å; V97-I273 HydrophobicContact CG1-CD1 4.08Å; V97-I273 HydrophobicContact CG2-CD1 3.82Å; M158-I273 HydrophobicContact CE-CB 3.91Å; M158-I273 HydrophobicContact CE-CD1 4.17Å; M158-I273 HydrophobicContact CE-CG2 3.66Å; A269-I273 WeakPolarHBondContact O-CB 3.5Å; A269-I273 WeakPolarHBondContact O-CD1 3.02Å; A269-I273 VanDerWaalsContact O-CG1 3.22Å; A269-I273 WeakPolarHBondContact O-CG1 3.44Å; A269-I273 PolarHBondContact O-N 3.43Å; I273-S275 VanDerWaalsContact C-N 3.32Å; I273-S275 PolarHBondContact O-N 3.41Å; I273-F276 WeakPolarHBondContact O-CB 3.32Å; I273-F276 PolarHBondContact O-N 2.86Å; I273-L277 HydrophobicContact CG2-CD1 3.88Å; I273-L277 HydrophobicContact CG2-CG 4.24Å; I273-L277 VanDerWaalsContact O-CG 3.26Å; I273-L277 WeakPolarHBondContact O-CG 3.43Å; I273-L277 PolarHBondContact O-N 2.84Å |
| 274 | G | 94.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58.7 | -41 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | A155 F159 Y270 I271 V272 L277 L278 | A155-G274 WeakPolarHBondContact CB-O 3.23Å; F159-G274 VanDerWaalsContact CZ-C 3.41Å; Y270-G274 PolarHBondContact O-N 3.44Å; I271-G274 PolarHBondContact O-N 2.75Å; V272-G274 PolarHBondContact O-N 3.34Å; G274-L277 PolarHBondContact O-N 2.96Å; G274-L278 WeakPolarHBondContact O-CB 3.15Å; G274-L278 PolarHBondContact O-N 3.25Å |
| 275 | S | 94.9 | Very high | 90.2 | Very high | 59 Ų | 59 | 40.9 Ų | 40.9 | 41% | 0.413 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -66.3 | -41.6 | 177 | -57.3 | 0 | 0 | 0 | 0 | 112.1 | I271 V272 I273 L278 F279 | I271-S275 WeakPolarHBondContact O-CB 3.48Å; I271-S275 PolarHBondContact O-N 3.27Å; I271-S275 PolarHBondContact O-OG 2.91Å; V272-S275 PolarHBondContact O-N 3.47Å; I273-S275 VanDerWaalsContact C-N 3.32Å; I273-S275 PolarHBondContact O-N 3.41Å; S275-L278 PolarHBondContact O-N 3.25Å; S275-F279 PolarHBondContact O-N 2.87Å |
| 276 | F | 95.8 | Very high | 91.4 | Very high | 63 Ų | 63 | 40.9 Ų | 40.9 | 28% | 0.276 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -61 | -47 | 172.9 | 170 | -97 | 0 | 0 | 0 | 111.6 | G86 L89 M93 V272 I273 L278 F279 I280 | G86-F276 VanDerWaalsContact O-CE1 3.26Å; G86-F276 WeakPolarHBondContact O-CE1 3.23Å; G86-F276 WeakPolarHBondContact O-CZ 3.23Å; L89-F276 HydrophobicContact CD2-CE1 4.12Å; L89-F276 HydrophobicContact CD2-CZ 4.04Å; M93-F276 HydrophobicContact CE-CD1 3.34Å; M93-F276 HydrophobicContact CE-CE1 3.63Å; M93-F276 HydrophobicContact CE-CG 3.96Å; M93-F276 HydrophobicContact CE-CZ 4.44Å; V272-F276 PolarHBondContact O-N 2.81Å; I273-F276 WeakPolarHBondContact O-CB 3.32Å; I273-F276 PolarHBondContact O-N 2.86Å; F276-L278 VanDerWaalsContact C-N 3.32Å; F276-L278 PolarHBondContact O-N 3.1Å; F276-F279 WeakPolarHBondContact O-CB 3.2Å; F276-F279 PolarHBondContact O-N 2.97Å; F276-I280 HydrophobicContact CD1-CG1 4.47Å; F276-I280 HydrophobicContact CE1-CG1 3.99Å; F276-I280 HydrophobicContact CE2-CD1 4.18Å; F276-I280 HydrophobicContact CE2-CG1 4.2Å; F276-I280 HydrophobicContact CZ-CD1 4.06Å; F276-I280 HydrophobicContact CZ-CG1 3.85Å; F276-I280 WeakPolarHBondContact O-CG1 3.34Å; F276-I280 PolarHBondContact O-N 2.91Å |
| 277 | L | 95.9 | Very high | 92.4 | Very high | 1 Ų | 1 | 41.3 Ų | 41.3 | 1% | 0.005 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.8 | -38.3 | 178.1 | -68.2 | 170 | 0 | 0 | 0 | 112.2 | M151 T154 A155 M158 I273 G274 F279 I280 S281 | M151-L277 HydrophobicContact CE-CB 4.29Å; M151-L277 HydrophobicContact CE-CD2 3.22Å; M151-L277 HydrophobicContact CE-CG 4.35Å; M151-L277 HydrophobicContact SD-CD2 4.29Å; T154-L277 HydrophobicContact CG2-CD1 3.69Å; A155-L277 HydrophobicContact CB-CB 3.93Å; M158-L277 HydrophobicContact CG-CD1 3.86Å; I273-L277 HydrophobicContact CG2-CD1 3.88Å; I273-L277 HydrophobicContact CG2-CG 4.24Å; I273-L277 VanDerWaalsContact O-CG 3.26Å; I273-L277 WeakPolarHBondContact O-CG 3.43Å; I273-L277 PolarHBondContact O-N 2.84Å; G274-L277 PolarHBondContact O-N 2.96Å; L277-F279 VanDerWaalsContact C-N 3.35Å; L277-I280 PolarHBondContact O-N 3.47Å; L277-S281 WeakPolarHBondContact O-CB 3.48Å; L277-S281 PolarHBondContact O-N 2.84Å |
| 278 | L | 97.1 | Very high | 93 | Very high | 61 Ų | 61 | 46.3 Ų | 46.3 | 32% | 0.319 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -61.8 | -43.6 | 174.7 | -179.1 | 64 | 0 | 0 | 0 | 111.1 | L152 A155 F159 G274 S275 F276 I280 S281 L282 | L152-L278 HydrophobicContact CD1-CD1 3.47Å; L152-L278 VanDerWaalsContact CD1-CD1 3.47Å; A155-L278 HydrophobicContact CB-CB 4.07Å; F159-L278 HydrophobicContact CE2-CD2 4.38Å; G274-L278 WeakPolarHBondContact O-CB 3.15Å; G274-L278 PolarHBondContact O-N 3.25Å; S275-L278 PolarHBondContact O-N 3.25Å; F276-L278 VanDerWaalsContact C-N 3.32Å; F276-L278 PolarHBondContact O-N 3.1Å; L278-I280 PolarHBondContact O-N 3.12Å; L278-S281 WeakPolarHBondContact O-CB 3.37Å; L278-S281 PolarHBondContact O-N 2.74Å; L278-L282 WeakPolarHBondContact O-CG 3.35Å; L278-L282 PolarHBondContact O-N 3.49Å |
| 279 | F | 96.8 | Very high | 93.1 | Very high | 117 Ų | 117 | 43.5 Ų | 43.5 | 51% | 0.513 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -60 | -45.5 | 174.6 | 173.1 | -103.1 | 0 | 0 | 0 | 112 | S275 F276 L277 S281 L282 L283 | S275-F279 PolarHBondContact O-N 2.87Å; F276-F279 WeakPolarHBondContact O-CB 3.2Å; F276-F279 PolarHBondContact O-N 2.97Å; L277-F279 VanDerWaalsContact C-N 3.35Å; F279-S281 VanDerWaalsContact C-N 3.32Å; F279-S281 PolarHBondContact O-N 2.92Å; F279-L282 WeakPolarHBondContact O-CB 3.17Å; F279-L282 PolarHBondContact O-N 3.08Å; F279-L283 HydrophobicContact CD1-CD1 4.24Å; F279-L283 HydrophobicContact CE1-CD1 3.68Å; F279-L283 HydrophobicContact CE1-CG 4.19Å; F279-L283 HydrophobicContact CE2-CD2 4.49Å; F279-L283 HydrophobicContact CZ-CD1 4.05Å; F279-L283 HydrophobicContact CZ-CD2 4.12Å; F279-L283 HydrophobicContact CZ-CG 4.19Å; F279-L283 PolarHBondContact O-N 3.04Å; F279-L283 VanDerWaalsContact O-N 3.08Å |
| 280 | I | 96.4 | Very high | 92.8 | Very high | 8 Ų | 8 | 52.1 Ų | 52.1 | 4% | 0.041 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.5 | -38.1 | 176.2 | -59.5 | -57.6 | 0 | 0 | 0 | 111.7 | M151 F276 L277 L278 L282 L283 F284 | M151-I280 HydrophobicContact CE-CB 3.96Å; M151-I280 HydrophobicContact CE-CG2 3.8Å; F276-I280 HydrophobicContact CD1-CG1 4.47Å; F276-I280 HydrophobicContact CE1-CG1 3.99Å; F276-I280 HydrophobicContact CE2-CD1 4.18Å; F276-I280 HydrophobicContact CE2-CG1 4.2Å; F276-I280 HydrophobicContact CZ-CD1 4.06Å; F276-I280 HydrophobicContact CZ-CG1 3.85Å; F276-I280 WeakPolarHBondContact O-CG1 3.34Å; F276-I280 PolarHBondContact O-N 2.91Å; L277-I280 PolarHBondContact O-N 3.47Å; L278-I280 PolarHBondContact O-N 3.12Å; I280-L282 VanDerWaalsContact C-N 3.35Å; I280-L282 PolarHBondContact O-N 3.33Å; I280-L283 HydrophobicContact CD1-CD1 3.97Å; I280-L283 WeakPolarHBondContact O-CB 3.42Å; I280-L283 PolarHBondContact O-N 3.38Å; I280-L283 VanDerWaalsContact O-N 3.16Å; I280-F284 HydrophobicContact CG2-CD2 4.15Å; I280-F284 HydrophobicContact CG2-CE2 3.88Å; I280-F284 WeakPolarHBondContact O-CD2 3.46Å; I280-F284 PolarHBondContact O-N 3.17Å; I280-F284 VanDerWaalsContact O-N 3.16Å |
| 281 | S | 96.7 | Very high | 91.8 | Very high | 1 Ų | 1 | 54.6 Ų | 54.6 | 1% | 0.007 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -58.3 | -45.9 | 174 | 177.2 | 0 | 0 | 0 | 0 | 111.6 | G148 L152 L277 L278 F279 L283 F284 F285 | G148-S281 PolarHBondContact O-OG 2.9Å; L152-S281 WeakPolarHBondContact CB-OG 3.37Å; L152-S281 PolarHBondContact N-OG 3.39Å; L277-S281 WeakPolarHBondContact O-CB 3.48Å; L277-S281 PolarHBondContact O-N 2.84Å; L278-S281 WeakPolarHBondContact O-CB 3.37Å; L278-S281 PolarHBondContact O-N 2.74Å; F279-S281 VanDerWaalsContact C-N 3.32Å; F279-S281 PolarHBondContact O-N 2.92Å; S281-L283 VanDerWaalsContact C-N 3.3Å; S281-L283 PolarHBondContact O-N 3.3Å; S281-F284 PolarHBondContact O-N 3.08Å; S281-F284 VanDerWaalsContact O-N 3.14Å; S281-F285 WeakPolarHBondContact O-CD2 3.38Å; S281-F285 PolarHBondContact O-N 3.17Å; S281-F285 VanDerWaalsContact O-N 3.16Å; S281-F285 WeakPolarHBondContact OG-CE2 2.96Å |
| 282 | L | 95.5 | Very high | 89.9 | Confident | 97 Ų | 97 | 55.6 Ų | 55.6 | 51% | 0.508 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60.4 | -38.5 | 175.1 | -65.9 | 173.6 | 0 | 0 | 0 | 112 | L278 F279 I280 F284 F285 V286 | L278-L282 WeakPolarHBondContact O-CG 3.35Å; L278-L282 PolarHBondContact O-N 3.49Å; F279-L282 WeakPolarHBondContact O-CB 3.17Å; F279-L282 PolarHBondContact O-N 3.08Å; I280-L282 VanDerWaalsContact C-N 3.35Å; I280-L282 PolarHBondContact O-N 3.33Å; L282-F284 VanDerWaalsContact C-N 3.33Å; L282-F284 PolarHBondContact O-N 3.32Å; L282-F285 PolarHBondContact O-N 3.36Å; L282-V286 VanDerWaalsContact O-CG2 3.32Å; L282-V286 WeakPolarHBondContact O-CG2 3.37Å; L282-V286 PolarHBondContact O-N 3.39Å |
| 283 | L | 94.4 | Very high | 87.6 | Confident | 59 Ų | 59 | 57.5 Ų | 57.5 | 31% | 0.309 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60.2 | -40.9 | 175 | -67.2 | 178.9 | 0 | 0 | 0 | 112.2 | F279 I280 S281 V286 L287 | F279-L283 HydrophobicContact CD1-CD1 4.24Å; F279-L283 HydrophobicContact CE1-CD1 3.68Å; F279-L283 HydrophobicContact CE1-CG 4.19Å; F279-L283 HydrophobicContact CE2-CD2 4.49Å; F279-L283 HydrophobicContact CZ-CD1 4.05Å; F279-L283 HydrophobicContact CZ-CD2 4.12Å; F279-L283 HydrophobicContact CZ-CG 4.19Å; F279-L283 PolarHBondContact O-N 3.04Å; F279-L283 VanDerWaalsContact O-N 3.08Å; I280-L283 HydrophobicContact CD1-CD1 3.97Å; I280-L283 WeakPolarHBondContact O-CB 3.42Å; I280-L283 PolarHBondContact O-N 3.38Å; I280-L283 VanDerWaalsContact O-N 3.16Å; S281-L283 VanDerWaalsContact C-N 3.3Å; S281-L283 PolarHBondContact O-N 3.3Å; L283-V286 PolarHBondContact O-N 3.33Å; L283-L287 WeakPolarHBondContact O-CB 3.34Å; L283-L287 VanDerWaalsContact O-CG 3.29Å; L283-L287 WeakPolarHBondContact O-CG 3.2Å; L283-L287 PolarHBondContact O-N 2.94Å |
| 284 | F | 94.4 | Very high | 85.2 | Confident | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -64.3 | -40.2 | 175.4 | -81.7 | -65.7 | 0 | 0 | 0 | 112.7 | A83 L84 L147 M151 I280 S281 L282 L287 Y288 | A83-F284 HydrophobicContact CB-CD1 4.43Å; A83-F284 HydrophobicContact CB-CE1 3.98Å; A83-F284 HydrophobicContact CB-CE2 4.28Å; A83-F284 HydrophobicContact CB-CZ 3.9Å; L84-F284 HydrophobicContact CD2-CE1 4.46Å; L84-F284 HydrophobicContact CD2-CZ 4.07Å; L84-F284 HydrophobicContact CG-CZ 4.34Å; L147-F284 HydrophobicContact CB-CD1 4.31Å; L147-F284 HydrophobicContact CB-CD2 4.45Å; L147-F284 HydrophobicContact CB-CE1 4.18Å; L147-F284 HydrophobicContact CB-CE2 4.31Å; L147-F284 HydrophobicContact CB-CG 4.45Å; L147-F284 HydrophobicContact CB-CZ 4.18Å; L147-F284 HydrophobicContact CD1-CE1 4.08Å; L147-F284 HydrophobicContact CD1-CZ 4.16Å; M151-F284 HydrophobicContact CG-CD2 4.35Å; M151-F284 HydrophobicContact CG-CE2 4.27Å; I280-F284 HydrophobicContact CG2-CD2 4.15Å; I280-F284 HydrophobicContact CG2-CE2 3.88Å; I280-F284 WeakPolarHBondContact O-CD2 3.46Å; I280-F284 PolarHBondContact O-N 3.17Å; I280-F284 VanDerWaalsContact O-N 3.16Å; S281-F284 PolarHBondContact O-N 3.08Å; S281-F284 VanDerWaalsContact O-N 3.14Å; L282-F284 VanDerWaalsContact C-N 3.33Å; L282-F284 PolarHBondContact O-N 3.32Å; F284-L287 HydrophobicContact CD1-CD1 4.41Å; F284-L287 PolarHBondContact O-N 3.38Å; F284-Y288 PolarHBondContact O-N 2.72Å |
| 285 | F | 93.9 | Very high | 82.7 | Confident | 66 Ų | 66 | 73.3 Ų | 73.3 | 29% | 0.289 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.5 | -37 | 174.2 | -68.6 | -60.1 | 0 | 0 | 0 | 112.4 | V149 S281 L282 Y288 S289 | V149-F285 HydrophobicContact CG2-CE1 4.25Å; V149-F285 HydrophobicContact CG2-CZ 3.97Å; S281-F285 WeakPolarHBondContact O-CD2 3.38Å; S281-F285 PolarHBondContact O-N 3.17Å; S281-F285 VanDerWaalsContact O-N 3.16Å; S281-F285 WeakPolarHBondContact OG-CE2 2.96Å; L282-F285 PolarHBondContact O-N 3.36Å; F285-Y288 PolarHBondContact O-N 3.22Å; F285-S289 PolarHBondContact O-N 3.12Å; F285-S289 PolarHBondContact O-OG 2.94Å |
| 286 | V | 91.7 | Very high | 79.6 | Confident | 67 Ų | 67 | 77.7 Ų | 77.7 | 41% | 0.406 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63 | -45.5 | 172.3 | 171 | 0 | 0 | 0 | 0 | 110.4 | L282 L283 Y288 S289 R290 | L282-V286 VanDerWaalsContact O-CG2 3.32Å; L282-V286 WeakPolarHBondContact O-CG2 3.37Å; L282-V286 PolarHBondContact O-N 3.39Å; L283-V286 PolarHBondContact O-N 3.33Å; V286-Y288 VanDerWaalsContact C-N 3.31Å; V286-Y288 PolarHBondContact O-N 3.06Å; V286-S289 WeakPolarHBondContact CA-OG 3.5Å; V286-S289 PolarHBondContact O-N 3.18Å; V286-S289 PolarHBondContact O-OG 3.48Å; V286-R290 HydrophobicContact CG1-CG 4.36Å; V286-R290 WeakPolarHBondContact O-CB 3.4Å; V286-R290 VanDerWaalsContact O-CG 3.32Å; V286-R290 WeakPolarHBondContact O-CG 3.32Å; V286-R290 PolarHBondContact O-N 3.41Å |
| 287 | L | 89.6 | Confident | 76.6 | Confident | 20 Ų | 20 | 83.1 Ų | 83.1 | 11% | 0.105 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -59.4 | -42.1 | 175.5 | -73.1 | 172.3 | 0 | 0 | 0 | 111.9 | M79 V80 A83 L283 F284 R290 G291 | M79-L287 HydrophobicContact CB-CD2 3.83Å; M79-L287 HydrophobicContact CE-CD2 3.99Å; V80-L287 HydrophobicContact CG2-CD1 4.23Å; A83-L287 HydrophobicContact CB-CD1 3.88Å; L283-L287 WeakPolarHBondContact O-CB 3.34Å; L283-L287 VanDerWaalsContact O-CG 3.29Å; L283-L287 WeakPolarHBondContact O-CG 3.2Å; L283-L287 PolarHBondContact O-N 2.94Å; F284-L287 HydrophobicContact CD1-CD1 4.41Å; F284-L287 PolarHBondContact O-N 3.38Å; L287-R290 PolarHBondContact O-N 3.4Å; L287-G291 PolarHBondContact O-N 3.15Å |
| 288 | Y | 88.9 | Confident | 73.7 | Confident | 114 Ų | 114 | 89.2 Ų | 89.2 | 45% | 0.447 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -49.7 | 173.7 | 173.1 | -109.2 | 0 | 0 | 0 | 112.2 | N142 V145 F284 F285 V286 R290 G291 G292 | N142-Y288 HydrophobicContact CB-CD2 4.48Å; N142-Y288 HydrophobicContact CB-CE2 4.24Å; V145-Y288 HydrophobicContact CG2-CD1 3.78Å; V145-Y288 HydrophobicContact CG2-CD2 3.35Å; V145-Y288 HydrophobicContact CG2-CE1 3.94Å; V145-Y288 HydrophobicContact CG2-CE2 3.52Å; V145-Y288 HydrophobicContact CG2-CG 3.47Å; V145-Y288 VanDerWaalsContact CG2-CG 3.47Å; F284-Y288 PolarHBondContact O-N 2.72Å; F285-Y288 PolarHBondContact O-N 3.22Å; V286-Y288 VanDerWaalsContact C-N 3.31Å; V286-Y288 PolarHBondContact O-N 3.06Å; Y288-R290 VanDerWaalsContact C-N 3.28Å; Y288-R290 PolarHBondContact O-N 2.85Å; Y288-G291 PolarHBondContact O-N 3.11Å; Y288-G292 PolarHBondContact O-N 3.45Å |
| 289 | S | 85.9 | Confident | 70.5 | Confident | 81 Ų | 81 | 94.4 Ų | 94.4 | 57% | 0.566 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.5 | -34 | -179.3 | 69.5 | 0 | 0 | 0 | 0 | 113.1 | F285 V286 | F285-S289 PolarHBondContact O-N 3.12Å; F285-S289 PolarHBondContact O-OG 2.94Å; V286-S289 WeakPolarHBondContact CA-OG 3.5Å; V286-S289 PolarHBondContact O-N 3.18Å; V286-S289 PolarHBondContact O-OG 3.48Å |
| 290 | R | 82.3 | Confident | 67.6 | Low | 182 Ų | 182 | 93.5 Ų | 93.5 | 69% | 0.687 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -79.4 | -28.8 | 177.4 | -66.9 | 176.6 | 75.1 | 102 | 1.2 | 112.6 | V286 L287 Y288 G292 | V286-R290 HydrophobicContact CG1-CG 4.36Å; V286-R290 WeakPolarHBondContact O-CB 3.4Å; V286-R290 VanDerWaalsContact O-CG 3.32Å; V286-R290 WeakPolarHBondContact O-CG 3.32Å; V286-R290 PolarHBondContact O-N 3.41Å; L287-R290 PolarHBondContact O-N 3.4Å; Y288-R290 VanDerWaalsContact C-N 3.28Å; Y288-R290 PolarHBondContact O-N 2.85Å; R290-G292 VanDerWaalsContact C-N 3.28Å; R290-G292 PolarHBondContact O-N 3.39Å |
| 291 | G | 67.4 | Low | 64.6 | Low | 54 Ų | 54 | 97.6 Ų | 97.6 | 56% | 0.557 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -73.2 | -15.7 | 175 | 0 | 0 | 0 | 0 | 0 | 114.2 | L287 Y288 A293 | L287-G291 PolarHBondContact O-N 3.15Å; Y288-G291 PolarHBondContact O-N 3.11Å; G291-A293 VanDerWaalsContact C-N 3.31Å; G291-A293 PolarHBondContact O-N 3.47Å |
| 292 | G | 52.8 | Low | 61.8 | Low | 56 Ų | 56 | 101.9 Ų | 101.9 | 58% | 0.577 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | -13.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 116 | Y288 R290 | Y288-G292 PolarHBondContact O-N 3.45Å; R290-G292 VanDerWaalsContact C-N 3.28Å; R290-G292 PolarHBondContact O-N 3.39Å |
| 293 | A | 42.3 | Very low | 59 | Low | 100 Ų | 100 | 100.2 Ų | 100.2 | 83% | 0.826 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -6.2 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | G291 | G291-A293 VanDerWaalsContact C-N 3.31Å; G291-A293 PolarHBondContact O-N 3.47Å |
| 294 | S | 43 | Very low | 56.1 | Low | 103 Ų | 103 | 106.5 Ų | 106.5 | 72% | 0.72 | 62% | 0.623 | S | S | * | * | trans | -124.4 | 70.1 | 178.1 | -178.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 295 | R | 40.3 | Very low | 54.1 | Low | 230 Ų | 230 | 109.9 Ų | 109.9 | 87% | 0.868 | 64% | 0.644 | S | S | * | * | trans | -105.4 | 61.6 | 174.3 | -160.5 | 176.5 | 159 | 144.5 | -2.3 | 110.2 | ||||
| 296 | D | 30.5 | Very low | 52.1 | Low | 151 Ų | 151 | 113.6 Ų | 113.6 | 81% | 0.807 | 66% | 0.661 | S | S | * | * | trans | -76.5 | 118.9 | 142 | -85.1 | -30.8 | 0 | 0 | 0 | 106.5 | ||||
| 297 | K | 32.8 | Very low | 50.3 | Low | 178 Ų | 178 | 116.2 Ų | 116.2 | 77% | 0.774 | 67% | 0.67 | S | S | * | * | trans | -28.4 | 126.4 | 166.7 | -157.2 | 172.6 | -171.8 | 177.3 | 0 | 109.2 | Q299 | K297-Q299 PolarHBondContact O-N 2.98Š| ||
| 298 | P | 35.3 | Very low | 48.9 | Very low | 129 Ų | 129 | 116.1 Ų | 116.1 | 84% | 0.838 | 67% | 0.672 | S | S | * | * | trans | -66.3 | 88.6 | 160.8 | 6.5 | 5.3 | 0 | 0 | 0 | 105.9 | A300 | P298-A300 PolarHBondContact O-N 2.79Š| ||
| 299 | Q | 30.4 | Very low | 47.7 | Very low | 170 Ų | 170 | 117.7 Ų | 117.7 | 79% | 0.794 | 68% | 0.681 | S | S | * | * | trans | -55.2 | 109.3 | 162.7 | -167.6 | 174.7 | 23.7 | 0 | 0 | 105.2 | K297 A301 | K297-Q299 PolarHBondContact O-N 2.98Å; Q299-A301 VanDerWaalsContact C-N 3.27Å; Q299-A301 PolarHBondContact O-N 3.49Å | ||
| 300 | A | 34.3 | Very low | 47.4 | Very low | 97 Ų | 97 | 117.9 Ų | 117.9 | 80% | 0.802 | 67% | 0.673 | S | S | * | * | S | Bend | trans | 17.3 | 66.8 | 145.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | P298 | P298-A300 PolarHBondContact O-N 2.79Š|
| 301 | A | 33 | Very low | 47.4 | Very low | 95 Ų | 95 | 110.7 Ų | 110.7 | 79% | 0.785 | 65% | 0.647 | S | S | * | * | trans | -116.5 | 24.8 | 156.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | Q299 G303 | Q299-A301 VanDerWaalsContact C-N 3.27Å; Q299-A301 PolarHBondContact O-N 3.49Å; A301-G303 PolarHBondContact O-N 2.83Å | ||
| 302 | A | 38.9 | Very low | 48.4 | Very low | 90 Ų | 90 | 114.2 Ų | 114.2 | 74% | 0.744 | 65% | 0.652 | S | S | * | * | trans | -64.5 | 85.1 | 154.5 | 0 | 0 | 0 | 0 | 0 | 106.3 | K304 | A302-K304 PolarHBondContact O-N 2.96Š| ||
| 303 | G | 36.2 | Very low | 50.1 | Low | 63 Ų | 63 | 113.5 Ų | 113.5 | 65% | 0.649 | 64% | 0.641 | S | S | * | * | trans | -45.8 | 127.7 | 152.9 | 0 | 0 | 0 | 0 | 0 | 105.9 | A301 P305 | A301-G303 PolarHBondContact O-N 2.83Å; G303-P305 VanDerWaalsContact O-N 3.17Å | ||
| 304 | K | 34.9 | Very low | 52.4 | Low | 191 Ų | 191 | 108.8 Ų | 108.8 | 83% | 0.83 | 60% | 0.602 | S | S | * | * | trans | -36.7 | 127.5 | -178.1 | -64.9 | -178.2 | 178.8 | -174.1 | 0 | 108.3 | A302 K306 | A302-K304 PolarHBondContact O-N 2.96Å; K304-K306 PolarHBondContact O-N 3.44Å | ||
| 305 | P | 51.1 | Low | 54.7 | Low | 71 Ų | 71 | 104.7 Ų | 104.7 | 46% | 0.461 | 57% | 0.572 | S | S | . | * | trans | -49.6 | 124.9 | -177.8 | 20.1 | -31 | 0 | 0 | 0 | 106.8 | G303 M307 T433 | G303-P305 VanDerWaalsContact O-N 3.17Å; P305-M307 HydrophobicContact CB-CG 3.88Å; P305-M307 HydrophobicContact CG-CG 4.02Å; P305-M307 HydrophobicContact CG-SD 4.22Å; P305-M307 PolarHBondContact O-N 3.5Å; P305-T433 HydrophobicContact CB-CG2 3.93Å | ||
| 306 | K | 51.2 | Low | 57.2 | Low | 144 Ų | 144 | 97.7 Ų | 97.7 | 63% | 0.626 | 55% | 0.551 | S | S | * | * | trans | -64.1 | 87 | 171.7 | -71 | 179.9 | -177.2 | 171.5 | 0 | 105.1 | K304 T432 T433 | K304-K306 PolarHBondContact O-N 3.44Å; K306-T432 WeakPolarHBondContact O-CA 3.43Å; K306-T432 PolarHBondContact O-OG1 2.81Å; K306-T433 PolarHBondContact O-N 3.39Å | ||
| 307 | M | 55 | Low | 60.2 | Low | 121 Ų | 121 | 92.1 Ų | 92.1 | 60% | 0.596 | 52% | 0.521 | S | S | * | . | trans | -91.4 | 110.4 | 175.6 | -65.6 | -166.3 | 79.7 | 0 | 0 | 105.6 | P305 K309 | P305-M307 HydrophobicContact CB-CG 3.88Å; P305-M307 HydrophobicContact CG-CG 4.02Å; P305-M307 HydrophobicContact CG-SD 4.22Å; P305-M307 PolarHBondContact O-N 3.5Å; M307-K309 PolarHBondContact O-N 3.05Å | ||
| 308 | A | 60.2 | Low | 63.1 | Low | 19 Ų | 19 | 83.7 Ų | 83.7 | 16% | 0.157 | 49% | 0.485 | C | S | . | . | trans | -56.3 | 137.7 | 165.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | H310 H311 | A308-H310 PolarHBondContact O-N 3.32Å; A308-H311 VanDerWaalsContact O-CB 3.31Å; A308-H311 WeakPolarHBondContact O-CB 3.44Å; A308-H311 PolarHBondContact O-N 3.4Å | ||
| 309 | K | 63.7 | Low | 65.9 | Low | 147 Ų | 147 | 80.1 Ų | 80.1 | 64% | 0.639 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | -27.6 | 178.4 | -173.2 | 179.4 | 178 | -173.9 | 0 | 112.4 | M307 T497 | M307-K309 PolarHBondContact O-N 3.05Å; K309-T497 PolarHBondContact NZ-OG1 3.33Å |
| 310 | H | 78.8 | Confident | 69.1 | Low | 84 Ų | 84 | 76.8 Ų | 76.8 | 39% | 0.389 | 44% | 0.439 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.6 | 36.1 | 178.6 | -60.7 | -63.9 | 0 | 0 | 0 | 112.6 | A308 L312 A313 L314 V491 | A308-H310 PolarHBondContact O-N 3.32Å; H310-L312 PolarHBondContact O-N 3.21Å; H310-A313 HydrophobicContact CB-CB 4.2Å; H310-A313 PolarHBondContact O-N 3.01Å; H310-L314 WeakPolarHBondContact O-CB 3.11Å; H310-L314 PolarHBondContact O-N 2.98Å; H310-V491 HydrophobicContact CB-CG1 3.46Å; H310-V491 VanDerWaalsContact CB-CG1 3.46Å |
| 311 | H | 83.7 | Confident | 72.1 | Confident | 32 Ų | 32 | 72.2 Ų | 72.2 | 15% | 0.148 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -53.3 | -49.9 | -178.6 | -179.5 | 81.9 | 0 | 0 | 0 | 112.3 | A308 A313 L314 V315 T432 T438 | A308-H311 VanDerWaalsContact O-CB 3.31Å; A308-H311 WeakPolarHBondContact O-CB 3.44Å; A308-H311 PolarHBondContact O-N 3.4Å; H311-A313 PolarHBondContact O-N 3.39Å; H311-L314 PolarHBondContact O-N 3.19Å; H311-V315 WeakPolarHBondContact O-CG2 3.47Å; H311-V315 PolarHBondContact O-N 3.08Å; H311-T432 PolarHBondContact CE1-OG1 3.02Å; H311-T432 WeakPolarHBondContact ND1-CG2 3.27Å; H311-T432 PolarHBondContact ND1-OG1 2.84Å; H311-T438 WeakPolarHBondContact NE2-CG2 3.46Å |
| 312 | L | 86.9 | Confident | 75.1 | Confident | 127 Ų | 127 | 67.7 Ų | 67.7 | 67% | 0.665 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -61 | -45.7 | 178.1 | 178.5 | 61.3 | 0 | 0 | 0 | 112.4 | H310 L314 V315 I316 | H310-L312 PolarHBondContact O-N 3.21Å; L312-L314 VanDerWaalsContact C-N 3.27Å; L312-L314 PolarHBondContact O-N 3.25Å; L312-V315 PolarHBondContact O-N 3.36Å; L312-I316 HydrophobicContact CD1-CD1 4.08Å; L312-I316 HydrophobicContact CD1-CG1 4.32Å; L312-I316 HydrophobicContact CG-CD1 3.96Å; L312-I316 WeakPolarHBondContact O-CG1 3.24Å; L312-I316 PolarHBondContact O-N 3.33Å |
| 313 | A | 90 | Very high | 77.8 | Confident | 41 Ų | 41 | 65.5 Ų | 65.5 | 34% | 0.339 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.7 | -39 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | H310 H311 I316 L317 | H310-A313 HydrophobicContact CB-CB 4.2Å; H310-A313 PolarHBondContact O-N 3.01Å; H311-A313 PolarHBondContact O-N 3.39Å; A313-I316 PolarHBondContact O-N 3.44Å; A313-L317 WeakPolarHBondContact O-CB 3.31Å; A313-L317 VanDerWaalsContact O-CG 3.23Å; A313-L317 WeakPolarHBondContact O-CG 3.3Å; A313-L317 PolarHBondContact O-N 3.48Å |
