| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.8 | Very low | 30.6 | Very low | 245 Ų | 245 | 162.6 Ų | 162.6 | 100% | 1.207 | 87% | 0.873 | S | S | * | * | 0 | 118.7 | 0 | -85.5 | 166 | 168.6 | 0 | 0 | 107.5 | |||||
| 2 | T | 32 | Very low | 30.7 | Very low | 126 Ų | 126 | 157.8 Ų | 157.8 | 77% | 0.773 | 87% | 0.872 | S | S | * | * | trans | -39.9 | 158.5 | 167.8 | 44.6 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 3 | D | 31.3 | Very low | 30.6 | Very low | 156 Ų | 156 | 150 Ų | 150 | 83% | 0.834 | 85% | 0.85 | S | S | * | * | cis | -171.4 | 152.5 | 43.8 | -124 | -32.2 | 0 | 0 | 0 | 114.3 | ||||
| 4 | G | 31.3 | Very low | 30.9 | Very low | 67 Ų | 67 | 146.9 Ų | 146.9 | 69% | 0.691 | 84% | 0.842 | S | S | * | * | trans | 81.4 | 140.4 | 153.8 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 5 | P | 34 | Very low | 30.9 | Very low | 121 Ų | 121 | 143 Ų | 143 | 79% | 0.786 | 84% | 0.835 | S | S | * | * | cis | -143.6 | 158.9 | 40 | 37.7 | -16.8 | 0 | 0 | 0 | 118.8 | ||||
| 6 | R | 28.2 | Very low | 30.7 | Very low | 247 Ų | 247 | 145.6 Ų | 145.6 | 93% | 0.932 | 83% | 0.833 | S | S | * | * | trans | 51.8 | 101.4 | 146 | -70.9 | 178.5 | 174.6 | 168.1 | -1.1 | 120 | ||||
| 7 | Q | 28.3 | Very low | 30.7 | Very low | 202 Ų | 202 | 144.9 Ų | 144.9 | 94% | 0.944 | 83% | 0.826 | S | S | * | * | trans | -73 | 125.1 | 156.5 | -87.2 | 173.2 | -26.9 | 0 | 0 | 111.7 | ||||
| 8 | R | 27.3 | Very low | 30.7 | Very low | 252 Ų | 252 | 141.4 Ų | 141.4 | 95% | 0.951 | 82% | 0.818 | S | S | * | * | trans | -110.2 | 109.7 | 149.5 | -93.1 | -177.7 | 172.1 | 179.8 | -2.5 | 106.6 | S10 | R8-S10 PolarHBondContact O-N 2.68Š| ||
| 9 | S | 26.7 | Very low | 30.5 | Very low | 122 Ų | 122 | 138.1 Ų | 138.1 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | trans | -76.5 | 115.9 | 168.6 | 47 | 0 | 0 | 0 | 0 | 109 | ||||
| 10 | S | 29.6 | Very low | 30.3 | Very low | 105 Ų | 105 | 135.4 Ų | 135.4 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | trans | -82.2 | 123.6 | 172.9 | 57.5 | 0 | 0 | 0 | 0 | 110.4 | R8 A12 | R8-S10 PolarHBondContact O-N 2.68Å; S10-A12 PolarHBondContact O-N 3.47Å | ||
| 11 | T | 33 | Very low | 30.3 | Very low | 146 Ų | 146 | 137.4 Ų | 137.4 | 90% | 0.896 | 80% | 0.804 | S | S | * | * | trans | -20.7 | 104.9 | 154.3 | 32.8 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 12 | A | 32 | Very low | 30 | Very low | 105 Ų | 105 | 135 Ų | 135 | 87% | 0.868 | 79% | 0.787 | S | S | * | * | trans | -134.2 | 30.9 | 166.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | S10 | S10-A12 PolarHBondContact O-N 3.47Š| ||
| 13 | G | 29.5 | Very low | 29.8 | Very low | 56 Ų | 56 | 138.5 Ų | 138.5 | 58% | 0.577 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -112.5 | -14.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 14 | S | 34.2 | Very low | 29.7 | Very low | 107 Ų | 107 | 136.3 Ų | 136.3 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -1.1 | -166.4 | -164.4 | 0 | 0 | 0 | 0 | 115.7 | ||
| 15 | A | 30.8 | Very low | 29.5 | Very low | 88 Ų | 88 | 137.6 Ų | 137.6 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.5 | -10.8 | -175 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 16 | K | 28.5 | Very low | 29.2 | Very low | 185 Ų | 185 | 134.6 Ų | 134.6 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -94.2 | -26.5 | 179.3 | -93 | -176.2 | 171.8 | -176.8 | 0 | 114.1 | ||
| 17 | D | 30.5 | Very low | 29.5 | Very low | 133 Ų | 133 | 128.9 Ų | 128.9 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | G | 310 helix | trans | -79.3 | -20.4 | 176.9 | -65.9 | -26.6 | 0 | 0 | 0 | 112.9 | A19 | D17-A19 VanDerWaalsContact C-N 3.31Å; D17-A19 PolarHBondContact O-N 2.82Å |
| 18 | A | 30 | Very low | 30 | Very low | 83 Ų | 83 | 123.1 Ų | 123.1 | 69% | 0.686 | 78% | 0.775 | S | S | * | * | G | 310 helix | trans | -80.9 | -7.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 19 | A | 27.6 | Very low | 31.2 | Very low | 78 Ų | 78 | 115.4 Ų | 115.4 | 65% | 0.645 | 75% | 0.752 | S | S | * | * | G | 310 helix | trans | -101.2 | -10.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | D17 | D17-A19 VanDerWaalsContact C-N 3.31Å; D17-A19 PolarHBondContact O-N 2.82Å |
| 20 | A | 27.2 | Very low | 32.5 | Very low | 83 Ų | 83 | 117.3 Ų | 117.3 | 69% | 0.686 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -94.7 | -9.2 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 21 | E | 29.4 | Very low | 34.4 | Very low | 178 Ų | 178 | 118.5 Ų | 118.5 | 83% | 0.832 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | 7.9 | -179.8 | -90.1 | -173.8 | 160.5 | 0 | 0 | 114.7 | ||
| 22 | K | 28.2 | Very low | 36.4 | Very low | 196 Ų | 196 | 118.6 Ų | 118.6 | 85% | 0.852 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | 3.1 | -178.2 | -97.3 | -174.3 | 177.6 | -178.7 | 0 | 116.2 | ||
| 23 | E | 29.1 | Very low | 38.5 | Very low | 198 Ų | 198 | 114.5 Ų | 114.5 | 93% | 0.925 | 69% | 0.69 | S | S | * | * | trans | -116.5 | 57.6 | 179.4 | -74.6 | -172.6 | 160 | 0 | 0 | 112.9 | ||||
| 24 | S | 28.2 | Very low | 41.2 | Very low | 110 Ų | 110 | 113.1 Ų | 113.1 | 77% | 0.769 | 68% | 0.676 | S | S | * | * | trans | -127.5 | 85.2 | 160.8 | 176.4 | 0 | 0 | 0 | 0 | 107.9 | G26 | S24-G26 PolarHBondContact O-N 2.97Š| ||
| 25 | G | 28 | Very low | 43.5 | Very low | 94 Ų | 94 | 110.2 Ų | 110.2 | 97% | 0.969 | 65% | 0.652 | S | S | * | * | trans | -76.2 | 63.4 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 26 | G | 26.7 | Very low | 45.9 | Very low | 58 Ų | 58 | 112.1 Ų | 112.1 | 60% | 0.598 | 66% | 0.655 | S | S | * | * | trans | -96.8 | 130 | 164.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | S24 A28 | S24-G26 PolarHBondContact O-N 2.97Å; G26-A28 VanDerWaalsContact C-N 3.33Å; G26-A28 PolarHBondContact O-N 3.42Å | ||
| 27 | V | 34.4 | Very low | 48.2 | Very low | 127 Ų | 127 | 106.3 Ų | 106.3 | 77% | 0.77 | 64% | 0.637 | S | S | * | * | trans | -67.2 | 95.9 | 167 | 179.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 28 | A | 40.2 | Very low | 50.6 | Low | 81 Ų | 81 | 100 Ų | 100 | 67% | 0.669 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 143.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | G26 K30 | G26-A28 VanDerWaalsContact C-N 3.33Å; G26-A28 PolarHBondContact O-N 3.42Å; A28-K30 PolarHBondContact O-N 3.4Å |
| 29 | L | 51.6 | Low | 53.1 | Low | 91 Ų | 91 | 97 Ų | 97 | 48% | 0.476 | 58% | 0.577 | S | S | . | * | P | Polyproline II helix | trans | -51.6 | 134.8 | 166.4 | -75.4 | 167.8 | 0 | 0 | 0 | 109.3 | K31 E249 E250 | L29-K31 PolarHBondContact O-N 3.35Å; L29-E249 HydrophobicContact CD1-CB 4.24Å; L29-E249 WeakPolarHBondContact CD1-OE2 3.3Å; L29-E250 HydrophobicContact CB-CG 4.31Å; L29-E250 HydrophobicContact CD1-CG 4.33Å |
| 30 | K | 54.7 | Low | 55.5 | Low | 161 Ų | 161 | 95.3 Ų | 95.3 | 70% | 0.7 | 57% | 0.567 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 125.4 | -179.2 | -72.9 | -175.6 | -179.9 | 175.6 | 0 | 109.7 | A28 E32 | A28-K30 PolarHBondContact O-N 3.4Å; K30-E32 HydrophobicContact CB-CG 3.91Å; K30-E32 WeakPolarHBondContact CD-OE1 3.4Å; K30-E32 PolarHBondContact O-N 2.74Å |
| 31 | K | 69.7 | Low | 57.9 | Low | 130 Ų | 130 | 93.6 Ų | 93.6 | 57% | 0.565 | 55% | 0.546 | S | S | * | . | trans | -75.2 | 89.6 | 173.7 | -65.8 | 179.4 | -179.4 | 176.8 | 0 | 110 | L29 E250 V252 | L29-K31 PolarHBondContact O-N 3.35Å; K31-E250 CarbonylContact C-O 3.16Å; K31-E250 WeakPolarHBondContact CA-O 3.28Å; K31-V252 HydrophobicContact CB-CG2 4.29Å; K31-V252 WeakPolarHBondContact O-CG2 3.22Å | ||
| 32 | E | 74.9 | Confident | 60.4 | Low | 148 Ų | 148 | 85.3 Ų | 85.3 | 69% | 0.692 | 51% | 0.507 | S | S | * | . | trans | -111 | -13.2 | -177 | -64 | -171.9 | 171.7 | 0 | 0 | 113.2 | K30 G34 E250 | K30-E32 HydrophobicContact CB-CG 3.91Å; K30-E32 WeakPolarHBondContact CD-OE1 3.4Å; K30-E32 PolarHBondContact O-N 2.74Å; E32-G34 PolarHBondContact O-N 2.94Å; E32-E250 PolarHBondContact N-O 2.96Å; E32-E250 VanDerWaalsContact N-O 3.12Å | ||
| 33 | I | 75.9 | Confident | 63 | Low | 19 Ų | 19 | 76.8 Ų | 76.8 | 10% | 0.097 | 47% | 0.472 | C | S | . | . | B | Isolated β-bridge | trans | -87.9 | 107.8 | -174.8 | -54.3 | 178.1 | 0 | 0 | 0 | 110 | A38 I41 V247 E250 L251 V252 | I33-A38 HydrophobicContact CG2-CB 4.14Å; I33-I41 HydrophobicContact CD1-CD1 4.04Å; I33-I41 HydrophobicContact CG2-CD1 3.84Å; I33-V247 HydrophobicContact CD1-CB 4.32Å; I33-V247 HydrophobicContact CD1-CG2 4.42Å; I33-E250 HydrophobicContact CD1-CB 3.76Å; I33-E250 HydrophobicContact CG1-CB 4.18Å; I33-E250 PolarHBondContact N-O 3.49Å; I33-L251 HydrophobicContact CB-CD1 4.27Å; I33-L251 HydrophobicContact CG2-CD1 3.91Å; I33-L251 WeakPolarHBondContact O-CD1 3.41Å; I33-V252 WeakPolarHBondContact O-CG2 3.43Å; I33-V252 PolarHBondContact O-N 3.21Å |
| 34 | G | 84.6 | Confident | 65.3 | Low | 27 Ų | 27 | 68 Ų | 68 | 28% | 0.278 | 43% | 0.434 | S | S | . | . | trans | -82.2 | 174.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | E32 V36 S37 A38 | E32-G34 PolarHBondContact O-N 2.94Å; G34-V36 PolarHBondContact O-N 2.87Å; G34-S37 WeakPolarHBondContact O-CB 3.45Å; G34-S37 PolarHBondContact O-N 2.94Å; G34-A38 WeakPolarHBondContact O-CB 3.36Å; G34-A38 PolarHBondContact O-N 3.04Å | ||
| 35 | L | 83.8 | Confident | 67.7 | Low | 47 Ų | 47 | 65.3 Ų | 65.3 | 25% | 0.246 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -56.9 | -47 | -176.1 | 179.1 | 63.5 | 0 | 0 | 0 | 114.1 | S37 A38 C39 N257 R260 A261 | L35-S37 VanDerWaalsContact C-N 3.32Å; L35-S37 PolarHBondContact O-N 3.27Å; L35-A38 WeakPolarHBondContact O-CB 3.43Å; L35-A38 PolarHBondContact O-N 3.48Å; L35-C39 PolarHBondContact O-N 2.92Å; L35-C39 PolarHBondContact O-SG 2.9Å; L35-C39 VanDerWaalsContact O-SG 3.35Å; L35-N257 HydrophobicContact CB-CB 4.5Å; L35-N257 HydrophobicContact CD1-CB 4.15Å; L35-N257 WeakPolarHBondContact CD1-O 3.41Å; L35-R260 HydrophobicContact CD1-CB 3.83Å; L35-R260 HydrophobicContact CD2-CB 4.49Å; L35-A261 HydrophobicContact CD1-CB 4.03Å |
| 36 | V | 80.6 | Confident | 70.4 | Confident | 128 Ų | 128 | 61 Ų | 61 | 78% | 0.776 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -65.5 | -40.1 | -179 | 179.2 | 0 | 0 | 0 | 0 | 110.8 | G34 C39 G40 | G34-V36 PolarHBondContact O-N 2.87Å; V36-C39 PolarHBondContact O-N 3.15Å; V36-G40 PolarHBondContact O-N 3.49Å |
| 37 | S | 77.8 | Confident | 73.2 | Confident | 63 Ų | 63 | 58.5 Ų | 58.5 | 44% | 0.441 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63 | -44.5 | 174.1 | -172.4 | 0 | 0 | 0 | 0 | 110.6 | G34 L35 C39 G40 I41 | G34-S37 WeakPolarHBondContact O-CB 3.45Å; G34-S37 PolarHBondContact O-N 2.94Å; L35-S37 VanDerWaalsContact C-N 3.32Å; L35-S37 PolarHBondContact O-N 3.27Å; S37-C39 PolarHBondContact O-N 3.14Å; S37-G40 CarbonylContact O-C 3.59Å; S37-G40 WeakPolarHBondContact O-CA 3.05Å; S37-G40 PolarHBondContact O-N 2.9Å; S37-G40 VanDerWaalsContact O-N 3.12Å; S37-I41 VanDerWaalsContact O-CG1 3.27Å; S37-I41 WeakPolarHBondContact O-CG1 3.42Å; S37-I41 PolarHBondContact O-N 3.25Å |
| 38 | A | 79.9 | Confident | 75.3 | Confident | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.2 | -43.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | I33 G34 L35 I41 I42 L244 L251 A261 | I33-A38 HydrophobicContact CG2-CB 4.14Å; G34-A38 WeakPolarHBondContact O-CB 3.36Å; G34-A38 PolarHBondContact O-N 3.04Å; L35-A38 WeakPolarHBondContact O-CB 3.43Å; L35-A38 PolarHBondContact O-N 3.48Å; A38-I41 PolarHBondContact O-N 2.9Å; A38-I42 WeakPolarHBondContact O-CG1 3.2Å; A38-I42 PolarHBondContact O-N 3.5Å; A38-L244 HydrophobicContact CB-CD1 4.07Å; A38-L244 HydrophobicContact CB-CD2 4.19Å; A38-L251 HydrophobicContact CB-CD1 3.6Å; A38-A261 HydrophobicContact CB-CB 4.08Å |
| 39 | C | 83.4 | Confident | 77.1 | Confident | 19 Ų | 19 | 49.5 Ų | 49.5 | 13% | 0.128 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 172.5 | -67 | 0 | 0 | 0 | 0 | 111.4 | L35 V36 S37 I41 I42 V43 S265 | L35-C39 PolarHBondContact O-N 2.92Å; L35-C39 PolarHBondContact O-SG 2.9Å; L35-C39 VanDerWaalsContact O-SG 3.35Å; V36-C39 PolarHBondContact O-N 3.15Å; S37-C39 PolarHBondContact O-N 3.14Å; C39-I41 VanDerWaalsContact C-N 3.29Å; C39-I41 PolarHBondContact O-N 3.41Å; C39-I42 PolarHBondContact O-N 2.83Å; C39-V43 WeakPolarHBondContact O-CB 3.37Å; C39-V43 VanDerWaalsContact O-CG2 3.29Å; C39-V43 WeakPolarHBondContact O-CG2 3.47Å; C39-V43 PolarHBondContact O-N 3.2Å; C39-S265 WeakPolarHBondContact CA-OG 3.04Å |
| 40 | G | 77.6 | Confident | 78.7 | Confident | 43 Ų | 43 | 45.4 Ų | 45.4 | 44% | 0.443 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -59.8 | -38 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113 | V36 S37 G44 | V36-G40 PolarHBondContact O-N 3.49Å; S37-G40 CarbonylContact O-C 3.59Å; S37-G40 WeakPolarHBondContact O-CA 3.05Å; S37-G40 PolarHBondContact O-N 2.9Å; S37-G40 VanDerWaalsContact O-N 3.12Å; G40-G44 VanDerWaalsContact O-CA 3.3Å; G40-G44 WeakPolarHBondContact O-CA 3.33Å; G40-G44 PolarHBondContact O-N 2.99Å |
| 41 | I | 77.5 | Confident | 80.4 | Confident | 47 Ų | 47 | 37.7 Ų | 37.7 | 24% | 0.241 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.6 | -45.8 | 175.1 | -68.9 | 165.4 | 0 | 0 | 0 | 110.7 | I33 S37 A38 C39 N45 L244 | I33-I41 HydrophobicContact CD1-CD1 4.04Å; I33-I41 HydrophobicContact CG2-CD1 3.84Å; S37-I41 VanDerWaalsContact O-CG1 3.27Å; S37-I41 WeakPolarHBondContact O-CG1 3.42Å; S37-I41 PolarHBondContact O-N 3.25Å; A38-I41 PolarHBondContact O-N 2.9Å; C39-I41 VanDerWaalsContact C-N 3.29Å; C39-I41 PolarHBondContact O-N 3.41Å; I41-N45 WeakPolarHBondContact CG2-ND2 3.27Å; I41-N45 VanDerWaalsContact O-CB 3.28Å; I41-N45 WeakPolarHBondContact O-CB 3.39Å; I41-N45 VanDerWaalsContact O-CG 3.25Å; I41-N45 PolarHBondContact O-N 3.46Å; I41-N45 PolarHBondContact O-ND2 2.85Å; I41-L244 HydrophobicContact CG2-CD1 4.4Å |
| 42 | I | 82.1 | Confident | 81.4 | Confident | 4 Ų | 4 | 31.7 Ų | 31.7 | 2% | 0.021 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.6 | -56.1 | 177.3 | -64.7 | 169.8 | 0 | 0 | 0 | 110 | A38 C39 G44 N45 I46 L244 A261 I262 S265 | A38-I42 WeakPolarHBondContact O-CG1 3.2Å; A38-I42 PolarHBondContact O-N 3.5Å; C39-I42 PolarHBondContact O-N 2.83Å; I42-G44 VanDerWaalsContact C-N 3.28Å; I42-G44 PolarHBondContact O-N 3.42Å; I42-N45 PolarHBondContact O-N 2.81Å; I42-N45 VanDerWaalsContact O-N 3.15Å; I42-I46 HydrophobicContact CG2-CD1 3.42Å; I42-I46 VanDerWaalsContact CG2-CD1 3.42Å; I42-I46 HydrophobicContact CG2-CG1 4.12Å; I42-I46 WeakPolarHBondContact O-CG1 3.45Å; I42-I46 PolarHBondContact O-N 3.47Å; I42-L244 HydrophobicContact CD1-CB 4.48Å; I42-L244 HydrophobicContact CD1-CD2 3.55Å; I42-L244 HydrophobicContact CG1-CB 4.03Å; I42-L244 HydrophobicContact CG1-CD2 3.82Å; I42-L244 HydrophobicContact CG1-CG 4.38Å; I42-A261 HydrophobicContact CD1-CB 3.75Å; I42-I262 HydrophobicContact CD1-CG1 4.21Å; I42-S265 VanDerWaalsContact CG2-CB 3.48Å |
| 43 | V | 83.3 | Confident | 82 | Confident | 18 Ų | 18 | 24.9 Ų | 24.9 | 11% | 0.109 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60.4 | -42.6 | -177.9 | 176.1 | 0 | 0 | 0 | 0 | 110.2 | C39 N45 I47 L268 V269 | C39-V43 WeakPolarHBondContact O-CB 3.37Å; C39-V43 VanDerWaalsContact O-CG2 3.29Å; C39-V43 WeakPolarHBondContact O-CG2 3.47Å; C39-V43 PolarHBondContact O-N 3.2Å; V43-N45 VanDerWaalsContact C-N 3.33Å; V43-N45 PolarHBondContact O-N 3.27Å; V43-I47 HydrophobicContact CG1-CD1 3.52Å; V43-I47 HydrophobicContact CG1-CG1 4.08Å; V43-I47 WeakPolarHBondContact O-CB 3.33Å; V43-I47 VanDerWaalsContact O-CG1 3.31Å; V43-I47 WeakPolarHBondContact O-CG1 3.3Å; V43-I47 PolarHBondContact O-N 2.94Å; V43-L268 HydrophobicContact CG2-CD2 4.11Å; V43-V269 HydrophobicContact CG1-CG2 4.38Å; V43-V269 HydrophobicContact CG2-CG2 4.3Å |
| 44 | G | 77.3 | Confident | 82.8 | Confident | 12 Ų | 12 | 24 Ų | 24 | 12% | 0.124 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -67.2 | -28.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | G40 I42 K187 | G40-G44 VanDerWaalsContact O-CA 3.3Å; G40-G44 WeakPolarHBondContact O-CA 3.33Å; G40-G44 PolarHBondContact O-N 2.99Å; I42-G44 VanDerWaalsContact C-N 3.28Å; I42-G44 PolarHBondContact O-N 3.42Å; G44-K187 PolarHBondContact O-NZ 3.28Å |
| 45 | N | 77.5 | Confident | 83.2 | Confident | 55 Ų | 55 | 22.7 Ų | 22.7 | 29% | 0.294 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -88.3 | -36.6 | 176.6 | -73 | -34.5 | 0 | 0 | 0 | 112.6 | I41 I42 V43 F243 | I41-N45 WeakPolarHBondContact CG2-ND2 3.27Å; I41-N45 VanDerWaalsContact O-CB 3.28Å; I41-N45 WeakPolarHBondContact O-CB 3.39Å; I41-N45 VanDerWaalsContact O-CG 3.25Å; I41-N45 PolarHBondContact O-N 3.46Å; I41-N45 PolarHBondContact O-ND2 2.85Å; I42-N45 PolarHBondContact O-N 2.81Å; I42-N45 VanDerWaalsContact O-N 3.15Å; V43-N45 VanDerWaalsContact C-N 3.33Å; V43-N45 PolarHBondContact O-N 3.27Å; N45-F243 HydrophobicContact CB-CD2 4.07Å |
| 46 | I | 85.3 | Confident | 83.6 | Confident | 4 Ų | 4 | 21.7 Ų | 21.7 | 2% | 0.021 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -71.1 | -49.4 | 177.3 | -61.1 | 173.8 | 0 | 0 | 0 | 110.6 | I42 G48 Y238 W241 I266 V269 Y273 | I42-I46 HydrophobicContact CG2-CD1 3.42Å; I42-I46 VanDerWaalsContact CG2-CD1 3.42Å; I42-I46 HydrophobicContact CG2-CG1 4.12Å; I42-I46 WeakPolarHBondContact O-CG1 3.45Å; I42-I46 PolarHBondContact O-N 3.47Å; I46-G48 VanDerWaalsContact C-N 3.29Å; I46-G48 PolarHBondContact O-N 2.86Å; I46-Y238 HydrophobicContact CG2-CD1 4.5Å; I46-Y238 WeakPolarHBondContact CG2-O 3.45Å; I46-W241 HydrophobicContact CD1-CB 3.69Å; I46-W241 HydrophobicContact CG1-CB 4.13Å; I46-I266 HydrophobicContact CD1-CG1 4.33Å; I46-V269 HydrophobicContact CB-CG1 4.5Å; I46-V269 HydrophobicContact CB-CG2 4.31Å; I46-V269 HydrophobicContact CD1-CG2 4.49Å; I46-V269 HydrophobicContact CG2-CG1 3.66Å; I46-V269 HydrophobicContact CG2-CG2 4.33Å; I46-Y273 HydrophobicContact CG2-CE2 4.45Å; I46-Y273 PolarHBondContact O-OH 3.39Å |
| 47 | I | 85.1 | Confident | 84.1 | Confident | 4 Ų | 4 | 15.6 Ų | 15.6 | 2% | 0.021 | 11% | 0.107 | C | C | . | . | S | Bend | trans | -71.6 | 91.3 | 176.6 | -57.4 | -174.7 | 0 | 0 | 0 | 108.2 | V43 K187 L188 L191 V269 V272 Y273 | V43-I47 HydrophobicContact CG1-CD1 3.52Å; V43-I47 HydrophobicContact CG1-CG1 4.08Å; V43-I47 WeakPolarHBondContact O-CB 3.33Å; V43-I47 VanDerWaalsContact O-CG1 3.31Å; V43-I47 WeakPolarHBondContact O-CG1 3.3Å; V43-I47 PolarHBondContact O-N 2.94Å; I47-K187 HydrophobicContact CG2-CD 4.44Å; I47-K187 VanDerWaalsContact O-CD 3.29Å; I47-K187 WeakPolarHBondContact O-CD 3.18Å; I47-K187 WeakPolarHBondContact O-CE 3.42Å; I47-K187 PolarHBondContact O-NZ 3.37Å; I47-L188 HydrophobicContact CD1-CD2 4.4Å; I47-L191 HydrophobicContact CG2-CD1 3.27Å; I47-V269 HydrophobicContact CD1-CG2 4.19Å; I47-V269 HydrophobicContact CG1-CG1 4.26Å; I47-V269 HydrophobicContact CG1-CG2 3.9Å; I47-V272 HydrophobicContact CD1-CG1 4.31Å; I47-Y273 WeakPolarHBondContact CA-OH 3.37Å; I47-Y273 HydrophobicContact CG1-CE1 4.18Å |
| 48 | G | 79.6 | Confident | 84.8 | Confident | 15 Ų | 15 | 12.6 Ų | 12.6 | 16% | 0.155 | 9% | 0.086 | C | C | . | . | S | Bend | trans | -120.4 | -145.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | I46 G50 | I46-G48 VanDerWaalsContact C-N 3.29Å; I46-G48 PolarHBondContact O-N 2.86Å; G48-G50 VanDerWaalsContact C-N 3.31Å |
| 49 | S | 77.1 | Confident | 85.5 | Confident | 4 Ų | 4 | 12.9 Ų | 12.9 | 3% | 0.028 | 9% | 0.087 | C | C | . | . | S | Bend | trans | -79.6 | -12 | 176.7 | 60.5 | 0 | 0 | 0 | 0 | 113.9 | I51 F52 V53 I131 | S49-I51 VanDerWaalsContact C-N 3.29Å; S49-I51 PolarHBondContact O-N 2.77Å; S49-F52 WeakPolarHBondContact O-CB 3.48Å; S49-F52 PolarHBondContact O-N 3.43Å; S49-V53 PolarHBondContact O-N 3.42Å; S49-I131 WeakPolarHBondContact OG-CG1 3.29Å |