| 314 | L | 90.3 | Very high | 80.7 | Confident | 1 Ų | 1 | 62.8 Ų | 62.8 | 1% | 0.005 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -67.9 | -39.8 | 178.1 | -167.1 | 152 | 0 | 0 | 0 | 111.8 | H310 H311 L312 L317 L318 W427 L428 V491 A492 | H310-L314 WeakPolarHBondContact O-CB 3.11Å; H310-L314 PolarHBondContact O-N 2.98Å; H311-L314 PolarHBondContact O-N 3.19Å; L312-L314 VanDerWaalsContact C-N 3.27Å; L312-L314 PolarHBondContact O-N 3.25Å; L314-L317 PolarHBondContact O-N 2.95Å; L314-L318 HydrophobicContact CD2-CD1 3.71Å; L314-L318 HydrophobicContact CD2-CG 4.4Å; L314-L318 WeakPolarHBondContact O-CB 3.31Å; L314-L318 PolarHBondContact O-N 3.39Å; L314-W427 HydrophobicContact CD1-CH2 4.44Å; L314-L428 HydrophobicContact CD2-CD1 3.07Å; L314-V491 HydrophobicContact CB-CG1 4.47Å; L314-A492 HydrophobicContact CD1-CB 3.6Å |
| 315 | V | 90.5 | Very high | 83.6 | Confident | 17 Ų | 17 | 53.9 Ų | 53.9 | 10% | 0.103 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.3 | -43.1 | 173.8 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | H311 L312 L318 F319 T438 A441 | H311-V315 WeakPolarHBondContact O-CG2 3.47Å; H311-V315 PolarHBondContact O-N 3.08Å; L312-V315 PolarHBondContact O-N 3.36Å; V315-L318 PolarHBondContact O-N 3.46Å; V315-F319 PolarHBondContact O-N 3.48Å; V315-T438 HydrophobicContact CG2-CG2 4.03Å; V315-A441 HydrophobicContact CG1-CB 3.54Å |
| 316 | I | 92.9 | Very high | 85.6 | Confident | 83 Ų | 83 | 51.2 Ų | 51.2 | 43% | 0.426 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.4 | -43.9 | 175.9 | -67.8 | 167.6 | 0 | 0 | 0 | 111 | L312 A313 L318 F319 F320 | L312-I316 HydrophobicContact CD1-CD1 4.08Å; L312-I316 HydrophobicContact CD1-CG1 4.32Å; L312-I316 HydrophobicContact CG-CD1 3.96Å; L312-I316 WeakPolarHBondContact O-CG1 3.24Å; L312-I316 PolarHBondContact O-N 3.33Å; A313-I316 PolarHBondContact O-N 3.44Å; I316-L318 VanDerWaalsContact C-N 3.32Å; I316-L318 PolarHBondContact O-N 3.22Å; I316-F319 WeakPolarHBondContact O-CB 3.16Å; I316-F319 PolarHBondContact O-N 2.82Å; I316-F320 HydrophobicContact CG2-CD2 3.99Å; I316-F320 HydrophobicContact CG2-CE2 3.7Å; I316-F320 VanDerWaalsContact O-CD2 3.23Å; I316-F320 WeakPolarHBondContact O-CD2 3.14Å; I316-F320 PolarHBondContact O-N 3.15Å |
| 317 | L | 94.3 | Very high | 87.7 | Confident | 34 Ų | 34 | 44.4 Ų | 44.4 | 18% | 0.178 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.8 | -40.2 | 176.9 | -70.9 | 165.9 | 0 | 0 | 0 | 111.6 | A313 L314 F320 F321 L484 V487 M488 V491 | A313-L317 WeakPolarHBondContact O-CB 3.31Å; A313-L317 VanDerWaalsContact O-CG 3.23Å; A313-L317 WeakPolarHBondContact O-CG 3.3Å; A313-L317 PolarHBondContact O-N 3.48Å; L314-L317 PolarHBondContact O-N 2.95Å; L317-F320 PolarHBondContact O-N 2.77Å; L317-F321 VanDerWaalsContact O-CB 3.3Å; L317-F321 WeakPolarHBondContact O-CB 3.5Å; L317-F321 PolarHBondContact O-N 2.79Å; L317-L484 HydrophobicContact CD2-CD2 3.75Å; L317-V487 HydrophobicContact CD1-CG1 4.24Å; L317-M488 HydrophobicContact CB-CG 3.57Å; L317-M488 HydrophobicContact CB-SD 4.21Å; L317-M488 HydrophobicContact CD1-CG 4.04Å; L317-M488 HydrophobicContact CG-CG 4.35Å; L317-V491 HydrophobicContact CD1-CG2 4.32Å |
| 318 | L | 92.8 | Very high | 89.6 | Confident | 1 Ų | 1 | 38.7 Ų | 38.7 | 1% | 0.005 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.9 | -38.2 | 174.9 | -86.7 | 171.2 | 0 | 0 | 0 | 113.1 | L314 V315 I316 F320 F321 F322 L428 M488 | L314-L318 HydrophobicContact CD2-CD1 3.71Å; L314-L318 HydrophobicContact CD2-CG 4.4Å; L314-L318 WeakPolarHBondContact O-CB 3.31Å; L314-L318 PolarHBondContact O-N 3.39Å; V315-L318 PolarHBondContact O-N 3.46Å; I316-L318 VanDerWaalsContact C-N 3.32Å; I316-L318 PolarHBondContact O-N 3.22Å; L318-F320 VanDerWaalsContact C-N 3.34Å; L318-F320 PolarHBondContact O-N 3.13Å; L318-F321 PolarHBondContact O-N 3.4Å; L318-F322 HydrophobicContact CB-CD2 4.49Å; L318-F322 HydrophobicContact CD2-CD2 4.19Å; L318-F322 HydrophobicContact CD2-CE2 3.67Å; L318-F322 HydrophobicContact CD2-CZ 4.13Å; L318-F322 VanDerWaalsContact O-CD2 3.31Å; L318-F322 WeakPolarHBondContact O-CD2 3.21Å; L318-F322 PolarHBondContact O-N 3.32Å; L318-L428 HydrophobicContact CD1-CB 4.12Å; L318-L428 HydrophobicContact CD1-CD1 3.64Å; L318-L428 HydrophobicContact CD1-CD2 3.66Å; L318-L428 HydrophobicContact CD1-CG 4.02Å; L318-M488 HydrophobicContact CD2-CE 3.3Å; L318-M488 HydrophobicContact CD2-SD 4.49Å; L318-M488 HydrophobicContact CG-CE 3.65Å |
| 319 | F | 95.4 | Very high | 91.2 | Very high | 54 Ų | 54 | 38.8 Ų | 38.8 | 24% | 0.237 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -53.7 | -53.2 | 173.3 | 178.7 | -76.6 | 0 | 0 | 0 | 110.4 | V315 I316 F322 F323 A441 V444 | V315-F319 PolarHBondContact O-N 3.48Å; I316-F319 WeakPolarHBondContact O-CB 3.16Å; I316-F319 PolarHBondContact O-N 2.82Å; F319-F322 PolarHBondContact O-N 2.95Å; F319-F323 VanDerWaalsContact O-CB 3.24Å; F319-F323 WeakPolarHBondContact O-CB 3.39Å; F319-F323 PolarHBondContact O-N 3.28Å; F319-A441 WeakPolarHBondContact CD2-O 3.38Å; F319-V444 HydrophobicContact CE2-CB 4.38Å; F319-V444 HydrophobicContact CE2-CG1 4.01Å |
| 320 | F | 96.9 | Very high | 92.5 | Very high | 100 Ų | 100 | 33 Ų | 33 | 44% | 0.439 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -69.4 | -35.5 | -179.5 | -71.6 | -64.8 | 0 | 0 | 0 | 112.7 | I316 L317 L318 F323 A324 F480 L484 | I316-F320 HydrophobicContact CG2-CD2 3.99Å; I316-F320 HydrophobicContact CG2-CE2 3.7Å; I316-F320 VanDerWaalsContact O-CD2 3.23Å; I316-F320 WeakPolarHBondContact O-CD2 3.14Å; I316-F320 PolarHBondContact O-N 3.15Å; L317-F320 PolarHBondContact O-N 2.77Å; L318-F320 VanDerWaalsContact C-N 3.34Å; L318-F320 PolarHBondContact O-N 3.13Å; F320-F323 PolarHBondContact O-N 3.26Å; F320-A324 PolarHBondContact O-N 3.04Å; F320-F480 HydrophobicContact CB-CE1 4.28Å; F320-F480 HydrophobicContact CB-CZ 4.19Å; F320-L484 HydrophobicContact CB-CD1 4.28Å |
| 321 | F | 96.8 | Very high | 93.1 | Very high | 2 Ų | 2 | 29 Ų | 29 | 1% | 0.009 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.3 | -51.7 | 175.5 | -179.5 | -90.4 | 0 | 0 | 0 | 111.1 | L317 L318 A324 Y325 I382 L386 T420 T481 L484 F485 M488 | L317-F321 VanDerWaalsContact O-CB 3.3Å; L317-F321 WeakPolarHBondContact O-CB 3.5Å; L317-F321 PolarHBondContact O-N 2.79Å; L318-F321 PolarHBondContact O-N 3.4Å; F321-A324 PolarHBondContact O-N 3.47Å; F321-Y325 VanDerWaalsContact O-CB 3.28Å; F321-Y325 WeakPolarHBondContact O-CB 3.31Å; F321-Y325 PolarHBondContact O-N 2.88Å; F321-I382 HydrophobicContact CZ-CG2 4.5Å; F321-L386 HydrophobicContact CE2-CD1 4.4Å; F321-L386 HydrophobicContact CE2-CD2 4.23Å; F321-L386 HydrophobicContact CZ-CD2 4.21Å; F321-T420 HydrophobicContact CE1-CG2 3.69Å; F321-T420 HydrophobicContact CZ-CG2 3.68Å; F321-T481 HydrophobicContact CD2-CG2 4.12Å; F321-T481 HydrophobicContact CE2-CG2 4.14Å; F321-T481 WeakPolarHBondContact CE2-O 3.31Å; F321-L484 HydrophobicContact CB-CD1 4.16Å; F321-L484 HydrophobicContact CD2-CB 4.13Å; F321-F485 HydrophobicContact CE2-CB 4.1Å; F321-M488 HydrophobicContact CB-SD 3.98Å; F321-M488 HydrophobicContact CD2-SD 4.1Å; F321-M488 HydrophobicContact CG-SD 4.13Å |
| 322 | F | 95.7 | Very high | 93.6 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -74.3 | -29.5 | 179.2 | -69 | -52 | 0 | 0 | 0 | 113.6 | L318 F319 Y325 V326 F421 F442 A446 | L318-F322 HydrophobicContact CB-CD2 4.49Å; L318-F322 HydrophobicContact CD2-CD2 4.19Å; L318-F322 HydrophobicContact CD2-CE2 3.67Å; L318-F322 HydrophobicContact CD2-CZ 4.13Å; L318-F322 VanDerWaalsContact O-CD2 3.31Å; L318-F322 WeakPolarHBondContact O-CD2 3.21Å; L318-F322 PolarHBondContact O-N 3.32Å; F319-F322 PolarHBondContact O-N 2.95Å; F322-Y325 HydrophobicContact CD1-CD1 4.15Å; F322-V326 VanDerWaalsContact O-CB 3.32Å; F322-V326 WeakPolarHBondContact O-CB 3.25Å; F322-V326 WeakPolarHBondContact O-CG2 3.48Å; F322-V326 PolarHBondContact O-N 2.91Å; F322-F421 AromaticContact CD1-CD2 3.62Å; F322-F421 HydrophobicContact CD1-CD2 3.62Å; F322-F421 HydrophobicContact CD1-CE2 4.17Å; F322-F421 HydrophobicContact CE1-CB 4.39Å; F322-F421 AromaticContact CE1-CD2 3.77Å; F322-F421 HydrophobicContact CE1-CD2 3.77Å; F322-F421 HydrophobicContact CE1-CE2 4.44Å; F322-F421 HydrophobicContact CE1-CG 4.34Å; F322-F421 HydrophobicContact CG-CD2 4.1Å; F322-F421 HydrophobicContact CG-CE2 4.19Å; F322-F421 HydrophobicContact CZ-CD2 4.26Å; F322-F442 HydrophobicContact CD2-CB 3.64Å; F322-F442 HydrophobicContact CD2-CG 4.32Å; F322-F442 HydrophobicContact CE2-CB 3.95Å; F322-F442 HydrophobicContact CE2-CD2 4.31Å; F322-F442 HydrophobicContact CE2-CG 4.17Å; F322-A446 HydrophobicContact CB-CB 4.21Å |
| 323 | F | 96.6 | Very high | 93.6 | Very high | 44 Ų | 44 | 21.7 Ų | 21.7 | 19% | 0.193 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -54.7 | -52.4 | 168.7 | 172.4 | -85.5 | 0 | 0 | 0 | 111.1 | F319 F320 G327 G445 T448 G449 V452 L453 | F319-F323 VanDerWaalsContact O-CB 3.24Å; F319-F323 WeakPolarHBondContact O-CB 3.39Å; F319-F323 PolarHBondContact O-N 3.28Å; F320-F323 PolarHBondContact O-N 3.26Å; F323-G327 PolarHBondContact O-N 2.89Å; F323-G327 VanDerWaalsContact O-N 3.12Å; F323-G445 VanDerWaalsContact CA-O 3.23Å; F323-G445 WeakPolarHBondContact CA-O 3.41Å; F323-G445 WeakPolarHBondContact CB-O 3.32Å; F323-T448 HydrophobicContact CD2-CG2 4.19Å; F323-T448 HydrophobicContact CE2-CG2 3.94Å; F323-G449 VanDerWaalsContact CD2-N 3.25Å; F323-G449 VanDerWaalsContact O-CA 3.29Å; F323-G449 WeakPolarHBondContact O-CA 3.47Å; F323-V452 HydrophobicContact CE2-CB 4.09Å; F323-V452 HydrophobicContact CE2-CG2 4.28Å; F323-V452 HydrophobicContact CZ-CB 4.02Å; F323-V452 HydrophobicContact CZ-CG1 4.01Å; F323-L453 HydrophobicContact CE1-CD2 4.2Å; F323-L453 HydrophobicContact CE1-CG 4.34Å; F323-L453 HydrophobicContact CZ-CD2 4.42Å |
| 324 | A | 96.8 | Very high | 93.4 | Very high | 5 Ų | 5 | 22.9 Ų | 22.9 | 4% | 0.041 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -69.4 | -43.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | F320 F321 A328 T477 F480 T481 | F320-A324 PolarHBondContact O-N 3.04Å; F321-A324 PolarHBondContact O-N 3.47Å; A324-A328 WeakPolarHBondContact O-CB 3.4Å; A324-A328 PolarHBondContact O-N 3.41Å; A324-T477 HydrophobicContact CB-CG2 4.4Å; A324-F480 HydrophobicContact CB-CD1 3.46Å; A324-F480 VanDerWaalsContact CB-CD1 3.46Å; A324-F480 HydrophobicContact CB-CE1 3.79Å; A324-T481 HydrophobicContact CB-CG2 3.97Å |
| 325 | Y | 95.9 | Very high | 93.4 | Very high | 5 Ų | 5 | 24.9 Ų | 24.9 | 2% | 0.02 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -66.3 | -54.5 | -178.3 | 161.3 | -91.7 | 0 | 0 | 0 | 112.5 | F321 F322 G327 A328 E329 M417 T420 F421 | F321-Y325 VanDerWaalsContact O-CB 3.28Å; F321-Y325 WeakPolarHBondContact O-CB 3.31Å; F321-Y325 PolarHBondContact O-N 2.88Å; F322-Y325 HydrophobicContact CD1-CD1 4.15Å; Y325-G327 PolarHBondContact O-N 3.37Å; Y325-A328 PolarHBondContact O-N 3.5Å; Y325-E329 PolarHBondContact O-N 3.37Å; Y325-M417 HydrophobicContact CD2-CE 4.4Å; Y325-M417 HydrophobicContact CD2-SD 3.42Å; Y325-M417 WeakPolarHBondContact CD2-SD 3.47Å; Y325-M417 HydrophobicContact CE2-CB 4.27Å; Y325-M417 HydrophobicContact CE2-CG 4.46Å; Y325-M417 WeakPolarHBondContact CE2-O 3.38Å; Y325-M417 HydrophobicContact CE2-SD 3.31Å; Y325-M417 WeakPolarHBondContact CE2-SD 3.44Å; Y325-M417 PolarHBondContact OH-O 2.84Å; Y325-T420 HydrophobicContact CD2-CG2 4.02Å; Y325-T420 HydrophobicContact CE2-CG2 3.98Å; Y325-T420 WeakPolarHBondContact CE2-OG1 3.37Å; Y325-T420 HydrophobicContact CG-CG2 4.47Å; Y325-F421 HydrophobicContact CE1-CB 3.84Å; Y325-F421 PolarHBondContact OH-N 2.97Å |
| 326 | V | 94.2 | Very high | 93.5 | Very high | 15 Ų | 15 | 24.1 Ų | 24.1 | 9% | 0.091 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -68.2 | -39.4 | -177.5 | 178.7 | 0 | 0 | 0 | 0 | 110.4 | F322 A328 E329 V330 F421 A446 E450 | F322-V326 VanDerWaalsContact O-CB 3.32Å; F322-V326 WeakPolarHBondContact O-CB 3.25Å; F322-V326 WeakPolarHBondContact O-CG2 3.48Å; F322-V326 PolarHBondContact O-N 2.91Å; V326-A328 VanDerWaalsContact C-N 3.31Å; V326-A328 PolarHBondContact O-N 3.31Å; V326-E329 WeakPolarHBondContact O-CB 3.4Å; V326-E329 PolarHBondContact O-N 3.47Å; V326-V330 HydrophobicContact CG1-CG2 4.34Å; V326-V330 WeakPolarHBondContact O-CG2 3.44Å; V326-V330 PolarHBondContact O-N 2.84Å; V326-F421 HydrophobicContact CG2-CD2 4.02Å; V326-F421 HydrophobicContact CG2-CE2 4.45Å; V326-A446 HydrophobicContact CB-CB 4.03Å; V326-A446 HydrophobicContact CG1-CB 4.29Å; V326-A446 HydrophobicContact CG2-CB 3.59Å; V326-E450 HydrophobicContact CG1-CB 4.17Å |
| 327 | G | 94.2 | Very high | 93.3 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -63.6 | -35.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | F323 Y325 A331 G449 | F323-G327 PolarHBondContact O-N 2.89Å; F323-G327 VanDerWaalsContact O-N 3.12Å; Y325-G327 PolarHBondContact O-N 3.37Å; G327-A331 WeakPolarHBondContact O-CB 3.5Å; G327-A331 PolarHBondContact O-N 3.32Å; G327-G449 WeakPolarHBondContact CA-O 3.35Å |
| 328 | A | 95.1 | Very high | 93 | Very high | 1 Ų | 1 | 23.7 Ų | 23.7 | 1% | 0.008 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -68.4 | -43.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A324 Y325 V326 V330 A331 Y332 M417 T477 | A324-A328 WeakPolarHBondContact O-CB 3.4Å; A324-A328 PolarHBondContact O-N 3.41Å; Y325-A328 PolarHBondContact O-N 3.5Å; V326-A328 VanDerWaalsContact C-N 3.31Å; V326-A328 PolarHBondContact O-N 3.31Å; A328-V330 PolarHBondContact O-N 3.5Å; A328-A331 PolarHBondContact O-N 3.27Å; A328-Y332 VanDerWaalsContact O-CB 3.29Å; A328-Y332 WeakPolarHBondContact O-CB 3.47Å; A328-Y332 PolarHBondContact O-N 2.83Å; A328-M417 HydrophobicContact CB-CE 3.93Å; A328-T477 HydrophobicContact CB-CG2 4.04Å; A328-T477 VanDerWaalsContact CB-OG1 3.26Å; A328-T477 WeakPolarHBondContact CB-OG1 3.35Å |
| 329 | E | 93.7 | Very high | 92.8 | Very high | 21 Ų | 21 | 24.2 Ų | 24.2 | 10% | 0.098 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -54 | -53.9 | 175.6 | 179.8 | -170.7 | 148.4 | 0 | 0 | 110.8 | Y325 V326 Y332 G333 F358 F362 | Y325-E329 PolarHBondContact O-N 3.37Å; V326-E329 WeakPolarHBondContact O-CB 3.4Å; V326-E329 PolarHBondContact O-N 3.47Å; E329-Y332 PolarHBondContact O-N 3.25Å; E329-G333 PolarHBondContact O-N 3.37Å; E329-F358 HydrophobicContact CG-CZ 4.42Å; E329-F362 HydrophobicContact CG-CE2 4.03Å; E329-F362 HydrophobicContact CG-CZ 4.37Å; E329-F362 WeakPolarHBondContact OE1-CZ 3.38Å |
| 330 | V | 90.8 | Very high | 92.6 | Very high | 25 Ų | 25 | 21.7 Ų | 21.7 | 15% | 0.152 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -71.6 | -37.8 | -177.1 | -178.8 | 0 | 0 | 0 | 0 | 111.6 | V326 A328 Y332 G333 S334 E450 P454 | V326-V330 HydrophobicContact CG1-CG2 4.34Å; V326-V330 WeakPolarHBondContact O-CG2 3.44Å; V326-V330 PolarHBondContact O-N 2.84Å; A328-V330 PolarHBondContact O-N 3.5Å; V330-Y332 VanDerWaalsContact C-N 3.35Å; V330-Y332 PolarHBondContact O-N 2.85Å; V330-G333 PolarHBondContact O-N 2.74Å; V330-S334 VanDerWaalsContact O-CB 3.24Å; V330-S334 WeakPolarHBondContact O-CB 3.4Å; V330-S334 PolarHBondContact O-N 3.39Å; V330-S334 PolarHBondContact O-OG 3.19Å; V330-E450 HydrophobicContact CB-CG 4.18Å; V330-E450 HydrophobicContact CG1-CG 4.03Å; V330-E450 HydrophobicContact CG2-CB 4.26Å; V330-E450 HydrophobicContact CG2-CG 3.89Å; V330-P454 HydrophobicContact CB-CG 4.26Å; V330-P454 HydrophobicContact CG1-CG 4.06Å |
| 331 | A | 92.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -61.9 | -45.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | G327 A328 S334 F335 P454 L473 | G327-A331 WeakPolarHBondContact O-CB 3.5Å; G327-A331 PolarHBondContact O-N 3.32Å; A328-A331 PolarHBondContact O-N 3.27Å; A331-S334 PolarHBondContact O-N 3.05Å; A331-F335 WeakPolarHBondContact O-CB 3.32Å; A331-F335 WeakPolarHBondContact O-CD2 3.49Å; A331-F335 PolarHBondContact O-N 2.87Å; A331-P454 HydrophobicContact CB-CB 4.24Å; A331-P454 HydrophobicContact CB-CG 3.9Å; A331-L473 HydrophobicContact CB-CD2 3.57Å |
| 332 | Y | 93.8 | Very high | 91.6 | Very high | 1 Ų | 1 | 25.2 Ų | 25.2 | 0% | 0.004 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.3 | -51.2 | 177 | -161.3 | -84.2 | 0 | 0 | 0 | 111.6 | A328 E329 V330 S334 F335 I336 F358 L396 T410 Y413 L470 M471 | A328-Y332 VanDerWaalsContact O-CB 3.29Å; A328-Y332 WeakPolarHBondContact O-CB 3.47Å; A328-Y332 PolarHBondContact O-N 2.83Å; E329-Y332 PolarHBondContact O-N 3.25Å; V330-Y332 VanDerWaalsContact C-N 3.35Å; V330-Y332 PolarHBondContact O-N 2.85Å; Y332-S334 PolarHBondContact O-N 3.38Å; Y332-F335 PolarHBondContact O-N 2.92Å; Y332-I336 HydrophobicContact CD1-CB 4.12Å; Y332-I336 HydrophobicContact CD1-CG1 4.43Å; Y332-I336 HydrophobicContact CE1-CB 3.92Å; Y332-I336 HydrophobicContact CE1-CD1 3.82Å; Y332-I336 HydrophobicContact CE1-CG1 3.72Å; Y332-I336 HydrophobicContact CE2-CD1 4.3Å; Y332-I336 VanDerWaalsContact O-CB 3.23Å; Y332-I336 WeakPolarHBondContact O-CB 3.41Å; Y332-I336 WeakPolarHBondContact O-CG2 3.11Å; Y332-I336 PolarHBondContact O-N 3.07Å; Y332-I336 WeakPolarHBondContact OH-CD1 3.24Å; Y332-F358 AromaticContact CD1-CD2 3.71Å; Y332-F358 HydrophobicContact CD1-CD2 3.71Å; Y332-F358 AromaticContact CD1-CE2 3.78Å; Y332-F358 HydrophobicContact CD1-CE2 3.78Å; Y332-F358 HydrophobicContact CD1-CG 4.11Å; Y332-F358 HydrophobicContact CD1-CZ 4.24Å; Y332-F358 AromaticContact CE1-CD2 3.96Å; Y332-F358 HydrophobicContact CE1-CD2 3.96Å; Y332-F358 HydrophobicContact CE1-CE2 4.42Å; Y332-F358 HydrophobicContact CE1-CG 4.38Å; Y332-L396 HydrophobicContact CE2-CD1 3.98Å; Y332-L396 VanDerWaalsContact OH-CD1 3.3Å; Y332-L396 WeakPolarHBondContact OH-CD1 3.04Å; Y332-T410 HydrophobicContact CE1-CG2 4.01Å; Y332-T410 PolarHBondContact OH-OG1 3.16Å; Y332-Y413 AromaticContact CD1-CD1 3.86Å; Y332-Y413 HydrophobicContact CD1-CD1 3.86Å; Y332-Y413 HydrophobicContact CD1-CE1 4.04Å; Y332-Y413 AromaticContact CD2-CD1 3.93Å; Y332-Y413 HydrophobicContact CD2-CD1 3.93Å; Y332-Y413 AromaticContact CD2-CE1 3.62Å; Y332-Y413 HydrophobicContact CD2-CE1 3.62Å; Y332-Y413 HydrophobicContact CE1-CD1 4.06Å; Y332-Y413 HydrophobicContact CE2-CD1 4.12Å; Y332-Y413 HydrophobicContact CE2-CE1 4.22Å; Y332-Y413 AromaticContact CG-CD1 3.78Å; Y332-Y413 HydrophobicContact CG-CD1 3.78Å; Y332-Y413 AromaticContact CG-CE1 3.5Å; Y332-Y413 HydrophobicContact CG-CE1 3.5Å; Y332-Y413 VanDerWaalsContact CG-CE1 3.5Å; Y332-L470 HydrophobicContact CD2-CD2 4.35Å; Y332-L470 HydrophobicContact CD2-CG 4.2Å; Y332-M471 HydrophobicContact CE2-CE 3.99Å; Y332-M471 HydrophobicContact CE2-SD 3.96Å |
| 333 | G | 87.7 | Confident | 91.2 | Very high | 6 Ų | 6 | 27.7 Ų | 27.7 | 6% | 0.062 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62 | -27.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | E329 V330 N355 | E329-G333 PolarHBondContact O-N 3.37Å; V330-G333 PolarHBondContact O-N 2.74Å; G333-N355 PolarHBondContact O-OD1 3.39Å; G333-N355 VanDerWaalsContact O-OD1 3.04Å |
| 334 | S | 85.8 | Confident | 90.7 | Very high | 66 Ų | 66 | 26.4 Ų | 26.4 | 46% | 0.462 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -84 | -36.3 | 179.4 | -58.2 | 0 | 0 | 0 | 0 | 113 | V330 A331 Y332 | V330-S334 VanDerWaalsContact O-CB 3.24Å; V330-S334 WeakPolarHBondContact O-CB 3.4Å; V330-S334 PolarHBondContact O-N 3.39Å; V330-S334 PolarHBondContact O-OG 3.19Å; A331-S334 PolarHBondContact O-N 3.05Å; Y332-S334 PolarHBondContact O-N 3.38Å |
| 335 | F | 90.1 | Very high | 90.4 | Very high | 43 Ų | 43 | 33.7 Ų | 33.7 | 19% | 0.189 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -108.8 | -7.7 | -170.1 | -71.2 | -79.2 | 0 | 0 | 0 | 114.7 | A331 Y332 F337 T338 F339 P454 V457 L461 L470 | A331-F335 WeakPolarHBondContact O-CB 3.32Å; A331-F335 WeakPolarHBondContact O-CD2 3.49Å; A331-F335 PolarHBondContact O-N 2.87Å; Y332-F335 PolarHBondContact O-N 2.92Å; F335-F337 VanDerWaalsContact C-N 3.28Å; F335-F337 PolarHBondContact O-N 3.44Å; F335-T338 PolarHBondContact O-N 3.14Å; F335-F339 WeakPolarHBondContact O-CB 3.26Å; F335-F339 PolarHBondContact O-N 3.38Å; F335-P454 HydrophobicContact CE2-CB 3.98Å; F335-P454 VanDerWaalsContact CE2-O 3.26Å; F335-P454 WeakPolarHBondContact CE2-O 3.27Å; F335-V457 HydrophobicContact CD2-CG1 4.07Å; F335-V457 HydrophobicContact CE2-CG1 4.39Å; F335-V457 HydrophobicContact CG-CG1 4.21Å; F335-L461 HydrophobicContact CD1-CD1 3.74Å; F335-L461 HydrophobicContact CE1-CD1 4.09Å; F335-L461 HydrophobicContact CG-CD1 4.37Å; F335-L470 HydrophobicContact CB-CD1 3.93Å; F335-L470 HydrophobicContact CB-CD2 4.01Å |
| 336 | I | 92.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.4 | -35.8 | -178.7 | -172.2 | 56.7 | 0 | 0 | 0 | 112.9 | Y332 F339 A340 L354 N355 L470 M471 | Y332-I336 HydrophobicContact CD1-CB 4.12Å; Y332-I336 HydrophobicContact CD1-CG1 4.43Å; Y332-I336 HydrophobicContact CE1-CB 3.92Å; Y332-I336 HydrophobicContact CE1-CD1 3.82Å; Y332-I336 HydrophobicContact CE1-CG1 3.72Å; Y332-I336 HydrophobicContact CE2-CD1 4.3Å; Y332-I336 VanDerWaalsContact O-CB 3.23Å; Y332-I336 WeakPolarHBondContact O-CB 3.41Å; Y332-I336 WeakPolarHBondContact O-CG2 3.11Å; Y332-I336 PolarHBondContact O-N 3.07Å; Y332-I336 WeakPolarHBondContact OH-CD1 3.24Å; I336-F339 HydrophobicContact CD1-CD1 4.31Å; I336-A340 VanDerWaalsContact O-CB 3.32Å; I336-A340 WeakPolarHBondContact O-CB 3.13Å; I336-A340 PolarHBondContact O-N 3.46Å; I336-L354 HydrophobicContact CD1-CD2 4.08Å; I336-L354 HydrophobicContact CG1-CB 4.46Å; I336-L354 HydrophobicContact CG1-CD2 4.13Å; I336-N355 HydrophobicContact CG2-CB 3.93Å; I336-N355 WeakPolarHBondContact CG2-OD1 3.41Å; I336-L470 HydrophobicContact CB-CD2 4.37Å; I336-L470 HydrophobicContact CD1-CD2 4.34Å; I336-M471 HydrophobicContact CD1-CE 3.86Å |
| 337 | F | 88.2 | Confident | 90 | Very high | 58 Ų | 58 | 36.9 Ų | 36.9 | 25% | 0.254 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -61.4 | -51.9 | 173.7 | 172.6 | -93.4 | 0 | 0 | 0 | 111.3 | F335 F339 A340 K341 E348 A351 A352 N355 | F335-F337 VanDerWaalsContact C-N 3.28Å; F335-F337 PolarHBondContact O-N 3.44Å; F337-F339 VanDerWaalsContact C-N 3.32Å; F337-F339 PolarHBondContact O-N 2.99Å; F337-A340 PolarHBondContact O-N 3.45Å; F337-K341 HydrophobicContact CE1-CD 4.05Å; F337-K341 HydrophobicContact CZ-CD 4.05Å; F337-K341 WeakPolarHBondContact O-CB 3.2Å; F337-K341 PolarHBondContact O-N 3.41Å; F337-E348 HydrophobicContact CE2-CG 4.03Å; F337-E348 HydrophobicContact CZ-CG 3.87Å; F337-A351 HydrophobicContact CD2-CB 3.78Å; F337-A351 HydrophobicContact CE2-CB 3.93Å; F337-A352 HydrophobicContact CD2-CB 4.3Å; F337-A352 HydrophobicContact CE2-CB 4.14Å; F337-N355 HydrophobicContact CB-CB 4.35Å |
| 338 | T | 87.6 | Confident | 89.6 | Confident | 51 Ų | 51 | 42.4 Ų | 42.4 | 31% | 0.313 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -60.9 | -43.2 | 179.6 | -51 | 0 | 0 | 0 | 0 | 110.7 | F335 K341 D342 | F335-T338 PolarHBondContact O-N 3.14Å; T338-K341 PolarHBondContact O-N 3.48Å; T338-D342 VanDerWaalsContact CG2-OD2 3.24Å; T338-D342 WeakPolarHBondContact CG2-OD2 3.31Å; T338-D342 VanDerWaalsContact O-CB 3.29Å; T338-D342 WeakPolarHBondContact O-CB 3.29Å; T338-D342 PolarHBondContact O-N 3.11Å |
| 339 | F | 90.1 | Very high | 89.2 | Confident | 12 Ų | 12 | 46 Ų | 46 | 5% | 0.053 | 25% | 0.251 | C | S | . | . | I | π-helix | trans | -59.2 | -48.8 | 174.6 | 179.2 | -87.6 | 0 | 0 | 0 | 111.9 | F335 I336 F337 K341 Y343 A344 T400 L406 P468 L470 M471 | F335-F339 WeakPolarHBondContact O-CB 3.26Å; F335-F339 PolarHBondContact O-N 3.38Å; I336-F339 HydrophobicContact CD1-CD1 4.31Å; F337-F339 VanDerWaalsContact C-N 3.32Å; F337-F339 PolarHBondContact O-N 2.99Å; F339-K341 PolarHBondContact O-N 3.32Å; F339-Y343 HydrophobicContact CD2-CD1 4.37Å; F339-Y343 HydrophobicContact CD2-CG 4.28Å; F339-Y343 HydrophobicContact CE1-CD1 4.21Å; F339-Y343 AromaticContact CE2-CD1 3.61Å; F339-Y343 HydrophobicContact CE2-CD1 3.61Å; F339-Y343 HydrophobicContact CE2-CE1 4.17Å; F339-Y343 AromaticContact CE2-CG 3.86Å; F339-Y343 HydrophobicContact CE2-CG 3.86Å; F339-Y343 AromaticContact CZ-CD1 3.51Å; F339-Y343 HydrophobicContact CZ-CD1 3.51Å; F339-Y343 AromaticContact CZ-CE1 3.96Å; F339-Y343 HydrophobicContact CZ-CE1 3.96Å; F339-Y343 HydrophobicContact CZ-CG 4.22Å; F339-Y343 WeakPolarHBondContact O-CA 3.3Å; F339-Y343 VanDerWaalsContact O-CB 3.27Å; F339-Y343 WeakPolarHBondContact O-CB 3.48Å; F339-Y343 PolarHBondContact O-N 3.49Å; F339-A344 PolarHBondContact O-N 3.22Å; F339-T400 HydrophobicContact CZ-CG2 4.48Å; F339-L406 HydrophobicContact CE1-CD2 4.05Å; F339-P468 HydrophobicContact CE2-CB 3.68Å; F339-P468 HydrophobicContact CZ-CB 4.1Å; F339-L470 HydrophobicContact CB-CD2 3.87Å; F339-L470 HydrophobicContact CD2-CB 4.12Å; F339-L470 HydrophobicContact CG-CD2 4.26Å; F339-M471 HydrophobicContact CD1-CE 3.49Å; F339-M471 VanDerWaalsContact CD1-CE 3.49Å; F339-M471 HydrophobicContact CD2-CE 4.14Å; F339-M471 HydrophobicContact CE1-CE 3.41Å; F339-M471 VanDerWaalsContact CE1-CE 3.41Å; F339-M471 HydrophobicContact CE1-CG 4.45Å; F339-M471 HydrophobicContact CE2-CE 4.04Å; F339-M471 HydrophobicContact CE2-CG 4.02Å; F339-M471 HydrophobicContact CG-CE 3.87Å; F339-M471 HydrophobicContact CZ-CE 3.69Å; F339-M471 HydrophobicContact CZ-CG 3.82Å |
| 340 | A | 89.5 | Confident | 89 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 27% | 0.267 | C | S | . | . | I | π-helix | trans | -64.4 | -39.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | I336 F337 A344 H345 M346 A351 L354 | I336-A340 VanDerWaalsContact O-CB 3.32Å; I336-A340 WeakPolarHBondContact O-CB 3.13Å; I336-A340 PolarHBondContact O-N 3.46Å; F337-A340 PolarHBondContact O-N 3.45Å; A340-A344 CarbonylContact O-C 3.55Å; A340-H345 PolarHBondContact O-N 3.37Å; A340-M346 HydrophobicContact CB-SD 3.93Å; A340-M346 WeakPolarHBondContact O-CB 3.41Å; A340-M346 PolarHBondContact O-N 3.45Å; A340-A351 HydrophobicContact CB-CB 3.66Å; A340-L354 HydrophobicContact CB-CD2 4.35Å |
| 341 | K | 87.6 | Confident | 88.8 | Confident | 77 Ų | 77 | 48.4 Ų | 48.4 | 34% | 0.335 | 26% | 0.26 | S | S | . | . | I | π-helix | trans | -75 | -52 | -179.8 | -177.9 | 175.1 | 172.5 | 162.8 | 0 | 112.4 | F337 T338 F339 H345 E348 A351 | F337-K341 HydrophobicContact CE1-CD 4.05Å; F337-K341 HydrophobicContact CZ-CD 4.05Å; F337-K341 WeakPolarHBondContact O-CB 3.2Å; F337-K341 PolarHBondContact O-N 3.41Å; T338-K341 PolarHBondContact O-N 3.48Å; F339-K341 PolarHBondContact O-N 3.32Å; K341-H345 WeakPolarHBondContact O-CA 3.24Å; K341-E348 IonicContact NZ-OE2 2.78Å; K341-E348 PolarHBondContact NZ-OE2 3Å; K341-A351 HydrophobicContact CB-CB 4.21Å |
| 342 | D | 86.4 | Confident | 88.4 | Confident | 100 Ų | 100 | 50.2 Ų | 50.2 | 54% | 0.535 | 28% | 0.275 | S | S | . | . | I | π-helix | trans | -90.4 | -35.8 | -167.4 | -61.3 | -21.9 | 0 | 0 | 0 | 112.6 | T338 H345 | T338-D342 VanDerWaalsContact CG2-OD2 3.24Å; T338-D342 WeakPolarHBondContact CG2-OD2 3.31Å; T338-D342 VanDerWaalsContact O-CB 3.29Å; T338-D342 WeakPolarHBondContact O-CB 3.29Å; T338-D342 PolarHBondContact O-N 3.11Å; D342-H345 PolarHBondContact O-CE1 3.39Å; D342-H345 PolarHBondContact O-ND1 2.75Å |
| 343 | Y | 87.4 | Confident | 88.1 | Confident | 52 Ų | 52 | 51.3 Ų | 51.3 | 20% | 0.204 | 29% | 0.286 | C | S | . | . | I | π-helix | trans | -94.7 | -50.6 | -179.6 | -177.1 | -83.2 | 0 | 0 | 0 | 112.4 | F339 H345 K466 P468 | F339-Y343 HydrophobicContact CD2-CD1 4.37Å; F339-Y343 HydrophobicContact CD2-CG 4.28Å; F339-Y343 HydrophobicContact CE1-CD1 4.21Å; F339-Y343 AromaticContact CE2-CD1 3.61Å; F339-Y343 HydrophobicContact CE2-CD1 3.61Å; F339-Y343 HydrophobicContact CE2-CE1 4.17Å; F339-Y343 AromaticContact CE2-CG 3.86Å; F339-Y343 HydrophobicContact CE2-CG 3.86Å; F339-Y343 AromaticContact CZ-CD1 3.51Å; F339-Y343 HydrophobicContact CZ-CD1 3.51Å; F339-Y343 AromaticContact CZ-CE1 3.96Å; F339-Y343 HydrophobicContact CZ-CE1 3.96Å; F339-Y343 HydrophobicContact CZ-CG 4.22Å; F339-Y343 WeakPolarHBondContact O-CA 3.3Å; F339-Y343 VanDerWaalsContact O-CB 3.27Å; F339-Y343 WeakPolarHBondContact O-CB 3.48Å; F339-Y343 PolarHBondContact O-N 3.49Å; Y343-H345 VanDerWaalsContact C-N 3.28Å; Y343-H345 PolarHBondContact O-N 3.37Å; Y343-K466 WeakPolarHBondContact CE2-O 3.29Å; Y343-P468 HydrophobicContact CE1-CB 4.02Å; Y343-P468 HydrophobicContact CE2-CB 4.11Å; Y343-P468 WeakPolarHBondContact OH-CD 3.27Å |
| 344 | A | 86.3 | Confident | 88.3 | Confident | 17 Ų | 17 | 51 Ų | 51 | 14% | 0.14 | 28% | 0.283 | C | S | . | . | S | Bend | trans | -84.1 | -1.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | F339 A340 M346 L406 | F339-A344 PolarHBondContact O-N 3.22Å; A340-A344 CarbonylContact O-C 3.55Å; A344-M346 HydrophobicContact CB-CG 4.02Å; A344-M346 HydrophobicContact CB-SD 4.42Å; A344-M346 PolarHBondContact O-N 3.41Å; A344-M346 VanDerWaalsContact O-N 3.12Å; A344-L406 HydrophobicContact CB-CD1 3.81Å |
| 345 | H | 89.4 | Confident | 88.4 | Confident | 157 Ų | 157 | 49.9 Ų | 49.9 | 73% | 0.727 | 27% | 0.272 | S | S | * | . | trans | 51.9 | 33 | 179 | -56.4 | -50.1 | 0 | 0 | 0 | 114.1 | A340 K341 D342 Y343 | A340-H345 PolarHBondContact O-N 3.37Å; K341-H345 WeakPolarHBondContact O-CA 3.24Å; D342-H345 PolarHBondContact O-CE1 3.39Å; D342-H345 PolarHBondContact O-ND1 2.75Å; Y343-H345 VanDerWaalsContact C-N 3.28Å; Y343-H345 PolarHBondContact O-N 3.37Å | ||
| 346 | M | 89.9 | Confident | 88.3 | Confident | 10 Ų | 10 | 51.7 Ų | 51.7 | 5% | 0.049 | 29% | 0.29 | C | S | . | . | trans | -75.9 | 148.4 | 177.7 | -60.4 | -178.5 | 83 | 0 | 0 | 110.7 | A340 A344 H350 L354 N403 L406 | A340-M346 HydrophobicContact CB-SD 3.93Å; A340-M346 WeakPolarHBondContact O-CB 3.41Å; A340-M346 PolarHBondContact O-N 3.45Å; A344-M346 HydrophobicContact CB-CG 4.02Å; A344-M346 HydrophobicContact CB-SD 4.42Å; A344-M346 PolarHBondContact O-N 3.41Å; A344-M346 VanDerWaalsContact O-N 3.12Å; M346-H350 HydrophobicContact CB-CB 4.36Å; M346-H350 HydrophobicContact CE-CB 3.96Å; M346-L354 HydrophobicContact CE-CD1 3.92Å; M346-L354 HydrophobicContact SD-CD1 4.2Å; M346-N403 HydrophobicContact CE-CB 4.31Å; M346-L406 HydrophobicContact SD-CD1 4.11Å | ||
| 347 | P | 91.7 | Very high | 88.3 | Confident | 77 Ų | 77 | 54.3 Ų | 54.3 | 50% | 0.5 | 30% | 0.303 | S | S | . | . | trans | -54.6 | 144.2 | 169 | -23.8 | 33 | 0 | 0 | 0 | 111.3 | A349 H350 A351 | P347-A349 PolarHBondContact O-N 3.5Å; P347-A349 VanDerWaalsContact O-N 3.13Å; P347-H350 WeakPolarHBondContact O-CA 3.46Å; P347-H350 WeakPolarHBondContact O-CB 3.29Å; P347-H350 PolarHBondContact O-N 2.99Å; P347-A351 PolarHBondContact O-N 2.65Å | ||
| 348 | E | 86.1 | Confident | 88.4 | Confident | 116 Ų | 116 | 51.5 Ų | 51.5 | 54% | 0.542 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -54.9 | -37.4 | -175.9 | -172.5 | 163.3 | 149 | 0 | 0 | 113.2 | F337 K341 H350 A351 A352 | F337-E348 HydrophobicContact CE2-CG 4.03Å; F337-E348 HydrophobicContact CZ-CG 3.87Å; K341-E348 IonicContact NZ-OE2 2.78Å; K341-E348 PolarHBondContact NZ-OE2 3Å; E348-H350 VanDerWaalsContact C-N 3.34Å; E348-H350 PolarHBondContact O-N 3.24Å; E348-A351 PolarHBondContact O-N 3.02Å; E348-A352 WeakPolarHBondContact O-CB 3.44Å; E348-A352 PolarHBondContact O-N 3.27Å |
| 349 | A | 85.6 | Confident | 88.5 | Confident | 78 Ų | 78 | 53.9 Ų | 53.9 | 65% | 0.645 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -62.3 | -38.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | P347 G353 | P347-A349 PolarHBondContact O-N 3.5Å; P347-A349 VanDerWaalsContact O-N 3.13Å; A349-G353 PolarHBondContact O-N 2.93Å |
| 350 | H | 89.5 | Confident | 88.4 | Confident | 95 Ų | 95 | 55.2 Ų | 55.2 | 44% | 0.44 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -73.4 | -39.2 | 176.6 | -65.3 | 168.3 | 0 | 0 | 0 | 111.7 | M346 P347 E348 G353 L354 W407 | M346-H350 HydrophobicContact CB-CB 4.36Å; M346-H350 HydrophobicContact CE-CB 3.96Å; P347-H350 WeakPolarHBondContact O-CA 3.46Å; P347-H350 WeakPolarHBondContact O-CB 3.29Å; P347-H350 PolarHBondContact O-N 2.99Å; E348-H350 VanDerWaalsContact C-N 3.34Å; E348-H350 PolarHBondContact O-N 3.24Å; H350-G353 CarbonylContact O-C 3.48Å; H350-G353 WeakPolarHBondContact O-CA 3.37Å; H350-G353 PolarHBondContact O-N 3Å; H350-L354 PolarHBondContact O-N 3.45Å; H350-W407 HydrophobicContact CB-CZ2 4.19Å |
| 351 | A | 87.7 | Confident | 88.5 | Confident | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.8 | -43.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | F337 A340 K341 P347 E348 G353 L354 N355 | F337-A351 HydrophobicContact CD2-CB 3.78Å; F337-A351 HydrophobicContact CE2-CB 3.93Å; A340-A351 HydrophobicContact CB-CB 3.66Å; K341-A351 HydrophobicContact CB-CB 4.21Å; P347-A351 PolarHBondContact O-N 2.65Å; E348-A351 PolarHBondContact O-N 3.02Å; A351-G353 VanDerWaalsContact C-N 3.3Å; A351-G353 PolarHBondContact O-N 3.25Å; A351-L354 WeakPolarHBondContact O-CB 3.34Å; A351-L354 PolarHBondContact O-N 3.01Å; A351-N355 PolarHBondContact O-N 3.38Å |
| 352 | A | 84.1 | Confident | 88.7 | Confident | 39 Ų | 39 | 52.7 Ų | 52.7 | 32% | 0.322 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64 | -37.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | F337 E348 N355 S356 | F337-A352 HydrophobicContact CD2-CB 4.3Å; F337-A352 HydrophobicContact CE2-CB 4.14Å; E348-A352 WeakPolarHBondContact O-CB 3.44Å; E348-A352 PolarHBondContact O-N 3.27Å; A352-N355 PolarHBondContact O-N 3.22Å; A352-S356 WeakPolarHBondContact O-CB 3.28Å; A352-S356 PolarHBondContact O-N 3.32Å; A352-S356 PolarHBondContact O-OG 3.12Å |
| 353 | G | 87.5 | Confident | 88.6 | Confident | 23 Ų | 23 | 49.6 Ų | 49.6 | 24% | 0.237 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.4 | -40.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113 | A349 H350 A351 S356 L357 W407 | A349-G353 PolarHBondContact O-N 2.93Å; H350-G353 CarbonylContact O-C 3.48Å; H350-G353 WeakPolarHBondContact O-CA 3.37Å; H350-G353 PolarHBondContact O-N 3Å; A351-G353 VanDerWaalsContact C-N 3.3Å; A351-G353 PolarHBondContact O-N 3.25Å; G353-S356 PolarHBondContact O-N 3.34Å; G353-L357 WeakPolarHBondContact O-CB 3.3Å; G353-L357 PolarHBondContact O-N 3.45Å; G353-W407 VanDerWaalsContact C-CZ3 3.5Å |
| 354 | L | 90.4 | Very high | 88.7 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.8 | -48.3 | 174.4 | -111.6 | 84.7 | 0 | 0 | 0 | 112 | I336 A340 M346 H350 A351 S356 L357 F358 L406 W407 | I336-L354 HydrophobicContact CD1-CD2 4.08Å; I336-L354 HydrophobicContact CG1-CB 4.46Å; I336-L354 HydrophobicContact CG1-CD2 4.13Å; A340-L354 HydrophobicContact CB-CD2 4.35Å; M346-L354 HydrophobicContact CE-CD1 3.92Å; M346-L354 HydrophobicContact SD-CD1 4.2Å; H350-L354 PolarHBondContact O-N 3.45Å; A351-L354 WeakPolarHBondContact O-CB 3.34Å; A351-L354 PolarHBondContact O-N 3.01Å; L354-S356 VanDerWaalsContact C-N 3.31Å; L354-S356 PolarHBondContact O-N 3.13Å; L354-L357 WeakPolarHBondContact O-CB 3.33Å; L354-L357 PolarHBondContact O-N 3.08Å; L354-F358 PolarHBondContact O-N 3.07Å; L354-L406 HydrophobicContact CD2-CB 4.09Å; L354-W407 HydrophobicContact CD1-CD2 3.36Å; L354-W407 HydrophobicContact CD1-CE3 3.63Å; L354-W407 HydrophobicContact CD1-CG 3.93Å; L354-W407 HydrophobicContact CD1-CH2 3.92Å; L354-W407 HydrophobicContact CD1-CZ2 3.63Å; L354-W407 HydrophobicContact CD1-CZ3 3.92Å; L354-W407 HydrophobicContact CG-CD2 4.33Å; L354-W407 HydrophobicContact CG-CE3 4.23Å |
| 355 | N | 89.2 | Confident | 89 | Confident | 43 Ų | 43 | 50.2 Ų | 50.2 | 23% | 0.23 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.8 | -43.1 | 177.8 | -173.7 | 44 | 0 | 0 | 0 | 111.5 | G333 I336 F337 A351 A352 L357 F358 W359 | G333-N355 PolarHBondContact O-OD1 3.39Å; G333-N355 VanDerWaalsContact O-OD1 3.04Å; I336-N355 HydrophobicContact CG2-CB 3.93Å; I336-N355 WeakPolarHBondContact CG2-OD1 3.41Å; F337-N355 HydrophobicContact CB-CB 4.35Å; A351-N355 PolarHBondContact O-N 3.38Å; A352-N355 PolarHBondContact O-N 3.22Å; N355-L357 VanDerWaalsContact C-N 3.31Å; N355-L357 PolarHBondContact O-N 2.87Å; N355-F358 PolarHBondContact O-N 2.79Å; N355-W359 PolarHBondContact O-N 2.99Å |
| 356 | S | 87.3 | Confident | 89 | Confident | 80 Ų | 80 | 43.2 Ų | 43.2 | 56% | 0.559 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -64.5 | -36.6 | 176.2 | -56.4 | 0 | 0 | 0 | 0 | 112 | A352 G353 L354 G360 | A352-S356 WeakPolarHBondContact O-CB 3.28Å; A352-S356 PolarHBondContact O-N 3.32Å; A352-S356 PolarHBondContact O-OG 3.12Å; G353-S356 PolarHBondContact O-N 3.34Å; L354-S356 VanDerWaalsContact C-N 3.31Å; L354-S356 PolarHBondContact O-N 3.13Å; S356-G360 WeakPolarHBondContact O-CA 3.1Å; S356-G360 PolarHBondContact O-N 3.44Å |
| 357 | L | 92 | Very high | 89 | Confident | 55 Ų | 55 | 43.4 Ų | 43.4 | 29% | 0.288 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66.9 | -43.7 | 177.6 | -176.1 | 63.7 | 0 | 0 | 0 | 111.5 | G353 L354 N355 G360 T361 W407 | G353-L357 WeakPolarHBondContact O-CB 3.3Å; G353-L357 PolarHBondContact O-N 3.45Å; L354-L357 WeakPolarHBondContact O-CB 3.33Å; L354-L357 PolarHBondContact O-N 3.08Å; N355-L357 VanDerWaalsContact C-N 3.31Å; N355-L357 PolarHBondContact O-N 2.87Å; L357-G360 PolarHBondContact O-N 3.22Å; L357-T361 HydrophobicContact CD1-CG2 3.65Å; L357-T361 HydrophobicContact CG-CG2 4.11Å; L357-T361 WeakPolarHBondContact O-CB 3.04Å; L357-T361 VanDerWaalsContact O-CG2 3.28Å; L357-T361 WeakPolarHBondContact O-CG2 3.43Å; L357-T361 PolarHBondContact O-N 3.22Å; L357-T361 PolarHBondContact O-OG1 2.84Å; L357-T361 VanDerWaalsContact O-OG1 3.06Å; L357-W407 HydrophobicContact CB-CE3 4.49Å; L357-W407 HydrophobicContact CB-CZ3 4.26Å; L357-W407 HydrophobicContact CD2-CE3 3.51Å; L357-W407 HydrophobicContact CD2-CZ3 4.02Å |
| 358 | F | 91.9 | Very high | 89 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -54 | -56.1 | 175.6 | 171.9 | -107 | 0 | 0 | 0 | 111.6 | E329 Y332 L354 N355 G360 T361 F362 T410 Y413 | E329-F358 HydrophobicContact CG-CZ 4.42Å; Y332-F358 AromaticContact CD1-CD2 3.71Å; Y332-F358 HydrophobicContact CD1-CD2 3.71Å; Y332-F358 AromaticContact CD1-CE2 3.78Å; Y332-F358 HydrophobicContact CD1-CE2 3.78Å; Y332-F358 HydrophobicContact CD1-CG 4.11Å; Y332-F358 HydrophobicContact CD1-CZ 4.24Å; Y332-F358 AromaticContact CE1-CD2 3.96Å; Y332-F358 HydrophobicContact CE1-CD2 3.96Å; Y332-F358 HydrophobicContact CE1-CE2 4.42Å; Y332-F358 HydrophobicContact CE1-CG 4.38Å; L354-F358 PolarHBondContact O-N 3.07Å; N355-F358 PolarHBondContact O-N 2.79Å; F358-G360 PolarHBondContact O-N 2.74Å; F358-T361 PolarHBondContact O-OG1 2.76Å; F358-F362 WeakPolarHBondContact O-CB 3.46Å; F358-F362 PolarHBondContact O-N 2.68Å; F358-T410 HydrophobicContact CB-CG2 3.67Å; F358-Y413 HydrophobicContact CD2-CD1 4.33Å; F358-Y413 AromaticContact CE2-CD1 3.81Å; F358-Y413 HydrophobicContact CE2-CD1 3.81Å; F358-Y413 HydrophobicContact CE2-CE1 4.29Å |
| 359 | W | 88.3 | Confident | 89.2 | Confident | 101 Ų | 101 | 38.9 Ų | 38.9 | 38% | 0.383 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -68.2 | -35.2 | -179.8 | -71.9 | 112.5 | 0 | 0 | 0 | 112.6 | N355 F362 A363 | N355-W359 PolarHBondContact O-N 2.99Å; W359-F362 HydrophobicContact CE3-CD1 4.33Å; W359-F362 HydrophobicContact CZ3-CD1 4.44Å; W359-F362 HydrophobicContact CZ3-CE1 4.34Å; W359-A363 VanDerWaalsContact O-CB 3.31Å; W359-A363 WeakPolarHBondContact O-CB 3.35Å; W359-A363 PolarHBondContact O-N 3.04Å |
| 360 | G | 87.8 | Confident | 89.5 | Confident | 39 Ų | 39 | 37.3 Ų | 37.3 | 40% | 0.402 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -64.9 | -47.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | S356 L357 F358 A363 A364 | S356-G360 WeakPolarHBondContact O-CA 3.1Å; S356-G360 PolarHBondContact O-N 3.44Å; L357-G360 PolarHBondContact O-N 3.22Å; F358-G360 PolarHBondContact O-N 2.74Å; G360-A363 PolarHBondContact O-N 3.43Å; G360-A364 VanDerWaalsContact O-CB 3.27Å; G360-A364 WeakPolarHBondContact O-CB 3.19Å; G360-A364 PolarHBondContact O-N 3.5Å |
| 361 | T | 93 | Very high | 89.6 | Confident | 21 Ų | 21 | 40.1 Ų | 40.1 | 13% | 0.129 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -70.6 | -36.6 | 178.6 | 61.1 | 0 | 0 | 0 | 0 | 111.4 | L357 F358 T365 S411 | L357-T361 HydrophobicContact CD1-CG2 3.65Å; L357-T361 HydrophobicContact CG-CG2 4.11Å; L357-T361 WeakPolarHBondContact O-CB 3.04Å; L357-T361 VanDerWaalsContact O-CG2 3.28Å; L357-T361 WeakPolarHBondContact O-CG2 3.43Å; L357-T361 PolarHBondContact O-N 3.22Å; L357-T361 PolarHBondContact O-OG1 2.84Å; L357-T361 VanDerWaalsContact O-OG1 3.06Å; F358-T361 PolarHBondContact O-OG1 2.76Å; T361-T365 VanDerWaalsContact O-CB 3.22Å; T361-T365 WeakPolarHBondContact O-CB 3.19Å; T361-T365 PolarHBondContact O-N 3.19Å; T361-T365 PolarHBondContact O-OG1 3.43Å; T361-S411 WeakPolarHBondContact CG2-OG 3.4Å; T361-S411 PolarHBondContact OG1-O 2.49Å; T361-S411 VanDerWaalsContact OG1-O 3.04Å |
| 362 | F | 90 | Very high | 89.8 | Confident | 4 Ų | 4 | 45.1 Ų | 45.1 | 2% | 0.018 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -58.5 | -51.4 | 172.5 | -178.1 | -87 | 0 | 0 | 0 | 111.7 | E329 F358 W359 T365 R366 G414 M417 A418 | E329-F362 HydrophobicContact CG-CE2 4.03Å; E329-F362 HydrophobicContact CG-CZ 4.37Å; E329-F362 WeakPolarHBondContact OE1-CZ 3.38Å; F358-F362 WeakPolarHBondContact O-CB 3.46Å; F358-F362 PolarHBondContact O-N 2.68Å; W359-F362 HydrophobicContact CE3-CD1 4.33Å; W359-F362 HydrophobicContact CZ3-CD1 4.44Å; W359-F362 HydrophobicContact CZ3-CE1 4.34Å; F362-T365 PolarHBondContact O-N 3.48Å; F362-R366 VanDerWaalsContact CE1-NH1 3.3Å; F362-R366 VanDerWaalsContact CE1-NH2 3.34Å; F362-R366 WeakPolarHBondContact O-CB 3.48Å; F362-R366 PolarHBondContact O-N 2.99Å; F362-G414 WeakPolarHBondContact CA-O 3.23Å; F362-G414 WeakPolarHBondContact CB-O 3.32Å; F362-G414 WeakPolarHBondContact CD2-O 3.38Å; F362-M417 HydrophobicContact CD2-CB 4.16Å; F362-M417 HydrophobicContact CE2-CB 4.1Å; F362-A418 HydrophobicContact CD2-CB 4.1Å; F362-A418 HydrophobicContact CE2-CB 4.5Å; F362-A418 HydrophobicContact CG-CB 4.3Å; F362-A418 VanDerWaalsContact O-CB 3.31Å; F362-A418 WeakPolarHBondContact O-CB 3.29Å |
| 363 | A | 86 | Confident | 90 | Very high | 34 Ų | 34 | 44 Ų | 44 | 28% | 0.281 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -65.5 | -44.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | W359 G360 T365 R366 G367 | W359-A363 VanDerWaalsContact O-CB 3.31Å; W359-A363 WeakPolarHBondContact O-CB 3.35Å; W359-A363 PolarHBondContact O-N 3.04Å; G360-A363 PolarHBondContact O-N 3.43Å; A363-T365 VanDerWaalsContact C-N 3.34Å; A363-T365 PolarHBondContact O-N 2.95Å; A363-R366 PolarHBondContact O-N 2.95Å; A363-G367 PolarHBondContact O-N 3.28Å |
| 364 | A | 89.6 | Confident | 90 | Very high | 57 Ų | 57 | 46.3 Ų | 46.3 | 47% | 0.471 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61 | -43.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | G360 G367 M368 | G360-A364 VanDerWaalsContact O-CB 3.27Å; G360-A364 WeakPolarHBondContact O-CB 3.19Å; G360-A364 PolarHBondContact O-N 3.5Å; A364-G367 PolarHBondContact O-N 2.96Å; A364-M368 PolarHBondContact O-N 3.13Å |
| 365 | T | 92.7 | Very high | 89.9 | Confident | 26 Ų | 26 | 51.6 Ų | 51.6 | 16% | 0.16 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67 | -38.1 | 178.2 | -53.8 | 0 | 0 | 0 | 0 | 111.4 | T361 F362 A363 G367 M368 A369 A415 A418 | T361-T365 VanDerWaalsContact O-CB 3.22Å; T361-T365 WeakPolarHBondContact O-CB 3.19Å; T361-T365 PolarHBondContact O-N 3.19Å; T361-T365 PolarHBondContact O-OG1 3.43Å; F362-T365 PolarHBondContact O-N 3.48Å; A363-T365 VanDerWaalsContact C-N 3.34Å; A363-T365 PolarHBondContact O-N 2.95Å; T365-G367 VanDerWaalsContact C-N 3.33Å; T365-G367 PolarHBondContact O-N 3.49Å; T365-M368 CarbonylContact O-C 3.6Å; T365-M368 PolarHBondContact O-N 2.85Å; T365-A369 WeakPolarHBondContact O-CB 3.47Å; T365-A369 PolarHBondContact O-N 3.25Å; T365-A415 HydrophobicContact CG2-CB 4.42Å; T365-A415 WeakPolarHBondContact CG2-O 3.34Å; T365-A415 WeakPolarHBondContact OG1-CB 3.03Å; T365-A418 HydrophobicContact CG2-CB 4.02Å |
| 366 | R | 89.6 | Confident | 89.9 | Confident | 9 Ų | 9 | 52.7 Ų | 52.7 | 3% | 0.034 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.1 | -37.2 | 174 | -167.9 | 169.7 | -77.2 | 179.6 | -7.3 | 112.5 | H208 F209 F362 A363 A369 A418 | H208-R366 WeakPolarHBondContact O-CD 3.21Å; F209-R366 HydrophobicContact CB-CG 4.2Å; F362-R366 VanDerWaalsContact CE1-NH1 3.3Å; F362-R366 VanDerWaalsContact CE1-NH2 3.34Å; F362-R366 WeakPolarHBondContact O-CB 3.48Å; F362-R366 PolarHBondContact O-N 2.99Å; A363-R366 PolarHBondContact O-N 2.95Å; R366-A369 WeakPolarHBondContact O-CB 3.16Å; R366-A369 PolarHBondContact O-N 3.49Å; R366-A418 HydrophobicContact CB-CB 4.33Å; R366-A418 VanDerWaalsContact CZ-O 3.29Å; R366-A418 PolarHBondContact NE-O 3.4Å; R366-A418 PolarHBondContact NH2-O 3.35Å |
| 367 | G | 89.1 | Confident | 90 | Very high | 15 Ų | 15 | 54.2 Ų | 54.2 | 16% | 0.155 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.2 | -44.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A363 A364 T365 A369 I370 | A363-G367 PolarHBondContact O-N 3.28Å; A364-G367 PolarHBondContact O-N 2.96Å; T365-G367 VanDerWaalsContact C-N 3.33Å; T365-G367 PolarHBondContact O-N 3.49Å; G367-A369 VanDerWaalsContact C-N 3.26Å; G367-A369 PolarHBondContact O-N 3.12Å; G367-I370 PolarHBondContact O-N 3.01Å |
| 368 | M | 91.6 | Very high | 89.8 | Confident | 96 Ų | 96 | 52.3 Ų | 52.3 | 47% | 0.473 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -64 | -31.7 | 173.7 | -67.9 | -171.9 | -67.5 | 0 | 0 | 112.5 | A364 T365 I370 F371 F372 | A364-M368 PolarHBondContact O-N 3.13Å; T365-M368 CarbonylContact O-C 3.6Å; T365-M368 PolarHBondContact O-N 2.85Å; M368-I370 PolarHBondContact O-N 3.06Å; M368-F371 PolarHBondContact O-N 3.4Å; M368-F371 VanDerWaalsContact O-N 3.08Å; M368-F372 HydrophobicContact CB-CD2 4.42Å; M368-F372 HydrophobicContact CB-CE2 4.12Å; M368-F372 PolarHBondContact O-N 3.4Å; M368-F372 VanDerWaalsContact O-N 3.13Å |
| 369 | A | 90.8 | Very high | 89.8 | Confident | 1 Ų | 1 | 52.8 Ų | 52.8 | 1% | 0.008 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.7 | -24.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q205 T365 R366 G367 F371 F372 A373 M381 T419 | Q205-A369 HydrophobicContact CG-CB 4.37Å; T365-A369 WeakPolarHBondContact O-CB 3.47Å; T365-A369 PolarHBondContact O-N 3.25Å; R366-A369 WeakPolarHBondContact O-CB 3.16Å; R366-A369 PolarHBondContact O-N 3.49Å; G367-A369 VanDerWaalsContact C-N 3.26Å; G367-A369 PolarHBondContact O-N 3.12Å; A369-F371 VanDerWaalsContact C-N 3.29Å; A369-F371 PolarHBondContact O-N 2.93Å; A369-F372 PolarHBondContact O-N 3.34Å; A369-A373 WeakPolarHBondContact O-CB 3.46Å; A369-A373 PolarHBondContact O-N 2.92Å; A369-M381 HydrophobicContact CB-CE 4.1Å; A369-T419 HydrophobicContact CB-CG2 3.3Å |
| 370 | I | 92 | Very high | 89.9 | Confident | 45 Ų | 45 | 51.2 Ų | 51.2 | 23% | 0.231 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.3 | -43.4 | 174.2 | -58.1 | 172.3 | 0 | 0 | 0 | 110 | Q205 A206 F209 G367 M368 | Q205-I370 HydrophobicContact CB-CG1 3.97Å; A206-I370 HydrophobicContact CB-CD1 4.17Å; A206-I370 HydrophobicContact CB-CG1 4.47Å; F209-I370 HydrophobicContact CB-CD1 4.09Å; F209-I370 HydrophobicContact CD1-CD1 4.25Å; F209-I370 HydrophobicContact CG-CD1 4.14Å; G367-I370 PolarHBondContact O-N 3.01Å; M368-I370 PolarHBondContact O-N 3.06Å |