| 50 | G | 86 | Confident | 85.8 | Confident | 5 Ų | 5 | 16.6 Ų | 16.6 | 5% | 0.052 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -59.1 | -36.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | G48 F52 V53 S54 | G48-G50 VanDerWaalsContact C-N 3.31Å; G50-F52 PolarHBondContact O-N 3.45Å; G50-F52 VanDerWaalsContact O-N 3.16Å; G50-V53 PolarHBondContact O-N 2.77Å; G50-S54 VanDerWaalsContact O-CB 3.31Å; G50-S54 WeakPolarHBondContact O-CB 3.43Å; G50-S54 PolarHBondContact O-N 3.47Å; G50-S54 PolarHBondContact O-OG 2.79Å |
| 51 | I | 90.5 | Very high | 86.5 | Confident | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -66.2 | -15.9 | 176.6 | -167.2 | 53 | 0 | 0 | 0 | 114 | S49 P55 W72 L191 Y273 A276 | S49-I51 VanDerWaalsContact C-N 3.29Å; S49-I51 PolarHBondContact O-N 2.77Å; I51-P55 VanDerWaalsContact O-CD 3.26Å; I51-P55 WeakPolarHBondContact O-CD 3.34Å; I51-P55 WeakPolarHBondContact O-CG 3.33Å; I51-W72 HydrophobicContact CD1-CH2 3.79Å; I51-W72 HydrophobicContact CD1-CZ2 4.24Å; I51-W72 HydrophobicContact CD1-CZ3 4.15Å; I51-L191 HydrophobicContact CG1-CD2 4.25Å; I51-L191 HydrophobicContact CG2-CD1 4.48Å; I51-L191 HydrophobicContact CG2-CD2 3.95Å; I51-Y273 HydrophobicContact CB-CD1 4.07Å; I51-Y273 HydrophobicContact CB-CE1 3.76Å; I51-Y273 HydrophobicContact CD1-CD1 3.62Å; I51-Y273 HydrophobicContact CD1-CE1 4.19Å; I51-Y273 HydrophobicContact CD1-CG 3.81Å; I51-Y273 HydrophobicContact CG1-CD1 3.71Å; I51-Y273 HydrophobicContact CG1-CE1 3.95Å; I51-Y273 HydrophobicContact CG1-CG 4.42Å; I51-Y273 HydrophobicContact CG2-CE1 4.36Å; I51-A276 HydrophobicContact CD1-CB 4.39Å; I51-A276 HydrophobicContact CG1-CB 4.3Å |
| 52 | F | 88.9 | Confident | 87.1 | Confident | 3 Ų | 3 | 13 Ų | 13 | 1% | 0.013 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -90.8 | -19.6 | 175.7 | -58.9 | -55.8 | 0 | 0 | 0 | 112 | S49 G50 Y138 L191 I194 A296 V315 | S49-F52 WeakPolarHBondContact O-CB 3.48Å; S49-F52 PolarHBondContact O-N 3.43Å; G50-F52 PolarHBondContact O-N 3.45Å; G50-F52 VanDerWaalsContact O-N 3.16Å; F52-Y138 HydrophobicContact CB-CE1 4.38Å; F52-Y138 HydrophobicContact CB-CE2 4.27Å; F52-Y138 WeakPolarHBondContact CB-OH 3.27Å; F52-Y138 PolarHBondContact O-OH 2.92Å; F52-L191 HydrophobicContact CE1-CD2 4.27Å; F52-L191 HydrophobicContact CZ-CD2 4.27Å; F52-L191 HydrophobicContact CZ-CG 4.43Å; F52-I194 HydrophobicContact CE1-CD1 3.99Å; F52-A296 HydrophobicContact CD1-CB 3.75Å; F52-A296 HydrophobicContact CE1-CB 4.16Å; F52-V315 HydrophobicContact CB-CG1 4.15Å; F52-V315 HydrophobicContact CD1-CG1 4.46Å; F52-V315 HydrophobicContact CD1-CG2 3.84Å; F52-V315 HydrophobicContact CD2-CB 4.38Å; F52-V315 HydrophobicContact CD2-CG1 3.59Å; F52-V315 HydrophobicContact CD2-CG2 4.12Å; F52-V315 HydrophobicContact CE1-CG2 3.75Å; F52-V315 HydrophobicContact CE2-CB 4.45Å; F52-V315 HydrophobicContact CE2-CG1 4.1Å; F52-V315 HydrophobicContact CE2-CG2 4.04Å; F52-V315 HydrophobicContact CG-CG1 3.81Å; F52-V315 HydrophobicContact CG-CG2 4.03Å; F52-V315 HydrophobicContact CZ-CG2 3.86Å |
| 53 | V | 88.4 | Confident | 87.4 | Confident | 5 Ų | 5 | 13 Ų | 13 | 3% | 0.03 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -105.9 | -52.4 | -174.2 | 176.4 | 0 | 0 | 0 | 0 | 112 | S49 G50 K56 T134 M377 Y378 I381 | S49-V53 PolarHBondContact O-N 3.42Å; G50-V53 PolarHBondContact O-N 2.77Å; V53-K56 PolarHBondContact O-N 2.98Å; V53-T134 HydrophobicContact CG2-CG2 3.48Å; V53-T134 VanDerWaalsContact CG2-CG2 3.48Å; V53-T134 WeakPolarHBondContact CG2-OG1 3.16Å; V53-M377 HydrophobicContact CB-CE 4.02Å; V53-M377 HydrophobicContact CG1-CE 3.34Å; V53-M377 HydrophobicContact CG2-CE 3.42Å; V53-M377 VanDerWaalsContact CG2-CE 3.42Å; V53-Y378 HydrophobicContact CG1-CE1 4.15Å; V53-I381 HydrophobicContact CG1-CD1 3.66Å |
| 54 | S | 92.1 | Very high | 87.8 | Confident | 0 Ų | 0 | 12.1 Ų | 12.1 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -59.7 | -32.2 | -173.3 | -63.7 | 0 | 0 | 0 | 0 | 114.7 | G50 K56 G57 V58 Q233 | G50-S54 VanDerWaalsContact O-CB 3.31Å; G50-S54 WeakPolarHBondContact O-CB 3.43Å; G50-S54 PolarHBondContact O-N 3.47Å; G50-S54 PolarHBondContact O-OG 2.79Å; S54-K56 PolarHBondContact O-N 3.49Å; S54-G57 PolarHBondContact O-N 3.36Å; S54-V58 WeakPolarHBondContact O-CB 3.34Å; S54-V58 WeakPolarHBondContact O-CG2 3.37Å; S54-V58 PolarHBondContact O-N 3.11Å; S54-Q233 WeakPolarHBondContact CB-O 3.4Å; S54-Q233 PolarHBondContact OG-O 3.36Å |
| 55 | P | 94.1 | Very high | 88.6 | Confident | 1 Ų | 1 | 11.6 Ų | 11.6 | 1% | 0.006 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -53.5 | -40.5 | 179.2 | -29.7 | 36.3 | 0 | 0 | 0 | 113.8 | I51 M59 W72 N277 Y280 | I51-P55 VanDerWaalsContact O-CD 3.26Å; I51-P55 WeakPolarHBondContact O-CD 3.34Å; I51-P55 WeakPolarHBondContact O-CG 3.33Å; P55-M59 WeakPolarHBondContact O-CB 3.23Å; P55-M59 PolarHBondContact O-N 2.87Å; P55-W72 HydrophobicContact CG-CZ2 4.19Å; P55-N277 WeakPolarHBondContact CB-OD1 3.39Å; P55-Y280 HydrophobicContact CB-CD2 4.22Å; P55-Y280 HydrophobicContact CB-CE2 4.37Å; P55-Y280 HydrophobicContact CG-CD2 4.18Å; P55-Y280 HydrophobicContact CG-CE2 3.86Å |
| 56 | K | 92.2 | Very high | 89.3 | Confident | 26 Ų | 26 | 9.2 Ų | 9.2 | 11% | 0.113 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -62.4 | -56.9 | 179.8 | 169.3 | 163.3 | 172.5 | 171.6 | 0 | 111.8 | V53 S54 M59 E60 L289 L290 S292 N293 V295 Y378 | V53-K56 PolarHBondContact O-N 2.98Å; S54-K56 PolarHBondContact O-N 3.49Å; K56-M59 WeakPolarHBondContact O-CB 3.17Å; K56-M59 PolarHBondContact O-N 3.12Å; K56-E60 WeakPolarHBondContact O-CB 3.29Å; K56-E60 PolarHBondContact O-N 2.97Å; K56-L289 HydrophobicContact CB-CD2 4.3Å; K56-L290 WeakPolarHBondContact CE-O 3.5Å; K56-L290 PolarHBondContact NZ-O 3.23Å; K56-L290 WeakPolarHBondContact O-CD2 3.41Å; K56-S292 WeakPolarHBondContact CD-O 3.43Å; K56-S292 PolarHBondContact NZ-O 3.12Å; K56-N293 PolarHBondContact NZ-OD1 3.37Å; K56-V295 HydrophobicContact CB-CG2 4.21Å; K56-Y378 WeakPolarHBondContact CD-OH 3.39Å |
| 57 | G | 90.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 10.7 Ų | 10.7 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -81.6 | -16.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | S54 N61 | S54-G57 PolarHBondContact O-N 3.36Å; G57-N61 VanDerWaalsContact O-CB 3.32Å; G57-N61 WeakPolarHBondContact O-CB 3.46Å; G57-N61 PolarHBondContact O-N 3.1Å; G57-N61 VanDerWaalsContact O-N 3.13Å; G57-N61 PolarHBondContact O-ND2 2.82Å |
| 58 | V | 93.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 10.7 Ų | 10.7 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -65.8 | -45.4 | 162.8 | 173.8 | 0 | 0 | 0 | 0 | 109.9 | S54 N61 A62 A68 V71 W72 Q233 | S54-V58 WeakPolarHBondContact O-CB 3.34Å; S54-V58 WeakPolarHBondContact O-CG2 3.37Å; S54-V58 PolarHBondContact O-N 3.11Å; V58-N61 PolarHBondContact O-N 3.48Å; V58-A62 WeakPolarHBondContact O-CB 3.24Å; V58-A62 PolarHBondContact O-N 3.32Å; V58-A68 HydrophobicContact CG1-CB 4.08Å; V58-V71 HydrophobicContact CG1-CB 4.3Å; V58-V71 HydrophobicContact CG1-CG1 4.04Å; V58-W72 HydrophobicContact CG2-CZ2 4.37Å; V58-Q233 HydrophobicContact CG2-CB 3.96Å |
| 59 | M | 93.4 | Very high | 90.9 | Very high | 6 Ų | 6 | 11.4 Ų | 11.4 | 3% | 0.03 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -63 | -42.7 | 177.3 | -170.3 | 68.2 | 65.1 | 0 | 0 | 111.7 | P55 K56 N61 S63 V65 A68 V281 L289 L290 | P55-M59 WeakPolarHBondContact O-CB 3.23Å; P55-M59 PolarHBondContact O-N 2.87Å; K56-M59 WeakPolarHBondContact O-CB 3.17Å; K56-M59 PolarHBondContact O-N 3.12Å; M59-N61 VanDerWaalsContact C-N 3.34Å; M59-N61 PolarHBondContact O-N 3.22Å; M59-S63 PolarHBondContact O-N 3.11Å; M59-V65 HydrophobicContact CE-CG2 4.2Å; M59-V65 HydrophobicContact SD-CB 4.48Å; M59-V65 HydrophobicContact SD-CG2 3.96Å; M59-A68 HydrophobicContact CE-CB 4.12Å; M59-A68 HydrophobicContact SD-CB 4.09Å; M59-V281 HydrophobicContact CE-CG1 3.85Å; M59-L289 HydrophobicContact CB-CD2 3.97Å; M59-L289 HydrophobicContact CG-CD2 4.25Å; M59-L290 HydrophobicContact CB-CD2 4.08Å; M59-L290 HydrophobicContact CG-CD2 4.19Å; M59-L290 HydrophobicContact CG-CG 4.43Å |
| 60 | E | 91.3 | Very high | 91.8 | Very high | 97 Ų | 97 | 14.3 Ų | 14.3 | 45% | 0.453 | 8% | 0.075 | S | C | . | . | H | α-helix | trans | -60.6 | -42.9 | 179.1 | -171.1 | 173.9 | -159.4 | 0 | 0 | 111.8 | K56 Q220 L290 | K56-E60 WeakPolarHBondContact O-CB 3.29Å; K56-E60 PolarHBondContact O-N 2.97Å; E60-Q220 PolarHBondContact O-NE2 3.07Å; E60-L290 HydrophobicContact CB-CD2 3.68Å; E60-L290 HydrophobicContact CG-CD2 4.38Å |
| 61 | N | 90.8 | Very high | 92.3 | Very high | 15 Ų | 15 | 14.2 Ų | 14.2 | 8% | 0.08 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -88.7 | -23.9 | -175.8 | -73.4 | -60.6 | 0 | 0 | 0 | 113.8 | G57 V58 M59 L226 L229 A230 Q233 | G57-N61 VanDerWaalsContact O-CB 3.32Å; G57-N61 WeakPolarHBondContact O-CB 3.46Å; G57-N61 PolarHBondContact O-N 3.1Å; G57-N61 VanDerWaalsContact O-N 3.13Å; G57-N61 PolarHBondContact O-ND2 2.82Å; V58-N61 PolarHBondContact O-N 3.48Å; M59-N61 VanDerWaalsContact C-N 3.34Å; M59-N61 PolarHBondContact O-N 3.22Å; N61-L226 WeakPolarHBondContact CB-O 3.35Å; N61-L226 CarbonylContact O-C 3.59Å; N61-L226 WeakPolarHBondContact O-CB 3.09Å; N61-L229 HydrophobicContact CB-CB 4.44Å; N61-A230 HydrophobicContact CB-CB 3.71Å; N61-Q233 PolarHBondContact ND2-NE2 3.47Å; N61-Q233 VanDerWaalsContact ND2-NE2 3.12Å |
| 62 | A | 90.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -83.5 | -13.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | V58 S64 L67 A68 A230 | V58-A62 WeakPolarHBondContact O-CB 3.24Å; V58-A62 PolarHBondContact O-N 3.32Å; A62-S64 PolarHBondContact O-N 3.36Å; A62-L67 HydrophobicContact CB-CB 4.37Å; A62-L67 HydrophobicContact CB-CG 4.34Å; A62-L67 WeakPolarHBondContact O-CD2 3.21Å; A62-A68 HydrophobicContact CB-CB 3.96Å; A62-A230 HydrophobicContact CB-CB 4.37Å |
| 63 | S | 88.4 | Confident | 92.9 | Very high | 2 Ų | 2 | 17.6 Ų | 17.6 | 1% | 0.014 | 9% | 0.09 | C | C | . | . | trans | 63.8 | -10 | 174.6 | -48.7 | 0 | 0 | 0 | 0 | 116.6 | M59 P218 F219 Q220 | M59-S63 PolarHBondContact O-N 3.11Å; S63-P218 CarbonylContact O-C 3.56Å; S63-P218 WeakPolarHBondContact O-CA 3.43Å; S63-F219 WeakPolarHBondContact O-CD2 3.43Å; S63-F219 PolarHBondContact O-N 3.47Å; S63-Q220 WeakPolarHBondContact CB-O 3.47Å; S63-Q220 WeakPolarHBondContact OG-CG 3.48Å; S63-Q220 PolarHBondContact OG-NE2 3.48Å | ||
| 64 | S | 92.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.104 | C | C | . | . | S | Bend | trans | -150.5 | 154.5 | 175.2 | 68.2 | 0 | 0 | 0 | 0 | 111.8 | A62 L67 A68 Y222 | A62-S64 PolarHBondContact O-N 3.36Å; S64-L67 PolarHBondContact O-N 3.41Å; S64-L67 VanDerWaalsContact OG-CB 3.22Å; S64-L67 WeakPolarHBondContact OG-CB 3.46Å; S64-L67 PolarHBondContact OG-N 3.21Å; S64-A68 WeakPolarHBondContact O-CB 3.39Å; S64-A68 PolarHBondContact O-N 3.08Å; S64-Y222 WeakPolarHBondContact CB-OH 3.45Å; S64-Y222 PolarHBondContact OG-OH 2.95Å |
| 65 | V | 93.1 | Very high | 93.4 | Very high | 1 Ų | 1 | 20.3 Ų | 20.3 | 1% | 0.006 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -65.7 | -44.5 | -177.5 | 177.9 | 0 | 0 | 0 | 0 | 111.3 | M59 A68 L69 A215 F219 V281 P286 | M59-V65 HydrophobicContact CE-CG2 4.2Å; M59-V65 HydrophobicContact SD-CB 4.48Å; M59-V65 HydrophobicContact SD-CG2 3.96Å; V65-A68 PolarHBondContact O-N 3.25Å; V65-L69 WeakPolarHBondContact O-CG 3.44Å; V65-L69 PolarHBondContact O-N 3.45Å; V65-A215 PolarHBondContact N-O 3.15Å; V65-F219 HydrophobicContact CG2-CZ 4.29Å; V65-V281 HydrophobicContact CG1-CB 4.23Å; V65-V281 HydrophobicContact CG1-CG1 3.93Å; V65-V281 HydrophobicContact CG1-CG2 4.1Å; V65-P286 HydrophobicContact CG2-CB 4.26Å; V65-P286 HydrophobicContact CG2-CG 3.53Å |
| 66 | G | 93.3 | Very high | 93.4 | Very high | 6 Ų | 6 | 20.4 Ų | 20.4 | 6% | 0.062 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.6 | -43.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L69 I70 A215 | G66-L69 PolarHBondContact O-N 3.33Å; G66-I70 WeakPolarHBondContact O-CG1 3.23Å; G66-I70 PolarHBondContact O-N 3.32Å; G66-I70 VanDerWaalsContact O-N 3.14Å; G66-A215 PolarHBondContact N-O 3.5Å |
| 67 | L | 93.4 | Very high | 93.5 | Very high | 35 Ų | 35 | 23.6 Ų | 23.6 | 18% | 0.183 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -68.4 | -39.4 | 176.8 | -169.5 | 59.6 | 0 | 0 | 0 | 111.7 | A62 S64 L69 I70 V71 Y222 I227 | A62-L67 HydrophobicContact CB-CB 4.37Å; A62-L67 HydrophobicContact CB-CG 4.34Å; A62-L67 WeakPolarHBondContact O-CD2 3.21Å; S64-L67 PolarHBondContact O-N 3.41Å; S64-L67 VanDerWaalsContact OG-CB 3.22Å; S64-L67 WeakPolarHBondContact OG-CB 3.46Å; S64-L67 PolarHBondContact OG-N 3.21Å; L67-L69 VanDerWaalsContact C-N 3.33Å; L67-L69 PolarHBondContact O-N 3.42Å; L67-I70 WeakPolarHBondContact O-CB 3.4Å; L67-I70 PolarHBondContact O-N 2.88Å; L67-I70 VanDerWaalsContact O-N 3.15Å; L67-V71 WeakPolarHBondContact O-CG2 3.36Å; L67-V71 PolarHBondContact O-N 2.87Å; L67-Y222 HydrophobicContact CD2-CD1 3.79Å; L67-Y222 HydrophobicContact CD2-CE1 3.61Å; L67-I227 HydrophobicContact CD2-CD1 3.95Å; L67-I227 HydrophobicContact CD2-CG1 4.07Å |
| 68 | A | 94.7 | Very high | 93.7 | Very high | 4 Ų | 4 | 24.1 Ų | 24.1 | 3% | 0.033 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -57.3 | -44.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | V58 M59 A62 S64 V65 I70 V71 W72 | V58-A68 HydrophobicContact CG1-CB 4.08Å; M59-A68 HydrophobicContact CE-CB 4.12Å; M59-A68 HydrophobicContact SD-CB 4.09Å; A62-A68 HydrophobicContact CB-CB 3.96Å; S64-A68 WeakPolarHBondContact O-CB 3.39Å; S64-A68 PolarHBondContact O-N 3.08Å; V65-A68 PolarHBondContact O-N 3.25Å; A68-I70 PolarHBondContact O-N 2.86Å; A68-V71 WeakPolarHBondContact O-CB 3.49Å; A68-V71 PolarHBondContact O-N 3.4Å; A68-W72 PolarHBondContact O-N 3.48Å; A68-W72 VanDerWaalsContact O-N 3.16Å |
| 69 | L | 95.4 | Very high | 93.7 | Very high | 29 Ų | 29 | 24.3 Ų | 24.3 | 15% | 0.152 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -64.5 | -38.5 | 176.2 | -67.8 | 177.1 | 0 | 0 | 0 | 112.5 | V65 G66 L67 V71 W72 I73 L210 N277 I278 | V65-L69 WeakPolarHBondContact O-CG 3.44Å; V65-L69 PolarHBondContact O-N 3.45Å; G66-L69 PolarHBondContact O-N 3.33Å; L67-L69 VanDerWaalsContact C-N 3.33Å; L67-L69 PolarHBondContact O-N 3.42Å; L69-V71 VanDerWaalsContact C-N 3.33Å; L69-W72 PolarHBondContact O-N 3.34Å; L69-I73 WeakPolarHBondContact O-CG1 3.44Å; L69-I73 PolarHBondContact O-N 3.43Å; L69-I73 VanDerWaalsContact O-N 3.16Å; L69-L210 HydrophobicContact CD1-CD2 4.06Å; L69-N277 HydrophobicContact CD2-CB 3.82Å; L69-I278 HydrophobicContact CD1-CG1 4.15Å; L69-I278 HydrophobicContact CD2-CG1 4.03Å |
| 70 | I | 95.7 | Very high | 93.7 | Very high | 66 Ų | 66 | 25.1 Ų | 25.1 | 34% | 0.338 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -62.7 | -41.9 | 174.4 | -69 | 167.4 | 0 | 0 | 0 | 110.7 | G66 L67 A68 W72 I73 I74 F216 | G66-I70 WeakPolarHBondContact O-CG1 3.23Å; G66-I70 PolarHBondContact O-N 3.32Å; G66-I70 VanDerWaalsContact O-N 3.14Å; L67-I70 WeakPolarHBondContact O-CB 3.4Å; L67-I70 PolarHBondContact O-N 2.88Å; L67-I70 VanDerWaalsContact O-N 3.15Å; A68-I70 PolarHBondContact O-N 2.86Å; I70-W72 VanDerWaalsContact C-N 3.32Å; I70-W72 PolarHBondContact O-N 2.98Å; I70-I73 PolarHBondContact O-N 3.28Å; I70-I74 HydrophobicContact CG2-CD1 3.52Å; I70-I74 HydrophobicContact CG2-CG1 4.1Å; I70-I74 WeakPolarHBondContact O-CG1 3.49Å; I70-I74 PolarHBondContact O-N 2.83Å; I70-F216 HydrophobicContact CD1-CE1 3.93Å; I70-F216 HydrophobicContact CD1-CZ 4.19Å |
| 71 | V | 95.7 | Very high | 93.8 | Very high | 2 Ų | 2 | 21 Ų | 21 | 1% | 0.012 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -57.8 | -44.3 | 176 | 168.9 | 0 | 0 | 0 | 0 | 110.8 | V58 L67 A68 L69 I73 T75 A230 F231 | V58-V71 HydrophobicContact CG1-CB 4.3Å; V58-V71 HydrophobicContact CG1-CG1 4.04Å; L67-V71 WeakPolarHBondContact O-CG2 3.36Å; L67-V71 PolarHBondContact O-N 2.87Å; A68-V71 WeakPolarHBondContact O-CB 3.49Å; A68-V71 PolarHBondContact O-N 3.4Å; L69-V71 VanDerWaalsContact C-N 3.33Å; V71-I73 PolarHBondContact O-N 3.41Å; V71-T75 VanDerWaalsContact O-CB 3.26Å; V71-T75 WeakPolarHBondContact O-CB 3.43Å; V71-T75 PolarHBondContact O-N 2.91Å; V71-T75 PolarHBondContact O-OG1 3.15Å; V71-A230 HydrophobicContact CG1-CB 4.3Å; V71-A230 HydrophobicContact CG2-CB 4.39Å; V71-F231 HydrophobicContact CB-CE1 4.28Å; V71-F231 HydrophobicContact CG1-CD1 3.83Å; V71-F231 HydrophobicContact CG1-CE1 3.97Å; V71-F231 HydrophobicContact CG1-CG 4.27Å; V71-F231 HydrophobicContact CG2-CE1 4.3Å; V71-F231 HydrophobicContact CG2-CE2 4.3Å; V71-F231 HydrophobicContact CG2-CZ 4.07Å |
| 72 | W | 96.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 20.2 Ų | 20.2 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -59.4 | -46.5 | 175.5 | -77.9 | 104.1 | 0 | 0 | 0 | 112.5 | I51 P55 V58 A68 L69 I70 T75 G76 A237 Y238 Y273 V274 N277 | I51-W72 HydrophobicContact CD1-CH2 3.79Å; I51-W72 HydrophobicContact CD1-CZ2 4.24Å; I51-W72 HydrophobicContact CD1-CZ3 4.15Å; P55-W72 HydrophobicContact CG-CZ2 4.19Å; V58-W72 HydrophobicContact CG2-CZ2 4.37Å; A68-W72 PolarHBondContact O-N 3.48Å; A68-W72 VanDerWaalsContact O-N 3.16Å; L69-W72 PolarHBondContact O-N 3.34Å; I70-W72 VanDerWaalsContact C-N 3.32Å; I70-W72 PolarHBondContact O-N 2.98Å; W72-T75 PolarHBondContact O-N 3.41Å; W72-G76 PolarHBondContact O-N 3.35Å; W72-A237 HydrophobicContact CH2-CB 3.52Å; W72-A237 HydrophobicContact CZ3-CB 3.63Å; W72-Y238 HydrophobicContact CE3-CD2 4.43Å; W72-Y238 AromaticContact CE3-CE2 3.6Å; W72-Y238 HydrophobicContact CE3-CE2 3.6Å; W72-Y238 HydrophobicContact CZ3-CD2 4.35Å; W72-Y238 AromaticContact CZ3-CE2 3.9Å; W72-Y238 HydrophobicContact CZ3-CE2 3.9Å; W72-Y238 PolarHBondContact O-OH 3.42Å; W72-Y273 AromaticContact CE3-CD2 3.84Å; W72-Y273 HydrophobicContact CE3-CD2 3.84Å; W72-Y273 HydrophobicContact CE3-CG 4.2Å; W72-Y273 HydrophobicContact CH2-CD2 4.49Å; W72-Y273 AromaticContact CZ3-CD2 3.42Å; W72-Y273 HydrophobicContact CZ3-CD2 3.42Å; W72-Y273 VanDerWaalsContact CZ3-CD2 3.42Å; W72-Y273 HydrophobicContact CZ3-CE2 4.07Å; W72-Y273 AromaticContact CZ3-CG 3.91Å; W72-Y273 HydrophobicContact CZ3-CG 3.91Å; W72-V274 HydrophobicContact CB-CG2 4.1Å; W72-N277 VanDerWaalsContact NE1-CG 3.34Å; W72-N277 PolarHBondContact NE1-ND2 3.24Å; W72-N277 PolarHBondContact NE1-OD1 3.49Å |
| 73 | I | 96.5 | Very high | 93.8 | Very high | 74 Ų | 74 | 20.3 Ų | 20.3 | 38% | 0.379 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -63.9 | -49.9 | 179.9 | -65.2 | 167.2 | 0 | 0 | 0 | 111 | L69 I70 V71 T75 G76 I77 V274 | L69-I73 WeakPolarHBondContact O-CG1 3.44Å; L69-I73 PolarHBondContact O-N 3.43Å; L69-I73 VanDerWaalsContact O-N 3.16Å; I70-I73 PolarHBondContact O-N 3.28Å; V71-I73 PolarHBondContact O-N 3.41Å; I73-T75 VanDerWaalsContact C-N 3.32Å; I73-T75 PolarHBondContact O-N 3.38Å; I73-G76 PolarHBondContact O-N 3.22Å; I73-I77 HydrophobicContact CG2-CD1 4.03Å; I73-I77 WeakPolarHBondContact O-CG1 3.39Å; I73-I77 PolarHBondContact O-N 3.35Å; I73-V274 HydrophobicContact CG1-CG2 3.71Å |
| 74 | I | 95.9 | Very high | 93.9 | Very high | 62 Ų | 62 | 21.2 Ų | 21.2 | 32% | 0.318 | 12% | 0.116 | S | C | . | . | H | α-helix | trans | -63.2 | -41.1 | -179.2 | -67.9 | 176.2 | 0 | 0 | 0 | 110.2 | I70 G76 I77 I78 F231 F426 | I70-I74 HydrophobicContact CG2-CD1 3.52Å; I70-I74 HydrophobicContact CG2-CG1 4.1Å; I70-I74 WeakPolarHBondContact O-CG1 3.49Å; I70-I74 PolarHBondContact O-N 2.83Å; I74-G76 VanDerWaalsContact C-N 3.3Å; I74-G76 PolarHBondContact O-N 3.46Å; I74-I77 PolarHBondContact O-N 3.07Å; I74-I78 HydrophobicContact CG2-CG1 4.18Å; I74-I78 WeakPolarHBondContact O-CG1 3.48Å; I74-I78 PolarHBondContact O-N 2.82Å; I74-F231 HydrophobicContact CB-CE1 3.81Å; I74-F231 HydrophobicContact CB-CZ 4.14Å; I74-F231 HydrophobicContact CD1-CZ 4.31Å; I74-F231 HydrophobicContact CG2-CE1 3.57Å; I74-F231 HydrophobicContact CG2-CZ 3.84Å; I74-F426 HydrophobicContact CG2-CE2 4.41Å |
| 75 | T | 94.3 | Very high | 93.9 | Very high | 1 Ų | 1 | 21.2 Ų | 21.2 | 1% | 0.006 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -59.9 | -42 | 176.2 | -55.2 | 0 | 0 | 0 | 0 | 111.3 | V71 W72 I73 I78 T79 F231 Y238 | V71-T75 VanDerWaalsContact O-CB 3.26Å; V71-T75 WeakPolarHBondContact O-CB 3.43Å; V71-T75 PolarHBondContact O-N 2.91Å; V71-T75 PolarHBondContact O-OG1 3.15Å; W72-T75 PolarHBondContact O-N 3.41Å; I73-T75 VanDerWaalsContact C-N 3.32Å; I73-T75 PolarHBondContact O-N 3.38Å; T75-I78 PolarHBondContact O-N 3.19Å; T75-T79 VanDerWaalsContact O-CB 3.28Å; T75-T79 WeakPolarHBondContact O-CB 3.45Å; T75-T79 PolarHBondContact O-N 3.38Å; T75-T79 PolarHBondContact O-OG1 3.03Å; T75-F231 WeakPolarHBondContact OG1-CD1 3.42Å; T75-Y238 HydrophobicContact CG2-CD2 3.44Å; T75-Y238 VanDerWaalsContact CG2-CD2 3.44Å; T75-Y238 HydrophobicContact CG2-CE2 3.87Å; T75-Y238 HydrophobicContact CG2-CG 4.16Å |
| 76 | G | 94.4 | Very high | 93.8 | Very high | 2 Ų | 2 | 21.2 Ų | 21.2 | 2% | 0.021 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -60.9 | -43.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | W72 I73 I74 T79 A80 T270 | W72-G76 PolarHBondContact O-N 3.35Å; I73-G76 PolarHBondContact O-N 3.22Å; I74-G76 VanDerWaalsContact C-N 3.3Å; I74-G76 PolarHBondContact O-N 3.46Å; G76-T79 PolarHBondContact O-N 3.45Å; G76-A80 PolarHBondContact O-N 3.31Å; G76-T270 WeakPolarHBondContact CA-OG1 3.46Å |
| 77 | I | 94.9 | Very high | 93.6 | Very high | 93 Ų | 93 | 21 Ų | 21 | 48% | 0.477 | 11% | 0.113 | S | C | . | . | H | α-helix | trans | -64 | -48.6 | 177.1 | -66.5 | 168.4 | 0 | 0 | 0 | 110.9 | I73 I74 T79 A80 I81 | I73-I77 HydrophobicContact CG2-CD1 4.03Å; I73-I77 WeakPolarHBondContact O-CG1 3.39Å; I73-I77 PolarHBondContact O-N 3.35Å; I74-I77 PolarHBondContact O-N 3.07Å; I77-T79 VanDerWaalsContact C-N 3.27Å; I77-T79 PolarHBondContact O-N 3.29Å; I77-A80 WeakPolarHBondContact O-CB 3.45Å; I77-A80 PolarHBondContact O-N 3.09Å; I77-A80 VanDerWaalsContact O-N 3.14Å; I77-I81 HydrophobicContact CG2-CD1 4.04Å; I77-I81 WeakPolarHBondContact O-CG1 3.04Å; I77-I81 PolarHBondContact O-N 3.28Å |
| 78 | I | 93.8 | Very high | 93.4 | Very high | 11 Ų | 11 | 19.4 Ų | 19.4 | 6% | 0.056 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -61 | -39.6 | 177.7 | -67.1 | -63.3 | 0 | 0 | 0 | 110.8 | I74 T75 A80 I81 G82 Y423 F426 | I74-I78 HydrophobicContact CG2-CG1 4.18Å; I74-I78 WeakPolarHBondContact O-CG1 3.48Å; I74-I78 PolarHBondContact O-N 2.82Å; T75-I78 PolarHBondContact O-N 3.19Å; I78-A80 VanDerWaalsContact C-N 3.34Å; I78-A80 PolarHBondContact O-N 3.43Å; I78-I81 HydrophobicContact CD1-CD1 4.46Å; I78-I81 PolarHBondContact O-N 3.21Å; I78-G82 PolarHBondContact O-N 3.01Å; I78-Y423 HydrophobicContact CG2-CD2 3.86Å; I78-Y423 HydrophobicContact CG2-CE2 3.67Å; I78-Y423 WeakPolarHBondContact O-CE2 3.07Å; I78-F426 HydrophobicContact CB-CD1 4.32Å; I78-F426 HydrophobicContact CB-CE1 4.22Å; I78-F426 HydrophobicContact CD1-CB 3.97Å; I78-F426 HydrophobicContact CD1-CD1 3.95Å; I78-F426 HydrophobicContact CD1-CD2 4.14Å; I78-F426 HydrophobicContact CD1-CE1 4.48Å; I78-F426 HydrophobicContact CD1-CG 3.74Å; I78-F426 HydrophobicContact CG1-CD1 3.86Å; I78-F426 HydrophobicContact CG1-CD2 4.26Å; I78-F426 HydrophobicContact CG1-CE1 3.89Å; I78-F426 HydrophobicContact CG1-CE2 4.31Å; I78-F426 HydrophobicContact CG1-CG 4.03Å; I78-F426 HydrophobicContact CG1-CZ 4.12Å; I78-F426 HydrophobicContact CG2-CD1 3.59Å; I78-F426 HydrophobicContact CG2-CE1 3.71Å; I78-F426 HydrophobicContact CG2-CG 4.46Å |
| 79 | T | 92.9 | Very high | 93.1 | Very high | 4 Ų | 4 | 19.2 Ų | 19.2 | 3% | 0.025 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -62.4 | -41.4 | 175.8 | -60.3 | 0 | 0 | 0 | 0 | 111.4 | T75 G76 I77 G82 A83 Y238 W241 I266 | T75-T79 VanDerWaalsContact O-CB 3.28Å; T75-T79 WeakPolarHBondContact O-CB 3.45Å; T75-T79 PolarHBondContact O-N 3.38Å; T75-T79 PolarHBondContact O-OG1 3.03Å; G76-T79 PolarHBondContact O-N 3.45Å; I77-T79 VanDerWaalsContact C-N 3.27Å; I77-T79 PolarHBondContact O-N 3.29Å; T79-G82 PolarHBondContact O-N 3.07Å; T79-A83 VanDerWaalsContact O-CB 3.3Å; T79-A83 WeakPolarHBondContact O-CB 3.31Å; T79-A83 PolarHBondContact O-N 3.19Å; T79-Y238 HydrophobicContact CG2-CD1 4.4Å; T79-W241 HydrophobicContact CG2-CB 4.02Å; T79-W241 HydrophobicContact CG2-CD2 4.23Å; T79-W241 HydrophobicContact CG2-CG 3.6Å; T79-I266 HydrophobicContact CG2-CD1 4.23Å; T79-I266 HydrophobicContact CG2-CG2 4.26Å |
| 80 | A | 92.6 | Very high | 92.6 | Very high | 24 Ų | 24 | 17.9 Ų | 17.9 | 20% | 0.198 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -62.8 | -43.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | G76 I77 I78 A83 L84 I266 | G76-A80 PolarHBondContact O-N 3.31Å; I77-A80 WeakPolarHBondContact O-CB 3.45Å; I77-A80 PolarHBondContact O-N 3.09Å; I77-A80 VanDerWaalsContact O-N 3.14Å; I78-A80 VanDerWaalsContact C-N 3.34Å; I78-A80 PolarHBondContact O-N 3.43Å; A80-A83 PolarHBondContact O-N 3.42Å; A80-L84 VanDerWaalsContact O-CG 3.29Å; A80-L84 WeakPolarHBondContact O-CG 3.29Å; A80-L84 PolarHBondContact O-N 3Å; A80-I266 HydrophobicContact CB-CB 4.44Å; A80-I266 HydrophobicContact CB-CD1 4.41Å; A80-I266 HydrophobicContact CB-CG2 3.92Å |
| 81 | I | 93.4 | Very high | 92.2 | Very high | 9 Ų | 9 | 15 Ų | 15 | 5% | 0.046 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -61.5 | -47.1 | 176.4 | -64.3 | 169.1 | 0 | 0 | 0 | 110.6 | I77 I78 L84 C85 W419 I422 Y423 | I77-I81 HydrophobicContact CG2-CD1 4.04Å; I77-I81 WeakPolarHBondContact O-CG1 3.04Å; I77-I81 PolarHBondContact O-N 3.28Å; I78-I81 HydrophobicContact CD1-CD1 4.46Å; I78-I81 PolarHBondContact O-N 3.21Å; I81-L84 PolarHBondContact O-N 3.22Å; I81-C85 PolarHBondContact O-N 3.32Å; I81-C85 VanDerWaalsContact O-N 3.11Å; I81-C85 PolarHBondContact O-SG 2.99Å; I81-W419 HydrophobicContact CD1-CE3 3.76Å; I81-W419 HydrophobicContact CD1-CZ3 3.78Å; I81-W419 HydrophobicContact CG1-CE3 3.7Å; I81-W419 HydrophobicContact CG1-CZ3 3.94Å; I81-W419 HydrophobicContact CG2-CB 4.12Å; I81-W419 HydrophobicContact CG2-CE3 4.24Å; I81-W419 WeakPolarHBondContact CG2-O 3.44Å; I81-I422 HydrophobicContact CD1-CG2 4.25Å; I81-Y423 HydrophobicContact CG2-CD2 4.32Å |
| 82 | G | 92.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -60 | -47 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | I78 T79 L84 C85 Y86 | I78-G82 PolarHBondContact O-N 3.01Å; T79-G82 PolarHBondContact O-N 3.07Å; G82-L84 VanDerWaalsContact C-N 3.31Å; G82-L84 PolarHBondContact O-N 3.24Å; G82-C85 WeakPolarHBondContact O-CB 3.26Å; G82-C85 PolarHBondContact O-N 3.03Å; G82-C85 VanDerWaalsContact O-N 3.13Å; G82-Y86 WeakPolarHBondContact O-CD2 3.41Å; G82-Y86 PolarHBondContact O-N 2.63Å |
| 83 | A | 91.3 | Very high | 91.2 | Very high | 1 Ų | 1 | 16.4 Ų | 16.4 | 1% | 0.008 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -60.8 | -38.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | T79 A80 Y86 A87 W241 I262 I266 | T79-A83 VanDerWaalsContact O-CB 3.3Å; T79-A83 WeakPolarHBondContact O-CB 3.31Å; T79-A83 PolarHBondContact O-N 3.19Å; A80-A83 PolarHBondContact O-N 3.42Å; A83-Y86 PolarHBondContact O-N 3.3Å; A83-A87 WeakPolarHBondContact O-CB 3.42Å; A83-A87 PolarHBondContact O-N 3.24Å; A83-W241 HydrophobicContact CB-CD2 4.43Å; A83-W241 HydrophobicContact CB-CE3 3.73Å; A83-W241 HydrophobicContact CB-CZ3 4.25Å; A83-I262 HydrophobicContact CB-CD1 4.15Å; A83-I262 HydrophobicContact CB-CG1 4.33Å; A83-I262 HydrophobicContact CB-CG2 3.66Å; A83-I266 HydrophobicContact CB-CD1 3.38Å |
| 84 | L | 90.7 | Very high | 90.2 | Very high | 22 Ų | 22 | 16.7 Ų | 16.7 | 12% | 0.115 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -65.5 | -39.3 | 174.6 | -71.4 | 170.9 | 0 | 0 | 0 | 112.7 | A80 I81 G82 Y86 A87 E88 I262 F263 | A80-L84 VanDerWaalsContact O-CG 3.29Å; A80-L84 WeakPolarHBondContact O-CG 3.29Å; A80-L84 PolarHBondContact O-N 3Å; I81-L84 PolarHBondContact O-N 3.22Å; G82-L84 VanDerWaalsContact C-N 3.31Å; G82-L84 PolarHBondContact O-N 3.24Å; L84-Y86 VanDerWaalsContact C-N 3.29Å; L84-Y86 PolarHBondContact O-N 2.94Å; L84-A87 PolarHBondContact O-N 3.25Å; L84-E88 PolarHBondContact O-N 3.5Å; L84-I262 HydrophobicContact CD2-CG2 4.25Å; L84-I262 HydrophobicContact CG-CG2 4.38Å; L84-F263 HydrophobicContact CD1-CE1 4.01Å; L84-F263 HydrophobicContact CD1-CE2 4.45Å; L84-F263 HydrophobicContact CD1-CZ 3.69Å; L84-F263 HydrophobicContact CD2-CD2 4.21Å; L84-F263 HydrophobicContact CD2-CE1 4.4Å; L84-F263 HydrophobicContact CD2-CE2 3.54Å; L84-F263 HydrophobicContact CD2-CZ 3.65Å; L84-F263 HydrophobicContact CG-CZ 4.29Å |
| 85 | C | 91.8 | Very high | 89.1 | Confident | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -62.4 | -40.7 | 174.5 | -60.6 | 0 | 0 | 0 | 0 | 111.3 | I81 G82 L89 V396 I415 | I81-C85 PolarHBondContact O-N 3.32Å; I81-C85 VanDerWaalsContact O-N 3.11Å; I81-C85 PolarHBondContact O-SG 2.99Å; G82-C85 WeakPolarHBondContact O-CB 3.26Å; G82-C85 PolarHBondContact O-N 3.03Å; G82-C85 VanDerWaalsContact O-N 3.13Å; C85-L89 PolarHBondContact O-N 3.18Å; C85-V396 HydrophobicContact CB-CG1 4.4Å; C85-V396 HydrophobicContact CB-CG2 4.06Å; C85-I415 HydrophobicContact CB-CD1 4.16Å; C85-I415 VanDerWaalsContact SG-CD1 3.55Å |
| 86 | Y | 89.8 | Confident | 87.8 | Confident | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -69 | -37.2 | 175.5 | -89.8 | -107.6 | 0 | 0 | 0 | 112.9 | G82 A83 L84 E88 L89 G90 D99 Y102 W241 N242 N245 Y392 T395 V396 | G82-Y86 WeakPolarHBondContact O-CD2 3.41Å; G82-Y86 PolarHBondContact O-N 2.63Å; A83-Y86 PolarHBondContact O-N 3.3Å; L84-Y86 VanDerWaalsContact C-N 3.29Å; L84-Y86 PolarHBondContact O-N 2.94Å; Y86-E88 VanDerWaalsContact C-N 3.27Å; Y86-E88 PolarHBondContact O-N 3.36Å; Y86-L89 PolarHBondContact O-N 3.4Å; Y86-L89 VanDerWaalsContact O-N 3.08Å; Y86-G90 PolarHBondContact O-N 3.05Å; Y86-D99 VanDerWaalsContact CE1-OD1 3.26Å; Y86-D99 WeakPolarHBondContact CE1-OD1 3.26Å; Y86-Y102 HydrophobicContact CD1-CD2 4.47Å; Y86-Y102 HydrophobicContact CD1-CE2 4.21Å; Y86-Y102 HydrophobicContact CE1-CD2 4.47Å; Y86-W241 HydrophobicContact CD1-CZ3 4.27Å; Y86-W241 AromaticContact CD2-CH2 3.61Å; Y86-W241 HydrophobicContact CD2-CH2 3.61Å; Y86-W241 AromaticContact CD2-CZ3 3.58Å; Y86-W241 HydrophobicContact CD2-CZ3 3.58Å; Y86-W241 AromaticContact CE2-CH2 3.63Å; Y86-W241 HydrophobicContact CE2-CH2 3.63Å; Y86-W241 HydrophobicContact CE2-CZ3 4.05Å; Y86-W241 HydrophobicContact CG-CH2 4.14Å; Y86-W241 AromaticContact CG-CZ3 3.68Å; Y86-W241 HydrophobicContact CG-CZ3 3.68Å; Y86-N242 HydrophobicContact CD1-CB 4.4Å; Y86-N242 HydrophobicContact CE1-CB 4.45Å; Y86-N245 PolarHBondContact O-OD1 3.42Å; Y86-Y392 WeakPolarHBondContact OH-CD1 3.49Å; Y86-T395 HydrophobicContact CE1-CG2 3.78Å; Y86-T395 HydrophobicContact CE2-CG2 4.02Å; Y86-T395 WeakPolarHBondContact OH-CB 3.33Å; Y86-T395 WeakPolarHBondContact OH-CG2 3.49Å; Y86-T395 PolarHBondContact OH-OG1 2.6Å; Y86-T395 VanDerWaalsContact OH-OG1 3.14Å; Y86-V396 HydrophobicContact CD2-CG2 4.38Å; Y86-V396 HydrophobicContact CE2-CG2 4.03Å |
| 87 | A | 88.9 | Confident | 86.6 | Confident | 1 Ų | 1 | 21.3 Ų | 21.3 | 1% | 0.008 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.2 | -39.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A83 L84 G90 V91 L258 I262 | A83-A87 WeakPolarHBondContact O-CB 3.42Å; A83-A87 PolarHBondContact O-N 3.24Å; L84-A87 PolarHBondContact O-N 3.25Å; A87-G90 PolarHBondContact O-N 3.46Å; A87-V91 WeakPolarHBondContact O-CG2 3.39Å; A87-V91 PolarHBondContact O-N 3.43Å; A87-L258 HydrophobicContact CB-CD2 3.94Å; A87-L258 HydrophobicContact CB-CG 4.09Å; A87-I262 HydrophobicContact CB-CD1 3.65Å |
| 88 | E | 89.9 | Confident | 85.9 | Confident | 2 Ų | 2 | 16.9 Ų | 16.9 | 1% | 0.009 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -62.1 | -45.8 | 172.6 | 174.7 | 168.2 | 144.8 | 0 | 0 | 111.9 | L84 Y86 G90 V91 T92 Q399 R403 I413 K414 I415 | L84-E88 PolarHBondContact O-N 3.5Å; Y86-E88 VanDerWaalsContact C-N 3.27Å; Y86-E88 PolarHBondContact O-N 3.36Å; E88-G90 PolarHBondContact O-N 3.48Å; E88-V91 WeakPolarHBondContact O-CG2 3.49Å; E88-V91 PolarHBondContact O-N 2.85Å; E88-T92 WeakPolarHBondContact O-CB 3.45Å; E88-T92 PolarHBondContact O-N 2.9Å; E88-T92 PolarHBondContact O-OG1 3.41Å; E88-Q399 VanDerWaalsContact CD-NE2 3.29Å; E88-Q399 PolarHBondContact OE1-NE2 3.12Å; E88-R403 IonicContact OE1-CZ 3.27Å; E88-R403 VanDerWaalsContact OE1-CZ 3.27Å; E88-R403 IonicContact OE1-NE 2.95Å; E88-R403 PolarHBondContact OE1-NE 3Å; E88-R403 IonicContact OE1-NH2 2.78Å; E88-R403 PolarHBondContact OE1-NH2 3.22Å; E88-R403 IonicContact OE2-CZ 3.75Å; E88-R403 IonicContact OE2-NH2 2.63Å; E88-R403 PolarHBondContact OE2-NH2 2.9Å; E88-I413 WeakPolarHBondContact CG-O 3.42Å; E88-K414 WeakPolarHBondContact OE2-CA 3.2Å; E88-I415 WeakPolarHBondContact OE2-CG1 3.45Å; E88-I415 PolarHBondContact OE2-N 3.41Å |
| 89 | L | 88.9 | Confident | 85.4 | Confident | 1 Ų | 1 | 16.4 Ų | 16.4 | 1% | 0.005 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -62.2 | -42.6 | 176.7 | -72.8 | 175.1 | 0 | 0 | 0 | 111.9 | C85 Y86 V91 T92 I93 Y102 I106 T395 Q399 L402 | C85-L89 PolarHBondContact O-N 3.18Å; Y86-L89 PolarHBondContact O-N 3.4Å; Y86-L89 VanDerWaalsContact O-N 3.08Å; L89-V91 VanDerWaalsContact C-N 3.32Å; L89-V91 PolarHBondContact O-N 3.43Å; L89-T92 PolarHBondContact O-N 2.87Å; L89-T92 VanDerWaalsContact O-N 3.14Å; L89-I93 PolarHBondContact O-N 3.42Å; L89-Y102 HydrophobicContact CB-CD1 4.42Å; L89-Y102 HydrophobicContact CB-CD2 4.13Å; L89-Y102 HydrophobicContact CB-CE2 4.2Å; L89-Y102 HydrophobicContact CB-CG 4.27Å; L89-Y102 HydrophobicContact CD1-CD2 4.2Å; L89-Y102 HydrophobicContact CD1-CG 4.42Å; L89-I106 HydrophobicContact CD2-CD1 4.22Å; L89-T395 HydrophobicContact CD1-CG2 3.46Å; L89-T395 VanDerWaalsContact CD1-CG2 3.46Å; L89-Q399 HydrophobicContact CD1-CB 4.06Å; L89-Q399 HydrophobicContact CD2-CB 3.88Å; L89-Q399 HydrophobicContact CD2-CG 3.96Å; L89-Q399 HydrophobicContact CG-CB 4.01Å; L89-Q399 HydrophobicContact CG-CG 4.03Å; L89-L402 HydrophobicContact CD2-CD2 4.03Å |
| 90 | G | 84.8 | Confident | 85.1 | Confident | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -65.3 | -30.7 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y86 A87 E88 Y102 | Y86-G90 PolarHBondContact O-N 3.05Å; A87-G90 PolarHBondContact O-N 3.46Å; E88-G90 PolarHBondContact O-N 3.48Å; G90-Y102 WeakPolarHBondContact CA-OH 3.16Å |
| 91 | V | 86.2 | Confident | 84.8 | Confident | 7 Ų | 7 | 15.5 Ų | 15.5 | 4% | 0.042 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -88 | -19.3 | 172.8 | -59.5 | 0 | 0 | 0 | 0 | 113.8 | A87 E88 L89 Y255 L258 P412 I413 | A87-V91 WeakPolarHBondContact O-CG2 3.39Å; A87-V91 PolarHBondContact O-N 3.43Å; E88-V91 WeakPolarHBondContact O-CG2 3.49Å; E88-V91 PolarHBondContact O-N 2.85Å; L89-V91 VanDerWaalsContact C-N 3.32Å; L89-V91 PolarHBondContact O-N 3.43Å; V91-Y255 HydrophobicContact CB-CD1 3.83Å; V91-Y255 HydrophobicContact CB-CE1 4.04Å; V91-Y255 HydrophobicContact CG1-CD1 3.91Å; V91-Y255 HydrophobicContact CG1-CE1 4.43Å; V91-L258 HydrophobicContact CG1-CD2 3.97Å; V91-P412 HydrophobicContact CG2-CB 4.49Å; V91-I413 HydrophobicContact CB-CD1 4.34Å; V91-I413 HydrophobicContact CG1-CD1 3.68Å; V91-I413 HydrophobicContact CG1-CG1 4.43Å; V91-I413 HydrophobicContact CG2-CB 3.79Å; V91-I413 HydrophobicContact CG2-CD1 3.79Å; V91-I413 HydrophobicContact CG2-CG1 3.81Å |
| 92 | T | 87.7 | Confident | 84.6 | Confident | 16 Ų | 16 | 15.2 Ų | 15.2 | 10% | 0.098 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -84.5 | -38.8 | 179.3 | -59.4 | 0 | 0 | 0 | 0 | 111 | E88 L89 P94 M409 R411 | E88-T92 WeakPolarHBondContact O-CB 3.45Å; E88-T92 PolarHBondContact O-N 2.9Å; E88-T92 PolarHBondContact O-OG1 3.41Å; L89-T92 PolarHBondContact O-N 2.87Å; L89-T92 VanDerWaalsContact O-N 3.14Å; T92-P94 WeakPolarHBondContact O-CD 3.34Å; T92-M409 HydrophobicContact CG2-CE 3.1Å; T92-M409 HydrophobicContact CG2-CG 4.39Å; T92-M409 HydrophobicContact CG2-SD 3.99Å; T92-R411 HydrophobicContact CG2-CG 4.05Å |
| 93 | I | 84.6 | Confident | 84.5 | Confident | 14 Ų | 14 | 15.2 Ų | 15.2 | 7% | 0.072 | 9% | 0.088 | C | C | . | . | S | Bend | trans | -122.1 | 80.6 | 178.1 | -51.6 | 175.2 | 0 | 0 | 0 | 107.1 | L89 K95 Y102 D105 I106 L402 | L89-I93 PolarHBondContact O-N 3.42Å; I93-K95 HydrophobicContact CG2-CB 4.4Å; I93-K95 HydrophobicContact CG2-CD 4.15Å; I93-K95 HydrophobicContact CG2-CG 4.13Å; I93-K95 PolarHBondContact O-N 3.43Å; I93-Y102 HydrophobicContact CB-CD1 4.17Å; I93-Y102 HydrophobicContact CB-CE1 4.31Å; I93-Y102 HydrophobicContact CG2-CD1 4.42Å; I93-Y102 WeakPolarHBondContact O-CE1 3.35Å; I93-D105 HydrophobicContact CD1-CB 4.25Å; I93-D105 WeakPolarHBondContact CG2-OD2 3.5Å; I93-I106 HydrophobicContact CD1-CG1 4.5Å; I93-L402 HydrophobicContact CD1-CD2 4.07Å |
| 94 | P | 75.4 | Confident | 84.5 | Confident | 81 Ų | 81 | 17 Ų | 17 | 53% | 0.526 | 10% | 0.096 | S | C | . | . | trans | -78.9 | 66.1 | -177 | 34.4 | -36.3 | 0 | 0 | 0 | 110.3 | T92 | T92-P94 WeakPolarHBondContact O-CD 3.34Š| ||
| 95 | K | 73.5 | Confident | 84.4 | Confident | 94 Ų | 94 | 19.3 Ų | 19.3 | 41% | 0.409 | 11% | 0.108 | S | C | . | . | trans | -113.4 | 137.3 | 173.6 | -69.1 | -177.2 | -178.9 | 171.5 | 0 | 110.1 | I93 D105 E249 | I93-K95 HydrophobicContact CG2-CB 4.4Å; I93-K95 HydrophobicContact CG2-CD 4.15Å; I93-K95 HydrophobicContact CG2-CG 4.13Å; I93-K95 PolarHBondContact O-N 3.43Å; K95-D105 WeakPolarHBondContact CD-OD2 3.47Å; K95-D105 WeakPolarHBondContact CE-OD2 3.38Å; K95-D105 IonicContact NZ-OD1 3.95Å; K95-D105 PolarHBondContact NZ-OD1 3.48Å; K95-D105 IonicContact NZ-OD2 2.85Å; K95-D105 PolarHBondContact NZ-OD2 3.28Å; K95-E249 WeakPolarHBondContact CA-OE1 3.46Å | ||
| 96 | S | 66.3 | Low | 84.4 | Confident | 64 Ų | 64 | 20.4 Ų | 20.4 | 45% | 0.448 | 11% | 0.114 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.2 | 145.5 | 168.1 | -165.8 | 0 | 0 | 0 | 0 | 111.3 | S101 E249 | S96-S101 PolarHBondContact O-OG 3.35Å; S96-E249 PolarHBondContact N-OE1 3.37Å |
| 97 | G | 68.1 | Low | 84.4 | Confident | 4 Ų | 4 | 24.6 Ų | 24.6 | 4% | 0.041 | 13% | 0.132 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 109.2 | -3.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | D99 Y100 S101 Y246 | G97-D99 PolarHBondContact O-N 3.36Å; G97-Y100 PolarHBondContact O-N 3.2Å; G97-S101 WeakPolarHBondContact CA-OG 3.4Å; G97-Y246 VanDerWaalsContact C-CD1 3.45Å; G97-Y246 VanDerWaalsContact C-CE1 3.49Å; G97-Y246 WeakPolarHBondContact O-CE1 3.31Å |
| 98 | G | 81.2 | Confident | 84.4 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 15% | 0.147 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 53.7 | -124.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y100 S101 Y102 | G98-Y100 PolarHBondContact O-N 3.19Å; G98-Y100 VanDerWaalsContact O-N 3.17Å; G98-S101 PolarHBondContact O-N 3.48Å; G98-S101 VanDerWaalsContact O-N 3.1Å; G98-Y102 WeakPolarHBondContact O-CD2 3.41Å; G98-Y102 PolarHBondContact O-N 3.32Å; G98-Y102 VanDerWaalsContact O-N 3.14Å |
| 99 | D | 83.1 | Confident | 84.3 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -54.9 | -37.1 | -175.4 | -45 | -2.1 | 0 | 0 | 0 | 112.9 | Y86 G97 V103 R115 N242 Y246 | Y86-D99 VanDerWaalsContact CE1-OD1 3.26Å; Y86-D99 WeakPolarHBondContact CE1-OD1 3.26Å; G97-D99 PolarHBondContact O-N 3.36Å; D99-V103 VanDerWaalsContact O-CG2 3.31Å; D99-V103 WeakPolarHBondContact O-CG2 3.46Å; D99-V103 PolarHBondContact O-N 3.07Å; D99-V103 VanDerWaalsContact O-N 3.11Å; D99-R115 IonicContact OD2-CZ 3.35Å; D99-R115 IonicContact OD2-NE 3.71Å; D99-R115 IonicContact OD2-NH2 2.78Å; D99-R115 PolarHBondContact OD2-NH2 3.38Å; D99-N242 PolarHBondContact OD1-ND2 2.62Å; D99-N242 PolarHBondContact OD2-ND2 3.49Å; D99-Y246 PolarHBondContact N-OH 3.48Å; D99-Y246 PolarHBondContact OD1-OH 2.82Å; D99-Y246 VanDerWaalsContact OD1-OH 3.13Å; D99-Y246 PolarHBondContact OD2-OH 2.8Å; D99-Y246 VanDerWaalsContact OD2-OH 3.08Å |