| 371 | F | 91.6 | Very high | 90.2 | Very high | 154 Ų | 154 | 49.9 Ų | 49.9 | 68% | 0.675 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -73.3 | -41.4 | 176.5 | -58.8 | -77.7 | 0 | 0 | 0 | 111.6 | M368 A369 A373 A374 | M368-F371 PolarHBondContact O-N 3.4Å; M368-F371 VanDerWaalsContact O-N 3.08Å; A369-F371 VanDerWaalsContact C-N 3.29Å; A369-F371 PolarHBondContact O-N 2.93Å; F371-A373 VanDerWaalsContact C-N 3.32Å; F371-A373 PolarHBondContact O-N 3.4Å; F371-A374 WeakPolarHBondContact O-CB 3.42Å; F371-A374 PolarHBondContact O-N 3.39Å; F371-A374 VanDerWaalsContact O-N 3.12Å |
| 372 | F | 90.4 | Very high | 90.3 | Very high | 106 Ų | 106 | 49 Ų | 49 | 47% | 0.465 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -65.1 | -35.3 | 178.1 | -68 | -38.1 | 0 | 0 | 0 | 112.8 | M368 A369 A374 C375 L376 M381 | M368-F372 HydrophobicContact CB-CD2 4.42Å; M368-F372 HydrophobicContact CB-CE2 4.12Å; M368-F372 PolarHBondContact O-N 3.4Å; M368-F372 VanDerWaalsContact O-N 3.13Å; A369-F372 PolarHBondContact O-N 3.34Å; F372-A374 PolarHBondContact O-N 2.99Å; F372-C375 PolarHBondContact O-N 3.49Å; F372-L376 HydrophobicContact CB-CD1 4.15Å; F372-L376 WeakPolarHBondContact O-CB 3.24Å; F372-L376 PolarHBondContact O-N 3.36Å; F372-M381 HydrophobicContact CB-CE 4.41Å |
| 373 | A | 89.1 | Confident | 90.5 | Very high | 14 Ų | 14 | 53 Ų | 53 | 12% | 0.116 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -66.6 | -16.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | P202 Q205 A369 F371 M381 | P202-A373 HydrophobicContact CG-CB 4.24Å; Q205-A373 HydrophobicContact CG-CB 3.78Å; A369-A373 WeakPolarHBondContact O-CB 3.46Å; A369-A373 PolarHBondContact O-N 2.92Å; F371-A373 VanDerWaalsContact C-N 3.32Å; F371-A373 PolarHBondContact O-N 3.4Å; A373-M381 HydrophobicContact CB-CE 4.38Å; A373-M381 HydrophobicContact CB-SD 4.02Å |
| 374 | A | 87.3 | Confident | 91 | Very high | 73 Ų | 73 | 56.3 Ų | 56.3 | 60% | 0.603 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -81.5 | -20.8 | 172 | 0 | 0 | 0 | 0 | 0 | 112.5 | P202 F371 F372 | P202-A374 HydrophobicContact CG-CB 4.01Å; F371-A374 WeakPolarHBondContact O-CB 3.42Å; F371-A374 PolarHBondContact O-N 3.39Å; F371-A374 VanDerWaalsContact O-N 3.12Å; F372-A374 PolarHBondContact O-N 2.99Å |
| 375 | C | 88.8 | Confident | 91.3 | Very high | 110 Ų | 110 | 54.1 Ų | 54.1 | 74% | 0.743 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -112.7 | -26.1 | -173.4 | -61.3 | 0 | 0 | 0 | 0 | 113.6 | F372 | F372-C375 PolarHBondContact O-N 3.49Å |
| 376 | L | 89.4 | Confident | 91.4 | Very high | 67 Ų | 67 | 53.3 Ų | 53.3 | 35% | 0.351 | 29% | 0.29 | S | S | . | . | S | Bend | trans | -114.8 | 148 | -172.8 | -60.1 | -178.9 | 0 | 0 | 0 | 111.1 | F372 M381 | F372-L376 HydrophobicContact CB-CD1 4.15Å; F372-L376 WeakPolarHBondContact O-CB 3.24Å; F372-L376 PolarHBondContact O-N 3.36Å; L376-M381 HydrophobicContact CB-CG 3.94Å; L376-M381 HydrophobicContact CB-SD 4.45Å; L376-M381 HydrophobicContact CD1-CG 4.32Å |
| 377 | Y | 88.7 | Confident | 91.8 | Very high | 111 Ų | 111 | 57.9 Ų | 57.9 | 44% | 0.435 | 32% | 0.315 | S | S | . | . | trans | -71.9 | 140.8 | 172.8 | -163.7 | -102.2 | 0 | 0 | 0 | 110.5 | G379 T380 M381 Q430 | Y377-G379 VanDerWaalsContact C-N 3.26Å; Y377-G379 PolarHBondContact O-N 3.48Å; Y377-T380 WeakPolarHBondContact O-CB 3.11Å; Y377-T380 PolarHBondContact O-N 2.87Å; Y377-M381 PolarHBondContact O-N 3.02Å; Y377-M381 VanDerWaalsContact O-N 3.13Å; Y377-Q430 PolarHBondContact OH-NE2 3.44Å; Y377-Q430 PolarHBondContact OH-OE1 3.43Å | ||
| 378 | P | 88.6 | Confident | 92.1 | Very high | 16 Ų | 16 | 57.8 Ų | 57.8 | 10% | 0.104 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -52.5 | -40.7 | 179.5 | -28.9 | 35.5 | 0 | 0 | 0 | 113.7 | T380 M381 I382 W427 | P378-T380 VanDerWaalsContact C-N 3.34Å; P378-T380 PolarHBondContact O-N 2.96Å; P378-M381 WeakPolarHBondContact O-CB 3.46Å; P378-M381 PolarHBondContact O-N 3.42Å; P378-I382 WeakPolarHBondContact O-CG1 3.31Å; P378-I382 PolarHBondContact O-N 3.45Å; P378-W427 HydrophobicContact CB-CB 3.97Å |
| 379 | G | 90.7 | Very high | 92.3 | Very high | 10 Ų | 10 | 53.3 Ų | 53.3 | 10% | 0.103 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.1 | -36.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114 | Y377 L383 | Y377-G379 VanDerWaalsContact C-N 3.26Å; Y377-G379 PolarHBondContact O-N 3.48Å; G379-L383 PolarHBondContact O-N 3.04Å |
| 380 | T | 91.9 | Very high | 92.6 | Very high | 67 Ų | 67 | 55.3 Ų | 55.3 | 41% | 0.411 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -69.3 | -39.4 | 175.2 | -52.4 | 0 | 0 | 0 | 0 | 111 | Y377 P378 L383 L384 | Y377-T380 WeakPolarHBondContact O-CB 3.11Å; Y377-T380 PolarHBondContact O-N 2.87Å; P378-T380 VanDerWaalsContact C-N 3.34Å; P378-T380 PolarHBondContact O-N 2.96Å; T380-L383 PolarHBondContact O-N 3.15Å; T380-L384 HydrophobicContact CG2-CD1 4.34Å; T380-L384 WeakPolarHBondContact O-CG 3.4Å; T380-L384 PolarHBondContact O-N 3.46Å |
| 381 | M | 93.5 | Very high | 92.8 | Very high | 11 Ų | 11 | 57.8 Ų | 57.8 | 5% | 0.054 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.2 | -45.7 | 175.7 | -65.6 | -178.1 | 65 | 0 | 0 | 111.4 | A369 F372 A373 L376 Y377 P378 L383 L384 C385 T419 | A369-M381 HydrophobicContact CB-CE 4.1Å; F372-M381 HydrophobicContact CB-CE 4.41Å; A373-M381 HydrophobicContact CB-CE 4.38Å; A373-M381 HydrophobicContact CB-SD 4.02Å; L376-M381 HydrophobicContact CB-CG 3.94Å; L376-M381 HydrophobicContact CB-SD 4.45Å; L376-M381 HydrophobicContact CD1-CG 4.32Å; Y377-M381 PolarHBondContact O-N 3.02Å; Y377-M381 VanDerWaalsContact O-N 3.13Å; P378-M381 WeakPolarHBondContact O-CB 3.46Å; P378-M381 PolarHBondContact O-N 3.42Å; M381-L383 PolarHBondContact O-N 3.31Å; M381-L384 PolarHBondContact O-N 3.48Å; M381-C385 WeakPolarHBondContact O-CB 3.49Å; M381-C385 PolarHBondContact O-N 2.96Å; M381-C385 PolarHBondContact O-SG 2.99Å; M381-T419 HydrophobicContact CE-CG2 4.32Å |
| 382 | I | 95 | Very high | 93.1 | Very high | 2 Ų | 2 | 50.5 Ų | 50.5 | 1% | 0.01 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.6 | -46 | 176.4 | -63.4 | 165.1 | 0 | 0 | 0 | 110.7 | F321 P378 L384 C385 L386 T420 W427 F485 | F321-I382 HydrophobicContact CZ-CG2 4.5Å; P378-I382 WeakPolarHBondContact O-CG1 3.31Å; P378-I382 PolarHBondContact O-N 3.45Å; I382-L384 PolarHBondContact O-N 3.09Å; I382-C385 WeakPolarHBondContact O-CB 3.5Å; I382-C385 PolarHBondContact O-N 3.38Å; I382-L386 HydrophobicContact CG2-CD1 3.72Å; I382-L386 HydrophobicContact CG2-CG 4.08Å; I382-L386 WeakPolarHBondContact O-CG 3.45Å; I382-L386 PolarHBondContact O-N 2.9Å; I382-T420 HydrophobicContact CG2-CG2 4.4Å; I382-W427 HydrophobicContact CD1-CB 3.75Å; I382-W427 HydrophobicContact CD1-CG 4.01Å; I382-F485 HydrophobicContact CB-CE2 3.96Å; I382-F485 HydrophobicContact CB-CZ 3.92Å; I382-F485 HydrophobicContact CD1-CE2 3.74Å; I382-F485 HydrophobicContact CD1-CZ 4.26Å; I382-F485 HydrophobicContact CG1-CE2 4.47Å; I382-F485 HydrophobicContact CG2-CD1 4.26Å; I382-F485 HydrophobicContact CG2-CD2 3.62Å; I382-F485 HydrophobicContact CG2-CE1 4.13Å; I382-F485 HydrophobicContact CG2-CE2 3.48Å; I382-F485 VanDerWaalsContact CG2-CE2 3.48Å; I382-F485 HydrophobicContact CG2-CG 4.01Å; I382-F485 HydrophobicContact CG2-CZ 3.75Å |
| 383 | L | 95.1 | Very high | 93.3 | Very high | 89 Ų | 89 | 45.4 Ų | 45.4 | 47% | 0.466 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -60 | -45.3 | 179.7 | -176.9 | 65.2 | 0 | 0 | 0 | 112.2 | G379 T380 M381 C385 L386 L387 | G379-L383 PolarHBondContact O-N 3.04Å; T380-L383 PolarHBondContact O-N 3.15Å; M381-L383 PolarHBondContact O-N 3.31Å; L383-C385 VanDerWaalsContact C-N 3.31Å; L383-C385 PolarHBondContact O-N 2.91Å; L383-L386 PolarHBondContact O-N 3.09Å; L383-L387 HydrophobicContact CG-CD1 4.24Å; L383-L387 WeakPolarHBondContact O-CB 3.42Å; L383-L387 VanDerWaalsContact O-CG 3.31Å; L383-L387 WeakPolarHBondContact O-CG 3.38Å; L383-L387 PolarHBondContact O-N 3.42Å |
| 384 | L | 95.1 | Very high | 93.7 | Very high | 103 Ų | 103 | 47.8 Ų | 47.8 | 54% | 0.539 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.7 | -40.7 | 176.2 | -69.5 | 173.9 | 0 | 0 | 0 | 111.7 | T380 M381 I382 G388 | T380-L384 HydrophobicContact CG2-CD1 4.34Å; T380-L384 WeakPolarHBondContact O-CG 3.4Å; T380-L384 PolarHBondContact O-N 3.46Å; M381-L384 PolarHBondContact O-N 3.48Å; I382-L384 PolarHBondContact O-N 3.09Å; L384-G388 PolarHBondContact O-N 3.47Å |
| 385 | C | 95.9 | Very high | 94 | Very high | 11 Ų | 11 | 47 Ų | 47 | 7% | 0.074 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.4 | -45.3 | 176.3 | -70.9 | 0 | 0 | 0 | 0 | 112 | M381 I382 L383 G388 T389 S416 T419 T420 | M381-C385 WeakPolarHBondContact O-CB 3.49Å; M381-C385 PolarHBondContact O-N 2.96Å; M381-C385 PolarHBondContact O-SG 2.99Å; I382-C385 WeakPolarHBondContact O-CB 3.5Å; I382-C385 PolarHBondContact O-N 3.38Å; L383-C385 VanDerWaalsContact C-N 3.31Å; L383-C385 PolarHBondContact O-N 2.91Å; C385-G388 PolarHBondContact O-N 3.04Å; C385-T389 WeakPolarHBondContact O-CB 3.33Å; C385-T389 PolarHBondContact O-N 3.46Å; C385-T389 PolarHBondContact O-OG1 3.04Å; C385-S416 WeakPolarHBondContact CB-O 3.09Å; C385-S416 WeakPolarHBondContact O-CB 3.45Å; C385-S416 PolarHBondContact SG-O 3.01Å; C385-S416 VanDerWaalsContact SG-O 3.35Å; C385-T419 PolarHBondContact SG-OG1 2.75Å; C385-T420 WeakPolarHBondContact CB-OG1 3.35Å |
| 386 | L | 96.2 | Very high | 94.2 | Very high | 9 Ų | 9 | 41.7 Ų | 41.7 | 5% | 0.047 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -65.4 | -41.6 | 178.7 | -69.5 | 174.9 | 0 | 0 | 0 | 112 | F321 I382 L383 T389 M390 F485 | F321-L386 HydrophobicContact CE2-CD1 4.4Å; F321-L386 HydrophobicContact CE2-CD2 4.23Å; F321-L386 HydrophobicContact CZ-CD2 4.21Å; I382-L386 HydrophobicContact CG2-CD1 3.72Å; I382-L386 HydrophobicContact CG2-CG 4.08Å; I382-L386 WeakPolarHBondContact O-CG 3.45Å; I382-L386 PolarHBondContact O-N 2.9Å; L383-L386 PolarHBondContact O-N 3.09Å; L386-T389 PolarHBondContact O-N 3.36Å; L386-M390 WeakPolarHBondContact O-CB 3.28Å; L386-M390 WeakPolarHBondContact O-CG 3.47Å; L386-M390 PolarHBondContact O-N 3.47Å; L386-F485 HydrophobicContact CD1-CB 3.46Å; L386-F485 VanDerWaalsContact CD1-CB 3.46Å; L386-F485 HydrophobicContact CD1-CD1 3.8Å; L386-F485 HydrophobicContact CD1-CD2 4.45Å; L386-F485 HydrophobicContact CD1-CG 3.65Å |
| 387 | L | 96.6 | Very high | 94.3 | Very high | 106 Ų | 106 | 39.7 Ų | 39.7 | 56% | 0.555 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -61.2 | -45.2 | 173.7 | -72 | 172.3 | 0 | 0 | 0 | 111.6 | L383 T389 M390 L391 | L383-L387 HydrophobicContact CG-CD1 4.24Å; L383-L387 WeakPolarHBondContact O-CB 3.42Å; L383-L387 VanDerWaalsContact O-CG 3.31Å; L383-L387 WeakPolarHBondContact O-CG 3.38Å; L383-L387 PolarHBondContact O-N 3.42Å; L387-T389 VanDerWaalsContact C-N 3.35Å; L387-M390 PolarHBondContact O-N 3.22Å; L387-L391 WeakPolarHBondContact O-CB 3.28Å; L387-L391 PolarHBondContact O-N 3.04Å |
| 388 | G | 96.6 | Very high | 94.5 | Very high | 13 Ų | 13 | 41.8 Ų | 41.8 | 13% | 0.134 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.7 | -40.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L384 C385 S392 | L384-G388 PolarHBondContact O-N 3.47Å; C385-G388 PolarHBondContact O-N 3.04Å; G388-S392 WeakPolarHBondContact O-CB 3.2Å; G388-S392 PolarHBondContact O-N 2.92Å; G388-S392 PolarHBondContact O-OG 3.28Å |
| 389 | T | 96.2 | Very high | 94.5 | Very high | 2 Ų | 2 | 45.6 Ų | 45.6 | 1% | 0.012 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -67.7 | -42.6 | 179.4 | -54.8 | 0 | 0 | 0 | 0 | 110.7 | C385 L386 L387 S392 S393 Y413 S416 M417 A478 | C385-T389 WeakPolarHBondContact O-CB 3.33Å; C385-T389 PolarHBondContact O-N 3.46Å; C385-T389 PolarHBondContact O-OG1 3.04Å; L386-T389 PolarHBondContact O-N 3.36Å; L387-T389 VanDerWaalsContact C-N 3.35Å; T389-S392 WeakPolarHBondContact CA-OG 3.48Å; T389-S392 PolarHBondContact O-OG 2.8Å; T389-S392 VanDerWaalsContact O-OG 3.1Å; T389-S393 VanDerWaalsContact O-CB 3.23Å; T389-S393 WeakPolarHBondContact O-CB 3.43Å; T389-S393 PolarHBondContact O-N 2.96Å; T389-S393 PolarHBondContact O-OG 3.45Å; T389-Y413 HydrophobicContact CG2-CD2 4.09Å; T389-Y413 HydrophobicContact CG2-CE2 3.6Å; T389-S416 WeakPolarHBondContact CA-OG 3.43Å; T389-S416 PolarHBondContact N-OG 2.98Å; T389-S416 PolarHBondContact OG1-OG 3.27Å; T389-M417 HydrophobicContact CG2-CE 3.79Å; T389-M417 HydrophobicContact CG2-SD 4.03Å; T389-A478 HydrophobicContact CG2-CB 3.92Å |
| 390 | M | 96.5 | Very high | 94.2 | Very high | 42 Ų | 42 | 45.8 Ų | 45.8 | 21% | 0.207 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.9 | -49.1 | 174.6 | -83.1 | -62.6 | -65.5 | 0 | 0 | 112.1 | L386 L387 S393 L394 A478 V479 S482 | L386-M390 WeakPolarHBondContact O-CB 3.28Å; L386-M390 WeakPolarHBondContact O-CG 3.47Å; L386-M390 PolarHBondContact O-N 3.47Å; L387-M390 PolarHBondContact O-N 3.22Å; M390-S393 PolarHBondContact O-N 3.23Å; M390-L394 HydrophobicContact CE-CD1 4.36Å; M390-L394 WeakPolarHBondContact O-CB 3.43Å; M390-L394 VanDerWaalsContact O-CG 3.29Å; M390-L394 WeakPolarHBondContact O-CG 3.43Å; M390-L394 PolarHBondContact O-N 3.04Å; M390-A478 HydrophobicContact CG-CB 4.32Å; M390-A478 HydrophobicContact SD-CB 3.59Å; M390-A478 VanDerWaalsContact SD-CB 3.59Å; M390-V479 HydrophobicContact CE-CG2 3.73Å; M390-V479 HydrophobicContact SD-CB 4.43Å; M390-V479 HydrophobicContact SD-CG2 3.87Å; M390-V479 PolarHBondContact SD-N 2.93Å; M390-V479 VanDerWaalsContact SD-N 3.41Å; M390-S482 WeakPolarHBondContact CG-OG 3.43Å |
| 391 | L | 96.8 | Very high | 93.6 | Very high | 98 Ų | 98 | 48.3 Ų | 48.3 | 51% | 0.513 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.8 | -48.2 | -179.6 | 178.4 | 59.9 | 0 | 0 | 0 | 111.4 | L387 L394 L395 L412 | L387-L391 WeakPolarHBondContact O-CB 3.28Å; L387-L391 PolarHBondContact O-N 3.04Å; L391-L394 PolarHBondContact O-N 3.46Å; L391-L395 HydrophobicContact CD1-CD1 4.22Å; L391-L395 HydrophobicContact CD1-CG 4.36Å; L391-L395 HydrophobicContact CG-CD1 4.15Å; L391-L395 VanDerWaalsContact O-CG 3.27Å; L391-L395 WeakPolarHBondContact O-CG 3.44Å; L391-L395 PolarHBondContact O-N 3.46Å; L391-L412 HydrophobicContact CD2-CD2 4.28Å; L391-L412 HydrophobicContact CG-CD2 4.38Å |
| 392 | S | 96.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.4 | -42.4 | 178.8 | 51.3 | 0 | 0 | 0 | 0 | 112.4 | G388 T389 L394 L395 L396 Y413 | G388-S392 WeakPolarHBondContact O-CB 3.2Å; G388-S392 PolarHBondContact O-N 2.92Å; G388-S392 PolarHBondContact O-OG 3.28Å; T389-S392 WeakPolarHBondContact CA-OG 3.48Å; T389-S392 PolarHBondContact O-OG 2.8Å; T389-S392 VanDerWaalsContact O-OG 3.1Å; S392-L394 PolarHBondContact O-N 2.9Å; S392-L395 PolarHBondContact O-N 3.02Å; S392-L396 WeakPolarHBondContact O-CB 3.42Å; S392-L396 VanDerWaalsContact O-CG 3.25Å; S392-L396 WeakPolarHBondContact O-CG 3.44Å; S392-L396 PolarHBondContact O-N 2.93Å; S392-Y413 WeakPolarHBondContact OG-CA 3.31Å; S392-Y413 WeakPolarHBondContact OG-CD2 3.22Å |
| 393 | S | 95.8 | Very high | 93 | Very high | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.4 | -39.2 | 177.7 | -56.6 | 0 | 0 | 0 | 0 | 112.4 | T389 M390 C397 Y413 S474 | T389-S393 VanDerWaalsContact O-CB 3.23Å; T389-S393 WeakPolarHBondContact O-CB 3.43Å; T389-S393 PolarHBondContact O-N 2.96Å; T389-S393 PolarHBondContact O-OG 3.45Å; M390-S393 PolarHBondContact O-N 3.23Å; S393-C397 VanDerWaalsContact O-CB 3.22Å; S393-C397 WeakPolarHBondContact O-CB 3.48Å; S393-C397 PolarHBondContact O-N 3.49Å; S393-Y413 VanDerWaalsContact OG-CE2 3.23Å; S393-Y413 WeakPolarHBondContact OG-CE2 3.39Å; S393-S474 PolarHBondContact OG-O 2.86Å |
| 394 | L | 95.6 | Very high | 92.7 | Very high | 63 Ų | 63 | 56.1 Ų | 56.1 | 33% | 0.33 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -64.5 | -46.3 | 174.7 | -75 | 168.4 | 0 | 0 | 0 | 111.5 | M390 L391 S392 L396 C397 F398 L475 | M390-L394 HydrophobicContact CE-CD1 4.36Å; M390-L394 WeakPolarHBondContact O-CB 3.43Å; M390-L394 VanDerWaalsContact O-CG 3.29Å; M390-L394 WeakPolarHBondContact O-CG 3.43Å; M390-L394 PolarHBondContact O-N 3.04Å; L391-L394 PolarHBondContact O-N 3.46Å; S392-L394 PolarHBondContact O-N 2.9Å; L394-L396 VanDerWaalsContact C-N 3.34Å; L394-L396 PolarHBondContact O-N 3.06Å; L394-C397 PolarHBondContact O-N 3.34Å; L394-F398 HydrophobicContact CD2-CE2 4.02Å; L394-F398 VanDerWaalsContact O-CD2 3.27Å; L394-F398 WeakPolarHBondContact O-CD2 3.39Å; L394-F398 PolarHBondContact O-N 3.28Å; L394-L475 HydrophobicContact CD2-CD1 3.57Å; L394-L475 HydrophobicContact CD2-CD2 4.31Å; L394-L475 HydrophobicContact CG-CD1 3.85Å |
| 395 | L | 94.3 | Very high | 92.6 | Very high | 56 Ų | 56 | 53 Ų | 53 | 29% | 0.293 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.3 | -46.2 | 176.9 | -72.5 | 171.6 | 0 | 0 | 0 | 111.5 | L391 S392 C397 F399 V405 | L391-L395 HydrophobicContact CD1-CD1 4.22Å; L391-L395 HydrophobicContact CD1-CG 4.36Å; L391-L395 HydrophobicContact CG-CD1 4.15Å; L391-L395 VanDerWaalsContact O-CG 3.27Å; L391-L395 WeakPolarHBondContact O-CG 3.44Å; L391-L395 PolarHBondContact O-N 3.46Å; S392-L395 PolarHBondContact O-N 3.02Å; L395-C397 VanDerWaalsContact C-N 3.33Å; L395-C397 PolarHBondContact O-N 3.21Å; L395-F399 HydrophobicContact CD2-CD2 4.46Å; L395-F399 HydrophobicContact CD2-CE2 4.47Å; L395-F399 PolarHBondContact O-N 2.96Å; L395-V405 HydrophobicContact CB-CG1 4.22Å |
| 396 | L | 93.2 | Very high | 92.4 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.8 | -35.7 | 178.1 | -74.4 | 170.8 | 0 | 0 | 0 | 112.4 | Y332 S392 L394 T400 L406 M471 | Y332-L396 HydrophobicContact CE2-CD1 3.98Å; Y332-L396 VanDerWaalsContact OH-CD1 3.3Å; Y332-L396 WeakPolarHBondContact OH-CD1 3.04Å; S392-L396 WeakPolarHBondContact O-CB 3.42Å; S392-L396 VanDerWaalsContact O-CG 3.25Å; S392-L396 WeakPolarHBondContact O-CG 3.44Å; S392-L396 PolarHBondContact O-N 2.93Å; L394-L396 VanDerWaalsContact C-N 3.34Å; L394-L396 PolarHBondContact O-N 3.06Å; L396-T400 WeakPolarHBondContact O-CG2 3.42Å; L396-L406 HydrophobicContact CD2-CD2 3.95Å; L396-M471 HydrophobicContact CB-SD 3.73Å; L396-M471 HydrophobicContact CD1-SD 4.21Å; L396-M471 HydrophobicContact CD2-SD 4.39Å; L396-M471 HydrophobicContact CG-SD 4.34Å |
| 397 | C | 92.4 | Very high | 92.4 | Very high | 25 Ų | 25 | 56 Ų | 56 | 17% | 0.169 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -74.4 | -40 | 179.8 | -170.9 | 0 | 0 | 0 | 0 | 113.1 | S393 L394 L395 L475 | S393-C397 VanDerWaalsContact O-CB 3.22Å; S393-C397 WeakPolarHBondContact O-CB 3.48Å; S393-C397 PolarHBondContact O-N 3.49Å; L394-C397 PolarHBondContact O-N 3.34Å; L395-C397 VanDerWaalsContact C-N 3.33Å; L395-C397 PolarHBondContact O-N 3.21Å; C397-L475 HydrophobicContact CB-CD2 4.13Å |
| 398 | F | 91.1 | Very high | 92.3 | Very high | 154 Ų | 154 | 55.5 Ų | 55.5 | 68% | 0.675 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -79.8 | -32.5 | -179 | -77 | -61 | 0 | 0 | 0 | 113.5 | L394 | L394-F398 HydrophobicContact CD2-CE2 4.02Å; L394-F398 VanDerWaalsContact O-CD2 3.27Å; L394-F398 WeakPolarHBondContact O-CD2 3.39Å; L394-F398 PolarHBondContact O-N 3.28Å |
| 399 | F | 89.6 | Confident | 92.3 | Very high | 97 Ų | 97 | 55 Ų | 55 | 43% | 0.425 | 29% | 0.288 | S | S | . | . | trans | -118.4 | 44 | -173 | -58.6 | -76.3 | 0 | 0 | 0 | 112.6 | L395 N401 H402 V405 | L395-F399 HydrophobicContact CD2-CD2 4.46Å; L395-F399 HydrophobicContact CD2-CE2 4.47Å; L395-F399 PolarHBondContact O-N 2.96Å; F399-N401 PolarHBondContact O-N 3.23Å; F399-N401 VanDerWaalsContact O-N 3.15Å; F399-H402 HydrophobicContact CB-CB 4.41Å; F399-H402 AromaticContact CD1-CD2 3.82Å; F399-H402 PolarHBondContact O-N 2.7Å; F399-H402 VanDerWaalsContact O-N 3.13Å; F399-V405 HydrophobicContact CB-CB 3.97Å; F399-V405 HydrophobicContact CB-CG1 3.77Å; F399-V405 HydrophobicContact CB-CG2 3.98Å; F399-V405 HydrophobicContact CD2-CG1 4.49Å; F399-V405 HydrophobicContact CG-CG2 4.45Å | ||
| 400 | T | 84 | Confident | 92.2 | Very high | 13 Ų | 13 | 54.9 Ų | 54.9 | 8% | 0.08 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.7 | -27.7 | -178.6 | 49.8 | 0 | 0 | 0 | 0 | 114.3 | F339 L396 P468 M471 | F339-T400 HydrophobicContact CZ-CG2 4.48Å; L396-T400 WeakPolarHBondContact O-CG2 3.42Å; T400-P468 HydrophobicContact CG2-CB 3.89Å; T400-P468 HydrophobicContact CG2-CG 4.15Å; T400-M471 HydrophobicContact CG2-CB 4.4Å; T400-M471 HydrophobicContact CG2-CG 4.08Å |
| 401 | N | 79.6 | Confident | 92.2 | Very high | 121 Ų | 121 | 54.7 Ų | 54.7 | 65% | 0.647 | 29% | 0.29 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.1 | -7 | -177.8 | -62.7 | -40.9 | 0 | 0 | 0 | 113.8 | F399 | F399-N401 PolarHBondContact O-N 3.23Å; F399-N401 VanDerWaalsContact O-N 3.15Å |
| 402 | H | 88.6 | Confident | 92.2 | Very high | 110 Ų | 110 | 52.9 Ų | 52.9 | 51% | 0.509 | 28% | 0.281 | S | S | . | . | trans | -96.6 | 106.5 | -178.3 | -73.7 | -74.5 | 0 | 0 | 0 | 111.3 | F399 A404 V405 L406 | F399-H402 HydrophobicContact CB-CB 4.41Å; F399-H402 AromaticContact CD1-CD2 3.82Å; F399-H402 PolarHBondContact O-N 2.7Å; F399-H402 VanDerWaalsContact O-N 3.13Å; H402-A404 VanDerWaalsContact C-N 3.28Å; H402-A404 PolarHBondContact O-N 3.39Å; H402-A404 VanDerWaalsContact O-N 3.16Å; H402-V405 HydrophobicContact CB-CB 4.12Å; H402-V405 HydrophobicContact CB-CG2 3.83Å; H402-V405 PolarHBondContact O-N 2.91Å; H402-L406 PolarHBondContact O-N 3.34Å | ||
| 403 | N | 87.4 | Confident | 92.2 | Very high | 82 Ų | 82 | 52.9 Ų | 52.9 | 44% | 0.439 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -50.6 | -43.5 | -179.1 | -68.1 | -18.6 | 0 | 0 | 0 | 113.6 | M346 V405 L406 W407 | M346-N403 HydrophobicContact CE-CB 4.31Å; N403-V405 VanDerWaalsContact C-N 3.33Å; N403-V405 PolarHBondContact O-N 2.93Å; N403-L406 WeakPolarHBondContact O-CB 3.48Å; N403-L406 PolarHBondContact O-N 2.98Å; N403-W407 PolarHBondContact O-N 3.26Å; N403-W407 VanDerWaalsContact O-N 3.16Å |
| 404 | A | 89.8 | Confident | 92.1 | Very high | 74 Ų | 74 | 52.9 Ų | 52.9 | 61% | 0.612 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -62.9 | -38.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | H402 W407 V408 | H402-A404 VanDerWaalsContact C-N 3.28Å; H402-A404 PolarHBondContact O-N 3.39Å; H402-A404 VanDerWaalsContact O-N 3.16Å; A404-W407 PolarHBondContact O-N 3.43Å; A404-V408 WeakPolarHBondContact O-CG2 3.27Å; A404-V408 PolarHBondContact O-N 2.96Å; A404-V408 VanDerWaalsContact O-N 3.1Å |
| 405 | V | 91.7 | Very high | 92.1 | Very high | 37 Ų | 37 | 51 Ų | 51 | 22% | 0.224 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -71.1 | -34.2 | 177.9 | -176.3 | 0 | 0 | 0 | 0 | 110.8 | L395 F399 H402 N403 W407 G409 | L395-V405 HydrophobicContact CB-CG1 4.22Å; F399-V405 HydrophobicContact CB-CB 3.97Å; F399-V405 HydrophobicContact CB-CG1 3.77Å; F399-V405 HydrophobicContact CB-CG2 3.98Å; F399-V405 HydrophobicContact CD2-CG1 4.49Å; F399-V405 HydrophobicContact CG-CG2 4.45Å; H402-V405 HydrophobicContact CB-CB 4.12Å; H402-V405 HydrophobicContact CB-CG2 3.83Å; H402-V405 PolarHBondContact O-N 2.91Å; N403-V405 VanDerWaalsContact C-N 3.33Å; N403-V405 PolarHBondContact O-N 2.93Å; V405-W407 PolarHBondContact O-N 3.5Å; V405-G409 WeakPolarHBondContact O-CA 3.45Å; V405-G409 PolarHBondContact O-N 3.35Å |