| 100 | Y | 86.9 | Confident | 84.4 | Confident | 3 Ų | 3 | 29.8 Ų | 29.8 | 1% | 0.012 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.5 | -48.3 | 179.2 | 163.5 | -104.2 | 0 | 0 | 0 | 111.1 | G97 G98 Y102 V103 K104 G112 L116 E340 H342 | G97-Y100 PolarHBondContact O-N 3.2Å; G98-Y100 PolarHBondContact O-N 3.19Å; G98-Y100 VanDerWaalsContact O-N 3.17Å; Y100-Y102 PolarHBondContact O-N 2.9Å; Y100-V103 PolarHBondContact O-N 3.26Å; Y100-K104 HydrophobicContact CE1-CD 4.42Å; Y100-K104 VanDerWaalsContact O-CB 3.29Å; Y100-K104 WeakPolarHBondContact O-CB 3.37Å; Y100-K104 PolarHBondContact O-N 2.88Å; Y100-G112 WeakPolarHBondContact CD2-O 3.29Å; Y100-G112 VanDerWaalsContact CE2-O 3.31Å; Y100-G112 WeakPolarHBondContact CE2-O 3.39Å; Y100-L116 HydrophobicContact CD2-CB 3.76Å; Y100-L116 HydrophobicContact CE2-CB 3.93Å; Y100-L116 HydrophobicContact CE2-CD2 4.06Å; Y100-E340 HydrophobicContact CE1-CG 4.1Å; Y100-E340 VanDerWaalsContact OH-CB 3.25Å; Y100-E340 WeakPolarHBondContact OH-CB 3.44Å; Y100-H342 AromaticContact CE2-ND1 3.68Å; Y100-H342 AromaticContact CZ-ND1 3.79Å; Y100-H342 PolarHBondContact OH-CE1 3.2Å; Y100-H342 VanDerWaalsContact OH-CE1 3.28Å; Y100-H342 PolarHBondContact OH-ND1 2.91Å |
| 101 | S | 85.7 | Confident | 84.8 | Confident | 7 Ų | 7 | 31 Ų | 31 | 5% | 0.049 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -66.6 | -38.5 | -177.8 | -53.5 | 0 | 0 | 0 | 0 | 111.4 | S96 G97 G98 K104 D105 | S96-S101 PolarHBondContact O-OG 3.35Å; G97-S101 WeakPolarHBondContact CA-OG 3.4Å; G98-S101 PolarHBondContact O-N 3.48Å; G98-S101 VanDerWaalsContact O-N 3.1Å; S101-K104 PolarHBondContact O-N 2.96Å; S101-D105 WeakPolarHBondContact O-CB 3.47Å; S101-D105 PolarHBondContact O-N 2.99Å |
| 102 | Y | 89.1 | Confident | 85 | Confident | 2 Ų | 2 | 30.7 Ų | 30.7 | 1% | 0.008 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.4 | -48.1 | 176.6 | -53.8 | -29 | 0 | 0 | 0 | 112.1 | Y86 L89 G90 I93 G98 Y100 K104 D105 I106 N245 T395 | Y86-Y102 HydrophobicContact CD1-CD2 4.47Å; Y86-Y102 HydrophobicContact CD1-CE2 4.21Å; Y86-Y102 HydrophobicContact CE1-CD2 4.47Å; L89-Y102 HydrophobicContact CB-CD1 4.42Å; L89-Y102 HydrophobicContact CB-CD2 4.13Å; L89-Y102 HydrophobicContact CB-CE2 4.2Å; L89-Y102 HydrophobicContact CB-CG 4.27Å; L89-Y102 HydrophobicContact CD1-CD2 4.2Å; L89-Y102 HydrophobicContact CD1-CG 4.42Å; G90-Y102 WeakPolarHBondContact CA-OH 3.16Å; I93-Y102 HydrophobicContact CB-CD1 4.17Å; I93-Y102 HydrophobicContact CB-CE1 4.31Å; I93-Y102 HydrophobicContact CG2-CD1 4.42Å; I93-Y102 WeakPolarHBondContact O-CE1 3.35Å; G98-Y102 WeakPolarHBondContact O-CD2 3.41Å; G98-Y102 PolarHBondContact O-N 3.32Å; G98-Y102 VanDerWaalsContact O-N 3.14Å; Y100-Y102 PolarHBondContact O-N 2.9Å; Y102-K104 VanDerWaalsContact C-N 3.32Å; Y102-K104 PolarHBondContact O-N 3.07Å; Y102-D105 PolarHBondContact O-N 3.43Å; Y102-I106 WeakPolarHBondContact O-CB 3.31Å; Y102-I106 WeakPolarHBondContact O-CD1 3.35Å; Y102-I106 VanDerWaalsContact O-CG1 3.22Å; Y102-I106 WeakPolarHBondContact O-CG1 3.41Å; Y102-I106 PolarHBondContact O-N 2.95Å; Y102-I106 VanDerWaalsContact O-N 3.15Å; Y102-N245 HydrophobicContact CE2-CB 4.41Å; Y102-T395 HydrophobicContact CD2-CG2 4.11Å |
| 103 | V | 91.4 | Very high | 85.2 | Confident | 1 Ų | 1 | 30.2 Ų | 30.2 | 1% | 0.006 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -65.8 | -38.7 | 180 | 175 | 0 | 0 | 0 | 0 | 110.6 | D99 Y100 F107 A111 V394 | D99-V103 VanDerWaalsContact O-CG2 3.31Å; D99-V103 WeakPolarHBondContact O-CG2 3.46Å; D99-V103 PolarHBondContact O-N 3.07Å; D99-V103 VanDerWaalsContact O-N 3.11Å; Y100-V103 PolarHBondContact O-N 3.26Å; V103-F107 HydrophobicContact CG1-CD2 4.25Å; V103-F107 WeakPolarHBondContact O-CB 3.41Å; V103-F107 PolarHBondContact O-N 3.47Å; V103-A111 HydrophobicContact CG1-CB 3.71Å; V103-V394 HydrophobicContact CG1-CG1 4.49Å; V103-V394 HydrophobicContact CG2-CG1 4.39Å |
| 104 | K | 90.3 | Very high | 85.6 | Confident | 38 Ų | 38 | 30.9 Ų | 30.9 | 17% | 0.165 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -61.8 | -47.8 | 176.9 | -175.4 | 178.4 | -179 | 171.6 | 0 | 112.2 | Y100 S101 Y102 I106 G108 E340 | Y100-K104 HydrophobicContact CE1-CD 4.42Å; Y100-K104 VanDerWaalsContact O-CB 3.29Å; Y100-K104 WeakPolarHBondContact O-CB 3.37Å; Y100-K104 PolarHBondContact O-N 2.88Å; S101-K104 PolarHBondContact O-N 2.96Å; Y102-K104 VanDerWaalsContact C-N 3.32Å; Y102-K104 PolarHBondContact O-N 3.07Å; K104-I106 VanDerWaalsContact C-N 3.34Å; K104-I106 PolarHBondContact O-N 3.24Å; K104-G108 CarbonylContact O-C 3.55Å; K104-G108 WeakPolarHBondContact O-CA 3.46Å; K104-G108 PolarHBondContact O-N 2.92Å; K104-E340 IonicContact NZ-OE1 2.79Å; K104-E340 IonicContact NZ-OE2 2.76Å; K104-E340 PolarHBondContact NZ-OE2 2.56Å |
| 105 | D | 88.9 | Confident | 86.4 | Confident | 70 Ų | 70 | 27.6 Ų | 27.6 | 37% | 0.374 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -68.7 | -32.6 | -177.5 | -78.8 | -2.7 | 0 | 0 | 0 | 112.5 | I93 K95 S101 Y102 | I93-D105 HydrophobicContact CD1-CB 4.25Å; I93-D105 WeakPolarHBondContact CG2-OD2 3.5Å; K95-D105 WeakPolarHBondContact CD-OD2 3.47Å; K95-D105 WeakPolarHBondContact CE-OD2 3.38Å; K95-D105 IonicContact NZ-OD1 3.95Å; K95-D105 PolarHBondContact NZ-OD1 3.48Å; K95-D105 IonicContact NZ-OD2 2.85Å; K95-D105 PolarHBondContact NZ-OD2 3.28Å; S101-D105 WeakPolarHBondContact O-CB 3.47Å; S101-D105 PolarHBondContact O-N 2.99Å; Y102-D105 PolarHBondContact O-N 3.43Å |
| 106 | I | 90.8 | Very high | 87.2 | Confident | 23 Ų | 23 | 23.1 Ų | 23.1 | 12% | 0.118 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -87.3 | -46 | -176 | -60.5 | 165.9 | 0 | 0 | 0 | 112.1 | L89 I93 Y102 K104 V401 L402 | L89-I106 HydrophobicContact CD2-CD1 4.22Å; I93-I106 HydrophobicContact CD1-CG1 4.5Å; Y102-I106 WeakPolarHBondContact O-CB 3.31Å; Y102-I106 WeakPolarHBondContact O-CD1 3.35Å; Y102-I106 VanDerWaalsContact O-CG1 3.22Å; Y102-I106 WeakPolarHBondContact O-CG1 3.41Å; Y102-I106 PolarHBondContact O-N 2.95Å; Y102-I106 VanDerWaalsContact O-N 3.15Å; K104-I106 VanDerWaalsContact C-N 3.34Å; K104-I106 PolarHBondContact O-N 3.24Å; I106-V401 HydrophobicContact CG2-CG1 4.48Å; I106-L402 HydrophobicContact CD1-CD2 4.25Å; I106-L402 HydrophobicContact CG1-CD1 4.42Å; I106-L402 HydrophobicContact CG1-CD2 4.36Å |
| 107 | F | 91.1 | Very high | 88.4 | Confident | 89 Ų | 89 | 22.6 Ų | 22.6 | 39% | 0.39 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -110.5 | -5.7 | -171.1 | -64 | -70.2 | 0 | 0 | 0 | 114.1 | V103 A111 V394 | V103-F107 HydrophobicContact CG1-CD2 4.25Å; V103-F107 WeakPolarHBondContact O-CB 3.41Å; V103-F107 PolarHBondContact O-N 3.47Å; F107-A111 HydrophobicContact CB-CB 3.56Å; F107-V394 HydrophobicContact CD2-CG1 4.14Å; F107-V394 HydrophobicContact CE2-CG1 3.84Å; F107-V394 WeakPolarHBondContact CE2-O 3.37Å |
| 108 | G | 89.3 | Confident | 89.6 | Confident | 30 Ų | 30 | 22.4 Ų | 22.4 | 31% | 0.309 | 12% | 0.124 | S | C | . | . | trans | 93.2 | -175.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115 | K104 L110 G112 | K104-G108 CarbonylContact O-C 3.55Å; K104-G108 WeakPolarHBondContact O-CA 3.46Å; K104-G108 PolarHBondContact O-N 2.92Å; G108-L110 PolarHBondContact O-N 3.02Å; G108-G112 PolarHBondContact O-N 3.31Å; G108-G112 VanDerWaalsContact O-N 3.15Å | ||
| 109 | G | 87.4 | Confident | 90 | Very high | 22 Ų | 22 | 22.4 Ų | 22.4 | 23% | 0.227 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -60 | -43.9 | -170 | 0 | 0 | 0 | 0 | 0 | 114.8 | G112 F113 H342 | G109-G112 PolarHBondContact O-N 2.98Å; G109-F113 WeakPolarHBondContact O-CB 3.42Å; G109-F113 PolarHBondContact O-N 2.95Å; G109-H342 PolarHBondContact O-CE1 3.36Å |
| 110 | L | 91.4 | Very high | 90.3 | Very high | 60 Ų | 60 | 22.7 Ų | 22.7 | 31% | 0.314 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -63.6 | -49.3 | -178.4 | 177.1 | 64.9 | 0 | 0 | 0 | 111.9 | G108 G112 F113 L114 Y456 | G108-L110 PolarHBondContact O-N 3.02Å; L110-G112 VanDerWaalsContact C-N 3.33Å; L110-G112 PolarHBondContact O-N 3.18Å; L110-F113 WeakPolarHBondContact O-CB 3.41Å; L110-F113 PolarHBondContact O-N 3.27Å; L110-L114 HydrophobicContact CD1-CG 4.4Å; L110-L114 HydrophobicContact CG-CD1 4.44Å; L110-L114 WeakPolarHBondContact O-CG 3.13Å; L110-L114 PolarHBondContact O-N 3.26Å; L110-Y456 HydrophobicContact CB-CD1 4.27Å; L110-Y456 HydrophobicContact CB-CE1 3.99Å; L110-Y456 HydrophobicContact CD1-CD1 3.47Å; L110-Y456 VanDerWaalsContact CD1-CD1 3.47Å; L110-Y456 HydrophobicContact CD1-CD2 4.45Å; L110-Y456 HydrophobicContact CD1-CE1 4.07Å; L110-Y456 HydrophobicContact CD1-CG 3.67Å; L110-Y456 HydrophobicContact CG-CD1 4.44Å; L110-Y456 PolarHBondContact N-OH 2.99Å |
| 111 | A | 92 | Very high | 90.4 | Very high | 26 Ų | 26 | 24.6 Ų | 24.6 | 22% | 0.215 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -64.2 | -40.1 | 180 | 0 | 0 | 0 | 0 | 0 | 111.5 | V103 F107 L114 R115 | V103-A111 HydrophobicContact CG1-CB 3.71Å; F107-A111 HydrophobicContact CB-CB 3.56Å; A111-L114 PolarHBondContact O-N 2.74Å; A111-R115 PolarHBondContact O-N 3.49Å |
| 112 | G | 90.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -59.5 | -45.6 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112 | Y100 G108 G109 L110 R115 L116 | Y100-G112 WeakPolarHBondContact CD2-O 3.29Å; Y100-G112 VanDerWaalsContact CE2-O 3.31Å; Y100-G112 WeakPolarHBondContact CE2-O 3.39Å; G108-G112 PolarHBondContact O-N 3.31Å; G108-G112 VanDerWaalsContact O-N 3.15Å; G109-G112 PolarHBondContact O-N 2.98Å; L110-G112 VanDerWaalsContact C-N 3.33Å; L110-G112 PolarHBondContact O-N 3.18Å; G112-R115 PolarHBondContact O-N 3.35Å; G112-L116 PolarHBondContact O-N 2.86Å |
| 113 | F | 91.6 | Very high | 90.5 | Very high | 7 Ų | 7 | 24.7 Ų | 24.7 | 3% | 0.031 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -61.1 | -45.1 | 175.9 | -179.1 | -89.9 | 0 | 0 | 0 | 112.4 | G109 L110 R115 L116 W117 H342 G452 V455 Y456 V460 | G109-F113 WeakPolarHBondContact O-CB 3.42Å; G109-F113 PolarHBondContact O-N 2.95Å; L110-F113 WeakPolarHBondContact O-CB 3.41Å; L110-F113 PolarHBondContact O-N 3.27Å; F113-R115 VanDerWaalsContact C-N 3.29Å; F113-R115 PolarHBondContact O-N 3.27Å; F113-L116 WeakPolarHBondContact O-CB 3.15Å; F113-L116 PolarHBondContact O-N 3.24Å; F113-L116 VanDerWaalsContact O-N 3.13Å; F113-W117 HydrophobicContact CD1-CB 4.31Å; F113-W117 HydrophobicContact CE1-CB 4.04Å; F113-W117 HydrophobicContact CE1-CD2 4.18Å; F113-W117 HydrophobicContact CE1-CE3 4.02Å; F113-W117 HydrophobicContact CE1-CG 4.23Å; F113-W117 HydrophobicContact CZ-CD2 4.35Å; F113-W117 AromaticContact CZ-CE3 3.73Å; F113-W117 HydrophobicContact CZ-CE3 3.73Å; F113-W117 HydrophobicContact CZ-CZ3 4.32Å; F113-W117 VanDerWaalsContact O-CB 3.26Å; F113-W117 WeakPolarHBondContact O-CB 3.42Å; F113-W117 PolarHBondContact O-N 3.06Å; F113-H342 HydrophobicContact CD2-CB 3.97Å; F113-H342 WeakPolarHBondContact CE2-O 3.29Å; F113-G452 WeakPolarHBondContact CE1-O 3.3Å; F113-V455 HydrophobicContact CZ-CB 4.47Å; F113-V455 HydrophobicContact CZ-CG1 4Å; F113-Y456 HydrophobicContact CB-CD2 3.4Å; F113-Y456 HydrophobicContact CB-CE2 3.83Å; F113-Y456 HydrophobicContact CB-CG 4.31Å; F113-Y456 AromaticContact CD1-CD2 3.93Å; F113-Y456 HydrophobicContact CD1-CD2 3.93Å; F113-Y456 HydrophobicContact CD1-CG 4.23Å; F113-Y456 AromaticContact CD2-CD2 3.84Å; F113-Y456 HydrophobicContact CD2-CD2 3.84Å; F113-Y456 AromaticContact CG-CD2 3.44Å; F113-Y456 HydrophobicContact CG-CD2 3.44Å; F113-Y456 VanDerWaalsContact CG-CD2 3.44Å; F113-Y456 HydrophobicContact CG-CE2 4.3Å; F113-Y456 HydrophobicContact CG-CG 4.19Å; F113-V460 HydrophobicContact CD2-CG2 4.47Å |
| 114 | L | 93 | Very high | 90.4 | Very high | 28 Ų | 28 | 25.3 Ų | 25.3 | 15% | 0.147 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.4 | -39.7 | 178 | -68.5 | 179.2 | 0 | 0 | 0 | 112 | L110 A111 L116 I118 F391 M449 V453 | L110-L114 HydrophobicContact CD1-CG 4.4Å; L110-L114 HydrophobicContact CG-CD1 4.44Å; L110-L114 WeakPolarHBondContact O-CG 3.13Å; L110-L114 PolarHBondContact O-N 3.26Å; A111-L114 PolarHBondContact O-N 2.74Å; L114-L116 VanDerWaalsContact C-N 3.35Å; L114-I118 WeakPolarHBondContact O-CB 3.38Å; L114-I118 PolarHBondContact O-N 2.83Å; L114-I118 VanDerWaalsContact O-N 3.08Å; L114-F391 HydrophobicContact CB-CZ 4.49Å; L114-M449 WeakPolarHBondContact CD2-O 3.44Å; L114-V453 HydrophobicContact CD1-CG2 4.3Å; L114-V453 HydrophobicContact CD2-CG2 4Å |
| 115 | R | 91.6 | Very high | 90.5 | Very high | 11 Ų | 11 | 23.5 Ų | 23.5 | 4% | 0.042 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.6 | -43.2 | 174.4 | 176.4 | 64.1 | -171.1 | 90.2 | -4.2 | 111.8 | D99 A111 G112 F113 A119 F391 | D99-R115 IonicContact OD2-CZ 3.35Å; D99-R115 IonicContact OD2-NE 3.71Å; D99-R115 IonicContact OD2-NH2 2.78Å; D99-R115 PolarHBondContact OD2-NH2 3.38Å; A111-R115 PolarHBondContact O-N 3.49Å; G112-R115 PolarHBondContact O-N 3.35Å; F113-R115 VanDerWaalsContact C-N 3.29Å; F113-R115 PolarHBondContact O-N 3.27Å; R115-A119 WeakPolarHBondContact O-CB 3.22Å; R115-A119 PolarHBondContact O-N 3.12Å; R115-A119 VanDerWaalsContact O-N 3.07Å; R115-F391 HydrophobicContact CB-CD1 3.99Å; R115-F391 HydrophobicContact CB-CE1 3.82Å; R115-F391 VanDerWaalsContact CD-CG 3.47Å; R115-F391 HydrophobicContact CG-CD1 4.23Å |
| 116 | L | 91.1 | Very high | 90.6 | Very high | 1 Ų | 1 | 20.1 Ų | 20.1 | 1% | 0.005 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -67.6 | -48.1 | 178.3 | -179.1 | 64.7 | 0 | 0 | 0 | 111.8 | Y100 G112 F113 L114 I118 A119 V120 L333 H342 L343 | Y100-L116 HydrophobicContact CD2-CB 3.76Å; Y100-L116 HydrophobicContact CE2-CB 3.93Å; Y100-L116 HydrophobicContact CE2-CD2 4.06Å; G112-L116 PolarHBondContact O-N 2.86Å; F113-L116 WeakPolarHBondContact O-CB 3.15Å; F113-L116 PolarHBondContact O-N 3.24Å; F113-L116 VanDerWaalsContact O-N 3.13Å; L114-L116 VanDerWaalsContact C-N 3.35Å; L116-I118 VanDerWaalsContact C-N 3.33Å; L116-I118 PolarHBondContact O-N 3.15Å; L116-A119 PolarHBondContact O-N 3.42Å; L116-A119 VanDerWaalsContact O-N 3.14Å; L116-V120 HydrophobicContact CD1-CG2 4.15Å; L116-V120 WeakPolarHBondContact O-CB 3.48Å; L116-V120 WeakPolarHBondContact O-CG2 3.38Å; L116-V120 PolarHBondContact O-N 2.78Å; L116-L333 HydrophobicContact CD1-CD1 3.89Å; L116-L333 HydrophobicContact CD1-CD2 3.9Å; L116-L333 HydrophobicContact CD1-CG 3.58Å; L116-H342 HydrophobicContact CD2-CB 3.85Å; L116-L343 HydrophobicContact CD1-CD1 4.14Å; L116-L343 HydrophobicContact CD2-CD1 3.77Å; L116-L343 HydrophobicContact CD2-CG 3.82Å; L116-L343 HydrophobicContact CG-CD1 4.11Å; L116-L343 HydrophobicContact CG-CG 4.49Å |
| 117 | W | 92.4 | Very high | 90.5 | Very high | 52 Ų | 52 | 20.7 Ų | 20.7 | 20% | 0.197 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -52.9 | -50.7 | 178.6 | -177.9 | -106.7 | 0 | 0 | 0 | 111.3 | F113 V120 L121 I448 T451 V455 | F113-W117 HydrophobicContact CD1-CB 4.31Å; F113-W117 HydrophobicContact CE1-CB 4.04Å; F113-W117 HydrophobicContact CE1-CD2 4.18Å; F113-W117 HydrophobicContact CE1-CE3 4.02Å; F113-W117 HydrophobicContact CE1-CG 4.23Å; F113-W117 HydrophobicContact CZ-CD2 4.35Å; F113-W117 AromaticContact CZ-CE3 3.73Å; F113-W117 HydrophobicContact CZ-CE3 3.73Å; F113-W117 HydrophobicContact CZ-CZ3 4.32Å; F113-W117 VanDerWaalsContact O-CB 3.26Å; F113-W117 WeakPolarHBondContact O-CB 3.42Å; F113-W117 PolarHBondContact O-N 3.06Å; W117-V120 PolarHBondContact O-N 3.13Å; W117-L121 HydrophobicContact CD2-CD1 3.68Å; W117-L121 HydrophobicContact CE3-CD1 4.05Å; W117-L121 HydrophobicContact CG-CD1 4.32Å; W117-L121 HydrophobicContact CH2-CD1 3.73Å; W117-L121 HydrophobicContact CZ2-CD1 3.33Å; W117-L121 HydrophobicContact CZ3-CD1 4.07Å; W117-L121 WeakPolarHBondContact O-CB 3.24Å; W117-L121 WeakPolarHBondContact O-CG 3.29Å; W117-L121 PolarHBondContact O-N 3.12Å; W117-I448 PolarHBondContact NE1-O 2.9Å; W117-T451 PolarHBondContact NE1-OG1 2.97Å; W117-V455 HydrophobicContact CE3-CG1 4.5Å; W117-V455 HydrophobicContact CH2-CB 4.27Å; W117-V455 HydrophobicContact CH2-CG1 3.94Å; W117-V455 HydrophobicContact CH2-CG2 3.96Å; W117-V455 HydrophobicContact CZ2-CG2 4.13Å; W117-V455 HydrophobicContact CZ3-CB 4.47Å; W117-V455 HydrophobicContact CZ3-CG1 3.82Å |
| 118 | I | 91.5 | Very high | 90.5 | Very high | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -68.5 | -39.6 | 177.8 | -77.2 | -66.4 | 0 | 0 | 0 | 112.4 | L114 L116 V120 V122 I123 I387 F391 I448 M449 | L114-I118 WeakPolarHBondContact O-CB 3.38Å; L114-I118 PolarHBondContact O-N 2.83Å; L114-I118 VanDerWaalsContact O-N 3.08Å; L116-I118 VanDerWaalsContact C-N 3.33Å; L116-I118 PolarHBondContact O-N 3.15Å; I118-V120 VanDerWaalsContact C-N 3.28Å; I118-V120 PolarHBondContact O-N 2.83Å; I118-V122 HydrophobicContact CD1-CB 4.44Å; I118-V122 HydrophobicContact CD1-CG2 3.97Å; I118-V122 HydrophobicContact CG2-CB 4.39Å; I118-V122 WeakPolarHBondContact O-CA 3.41Å; I118-V122 VanDerWaalsContact O-CB 3.29Å; I118-V122 WeakPolarHBondContact O-CB 3.46Å; I118-V122 PolarHBondContact O-N 3.03Å; I118-I123 HydrophobicContact CG2-CD1 3.76Å; I118-I123 HydrophobicContact CG2-CG1 3.99Å; I118-I123 PolarHBondContact O-N 3.02Å; I118-I387 HydrophobicContact CB-CG2 4.46Å; I118-I387 HydrophobicContact CD1-CG2 4.44Å; I118-I387 HydrophobicContact CG2-CG2 3.15Å; I118-F391 HydrophobicContact CB-CE2 3.76Å; I118-F391 HydrophobicContact CB-CZ 4.25Å; I118-F391 HydrophobicContact CG1-CE2 3.85Å; I118-F391 HydrophobicContact CG1-CZ 4.2Å; I118-F391 HydrophobicContact CG2-CD2 4.02Å; I118-F391 HydrophobicContact CG2-CE2 3.6Å; I118-I448 HydrophobicContact CD1-CG2 4.04Å; I118-M449 HydrophobicContact CD1-CB 3.85Å; I118-M449 HydrophobicContact CG1-CB 3.98Å; I118-M449 HydrophobicContact CG1-CG 4.1Å |
| 119 | A | 89.8 | Confident | 90.6 | Very high | 1 Ų | 1 | 15 Ų | 15 | 1% | 0.008 | 8% | 0.083 | C | C | . | . | I | π-helix | trans | -58.8 | -46.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | R115 L116 I123 Y124 L333 | R115-A119 WeakPolarHBondContact O-CB 3.22Å; R115-A119 PolarHBondContact O-N 3.12Å; R115-A119 VanDerWaalsContact O-N 3.07Å; L116-A119 PolarHBondContact O-N 3.42Å; L116-A119 VanDerWaalsContact O-N 3.14Å; A119-I123 HydrophobicContact CB-CD1 4.43Å; A119-I123 PolarHBondContact O-N 3.44Å; A119-Y124 HydrophobicContact CB-CD2 4.27Å; A119-Y124 HydrophobicContact CB-CE2 4.27Å; A119-Y124 VanDerWaalsContact O-CD2 3.27Å; A119-Y124 WeakPolarHBondContact O-CD2 3.43Å; A119-Y124 PolarHBondContact O-N 3.47Å; A119-L333 HydrophobicContact CB-CD2 3.35Å |
| 120 | V | 89.3 | Confident | 90.8 | Very high | 5 Ų | 5 | 14 Ų | 14 | 3% | 0.03 | 7% | 0.072 | C | C | . | . | I | π-helix | trans | -71.7 | -42.6 | -173.4 | 163.5 | 0 | 0 | 0 | 0 | 112.2 | L116 W117 I118 P125 L333 F334 F363 | L116-V120 HydrophobicContact CD1-CG2 4.15Å; L116-V120 WeakPolarHBondContact O-CB 3.48Å; L116-V120 WeakPolarHBondContact O-CG2 3.38Å; L116-V120 PolarHBondContact O-N 2.78Å; W117-V120 PolarHBondContact O-N 3.13Å; I118-V120 VanDerWaalsContact C-N 3.28Å; I118-V120 PolarHBondContact O-N 2.83Å; V120-P125 WeakPolarHBondContact O-CD 3.29Å; V120-P125 WeakPolarHBondContact O-CG 3.43Å; V120-L333 HydrophobicContact CG2-CD2 4.44Å; V120-F334 HydrophobicContact CB-CE1 4.3Å; V120-F334 HydrophobicContact CB-CZ 4.2Å; V120-F334 HydrophobicContact CG1-CE1 3.51Å; V120-F334 HydrophobicContact CG1-CZ 3.56Å; V120-F334 HydrophobicContact CG2-CD1 4.34Å; V120-F334 HydrophobicContact CG2-CE1 3.81Å; V120-F334 HydrophobicContact CG2-CE2 4.38Å; V120-F334 HydrophobicContact CG2-CZ 3.82Å; V120-F363 HydrophobicContact CG1-CD1 4.12Å; V120-F363 HydrophobicContact CG1-CE1 3.42Å; V120-F363 VanDerWaalsContact CG1-CE1 3.42Å; V120-F363 HydrophobicContact CG1-CZ 4.28Å |
| 121 | L | 89.4 | Confident | 90.7 | Very high | 43 Ų | 43 | 12.1 Ų | 12.1 | 23% | 0.225 | 6% | 0.062 | C | C | . | . | I | π-helix | trans | -90.9 | -30.8 | -175.2 | -64.5 | -179.3 | 0 | 0 | 0 | 113.9 | W117 F363 M371 | W117-L121 HydrophobicContact CD2-CD1 3.68Å; W117-L121 HydrophobicContact CE3-CD1 4.05Å; W117-L121 HydrophobicContact CG-CD1 4.32Å; W117-L121 HydrophobicContact CH2-CD1 3.73Å; W117-L121 HydrophobicContact CZ2-CD1 3.33Å; W117-L121 HydrophobicContact CZ3-CD1 4.07Å; W117-L121 WeakPolarHBondContact O-CB 3.24Å; W117-L121 WeakPolarHBondContact O-CG 3.29Å; W117-L121 PolarHBondContact O-N 3.12Å; L121-F363 HydrophobicContact CD2-CE1 4.13Å; L121-F363 HydrophobicContact CD2-CZ 3.84Å; L121-M371 VanDerWaalsContact O-CE 3.29Å; L121-M371 WeakPolarHBondContact O-CE 3.24Å |
| 122 | V | 88.9 | Confident | 90.8 | Very high | 1 Ų | 1 | 10.9 Ų | 10.9 | 1% | 0.006 | 5% | 0.052 | C | C | . | . | I | π-helix | trans | -112.4 | -62.1 | -170.8 | 166.7 | 0 | 0 | 0 | 0 | 111 | I118 T126 Y383 I387 I448 | I118-V122 HydrophobicContact CD1-CB 4.44Å; I118-V122 HydrophobicContact CD1-CG2 3.97Å; I118-V122 HydrophobicContact CG2-CB 4.39Å; I118-V122 WeakPolarHBondContact O-CA 3.41Å; I118-V122 VanDerWaalsContact O-CB 3.29Å; I118-V122 WeakPolarHBondContact O-CB 3.46Å; I118-V122 PolarHBondContact O-N 3.03Å; V122-T126 WeakPolarHBondContact O-CB 3.37Å; V122-T126 PolarHBondContact O-N 2.97Å; V122-T126 VanDerWaalsContact O-N 3.08Å; V122-T126 PolarHBondContact O-OG1 3.47Å; V122-Y383 HydrophobicContact CB-CE1 3.99Å; V122-Y383 HydrophobicContact CG1-CD1 3.79Å; V122-Y383 HydrophobicContact CG1-CE1 3.17Å; V122-Y383 HydrophobicContact CG2-CE1 3.83Å; V122-Y383 VanDerWaalsContact CG2-OH 3.24Å; V122-Y383 WeakPolarHBondContact CG2-OH 3.48Å; V122-I387 HydrophobicContact CG1-CB 4.48Å; V122-I387 HydrophobicContact CG1-CG2 4.24Å; V122-I448 HydrophobicContact CG2-CG2 3.77Å |
| 123 | I | 89.1 | Confident | 90.8 | Very high | 10 Ų | 10 | 11.7 Ų | 11.7 | 5% | 0.051 | 6% | 0.056 | C | C | . | . | I | π-helix | trans | -66.8 | -55 | -166.3 | -61.1 | 166.7 | 0 | 0 | 0 | 111.3 | I118 A119 N127 I387 N388 | I118-I123 HydrophobicContact CG2-CD1 3.76Å; I118-I123 HydrophobicContact CG2-CG1 3.99Å; I118-I123 PolarHBondContact O-N 3.02Å; A119-I123 HydrophobicContact CB-CD1 4.43Å; A119-I123 PolarHBondContact O-N 3.44Å; I123-N127 WeakPolarHBondContact O-CB 3.45Å; I123-N127 PolarHBondContact O-N 3.44Å; I123-N127 PolarHBondContact O-ND2 3.38Å; I123-I387 HydrophobicContact CG1-CG2 4.41Å; I123-N388 WeakPolarHBondContact CD1-OD1 3.17Å; I123-N388 VanDerWaalsContact CG1-OD1 3.26Å; I123-N388 WeakPolarHBondContact CG1-OD1 3.25Å; I123-N388 VanDerWaalsContact CG2-OD1 3.3Å; I123-N388 WeakPolarHBondContact CG2-OD1 3.31Å |
| 124 | Y | 89.2 | Confident | 90.7 | Very high | 14 Ų | 14 | 11.4 Ų | 11.4 | 6% | 0.055 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -65.5 | -49.7 | -177.8 | -79.1 | -72.2 | 0 | 0 | 0 | 112.8 | A119 T126 N127 Q128 L333 | A119-Y124 HydrophobicContact CB-CD2 4.27Å; A119-Y124 HydrophobicContact CB-CE2 4.27Å; A119-Y124 VanDerWaalsContact O-CD2 3.27Å; A119-Y124 WeakPolarHBondContact O-CD2 3.43Å; A119-Y124 PolarHBondContact O-N 3.47Å; Y124-T126 PolarHBondContact O-N 2.96Å; Y124-N127 PolarHBondContact O-N 2.93Å; Y124-Q128 VanDerWaalsContact O-CG 3.32Å; Y124-Q128 WeakPolarHBondContact O-CG 3.48Å; Y124-Q128 PolarHBondContact O-N 3.48Å; Y124-L333 HydrophobicContact CD2-CD2 4.32Å; Y124-L333 HydrophobicContact CE2-CB 4.34Å; Y124-L333 HydrophobicContact CE2-CD2 3.64Å |
| 125 | P | 91.7 | Very high | 90.7 | Very high | 0 Ų | 0 | 10.9 Ų | 10.9 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -61.8 | -44.6 | -178.5 | -27.5 | 38.7 | 0 | 0 | 0 | 112.8 | V120 Q128 A129 T368 M371 | V120-P125 WeakPolarHBondContact O-CD 3.29Å; V120-P125 WeakPolarHBondContact O-CG 3.43Å; P125-Q128 PolarHBondContact O-N 3.38Å; P125-A129 WeakPolarHBondContact O-CB 3.39Å; P125-A129 PolarHBondContact O-N 3.14Å; P125-T368 VanDerWaalsContact CA-OG1 3.31Å; P125-T368 WeakPolarHBondContact CA-OG1 3.37Å; P125-T368 WeakPolarHBondContact O-CG2 3.47Å; P125-M371 HydrophobicContact CB-CG 4Å |
| 126 | T | 90.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 10.4 Ų | 10.4 | 0% | 0 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -71.5 | -37.9 | -176.6 | -46.2 | 0 | 0 | 0 | 0 | 111.4 | V122 Y124 Q128 A129 V130 L380 V384 | V122-T126 WeakPolarHBondContact O-CB 3.37Å; V122-T126 PolarHBondContact O-N 2.97Å; V122-T126 VanDerWaalsContact O-N 3.08Å; V122-T126 PolarHBondContact O-OG1 3.47Å; Y124-T126 PolarHBondContact O-N 2.96Å; T126-Q128 VanDerWaalsContact C-N 3.35Å; T126-Q128 PolarHBondContact O-N 3.07Å; T126-A129 PolarHBondContact O-N 3.07Å; T126-V130 WeakPolarHBondContact O-CG2 3.4Å; T126-V130 PolarHBondContact O-N 3.13Å; T126-L380 HydrophobicContact CG2-CB 3.68Å; T126-L380 HydrophobicContact CG2-CD2 3.76Å; T126-L380 HydrophobicContact CG2-CG 3.64Å; T126-V384 HydrophobicContact CG2-CG2 3.25Å |
| 127 | N | 89.6 | Confident | 90.6 | Very high | 35 Ų | 35 | 11.5 Ų | 11.5 | 19% | 0.187 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -58.4 | -46.5 | 171.4 | -81.9 | -24.5 | 0 | 0 | 0 | 111.6 | I123 Y124 A129 V130 I131 F236 V384 | I123-N127 WeakPolarHBondContact O-CB 3.45Å; I123-N127 PolarHBondContact O-N 3.44Å; I123-N127 PolarHBondContact O-ND2 3.38Å; Y124-N127 PolarHBondContact O-N 2.93Å; N127-A129 VanDerWaalsContact C-N 3.33Å; N127-A129 PolarHBondContact O-N 3.04Å; N127-V130 PolarHBondContact O-N 3.06Å; N127-I131 WeakPolarHBondContact O-CD1 3.26Å; N127-I131 WeakPolarHBondContact O-CG1 3.37Å; N127-I131 PolarHBondContact O-N 2.58Å; N127-I131 VanDerWaalsContact O-N 3.1Å; N127-F236 WeakPolarHBondContact OD1-CE2 3.43Å; N127-V384 WeakPolarHBondContact OD1-CG1 3.31Å |
| 128 | Q | 91.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 9.2 Ų | 9.2 | 0% | 0 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -62.9 | -40.7 | 177.7 | -70.2 | 171.2 | 20.8 | 0 | 0 | 111.7 | Y124 P125 T126 I131 A132 L162 S326 T368 | Y124-Q128 VanDerWaalsContact O-CG 3.32Å; Y124-Q128 WeakPolarHBondContact O-CG 3.48Å; Y124-Q128 PolarHBondContact O-N 3.48Å; P125-Q128 PolarHBondContact O-N 3.38Å; T126-Q128 VanDerWaalsContact C-N 3.35Å; T126-Q128 PolarHBondContact O-N 3.07Å; Q128-I131 PolarHBondContact O-N 3.39Å; Q128-A132 VanDerWaalsContact O-CB 3.27Å; Q128-A132 WeakPolarHBondContact O-CB 3.48Å; Q128-A132 PolarHBondContact O-N 3.06Å; Q128-L162 HydrophobicContact CB-CD1 4.49Å; Q128-S326 VanDerWaalsContact CG-OG 3.32Å; Q128-S326 WeakPolarHBondContact CG-OG 3.16Å; Q128-S326 PolarHBondContact NE2-OG 2.93Å; Q128-T368 HydrophobicContact CB-CG2 3.64Å; Q128-T368 PolarHBondContact OE1-OG1 3.47Å |
| 129 | A | 92.1 | Very high | 90.5 | Very high | 0 Ų | 0 | 11.6 Ų | 11.6 | 0% | 0 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -63.3 | -46.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | P125 T126 N127 I131 A132 L133 T368 M371 L372 L380 | P125-A129 WeakPolarHBondContact O-CB 3.39Å; P125-A129 PolarHBondContact O-N 3.14Å; T126-A129 PolarHBondContact O-N 3.07Å; N127-A129 VanDerWaalsContact C-N 3.33Å; N127-A129 PolarHBondContact O-N 3.04Å; A129-I131 VanDerWaalsContact C-N 3.35Å; A129-I131 PolarHBondContact O-N 3.08Å; A129-A132 PolarHBondContact O-N 3.39Å; A129-L133 WeakPolarHBondContact O-CB 3.25Å; A129-L133 WeakPolarHBondContact O-CG 3.31Å; A129-L133 PolarHBondContact O-N 2.77Å; A129-T368 HydrophobicContact CB-CG2 4.1Å; A129-M371 HydrophobicContact CB-CB 4.28Å; A129-L372 HydrophobicContact CB-CD1 4.37Å; A129-L380 HydrophobicContact CB-CD2 4.04Å |
| 130 | V | 90.5 | Very high | 90.5 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -60.3 | -44.7 | 177.6 | 172.9 | 0 | 0 | 0 | 0 | 111 | T126 N127 L133 T134 F236 M377 L380 I381 | T126-V130 WeakPolarHBondContact O-CG2 3.4Å; T126-V130 PolarHBondContact O-N 3.13Å; N127-V130 PolarHBondContact O-N 3.06Å; V130-L133 PolarHBondContact O-N 3.38Å; V130-T134 PolarHBondContact O-N 3.35Å; V130-T134 PolarHBondContact O-OG1 3.28Å; V130-F236 HydrophobicContact CB-CZ 4.16Å; V130-F236 HydrophobicContact CG1-CE1 3.98Å; V130-F236 HydrophobicContact CG1-CE2 4.3Å; V130-F236 HydrophobicContact CG1-CZ 3.51Å; V130-M377 HydrophobicContact CG1-CE 3.74Å; V130-M377 HydrophobicContact CG1-CG 4.2Å; V130-L380 HydrophobicContact CG2-CB 3.68Å; V130-L380 HydrophobicContact CG2-CD2 4.21Å; V130-I381 HydrophobicContact CG1-CD1 3.89Å; V130-I381 HydrophobicContact CG1-CG1 3.72Å; V130-I381 HydrophobicContact CG2-CG1 3.96Å |
| 131 | I | 90.5 | Very high | 90.4 | Very high | 20 Ų | 20 | 13 Ų | 13 | 10% | 0.103 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -66.1 | -40.9 | 178.8 | -58.1 | 165.9 | 0 | 0 | 0 | 110.8 | S49 N127 Q128 A129 T134 F135 T319 V323 | S49-I131 WeakPolarHBondContact OG-CG1 3.29Å; N127-I131 WeakPolarHBondContact O-CD1 3.26Å; N127-I131 WeakPolarHBondContact O-CG1 3.37Å; N127-I131 PolarHBondContact O-N 2.58Å; N127-I131 VanDerWaalsContact O-N 3.1Å; Q128-I131 PolarHBondContact O-N 3.39Å; A129-I131 VanDerWaalsContact C-N 3.35Å; A129-I131 PolarHBondContact O-N 3.08Å; I131-T134 VanDerWaalsContact O-CB 3.31Å; I131-T134 WeakPolarHBondContact O-CB 3.33Å; I131-T134 PolarHBondContact O-N 3.38Å; I131-F135 PolarHBondContact O-N 3.41Å; I131-T319 HydrophobicContact CG2-CG2 4.34Å; I131-T319 WeakPolarHBondContact CG2-O 3.44Å; I131-V323 HydrophobicContact CB-CG2 3.84Å; I131-V323 HydrophobicContact CG2-CG2 3.61Å |
| 132 | A | 92.5 | Very high | 90.3 | Very high | 1 Ų | 1 | 13.8 Ų | 13.8 | 1% | 0.008 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -68.1 | -36.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q128 A129 F135 S136 A158 V323 | Q128-A132 VanDerWaalsContact O-CB 3.27Å; Q128-A132 WeakPolarHBondContact O-CB 3.48Å; Q128-A132 PolarHBondContact O-N 3.06Å; A129-A132 PolarHBondContact O-N 3.39Å; A132-F135 WeakPolarHBondContact O-CB 3.48Å; A132-F135 PolarHBondContact O-N 3.14Å; A132-S136 PolarHBondContact O-N 3.49Å; A132-S136 VanDerWaalsContact O-N 3.14Å; A132-A158 HydrophobicContact CB-CB 3.97Å; A132-A158 VanDerWaalsContact O-CB 3.3Å; A132-A158 WeakPolarHBondContact O-CB 3.03Å; A132-V323 HydrophobicContact CB-CG2 4.4Å |
| 133 | L | 91.3 | Very high | 90.2 | Very high | 16 Ų | 16 | 19.6 Ų | 19.6 | 8% | 0.084 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -65.9 | -41 | 171.6 | -73.5 | 170.9 | 0 | 0 | 0 | 111 | A129 V130 F135 S136 N137 A158 L372 M377 | A129-L133 WeakPolarHBondContact O-CB 3.25Å; A129-L133 WeakPolarHBondContact O-CG 3.31Å; A129-L133 PolarHBondContact O-N 2.77Å; V130-L133 PolarHBondContact O-N 3.38Å; L133-F135 VanDerWaalsContact C-N 3.3Å; L133-F135 PolarHBondContact O-N 3.49Å; L133-S136 PolarHBondContact O-N 3.36Å; L133-S136 VanDerWaalsContact O-N 3.13Å; L133-S136 PolarHBondContact O-OG 3.38Å; L133-N137 PolarHBondContact O-N 3.15Å; L133-N137 PolarHBondContact O-ND2 3.04Å; L133-A158 HydrophobicContact CD2-CB 4.21Å; L133-L372 HydrophobicContact CD1-CD1 4.14Å; L133-L372 HydrophobicContact CD2-CD1 3.65Å; L133-L372 HydrophobicContact CG-CD1 3.6Å; L133-M377 HydrophobicContact CB-CG 4.45Å; L133-M377 HydrophobicContact CB-SD 4.13Å; L133-M377 HydrophobicContact CD1-CB 4.27Å |
| 134 | T | 90.4 | Very high | 90.2 | Very high | 1 Ų | 1 | 22.4 Ų | 22.4 | 1% | 0.006 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -55.8 | -47.1 | 172.7 | -48.4 | 0 | 0 | 0 | 0 | 110.6 | V53 V130 I131 S136 N137 Y138 T319 M377 | V53-T134 HydrophobicContact CG2-CG2 3.48Å; V53-T134 VanDerWaalsContact CG2-CG2 3.48Å; V53-T134 WeakPolarHBondContact CG2-OG1 3.16Å; V130-T134 PolarHBondContact O-N 3.35Å; V130-T134 PolarHBondContact O-OG1 3.28Å; I131-T134 VanDerWaalsContact O-CB 3.31Å; I131-T134 WeakPolarHBondContact O-CB 3.33Å; I131-T134 PolarHBondContact O-N 3.38Å; T134-S136 VanDerWaalsContact C-N 3.32Å; T134-S136 PolarHBondContact O-N 3.32Å; T134-N137 PolarHBondContact O-N 3.27Å; T134-Y138 HydrophobicContact CG2-CD2 3.69Å; T134-Y138 HydrophobicContact CG2-CE2 3.76Å; T134-Y138 WeakPolarHBondContact O-CB 3.32Å; T134-Y138 VanDerWaalsContact O-CD2 3.23Å; T134-Y138 WeakPolarHBondContact O-CD2 3.28Å; T134-Y138 PolarHBondContact O-N 3.34Å; T134-T319 HydrophobicContact CG2-CG2 3.67Å; T134-M377 WeakPolarHBondContact OG1-CE 3.31Å |
| 135 | F | 92.1 | Very high | 89.7 | Confident | 18 Ų | 18 | 25.1 Ų | 25.1 | 8% | 0.079 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -52.7 | -50.9 | 175.4 | 166.4 | -105 | 0 | 0 | 0 | 111.5 | I131 A132 L133 N137 Y138 V139 L157 C161 A316 T319 F320 | I131-F135 PolarHBondContact O-N 3.41Å; A132-F135 WeakPolarHBondContact O-CB 3.48Å; A132-F135 PolarHBondContact O-N 3.14Å; L133-F135 VanDerWaalsContact C-N 3.3Å; L133-F135 PolarHBondContact O-N 3.49Å; F135-N137 PolarHBondContact O-N 2.85Å; F135-Y138 PolarHBondContact O-N 3.04Å; F135-V139 HydrophobicContact CD2-CG2 3.94Å; F135-V139 HydrophobicContact CE2-CG2 3.44Å; F135-V139 VanDerWaalsContact CE2-CG2 3.44Å; F135-V139 HydrophobicContact CZ-CG2 3.83Å; F135-V139 WeakPolarHBondContact O-CG2 3.43Å; F135-V139 PolarHBondContact O-N 3.46Å; F135-L157 HydrophobicContact CE1-CD1 4.23Å; F135-L157 HydrophobicContact CE1-CD2 4.44Å; F135-L157 HydrophobicContact CE1-CG 3.91Å; F135-C161 HydrophobicContact CD1-CB 3.56Å; F135-C161 HydrophobicContact CE1-CB 3.65Å; F135-C161 HydrophobicContact CG-CB 4.4Å; F135-A316 HydrophobicContact CD2-CB 3.9Å; F135-A316 HydrophobicContact CE2-CB 3.87Å; F135-T319 WeakPolarHBondContact CA-OG1 3.24Å; F135-T319 HydrophobicContact CB-CG2 4.47Å; F135-T319 VanDerWaalsContact CB-OG1 3.29Å; F135-T319 WeakPolarHBondContact CB-OG1 3.48Å; F135-F320 AromaticContact CD2-CD2 3.71Å; F135-F320 HydrophobicContact CD2-CD2 3.71Å; F135-F320 AromaticContact CD2-CE2 3.71Å; F135-F320 HydrophobicContact CD2-CE2 3.71Å; F135-F320 HydrophobicContact CE1-CE2 4.15Å; F135-F320 HydrophobicContact CE1-CZ 4.42Å; F135-F320 AromaticContact CE2-CD2 3.52Å; F135-F320 HydrophobicContact CE2-CD2 3.52Å; F135-F320 AromaticContact CE2-CE2 3.09Å; F135-F320 HydrophobicContact CE2-CE2 3.09Å; F135-F320 HydrophobicContact CE2-CZ 4.08Å; F135-F320 HydrophobicContact CG-CE2 4.46Å; F135-F320 HydrophobicContact CZ-CD2 4.21Å; F135-F320 AromaticContact CZ-CE2 3.34Å; F135-F320 HydrophobicContact CZ-CE2 3.34Å; F135-F320 AromaticContact CZ-CZ 3.92Å; F135-F320 HydrophobicContact CZ-CZ 3.92Å |
| 136 | S | 92.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.5 | -41.9 | -177.9 | 68.6 | 0 | 0 | 0 | 0 | 113.2 | A132 L133 T134 Y138 V139 L140 L154 | A132-S136 PolarHBondContact O-N 3.49Å; A132-S136 VanDerWaalsContact O-N 3.14Å; L133-S136 PolarHBondContact O-N 3.36Å; L133-S136 VanDerWaalsContact O-N 3.13Å; L133-S136 PolarHBondContact O-OG 3.38Å; T134-S136 VanDerWaalsContact C-N 3.32Å; T134-S136 PolarHBondContact O-N 3.32Å; S136-Y138 PolarHBondContact O-N 3.06Å; S136-V139 PolarHBondContact O-N 3.25Å; S136-L140 WeakPolarHBondContact O-CB 3.34Å; S136-L140 WeakPolarHBondContact O-CG 3.45Å; S136-L140 PolarHBondContact O-N 2.96Å; S136-L154 VanDerWaalsContact CB-O 3.28Å; S136-L154 WeakPolarHBondContact CB-O 3.21Å; S136-L154 WeakPolarHBondContact OG-CD2 3.43Å; S136-L154 PolarHBondContact OG-O 2.93Å |
| 137 | N | 89.4 | Confident | 88.9 | Confident | 25 Ų | 25 | 35 Ų | 35 | 13% | 0.134 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.3 | -44.9 | 177.5 | -83 | -44.7 | 0 | 0 | 0 | 111.3 | L133 T134 F135 L140 Q141 L154 | L133-N137 PolarHBondContact O-N 3.15Å; L133-N137 PolarHBondContact O-ND2 3.04Å; T134-N137 PolarHBondContact O-N 3.27Å; F135-N137 PolarHBondContact O-N 2.85Å; N137-L140 PolarHBondContact O-N 3.49Å; N137-Q141 WeakPolarHBondContact O-CB 3.43Å; N137-Q141 PolarHBondContact O-N 3.28Å; N137-L154 HydrophobicContact CB-CD2 4.37Å; N137-L154 WeakPolarHBondContact OD1-CD1 3.27Å; N137-L154 WeakPolarHBondContact OD1-CD2 3.44Å |
| 138 | Y | 89.7 | Confident | 88.5 | Confident | 3 Ų | 3 | 41.3 Ų | 41.3 | 1% | 0.012 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -71.1 | -34.3 | -177.8 | -87.2 | -100.9 | 0 | 0 | 0 | 113.6 | F52 T134 F135 S136 P142 A294 V295 A296 V297 P312 V315 | F52-Y138 HydrophobicContact CB-CE1 4.38Å; F52-Y138 HydrophobicContact CB-CE2 4.27Å; F52-Y138 WeakPolarHBondContact CB-OH 3.27Å; F52-Y138 PolarHBondContact O-OH 2.92Å; T134-Y138 HydrophobicContact CG2-CD2 3.69Å; T134-Y138 HydrophobicContact CG2-CE2 3.76Å; T134-Y138 WeakPolarHBondContact O-CB 3.32Å; T134-Y138 VanDerWaalsContact O-CD2 3.23Å; T134-Y138 WeakPolarHBondContact O-CD2 3.28Å; T134-Y138 PolarHBondContact O-N 3.34Å; F135-Y138 PolarHBondContact O-N 3.04Å; S136-Y138 PolarHBondContact O-N 3.06Å; Y138-P142 WeakPolarHBondContact O-CD 3.32Å; Y138-A294 HydrophobicContact CD1-CB 3.98Å; Y138-A294 HydrophobicContact CD2-CB 4.02Å; Y138-A294 HydrophobicContact CE1-CB 3.79Å; Y138-A294 HydrophobicContact CE2-CB 3.85Å; Y138-A294 HydrophobicContact CG-CB 4.1Å; Y138-V295 PolarHBondContact OH-N 3.26Å; Y138-A296 HydrophobicContact CE1-CB 4.04Å; Y138-V297 HydrophobicContact CD1-CG2 3.61Å; Y138-V297 HydrophobicContact CE1-CG2 3.94Å; Y138-P312 WeakPolarHBondContact O-CB 3.3Å; Y138-V315 HydrophobicContact CD1-CB 3.54Å; Y138-V315 HydrophobicContact CD1-CG1 3.29Å; Y138-V315 HydrophobicContact CD1-CG2 3.89Å; Y138-V315 HydrophobicContact CD2-CG1 4.11Å; Y138-V315 HydrophobicContact CE1-CB 3.97Å; Y138-V315 HydrophobicContact CE1-CG1 3.58Å; Y138-V315 HydrophobicContact CE1-CG2 3.86Å; Y138-V315 HydrophobicContact CE2-CG1 4.34Å; Y138-V315 HydrophobicContact CG-CB 4.18Å; Y138-V315 HydrophobicContact CG-CG1 3.58Å |
| 139 | V | 90.9 | Very high | 88.3 | Confident | 50 Ų | 50 | 41.8 Ų | 41.8 | 30% | 0.303 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -74.1 | -35.3 | 176.5 | 171.7 | 0 | 0 | 0 | 0 | 111.7 | F135 S136 P142 L157 A316 | F135-V139 HydrophobicContact CD2-CG2 3.94Å; F135-V139 HydrophobicContact CE2-CG2 3.44Å; F135-V139 VanDerWaalsContact CE2-CG2 3.44Å; F135-V139 HydrophobicContact CZ-CG2 3.83Å; F135-V139 WeakPolarHBondContact O-CG2 3.43Å; F135-V139 PolarHBondContact O-N 3.46Å; S136-V139 PolarHBondContact O-N 3.25Å; V139-P142 WeakPolarHBondContact O-CD 3.32Å; V139-L157 HydrophobicContact CB-CD2 4.27Å; V139-L157 HydrophobicContact CG1-CD2 4.1Å; V139-A316 HydrophobicContact CG2-CB 3.86Å |
| 140 | L | 90.4 | Very high | 88.1 | Confident | 23 Ų | 23 | 45.3 Ų | 45.3 | 12% | 0.12 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -84.2 | -21.2 | -179.5 | -66.3 | -173.8 | 0 | 0 | 0 | 113.7 | S136 N137 L143 F144 P149 L154 L157 | S136-L140 WeakPolarHBondContact O-CB 3.34Å; S136-L140 WeakPolarHBondContact O-CG 3.45Å; S136-L140 PolarHBondContact O-N 2.96Å; N137-L140 PolarHBondContact O-N 3.49Å; L140-L143 HydrophobicContact CD2-CD1 3.94Å; L140-L143 WeakPolarHBondContact O-CB 3.33Å; L140-L143 PolarHBondContact O-N 3.37Å; L140-F144 HydrophobicContact CB-CD2 4.3Å; L140-F144 HydrophobicContact CD2-CE2 4.5Å; L140-F144 PolarHBondContact O-N 3.03Å; L140-P149 HydrophobicContact CB-CB 4.21Å; L140-P149 HydrophobicContact CD1-CB 4.15Å; L140-L154 HydrophobicContact CD1-CD2 3.8Å; L140-L154 HydrophobicContact CD1-CG 4.3Å; L140-L157 HydrophobicContact CD1-CD2 4.45Å; L140-L157 HydrophobicContact CD2-CD2 4.12Å; L140-L157 HydrophobicContact CG-CD2 4.01Å |
| 141 | Q | 87 | Confident | 87.9 | Confident | 13 Ų | 13 | 51.7 Ų | 51.7 | 6% | 0.061 | 28% | 0.282 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.5 | -45.9 | -178.7 | -169.4 | 72.5 | 13.7 | 0 | 0 | 113.7 | N137 L143 F144 P145 A294 V297 | N137-Q141 WeakPolarHBondContact O-CB 3.43Å; N137-Q141 PolarHBondContact O-N 3.28Å; Q141-L143 PolarHBondContact O-N 2.8Å; Q141-F144 CarbonylContact O-C 3.53Å; Q141-F144 PolarHBondContact O-N 3.13Å; Q141-P145 WeakPolarHBondContact O-CA 3.48Å; Q141-A294 HydrophobicContact CB-CB 3.97Å; Q141-A294 HydrophobicContact CG-CB 3.9Å; Q141-V297 HydrophobicContact CB-CG1 4.39Å; Q141-V297 HydrophobicContact CG-CB 4.32Å; Q141-V297 HydrophobicContact CG-CG1 4.11Å |
| 142 | P | 86.7 | Confident | 87.8 | Confident | 60 Ų | 60 | 56.8 Ų | 56.8 | 39% | 0.39 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | -24.2 | 178.9 | -21.2 | 34.5 | 0 | 0 | 0 | 114 | Y138 V139 V297 P312 | Y138-P142 WeakPolarHBondContact O-CD 3.32Å; V139-P142 WeakPolarHBondContact O-CD 3.32Å; P142-V297 HydrophobicContact CG-CG1 4.34Å; P142-P312 HydrophobicContact CG-CB 3.9Å; P142-P312 HydrophobicContact CG-CG 3.8Å |