| 406 | L | 92.5 | Very high | 92.2 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.7 | -44.5 | 173 | -67.6 | 178.5 | 0 | 0 | 0 | 111.6 | F339 A344 M346 L354 L396 H402 N403 T410 | F339-L406 HydrophobicContact CE1-CD2 4.05Å; A344-L406 HydrophobicContact CB-CD1 3.81Å; M346-L406 HydrophobicContact SD-CD1 4.11Å; L354-L406 HydrophobicContact CD2-CB 4.09Å; L396-L406 HydrophobicContact CD2-CD2 3.95Å; H402-L406 PolarHBondContact O-N 3.34Å; N403-L406 WeakPolarHBondContact O-CB 3.48Å; N403-L406 PolarHBondContact O-N 2.98Å; L406-T410 WeakPolarHBondContact O-CB 3.19Å; L406-T410 PolarHBondContact O-N 3.44Å; L406-T410 PolarHBondContact O-OG1 3.39Å |
| 407 | W | 95 | Very high | 92.2 | Very high | 82 Ų | 82 | 49 Ų | 49 | 31% | 0.311 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.8 | -52.2 | 176.3 | -75.4 | 106.1 | 0 | 0 | 0 | 112.7 | H350 G353 L354 L357 N403 A404 V405 S411 | H350-W407 HydrophobicContact CB-CZ2 4.19Å; G353-W407 VanDerWaalsContact C-CZ3 3.5Å; L354-W407 HydrophobicContact CD1-CD2 3.36Å; L354-W407 HydrophobicContact CD1-CE3 3.63Å; L354-W407 HydrophobicContact CD1-CG 3.93Å; L354-W407 HydrophobicContact CD1-CH2 3.92Å; L354-W407 HydrophobicContact CD1-CZ2 3.63Å; L354-W407 HydrophobicContact CD1-CZ3 3.92Å; L354-W407 HydrophobicContact CG-CD2 4.33Å; L354-W407 HydrophobicContact CG-CE3 4.23Å; L357-W407 HydrophobicContact CB-CE3 4.49Å; L357-W407 HydrophobicContact CB-CZ3 4.26Å; L357-W407 HydrophobicContact CD2-CE3 3.51Å; L357-W407 HydrophobicContact CD2-CZ3 4.02Å; N403-W407 PolarHBondContact O-N 3.26Å; N403-W407 VanDerWaalsContact O-N 3.16Å; A404-W407 PolarHBondContact O-N 3.43Å; V405-W407 PolarHBondContact O-N 3.5Å; W407-S411 WeakPolarHBondContact O-CB 3.49Å; W407-S411 PolarHBondContact O-N 3.49Å |
| 408 | V | 95.6 | Very high | 92.1 | Very high | 97 Ų | 97 | 47.8 Ų | 47.8 | 59% | 0.588 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -66.5 | -44 | -178.1 | 175.5 | 0 | 0 | 0 | 0 | 111.1 | A404 S411 L412 | A404-V408 WeakPolarHBondContact O-CG2 3.27Å; A404-V408 PolarHBondContact O-N 2.96Å; A404-V408 VanDerWaalsContact O-N 3.1Å; V408-S411 WeakPolarHBondContact O-CB 3.37Å; V408-S411 PolarHBondContact O-N 2.99Å; V408-L412 WeakPolarHBondContact O-CB 3.31Å; V408-L412 PolarHBondContact O-N 3.48Å |
| 409 | G | 95.4 | Very high | 92.2 | Very high | 1 Ų | 1 | 40.8 Ų | 40.8 | 1% | 0.01 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.9 | -46 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | V405 S411 L412 Y413 | V405-G409 WeakPolarHBondContact O-CA 3.45Å; V405-G409 PolarHBondContact O-N 3.35Å; G409-S411 PolarHBondContact O-N 3.2Å; G409-L412 PolarHBondContact O-N 2.91Å; G409-Y413 VanDerWaalsContact O-CB 3.22Å; G409-Y413 WeakPolarHBondContact O-CB 3.42Å; G409-Y413 PolarHBondContact O-N 2.72Å |
| 410 | T | 95.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.1 | -45 | 175.7 | -61.5 | 0 | 0 | 0 | 0 | 111.5 | Y332 F358 L406 Y413 G414 | Y332-T410 HydrophobicContact CE1-CG2 4.01Å; Y332-T410 PolarHBondContact OH-OG1 3.16Å; F358-T410 HydrophobicContact CB-CG2 3.67Å; L406-T410 WeakPolarHBondContact O-CB 3.19Å; L406-T410 PolarHBondContact O-N 3.44Å; L406-T410 PolarHBondContact O-OG1 3.39Å; T410-Y413 PolarHBondContact O-N 2.84Å; T410-G414 PolarHBondContact O-N 3.18Å |
| 411 | S | 95.8 | Very high | 92.7 | Very high | 39 Ų | 39 | 36.4 Ų | 36.4 | 27% | 0.273 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -58.5 | -49.5 | 177.1 | -179.4 | 0 | 0 | 0 | 0 | 111.8 | T361 W407 V408 G409 A415 | T361-S411 WeakPolarHBondContact CG2-OG 3.4Å; T361-S411 PolarHBondContact OG1-O 2.49Å; T361-S411 VanDerWaalsContact OG1-O 3.04Å; W407-S411 WeakPolarHBondContact O-CB 3.49Å; W407-S411 PolarHBondContact O-N 3.49Å; V408-S411 WeakPolarHBondContact O-CB 3.37Å; V408-S411 PolarHBondContact O-N 2.99Å; G409-S411 PolarHBondContact O-N 3.2Å; S411-A415 WeakPolarHBondContact O-CB 3.23Å; S411-A415 PolarHBondContact O-N 3.04Å |
| 412 | L | 96.8 | Very high | 93.3 | Very high | 59 Ų | 59 | 30.7 Ų | 30.7 | 31% | 0.309 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -68 | -39 | -179 | -176.8 | 62 | 0 | 0 | 0 | 111.6 | L391 V408 G409 A415 S416 | L391-L412 HydrophobicContact CD2-CD2 4.28Å; L391-L412 HydrophobicContact CG-CD2 4.38Å; V408-L412 WeakPolarHBondContact O-CB 3.31Å; V408-L412 PolarHBondContact O-N 3.48Å; G409-L412 PolarHBondContact O-N 2.91Å; L412-A415 PolarHBondContact O-N 3.46Å; L412-S416 VanDerWaalsContact O-CB 3.26Å; L412-S416 WeakPolarHBondContact O-CB 3.33Å; L412-S416 PolarHBondContact O-N 3.43Å; L412-S416 PolarHBondContact O-OG 3.32Å |
| 413 | Y | 96.6 | Very high | 93.5 | Very high | 1 Ų | 1 | 25.6 Ų | 25.6 | 0% | 0.004 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.2 | -48.5 | 175.5 | -168.4 | -107.1 | 0 | 0 | 0 | 111 | Y332 F358 T389 S392 S393 G409 T410 A415 S416 M417 S474 | Y332-Y413 AromaticContact CD1-CD1 3.86Å; Y332-Y413 HydrophobicContact CD1-CD1 3.86Å; Y332-Y413 HydrophobicContact CD1-CE1 4.04Å; Y332-Y413 AromaticContact CD2-CD1 3.93Å; Y332-Y413 HydrophobicContact CD2-CD1 3.93Å; Y332-Y413 AromaticContact CD2-CE1 3.62Å; Y332-Y413 HydrophobicContact CD2-CE1 3.62Å; Y332-Y413 HydrophobicContact CE1-CD1 4.06Å; Y332-Y413 HydrophobicContact CE2-CD1 4.12Å; Y332-Y413 HydrophobicContact CE2-CE1 4.22Å; Y332-Y413 AromaticContact CG-CD1 3.78Å; Y332-Y413 HydrophobicContact CG-CD1 3.78Å; Y332-Y413 AromaticContact CG-CE1 3.5Å; Y332-Y413 HydrophobicContact CG-CE1 3.5Å; Y332-Y413 VanDerWaalsContact CG-CE1 3.5Å; F358-Y413 HydrophobicContact CD2-CD1 4.33Å; F358-Y413 AromaticContact CE2-CD1 3.81Å; F358-Y413 HydrophobicContact CE2-CD1 3.81Å; F358-Y413 HydrophobicContact CE2-CE1 4.29Å; T389-Y413 HydrophobicContact CG2-CD2 4.09Å; T389-Y413 HydrophobicContact CG2-CE2 3.6Å; S392-Y413 WeakPolarHBondContact OG-CA 3.31Å; S392-Y413 WeakPolarHBondContact OG-CD2 3.22Å; S393-Y413 VanDerWaalsContact OG-CE2 3.23Å; S393-Y413 WeakPolarHBondContact OG-CE2 3.39Å; G409-Y413 VanDerWaalsContact O-CB 3.22Å; G409-Y413 WeakPolarHBondContact O-CB 3.42Å; G409-Y413 PolarHBondContact O-N 2.72Å; T410-Y413 PolarHBondContact O-N 2.84Å; Y413-A415 PolarHBondContact O-N 3.36Å; Y413-S416 WeakPolarHBondContact CA-OG 3.34Å; Y413-S416 PolarHBondContact O-N 3.31Å; Y413-S416 PolarHBondContact O-OG 2.82Å; Y413-M417 HydrophobicContact CD1-CG 4.43Å; Y413-M417 HydrophobicContact CE1-CE 3.96Å; Y413-M417 HydrophobicContact CE1-CG 4.23Å; Y413-M417 HydrophobicContact CE2-CE 3.8Å; Y413-M417 WeakPolarHBondContact O-CB 3.26Å; Y413-M417 WeakPolarHBondContact O-CG 3.37Å; Y413-M417 PolarHBondContact O-N 3.34Å; Y413-M417 WeakPolarHBondContact OH-CE 3.48Å; Y413-S474 WeakPolarHBondContact OH-CB 3.33Å |
| 414 | G | 94.5 | Very high | 93.6 | Very high | 0 Ų | 0 | 21.8 Ų | 21.8 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.7 | -45.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | F362 T410 M417 A418 | F362-G414 WeakPolarHBondContact CA-O 3.23Å; F362-G414 WeakPolarHBondContact CB-O 3.32Å; F362-G414 WeakPolarHBondContact CD2-O 3.38Å; T410-G414 PolarHBondContact O-N 3.18Å; G414-M417 PolarHBondContact O-N 3.37Å; G414-A418 PolarHBondContact O-N 3.25Å |
| 415 | A | 95.4 | Very high | 93.7 | Very high | 24 Ų | 24 | 18.3 Ų | 18.3 | 20% | 0.198 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -63 | -44.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | T365 S411 L412 Y413 A418 | T365-A415 HydrophobicContact CG2-CB 4.42Å; T365-A415 WeakPolarHBondContact CG2-O 3.34Å; T365-A415 WeakPolarHBondContact OG1-CB 3.03Å; S411-A415 WeakPolarHBondContact O-CB 3.23Å; S411-A415 PolarHBondContact O-N 3.04Å; L412-A415 PolarHBondContact O-N 3.46Å; Y413-A415 PolarHBondContact O-N 3.36Å; A415-A418 WeakPolarHBondContact O-CB 3.02Å; A415-A418 PolarHBondContact O-N 3.34Å |
| 416 | S | 95.8 | Very high | 93.6 | Very high | 9 Ų | 9 | 16.8 Ų | 16.8 | 6% | 0.063 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -72 | -27.4 | -177.9 | 59.3 | 0 | 0 | 0 | 0 | 113.7 | C385 T389 L412 Y413 A418 | C385-S416 WeakPolarHBondContact CB-O 3.09Å; C385-S416 WeakPolarHBondContact O-CB 3.45Å; C385-S416 PolarHBondContact SG-O 3.01Å; C385-S416 VanDerWaalsContact SG-O 3.35Å; T389-S416 WeakPolarHBondContact CA-OG 3.43Å; T389-S416 PolarHBondContact N-OG 2.98Å; T389-S416 PolarHBondContact OG1-OG 3.27Å; L412-S416 VanDerWaalsContact O-CB 3.26Å; L412-S416 WeakPolarHBondContact O-CB 3.33Å; L412-S416 PolarHBondContact O-N 3.43Å; L412-S416 PolarHBondContact O-OG 3.32Å; Y413-S416 WeakPolarHBondContact CA-OG 3.34Å; Y413-S416 PolarHBondContact O-N 3.31Å; Y413-S416 PolarHBondContact O-OG 2.82Å; S416-A418 VanDerWaalsContact C-N 3.32Å |
| 417 | M | 93.2 | Very high | 93.6 | Very high | 4 Ų | 4 | 16.8 Ų | 16.8 | 2% | 0.02 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -76.5 | -14.7 | 173.1 | -73.3 | -71.1 | -151.4 | 0 | 0 | 112.9 | Y325 A328 F362 T389 Y413 G414 T419 | Y325-M417 HydrophobicContact CD2-CE 4.4Å; Y325-M417 HydrophobicContact CD2-SD 3.42Å; Y325-M417 WeakPolarHBondContact CD2-SD 3.47Å; Y325-M417 HydrophobicContact CE2-CB 4.27Å; Y325-M417 HydrophobicContact CE2-CG 4.46Å; Y325-M417 WeakPolarHBondContact CE2-O 3.38Å; Y325-M417 HydrophobicContact CE2-SD 3.31Å; Y325-M417 WeakPolarHBondContact CE2-SD 3.44Å; Y325-M417 PolarHBondContact OH-O 2.84Å; A328-M417 HydrophobicContact CB-CE 3.93Å; F362-M417 HydrophobicContact CD2-CB 4.16Å; F362-M417 HydrophobicContact CE2-CB 4.1Å; T389-M417 HydrophobicContact CG2-CE 3.79Å; T389-M417 HydrophobicContact CG2-SD 4.03Å; Y413-M417 HydrophobicContact CD1-CG 4.43Å; Y413-M417 HydrophobicContact CE1-CE 3.96Å; Y413-M417 HydrophobicContact CE1-CG 4.23Å; Y413-M417 HydrophobicContact CE2-CE 3.8Å; Y413-M417 WeakPolarHBondContact O-CB 3.26Å; Y413-M417 WeakPolarHBondContact O-CG 3.37Å; Y413-M417 PolarHBondContact O-N 3.34Å; Y413-M417 WeakPolarHBondContact OH-CE 3.48Å; G414-M417 PolarHBondContact O-N 3.37Å; M417-T419 PolarHBondContact O-N 2.99Å |
| 418 | A | 91.1 | Very high | 93.3 | Very high | 0 Ų | 0 | 12.9 Ų | 12.9 | 0% | 0 | 8% | 0.08 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | -34.8 | -164.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | F362 T365 R366 G414 A415 S416 | F362-A418 HydrophobicContact CD2-CB 4.1Å; F362-A418 HydrophobicContact CE2-CB 4.5Å; F362-A418 HydrophobicContact CG-CB 4.3Å; F362-A418 VanDerWaalsContact O-CB 3.31Å; F362-A418 WeakPolarHBondContact O-CB 3.29Å; T365-A418 HydrophobicContact CG2-CB 4.02Å; R366-A418 HydrophobicContact CB-CB 4.33Å; R366-A418 VanDerWaalsContact CZ-O 3.29Å; R366-A418 PolarHBondContact NE-O 3.4Å; R366-A418 PolarHBondContact NH2-O 3.35Å; G414-A418 PolarHBondContact O-N 3.25Å; A415-A418 WeakPolarHBondContact O-CB 3.02Å; A415-A418 PolarHBondContact O-N 3.34Å; S416-A418 VanDerWaalsContact C-N 3.32Å |
| 419 | T | 92.5 | Very high | 92.9 | Very high | 6 Ų | 6 | 10.5 Ų | 10.5 | 4% | 0.037 | 6% | 0.062 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -115.4 | -4.2 | -163.5 | 81.4 | 0 | 0 | 0 | 0 | 114.5 | A369 M381 C385 M417 F421 P422 S423 | A369-T419 HydrophobicContact CB-CG2 3.3Å; M381-T419 HydrophobicContact CE-CG2 4.32Å; C385-T419 PolarHBondContact SG-OG1 2.75Å; M417-T419 PolarHBondContact O-N 2.99Å; T419-F421 PolarHBondContact O-N 3.32Å; T419-P422 WeakPolarHBondContact O-CD 3.31Å; T419-P422 WeakPolarHBondContact O-CG 3.35Å; T419-S423 WeakPolarHBondContact O-CB 3.48Å; T419-S423 PolarHBondContact O-N 2.92Å; T419-S423 PolarHBondContact O-OG 3.48Å |
| 420 | T | 93.5 | Very high | 92.4 | Very high | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -66.1 | -42 | -171.4 | -47.3 | 0 | 0 | 0 | 0 | 112.2 | F321 Y325 I382 C385 G424 | F321-T420 HydrophobicContact CE1-CG2 3.69Å; F321-T420 HydrophobicContact CZ-CG2 3.68Å; Y325-T420 HydrophobicContact CD2-CG2 4.02Å; Y325-T420 HydrophobicContact CE2-CG2 3.98Å; Y325-T420 WeakPolarHBondContact CE2-OG1 3.37Å; Y325-T420 HydrophobicContact CG-CG2 4.47Å; I382-T420 HydrophobicContact CG2-CG2 4.4Å; C385-T420 WeakPolarHBondContact CB-OG1 3.35Å; T420-G424 WeakPolarHBondContact O-CA 3.4Å; T420-G424 PolarHBondContact O-N 3.08Å |
| 421 | F | 91.6 | Very high | 91.9 | Very high | 19 Ų | 19 | 15.5 Ų | 15.5 | 8% | 0.083 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -59.4 | -61.9 | 176.2 | -168.4 | -92.3 | 0 | 0 | 0 | 113.4 | H208 F322 Y325 V326 T419 S423 G424 I425 A446 | H208-F421 AromaticContact CE1-CD1 3.42Å; H208-F421 VanDerWaalsContact CE1-CD1 3.42Å; H208-F421 WeakPolarHBondContact CE1-CD1 3.3Å; H208-F421 AromaticContact CE1-CE1 3.36Å; H208-F421 WeakPolarHBondContact CE1-CE1 3.44Å; H208-F421 AromaticContact NE2-CD1 3.62Å; H208-F421 AromaticContact NE2-CE1 3.66Å; F322-F421 AromaticContact CD1-CD2 3.62Å; F322-F421 HydrophobicContact CD1-CD2 3.62Å; F322-F421 HydrophobicContact CD1-CE2 4.17Å; F322-F421 HydrophobicContact CE1-CB 4.39Å; F322-F421 AromaticContact CE1-CD2 3.77Å; F322-F421 HydrophobicContact CE1-CD2 3.77Å; F322-F421 HydrophobicContact CE1-CE2 4.44Å; F322-F421 HydrophobicContact CE1-CG 4.34Å; F322-F421 HydrophobicContact CG-CD2 4.1Å; F322-F421 HydrophobicContact CG-CE2 4.19Å; F322-F421 HydrophobicContact CZ-CD2 4.26Å; Y325-F421 HydrophobicContact CE1-CB 3.84Å; Y325-F421 PolarHBondContact OH-N 2.97Å; V326-F421 HydrophobicContact CG2-CD2 4.02Å; V326-F421 HydrophobicContact CG2-CE2 4.45Å; T419-F421 PolarHBondContact O-N 3.32Å; F421-S423 VanDerWaalsContact C-N 3.32Å; F421-S423 PolarHBondContact O-N 3.46Å; F421-G424 PolarHBondContact O-N 3.09Å; F421-G424 VanDerWaalsContact O-N 3.15Å; F421-I425 HydrophobicContact CD1-CD1 4.07Å; F421-I425 HydrophobicContact CE1-CD1 3.54Å; F421-I425 HydrophobicContact CZ-CD1 4Å; F421-I425 PolarHBondContact O-N 3.11Å; F421-A446 HydrophobicContact CE2-CB 3.9Å |
| 422 | P | 90.8 | Very high | 91.2 | Very high | 1 Ų | 1 | 13.7 Ų | 13.7 | 1% | 0.006 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -59.6 | -40.5 | 178.7 | 18.2 | -29.9 | 0 | 0 | 0 | 112.8 | M204 H208 T419 G424 I425 S426 | M204-P422 HydrophobicContact CG-CB 3.82Å; H208-P422 HydrophobicContact CB-CG 4.42Å; T419-P422 WeakPolarHBondContact O-CD 3.31Å; T419-P422 WeakPolarHBondContact O-CG 3.35Å; P422-G424 VanDerWaalsContact C-N 3.33Å; P422-G424 PolarHBondContact O-N 2.78Å; P422-I425 PolarHBondContact O-N 2.94Å; P422-S426 PolarHBondContact O-N 3.46Å; P422-S426 VanDerWaalsContact O-N 3.09Å; P422-S426 PolarHBondContact O-OG 2.72Å |
| 423 | S | 92.5 | Very high | 90.5 | Very high | 2 Ų | 2 | 13.4 Ų | 13.4 | 1% | 0.014 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -68.1 | -33.4 | 178.9 | -52.2 | 0 | 0 | 0 | 0 | 112 | Q205 T419 F421 S426 W427 | Q205-S423 PolarHBondContact NE2-OG 2.97Å; Q205-S423 VanDerWaalsContact NE2-OG 3.07Å; T419-S423 WeakPolarHBondContact O-CB 3.48Å; T419-S423 PolarHBondContact O-N 2.92Å; T419-S423 PolarHBondContact O-OG 3.48Å; F421-S423 VanDerWaalsContact C-N 3.32Å; F421-S423 PolarHBondContact O-N 3.46Å; S423-S426 PolarHBondContact O-N 2.81Å; S423-W427 WeakPolarHBondContact O-CB 3.41Å; S423-W427 PolarHBondContact O-N 2.92Å |
| 424 | G | 91.5 | Very high | 89.9 | Confident | 2 Ų | 2 | 14 Ų | 14 | 2% | 0.021 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -64.9 | -39.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | T420 F421 P422 W427 L428 | T420-G424 WeakPolarHBondContact O-CA 3.4Å; T420-G424 PolarHBondContact O-N 3.08Å; F421-G424 PolarHBondContact O-N 3.09Å; F421-G424 VanDerWaalsContact O-N 3.15Å; P422-G424 VanDerWaalsContact C-N 3.33Å; P422-G424 PolarHBondContact O-N 2.78Å; G424-W427 PolarHBondContact O-N 3.17Å; G424-L428 WeakPolarHBondContact O-CB 3.26Å; G424-L428 PolarHBondContact O-N 3.46Å |
| 425 | I | 90.7 | Very high | 89.6 | Confident | 1 Ų | 1 | 16.3 Ų | 16.3 | 1% | 0.005 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -67 | -48.5 | 174.2 | -59.1 | 177.5 | 0 | 0 | 0 | 110.7 | N189 L193 M204 F421 P422 W427 L428 E429 F442 | N189-I425 HydrophobicContact CB-CD1 4.34Å; L193-I425 HydrophobicContact CD1-CG2 3.66Å; L193-I425 HydrophobicContact CD2-CG2 4.2Å; L193-I425 HydrophobicContact CG-CG2 4.38Å; M204-I425 HydrophobicContact CE-CB 4.35Å; M204-I425 HydrophobicContact CE-CG2 3.73Å; F421-I425 HydrophobicContact CD1-CD1 4.07Å; F421-I425 HydrophobicContact CE1-CD1 3.54Å; F421-I425 HydrophobicContact CZ-CD1 4Å; F421-I425 PolarHBondContact O-N 3.11Å; P422-I425 PolarHBondContact O-N 2.94Å; I425-W427 VanDerWaalsContact C-N 3.28Å; I425-W427 PolarHBondContact O-N 3.37Å; I425-L428 WeakPolarHBondContact O-CB 3.2Å; I425-L428 PolarHBondContact O-N 2.92Å; I425-E429 PolarHBondContact O-N 3.28Å; I425-F442 HydrophobicContact CB-CZ 4.47Å; I425-F442 HydrophobicContact CD1-CD2 4.39Å; I425-F442 HydrophobicContact CD1-CE2 3.49Å; I425-F442 VanDerWaalsContact CD1-CE2 3.49Å; I425-F442 HydrophobicContact CD1-CZ 3.89Å; I425-F442 HydrophobicContact CG1-CD2 4.39Å; I425-F442 HydrophobicContact CG1-CE2 3.67Å; I425-F442 HydrophobicContact CG1-CZ 3.75Å; I425-F442 HydrophobicContact CG2-CZ 4.03Å |
| 426 | S | 89.5 | Confident | 89 | Confident | 5 Ų | 5 | 15.3 Ų | 15.3 | 4% | 0.035 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -64.5 | -31.7 | 176.8 | -65.8 | 0 | 0 | 0 | 0 | 113 | P422 S423 Q430 | P422-S426 PolarHBondContact O-N 3.46Å; P422-S426 VanDerWaalsContact O-N 3.09Å; P422-S426 PolarHBondContact O-OG 2.72Å; S423-S426 PolarHBondContact O-N 2.81Å; S426-Q430 WeakPolarHBondContact O-CG 3.28Å |
| 427 | W | 92.1 | Very high | 88.6 | Confident | 1 Ų | 1 | 19 Ų | 19 | 0% | 0.004 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -67.5 | -43.3 | 173.9 | 175.2 | 79.9 | 0 | 0 | 0 | 111.1 | L314 P378 I382 S423 G424 I425 E429 Q430 Y431 F485 M488 Y489 A492 | L314-W427 HydrophobicContact CD1-CH2 4.44Å; P378-W427 HydrophobicContact CB-CB 3.97Å; I382-W427 HydrophobicContact CD1-CB 3.75Å; I382-W427 HydrophobicContact CD1-CG 4.01Å; S423-W427 WeakPolarHBondContact O-CB 3.41Å; S423-W427 PolarHBondContact O-N 2.92Å; G424-W427 PolarHBondContact O-N 3.17Å; I425-W427 VanDerWaalsContact C-N 3.28Å; I425-W427 PolarHBondContact O-N 3.37Å; W427-E429 VanDerWaalsContact C-N 3.33Å; W427-E429 PolarHBondContact O-N 2.9Å; W427-Q430 WeakPolarHBondContact O-CB 3.3Å; W427-Q430 PolarHBondContact O-N 2.99Å; W427-Y431 AromaticContact CD1-CE2 3.82Å; W427-Y431 HydrophobicContact CD2-CD2 4.43Å; W427-Y431 HydrophobicContact CD2-CE2 4.23Å; W427-Y431 AromaticContact CE2-CE2 3.55Å; W427-Y431 HydrophobicContact CG-CE2 4.37Å; W427-Y431 HydrophobicContact CZ2-CD2 4.15Å; W427-Y431 AromaticContact CZ2-CE2 3.88Å; W427-Y431 HydrophobicContact CZ2-CE2 3.88Å; W427-Y431 AromaticContact NE1-CE2 3.31Å; W427-Y431 VanDerWaalsContact NE1-CE2 3.31Å; W427-Y431 VanDerWaalsContact O-CD2 3.27Å; W427-Y431 WeakPolarHBondContact O-CD2 3.47Å; W427-F485 HydrophobicContact CD2-CE2 4.36Å; W427-M488 HydrophobicContact CE3-CE 4.37Å; W427-M488 HydrophobicContact CH2-CB 3.94Å; W427-M488 HydrophobicContact CH2-CE 4.22Å; W427-M488 HydrophobicContact CZ3-CB 4.4Å; W427-M488 HydrophobicContact CZ3-CE 3.65Å; W427-Y489 HydrophobicContact CZ2-CD2 4.16Å; W427-A492 HydrophobicContact CH2-CB 3.98Å; W427-A492 HydrophobicContact CZ2-CB 4.03Å |
| 428 | L | 89.2 | Confident | 88.4 | Confident | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -57.8 | -45 | 177 | 176.1 | 63.7 | 0 | 0 | 0 | 112 | L314 L318 G424 I425 Q430 Y431 T432 V434 F442 | L314-L428 HydrophobicContact CD2-CD1 3.07Å; L318-L428 HydrophobicContact CD1-CB 4.12Å; L318-L428 HydrophobicContact CD1-CD1 3.64Å; L318-L428 HydrophobicContact CD1-CD2 3.66Å; L318-L428 HydrophobicContact CD1-CG 4.02Å; G424-L428 WeakPolarHBondContact O-CB 3.26Å; G424-L428 PolarHBondContact O-N 3.46Å; I425-L428 WeakPolarHBondContact O-CB 3.2Å; I425-L428 PolarHBondContact O-N 2.92Å; L428-Q430 PolarHBondContact O-N 3.42Å; L428-Q430 VanDerWaalsContact O-N 3.09Å; L428-Y431 PolarHBondContact O-N 3.49Å; L428-T432 HydrophobicContact CD1-CG2 3.38Å; L428-T432 HydrophobicContact CG-CG2 3.89Å; L428-T432 PolarHBondContact O-N 2.97Å; L428-V434 HydrophobicContact CB-CG2 4.35Å; L428-V434 HydrophobicContact CD2-CG2 3.75Å; L428-V434 HydrophobicContact CG-CG2 3.82Å; L428-F442 HydrophobicContact CD2-CD1 4.22Å; L428-F442 HydrophobicContact CD2-CE1 3.9Å |
| 429 | E | 87.1 | Confident | 88.3 | Confident | 46 Ų | 46 | 19.2 Ų | 19.2 | 22% | 0.215 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -55.2 | -28.8 | -179.3 | -169.7 | -174.5 | -164.4 | 0 | 0 | 112.9 | L193 S200 I425 W427 Y431 T432 V434 | L193-E429 HydrophobicContact CD2-CB 4.31Å; L193-E429 HydrophobicContact CD2-CG 4.39Å; L193-E429 WeakPolarHBondContact CD2-OE2 3.07Å; S200-E429 PolarHBondContact OG-OE2 2.84Å; I425-E429 PolarHBondContact O-N 3.28Å; W427-E429 VanDerWaalsContact C-N 3.33Å; W427-E429 PolarHBondContact O-N 2.9Å; E429-Y431 VanDerWaalsContact C-N 3.33Å; E429-Y431 PolarHBondContact O-N 3.09Å; E429-T432 CarbonylContact C-O 3.58Å; E429-T432 VanDerWaalsContact CA-O 3.31Å; E429-T432 WeakPolarHBondContact CA-O 3.48Å; E429-V434 HydrophobicContact CB-CG2 4.17Å |
| 430 | Q | 85.4 | Confident | 88.2 | Confident | 63 Ų | 63 | 19.1 Ų | 19.1 | 29% | 0.294 | 10% | 0.098 | S | C | . | . | H | α-helix | trans | -72.3 | -27.2 | -178.7 | -64.1 | 170 | -30.8 | 0 | 0 | 113.1 | Y377 S426 W427 L428 | Y377-Q430 PolarHBondContact OH-NE2 3.44Å; Y377-Q430 PolarHBondContact OH-OE1 3.43Å; S426-Q430 WeakPolarHBondContact O-CG 3.28Å; W427-Q430 WeakPolarHBondContact O-CB 3.3Å; W427-Q430 PolarHBondContact O-N 2.99Å; L428-Q430 PolarHBondContact O-N 3.42Å; L428-Q430 VanDerWaalsContact O-N 3.09Å |
| 431 | Y | 83.4 | Confident | 88.2 | Confident | 43 Ų | 43 | 20.3 Ų | 20.3 | 17% | 0.169 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -106.4 | -26.6 | -177.8 | -60.8 | -85.4 | 0 | 0 | 0 | 112.5 | W427 L428 E429 Y489 A492 T493 | W427-Y431 AromaticContact CD1-CE2 3.82Å; W427-Y431 HydrophobicContact CD2-CD2 4.43Å; W427-Y431 HydrophobicContact CD2-CE2 4.23Å; W427-Y431 AromaticContact CE2-CE2 3.55Å; W427-Y431 HydrophobicContact CG-CE2 4.37Å; W427-Y431 HydrophobicContact CZ2-CD2 4.15Å; W427-Y431 AromaticContact CZ2-CE2 3.88Å; W427-Y431 HydrophobicContact CZ2-CE2 3.88Å; W427-Y431 AromaticContact NE1-CE2 3.31Å; W427-Y431 VanDerWaalsContact NE1-CE2 3.31Å; W427-Y431 VanDerWaalsContact O-CD2 3.27Å; W427-Y431 WeakPolarHBondContact O-CD2 3.47Å; L428-Y431 PolarHBondContact O-N 3.49Å; E429-Y431 VanDerWaalsContact C-N 3.33Å; E429-Y431 PolarHBondContact O-N 3.09Å; Y431-Y489 WeakPolarHBondContact OH-CE2 3.36Å; Y431-A492 HydrophobicContact CD1-CB 3.76Å; Y431-A492 HydrophobicContact CD2-CB 4.21Å; Y431-A492 HydrophobicContact CE1-CB 4.17Å; Y431-A492 HydrophobicContact CG-CB 3.78Å; Y431-T493 HydrophobicContact CE1-CG2 3.83Å |
| 432 | T | 82.6 | Confident | 88.2 | Confident | 2 Ų | 2 | 19.5 Ų | 19.5 | 1% | 0.012 | 11% | 0.105 | C | C | . | . | S | Bend | trans | -149.1 | 155.8 | 178.8 | -155.2 | 0 | 0 | 0 | 0 | 113.7 | K306 H311 L428 E429 V434 | K306-T432 WeakPolarHBondContact O-CA 3.43Å; K306-T432 PolarHBondContact O-OG1 2.81Å; H311-T432 PolarHBondContact CE1-OG1 3.02Å; H311-T432 WeakPolarHBondContact ND1-CG2 3.27Å; H311-T432 PolarHBondContact ND1-OG1 2.84Å; L428-T432 HydrophobicContact CD1-CG2 3.38Å; L428-T432 HydrophobicContact CG-CG2 3.89Å; L428-T432 PolarHBondContact O-N 2.97Å; E429-T432 CarbonylContact C-O 3.58Å; E429-T432 VanDerWaalsContact CA-O 3.31Å; E429-T432 WeakPolarHBondContact CA-O 3.48Å; T432-V434 PolarHBondContact O-N 3.03Å |
| 433 | T | 82.4 | Confident | 88.2 | Confident | 53 Ų | 53 | 19.5 Ų | 19.5 | 33% | 0.325 | 11% | 0.105 | S | C | . | . | trans | -68.6 | 121.2 | 174.3 | 50.6 | 0 | 0 | 0 | 0 | 110.2 | P305 K306 T435 | P305-T433 HydrophobicContact CB-CG2 3.93Å; K306-T433 PolarHBondContact O-N 3.39Å; T433-T435 PolarHBondContact O-N 3.42Å | ||