| 143 | L | 88.1 | Confident | 87.7 | Confident | 123 Ų | 123 | 58.1 Ų | 58.1 | 64% | 0.644 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.2 | -29.9 | 177.4 | -71.9 | 151.2 | 0 | 0 | 0 | 111.7 | L140 Q141 P145 | L140-L143 HydrophobicContact CD2-CD1 3.94Å; L140-L143 WeakPolarHBondContact O-CB 3.33Å; L140-L143 PolarHBondContact O-N 3.37Å; Q141-L143 PolarHBondContact O-N 2.8Å; L143-P145 VanDerWaalsContact C-CD 3.44Å; L143-P145 WeakPolarHBondContact O-CD 3.14Å |
| 144 | F | 87.5 | Confident | 87.6 | Confident | 69 Ų | 69 | 58.4 Ų | 58.4 | 30% | 0.303 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -125.7 | 65.7 | -179.9 | -58.8 | -80.8 | 0 | 0 | 0 | 110.8 | L140 Q141 T146 C147 P149 | L140-F144 HydrophobicContact CB-CD2 4.3Å; L140-F144 HydrophobicContact CD2-CE2 4.5Å; L140-F144 PolarHBondContact O-N 3.03Å; Q141-F144 CarbonylContact O-C 3.53Å; Q141-F144 PolarHBondContact O-N 3.13Å; F144-T146 VanDerWaalsContact C-N 3.34Å; F144-T146 PolarHBondContact O-N 3.07Å; F144-C147 VanDerWaalsContact O-O 3.09Å; F144-P149 HydrophobicContact CB-CB 4.48Å; F144-P149 HydrophobicContact CD2-CB 3.96Å; F144-P149 HydrophobicContact CG-CB 4.33Å |
| 145 | P | 79.6 | Confident | 87.6 | Confident | 70 Ų | 70 | 62.2 Ų | 62.2 | 46% | 0.455 | 34% | 0.339 | S | S | . | . | S | Bend | trans | -69.2 | -30.3 | -170.9 | 26.3 | -34.9 | 0 | 0 | 0 | 113.6 | Q141 L143 | Q141-P145 WeakPolarHBondContact O-CA 3.48Å; L143-P145 VanDerWaalsContact C-CD 3.44Å; L143-P145 WeakPolarHBondContact O-CD 3.14Å |
| 146 | T | 80.8 | Confident | 87.7 | Confident | 140 Ų | 140 | 66.9 Ų | 66.9 | 86% | 0.859 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -116.8 | -1.9 | -173.6 | 54.3 | 0 | 0 | 0 | 0 | 114.1 | F144 | F144-T146 VanDerWaalsContact C-N 3.34Å; F144-T146 PolarHBondContact O-N 3.07Å |
| 147 | C | 84.9 | Confident | 87.8 | Confident | 67 Ų | 67 | 69 Ų | 69 | 45% | 0.453 | 38% | 0.375 | S | S | . | . | S | Bend | trans | -133.5 | 159.7 | -177.2 | 55.9 | 0 | 0 | 0 | 0 | 110.9 | F144 | F144-C147 VanDerWaalsContact O-O 3.09Š|
| 148 | F | 80.9 | Confident | 88 | Confident | 168 Ų | 168 | 67.8 Ų | 67.8 | 74% | 0.737 | 37% | 0.369 | S | S | * | . | P | Polyproline II helix | trans | -73 | 128.3 | 178.8 | -67.2 | -74.7 | 0 | 0 | 0 | 110.4 | ||
| 149 | P | 85.6 | Confident | 88.2 | Confident | 10 Ų | 10 | 68.3 Ų | 68.3 | 7% | 0.065 | 37% | 0.374 | C | S | . | . | P | Polyproline II helix | trans | -64.4 | 147.7 | 172.9 | 27.3 | -33.8 | 0 | 0 | 0 | 110 | L140 F144 E151 L154 | L140-P149 HydrophobicContact CB-CB 4.21Å; L140-P149 HydrophobicContact CD1-CB 4.15Å; F144-P149 HydrophobicContact CB-CB 4.48Å; F144-P149 HydrophobicContact CD2-CB 3.96Å; F144-P149 HydrophobicContact CG-CB 4.33Å; P149-E151 PolarHBondContact O-N 3.22Å; P149-L154 HydrophobicContact CB-CD2 4.46Å; P149-L154 HydrophobicContact CB-CG 4.41Å; P149-L154 HydrophobicContact CG-CD1 4.03Å; P149-L154 HydrophobicContact CG-CD2 4.17Å; P149-L154 HydrophobicContact CG-CG 4.23Å |
| 150 | P | 88.9 | Confident | 88.4 | Confident | 74 Ų | 74 | 70.4 Ų | 70.4 | 48% | 0.481 | 38% | 0.383 | S | S | . | . | P | Polyproline II helix | trans | -60.3 | 127.4 | 178.3 | -21.8 | 32 | 0 | 0 | 0 | 111.6 | N152 G153 L154 | P150-N152 VanDerWaalsContact C-N 3.28Å; P150-N152 PolarHBondContact O-N 3.01Å; P150-G153 WeakPolarHBondContact O-CA 3.43Å; P150-G153 PolarHBondContact O-N 3.48Å; P150-L154 PolarHBondContact O-N 3.47Å; P150-L154 VanDerWaalsContact O-N 3.11Å |
| 151 | E | 86.3 | Confident | 88.6 | Confident | 134 Ų | 134 | 69.5 Ų | 69.5 | 63% | 0.626 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -55.4 | -41.6 | -178.7 | -68.2 | -174.7 | -175.8 | 0 | 0 | 113.1 | P149 G153 L154 R155 | P149-E151 PolarHBondContact O-N 3.22Å; E151-G153 PolarHBondContact O-N 3.4Å; E151-L154 WeakPolarHBondContact O-CB 3.12Å; E151-L154 PolarHBondContact O-N 3.3Å; E151-R155 PolarHBondContact O-N 3.49Å |
| 152 | N | 88 | Confident | 88.9 | Confident | 127 Ų | 127 | 68.9 Ų | 68.9 | 68% | 0.679 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -63.3 | -33.2 | 176.7 | -68.8 | -26.4 | 0 | 0 | 0 | 111.9 | P150 L156 | P150-N152 VanDerWaalsContact C-N 3.28Å; P150-N152 PolarHBondContact O-N 3.01Å; N152-L156 VanDerWaalsContact O-CB 3.26Å; N152-L156 WeakPolarHBondContact O-CB 3.5Å; N152-L156 PolarHBondContact O-N 3.03Å |
| 153 | G | 90.4 | Very high | 89.3 | Confident | 29 Ų | 29 | 70.3 Ų | 70.3 | 30% | 0.299 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -68.1 | -42 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | P150 E151 L157 | P150-G153 WeakPolarHBondContact O-CA 3.43Å; P150-G153 PolarHBondContact O-N 3.48Å; E151-G153 PolarHBondContact O-N 3.4Å; G153-L157 VanDerWaalsContact O-CB 3.29Å; G153-L157 WeakPolarHBondContact O-CB 3.33Å; G153-L157 PolarHBondContact O-N 3.32Å |
| 154 | L | 89.7 | Confident | 89.6 | Confident | 22 Ų | 22 | 68.6 Ų | 68.6 | 12% | 0.115 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -60 | -52.7 | 174.5 | -70.1 | 171 | 0 | 0 | 0 | 111.3 | S136 N137 L140 P149 P150 E151 L156 L157 A158 | S136-L154 VanDerWaalsContact CB-O 3.28Å; S136-L154 WeakPolarHBondContact CB-O 3.21Å; S136-L154 WeakPolarHBondContact OG-CD2 3.43Å; S136-L154 PolarHBondContact OG-O 2.93Å; N137-L154 HydrophobicContact CB-CD2 4.37Å; N137-L154 WeakPolarHBondContact OD1-CD1 3.27Å; N137-L154 WeakPolarHBondContact OD1-CD2 3.44Å; L140-L154 HydrophobicContact CD1-CD2 3.8Å; L140-L154 HydrophobicContact CD1-CG 4.3Å; P149-L154 HydrophobicContact CB-CD2 4.46Å; P149-L154 HydrophobicContact CB-CG 4.41Å; P149-L154 HydrophobicContact CG-CD1 4.03Å; P149-L154 HydrophobicContact CG-CD2 4.17Å; P149-L154 HydrophobicContact CG-CG 4.23Å; P150-L154 PolarHBondContact O-N 3.47Å; P150-L154 VanDerWaalsContact O-N 3.11Å; E151-L154 WeakPolarHBondContact O-CB 3.12Å; E151-L154 PolarHBondContact O-N 3.3Å; L154-L156 PolarHBondContact O-N 2.99Å; L154-L157 PolarHBondContact O-N 3.46Å; L154-A158 VanDerWaalsContact O-CB 3.32Å; L154-A158 WeakPolarHBondContact O-CB 3.3Å; L154-A158 PolarHBondContact O-N 3.05Å |
| 155 | R | 91.3 | Very high | 89.8 | Confident | 81 Ų | 81 | 65.6 Ų | 65.6 | 31% | 0.306 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | -179.4 | -69.3 | -177 | -177.7 | 147.7 | 7.6 | 112.2 | E151 A158 A159 L372 | E151-R155 PolarHBondContact O-N 3.49Å; R155-A158 PolarHBondContact O-N 3.37Å; R155-A159 WeakPolarHBondContact O-CB 3.26Å; R155-A159 PolarHBondContact O-N 3.01Å; R155-L372 WeakPolarHBondContact O-CD2 3.38Å |
| 156 | L | 93.3 | Very high | 90.4 | Very high | 116 Ų | 116 | 62.6 Ų | 62.6 | 61% | 0.607 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -65.6 | -42.9 | 179.2 | -171.3 | 67.5 | 0 | 0 | 0 | 111.5 | N152 L154 A159 I160 | N152-L156 VanDerWaalsContact O-CB 3.26Å; N152-L156 WeakPolarHBondContact O-CB 3.5Å; N152-L156 PolarHBondContact O-N 3.03Å; L154-L156 PolarHBondContact O-N 2.99Å; L156-A159 PolarHBondContact O-N 3.31Å; L156-I160 HydrophobicContact CG-CD1 4.23Å; L156-I160 VanDerWaalsContact O-CG1 3.26Å; L156-I160 WeakPolarHBondContact O-CG1 3.41Å; L156-I160 PolarHBondContact O-N 2.97Å |
| 157 | L | 94.1 | Very high | 91 | Very high | 44 Ų | 44 | 63.1 Ų | 63.1 | 23% | 0.23 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -67.3 | -39.3 | 178.8 | -173.3 | 60.4 | 0 | 0 | 0 | 112 | F135 V139 L140 G153 L154 I160 C161 | F135-L157 HydrophobicContact CE1-CD1 4.23Å; F135-L157 HydrophobicContact CE1-CD2 4.44Å; F135-L157 HydrophobicContact CE1-CG 3.91Å; V139-L157 HydrophobicContact CB-CD2 4.27Å; V139-L157 HydrophobicContact CG1-CD2 4.1Å; L140-L157 HydrophobicContact CD1-CD2 4.45Å; L140-L157 HydrophobicContact CD2-CD2 4.12Å; L140-L157 HydrophobicContact CG-CD2 4.01Å; G153-L157 VanDerWaalsContact O-CB 3.29Å; G153-L157 WeakPolarHBondContact O-CB 3.33Å; G153-L157 PolarHBondContact O-N 3.32Å; L154-L157 PolarHBondContact O-N 3.46Å; L157-I160 PolarHBondContact O-N 2.84Å; L157-C161 PolarHBondContact O-N 3.2Å |
| 158 | A | 93.3 | Very high | 91.2 | Very high | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.3 | -42.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | A132 L133 L154 R155 C161 L162 L372 | A132-A158 HydrophobicContact CB-CB 3.97Å; A132-A158 VanDerWaalsContact O-CB 3.3Å; A132-A158 WeakPolarHBondContact O-CB 3.03Å; L133-A158 HydrophobicContact CD2-CB 4.21Å; L154-A158 VanDerWaalsContact O-CB 3.32Å; L154-A158 WeakPolarHBondContact O-CB 3.3Å; L154-A158 PolarHBondContact O-N 3.05Å; R155-A158 PolarHBondContact O-N 3.37Å; A158-C161 WeakPolarHBondContact O-CB 3.45Å; A158-C161 PolarHBondContact O-N 3.44Å; A158-L162 PolarHBondContact O-N 2.9Å; A158-L372 HydrophobicContact CB-CD1 3.87Å; A158-L372 HydrophobicContact CB-CD2 4.07Å |
| 159 | A | 94.7 | Very high | 91.6 | Very high | 15 Ų | 15 | 53.4 Ų | 53.4 | 12% | 0.124 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.6 | -41.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | R155 L156 L162 L163 L369 L372 | R155-A159 WeakPolarHBondContact O-CB 3.26Å; R155-A159 PolarHBondContact O-N 3.01Å; L156-A159 PolarHBondContact O-N 3.31Å; A159-L162 PolarHBondContact O-N 2.81Å; A159-L163 WeakPolarHBondContact O-CB 3.1Å; A159-L163 VanDerWaalsContact O-CG 3.29Å; A159-L163 WeakPolarHBondContact O-CG 3.39Å; A159-L163 PolarHBondContact O-N 2.79Å; A159-L369 HydrophobicContact CB-CD2 3.83Å; A159-L372 HydrophobicContact CB-CD2 3.8Å |
| 160 | I | 95.4 | Very high | 91.7 | Very high | 94 Ų | 94 | 53.6 Ų | 53.6 | 48% | 0.482 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.5 | -45.8 | 175 | -70.2 | 164 | 0 | 0 | 0 | 110.6 | L156 L157 L162 L163 L164 | L156-I160 HydrophobicContact CG-CD1 4.23Å; L156-I160 VanDerWaalsContact O-CG1 3.26Å; L156-I160 WeakPolarHBondContact O-CG1 3.41Å; L156-I160 PolarHBondContact O-N 2.97Å; L157-I160 PolarHBondContact O-N 2.84Å; I160-L162 PolarHBondContact O-N 2.06Å; I160-L163 PolarHBondContact O-N 3.31Å; I160-L164 VanDerWaalsContact O-CB 3.25Å; I160-L164 WeakPolarHBondContact O-CB 3.48Å; I160-L164 PolarHBondContact O-N 2.94Å |
| 161 | C | 93.4 | Very high | 91.7 | Very high | 3 Ų | 3 | 51 Ų | 51 | 2% | 0.02 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.2 | -48.1 | 177 | 178.6 | 0 | 0 | 0 | 0 | 111.6 | F135 L157 A158 L165 F320 | F135-C161 HydrophobicContact CD1-CB 3.56Å; F135-C161 HydrophobicContact CE1-CB 3.65Å; F135-C161 HydrophobicContact CG-CB 4.4Å; L157-C161 PolarHBondContact O-N 3.2Å; A158-C161 WeakPolarHBondContact O-CB 3.45Å; A158-C161 PolarHBondContact O-N 3.44Å; C161-L165 WeakPolarHBondContact O-CG 3.39Å; C161-L165 PolarHBondContact O-N 3.35Å; C161-F320 HydrophobicContact CB-CE1 4.41Å; C161-F320 HydrophobicContact CB-CZ 4.26Å; C161-F320 WeakPolarHBondContact SG-CE1 3.42Å; C161-F320 VanDerWaalsContact SG-CZ 3.58Å |
| 162 | L | 94.1 | Very high | 91.5 | Very high | 1 Ų | 1 | 46.2 Ų | 46.2 | 1% | 0.005 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.4 | -52 | 178.1 | -178.4 | 71.7 | 0 | 0 | 0 | 111.9 | Q128 A158 A159 I160 L164 L165 T166 V323 T368 L369 | Q128-L162 HydrophobicContact CB-CD1 4.49Å; A158-L162 PolarHBondContact O-N 2.9Å; A159-L162 PolarHBondContact O-N 2.81Å; I160-L162 PolarHBondContact O-N 2.06Å; L162-L164 VanDerWaalsContact C-N 3.3Å; L162-L164 PolarHBondContact O-N 2.88Å; L162-L165 PolarHBondContact O-N 2.9Å; L162-T166 PolarHBondContact O-N 3.46Å; L162-T166 PolarHBondContact O-OG1 3.29Å; L162-V323 HydrophobicContact CD1-CG1 3.91Å; L162-T368 HydrophobicContact CD1-CG2 3.96Å; L162-T368 HydrophobicContact CD2-CG2 3.46Å; L162-T368 VanDerWaalsContact CD2-CG2 3.46Å; L162-T368 HydrophobicContact CG-CG2 4.34Å; L162-L369 HydrophobicContact CD2-CD2 3.91Å; L162-L369 HydrophobicContact CD2-CG 3.99Å |
| 163 | L | 95.4 | Very high | 90.8 | Very high | 90 Ų | 90 | 42.3 Ų | 42.3 | 47% | 0.471 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.1 | -41.3 | -178.6 | -73.9 | 170.6 | 0 | 0 | 0 | 111.9 | A159 I160 W167 L369 | A159-L163 WeakPolarHBondContact O-CB 3.1Å; A159-L163 VanDerWaalsContact O-CG 3.29Å; A159-L163 WeakPolarHBondContact O-CG 3.39Å; A159-L163 PolarHBondContact O-N 2.79Å; I160-L163 PolarHBondContact O-N 3.31Å; L163-W167 WeakPolarHBondContact O-CB 3.31Å; L163-W167 PolarHBondContact O-N 3.11Å; L163-L369 HydrophobicContact CD2-CD1 4.25Å |
| 164 | L | 93.8 | Very high | 90.3 | Very high | 86 Ų | 86 | 49 Ų | 49 | 45% | 0.45 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.4 | -48.3 | 176 | 179.5 | 64.2 | 0 | 0 | 0 | 111.1 | I160 L162 W167 V168 F320 | I160-L164 VanDerWaalsContact O-CB 3.25Å; I160-L164 WeakPolarHBondContact O-CB 3.48Å; I160-L164 PolarHBondContact O-N 2.94Å; L162-L164 VanDerWaalsContact C-N 3.3Å; L162-L164 PolarHBondContact O-N 2.88Å; L164-W167 HydrophobicContact CD1-CE3 4.43Å; L164-W167 WeakPolarHBondContact O-CB 3.16Å; L164-W167 PolarHBondContact O-N 3.03Å; L164-V168 WeakPolarHBondContact O-CG2 3.49Å; L164-V168 PolarHBondContact O-N 3.24Å; L164-F320 HydrophobicContact CD2-CE1 4.39Å |
| 165 | L | 91.6 | Very high | 89.7 | Confident | 6 Ų | 6 | 55.2 Ų | 55.2 | 3% | 0.031 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -67 | -40 | 179.6 | -77.1 | 178.9 | 0 | 0 | 0 | 112.6 | C161 L162 W167 V168 N169 F320 V323 N324 L327 | C161-L165 WeakPolarHBondContact O-CG 3.39Å; C161-L165 PolarHBondContact O-N 3.35Å; L162-L165 PolarHBondContact O-N 2.9Å; L165-W167 VanDerWaalsContact C-N 3.29Å; L165-W167 PolarHBondContact O-N 3.28Å; L165-V168 PolarHBondContact O-N 3.41Å; L165-N169 WeakPolarHBondContact O-CB 3.47Å; L165-N169 PolarHBondContact O-N 3.45Å; L165-N169 PolarHBondContact O-ND2 3.43Å; L165-F320 HydrophobicContact CD1-CD1 3.72Å; L165-F320 HydrophobicContact CD1-CE1 4.28Å; L165-F320 WeakPolarHBondContact CD1-O 3.43Å; L165-F320 HydrophobicContact CD2-CD1 3.89Å; L165-F320 HydrophobicContact CD2-CE1 4.34Å; L165-F320 HydrophobicContact CG-CD1 3.82Å; L165-F320 HydrophobicContact CG-CE1 4.05Å; L165-V323 HydrophobicContact CB-CG1 4.47Å; L165-V323 HydrophobicContact CD1-CB 3.51Å; L165-V323 HydrophobicContact CD1-CG1 3.54Å; L165-N324 HydrophobicContact CD1-CB 4.4Å; L165-N324 HydrophobicContact CD2-CB 4.13Å; L165-L327 HydrophobicContact CB-CD1 4Å |
| 166 | T | 92.6 | Very high | 89 | Confident | 7 Ų | 7 | 51.5 Ų | 51.5 | 4% | 0.043 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -58.8 | -43.9 | 172.7 | -57.5 | 0 | 0 | 0 | 0 | 110.2 | L162 V168 N169 C170 L361 C365 | L162-T166 PolarHBondContact O-N 3.46Å; L162-T166 PolarHBondContact O-OG1 3.29Å; T166-V168 PolarHBondContact O-N 2.77Å; T166-N169 PolarHBondContact O-N 3.26Å; T166-C170 WeakPolarHBondContact O-CB 3.49Å; T166-C170 PolarHBondContact O-N 2.9Å; T166-C170 PolarHBondContact O-SG 3.46Å; T166-L361 HydrophobicContact CG2-CB 4.31Å; T166-C365 HydrophobicContact CG2-CB 3.84Å; T166-C365 PolarHBondContact OG1-SG 3.15Å |
| 167 | W | 93.2 | Very high | 88.1 | Confident | 152 Ų | 152 | 48.8 Ų | 48.8 | 58% | 0.576 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -62.5 | -42.1 | 176.4 | 176.4 | 83 | 0 | 0 | 0 | 113.1 | L163 L164 L165 C170 S171 | L163-W167 WeakPolarHBondContact O-CB 3.31Å; L163-W167 PolarHBondContact O-N 3.11Å; L164-W167 HydrophobicContact CD1-CE3 4.43Å; L164-W167 WeakPolarHBondContact O-CB 3.16Å; L164-W167 PolarHBondContact O-N 3.03Å; L165-W167 VanDerWaalsContact C-N 3.29Å; L165-W167 PolarHBondContact O-N 3.28Å; W167-C170 PolarHBondContact O-N 2.76Å; W167-S171 WeakPolarHBondContact O-CB 3.33Å; W167-S171 PolarHBondContact O-N 3.49Å; W167-S171 PolarHBondContact O-OG 3.39Å |
| 168 | V | 89.9 | Confident | 87.3 | Confident | 22 Ų | 22 | 53.6 Ų | 53.6 | 13% | 0.133 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.7 | -46.3 | 175.1 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | L164 L165 T166 C170 S171 S172 A176 | L164-V168 WeakPolarHBondContact O-CG2 3.49Å; L164-V168 PolarHBondContact O-N 3.24Å; L165-V168 PolarHBondContact O-N 3.41Å; T166-V168 PolarHBondContact O-N 2.77Å; V168-C170 PolarHBondContact O-N 2.92Å; V168-S171 PolarHBondContact O-N 2.91Å; V168-S171 VanDerWaalsContact O-N 3.07Å; V168-S172 PolarHBondContact O-N 3.45Å; V168-S172 VanDerWaalsContact O-N 3.13Å; V168-A176 HydrophobicContact CG1-CB 4.47Å |
| 169 | N | 87.8 | Confident | 86.5 | Confident | 8 Ų | 8 | 55.6 Ų | 55.6 | 4% | 0.043 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.5 | -35.5 | 179.1 | -81.2 | -85.3 | 0 | 0 | 0 | 112.8 | L165 T166 S171 A176 N324 T356 L361 | L165-N169 WeakPolarHBondContact O-CB 3.47Å; L165-N169 PolarHBondContact O-N 3.45Å; L165-N169 PolarHBondContact O-ND2 3.43Å; T166-N169 PolarHBondContact O-N 3.26Å; N169-S171 VanDerWaalsContact C-N 3.28Å; N169-S171 PolarHBondContact O-N 2.91Å; N169-A176 WeakPolarHBondContact OD1-CB 3.43Å; N169-N324 PolarHBondContact ND2-OD1 2.84Å; N169-T356 VanDerWaalsContact O-CG2 3.31Å; N169-T356 WeakPolarHBondContact O-CG2 3.4Å; N169-L361 HydrophobicContact CB-CD1 3.88Å; N169-L361 HydrophobicContact CB-CD2 4.49Å |
| 170 | C | 88 | Confident | 85.8 | Confident | 15 Ų | 15 | 56.5 Ų | 56.5 | 10% | 0.101 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -72.2 | -19.7 | 172.8 | -70 | 0 | 0 | 0 | 0 | 113.4 | T166 W167 V168 R354 T356 I358 | T166-C170 WeakPolarHBondContact O-CB 3.49Å; T166-C170 PolarHBondContact O-N 2.9Å; T166-C170 PolarHBondContact O-SG 3.46Å; W167-C170 PolarHBondContact O-N 2.76Å; V168-C170 PolarHBondContact O-N 2.92Å; C170-R354 PolarHBondContact O-NH1 3.2Å; C170-T356 PolarHBondContact O-OG1 3.26Å; C170-I358 HydrophobicContact CB-CG1 4.38Å |
| 171 | S | 88.3 | Confident | 84.8 | Confident | 19 Ų | 19 | 57.1 Ų | 57.1 | 13% | 0.133 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -90.4 | -48.2 | -174.6 | -65.6 | 0 | 0 | 0 | 0 | 113.2 | W167 V168 N169 R354 | W167-S171 WeakPolarHBondContact O-CB 3.33Å; W167-S171 PolarHBondContact O-N 3.49Å; W167-S171 PolarHBondContact O-OG 3.39Å; V168-S171 PolarHBondContact O-N 2.91Å; V168-S171 VanDerWaalsContact O-N 3.07Å; N169-S171 VanDerWaalsContact C-N 3.28Å; N169-S171 PolarHBondContact O-N 2.91Å; S171-R354 VanDerWaalsContact O-CD 3.31Å; S171-R354 WeakPolarHBondContact O-CD 3.42Å |
| 172 | S | 82.1 | Confident | 84.2 | Confident | 33 Ų | 33 | 62.5 Ų | 62.5 | 23% | 0.231 | 30% | 0.297 | C | S | . | . | trans | -159.4 | 123 | 175.9 | -174.3 | 0 | 0 | 0 | 0 | 111.8 | V168 R174 W175 A176 | V168-S172 PolarHBondContact O-N 3.45Å; V168-S172 VanDerWaalsContact O-N 3.13Å; S172-R174 PolarHBondContact O-N 3.3Å; S172-R174 PolarHBondContact OG-N 3.44Å; S172-W175 PolarHBondContact O-N 2.91Å; S172-W175 VanDerWaalsContact O-N 3.15Å; S172-A176 PolarHBondContact O-N 3.09Å; S172-A176 VanDerWaalsContact O-N 3.1Å | ||
| 173 | V | 75.3 | Confident | 83.5 | Confident | 46 Ų | 46 | 63.9 Ų | 63.9 | 28% | 0.279 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -57.7 | -37.7 | 172.6 | -174.8 | 0 | 0 | 0 | 0 | 111.1 | W175 A176 T177 F328 T356 | V173-W175 VanDerWaalsContact C-N 3.3Å; V173-W175 PolarHBondContact O-N 3.33Å; V173-A176 PolarHBondContact O-N 3.29Å; V173-T177 HydrophobicContact CG1-CG2 4.31Å; V173-T177 WeakPolarHBondContact O-CG2 3.37Å; V173-T177 PolarHBondContact O-N 3.04Å; V173-T177 PolarHBondContact O-OG1 3.46Å; V173-F328 HydrophobicContact CG1-CE2 3.82Å; V173-T356 HydrophobicContact CG2-CG2 3.56Å |
| 174 | R | 78.4 | Confident | 82.6 | Confident | 169 Ų | 169 | 61.3 Ų | 61.3 | 64% | 0.638 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -66.4 | -31.7 | -179.5 | -167 | 178.3 | -173.9 | -178.2 | 3.9 | 113 | S172 T177 R178 | S172-R174 PolarHBondContact O-N 3.3Å; S172-R174 PolarHBondContact OG-N 3.44Å; R174-T177 WeakPolarHBondContact CA-OG1 3.22Å; R174-T177 PolarHBondContact O-OG1 3.04Å; R174-T177 VanDerWaalsContact O-OG1 3.09Å; R174-R178 WeakPolarHBondContact O-CG 3.39Å; R174-R178 PolarHBondContact O-N 3.45Å |