| 434 | V | 84 | Confident | 88.3 | Confident | 12 Ų | 12 | 20.1 Ų | 20.1 | 7% | 0.073 | 11% | 0.108 | C | C | . | . | trans | -82.9 | 109.2 | 173.9 | -174.1 | 0 | 0 | 0 | 0 | 108.4 | V190 L193 L428 E429 T432 T438 A439 F442 | V190-V434 HydrophobicContact CG2-CG1 4.37Å; L193-V434 HydrophobicContact CD1-CB 3.78Å; L193-V434 HydrophobicContact CD1-CG1 3.86Å; L193-V434 HydrophobicContact CD1-CG2 4.02Å; L428-V434 HydrophobicContact CB-CG2 4.35Å; L428-V434 HydrophobicContact CD2-CG2 3.75Å; L428-V434 HydrophobicContact CG-CG2 3.82Å; E429-V434 HydrophobicContact CB-CG2 4.17Å; T432-V434 PolarHBondContact O-N 3.03Å; V434-T438 WeakPolarHBondContact CA-OG1 3.46Å; V434-A439 HydrophobicContact CG1-CB 4.19Å; V434-F442 HydrophobicContact CG1-CE1 4.12Å; V434-F442 HydrophobicContact CG1-CZ 4.32Å | ||
| 435 | T | 86.8 | Confident | 88.4 | Confident | 50 Ų | 50 | 20 Ų | 20 | 31% | 0.307 | 11% | 0.107 | S | C | . | . | trans | -98.2 | 176.2 | 175.9 | 72.3 | 0 | 0 | 0 | 0 | 110.3 | E139 T433 H437 T438 A439 | E139-T435 VanDerWaalsContact OE1-CB 3.27Å; E139-T435 WeakPolarHBondContact OE1-CB 3.36Å; E139-T435 PolarHBondContact OE1-OG1 3.34Å; T433-T435 PolarHBondContact O-N 3.42Å; T435-H437 VanDerWaalsContact C-N 3.27Å; T435-H437 PolarHBondContact O-N 2.95Å; T435-T438 PolarHBondContact N-OG1 3.14Å; T435-T438 PolarHBondContact O-N 3.43Å; T435-T438 PolarHBondContact O-OG1 3.41Å; T435-A439 WeakPolarHBondContact O-CB 3.31Å; T435-A439 PolarHBondContact O-N 3.09Å | ||
| 436 | G | 83.6 | Confident | 88.6 | Confident | 2 Ų | 2 | 20.3 Ų | 20.3 | 2% | 0.021 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -58.8 | -41.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | G135 E139 A439 A440 | G135-G436 WeakPolarHBondContact CA-O 2.97Å; G135-G436 WeakPolarHBondContact O-CA 3.37Å; E139-G436 PolarHBondContact OE1-N 3.18Å; G436-A439 PolarHBondContact O-N 3.08Å; G436-A440 WeakPolarHBondContact O-CB 3.45Å; G436-A440 PolarHBondContact O-N 2.91Å |
| 437 | H | 86.9 | Confident | 88.7 | Confident | 88 Ų | 88 | 20.4 Ų | 20.4 | 41% | 0.407 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -64.8 | -42.5 | 178.6 | -65.9 | 88 | 0 | 0 | 0 | 113.3 | I136 E139 T435 A440 A441 | I136-H437 WeakPolarHBondContact CG1-NE2 3.41Å; E139-H437 VanDerWaalsContact CD-CE1 3.41Å; E139-H437 IonicContact OE1-CE1 3.34Å; E139-H437 IonicContact OE1-CG 2.75Å; E139-H437 IonicContact OE1-ND1 2.84Å; E139-H437 PolarHBondContact OE1-ND1 3.46Å; E139-H437 IonicContact OE2-CE1 3.5Å; E139-H437 PolarHBondContact OE2-CE1 3.3Å; E139-H437 IonicContact OE2-ND1 3.57Å; E139-H437 PolarHBondContact OE2-ND1 3.01Å; T435-H437 VanDerWaalsContact C-N 3.27Å; T435-H437 PolarHBondContact O-N 2.95Å; H437-A440 PolarHBondContact O-N 3.48Å; H437-A441 PolarHBondContact O-N 3.44Å; H437-A441 VanDerWaalsContact O-N 3.09Å |
| 438 | T | 88.5 | Confident | 88.7 | Confident | 8 Ų | 8 | 22.1 Ų | 22.1 | 5% | 0.049 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -71.7 | -36.2 | -179.3 | 64.4 | 0 | 0 | 0 | 0 | 111.1 | H311 V315 V434 T435 A441 F442 | H311-T438 WeakPolarHBondContact NE2-CG2 3.46Å; V315-T438 HydrophobicContact CG2-CG2 4.03Å; V434-T438 WeakPolarHBondContact CA-OG1 3.46Å; T435-T438 PolarHBondContact N-OG1 3.14Å; T435-T438 PolarHBondContact O-N 3.43Å; T435-T438 PolarHBondContact O-OG1 3.41Å; T438-A441 PolarHBondContact O-N 2.97Å; T438-F442 WeakPolarHBondContact O-CD1 3.49Å; T438-F442 WeakPolarHBondContact O-CE1 3.49Å; T438-F442 PolarHBondContact O-N 3.36Å |
| 439 | A | 89.1 | Confident | 88.9 | Confident | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -62.3 | -45.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | T186 V190 V434 T435 G436 A441 F442 V443 | T186-A439 HydrophobicContact CG2-CB 3.92Å; V190-A439 HydrophobicContact CG2-CB 3.3Å; V434-A439 HydrophobicContact CG1-CB 4.19Å; T435-A439 WeakPolarHBondContact O-CB 3.31Å; T435-A439 PolarHBondContact O-N 3.09Å; G436-A439 PolarHBondContact O-N 3.08Å; A439-A441 VanDerWaalsContact C-N 3.28Å; A439-A441 PolarHBondContact O-N 3.43Å; A439-F442 VanDerWaalsContact CA-CZ 3.41Å; A439-F442 HydrophobicContact CB-CE1 4.18Å; A439-F442 HydrophobicContact CB-CE2 4.36Å; A439-F442 HydrophobicContact CB-CZ 3.8Å; A439-F442 WeakPolarHBondContact O-CD2 3.42Å; A439-F442 PolarHBondContact O-N 3.19Å; A439-V443 WeakPolarHBondContact O-CB 3.34Å; A439-V443 VanDerWaalsContact O-CG2 3.26Å; A439-V443 WeakPolarHBondContact O-CG2 3.49Å; A439-V443 PolarHBondContact O-N 3.29Å |
| 440 | A | 91.9 | Very high | 89 | Confident | 3 Ų | 3 | 24.2 Ų | 24.2 | 3% | 0.025 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -56.9 | -44.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | S131 T186 G436 H437 F442 V443 V444 | S131-A440 WeakPolarHBondContact O-CB 3.41Å; T186-A440 HydrophobicContact CG2-CB 3.99Å; G436-A440 WeakPolarHBondContact O-CB 3.45Å; G436-A440 PolarHBondContact O-N 2.91Å; H437-A440 PolarHBondContact O-N 3.48Å; A440-F442 PolarHBondContact O-N 3.4Å; A440-V443 PolarHBondContact O-N 3.45Å; A440-V444 WeakPolarHBondContact O-CB 3.46Å; A440-V444 WeakPolarHBondContact O-CG2 3.43Å; A440-V444 PolarHBondContact O-N 2.83Å |
| 441 | A | 92.1 | Very high | 89.2 | Confident | 25 Ų | 25 | 24.6 Ų | 24.6 | 21% | 0.207 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -57.8 | -52.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | V315 F319 H437 T438 A439 V444 G445 | V315-A441 HydrophobicContact CG1-CB 3.54Å; F319-A441 WeakPolarHBondContact CD2-O 3.38Å; H437-A441 PolarHBondContact O-N 3.44Å; H437-A441 VanDerWaalsContact O-N 3.09Å; T438-A441 PolarHBondContact O-N 2.97Å; A439-A441 VanDerWaalsContact C-N 3.28Å; A439-A441 PolarHBondContact O-N 3.43Å; A441-V444 PolarHBondContact O-N 3.06Å; A441-G445 PolarHBondContact O-N 3.04Å |
| 442 | F | 91.6 | Very high | 89.6 | Confident | 3 Ų | 3 | 25.7 Ų | 25.7 | 1% | 0.013 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -73.3 | -31.2 | -178.8 | 59.1 | -114.9 | 0 | 0 | 0 | 113.9 | F322 I425 L428 V434 T438 A439 A440 V444 G445 A446 | F322-F442 HydrophobicContact CD2-CB 3.64Å; F322-F442 HydrophobicContact CD2-CG 4.32Å; F322-F442 HydrophobicContact CE2-CB 3.95Å; F322-F442 HydrophobicContact CE2-CD2 4.31Å; F322-F442 HydrophobicContact CE2-CG 4.17Å; I425-F442 HydrophobicContact CB-CZ 4.47Å; I425-F442 HydrophobicContact CD1-CD2 4.39Å; I425-F442 HydrophobicContact CD1-CE2 3.49Å; I425-F442 VanDerWaalsContact CD1-CE2 3.49Å; I425-F442 HydrophobicContact CD1-CZ 3.89Å; I425-F442 HydrophobicContact CG1-CD2 4.39Å; I425-F442 HydrophobicContact CG1-CE2 3.67Å; I425-F442 HydrophobicContact CG1-CZ 3.75Å; I425-F442 HydrophobicContact CG2-CZ 4.03Å; L428-F442 HydrophobicContact CD2-CD1 4.22Å; L428-F442 HydrophobicContact CD2-CE1 3.9Å; V434-F442 HydrophobicContact CG1-CE1 4.12Å; V434-F442 HydrophobicContact CG1-CZ 4.32Å; T438-F442 WeakPolarHBondContact O-CD1 3.49Å; T438-F442 WeakPolarHBondContact O-CE1 3.49Å; T438-F442 PolarHBondContact O-N 3.36Å; A439-F442 VanDerWaalsContact CA-CZ 3.41Å; A439-F442 HydrophobicContact CB-CE1 4.18Å; A439-F442 HydrophobicContact CB-CE2 4.36Å; A439-F442 HydrophobicContact CB-CZ 3.8Å; A439-F442 WeakPolarHBondContact O-CD2 3.42Å; A439-F442 PolarHBondContact O-N 3.19Å; A440-F442 PolarHBondContact O-N 3.4Å; F442-V444 VanDerWaalsContact C-N 3.34Å; F442-G445 PolarHBondContact O-N 2.86Å; F442-A446 PolarHBondContact O-N 2.94Å |
| 443 | V | 91.6 | Very high | 90.1 | Very high | 1 Ų | 1 | 26.3 Ų | 26.3 | 1% | 0.006 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64.1 | -41.5 | 173.5 | 170 | 0 | 0 | 0 | 0 | 110.4 | Y127 S131 D185 A439 A440 G445 A446 A447 | Y127-V443 HydrophobicContact CE1-CG1 3.77Å; S131-V443 VanDerWaalsContact OG-CG1 3.28Å; S131-V443 WeakPolarHBondContact OG-CG1 3.36Å; D185-V443 VanDerWaalsContact OD2-CG1 3.24Å; D185-V443 WeakPolarHBondContact OD2-CG1 3.33Å; A439-V443 WeakPolarHBondContact O-CB 3.34Å; A439-V443 VanDerWaalsContact O-CG2 3.26Å; A439-V443 WeakPolarHBondContact O-CG2 3.49Å; A439-V443 PolarHBondContact O-N 3.29Å; A440-V443 PolarHBondContact O-N 3.45Å; V443-G445 VanDerWaalsContact C-N 3.34Å; V443-A446 WeakPolarHBondContact O-CB 3.28Å; V443-A446 PolarHBondContact O-N 3.17Å; V443-A447 WeakPolarHBondContact O-CB 3.36Å; V443-A447 PolarHBondContact O-N 2.92Å |
| 444 | V | 94.2 | Very high | 90.5 | Very high | 14 Ų | 14 | 24.5 Ų | 24.5 | 9% | 0.085 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -64.8 | -40.3 | 174.5 | 171.8 | 0 | 0 | 0 | 0 | 111 | I128 L132 F319 A440 A441 F442 A447 T448 | I128-V444 HydrophobicContact CG2-CG1 3.93Å; I128-V444 HydrophobicContact CG2-CG2 4.24Å; L132-V444 HydrophobicContact CD2-CG2 3.82Å; L132-V444 HydrophobicContact CG-CG2 3.88Å; F319-V444 HydrophobicContact CE2-CB 4.38Å; F319-V444 HydrophobicContact CE2-CG1 4.01Å; A440-V444 WeakPolarHBondContact O-CB 3.46Å; A440-V444 WeakPolarHBondContact O-CG2 3.43Å; A440-V444 PolarHBondContact O-N 2.83Å; A441-V444 PolarHBondContact O-N 3.06Å; F442-V444 VanDerWaalsContact C-N 3.34Å; V444-A447 PolarHBondContact O-N 2.93Å; V444-T448 VanDerWaalsContact O-CB 3.32Å; V444-T448 WeakPolarHBondContact O-CB 3.46Å; V444-T448 PolarHBondContact O-N 3.46Å; V444-T448 PolarHBondContact O-OG1 2.82Å |
| 445 | G | 94.3 | Very high | 90.8 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -55.8 | -51.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | F323 A441 F442 V443 T448 G449 | F323-G445 VanDerWaalsContact CA-O 3.23Å; F323-G445 WeakPolarHBondContact CA-O 3.41Å; F323-G445 WeakPolarHBondContact CB-O 3.32Å; A441-G445 PolarHBondContact O-N 3.04Å; F442-G445 PolarHBondContact O-N 2.86Å; V443-G445 VanDerWaalsContact C-N 3.34Å; G445-T448 PolarHBondContact O-N 3.42Å; G445-G449 PolarHBondContact O-N 3.18Å |
| 446 | A | 93.8 | Very high | 91 | Very high | 8 Ų | 8 | 28.3 Ų | 28.3 | 7% | 0.066 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -56.3 | -52.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | F322 V326 F421 F442 V443 T448 G449 E450 | F322-A446 HydrophobicContact CB-CB 4.21Å; V326-A446 HydrophobicContact CB-CB 4.03Å; V326-A446 HydrophobicContact CG1-CB 4.29Å; V326-A446 HydrophobicContact CG2-CB 3.59Å; F421-A446 HydrophobicContact CE2-CB 3.9Å; F442-A446 PolarHBondContact O-N 2.94Å; V443-A446 WeakPolarHBondContact O-CB 3.28Å; V443-A446 PolarHBondContact O-N 3.17Å; A446-T448 VanDerWaalsContact C-N 3.32Å; A446-T448 PolarHBondContact O-N 3.22Å; A446-G449 PolarHBondContact O-N 3.45Å; A446-G449 VanDerWaalsContact O-N 3.13Å; A446-E450 PolarHBondContact O-N 3.31Å |
| 447 | A | 91.6 | Very high | 91.3 | Very high | 7 Ų | 7 | 28.4 Ų | 28.4 | 6% | 0.058 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.2 | -39.4 | -179 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y127 I128 V443 V444 G449 E450 M451 | Y127-A447 HydrophobicContact CD1-CB 3.76Å; Y127-A447 HydrophobicContact CE1-CB 3.89Å; I128-A447 HydrophobicContact CG1-CB 4Å; V443-A447 WeakPolarHBondContact O-CB 3.36Å; V443-A447 PolarHBondContact O-N 2.92Å; V444-A447 PolarHBondContact O-N 2.93Å; A447-G449 VanDerWaalsContact C-N 3.33Å; A447-E450 PolarHBondContact O-N 3.03Å; A447-M451 WeakPolarHBondContact O-CG 3.37Å; A447-M451 PolarHBondContact O-N 3.33Å |
| 448 | T | 92.2 | Very high | 91.3 | Very high | 37 Ų | 37 | 25.6 Ų | 25.6 | 23% | 0.227 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -66.2 | -39.5 | 176.3 | -50.8 | 0 | 0 | 0 | 0 | 110.6 | F323 V444 G445 A446 M451 V452 | F323-T448 HydrophobicContact CD2-CG2 4.19Å; F323-T448 HydrophobicContact CE2-CG2 3.94Å; V444-T448 VanDerWaalsContact O-CB 3.32Å; V444-T448 WeakPolarHBondContact O-CB 3.46Å; V444-T448 PolarHBondContact O-N 3.46Å; V444-T448 PolarHBondContact O-OG1 2.82Å; G445-T448 PolarHBondContact O-N 3.42Å; A446-T448 VanDerWaalsContact C-N 3.32Å; A446-T448 PolarHBondContact O-N 3.22Å; T448-M451 PolarHBondContact O-N 2.89Å; T448-V452 HydrophobicContact CG2-CG2 4.11Å; T448-V452 WeakPolarHBondContact O-CB 3.45Å; T448-V452 VanDerWaalsContact O-CG2 3.26Å; T448-V452 WeakPolarHBondContact O-CG2 3.26Å; T448-V452 PolarHBondContact O-N 2.78Å |
| 449 | G | 93.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.7 | -48.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | F323 G327 G445 A446 A447 M451 V452 L453 | F323-G449 VanDerWaalsContact CD2-N 3.25Å; F323-G449 VanDerWaalsContact O-CA 3.29Å; F323-G449 WeakPolarHBondContact O-CA 3.47Å; G327-G449 WeakPolarHBondContact CA-O 3.35Å; G445-G449 PolarHBondContact O-N 3.18Å; A446-G449 PolarHBondContact O-N 3.45Å; A446-G449 VanDerWaalsContact O-N 3.13Å; A447-G449 VanDerWaalsContact C-N 3.33Å; G449-M451 PolarHBondContact O-N 3.45Å; G449-V452 PolarHBondContact O-N 2.82Å; G449-L453 PolarHBondContact O-N 3.02Å |
| 450 | E | 89.7 | Confident | 91.3 | Very high | 90 Ų | 90 | 34.2 Ų | 34.2 | 42% | 0.421 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -54.7 | -35.9 | 174.5 | 170.6 | 173.8 | -175.7 | 0 | 0 | 112.4 | V326 V330 A446 A447 P454 | V326-E450 HydrophobicContact CG1-CB 4.17Å; V330-E450 HydrophobicContact CB-CG 4.18Å; V330-E450 HydrophobicContact CG1-CG 4.03Å; V330-E450 HydrophobicContact CG2-CB 4.26Å; V330-E450 HydrophobicContact CG2-CG 3.89Å; A446-E450 PolarHBondContact O-N 3.31Å; A447-E450 PolarHBondContact O-N 3.03Å; E450-P454 WeakPolarHBondContact O-CD 3.29Å; E450-P454 WeakPolarHBondContact O-CG 3.24Å |
| 451 | M | 89 | Confident | 91.1 | Very high | 71 Ų | 71 | 36.2 Ų | 36.2 | 35% | 0.35 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -80.6 | -43.9 | 178.8 | -65.5 | 177.4 | 75.3 | 0 | 0 | 112.6 | A124 I128 A447 T448 G449 A455 | A124-M451 HydrophobicContact CB-CE 3.48Å; A124-M451 VanDerWaalsContact CB-CE 3.48Å; A124-M451 HydrophobicContact CB-CG 4.05Å; A124-M451 HydrophobicContact CB-SD 3.39Å; A124-M451 WeakPolarHBondContact CB-SD 3.19Å; I128-M451 HydrophobicContact CD1-SD 3.83Å; A447-M451 WeakPolarHBondContact O-CG 3.37Å; A447-M451 PolarHBondContact O-N 3.33Å; T448-M451 PolarHBondContact O-N 2.89Å; G449-M451 PolarHBondContact O-N 3.45Å; M451-A455 VanDerWaalsContact O-CB 3.24Å; M451-A455 WeakPolarHBondContact O-CB 3.4Å |
| 452 | V | 92.6 | Very high | 90.7 | Very high | 66 Ų | 66 | 38.2 Ų | 38.2 | 40% | 0.4 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -79.2 | -47.1 | -168.3 | 173.5 | 0 | 0 | 0 | 0 | 111.9 | F323 T448 G449 A455 L456 | F323-V452 HydrophobicContact CE2-CB 4.09Å; F323-V452 HydrophobicContact CE2-CG2 4.28Å; F323-V452 HydrophobicContact CZ-CB 4.02Å; F323-V452 HydrophobicContact CZ-CG1 4.01Å; T448-V452 HydrophobicContact CG2-CG2 4.11Å; T448-V452 WeakPolarHBondContact O-CB 3.45Å; T448-V452 VanDerWaalsContact O-CG2 3.26Å; T448-V452 WeakPolarHBondContact O-CG2 3.26Å; T448-V452 PolarHBondContact O-N 2.78Å; G449-V452 PolarHBondContact O-N 2.82Å; V452-A455 PolarHBondContact O-N 3.28Å; V452-L456 VanDerWaalsContact O-CB 3.28Å; V452-L456 WeakPolarHBondContact O-CB 3.3Å; V452-L456 PolarHBondContact O-N 2.67Å |
| 453 | L | 93.9 | Very high | 90.5 | Very high | 15 Ų | 15 | 42.3 Ų | 42.3 | 8% | 0.079 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -70 | -45 | -172 | -65.4 | -171.1 | 0 | 0 | 0 | 113.8 | F323 G449 L456 V457 L473 T477 | F323-L453 HydrophobicContact CE1-CD2 4.2Å; F323-L453 HydrophobicContact CE1-CG 4.34Å; F323-L453 HydrophobicContact CZ-CD2 4.42Å; G449-L453 PolarHBondContact O-N 3.02Å; L453-L456 PolarHBondContact O-N 2.95Å; L453-V457 WeakPolarHBondContact O-CG2 3.23Å; L453-V457 PolarHBondContact O-N 3.31Å; L453-L473 HydrophobicContact CB-CD2 4.2Å; L453-L473 HydrophobicContact CD2-CD1 4.22Å; L453-T477 HydrophobicContact CD1-CG2 3.88Å |
| 454 | P | 90.1 | Very high | 90.3 | Very high | 15 Ų | 15 | 47.7 Ų | 47.7 | 10% | 0.097 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.9 | -39.8 | 174.2 | -21.8 | 34.6 | 0 | 0 | 0 | 112.5 | V330 A331 F335 E450 L456 V457 G458 | V330-P454 HydrophobicContact CB-CG 4.26Å; V330-P454 HydrophobicContact CG1-CG 4.06Å; A331-P454 HydrophobicContact CB-CB 4.24Å; A331-P454 HydrophobicContact CB-CG 3.9Å; F335-P454 HydrophobicContact CE2-CB 3.98Å; F335-P454 VanDerWaalsContact CE2-O 3.26Å; F335-P454 WeakPolarHBondContact CE2-O 3.27Å; E450-P454 WeakPolarHBondContact O-CD 3.29Å; E450-P454 WeakPolarHBondContact O-CG 3.24Å; P454-L456 VanDerWaalsContact C-N 3.34Å; P454-L456 PolarHBondContact O-N 2.68Å; P454-V457 PolarHBondContact O-N 2.93Å; P454-G458 PolarHBondContact O-N 2.82Å |
| 455 | A | 89.2 | Confident | 89.6 | Confident | 64 Ų | 64 | 51.2 Ų | 51.2 | 53% | 0.529 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -63 | -42.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | M451 V452 G458 F459 | M451-A455 VanDerWaalsContact O-CB 3.24Å; M451-A455 WeakPolarHBondContact O-CB 3.4Å; V452-A455 PolarHBondContact O-N 3.28Å; A455-G458 PolarHBondContact O-N 3.1Å; A455-F459 WeakPolarHBondContact O-CB 3.45Å; A455-F459 PolarHBondContact O-N 3.46Å |
| 456 | L | 91.1 | Very high | 89 | Confident | 77 Ų | 77 | 59.9 Ų | 59.9 | 40% | 0.403 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 175.3 | 178.7 | 62.3 | 0 | 0 | 0 | 111.7 | V452 L453 P454 F459 L460 | V452-L456 VanDerWaalsContact O-CB 3.28Å; V452-L456 WeakPolarHBondContact O-CB 3.3Å; V452-L456 PolarHBondContact O-N 2.67Å; L453-L456 PolarHBondContact O-N 2.95Å; P454-L456 VanDerWaalsContact C-N 3.34Å; P454-L456 PolarHBondContact O-N 2.68Å; L456-F459 PolarHBondContact O-N 3.15Å; L456-L460 HydrophobicContact CD1-CD1 3.98Å; L456-L460 HydrophobicContact CD1-CG 4.19Å; L456-L460 HydrophobicContact CG-CD1 3.97Å; L456-L460 WeakPolarHBondContact O-CB 3.23Å; L456-L460 VanDerWaalsContact O-CG 3.3Å; L456-L460 WeakPolarHBondContact O-CG 3.34Å; L456-L460 PolarHBondContact O-N 3.43Å |
| 457 | V | 90.6 | Very high | 88.6 | Confident | 4 Ų | 4 | 63.9 Ų | 63.9 | 2% | 0.024 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -62.8 | -45.9 | 176.5 | 168.7 | 0 | 0 | 0 | 0 | 111.3 | F335 L453 P454 F459 L460 L461 L470 L473 | F335-V457 HydrophobicContact CD2-CG1 4.07Å; F335-V457 HydrophobicContact CE2-CG1 4.39Å; F335-V457 HydrophobicContact CG-CG1 4.21Å; L453-V457 WeakPolarHBondContact O-CG2 3.23Å; L453-V457 PolarHBondContact O-N 3.31Å; P454-V457 PolarHBondContact O-N 2.93Å; V457-F459 VanDerWaalsContact C-N 3.31Å; V457-F459 PolarHBondContact O-N 2.92Å; V457-L460 PolarHBondContact O-N 2.99Å; V457-L461 HydrophobicContact CG1-CD1 3.74Å; V457-L461 HydrophobicContact CG1-CG 4.13Å; V457-L461 WeakPolarHBondContact O-CB 3.44Å; V457-L461 VanDerWaalsContact O-CG 3.28Å; V457-L461 WeakPolarHBondContact O-CG 3.45Å; V457-L461 PolarHBondContact O-N 2.95Å; V457-L470 HydrophobicContact CG1-CD1 4.32Å; V457-L473 HydrophobicContact CG2-CB 4.07Å; V457-L473 HydrophobicContact CG2-CD2 3.35Å; V457-L473 HydrophobicContact CG2-CG 4.14Å |
| 458 | G | 87.2 | Confident | 88.5 | Confident | 29 Ų | 29 | 63.7 Ų | 63.7 | 30% | 0.299 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -58.2 | -43.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | P454 A455 G462 | P454-G458 PolarHBondContact O-N 2.82Å; A455-G458 PolarHBondContact O-N 3.1Å; G458-G462 PolarHBondContact O-N 3.47Å |
| 459 | F | 88.9 | Confident | 88.5 | Confident | 138 Ų | 138 | 63.3 Ų | 63.3 | 61% | 0.605 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -63.3 | -48 | 175 | 176.4 | -102.2 | 0 | 0 | 0 | 112.2 | A455 L456 V457 L461 G462 I463 | A455-F459 WeakPolarHBondContact O-CB 3.45Å; A455-F459 PolarHBondContact O-N 3.46Å; L456-F459 PolarHBondContact O-N 3.15Å; V457-F459 VanDerWaalsContact C-N 3.31Å; V457-F459 PolarHBondContact O-N 2.92Å; F459-L461 PolarHBondContact O-N 3.34Å; F459-G462 PolarHBondContact O-N 2.98Å; F459-G462 VanDerWaalsContact O-N 3.17Å; F459-I463 HydrophobicContact CD1-CD1 4.08Å; F459-I463 HydrophobicContact CE1-CD1 3.43Å; F459-I463 VanDerWaalsContact CE1-CD1 3.43Å; F459-I463 HydrophobicContact CE2-CD1 4.25Å; F459-I463 HydrophobicContact CZ-CD1 3.54Å; F459-I463 PolarHBondContact O-N 3.44Å |
| 460 | L | 89.1 | Confident | 88.4 | Confident | 51 Ų | 51 | 63.4 Ų | 63.4 | 27% | 0.267 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -66.4 | -35 | -179.3 | -71.7 | 172.1 | 0 | 0 | 0 | 112.6 | L456 V457 G462 I463 F464 L469 | L456-L460 HydrophobicContact CD1-CD1 3.98Å; L456-L460 HydrophobicContact CD1-CG 4.19Å; L456-L460 HydrophobicContact CG-CD1 3.97Å; L456-L460 WeakPolarHBondContact O-CB 3.23Å; L456-L460 VanDerWaalsContact O-CG 3.3Å; L456-L460 WeakPolarHBondContact O-CG 3.34Å; L456-L460 PolarHBondContact O-N 3.43Å; V457-L460 PolarHBondContact O-N 2.99Å; L460-G462 PolarHBondContact O-N 2.73Å; L460-I463 PolarHBondContact O-N 3.39Å; L460-I463 VanDerWaalsContact O-N 3.08Å; L460-F464 HydrophobicContact CD2-CD2 4.42Å; L460-F464 HydrophobicContact CD2-CE2 4.44Å; L460-F464 PolarHBondContact O-N 2.83Å; L460-L469 HydrophobicContact CB-CD1 3.6Å; L460-L469 WeakPolarHBondContact O-CD1 3.33Å |
| 461 | L | 86.7 | Confident | 88.7 | Confident | 45 Ų | 45 | 59.1 Ų | 59.1 | 24% | 0.236 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.4 | -33.4 | 174 | -77.4 | 170.6 | 0 | 0 | 0 | 111.9 | F335 V457 F459 I463 P465 L469 | F335-L461 HydrophobicContact CD1-CD1 3.74Å; F335-L461 HydrophobicContact CE1-CD1 4.09Å; F335-L461 HydrophobicContact CG-CD1 4.37Å; V457-L461 HydrophobicContact CG1-CD1 3.74Å; V457-L461 HydrophobicContact CG1-CG 4.13Å; V457-L461 WeakPolarHBondContact O-CB 3.44Å; V457-L461 VanDerWaalsContact O-CG 3.28Å; V457-L461 WeakPolarHBondContact O-CG 3.45Å; V457-L461 PolarHBondContact O-N 2.95Å; F459-L461 PolarHBondContact O-N 3.34Å; L461-I463 VanDerWaalsContact C-N 3.29Å; L461-I463 PolarHBondContact O-N 3.25Å; L461-P465 WeakPolarHBondContact O-CA 3.35Å; L461-L469 HydrophobicContact CD2-CB 4.33Å; L461-L469 HydrophobicContact CD2-CD1 4.09Å; L461-L469 HydrophobicContact CG-CD1 4.27Å |
| 462 | G | 83.4 | Confident | 88.9 | Confident | 68 Ų | 68 | 60.2 Ų | 60.2 | 70% | 0.701 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -66.3 | -29.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | G458 F459 L460 | G458-G462 PolarHBondContact O-N 3.47Å; F459-G462 PolarHBondContact O-N 2.98Å; F459-G462 VanDerWaalsContact O-N 3.17Å; L460-G462 PolarHBondContact O-N 2.73Å |
| 463 | I | 88.6 | Confident | 89 | Confident | 88 Ų | 88 | 58.1 Ų | 58.1 | 45% | 0.451 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -91.3 | -43.4 | -179.1 | -58.5 | 175 | 0 | 0 | 0 | 111.3 | F459 L460 L461 P465 | F459-I463 HydrophobicContact CD1-CD1 4.08Å; F459-I463 HydrophobicContact CE1-CD1 3.43Å; F459-I463 VanDerWaalsContact CE1-CD1 3.43Å; F459-I463 HydrophobicContact CE2-CD1 4.25Å; F459-I463 HydrophobicContact CZ-CD1 3.54Å; F459-I463 PolarHBondContact O-N 3.44Å; L460-I463 PolarHBondContact O-N 3.39Å; L460-I463 VanDerWaalsContact O-N 3.08Å; L461-I463 VanDerWaalsContact C-N 3.29Å; L461-I463 PolarHBondContact O-N 3.25Å; I463-P465 VanDerWaalsContact C-CD 3.41Å; I463-P465 VanDerWaalsContact O-CD 3.29Å; I463-P465 WeakPolarHBondContact O-CD 3.15Å |
| 464 | F | 87.6 | Confident | 89.1 | Confident | 114 Ų | 114 | 57.5 Ų | 57.5 | 50% | 0.5 | 31% | 0.314 | S | S | . | . | trans | -121.8 | 67.7 | -174.9 | -55.1 | -71.5 | 0 | 0 | 0 | 111.8 | L460 K466 Q467 L469 | L460-F464 HydrophobicContact CD2-CD2 4.42Å; L460-F464 HydrophobicContact CD2-CE2 4.44Å; L460-F464 PolarHBondContact O-N 2.83Å; F464-K466 PolarHBondContact O-N 3.03Å; F464-K466 VanDerWaalsContact O-N 3.15Å; F464-Q467 PolarHBondContact O-N 3.47Å; F464-L469 HydrophobicContact CB-CD1 4.17Å | ||
| 465 | P | 78.8 | Confident | 89.4 | Confident | 89 Ų | 89 | 58.5 Ų | 58.5 | 58% | 0.578 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68 | -17.8 | -174.4 | 26.8 | -35.7 | 0 | 0 | 0 | 114 | L461 I463 | L461-P465 WeakPolarHBondContact O-CA 3.35Å; I463-P465 VanDerWaalsContact C-CD 3.41Å; I463-P465 VanDerWaalsContact O-CD 3.29Å; I463-P465 WeakPolarHBondContact O-CD 3.15Å |