| 175 | W | 78.5 | Confident | 81.9 | Confident | 153 Ų | 153 | 60.2 Ų | 60.2 | 58% | 0.58 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -73.9 | -45.3 | 174.2 | -70.3 | 16.3 | 0 | 0 | 0 | 109.9 | S172 V173 T177 R178 V179 | S172-W175 PolarHBondContact O-N 2.91Å; S172-W175 VanDerWaalsContact O-N 3.15Å; V173-W175 VanDerWaalsContact C-N 3.3Å; V173-W175 PolarHBondContact O-N 3.33Å; W175-T177 VanDerWaalsContact C-N 3.3Å; W175-T177 PolarHBondContact O-N 3.32Å; W175-R178 PolarHBondContact O-N 3.5Å; W175-V179 WeakPolarHBondContact O-CB 3.46Å; W175-V179 WeakPolarHBondContact O-CG2 3.36Å; W175-V179 PolarHBondContact O-N 3.3Å |
| 176 | A | 74.8 | Confident | 81.3 | Confident | 3 Ų | 3 | 60.6 Ų | 60.6 | 3% | 0.025 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -57.5 | -40.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | V168 N169 S172 V173 Q180 N324 | V168-A176 HydrophobicContact CG1-CB 4.47Å; N169-A176 WeakPolarHBondContact OD1-CB 3.43Å; S172-A176 PolarHBondContact O-N 3.09Å; S172-A176 VanDerWaalsContact O-N 3.1Å; V173-A176 PolarHBondContact O-N 3.29Å; A176-Q180 PolarHBondContact O-N 3.45Å; A176-N324 PolarHBondContact O-ND2 3.3Å |
| 177 | T | 75.1 | Confident | 80.7 | Confident | 58 Ų | 58 | 60.8 Ų | 60.8 | 36% | 0.356 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -69.1 | -46.3 | 176.9 | 54 | 0 | 0 | 0 | 0 | 112.7 | V173 R174 W175 V179 Q180 D181 | V173-T177 HydrophobicContact CG1-CG2 4.31Å; V173-T177 WeakPolarHBondContact O-CG2 3.37Å; V173-T177 PolarHBondContact O-N 3.04Å; V173-T177 PolarHBondContact O-OG1 3.46Å; R174-T177 WeakPolarHBondContact CA-OG1 3.22Å; R174-T177 PolarHBondContact O-OG1 3.04Å; R174-T177 VanDerWaalsContact O-OG1 3.09Å; W175-T177 VanDerWaalsContact C-N 3.3Å; W175-T177 PolarHBondContact O-N 3.32Å; T177-V179 VanDerWaalsContact C-N 3.29Å; T177-V179 PolarHBondContact O-N 3.3Å; T177-Q180 VanDerWaalsContact O-CB 3.27Å; T177-Q180 WeakPolarHBondContact O-CB 3.39Å; T177-Q180 PolarHBondContact O-N 3.04Å; T177-Q180 VanDerWaalsContact O-N 3.11Å; T177-D181 PolarHBondContact O-N 3.3Å; T177-D181 VanDerWaalsContact O-N 3.09Å |
| 178 | R | 77.8 | Confident | 80.3 | Confident | 145 Ų | 145 | 57.5 Ų | 57.5 | 55% | 0.547 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60.3 | -39.5 | 176.4 | -76.6 | -177.5 | 172.7 | -176.8 | -2.8 | 112.8 | R174 W175 Q180 D181 I182 | R174-R178 WeakPolarHBondContact O-CG 3.39Å; R174-R178 PolarHBondContact O-N 3.45Å; W175-R178 PolarHBondContact O-N 3.5Å; R178-Q180 VanDerWaalsContact C-N 3.33Å; R178-D181 PolarHBondContact O-N 3.29Å; R178-I182 WeakPolarHBondContact O-CG1 3.45Å; R178-I182 PolarHBondContact O-N 3.42Å |
| 179 | V | 76.9 | Confident | 80 | Confident | 43 Ų | 43 | 61.5 Ų | 61.5 | 26% | 0.261 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.8 | -41 | 176.3 | 168 | 0 | 0 | 0 | 0 | 110.4 | W175 T177 D181 I182 F183 | W175-V179 WeakPolarHBondContact O-CB 3.46Å; W175-V179 WeakPolarHBondContact O-CG2 3.36Å; W175-V179 PolarHBondContact O-N 3.3Å; T177-V179 VanDerWaalsContact C-N 3.29Å; T177-V179 PolarHBondContact O-N 3.3Å; V179-D181 PolarHBondContact O-N 3.07Å; V179-I182 PolarHBondContact O-N 3.2Å; V179-F183 HydrophobicContact CB-CE2 4.44Å; V179-F183 HydrophobicContact CG1-CD2 3.64Å; V179-F183 HydrophobicContact CG1-CE1 4.34Å; V179-F183 HydrophobicContact CG1-CE2 3.03Å; V179-F183 HydrophobicContact CG1-CZ 3.45Å; V179-F183 VanDerWaalsContact CG1-CZ 3.45Å; V179-F183 VanDerWaalsContact O-CD2 3.28Å; V179-F183 WeakPolarHBondContact O-CD2 3.47Å; V179-F183 VanDerWaalsContact O-CG 3.23Å; V179-F183 WeakPolarHBondContact O-CG 3.4Å; V179-F183 PolarHBondContact O-N 2.66Å; V179-F183 VanDerWaalsContact O-N 3.14Å |
| 180 | Q | 78.4 | Confident | 79.8 | Confident | 33 Ų | 33 | 61.1 Ų | 61.1 | 15% | 0.154 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.2 | -43.1 | 175 | -167.6 | 66.7 | 13.4 | 0 | 0 | 112.8 | A176 T177 R178 F183 T184 G321 N324 | A176-Q180 PolarHBondContact O-N 3.45Å; T177-Q180 VanDerWaalsContact O-CB 3.27Å; T177-Q180 WeakPolarHBondContact O-CB 3.39Å; T177-Q180 PolarHBondContact O-N 3.04Å; T177-Q180 VanDerWaalsContact O-N 3.11Å; R178-Q180 VanDerWaalsContact C-N 3.33Å; Q180-F183 PolarHBondContact O-N 3.39Å; Q180-T184 WeakPolarHBondContact O-CB 3.39Å; Q180-T184 PolarHBondContact O-N 3.45Å; Q180-T184 PolarHBondContact O-OG1 3.44Å; Q180-G321 PolarHBondContact NE2-O 3.38Å; Q180-G321 PolarHBondContact OE1-O 2.89Å; Q180-N324 PolarHBondContact OE1-ND2 3.14Å |
| 181 | D | 76.4 | Confident | 79.9 | Confident | 108 Ų | 108 | 60.6 Ų | 60.6 | 58% | 0.578 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -62.8 | -45.4 | -178.5 | -65 | -25.1 | 0 | 0 | 0 | 111.4 | T177 R178 V179 F183 T184 A185 | T177-D181 PolarHBondContact O-N 3.3Å; T177-D181 VanDerWaalsContact O-N 3.09Å; R178-D181 PolarHBondContact O-N 3.29Å; V179-D181 PolarHBondContact O-N 3.07Å; D181-F183 VanDerWaalsContact C-N 3.35Å; D181-F183 PolarHBondContact O-N 3.42Å; D181-T184 PolarHBondContact O-N 2.96Å; D181-A185 PolarHBondContact O-N 3.08Å; D181-A185 VanDerWaalsContact O-N 3.08Å |
| 182 | I | 79.8 | Confident | 80 | Confident | 116 Ų | 116 | 61.7 Ų | 61.7 | 60% | 0.595 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -60.6 | -45.6 | 177.6 | -64.8 | 168.7 | 0 | 0 | 0 | 110.5 | R178 V179 T184 A185 G186 | R178-I182 WeakPolarHBondContact O-CG1 3.45Å; R178-I182 PolarHBondContact O-N 3.42Å; V179-I182 PolarHBondContact O-N 3.2Å; I182-T184 VanDerWaalsContact C-N 3.3Å; I182-T184 PolarHBondContact O-N 3.09Å; I182-A185 PolarHBondContact O-N 3.2Å; I182-G186 PolarHBondContact O-N 2.94Å; I182-G186 VanDerWaalsContact O-N 3.08Å |
| 183 | F | 80 | Confident | 80.3 | Confident | 29 Ų | 29 | 62.6 Ų | 62.6 | 13% | 0.127 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -68 | -31.3 | 179.6 | -63.1 | -21.1 | 0 | 0 | 0 | 112.8 | V179 Q180 D181 G186 K187 L317 F320 | V179-F183 HydrophobicContact CB-CE2 4.44Å; V179-F183 HydrophobicContact CG1-CD2 3.64Å; V179-F183 HydrophobicContact CG1-CE1 4.34Å; V179-F183 HydrophobicContact CG1-CE2 3.03Å; V179-F183 HydrophobicContact CG1-CZ 3.45Å; V179-F183 VanDerWaalsContact CG1-CZ 3.45Å; V179-F183 VanDerWaalsContact O-CD2 3.28Å; V179-F183 WeakPolarHBondContact O-CD2 3.47Å; V179-F183 VanDerWaalsContact O-CG 3.23Å; V179-F183 WeakPolarHBondContact O-CG 3.4Å; V179-F183 PolarHBondContact O-N 2.66Å; V179-F183 VanDerWaalsContact O-N 3.14Å; Q180-F183 PolarHBondContact O-N 3.39Å; D181-F183 VanDerWaalsContact C-N 3.35Å; D181-F183 PolarHBondContact O-N 3.42Å; F183-G186 PolarHBondContact O-N 3.44Å; F183-K187 PolarHBondContact O-N 3.31Å; F183-K187 VanDerWaalsContact O-N 3.08Å; F183-L317 WeakPolarHBondContact CB-O 3.27Å; F183-L317 HydrophobicContact CD1-CB 4.07Å; F183-L317 HydrophobicContact CD1-CD2 3.67Å; F183-L317 HydrophobicContact CD1-CG 4.43Å; F183-L317 HydrophobicContact CE1-CD2 3.39Å; F183-L317 WeakPolarHBondContact CG-O 3.35Å; F183-L317 HydrophobicContact CZ-CD2 4.37Å; F183-F320 HydrophobicContact CD2-CB 4.06Å; F183-F320 HydrophobicContact CE2-CB 3.67Å; F183-F320 HydrophobicContact CE2-CG 4.43Å; F183-F320 HydrophobicContact CZ-CB 4.09Å |
| 184 | T | 76.5 | Confident | 81.1 | Confident | 36 Ų | 36 | 60.4 Ų | 60.4 | 22% | 0.221 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67.6 | -37.4 | 174.9 | -59.3 | 0 | 0 | 0 | 0 | 111.7 | Q180 D181 I182 K187 L188 | Q180-T184 WeakPolarHBondContact O-CB 3.39Å; Q180-T184 PolarHBondContact O-N 3.45Å; Q180-T184 PolarHBondContact O-OG1 3.44Å; D181-T184 PolarHBondContact O-N 2.96Å; I182-T184 VanDerWaalsContact C-N 3.3Å; I182-T184 PolarHBondContact O-N 3.09Å; T184-K187 VanDerWaalsContact O-CG 3.23Å; T184-K187 WeakPolarHBondContact O-CG 3.41Å; T184-L188 WeakPolarHBondContact O-CG 3.34Å; T184-L188 PolarHBondContact O-N 3.17Å |
| 185 | A | 78.9 | Confident | 81.8 | Confident | 64 Ų | 64 | 53.8 Ų | 53.8 | 53% | 0.529 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -66 | -43.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | D181 I182 K187 L188 L189 | D181-A185 PolarHBondContact O-N 3.08Å; D181-A185 VanDerWaalsContact O-N 3.08Å; I182-A185 PolarHBondContact O-N 3.2Å; A185-K187 PolarHBondContact O-N 3.36Å; A185-L188 PolarHBondContact O-N 3.48Å; A185-L189 PolarHBondContact O-N 3.45Å; A185-L189 VanDerWaalsContact O-N 3.09Å |
| 186 | G | 78.9 | Confident | 82.5 | Confident | 13 Ų | 13 | 51.2 Ų | 51.2 | 13% | 0.134 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -58.7 | -44.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | I182 F183 L189 A190 | I182-G186 PolarHBondContact O-N 2.94Å; I182-G186 VanDerWaalsContact O-N 3.08Å; F183-G186 PolarHBondContact O-N 3.44Å; G186-L189 PolarHBondContact O-N 2.76Å; G186-A190 PolarHBondContact O-N 3.1Å |
| 187 | K | 80.4 | Confident | 83.3 | Confident | 11 Ų | 11 | 53.2 Ų | 53.2 | 5% | 0.048 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -68.3 | -35.5 | 179.1 | 70.2 | -177.3 | -176.7 | -168.3 | 0 | 113.6 | G44 I47 F183 T184 A185 L189 A190 L191 S318 | G44-K187 PolarHBondContact O-NZ 3.28Å; I47-K187 HydrophobicContact CG2-CD 4.44Å; I47-K187 VanDerWaalsContact O-CD 3.29Å; I47-K187 WeakPolarHBondContact O-CD 3.18Å; I47-K187 WeakPolarHBondContact O-CE 3.42Å; I47-K187 PolarHBondContact O-NZ 3.37Å; F183-K187 PolarHBondContact O-N 3.31Å; F183-K187 VanDerWaalsContact O-N 3.08Å; T184-K187 VanDerWaalsContact O-CG 3.23Å; T184-K187 WeakPolarHBondContact O-CG 3.41Å; A185-K187 PolarHBondContact O-N 3.36Å; K187-L189 VanDerWaalsContact C-N 3.34Å; K187-A190 PolarHBondContact O-N 3.32Å; K187-L191 PolarHBondContact O-N 2.73Å; K187-L191 VanDerWaalsContact O-N 3.09Å; K187-S318 WeakPolarHBondContact CB-OG 3.48Å |
| 188 | L | 83.6 | Confident | 84.1 | Confident | 84 Ų | 84 | 50.5 Ų | 50.5 | 44% | 0.44 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -68.8 | -38.3 | 178 | -70.4 | 177.6 | 0 | 0 | 0 | 110.5 | I47 T184 A185 L191 A192 | I47-L188 HydrophobicContact CD1-CD2 4.4Å; T184-L188 WeakPolarHBondContact O-CG 3.34Å; T184-L188 PolarHBondContact O-N 3.17Å; A185-L188 PolarHBondContact O-N 3.48Å; L188-L191 PolarHBondContact O-N 3.13Å; L188-A192 WeakPolarHBondContact O-CB 3.33Å; L188-A192 PolarHBondContact O-N 3.36Å |
| 189 | L | 83.6 | Confident | 84.9 | Confident | 106 Ų | 106 | 47.6 Ų | 47.6 | 56% | 0.555 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -62.3 | -44.6 | 173.2 | -174.6 | 67.9 | 0 | 0 | 0 | 111.6 | A185 G186 K187 L191 A192 L193 | A185-L189 PolarHBondContact O-N 3.45Å; A185-L189 VanDerWaalsContact O-N 3.09Å; G186-L189 PolarHBondContact O-N 2.76Å; K187-L189 VanDerWaalsContact C-N 3.34Å; L189-L191 PolarHBondContact O-N 2.82Å; L189-A192 PolarHBondContact O-N 3.47Å; L189-L193 HydrophobicContact CG-CD1 4.5Å; L189-L193 WeakPolarHBondContact O-CG 3.38Å; L189-L193 PolarHBondContact O-N 3.46Å |
| 190 | A | 84.6 | Confident | 85.7 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -58 | -47.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | G186 K187 L193 I194 | G186-A190 PolarHBondContact O-N 3.1Å; K187-A190 PolarHBondContact O-N 3.32Å; A190-L193 PolarHBondContact O-N 3.37Å; A190-I194 WeakPolarHBondContact O-CG1 3.47Å; A190-I194 PolarHBondContact O-N 3.44Å; A190-I194 VanDerWaalsContact O-N 3.09Å |
| 191 | L | 89 | Confident | 86.3 | Confident | 4 Ų | 4 | 47.3 Ų | 47.3 | 2% | 0.021 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -68.9 | -38.1 | 179.3 | -73 | 170.7 | 0 | 0 | 0 | 112.2 | I47 I51 F52 K187 L188 L189 L193 I194 I195 V272 A276 | I47-L191 HydrophobicContact CG2-CD1 3.27Å; I51-L191 HydrophobicContact CG1-CD2 4.25Å; I51-L191 HydrophobicContact CG2-CD1 4.48Å; I51-L191 HydrophobicContact CG2-CD2 3.95Å; F52-L191 HydrophobicContact CE1-CD2 4.27Å; F52-L191 HydrophobicContact CZ-CD2 4.27Å; F52-L191 HydrophobicContact CZ-CG 4.43Å; K187-L191 PolarHBondContact O-N 2.73Å; K187-L191 VanDerWaalsContact O-N 3.09Å; L188-L191 PolarHBondContact O-N 3.13Å; L189-L191 PolarHBondContact O-N 2.82Å; L191-L193 VanDerWaalsContact C-N 3.32Å; L191-L193 PolarHBondContact O-N 2.98Å; L191-I194 HydrophobicContact CD2-CD1 4.37Å; L191-I194 PolarHBondContact O-N 3.11Å; L191-I195 VanDerWaalsContact O-CG1 3.3Å; L191-I195 WeakPolarHBondContact O-CG1 3.41Å; L191-I195 PolarHBondContact O-N 2.79Å; L191-V272 HydrophobicContact CB-CG1 4.48Å; L191-V272 HydrophobicContact CD1-CG1 4.04Å; L191-A276 HydrophobicContact CD2-CB 4.44Å |
| 192 | A | 90.1 | Very high | 87.1 | Confident | 42 Ų | 42 | 45.2 Ų | 45.2 | 35% | 0.347 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.9 | -43.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L188 L189 I195 I196 | L188-A192 WeakPolarHBondContact O-CB 3.33Å; L188-A192 PolarHBondContact O-N 3.36Å; L189-A192 PolarHBondContact O-N 3.47Å; A192-I195 PolarHBondContact O-N 3.37Å; A192-I196 WeakPolarHBondContact O-CB 3.42Å; A192-I196 WeakPolarHBondContact O-CD1 3.45Å; A192-I196 WeakPolarHBondContact O-CG1 3.16Å; A192-I196 PolarHBondContact O-N 3.26Å |
| 193 | L | 89.9 | Confident | 87.7 | Confident | 51 Ų | 51 | 44.9 Ų | 44.9 | 27% | 0.267 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.1 | -45.9 | 176.2 | -72.6 | 173.5 | 0 | 0 | 0 | 112.1 | L189 A190 L191 I195 I196 M197 I310 | L189-L193 HydrophobicContact CG-CD1 4.5Å; L189-L193 WeakPolarHBondContact O-CG 3.38Å; L189-L193 PolarHBondContact O-N 3.46Å; A190-L193 PolarHBondContact O-N 3.37Å; L191-L193 VanDerWaalsContact C-N 3.32Å; L191-L193 PolarHBondContact O-N 2.98Å; L193-I195 PolarHBondContact O-N 2.95Å; L193-I196 PolarHBondContact O-N 3.47Å; L193-M197 WeakPolarHBondContact O-CB 3.29Å; L193-M197 VanDerWaalsContact O-CG 3.24Å; L193-M197 WeakPolarHBondContact O-CG 3.31Å; L193-M197 PolarHBondContact O-N 3.47Å; L193-I310 HydrophobicContact CD1-CG2 4.04Å |
| 194 | I | 91.6 | Very high | 88.2 | Confident | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -58.5 | -49.1 | 177 | -68.4 | 162.3 | 0 | 0 | 0 | 110.6 | F52 A190 L191 M197 G198 A276 A279 Y280 A296 F299 M311 | F52-I194 HydrophobicContact CE1-CD1 3.99Å; A190-I194 WeakPolarHBondContact O-CG1 3.47Å; A190-I194 PolarHBondContact O-N 3.44Å; A190-I194 VanDerWaalsContact O-N 3.09Å; L191-I194 HydrophobicContact CD2-CD1 4.37Å; L191-I194 PolarHBondContact O-N 3.11Å; I194-M197 PolarHBondContact O-N 3.01Å; I194-G198 PolarHBondContact O-N 3.49Å; I194-A276 HydrophobicContact CG2-CB 4.39Å; I194-A279 HydrophobicContact CG2-CB 3.7Å; I194-A279 WeakPolarHBondContact O-CB 2.89Å; I194-Y280 HydrophobicContact CD1-CE1 4.1Å; I194-Y280 HydrophobicContact CG1-CE1 4.5Å; I194-Y280 HydrophobicContact CG2-CD1 4.42Å; I194-Y280 HydrophobicContact CG2-CE1 3.99Å; I194-A296 HydrophobicContact CD1-CB 4.36Å; I194-F299 HydrophobicContact CB-CE1 4.29Å; I194-F299 HydrophobicContact CB-CZ 4.46Å; I194-F299 HydrophobicContact CG1-CD1 4.2Å; I194-F299 HydrophobicContact CG1-CE1 4.03Å; I194-F299 HydrophobicContact CG2-CE1 4.36Å; I194-F299 HydrophobicContact CG2-CE2 4.45Å; I194-F299 HydrophobicContact CG2-CZ 4.15Å; I194-M311 HydrophobicContact CD1-CE 3.66Å; I194-M311 HydrophobicContact CG1-CE 3.69Å |
| 195 | I | 93.2 | Very high | 88.9 | Confident | 30 Ų | 30 | 51 Ų | 51 | 15% | 0.154 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -64.8 | -46.3 | -177.3 | -67.4 | 169.6 | 0 | 0 | 0 | 111.2 | L191 A192 L193 M197 G198 I199 V272 F275 | L191-I195 VanDerWaalsContact O-CG1 3.3Å; L191-I195 WeakPolarHBondContact O-CG1 3.41Å; L191-I195 PolarHBondContact O-N 2.79Å; A192-I195 PolarHBondContact O-N 3.37Å; L193-I195 PolarHBondContact O-N 2.95Å; I195-M197 VanDerWaalsContact C-N 3.35Å; I195-M197 PolarHBondContact O-N 3.45Å; I195-G198 PolarHBondContact O-N 3.39Å; I195-I199 HydrophobicContact CG2-CD1 3.96Å; I195-I199 WeakPolarHBondContact O-CG1 3.04Å; I195-I199 PolarHBondContact O-N 3.09Å; I195-V272 HydrophobicContact CD1-CG1 4.13Å; I195-F275 HydrophobicContact CD1-CB 4.31Å; I195-F275 HydrophobicContact CG1-CB 4.14Å; I195-F275 HydrophobicContact CG2-CB 4.31Å |
| 196 | I | 93.4 | Very high | 89.3 | Confident | 99 Ų | 99 | 51.7 Ų | 51.7 | 51% | 0.508 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.2 | -45.9 | 179.8 | -68.6 | 165 | 0 | 0 | 0 | 110.3 | A192 L193 G198 I199 V200 | A192-I196 WeakPolarHBondContact O-CB 3.42Å; A192-I196 WeakPolarHBondContact O-CD1 3.45Å; A192-I196 WeakPolarHBondContact O-CG1 3.16Å; A192-I196 PolarHBondContact O-N 3.26Å; L193-I196 PolarHBondContact O-N 3.47Å; I196-G198 PolarHBondContact O-N 2.98Å; I196-I199 PolarHBondContact O-N 3.4Å; I196-V200 WeakPolarHBondContact O-CG2 3.42Å; I196-V200 PolarHBondContact O-N 2.85Å |
| 197 | M | 91.7 | Very high | 89.9 | Confident | 45 Ų | 45 | 56.2 Ų | 56.2 | 22% | 0.222 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -66.5 | -36.3 | 179.1 | -69.7 | -58.1 | -63.9 | 0 | 0 | 112.4 | L193 I194 I195 V200 Q201 F299 L303 L304 | L193-M197 WeakPolarHBondContact O-CB 3.29Å; L193-M197 VanDerWaalsContact O-CG 3.24Å; L193-M197 WeakPolarHBondContact O-CG 3.31Å; L193-M197 PolarHBondContact O-N 3.47Å; I194-M197 PolarHBondContact O-N 3.01Å; I195-M197 VanDerWaalsContact C-N 3.35Å; I195-M197 PolarHBondContact O-N 3.45Å; M197-V200 PolarHBondContact O-N 3.29Å; M197-Q201 PolarHBondContact O-N 2.93Å; M197-F299 HydrophobicContact CB-CE1 4.17Å; M197-F299 HydrophobicContact CB-CZ 3.78Å; M197-L303 HydrophobicContact CB-CD1 4.49Å; M197-L303 HydrophobicContact CE-CB 4.12Å; M197-L304 HydrophobicContact CE-CD2 4.12Å; M197-L304 HydrophobicContact CG-CD2 4.05Å; M197-L304 HydrophobicContact SD-CD2 4.2Å |
| 198 | G | 92.1 | Very high | 90.3 | Very high | 2 Ų | 2 | 61.9 Ų | 61.9 | 2% | 0.021 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -61.6 | -44.5 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I194 I195 I196 V200 Q201 I202 | I194-G198 PolarHBondContact O-N 3.49Å; I195-G198 PolarHBondContact O-N 3.39Å; I196-G198 PolarHBondContact O-N 2.98Å; G198-V200 VanDerWaalsContact C-N 3.31Å; G198-V200 PolarHBondContact O-N 3.31Å; G198-Q201 WeakPolarHBondContact O-CB 3.42Å; G198-Q201 PolarHBondContact O-N 3.45Å; G198-I202 WeakPolarHBondContact O-CG1 3.49Å; G198-I202 PolarHBondContact O-N 3.33Å |
| 199 | I | 93.4 | Very high | 90.4 | Very high | 83 Ų | 83 | 60.7 Ų | 60.7 | 43% | 0.426 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -60.8 | -42 | 175.3 | -66.6 | 165.8 | 0 | 0 | 0 | 110.7 | I195 I196 Q201 I202 C203 | I195-I199 HydrophobicContact CG2-CD1 3.96Å; I195-I199 WeakPolarHBondContact O-CG1 3.04Å; I195-I199 PolarHBondContact O-N 3.09Å; I196-I199 PolarHBondContact O-N 3.4Å; I199-Q201 VanDerWaalsContact C-N 3.31Å; I199-Q201 PolarHBondContact O-N 3.1Å; I199-I202 PolarHBondContact O-N 2.91Å; I199-C203 PolarHBondContact O-N 3.15Å; I199-C203 PolarHBondContact O-SG 3.41Å |
| 200 | V | 93.9 | Very high | 90.6 | Very high | 57 Ų | 57 | 57.8 Ų | 57.8 | 35% | 0.345 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.1 | -40.5 | 176.4 | 170.3 | 0 | 0 | 0 | 0 | 111.7 | I196 M197 G198 C203 K204 | I196-V200 WeakPolarHBondContact O-CG2 3.42Å; I196-V200 PolarHBondContact O-N 2.85Å; M197-V200 PolarHBondContact O-N 3.29Å; G198-V200 VanDerWaalsContact C-N 3.31Å; G198-V200 PolarHBondContact O-N 3.31Å; V200-C203 PolarHBondContact O-N 3.03Å; V200-K204 HydrophobicContact CG1-CD 4.48Å; V200-K204 WeakPolarHBondContact O-CG 3.37Å; V200-K204 PolarHBondContact O-N 2.95Å; V200-K204 VanDerWaalsContact O-N 3.09Å |
| 201 | Q | 91.9 | Very high | 90.8 | Very high | 14 Ų | 14 | 61.2 Ų | 61.2 | 7% | 0.065 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -65 | -42.9 | 175.4 | -78.4 | -161.9 | -51.8 | 0 | 0 | 112.8 | M197 G198 I199 C203 K204 G205 D206 T282 A283 L303 | M197-Q201 PolarHBondContact O-N 2.93Å; G198-Q201 WeakPolarHBondContact O-CB 3.42Å; G198-Q201 PolarHBondContact O-N 3.45Å; I199-Q201 VanDerWaalsContact C-N 3.31Å; I199-Q201 PolarHBondContact O-N 3.1Å; Q201-C203 VanDerWaalsContact C-N 3.27Å; Q201-C203 PolarHBondContact O-N 3.24Å; Q201-K204 WeakPolarHBondContact O-CA 3.48Å; Q201-K204 WeakPolarHBondContact O-CB 3.46Å; Q201-K204 PolarHBondContact O-N 2.9Å; Q201-G205 PolarHBondContact O-N 3.15Å; Q201-D206 HydrophobicContact CB-CB 4.19Å; Q201-D206 PolarHBondContact O-N 3.38Å; Q201-T282 PolarHBondContact NE2-O 3.29Å; Q201-T282 VanDerWaalsContact OE1-CB 3.25Å; Q201-T282 PolarHBondContact OE1-O 3.41Å; Q201-T282 VanDerWaalsContact OE1-O 3.14Å; Q201-T282 PolarHBondContact OE1-OG1 2.84Å; Q201-A283 VanDerWaalsContact OE1-CA 3.24Å; Q201-L303 HydrophobicContact CG-CD1 4.25Å; Q201-L303 HydrophobicContact CG-CD2 3.79Å |