| 466 | K | 80.8 | Confident | 89.8 | Confident | 181 Ų | 181 | 60.8 Ų | 60.8 | 79% | 0.787 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | 2.8 | -176.8 | -63.1 | -174.6 | 180 | -179.5 | 0 | 114.3 | Y343 F464 | Y343-K466 WeakPolarHBondContact CE2-O 3.29Å; F464-K466 PolarHBondContact O-N 3.03Å; F464-K466 VanDerWaalsContact O-N 3.15Å |
| 467 | Q | 86.6 | Confident | 90 | Very high | 93 Ų | 93 | 57.5 Ų | 57.5 | 44% | 0.435 | 30% | 0.304 | S | S | . | . | S | Bend | trans | -115 | 144.9 | -176.3 | -65.5 | -64.7 | -10.7 | 0 | 0 | 110.8 | F464 L469 | F464-Q467 PolarHBondContact O-N 3.47Å; Q467-L469 HydrophobicContact CB-CD2 4.4Å; Q467-L469 HydrophobicContact CB-CG 4.27Å; Q467-L469 PolarHBondContact O-N 3.26Å |
| 468 | P | 89.8 | Confident | 90.3 | Very high | 3 Ų | 3 | 57.4 Ų | 57.4 | 2% | 0.019 | 30% | 0.303 | C | S | . | . | trans | -80.5 | 58.3 | -177.9 | 34 | -34.8 | 0 | 0 | 0 | 111.9 | F339 Y343 T400 L470 M471 Y472 | F339-P468 HydrophobicContact CE2-CB 3.68Å; F339-P468 HydrophobicContact CZ-CB 4.1Å; Y343-P468 HydrophobicContact CE1-CB 4.02Å; Y343-P468 HydrophobicContact CE2-CB 4.11Å; Y343-P468 WeakPolarHBondContact OH-CD 3.27Å; T400-P468 HydrophobicContact CG2-CB 3.89Å; T400-P468 HydrophobicContact CG2-CG 4.15Å; P468-L470 PolarHBondContact O-N 3.36Å; P468-L470 VanDerWaalsContact O-N 3.15Å; P468-M471 HydrophobicContact CB-CB 4.47Å; P468-M471 HydrophobicContact CB-CG 4.41Å; P468-M471 PolarHBondContact O-N 3.01Å; P468-Y472 HydrophobicContact CG-CE1 4.11Å; P468-Y472 HydrophobicContact CG-CE2 3.98Å; P468-Y472 PolarHBondContact O-N 3.38Å | ||
| 469 | L | 91.6 | Very high | 90.8 | Very high | 28 Ų | 28 | 58.7 Ų | 58.7 | 15% | 0.147 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -55.7 | -35.2 | -173.1 | -67.9 | 171.5 | 0 | 0 | 0 | 113.4 | L460 L461 F464 Q467 M471 Y472 L473 | L460-L469 HydrophobicContact CB-CD1 3.6Å; L460-L469 WeakPolarHBondContact O-CD1 3.33Å; L461-L469 HydrophobicContact CD2-CB 4.33Å; L461-L469 HydrophobicContact CD2-CD1 4.09Å; L461-L469 HydrophobicContact CG-CD1 4.27Å; F464-L469 HydrophobicContact CB-CD1 4.17Å; Q467-L469 HydrophobicContact CB-CD2 4.4Å; Q467-L469 HydrophobicContact CB-CG 4.27Å; Q467-L469 PolarHBondContact O-N 3.26Å; L469-M471 VanDerWaalsContact C-N 3.3Å; L469-M471 PolarHBondContact O-N 3.44Å; L469-Y472 HydrophobicContact CD2-CD2 4.48Å; L469-Y472 PolarHBondContact O-N 3.41Å; L469-L473 PolarHBondContact O-N 2.87Å |
| 470 | L | 92.3 | Very high | 91.2 | Very high | 3 Ų | 3 | 56.2 Ų | 56.2 | 2% | 0.016 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60 | -42.2 | 177.1 | -172 | 61.9 | 0 | 0 | 0 | 111.9 | Y332 F335 I336 F339 V457 P468 L473 S474 | Y332-L470 HydrophobicContact CD2-CD2 4.35Å; Y332-L470 HydrophobicContact CD2-CG 4.2Å; F335-L470 HydrophobicContact CB-CD1 3.93Å; F335-L470 HydrophobicContact CB-CD2 4.01Å; I336-L470 HydrophobicContact CB-CD2 4.37Å; I336-L470 HydrophobicContact CD1-CD2 4.34Å; F339-L470 HydrophobicContact CB-CD2 3.87Å; F339-L470 HydrophobicContact CD2-CB 4.12Å; F339-L470 HydrophobicContact CG-CD2 4.26Å; V457-L470 HydrophobicContact CG1-CD1 4.32Å; P468-L470 PolarHBondContact O-N 3.36Å; P468-L470 VanDerWaalsContact O-N 3.15Å; L470-L473 PolarHBondContact O-N 3.15Å; L470-S474 PolarHBondContact O-N 3.35Å; L470-S474 PolarHBondContact O-OG 3.13Å |
| 471 | M | 94.2 | Very high | 91.5 | Very high | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -72.3 | -36.3 | -178.6 | -56.2 | -53.5 | 154.2 | 0 | 0 | 111.2 | Y332 I336 F339 L396 T400 P468 L469 S474 L475 | Y332-M471 HydrophobicContact CE2-CE 3.99Å; Y332-M471 HydrophobicContact CE2-SD 3.96Å; I336-M471 HydrophobicContact CD1-CE 3.86Å; F339-M471 HydrophobicContact CD1-CE 3.49Å; F339-M471 VanDerWaalsContact CD1-CE 3.49Å; F339-M471 HydrophobicContact CD2-CE 4.14Å; F339-M471 HydrophobicContact CE1-CE 3.41Å; F339-M471 VanDerWaalsContact CE1-CE 3.41Å; F339-M471 HydrophobicContact CE1-CG 4.45Å; F339-M471 HydrophobicContact CE2-CE 4.04Å; F339-M471 HydrophobicContact CE2-CG 4.02Å; F339-M471 HydrophobicContact CG-CE 3.87Å; F339-M471 HydrophobicContact CZ-CE 3.69Å; F339-M471 HydrophobicContact CZ-CG 3.82Å; L396-M471 HydrophobicContact CB-SD 3.73Å; L396-M471 HydrophobicContact CD1-SD 4.21Å; L396-M471 HydrophobicContact CD2-SD 4.39Å; L396-M471 HydrophobicContact CG-SD 4.34Å; T400-M471 HydrophobicContact CG2-CB 4.4Å; T400-M471 HydrophobicContact CG2-CG 4.08Å; P468-M471 HydrophobicContact CB-CB 4.47Å; P468-M471 HydrophobicContact CB-CG 4.41Å; P468-M471 PolarHBondContact O-N 3.01Å; L469-M471 VanDerWaalsContact C-N 3.3Å; L469-M471 PolarHBondContact O-N 3.44Å; M471-S474 WeakPolarHBondContact CA-OG 3.28Å; M471-S474 PolarHBondContact O-N 3.01Å; M471-S474 PolarHBondContact O-OG 2.9Å; M471-L475 PolarHBondContact O-N 2.9Å |
| 472 | Y | 94.4 | Very high | 92 | Very high | 94 Ų | 94 | 53.3 Ų | 53.3 | 37% | 0.369 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -64.1 | -43.3 | 172.2 | -59.8 | -30.1 | 0 | 0 | 0 | 112 | P468 L469 S474 L475 I476 | P468-Y472 HydrophobicContact CG-CE1 4.11Å; P468-Y472 HydrophobicContact CG-CE2 3.98Å; P468-Y472 PolarHBondContact O-N 3.38Å; L469-Y472 HydrophobicContact CD2-CD2 4.48Å; L469-Y472 PolarHBondContact O-N 3.41Å; Y472-S474 PolarHBondContact O-N 3.45Å; Y472-L475 PolarHBondContact O-N 3.19Å; Y472-I476 WeakPolarHBondContact O-CB 3.46Å; Y472-I476 WeakPolarHBondContact O-CD1 3.48Å; Y472-I476 VanDerWaalsContact O-CG1 3.23Å; Y472-I476 WeakPolarHBondContact O-CG1 3.48Å; Y472-I476 PolarHBondContact O-N 2.9Å |
| 473 | L | 95.1 | Very high | 92.5 | Very high | 22 Ų | 22 | 55.1 Ų | 55.1 | 12% | 0.115 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -59.6 | -47.3 | 175 | -177.6 | 74 | 0 | 0 | 0 | 111 | A331 L453 V457 L469 L470 L475 I476 T477 | A331-L473 HydrophobicContact CB-CD2 3.57Å; L453-L473 HydrophobicContact CB-CD2 4.2Å; L453-L473 HydrophobicContact CD2-CD1 4.22Å; V457-L473 HydrophobicContact CG2-CB 4.07Å; V457-L473 HydrophobicContact CG2-CD2 3.35Å; V457-L473 HydrophobicContact CG2-CG 4.14Å; L469-L473 PolarHBondContact O-N 2.87Å; L470-L473 PolarHBondContact O-N 3.15Å; L473-L475 VanDerWaalsContact C-N 3.27Å; L473-L475 PolarHBondContact O-N 3Å; L473-I476 PolarHBondContact O-N 3.18Å; L473-T477 HydrophobicContact CD1-CG2 4.1Å; L473-T477 HydrophobicContact CG-CG2 4.31Å; L473-T477 WeakPolarHBondContact O-CB 3.4Å; L473-T477 WeakPolarHBondContact O-CG2 3.29Å; L473-T477 PolarHBondContact O-N 3.27Å; L473-T477 PolarHBondContact O-OG1 2.78Å |
| 474 | S | 95 | Very high | 92.9 | Very high | 2 Ų | 2 | 51.9 Ų | 51.9 | 1% | 0.014 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.1 | -39.7 | 178.5 | 56.5 | 0 | 0 | 0 | 0 | 112.2 | S393 Y413 L470 M471 Y472 T477 A478 | S393-S474 PolarHBondContact OG-O 2.86Å; Y413-S474 WeakPolarHBondContact OH-CB 3.33Å; L470-S474 PolarHBondContact O-N 3.35Å; L470-S474 PolarHBondContact O-OG 3.13Å; M471-S474 WeakPolarHBondContact CA-OG 3.28Å; M471-S474 PolarHBondContact O-N 3.01Å; M471-S474 PolarHBondContact O-OG 2.9Å; Y472-S474 PolarHBondContact O-N 3.45Å; S474-T477 PolarHBondContact O-OG1 3.27Å; S474-T477 VanDerWaalsContact O-OG1 3.09Å; S474-A478 WeakPolarHBondContact O-CB 3.23Å; S474-A478 PolarHBondContact O-N 2.63Å |
| 475 | L | 96.9 | Very high | 93.2 | Very high | 36 Ų | 36 | 47.1 Ų | 47.1 | 19% | 0.188 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -70.5 | -45.1 | 178.7 | -178.4 | 60.9 | 0 | 0 | 0 | 112.3 | L394 C397 M471 Y472 L473 T477 A478 V479 | L394-L475 HydrophobicContact CD2-CD1 3.57Å; L394-L475 HydrophobicContact CD2-CD2 4.31Å; L394-L475 HydrophobicContact CG-CD1 3.85Å; C397-L475 HydrophobicContact CB-CD2 4.13Å; M471-L475 PolarHBondContact O-N 2.9Å; Y472-L475 PolarHBondContact O-N 3.19Å; L473-L475 VanDerWaalsContact C-N 3.27Å; L473-L475 PolarHBondContact O-N 3Å; L475-T477 VanDerWaalsContact C-N 3.35Å; L475-T477 PolarHBondContact O-N 3.45Å; L475-A478 PolarHBondContact O-N 3Å; L475-V479 HydrophobicContact CD1-CG2 4.2Å; L475-V479 WeakPolarHBondContact O-CB 3.5Å; L475-V479 VanDerWaalsContact O-CG2 3.28Å; L475-V479 WeakPolarHBondContact O-CG2 3.46Å; L475-V479 PolarHBondContact O-N 2.95Å |
| 476 | I | 96.9 | Very high | 93.9 | Very high | 112 Ų | 112 | 46.4 Ų | 46.4 | 57% | 0.574 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -60.2 | -47.2 | 179.4 | -70.1 | 164.4 | 0 | 0 | 0 | 110.3 | Y472 L473 V479 F480 | Y472-I476 WeakPolarHBondContact O-CB 3.46Å; Y472-I476 WeakPolarHBondContact O-CD1 3.48Å; Y472-I476 VanDerWaalsContact O-CG1 3.23Å; Y472-I476 WeakPolarHBondContact O-CG1 3.48Å; Y472-I476 PolarHBondContact O-N 2.9Å; L473-I476 PolarHBondContact O-N 3.18Å; I476-V479 PolarHBondContact O-N 3.47Å; I476-F480 VanDerWaalsContact O-CB 3.27Å; I476-F480 WeakPolarHBondContact O-CB 3.49Å; I476-F480 PolarHBondContact O-N 3.26Å |
| 477 | T | 96.4 | Very high | 94.5 | Very high | 8 Ų | 8 | 41 Ų | 41 | 5% | 0.049 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -68.9 | -36.1 | 179.4 | 52.9 | 0 | 0 | 0 | 0 | 112.2 | A324 A328 L453 L473 S474 L475 F480 T481 | A324-T477 HydrophobicContact CB-CG2 4.4Å; A328-T477 HydrophobicContact CB-CG2 4.04Å; A328-T477 VanDerWaalsContact CB-OG1 3.26Å; A328-T477 WeakPolarHBondContact CB-OG1 3.35Å; L453-T477 HydrophobicContact CD1-CG2 3.88Å; L473-T477 HydrophobicContact CD1-CG2 4.1Å; L473-T477 HydrophobicContact CG-CG2 4.31Å; L473-T477 WeakPolarHBondContact O-CB 3.4Å; L473-T477 WeakPolarHBondContact O-CG2 3.29Å; L473-T477 PolarHBondContact O-N 3.27Å; L473-T477 PolarHBondContact O-OG1 2.78Å; S474-T477 PolarHBondContact O-OG1 3.27Å; S474-T477 VanDerWaalsContact O-OG1 3.09Å; L475-T477 VanDerWaalsContact C-N 3.35Å; L475-T477 PolarHBondContact O-N 3.45Å; T477-F480 PolarHBondContact O-N 3.43Å; T477-T481 WeakPolarHBondContact O-CB 3.22Å; T477-T481 WeakPolarHBondContact O-CG2 3.34Å; T477-T481 PolarHBondContact O-N 2.89Å; T477-T481 PolarHBondContact O-OG1 2.99Å |
| 478 | A | 96.8 | Very high | 94.8 | Very high | 1 Ų | 1 | 36.6 Ų | 36.6 | 1% | 0.008 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.8 | -44.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T389 M390 S474 L475 T481 S482 | T389-A478 HydrophobicContact CG2-CB 3.92Å; M390-A478 HydrophobicContact CG-CB 4.32Å; M390-A478 HydrophobicContact SD-CB 3.59Å; M390-A478 VanDerWaalsContact SD-CB 3.59Å; S474-A478 WeakPolarHBondContact O-CB 3.23Å; S474-A478 PolarHBondContact O-N 2.63Å; L475-A478 PolarHBondContact O-N 3Å; A478-T481 PolarHBondContact O-OG1 2.9Å; A478-T481 VanDerWaalsContact O-OG1 3.11Å; A478-S482 WeakPolarHBondContact O-CB 3.37Å; A478-S482 PolarHBondContact O-N 2.91Å; A478-S482 PolarHBondContact O-OG 3.37Å |
| 479 | V | 97.3 | Very high | 94.9 | Very high | 57 Ų | 57 | 41.7 Ų | 41.7 | 35% | 0.345 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62.6 | -48.1 | 175.9 | 169.9 | 0 | 0 | 0 | 0 | 110 | M390 L475 I476 T481 S482 I483 | M390-V479 HydrophobicContact CE-CG2 3.73Å; M390-V479 HydrophobicContact SD-CB 4.43Å; M390-V479 HydrophobicContact SD-CG2 3.87Å; M390-V479 PolarHBondContact SD-N 2.93Å; M390-V479 VanDerWaalsContact SD-N 3.41Å; L475-V479 HydrophobicContact CD1-CG2 4.2Å; L475-V479 WeakPolarHBondContact O-CB 3.5Å; L475-V479 VanDerWaalsContact O-CG2 3.28Å; L475-V479 WeakPolarHBondContact O-CG2 3.46Å; L475-V479 PolarHBondContact O-N 2.95Å; I476-V479 PolarHBondContact O-N 3.47Å; V479-T481 PolarHBondContact O-N 3.36Å; V479-S482 PolarHBondContact O-N 3.49Å; V479-I483 HydrophobicContact CG1-CD1 3.71Å; V479-I483 HydrophobicContact CG1-CG1 4.5Å; V479-I483 VanDerWaalsContact O-CG1 3.31Å; V479-I483 WeakPolarHBondContact O-CG1 3.32Å; V479-I483 PolarHBondContact O-N 3.39Å |
| 480 | F | 97 | Very high | 94.8 | Very high | 85 Ų | 85 | 48 Ų | 48 | 37% | 0.373 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -58.9 | -49.4 | -179.9 | -178.7 | -103.7 | 0 | 0 | 0 | 112.3 | F320 A324 I476 T477 S482 I483 L484 | F320-F480 HydrophobicContact CB-CE1 4.28Å; F320-F480 HydrophobicContact CB-CZ 4.19Å; A324-F480 HydrophobicContact CB-CD1 3.46Å; A324-F480 VanDerWaalsContact CB-CD1 3.46Å; A324-F480 HydrophobicContact CB-CE1 3.79Å; I476-F480 VanDerWaalsContact O-CB 3.27Å; I476-F480 WeakPolarHBondContact O-CB 3.49Å; I476-F480 PolarHBondContact O-N 3.26Å; T477-F480 PolarHBondContact O-N 3.43Å; F480-S482 PolarHBondContact O-N 3Å; F480-I483 PolarHBondContact O-N 2.75Å; F480-L484 HydrophobicContact CD1-CD1 3.73Å; F480-L484 HydrophobicContact CD1-CG 4.46Å; F480-L484 HydrophobicContact CE1-CD1 3.21Å; F480-L484 HydrophobicContact CE1-CG 4.19Å; F480-L484 HydrophobicContact CE2-CD1 4.2Å; F480-L484 HydrophobicContact CE2-CG 4.44Å; F480-L484 HydrophobicContact CG-CD1 4.44Å; F480-L484 HydrophobicContact CZ-CD1 3.49Å; F480-L484 VanDerWaalsContact CZ-CD1 3.49Å; F480-L484 HydrophobicContact CZ-CG 4.18Å; F480-L484 WeakPolarHBondContact O-CB 3.09Å; F480-L484 WeakPolarHBondContact O-CG 3.43Å; F480-L484 PolarHBondContact O-N 3.17Å |
| 481 | T | 96.3 | Very high | 94.7 | Very high | 4 Ų | 4 | 49.6 Ų | 49.6 | 3% | 0.025 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -66.7 | -35.8 | 178.1 | 51.4 | 0 | 0 | 0 | 0 | 112.4 | F321 A324 T477 A478 V479 I483 L484 F485 | F321-T481 HydrophobicContact CD2-CG2 4.12Å; F321-T481 HydrophobicContact CE2-CG2 4.14Å; F321-T481 WeakPolarHBondContact CE2-O 3.31Å; A324-T481 HydrophobicContact CB-CG2 3.97Å; T477-T481 WeakPolarHBondContact O-CB 3.22Å; T477-T481 WeakPolarHBondContact O-CG2 3.34Å; T477-T481 PolarHBondContact O-N 2.89Å; T477-T481 PolarHBondContact O-OG1 2.99Å; A478-T481 PolarHBondContact O-OG1 2.9Å; A478-T481 VanDerWaalsContact O-OG1 3.11Å; V479-T481 PolarHBondContact O-N 3.36Å; T481-I483 VanDerWaalsContact C-N 3.33Å; T481-I483 PolarHBondContact O-N 3Å; T481-L484 PolarHBondContact O-N 3.47Å; T481-F485 PolarHBondContact O-N 3.33Å; T481-F485 VanDerWaalsContact O-N 3.09Å |
| 482 | S | 95.6 | Very high | 94.4 | Very high | 31 Ų | 31 | 50.2 Ų | 50.2 | 22% | 0.217 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -69.2 | -27.5 | 176.2 | -61 | 0 | 0 | 0 | 0 | 113.7 | M390 A478 V479 F480 P486 | M390-S482 WeakPolarHBondContact CG-OG 3.43Å; A478-S482 WeakPolarHBondContact O-CB 3.37Å; A478-S482 PolarHBondContact O-N 2.91Å; A478-S482 PolarHBondContact O-OG 3.37Å; V479-S482 PolarHBondContact O-N 3.49Å; F480-S482 PolarHBondContact O-N 3Å; S482-P486 WeakPolarHBondContact O-CD 3.27Å; S482-P486 WeakPolarHBondContact O-CG 3.37Å |
| 483 | I | 95.7 | Very high | 93.9 | Very high | 106 Ų | 106 | 48.8 Ų | 48.8 | 54% | 0.544 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -80.6 | -42.5 | 173 | -67.9 | 167.6 | 0 | 0 | 0 | 110.8 | V479 F480 T481 F485 P486 V487 | V479-I483 HydrophobicContact CG1-CD1 3.71Å; V479-I483 HydrophobicContact CG1-CG1 4.5Å; V479-I483 VanDerWaalsContact O-CG1 3.31Å; V479-I483 WeakPolarHBondContact O-CG1 3.32Å; V479-I483 PolarHBondContact O-N 3.39Å; F480-I483 PolarHBondContact O-N 2.75Å; T481-I483 VanDerWaalsContact C-N 3.33Å; T481-I483 PolarHBondContact O-N 3Å; I483-F485 PolarHBondContact O-N 3.47Å; I483-P486 WeakPolarHBondContact O-CD 3.25Å; I483-V487 WeakPolarHBondContact O-CG2 3.35Å |
| 484 | L | 95.2 | Very high | 93.1 | Very high | 20 Ų | 20 | 50.2 Ų | 50.2 | 11% | 0.105 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.3 | -40 | -178.6 | -81.5 | -178.7 | 0 | 0 | 0 | 112.7 | L317 F320 F321 F480 T481 V487 M488 | L317-L484 HydrophobicContact CD2-CD2 3.75Å; F320-L484 HydrophobicContact CB-CD1 4.28Å; F321-L484 HydrophobicContact CB-CD1 4.16Å; F321-L484 HydrophobicContact CD2-CB 4.13Å; F480-L484 HydrophobicContact CD1-CD1 3.73Å; F480-L484 HydrophobicContact CD1-CG 4.46Å; F480-L484 HydrophobicContact CE1-CD1 3.21Å; F480-L484 HydrophobicContact CE1-CG 4.19Å; F480-L484 HydrophobicContact CE2-CD1 4.2Å; F480-L484 HydrophobicContact CE2-CG 4.44Å; F480-L484 HydrophobicContact CG-CD1 4.44Å; F480-L484 HydrophobicContact CZ-CD1 3.49Å; F480-L484 VanDerWaalsContact CZ-CD1 3.49Å; F480-L484 HydrophobicContact CZ-CG 4.18Å; F480-L484 WeakPolarHBondContact O-CB 3.09Å; F480-L484 WeakPolarHBondContact O-CG 3.43Å; F480-L484 PolarHBondContact O-N 3.17Å; T481-L484 PolarHBondContact O-N 3.47Å; L484-V487 WeakPolarHBondContact O-CB 3.27Å; L484-V487 PolarHBondContact O-N 3.44Å; L484-V487 VanDerWaalsContact O-N 3.15Å; L484-M488 HydrophobicContact CB-SD 4.41Å; L484-M488 VanDerWaalsContact O-CG 3.29Å; L484-M488 WeakPolarHBondContact O-CG 3.43Å; L484-M488 PolarHBondContact O-N 3.47Å |
| 485 | F | 94.8 | Very high | 91.3 | Very high | 14 Ų | 14 | 56 Ų | 56 | 6% | 0.061 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.6 | -46.9 | -174.4 | -179.7 | -105.5 | 0 | 0 | 0 | 113.9 | F321 I382 L386 W427 T481 I483 V487 M488 Y489 | F321-F485 HydrophobicContact CE2-CB 4.1Å; I382-F485 HydrophobicContact CB-CE2 3.96Å; I382-F485 HydrophobicContact CB-CZ 3.92Å; I382-F485 HydrophobicContact CD1-CE2 3.74Å; I382-F485 HydrophobicContact CD1-CZ 4.26Å; I382-F485 HydrophobicContact CG1-CE2 4.47Å; I382-F485 HydrophobicContact CG2-CD1 4.26Å; I382-F485 HydrophobicContact CG2-CD2 3.62Å; I382-F485 HydrophobicContact CG2-CE1 4.13Å; I382-F485 HydrophobicContact CG2-CE2 3.48Å; I382-F485 VanDerWaalsContact CG2-CE2 3.48Å; I382-F485 HydrophobicContact CG2-CG 4.01Å; I382-F485 HydrophobicContact CG2-CZ 3.75Å; L386-F485 HydrophobicContact CD1-CB 3.46Å; L386-F485 VanDerWaalsContact CD1-CB 3.46Å; L386-F485 HydrophobicContact CD1-CD1 3.8Å; L386-F485 HydrophobicContact CD1-CD2 4.45Å; L386-F485 HydrophobicContact CD1-CG 3.65Å; W427-F485 HydrophobicContact CD2-CE2 4.36Å; T481-F485 PolarHBondContact O-N 3.33Å; T481-F485 VanDerWaalsContact O-N 3.09Å; I483-F485 PolarHBondContact O-N 3.47Å; F485-V487 VanDerWaalsContact C-N 3.3Å; F485-V487 PolarHBondContact O-N 3.43Å; F485-M488 WeakPolarHBondContact O-CB 3.27Å; F485-M488 PolarHBondContact O-N 2.98Å; F485-Y489 WeakPolarHBondContact O-CB 3.48Å; F485-Y489 PolarHBondContact O-N 2.84Å |
| 486 | P | 93.8 | Very high | 89.4 | Confident | 74 Ų | 74 | 56.6 Ų | 56.6 | 48% | 0.481 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -58.9 | -37.4 | 171.2 | -26.5 | 34.2 | 0 | 0 | 0 | 113.9 | S482 I483 Y489 K490 | S482-P486 WeakPolarHBondContact O-CD 3.27Å; S482-P486 WeakPolarHBondContact O-CG 3.37Å; I483-P486 WeakPolarHBondContact O-CD 3.25Å; P486-Y489 PolarHBondContact O-N 3.12Å; P486-K490 WeakPolarHBondContact O-CB 3.03Å; P486-K490 PolarHBondContact O-N 3.02Å |
| 487 | V | 93.3 | Very high | 86.9 | Confident | 67 Ų | 67 | 56.6 Ų | 56.6 | 41% | 0.406 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.8 | -48.4 | 175.9 | 174.8 | 0 | 0 | 0 | 0 | 110 | L317 I483 L484 F485 Y489 K490 V491 | L317-V487 HydrophobicContact CD1-CG1 4.24Å; I483-V487 WeakPolarHBondContact O-CG2 3.35Å; L484-V487 WeakPolarHBondContact O-CB 3.27Å; L484-V487 PolarHBondContact O-N 3.44Å; L484-V487 VanDerWaalsContact O-N 3.15Å; F485-V487 VanDerWaalsContact C-N 3.3Å; F485-V487 PolarHBondContact O-N 3.43Å; V487-Y489 VanDerWaalsContact C-N 3.31Å; V487-Y489 PolarHBondContact O-N 3.16Å; V487-K490 PolarHBondContact O-N 3.25Å; V487-V491 HydrophobicContact CG1-CG2 4.46Å; V487-V491 VanDerWaalsContact O-CG2 3.29Å; V487-V491 WeakPolarHBondContact O-CG2 3.22Å; V487-V491 PolarHBondContact O-N 2.93Å |
| 488 | M | 92.4 | Very high | 84.4 | Confident | 2 Ų | 2 | 61.1 Ų | 61.1 | 1% | 0.01 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -57.7 | -44.2 | 174.7 | -71.1 | 165.1 | 47 | 0 | 0 | 111.5 | L317 L318 F321 W427 L484 F485 K490 V491 A492 | L317-M488 HydrophobicContact CB-CG 3.57Å; L317-M488 HydrophobicContact CB-SD 4.21Å; L317-M488 HydrophobicContact CD1-CG 4.04Å; L317-M488 HydrophobicContact CG-CG 4.35Å; L318-M488 HydrophobicContact CD2-CE 3.3Å; L318-M488 HydrophobicContact CD2-SD 4.49Å; L318-M488 HydrophobicContact CG-CE 3.65Å; F321-M488 HydrophobicContact CB-SD 3.98Å; F321-M488 HydrophobicContact CD2-SD 4.1Å; F321-M488 HydrophobicContact CG-SD 4.13Å; W427-M488 HydrophobicContact CE3-CE 4.37Å; W427-M488 HydrophobicContact CH2-CB 3.94Å; W427-M488 HydrophobicContact CH2-CE 4.22Å; W427-M488 HydrophobicContact CZ3-CB 4.4Å; W427-M488 HydrophobicContact CZ3-CE 3.65Å; L484-M488 HydrophobicContact CB-SD 4.41Å; L484-M488 VanDerWaalsContact O-CG 3.29Å; L484-M488 WeakPolarHBondContact O-CG 3.43Å; L484-M488 PolarHBondContact O-N 3.47Å; F485-M488 WeakPolarHBondContact O-CB 3.27Å; F485-M488 PolarHBondContact O-N 2.98Å; M488-K490 PolarHBondContact O-N 2.98Å; M488-V491 PolarHBondContact O-N 3.25Å; M488-A492 VanDerWaalsContact O-CB 3.27Å; M488-A492 WeakPolarHBondContact O-CB 3.29Å; M488-A492 PolarHBondContact O-N 3.39Å |
| 489 | Y | 91.4 | Very high | 81.5 | Confident | 110 Ų | 110 | 63.7 Ų | 63.7 | 43% | 0.431 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62.2 | -43.5 | 177.7 | -172.6 | -89.9 | 0 | 0 | 0 | 112.3 | W427 Y431 F485 P486 V487 A492 T493 | W427-Y489 HydrophobicContact CZ2-CD2 4.16Å; Y431-Y489 WeakPolarHBondContact OH-CE2 3.36Å; F485-Y489 WeakPolarHBondContact O-CB 3.48Å; F485-Y489 PolarHBondContact O-N 2.84Å; P486-Y489 PolarHBondContact O-N 3.12Å; V487-Y489 VanDerWaalsContact C-N 3.31Å; V487-Y489 PolarHBondContact O-N 3.16Å; Y489-A492 PolarHBondContact O-N 3.39Å; Y489-T493 HydrophobicContact CD1-CG2 4.24Å; Y489-T493 HydrophobicContact CE1-CG2 3.88Å; Y489-T493 HydrophobicContact CE2-CG2 4.41Å; Y489-T493 WeakPolarHBondContact O-CB 3.44Å; Y489-T493 WeakPolarHBondContact O-CG2 3.46Å; Y489-T493 PolarHBondContact O-N 3.25Å; Y489-T493 PolarHBondContact O-OG1 3.42Å |
| 490 | K | 90.9 | Very high | 78.4 | Confident | 160 Ų | 160 | 71.7 Ų | 71.7 | 70% | 0.696 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -63.6 | -43.1 | 175.6 | -172.5 | -179.5 | 178 | -178.2 | 0 | 111.9 | P486 V487 M488 A492 T493 A494 | P486-K490 WeakPolarHBondContact O-CB 3.03Å; P486-K490 PolarHBondContact O-N 3.02Å; V487-K490 PolarHBondContact O-N 3.25Å; M488-K490 PolarHBondContact O-N 2.98Å; K490-A492 VanDerWaalsContact C-N 3.34Å; K490-T493 PolarHBondContact O-N 3.04Å; K490-T493 PolarHBondContact O-OG1 2.94Å; K490-A494 PolarHBondContact O-N 3.16Å; K490-A494 VanDerWaalsContact O-N 3.07Å |
| 491 | V | 89.9 | Confident | 75.2 | Confident | 36 Ų | 36 | 77.6 Ų | 77.6 | 22% | 0.218 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -64.9 | -39.5 | 177.2 | 172.4 | 0 | 0 | 0 | 0 | 111.2 | H310 L314 L317 V487 M488 T493 | H310-V491 HydrophobicContact CB-CG1 3.46Å; H310-V491 VanDerWaalsContact CB-CG1 3.46Å; L314-V491 HydrophobicContact CB-CG1 4.47Å; L317-V491 HydrophobicContact CD1-CG2 4.32Å; V487-V491 HydrophobicContact CG1-CG2 4.46Å; V487-V491 VanDerWaalsContact O-CG2 3.29Å; V487-V491 WeakPolarHBondContact O-CG2 3.22Å; V487-V491 PolarHBondContact O-N 2.93Å; M488-V491 PolarHBondContact O-N 3.25Å; V491-T493 VanDerWaalsContact C-N 3.34Å; V491-T493 PolarHBondContact O-N 3.49Å |
| 492 | A | 86.6 | Confident | 72.4 | Confident | 14 Ų | 14 | 85.3 Ų | 85.3 | 12% | 0.116 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -67.3 | -32.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L314 W427 Y431 M488 Y489 K490 | L314-A492 HydrophobicContact CD1-CB 3.6Å; W427-A492 HydrophobicContact CH2-CB 3.98Å; W427-A492 HydrophobicContact CZ2-CB 4.03Å; Y431-A492 HydrophobicContact CD1-CB 3.76Å; Y431-A492 HydrophobicContact CD2-CB 4.21Å; Y431-A492 HydrophobicContact CE1-CB 4.17Å; Y431-A492 HydrophobicContact CG-CB 3.78Å; M488-A492 VanDerWaalsContact O-CB 3.27Å; M488-A492 WeakPolarHBondContact O-CB 3.29Å; M488-A492 PolarHBondContact O-N 3.39Å; Y489-A492 PolarHBondContact O-N 3.39Å; K490-A492 VanDerWaalsContact C-N 3.34Å |
| 493 | T | 84.2 | Confident | 69.4 | Low | 64 Ų | 64 | 94.8 Ų | 94.8 | 39% | 0.393 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -98.5 | -4.3 | -174.9 | 54.8 | 0 | 0 | 0 | 0 | 114.5 | Y431 Y489 K490 V491 | Y431-T493 HydrophobicContact CE1-CG2 3.83Å; Y489-T493 HydrophobicContact CD1-CG2 4.24Å; Y489-T493 HydrophobicContact CE1-CG2 3.88Å; Y489-T493 HydrophobicContact CE2-CG2 4.41Å; Y489-T493 WeakPolarHBondContact O-CB 3.44Å; Y489-T493 WeakPolarHBondContact O-CG2 3.46Å; Y489-T493 PolarHBondContact O-N 3.25Å; Y489-T493 PolarHBondContact O-OG1 3.42Å; K490-T493 PolarHBondContact O-N 3.04Å; K490-T493 PolarHBondContact O-OG1 2.94Å; V491-T493 VanDerWaalsContact C-N 3.34Å; V491-T493 PolarHBondContact O-N 3.49Å |
| 494 | A | 79.1 | Confident | 66.5 | Low | 51 Ų | 51 | 96.7 Ų | 96.7 | 42% | 0.421 | 53% | 0.53 | S | S | . | . | P | Polyproline II helix | trans | -59.5 | 125.5 | -176 | 0 | 0 | 0 | 0 | 0 | 111.9 | K490 G496 | K490-A494 PolarHBondContact O-N 3.16Å; K490-A494 VanDerWaalsContact O-N 3.07Å; A494-G496 PolarHBondContact O-N 3.1Å |
| 495 | P | 57.8 | Low | 63.5 | Low | 124 Ų | 124 | 99.2 Ų | 99.2 | 81% | 0.805 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 126.6 | -179.5 | -20 | 29.8 | 0 | 0 | 0 | 111.7 | T497 | P495-T497 PolarHBondContact O-N 2.92Š|
| 496 | G | 55.2 | Low | 60.2 | Low | 48 Ų | 48 | 102.1 Ų | 102.1 | 50% | 0.495 | 59% | 0.594 | S | S | . | * | P | Polyproline II helix | trans | -61.6 | 120.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | A494 A498 G499 | A494-G496 PolarHBondContact O-N 3.1Å; G496-A498 PolarHBondContact O-N 3.46Å; G496-G499 PolarHBondContact O-N 3.15Å |
| 497 | T | 44.5 | Very low | 57.1 | Low | 113 Ų | 113 | 108.7 Ų | 108.7 | 69% | 0.693 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.6 | -2.9 | -179.6 | -26.4 | 0 | 0 | 0 | 0 | 114.6 | K309 P495 | K309-T497 PolarHBondContact NZ-OG1 3.33Å; P495-T497 PolarHBondContact O-N 2.92Å |
| 498 | A | 44.5 | Very low | 54.1 | Low | 102 Ų | 102 | 114.6 Ų | 114.6 | 84% | 0.843 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | -10.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | G496 | G496-A498 PolarHBondContact O-N 3.46Š|
| 499 | G | 35.3 | Very low | 51.2 | Low | 55 Ų | 55 | 120.7 Ų | 120.7 | 57% | 0.567 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -92.5 | -7.2 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | G496 | G496-G499 PolarHBondContact O-N 3.15Š|
| 500 | R | 32.3 | Very low | 48.3 | Very low | 225 Ų | 225 | 120.1 Ų | 120.1 | 85% | 0.849 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -91.3 | -10.1 | -170 | -158 | 170.3 | -177.8 | 178.1 | -0.5 | 114.6 | ||
| 501 | K | 30.9 | Very low | 45.6 | Very low | 210 Ų | 210 | 119.9 Ų | 119.9 | 91% | 0.913 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -85.9 | -3.9 | 174.2 | -101.2 | -174 | 177.5 | -176.1 | 0 | 115 | ||
| 502 | L | 36.7 | Very low | 42.9 | Very low | 166 Ų | 166 | 125.5 Ų | 125.5 | 87% | 0.869 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -112.8 | 14.4 | 177.6 | -135.5 | 88 | 0 | 0 | 0 | 114.8 | ||
| 503 | R | 32.2 | Very low | 40.4 | Very low | 229 Ų | 229 | 128.1 Ų | 128.1 | 86% | 0.864 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -138 | 51.7 | 176.6 | -85.3 | -173.3 | 172.3 | 163 | -2.1 | 112 | ||
| 504 | V | 34.6 | Very low | 38.3 | Very low | 146 Ų | 146 | 134.2 Ų | 134.2 | 89% | 0.885 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -137.8 | 90.3 | 150.8 | -178.9 | 0 | 0 | 0 | 0 | 105.8 | ||
| 505 | G | 32.4 | Very low | 36.6 | Very low | 74 Ų | 74 | 139.2 Ų | 139.2 | 76% | 0.763 | 79% | 0.793 | S | S | * | * | trans | 179 | 51.5 | -175.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | R507 | G505-R507 PolarHBondContact O-N 3.13Š| ||
| 506 | G | 27.3 | Very low | 35.5 | Very low | 74 Ų | 74 | 144.9 Ų | 144.9 | 76% | 0.763 | 80% | 0.798 | S | S | * | * | trans | -69.3 | 116 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 507 | R | 28.4 | Very low | 34.6 | Very low | 212 Ų | 212 | 152.1 Ų | 152.1 | 80% | 0.8 | 82% | 0.819 | S | S | * | * | 37.7 | 97.6 | 129.5 | -159.2 | 176.6 | -171.7 | -175.6 | 5.2 | 116.2 | G505 D509 | G505-R507 PolarHBondContact O-N 3.13Å; R507-D509 IonicContact NE-OD1 3.06Å | |||
| 508 | M | 30 | Very low | 34.1 | Very low | 191 Ų | 191 | 150.9 Ų | 150.9 | 94% | 0.941 | 82% | 0.821 | S | S | * | * | trans | -110.8 | 122.7 | 142.4 | -80 | 171.8 | 85.8 | 0 | 0 | 107.1 | ||||
| 509 | D | 31.8 | Very low | 33.8 | Very low | 130 Ų | 130 | 153.5 Ų | 153.5 | 70% | 0.695 | 82% | 0.82 | S | S | * | * | trans | -68.1 | 131.3 | 172.7 | -58.2 | -57.5 | 0 | 0 | 0 | 109.3 | R507 | R507-D509 IonicContact NE-OD1 3.06Š| ||
| 510 | A | 30.3 | Very low | 33.8 | Very low | 98 Ų | 98 | 159.5 Ų | 159.5 | 81% | 0.81 | 84% | 0.838 | S | S | * | * | trans | -160.7 | 111.3 | 155.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | N512 | A510-N512 PolarHBondContact O-N 3.07Š| ||
| 511 | D | 34 | Very low | 33.7 | Very low | 155 Ų | 155 | 156.4 Ų | 156.4 | 83% | 0.829 | 84% | 0.838 | S | S | * | * | trans | -51.2 | 117 | 156.2 | -179 | 35 | 0 | 0 | 0 | 111 | ||||
| 512 | N | 32.2 | Very low | 33.8 | Very low | 155 Ų | 155 | 152.2 Ų | 152.2 | 83% | 0.829 | 84% | 0.835 | S | S | * | * | trans | 171.1 | 134.9 | 144.9 | -101.9 | -24.1 | 0 | 0 | 0 | 112.5 | A510 | A510-N512 PolarHBondContact O-N 3.07Š| ||
| 513 | G | 34.2 | Very low | 33.5 | Very low | 68 Ų | 68 | 148.1 Ų | 148.1 | 70% | 0.701 | 83% | 0.833 | S | S | * | * | trans | 95.2 | 91.6 | 140.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | D515 | G513-D515 VanDerWaalsContact C-N 3.31Å; G513-D515 PolarHBondContact O-N 3.46Å | ||
| 514 | E | 41.1 | Very low | 33.4 | Very low | 193 Ų | 193 | 142.1 Ų | 142.1 | 90% | 0.902 | 83% | 0.833 | S | S | * | * | S | Bend | trans | -47.2 | 98.7 | 141.1 | -66.1 | 168.4 | 127.6 | 0 | 0 | 108.7 | ||
| 515 | D | 42.5 | Very low | 33.2 | Very low | 156 Ų | 156 | 138.9 Ų | 138.9 | 83% | 0.834 | 82% | 0.821 | S | S | * | * | trans | 174.2 | 79.2 | 158.5 | -92.4 | -22.5 | 0 | 0 | 0 | 109.3 | G513 | G513-D515 VanDerWaalsContact C-N 3.31Å; G513-D515 PolarHBondContact O-N 3.46Å | ||
| 516 | R | 34.9 | Very low | 33.1 | Very low | 243 Ų | 243 | 143.6 Ų | 143.6 | 92% | 0.917 | 82% | 0.823 | S | S | * | * | trans | -165.8 | 18.7 | 154.5 | -114.3 | 166.1 | 161.4 | 152.3 | -2.6 | 115.8 | A518 | R516-A518 VanDerWaalsContact C-N 3.29Å; R516-A518 PolarHBondContact O-N 3.39Å | ||
| 517 | Q | 35.8 | Very low | 33.2 | Very low | 199 Ų | 199 | 146.4 Ų | 146.4 | 93% | 0.93 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -95.5 | 37.3 | 172.3 | -159.3 | 79.3 | 22.7 | 0 | 0 | 111.7 | ||
| 518 | A | 35.4 | Very low | 33.2 | Very low | 88 Ų | 88 | 144.6 Ų | 144.6 | 73% | 0.727 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -159.4 | 65.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | R516 | R516-A518 VanDerWaalsContact C-N 3.29Å; R516-A518 PolarHBondContact O-N 3.39Å |
| 519 | L | 37.6 | Very low | 33.3 | Very low | 157 Ų | 157 | 144.1 Ų | 144.1 | 82% | 0.822 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -168 | 19.6 | 166.2 | -110.3 | 172 | 0 | 0 | 0 | 116.1 | ||
| 520 | L | 34.3 | Very low | 33.3 | Very low | 181 Ų | 181 | 146.6 Ų | 146.6 | 95% | 0.948 | 83% | 0.83 | S | S | * | * | trans | -146 | 60 | 169.3 | -67 | 176.7 | 0 | 0 | 0 | 110.8 | ||||
| 521 | D | 30.3 | Very low | 33.2 | Very low | 159 Ų | 159 | 151.4 Ų | 151.4 | 85% | 0.85 | 84% | 0.836 | S | S | * | * | trans | -128.5 | 82.3 | 155.1 | -168.6 | 24.4 | 0 | 0 | 0 | 107.3 | ||||
| 522 | S | 33.9 | Very low | 33 | Very low | 122 Ų | 122 | 152 Ų | 152 | 85% | 0.853 | 83% | 0.834 | S | S | * | * | trans | -173.5 | 106.8 | 162 | 0.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 523 | G | 29.6 | Very low | 32.8 | Very low | 81 Ų | 81 | 152.5 Ų | 152.5 | 84% | 0.835 | 83% | 0.831 | S | S | * | * | trans | 161.9 | 66.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 524 | A | 31.4 | Very low | 32.6 | Very low | 103 Ų | 103 | 158.6 Ų | 158.6 | 85% | 0.851 | 84% | 0.841 | S | S | * | * | trans | -67.4 | 140 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 525 | A | 30.1 | Very low | 32.1 | Very low | 78 Ų | 78 | 157.1 Ų | 157.1 | 65% | 0.645 | 84% | 0.839 | S | S | * | * | trans | 148.3 | 128.3 | 133.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 526 | E | 30.2 | Very low | 31.5 | Very low | 173 Ų | 173 | 158.6 Ų | 158.6 | 81% | 0.808 | 84% | 0.841 | S | S | * | * | trans | 62.5 | 125.4 | 139.1 | -63.4 | 174.2 | -166.1 | 0 | 0 | 115.9 | ||||
| 527 | D | 28.7 | Very low | 31.3 | Very low | 133 Ų | 133 | 150.9 Ų | 150.9 | 71% | 0.711 | 83% | 0.829 | S | S | * | * | cis | -159.9 | 166 | 20 | -75.3 | -45.9 | 0 | 0 | 0 | 106 | ||||
| 528 | D | 29 | Very low | 31.1 | Very low | 173 Ų | 173 | 148.9 Ų | 148.9 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | trans | -174.2 | 85 | 145.5 | -89.6 | -22.1 | 0 | 0 | 0 | 107.9 | ||||
| 529 | E | 32.4 | Very low | 31 | Very low | 182 Ų | 182 | 154 Ų | 154 | 85% | 0.85 | 83% | 0.834 | S | S | * | * | trans | -77.8 | 142 | 154.4 | -72.9 | -174.9 | 165 | 0 | 0 | 109.2 | ||||
| 530 | E | 30.4 | Very low | 30.8 | Very low | 181 Ų | 181 | 158.5 Ų | 158.5 | 85% | 0.846 | 84% | 0.84 | S | S | * | * | trans | 23.1 | 126.1 | 148.4 | -54.8 | -175.2 | 175.7 | 0 | 0 | 119.7 | ||||
| 531 | E | 28.8 | Very low | 30.7 | Very low | 200 Ų | 200 | 157.5 Ų | 157.5 | 94% | 0.935 | 84% | 0.836 | S | S | * | * | -161.8 | 123.8 | 129.8 | -109.3 | 173.1 | -153.1 | 0 | 0 | 112.6 | |||||
| 532 | E | 29.8 | Very low | 30.8 | Very low | 168 Ų | 168 | 158 Ų | 158 | 79% | 0.785 | 84% | 0.838 | S | S | * | * | trans | -79.4 | 163.2 | 161.2 | -71 | -172.9 | 148.3 | 0 | 0 | 110.4 | ||||
| 533 | E | 28.4 | Very low | 30.8 | Very low | 164 Ų | 164 | 156.7 Ų | 156.7 | 77% | 0.766 | 84% | 0.835 | S | S | * | * | trans | 63.8 | 96.3 | 155.6 | -69.9 | -176.6 | 172.7 | 0 | 0 | 119.5 | ||||
| 534 | Q | 29.1 | Very low | 30.9 | Very low | 197 Ų | 197 | 160 Ų | 160 | 92% | 0.921 | 83% | 0.834 | S | S | * | * | -163.6 | 98.4 | 124.7 | -104.2 | 142.2 | 52 | 0 | 0 | 111.7 | |||||
| 535 | N | 31.3 | Very low | 31 | Very low | 162 Ų | 162 | 163.9 Ų | 163.9 | 87% | 0.866 | 83% | 0.832 | S | S | * | * | trans | -69.2 | 117.1 | 145.9 | -113.9 | -17.2 | 0 | 0 | 0 | 106 | ||||
| 536 | E | 30.1 | Very low | 31.1 | Very low | 186 Ų | 186 | 168.3 Ų | 168.3 | 87% | 0.869 | 84% | 0.839 | S | S | * | * | trans | -175.7 | 138.2 | 137.7 | -103.6 | 168.9 | -162.2 | 0 | 0 | 110.8 | ||||
| 537 | A | 30.8 | Very low | 31.1 | Very low | 81 Ų | 81 | 166 Ų | 166 | 67% | 0.669 | 84% | 0.836 | S | S | * | * | trans | 48.5 | 104.7 | 148.1 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 538 | D | 32.1 | Very low | 31.3 | Very low | 158 Ų | 158 | 167.9 Ų | 167.9 | 85% | 0.845 | 85% | 0.845 | S | S | * | * | 150.4 | 82.7 | 126.7 | -75.5 | -17.8 | 0 | 0 | 0 | 111.5 | |||||
| 539 | Q | 33.5 | Very low | 31.4 | Very low | 196 Ų | 196 | 167 Ų | 167 | 92% | 0.916 | 84% | 0.835 | S | S | * | * | trans | -151.4 | 61.2 | 156.2 | -146.6 | 150.5 | 73.9 | 0 | 0 | 111.2 | ||||
| 540 | W | 32.3 | Very low | 31.4 | Very low | 251 Ų | 251 | 165.9 Ų | 165.9 | 95% | 0.951 | 83% | 0.832 | S | S | * | * | trans | -134.4 | 89.1 | 161.3 | -107.1 | 9.6 | 0 | 0 | 0 | 108.1 | ||||
| 541 | N | 31.6 | Very low | 31.4 | Very low | 160 Ų | 160 | 163.7 Ų | 163.7 | 86% | 0.856 | 83% | 0.826 | S | S | * | * | trans | -169.1 | 95.1 | 150 | -107.7 | -7.8 | 0 | 0 | 0 | 108.8 | ||||
| 542 | D | 33.6 | Very low | 31.5 | Very low | 169 Ų | 169 | 160.7 Ų | 160.7 | 90% | 0.904 | 82% | 0.816 | S | S | * | * | trans | -147.8 | 88.1 | 155.2 | -95 | -21 | 0 | 0 | 0 | 105.9 | ||||
| 543 | A | 34.2 | Very low | 31.5 | Very low | 95 Ų | 95 | 158.7 Ų | 158.7 | 79% | 0.785 | 82% | 0.816 | S | S | * | * | trans | -146.1 | 85.9 | 164.9 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 544 | D | 31.8 | Very low | 31.6 | Very low | 151 Ų | 151 | 155.9 Ų | 155.9 | 81% | 0.807 | 81% | 0.814 | S | S | * | * | trans | -59.3 | 130 | 160.3 | -70.2 | -37.9 | 0 | 0 | 0 | 109 | ||||
| 545 | F | 32.3 | Very low | 31.5 | Very low | 184 Ų | 184 | 151.1 Ų | 151.1 | 81% | 0.807 | 80% | 0.803 | S | S | * | * | trans | -170.2 | 123.2 | 134 | -115.2 | -84.6 | 0 | 0 | 0 | 111.8 | ||||
| 546 | E | 33.2 | Very low | 31.5 | Very low | 170 Ų | 170 | 148.9 Ų | 148.9 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | 61.7 | 108.7 | 151 | -80.2 | 174.9 | 172 | 0 | 0 | 123.2 | ||||
| 547 | V | 30.6 | Very low | 31.5 | Very low | 124 Ų | 124 | 147.4 Ų | 147.4 | 75% | 0.752 | 79% | 0.793 | S | S | * | * | trans | -35.8 | 137.6 | 149.6 | 176.7 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 548 | I | 32 | Very low | 31.6 | Very low | 173 Ų | 173 | 148.8 Ų | 148.8 | 89% | 0.887 | 80% | 0.797 | S | S | * | * | trans | -150.2 | 135.5 | 132.9 | -88.5 | 146.8 | 0 | 0 | 0 | 108.1 | ||||
| 549 | E | 31.3 | Very low | 32.3 | Very low | 156 Ų | 156 | 146.6 Ų | 146.6 | 73% | 0.729 | 79% | 0.792 | S | S | * | * | trans | -76.8 | 156.3 | -168.9 | -69.5 | 172.5 | 143.5 | 0 | 0 | 116.5 | ||||
| 550 | M | 31.5 | Very low | 32.2 | Very low | 158 Ų | 158 | 142 Ų | 142 | 78% | 0.778 | 78% | 0.781 | S | S | * | * | trans | 60.9 | 142.5 | 142 | -70.4 | 168.1 | 115.2 | 0 | 0 | 118.4 | ||||
| 551 | D | 30.7 | Very low | 32.2 | Very low | 135 Ų | 135 | 139.9 Ų | 139.9 | 72% | 0.722 | 78% | 0.778 | S | S | * | * | cis | -163.1 | 164.3 | 38.5 | -135.6 | -20 | 0 | 0 | 0 | 111.6 | ||||
| 552 | D | 32.3 | Very low | 32.2 | Very low | 136 Ų | 136 | 135.5 Ų | 135.5 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | trans | -61.9 | 151.4 | -174.5 | -72.5 | -49 | 0 | 0 | 0 | 115.9 | ||||
| 553 | T | 29.5 | Very low | 32.1 | Very low | 127 Ų | 127 | 133 Ų | 133 | 78% | 0.779 | 77% | 0.767 | S | S | * | * | 162.1 | 123.6 | 106.5 | 37.1 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 554 | S | 29.6 | Very low | 32.2 | Very low | 104 Ų | 104 | 134.2 Ų | 134.2 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | trans | 47.2 | 138.1 | 134.9 | 77.5 | 0 | 0 | 0 | 0 | 120 | ||||
| 555 | S | 27.6 | Very low | 33.4 | Very low | 98 Ų | 98 | 132.6 Ų | 132.6 | 69% | 0.685 | 77% | 0.768 | S | S | * | * | cis | 169.8 | 161.9 | 1.2 | 44.6 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 556 | V | 32.1 | Very low | 34.7 | Very low | 114 Ų | 114 | 130 Ų | 130 | 69% | 0.691 | 77% | 0.769 | S | S | * | * | trans | 97.9 | 112.2 | 148.2 | -170.3 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 557 | N | 30.2 | Very low | 34.5 | Very low | 156 Ų | 156 | 126 Ų | 126 | 83% | 0.834 | 77% | 0.773 | S | S | * | * | trans | 91.6 | 113.2 | 137.6 | -72.8 | -6.1 | 0 | 0 | 0 | 124 | ||||
| 558 | S | 31.2 | Very low | 34.6 | Very low | 110 Ų | 110 | 123.9 Ų | 123.9 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | trans | -65.4 | -168.1 | 150.1 | -38.6 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 559 | P | 46.8 | Very low | 34.5 | Very low | 111 Ų | 111 | 119.5 Ų | 119.5 | 72% | 0.721 | 77% | 0.774 | S | S | * | * | cis | -146.4 | 176.6 | -4 | 41.1 | -20.8 | 0 | 0 | 0 | 118 | ||||
| 560 | S | 33 | Very low | 34.6 | Very low | 99 Ų | 99 | 116.6 Ų | 116.6 | 69% | 0.692 | 78% | 0.777 | S | S | * | * | 99.7 | 140.9 | 129.6 | 79.7 | 0 | 0 | 0 | 0 | 125.1 | |||||
| 561 | K | 31.7 | Very low | 34.7 | Very low | 207 Ų | 207 | 115.1 Ų | 115.1 | 90% | 0.9 | 78% | 0.776 | S | S | * | * | trans | 75.6 | 144.1 | 154.8 | -69 | 174.7 | 178.6 | 178.8 | 0 | 118.7 | ||||
| 562 | G | 30.4 | Very low | 34.8 | Very low | 68 Ų | 68 | 115 Ų | 115 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | cis | 141.6 | 125.7 | 5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 563 | S | 32.9 | Very low | 34.8 | Very low | 118 Ų | 118 | 114 Ų | 114 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | trans | 68.6 | 116.1 | 153.7 | 64.5 | 0 | 0 | 0 | 0 | 125.6 | ||||
| 564 | S | 34.9 | Very low | 35.7 | Very low | 120 Ų | 120 | 113.3 Ų | 113.3 | 84% | 0.839 | 78% | 0.782 | S | S | * | * | 74.6 | 154.8 | 121.5 | -54.4 | 0 | 0 | 0 | 0 | 125.5 | |||||
| 565 | P | 58.3 | Low | 35.8 | Very low | 117 Ų | 117 | 114.1 Ų | 114.1 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | trans | -114.3 | -147.4 | -154 | 46.7 | -33.5 | 0 | 0 | 0 | 113.6 | ||||
| 566 | P | 58.4 | Low | 36 | Very low | 130 Ų | 130 | 113.9 Ų | 113.9 | 84% | 0.844 | 79% | 0.792 | S | S | * | * | cis | -139 | -170.4 | -17.1 | 39.9 | -18.8 | 0 | 0 | 0 | 116.3 | ||||
| 567 | G | 30.4 | Very low | 36 | Very low | 84 Ų | 84 | 112.8 Ų | 112.8 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | trans | 127.3 | 149.3 | 157.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 568 | G | 31.2 | Very low | 36 | Very low | 81 Ų | 81 | 112.2 Ų | 112.2 | 84% | 0.835 | 79% | 0.791 | S | S | * | * | cis | 169.8 | 155.8 | -1.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 569 | G | 30.7 | Very low | 35.9 | Very low | 80 Ų | 80 | 113.8 Ų | 113.8 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | 68.9 | 100.3 | 147 | 0 | 0 | 0 | 0 | 0 | 125.1 | ||||
| 570 | A | 32.9 | Very low | 35.2 | Very low | 96 Ų | 96 | 113.6 Ų | 113.6 | 79% | 0.793 | 79% | 0.792 | S | S | * | * | 66.1 | 132.8 | 111.6 | 0 | 0 | 0 | 0 | 0 | 126.2 | |||||
| 571 | V | 34.2 | Very low | 35.9 | Very low | 126 Ų | 126 | 114.3 Ų | 114.3 | 76% | 0.764 | 79% | 0.794 | S | S | * | * | trans | 76.2 | 120.4 | 143.2 | -141 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 572 | T | 31.7 | Very low | 35.8 | Very low | 133 Ų | 133 | 111.2 Ų | 111.2 | 82% | 0.816 | 79% | 0.792 | S | S | * | * | 155.9 | 136 | 110.1 | 41.4 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 573 | S | 32.6 | Very low | 36 | Very low | 114 Ų | 114 | 111.6 Ų | 111.6 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -82.5 | 174.3 | 169.2 | -38.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 574 | P | 48.1 | Very low | 35.8 | Very low | 113 Ų | 113 | 113.9 Ų | 113.9 | 73% | 0.734 | 79% | 0.792 | S | S | * | * | -153 | 165.7 | 67.8 | 35.8 | -12.5 | 0 | 0 | 0 | 118.3 | |||||
| 575 | S | 32.2 | Very low | 35.7 | Very low | 121 Ų | 121 | 113.1 Ų | 113.1 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | trans | 42.2 | 144.3 | 136.8 | -51.5 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 576 | A | 31.9 | Very low | 35 | Very low | 94 Ų | 94 | 113 Ų | 113 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | cis | -172.4 | 164.6 | 13.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 577 | A | 31.3 | Very low | 33.7 | Very low | 91 Ų | 91 | 118.7 Ų | 118.7 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | trans | 67.7 | 145.5 | 149.9 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 578 | L | 30.3 | Very low | 33.5 | Very low | 144 Ų | 144 | 118.1 Ų | 118.1 | 75% | 0.754 | 79% | 0.785 | S | S | * | * | cis | -168.9 | 160.5 | 22.3 | -153.3 | 77.8 | 0 | 0 | 0 | 109.9 | ||||
| 579 | N | 30.3 | Very low | 33.6 | Very low | 143 Ų | 143 | 124.8 Ų | 124.8 | 77% | 0.765 | 79% | 0.79 | S | S | * | * | trans | 84 | 112.4 | 154.1 | -67.5 | -12.9 | 0 | 0 | 0 | 123.1 | ||||
| 580 | S | 32.3 | Very low | 33.5 | Very low | 107 Ų | 107 | 127.7 Ų | 127.7 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | trans | -77.7 | 176.2 | 142.7 | 57.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 581 | P | 47.2 | Very low | 33.2 | Very low | 114 Ų | 114 | 130.9 Ų | 130.9 | 74% | 0.74 | 79% | 0.785 | S | S | * | * | cis | -144.5 | -167.2 | 18.3 | 34.7 | -9.3 | 0 | 0 | 0 | 115.6 | ||||
| 582 | V | 30.4 | Very low | 33 | Very low | 141 Ų | 141 | 133 Ų | 133 | 86% | 0.855 | 79% | 0.791 | S | S | * | * | trans | 125.7 | 129.8 | 148.4 | -176.3 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 583 | A | 33 | Very low | 33 | Very low | 77 Ų | 77 | 132.3 Ų | 132.3 | 64% | 0.636 | 79% | 0.792 | S | S | * | * | trans | -72.5 | 154.4 | -179 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 584 | D | 29.9 | Very low | 33 | Very low | 166 Ų | 166 | 135 Ų | 135 | 89% | 0.888 | 80% | 0.796 | S | S | * | * | -177.2 | 137.5 | 121.5 | -97.7 | -22.6 | 0 | 0 | 0 | 112.1 | |||||
| 585 | S | 32.1 | Very low | 32.2 | Very low | 103 Ų | 103 | 136.8 Ų | 136.8 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | trans | -102.3 | 150.6 | 160.1 | -169.2 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 586 | P | 43.5 | Very low | 32.1 | Very low | 115 Ų | 115 | 142.9 Ų | 142.9 | 75% | 0.747 | 80% | 0.804 | S | S | * | * | -154 | 153 | 94.2 | 34.8 | -14 | 0 | 0 | 0 | 117.2 | |||||
| 587 | R | 31.9 | Very low | 32.3 | Very low | 250 Ų | 250 | 145.6 Ų | 145.6 | 94% | 0.943 | 80% | 0.801 | S | S | * | * | trans | 24.3 | 128.6 | 141 | -76 | 179.1 | 164.4 | -179.4 | -4.3 | 120.9 | ||||
| 588 | G | 26.5 | Very low | 32.4 | Very low | 72 Ų | 72 | 149.4 Ų | 149.4 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | 124 | 109.8 | 120.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 589 | K | 31.6 | Very low | 32.5 | Very low | 220 Ų | 220 | 153.8 Ų | 153.8 | 96% | 0.957 | 81% | 0.807 | S | S | * | * | trans | -160.3 | 121.9 | 135.2 | -110.1 | 170.1 | -171.4 | -177.3 | 0 | 112 | ||||
| 590 | L | 29.6 | Very low | 32.8 | Very low | 141 Ų | 141 | 158.2 Ų | 158.2 | 74% | 0.738 | 83% | 0.831 | S | S | * | * | trans | -83.6 | 156.9 | 174.5 | -158 | 82.8 | 0 | 0 | 0 | 108.7 | ||||
| 591 | Q | 27.6 | Very low | 32.9 | Very low | 163 Ų | 163 | 160.8 Ų | 160.8 | 76% | 0.762 | 84% | 0.835 | S | S | * | * | trans | 62.2 | 113.2 | 151.3 | -82.9 | 163.4 | -5.1 | 0 | 0 | 119 | ||||
| 592 | L | 29 | Very low | 32.1 | Very low | 170 Ų | 170 | 163.3 Ų | 163.3 | 89% | 0.89 | 84% | 0.84 | S | S | * | * | -178 | 149.2 | 118.4 | -105.7 | 141.6 | 0 | 0 | 0 | 111.7 | |||||
| 593 | S | 31.1 | Very low | 32.2 | Very low | 120 Ų | 120 | 164.5 Ų | 164.5 | 84% | 0.839 | 84% | 0.839 | S | S | * | * | trans | 90.1 | 61.4 | 165.9 | 71.6 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 594 | L | 32.4 | Very low | 32.2 | Very low | 170 Ų | 170 | 169.6 Ų | 169.6 | 89% | 0.89 | 85% | 0.851 | S | S | * | * | trans | -110.5 | 97.9 | 139.5 | -133.4 | 160 | 0 | 0 | 0 | 105.3 | ||||
| 595 | D | 31.6 | Very low | 32.3 | Very low | 150 Ų | 150 | 169.9 Ų | 169.9 | 80% | 0.802 | 85% | 0.849 | S | S | * | * | trans | 162.8 | 106.2 | 151.4 | -100.5 | -30.7 | 0 | 0 | 0 | 110.9 | ||||
| 596 | R | 29.7 | Very low | 32.3 | Very low | 249 Ų | 249 | 174.3 Ų | 174.3 | 94% | 0.94 | 86% | 0.857 | S | S | * | * | trans | -154 | 94.9 | 140.9 | -136.2 | 175 | 180 | 170.7 | -0.8 | 110.1 | ||||
| 597 | Q | 36.4 | Very low | 31.5 | Very low | 152 Ų | 152 | 178.6 Ų | 178.6 | 71% | 0.71 | 87% | 0.865 | S | S | * | * | trans | -81.6 | 151.4 | 166 | -135.4 | -168.3 | 22.1 | 0 | 0 | 110.1 | ||||
| 598 | K | 33.6 | Very low | 31.5 | Very low | 171 Ų | 171 | 173.1 Ų | 173.1 | 74% | 0.743 | 86% | 0.859 | S | S | * | * | trans | 71.2 | 105.3 | 152.9 | -69.4 | 174.1 | 176.3 | 174.7 | 0 | 119.4 | ||||
| 599 | R | 33.8 | Very low | 31.9 | Very low | 236 Ų | 236 | 181.5 Ų | 181.5 | 89% | 0.891 | 87% | 0.869 | S | S | * | * | -174 | 146.7 | 107.7 | -98.9 | 179.9 | -151.7 | 173.4 | 5.8 | 109.4 | |||||
| 600 | D | 36.4 | Very low | 31.9 | Very low | 236 Ų | 236 | 178 Ų | 178 | 100% | 1.262 | 86% | 0.861 | S | S | * | * | trans | 91.1 | 0 | 174.6 | -51.7 | -13.2 | 0 | 0 | 0 | 117.2 |
Retrieved 600 of 600 residues in 305 ms
(Link to these results)