| 202 | I | 92.6 | Very high | 90.6 | Very high | 64 Ų | 64 | 66 Ų | 66 | 33% | 0.328 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.7 | -43.8 | 174.8 | -65.2 | 170.3 | 0 | 0 | 0 | 110 | G198 I199 K204 G205 I278 T282 | G198-I202 WeakPolarHBondContact O-CG1 3.49Å; G198-I202 PolarHBondContact O-N 3.33Å; I199-I202 PolarHBondContact O-N 2.91Å; I202-K204 PolarHBondContact O-N 3.25Å; I202-G205 PolarHBondContact O-N 3.5Å; I202-I278 HydrophobicContact CD1-CG2 3.89Å; I202-T282 HydrophobicContact CG1-CG2 3.94Å |
| 203 | C | 92.4 | Very high | 90.3 | Very high | 108 Ų | 108 | 67.9 Ų | 67.9 | 73% | 0.73 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -65.3 | -22.8 | 176.3 | -67.1 | 0 | 0 | 0 | 0 | 114 | I199 V200 Q201 G205 | I199-C203 PolarHBondContact O-N 3.15Å; I199-C203 PolarHBondContact O-SG 3.41Å; V200-C203 PolarHBondContact O-N 3.03Å; Q201-C203 VanDerWaalsContact C-N 3.27Å; Q201-C203 PolarHBondContact O-N 3.24Å; C203-G205 VanDerWaalsContact C-N 3.34Å |
| 204 | K | 91.4 | Very high | 90.2 | Very high | 153 Ų | 153 | 66.4 Ų | 66.4 | 67% | 0.665 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -81.8 | -13 | 173.4 | -73.9 | 176.7 | 178.1 | -177.5 | 0 | 113.4 | V200 Q201 I202 | V200-K204 HydrophobicContact CG1-CD 4.48Å; V200-K204 WeakPolarHBondContact O-CG 3.37Å; V200-K204 PolarHBondContact O-N 2.95Å; V200-K204 VanDerWaalsContact O-N 3.09Å; Q201-K204 WeakPolarHBondContact O-CA 3.48Å; Q201-K204 WeakPolarHBondContact O-CB 3.46Å; Q201-K204 PolarHBondContact O-N 2.9Å; I202-K204 PolarHBondContact O-N 3.25Å |
| 205 | G | 89.9 | Confident | 90 | Very high | 40 Ų | 40 | 66.7 Ų | 66.7 | 41% | 0.412 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 97.4 | 7.1 | -176 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q201 I202 C203 Y207 | Q201-G205 PolarHBondContact O-N 3.15Å; I202-G205 PolarHBondContact O-N 3.5Å; C203-G205 VanDerWaalsContact C-N 3.34Å; G205-Y207 VanDerWaalsContact C-N 3.28Å; G205-Y207 PolarHBondContact O-N 3.33Å |
| 206 | D | 88.4 | Confident | 89.8 | Confident | 80 Ų | 80 | 70.3 Ų | 70.3 | 43% | 0.428 | 37% | 0.374 | S | S | . | . | trans | -84.1 | 65.6 | -178.2 | -63.2 | -37.1 | 0 | 0 | 0 | 111.2 | Q201 T282 | Q201-D206 HydrophobicContact CB-CB 4.19Å; Q201-D206 PolarHBondContact O-N 3.38Å; D206-T282 VanDerWaalsContact O-CB 3.32Å; D206-T282 WeakPolarHBondContact O-CB 3.2Å; D206-T282 WeakPolarHBondContact O-CG2 3.48Å | ||
| 207 | Y | 89.9 | Confident | 89.4 | Confident | 108 Ų | 108 | 70.9 Ų | 70.9 | 42% | 0.424 | 38% | 0.375 | S | S | . | . | trans | -125.3 | 19.6 | -178.5 | 58.9 | -100.7 | 0 | 0 | 0 | 114.1 | G205 W209 L210 E211 | G205-Y207 VanDerWaalsContact C-N 3.28Å; G205-Y207 PolarHBondContact O-N 3.33Å; Y207-W209 VanDerWaalsContact C-N 3.33Å; Y207-W209 PolarHBondContact O-N 3.36Å; Y207-L210 WeakPolarHBondContact O-CA 3.41Å; Y207-L210 WeakPolarHBondContact O-CB 3.43Å; Y207-L210 PolarHBondContact O-N 2.94Å; Y207-E211 HydrophobicContact CD2-CG 3.74Å; Y207-E211 HydrophobicContact CE2-CG 3.92Å; Y207-E211 WeakPolarHBondContact CE2-OE1 3.19Å; Y207-E211 PolarHBondContact O-N 3.47Å | ||
| 208 | Y | 89.3 | Confident | 89.2 | Confident | 129 Ų | 129 | 71.6 Ų | 71.6 | 51% | 0.506 | 38% | 0.383 | S | S | . | . | G | 310 helix | trans | -48.1 | -46.5 | -176.1 | 177.9 | -101.8 | 0 | 0 | 0 | 114.6 | L210 E211 N214 | Y208-L210 VanDerWaalsContact C-N 3.27Å; Y208-L210 PolarHBondContact O-N 2.74Å; Y208-E211 WeakPolarHBondContact O-CB 3.42Å; Y208-E211 PolarHBondContact O-N 3.13Å; Y208-N214 VanDerWaalsContact CE2-ND2 3.26Å; Y208-N214 WeakPolarHBondContact CE2-ND2 3.19Å; Y208-N214 PolarHBondContact O-ND2 3.14Å |
| 209 | W | 86.7 | Confident | 88.8 | Confident | 60 Ų | 60 | 75.2 Ų | 75.2 | 23% | 0.227 | 40% | 0.398 | C | S | . | . | G | 310 helix | trans | -77.3 | -9.8 | -179.6 | -62.1 | 110.7 | 0 | 0 | 0 | 114.3 | Y207 N214 A215 P286 | Y207-W209 VanDerWaalsContact C-N 3.33Å; Y207-W209 PolarHBondContact O-N 3.36Å; W209-N214 HydrophobicContact CE3-CB 4.41Å; W209-A215 WeakPolarHBondContact O-CA 3.27Å; W209-A215 WeakPolarHBondContact O-CB 3.26Å; W209-P286 HydrophobicContact CD2-CG 4.07Å; W209-P286 HydrophobicContact CE3-CG 3.99Å; W209-P286 HydrophobicContact CG-CG 4.48Å; W209-P286 HydrophobicContact CZ3-CG 4.38Å |
| 210 | L | 87.6 | Confident | 88.3 | Confident | 45 Ų | 45 | 75.3 Ų | 75.3 | 24% | 0.236 | 40% | 0.396 | C | S | . | . | G | 310 helix | trans | -93.4 | -13.4 | 174.1 | -64 | 166.6 | 0 | 0 | 0 | 111.9 | L69 Y207 Y208 I278 V281 T282 | L69-L210 HydrophobicContact CD1-CD2 4.06Å; Y207-L210 WeakPolarHBondContact O-CA 3.41Å; Y207-L210 WeakPolarHBondContact O-CB 3.43Å; Y207-L210 PolarHBondContact O-N 2.94Å; Y208-L210 VanDerWaalsContact C-N 3.27Å; Y208-L210 PolarHBondContact O-N 2.74Å; L210-I278 HydrophobicContact CD1-CG2 3.78Å; L210-I278 HydrophobicContact CD2-CG1 4.27Å; L210-I278 HydrophobicContact CD2-CG2 4.28Å; L210-V281 HydrophobicContact CD2-CG2 3.59Å; L210-V281 HydrophobicContact CG-CG2 4.02Å; L210-T282 HydrophobicContact CD1-CG2 3.49Å; L210-T282 VanDerWaalsContact CD1-CG2 3.49Å; L210-T282 HydrophobicContact CG-CG2 4.47Å |
| 211 | E | 88.8 | Confident | 87.9 | Confident | 71 Ų | 71 | 79.7 Ų | 79.7 | 33% | 0.332 | 42% | 0.418 | S | S | . | . | S | Bend | trans | -63.3 | 133.3 | 176.1 | -64.1 | -174.1 | 146.3 | 0 | 0 | 109.7 | Y207 Y208 A213 N214 A215 | Y207-E211 HydrophobicContact CD2-CG 3.74Å; Y207-E211 HydrophobicContact CE2-CG 3.92Å; Y207-E211 WeakPolarHBondContact CE2-OE1 3.19Å; Y207-E211 PolarHBondContact O-N 3.47Å; Y208-E211 WeakPolarHBondContact O-CB 3.42Å; Y208-E211 PolarHBondContact O-N 3.13Å; E211-A213 PolarHBondContact O-N 3.39Å; E211-N214 PolarHBondContact O-N 3.35Å; E211-A215 WeakPolarHBondContact O-CB 3.34Å; E211-A215 PolarHBondContact O-N 3.29Å |
| 212 | P | 84.9 | Confident | 87.7 | Confident | 104 Ų | 104 | 83.9 Ų | 83.9 | 68% | 0.675 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -54.5 | -27.9 | -175.7 | -28.6 | 34.8 | 0 | 0 | 0 | 114.6 | ||
| 213 | A | 83.1 | Confident | 87.4 | Confident | 82 Ų | 82 | 84.2 Ų | 84.2 | 68% | 0.678 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -64.2 | -38.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | E211 | E211-A213 PolarHBondContact O-N 3.39Å |
| 214 | N | 87.1 | Confident | 87.2 | Confident | 21 Ų | 21 | 82.1 Ų | 82.1 | 11% | 0.112 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -101.6 | -28 | -176.5 | -49.2 | -46.4 | 0 | 0 | 0 | 111.7 | Y208 W209 E211 F216 E217 | Y208-N214 VanDerWaalsContact CE2-ND2 3.26Å; Y208-N214 WeakPolarHBondContact CE2-ND2 3.19Å; Y208-N214 PolarHBondContact O-ND2 3.14Å; W209-N214 HydrophobicContact CE3-CB 4.41Å; E211-N214 PolarHBondContact O-N 3.35Å; N214-F216 VanDerWaalsContact C-N 3.29Å; N214-F216 PolarHBondContact O-N 2.97Å; N214-E217 WeakPolarHBondContact O-CB 3.3Å; N214-E217 PolarHBondContact O-N 3.36Å |
| 215 | A | 87.3 | Confident | 86.9 | Confident | 6 Ų | 6 | 74.9 Ų | 74.9 | 5% | 0.05 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -64 | -33.4 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113 | V65 G66 W209 E211 | V65-A215 PolarHBondContact N-O 3.15Å; G66-A215 PolarHBondContact N-O 3.5Å; W209-A215 WeakPolarHBondContact O-CA 3.27Å; W209-A215 WeakPolarHBondContact O-CB 3.26Å; E211-A215 WeakPolarHBondContact O-CB 3.34Å; E211-A215 PolarHBondContact O-N 3.29Å |
| 216 | F | 89.2 | Confident | 86.8 | Confident | 105 Ų | 105 | 75.2 Ų | 75.2 | 46% | 0.461 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | 4.2 | -179.2 | -69.6 | -80.7 | 0 | 0 | 0 | 113.7 | I70 N214 P218 Y222 | I70-F216 HydrophobicContact CD1-CE1 3.93Å; I70-F216 HydrophobicContact CD1-CZ 4.19Å; N214-F216 VanDerWaalsContact C-N 3.29Å; N214-F216 PolarHBondContact O-N 2.97Å; F216-P218 VanDerWaalsContact O-CD 3.25Å; F216-P218 WeakPolarHBondContact O-CD 3.49Å; F216-Y222 PolarHBondContact O-OH 3.32Å |
| 217 | E | 86.8 | Confident | 86.9 | Confident | 112 Ų | 112 | 73.1 Ų | 73.1 | 52% | 0.523 | 37% | 0.369 | S | S | . | . | trans | -69.3 | 115.7 | 173.9 | -168.4 | 174.6 | -174.8 | 0 | 0 | 109 | N214 | N214-E217 WeakPolarHBondContact O-CB 3.3Å; N214-E217 PolarHBondContact O-N 3.36Å | ||
| 218 | P | 85.7 | Confident | 86.8 | Confident | 60 Ų | 60 | 68 Ų | 68 | 39% | 0.39 | 35% | 0.349 | S | S | . | . | trans | -76.8 | 134.6 | -178.1 | 28.5 | -29.8 | 0 | 0 | 0 | 111.2 | S63 F216 Q220 Y222 | S63-P218 CarbonylContact O-C 3.56Å; S63-P218 WeakPolarHBondContact O-CA 3.43Å; F216-P218 VanDerWaalsContact O-CD 3.25Å; F216-P218 WeakPolarHBondContact O-CD 3.49Å; P218-Q220 VanDerWaalsContact C-N 3.32Å; P218-Q220 WeakPolarHBondContact CB-O 3.15Å; P218-Y222 HydrophobicContact CB-CE1 4.4Å; P218-Y222 HydrophobicContact CB-CE2 3.85Å; P218-Y222 HydrophobicContact CG-CE2 4.11Å | ||
| 219 | F | 83.7 | Confident | 86.7 | Confident | 77 Ų | 77 | 62.3 Ų | 62.3 | 34% | 0.338 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -77.6 | -21.6 | 169.7 | -45.3 | -59.6 | 0 | 0 | 0 | 112.4 | S63 V65 P286 | S63-F219 WeakPolarHBondContact O-CD2 3.43Å; S63-F219 PolarHBondContact O-N 3.47Å; V65-F219 HydrophobicContact CG2-CZ 4.29Å; F219-P286 HydrophobicContact CE1-CB 4.14Å; F219-P286 HydrophobicContact CE1-CG 4.25Å; F219-P286 HydrophobicContact CE2-CB 3.6Å; F219-P286 HydrophobicContact CE2-CG 4.19Å; F219-P286 HydrophobicContact CZ-CB 3.37Å; F219-P286 HydrophobicContact CZ-CG 3.52Å |
| 220 | Q | 83.6 | Confident | 87 | Confident | 86 Ų | 86 | 59.4 Ų | 59.4 | 40% | 0.402 | 32% | 0.316 | S | S | . | . | S | Bend | trans | -150.7 | 159.3 | 177.7 | 66.6 | -174.1 | -8.4 | 0 | 0 | 109.5 | E60 S63 P218 | E60-Q220 PolarHBondContact O-NE2 3.07Å; S63-Q220 WeakPolarHBondContact CB-O 3.47Å; S63-Q220 WeakPolarHBondContact OG-CG 3.48Å; S63-Q220 PolarHBondContact OG-NE2 3.48Å; P218-Q220 VanDerWaalsContact C-N 3.32Å; P218-Q220 WeakPolarHBondContact CB-O 3.15Å |
| 221 | D | 86 | Confident | 87.1 | Confident | 148 Ų | 148 | 58 Ų | 58 | 79% | 0.791 | 31% | 0.309 | S | S | * | . | trans | -58.2 | 141.4 | 179.1 | -68.9 | -41.4 | 0 | 0 | 0 | 112 | D223 | D221-D223 PolarHBondContact O-N 3.08Š| ||
| 222 | Y | 86.5 | Confident | 87.1 | Confident | 103 Ų | 103 | 54.8 Ų | 54.8 | 40% | 0.404 | 29% | 0.294 | S | S | . | . | trans | -71.8 | 118 | 177.7 | -65.1 | -66.8 | 0 | 0 | 0 | 110.1 | S64 L67 F216 P218 | S64-Y222 WeakPolarHBondContact CB-OH 3.45Å; S64-Y222 PolarHBondContact OG-OH 2.95Å; L67-Y222 HydrophobicContact CD2-CD1 3.79Å; L67-Y222 HydrophobicContact CD2-CE1 3.61Å; F216-Y222 PolarHBondContact O-OH 3.32Å; P218-Y222 HydrophobicContact CB-CE1 4.4Å; P218-Y222 HydrophobicContact CB-CE2 3.85Å; P218-Y222 HydrophobicContact CG-CE2 4.11Å | ||
| 223 | D | 87.9 | Confident | 87.2 | Confident | 70 Ų | 70 | 50 Ų | 50 | 37% | 0.374 | 26% | 0.262 | S | S | . | . | trans | -112.2 | 139.2 | 168.1 | 179.4 | 45.1 | 0 | 0 | 0 | 110.8 | D221 G225 L226 I227 | D221-D223 PolarHBondContact O-N 3.08Å; D223-G225 VanDerWaalsContact C-N 3.26Å; D223-G225 PolarHBondContact O-N 3.46Å; D223-G225 WeakPolarHBondContact OD2-CA 3.41Å; D223-G225 PolarHBondContact OD2-N 3.09Å; D223-G225 VanDerWaalsContact OD2-N 3.17Å; D223-L226 HydrophobicContact CB-CB 4.35Å; D223-L226 HydrophobicContact CB-CD1 4.04Å; D223-L226 HydrophobicContact CB-CG 4.05Å; D223-L226 PolarHBondContact O-N 2.92Å; D223-L226 PolarHBondContact OD2-N 3.24Å; D223-I227 WeakPolarHBondContact O-CG1 3.47Å; D223-I227 PolarHBondContact O-N 3.41Å; D223-I227 VanDerWaalsContact O-N 3.09Å | ||
| 224 | V | 87.9 | Confident | 87.6 | Confident | 64 Ų | 64 | 46.1 Ų | 46.1 | 39% | 0.388 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -67.7 | -32.7 | -177.8 | -174.1 | 0 | 0 | 0 | 0 | 110.7 | I227 A228 F429 F433 | V224-I227 PolarHBondContact O-N 2.93Å; V224-A228 PolarHBondContact O-N 3.1Å; V224-A228 VanDerWaalsContact O-N 3.11Å; V224-F429 HydrophobicContact CG1-CE2 3.78Å; V224-F429 HydrophobicContact CG1-CZ 3.59Å; V224-F433 HydrophobicContact CB-CD1 4.15Å; V224-F433 HydrophobicContact CB-CE1 3.9Å; V224-F433 HydrophobicContact CB-CZ 4.48Å; V224-F433 HydrophobicContact CG1-CD1 3.74Å; V224-F433 HydrophobicContact CG1-CD2 4.25Å; V224-F433 HydrophobicContact CG1-CE1 3.5Å; V224-F433 VanDerWaalsContact CG1-CE1 3.5Å; V224-F433 HydrophobicContact CG1-CE2 4.07Å; V224-F433 HydrophobicContact CG1-CG 4.12Å; V224-F433 HydrophobicContact CG1-CZ 3.69Å |
| 225 | G | 85.4 | Confident | 87.7 | Confident | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.01 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.8 | -49.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | D223 I227 A228 L229 S437 | D223-G225 VanDerWaalsContact C-N 3.26Å; D223-G225 PolarHBondContact O-N 3.46Å; D223-G225 WeakPolarHBondContact OD2-CA 3.41Å; D223-G225 PolarHBondContact OD2-N 3.09Å; D223-G225 VanDerWaalsContact OD2-N 3.17Å; G225-I227 PolarHBondContact O-N 3.43Å; G225-A228 WeakPolarHBondContact O-CB 3.24Å; G225-A228 PolarHBondContact O-N 2.72Å; G225-A228 VanDerWaalsContact O-N 3.11Å; G225-L229 PolarHBondContact O-N 3.07Å; G225-L229 VanDerWaalsContact O-N 3.08Å; G225-S437 WeakPolarHBondContact CA-OG 3.44Å; G225-S437 PolarHBondContact O-OG 2.89Å |
| 226 | L | 87.1 | Confident | 87.7 | Confident | 48 Ų | 48 | 47 Ų | 47 | 25% | 0.251 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -60 | -43.5 | 176 | -63.5 | 177.9 | 0 | 0 | 0 | 111.9 | N61 D223 A228 L229 A230 | N61-L226 WeakPolarHBondContact CB-O 3.35Å; N61-L226 CarbonylContact O-C 3.59Å; N61-L226 WeakPolarHBondContact O-CB 3.09Å; D223-L226 HydrophobicContact CB-CB 4.35Å; D223-L226 HydrophobicContact CB-CD1 4.04Å; D223-L226 HydrophobicContact CB-CG 4.05Å; D223-L226 PolarHBondContact O-N 2.92Å; D223-L226 PolarHBondContact OD2-N 3.24Å; L226-A228 VanDerWaalsContact C-N 3.26Å; L226-A228 PolarHBondContact O-N 3.01Å; L226-L229 HydrophobicContact CD2-CD1 4.32Å; L226-L229 WeakPolarHBondContact O-CA 3.46Å; L226-L229 WeakPolarHBondContact O-CB 3.46Å; L226-L229 PolarHBondContact O-N 3.07Å; L226-A230 PolarHBondContact O-N 3.37Å |
| 227 | I | 90.8 | Very high | 87.8 | Confident | 35 Ų | 35 | 42 Ų | 42 | 18% | 0.179 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -59.7 | -38 | 176.3 | -66.1 | 167.1 | 0 | 0 | 0 | 111.4 | L67 D223 V224 G225 A230 F231 | L67-I227 HydrophobicContact CD2-CD1 3.95Å; L67-I227 HydrophobicContact CD2-CG1 4.07Å; D223-I227 WeakPolarHBondContact O-CG1 3.47Å; D223-I227 PolarHBondContact O-N 3.41Å; D223-I227 VanDerWaalsContact O-N 3.09Å; V224-I227 PolarHBondContact O-N 2.93Å; G225-I227 PolarHBondContact O-N 3.43Å; I227-A230 WeakPolarHBondContact O-CB 3.23Å; I227-A230 PolarHBondContact O-N 3.18Å; I227-F231 HydrophobicContact CG2-CD2 4.01Å; I227-F231 HydrophobicContact CG2-CE2 3.75Å; I227-F231 VanDerWaalsContact O-CD2 3.24Å; I227-F231 WeakPolarHBondContact O-CD2 3.19Å; I227-F231 PolarHBondContact O-N 2.76Å; I227-F231 VanDerWaalsContact O-N 3.1Å |
| 228 | A | 88.7 | Confident | 88 | Confident | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.1 | -39.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | V224 G225 L226 A230 F231 L232 L430 F433 | V224-A228 PolarHBondContact O-N 3.1Å; V224-A228 VanDerWaalsContact O-N 3.11Å; G225-A228 WeakPolarHBondContact O-CB 3.24Å; G225-A228 PolarHBondContact O-N 2.72Å; G225-A228 VanDerWaalsContact O-N 3.11Å; L226-A228 VanDerWaalsContact C-N 3.26Å; L226-A228 PolarHBondContact O-N 3.01Å; A228-A230 VanDerWaalsContact C-N 3.33Å; A228-A230 PolarHBondContact O-N 3.39Å; A228-F231 WeakPolarHBondContact O-CB 3.35Å; A228-F231 PolarHBondContact O-N 2.94Å; A228-L232 PolarHBondContact O-N 3.12Å; A228-L430 HydrophobicContact CB-CD2 3.96Å; A228-F433 HydrophobicContact CB-CB 3.6Å |
| 229 | L | 86.9 | Confident | 88 | Confident | 10 Ų | 10 | 35.2 Ų | 35.2 | 5% | 0.052 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63.3 | -38 | 172.6 | -63.2 | 179.5 | 0 | 0 | 0 | 111.8 | N61 G225 L226 F231 L232 Q233 E438 | N61-L229 HydrophobicContact CB-CB 4.44Å; G225-L229 PolarHBondContact O-N 3.07Å; G225-L229 VanDerWaalsContact O-N 3.08Å; L226-L229 HydrophobicContact CD2-CD1 4.32Å; L226-L229 WeakPolarHBondContact O-CA 3.46Å; L226-L229 WeakPolarHBondContact O-CB 3.46Å; L226-L229 PolarHBondContact O-N 3.07Å; L229-F231 VanDerWaalsContact C-N 3.31Å; L229-F231 PolarHBondContact O-N 3.01Å; L229-L232 HydrophobicContact CD2-CD1 4.09Å; L229-L232 WeakPolarHBondContact O-CB 3.42Å; L229-L232 PolarHBondContact O-N 3.39Å; L229-L232 VanDerWaalsContact O-N 3.15Å; L229-Q233 WeakPolarHBondContact O-CG 3.2Å; L229-Q233 PolarHBondContact O-N 2.92Å; L229-E438 HydrophobicContact CD1-CG 4.43Å; L229-E438 HydrophobicContact CD2-CG 4.44Å |
| 230 | A | 91.3 | Very high | 87.8 | Confident | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -59.7 | -42.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | N61 A62 V71 L226 I227 A228 Q233 G234 | N61-A230 HydrophobicContact CB-CB 3.71Å; A62-A230 HydrophobicContact CB-CB 4.37Å; V71-A230 HydrophobicContact CG1-CB 4.3Å; V71-A230 HydrophobicContact CG2-CB 4.39Å; L226-A230 PolarHBondContact O-N 3.37Å; I227-A230 WeakPolarHBondContact O-CB 3.23Å; I227-A230 PolarHBondContact O-N 3.18Å; A228-A230 VanDerWaalsContact C-N 3.33Å; A228-A230 PolarHBondContact O-N 3.39Å; A230-Q233 PolarHBondContact O-N 3.41Å; A230-G234 PolarHBondContact O-N 3.08Å |
| 231 | F | 91.6 | Very high | 87.9 | Confident | 16 Ų | 16 | 28.3 Ų | 28.3 | 7% | 0.07 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.2 | -38.8 | 173.9 | -81.2 | -65.7 | 0 | 0 | 0 | 113 | V71 I74 T75 I227 A228 L229 Q233 G234 S235 F426 L430 | V71-F231 HydrophobicContact CB-CE1 4.28Å; V71-F231 HydrophobicContact CG1-CD1 3.83Å; V71-F231 HydrophobicContact CG1-CE1 3.97Å; V71-F231 HydrophobicContact CG1-CG 4.27Å; V71-F231 HydrophobicContact CG2-CE1 4.3Å; V71-F231 HydrophobicContact CG2-CE2 4.3Å; V71-F231 HydrophobicContact CG2-CZ 4.07Å; I74-F231 HydrophobicContact CB-CE1 3.81Å; I74-F231 HydrophobicContact CB-CZ 4.14Å; I74-F231 HydrophobicContact CD1-CZ 4.31Å; I74-F231 HydrophobicContact CG2-CE1 3.57Å; I74-F231 HydrophobicContact CG2-CZ 3.84Å; T75-F231 WeakPolarHBondContact OG1-CD1 3.42Å; I227-F231 HydrophobicContact CG2-CD2 4.01Å; I227-F231 HydrophobicContact CG2-CE2 3.75Å; I227-F231 VanDerWaalsContact O-CD2 3.24Å; I227-F231 WeakPolarHBondContact O-CD2 3.19Å; I227-F231 PolarHBondContact O-N 2.76Å; I227-F231 VanDerWaalsContact O-N 3.1Å; A228-F231 WeakPolarHBondContact O-CB 3.35Å; A228-F231 PolarHBondContact O-N 2.94Å; L229-F231 VanDerWaalsContact C-N 3.31Å; L229-F231 PolarHBondContact O-N 3.01Å; F231-Q233 VanDerWaalsContact C-N 3.33Å; F231-Q233 PolarHBondContact O-N 2.83Å; F231-G234 PolarHBondContact O-N 3.13Å; F231-S235 VanDerWaalsContact O-CB 3.31Å; F231-S235 WeakPolarHBondContact O-CB 3.25Å; F231-S235 PolarHBondContact O-N 2.96Å; F231-F426 HydrophobicContact CB-CZ 4.34Å; F231-F426 HydrophobicContact CD1-CE2 4.3Å; F231-F426 AromaticContact CD1-CZ 3.72Å; F231-F426 HydrophobicContact CD1-CZ 3.72Å; F231-F426 HydrophobicContact CD2-CE2 4.44Å; F231-F426 HydrophobicContact CD2-CZ 4.35Å; F231-F426 HydrophobicContact CE1-CE2 4.27Å; F231-F426 HydrophobicContact CE1-CZ 4.08Å; F231-F426 HydrophobicContact CE2-CE2 4.4Å; F231-F426 HydrophobicContact CG-CE2 4.4Å; F231-F426 AromaticContact CG-CZ 3.89Å; F231-F426 HydrophobicContact CG-CZ 3.89Å; F231-F426 HydrophobicContact CZ-CE2 4.33Å; F231-L430 HydrophobicContact CB-CD1 4.18Å; F231-L430 HydrophobicContact CB-CD2 3.51Å; F231-L430 HydrophobicContact CB-CG 4.49Å; F231-L430 HydrophobicContact CD2-CD2 4.13Å; F231-L430 HydrophobicContact CG-CD2 4.09Å |
| 232 | L | 87.5 | Confident | 87.7 | Confident | 3 Ų | 3 | 21.6 Ų | 21.6 | 2% | 0.016 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -59.9 | -45.4 | 173.6 | -73.1 | -178.3 | 0 | 0 | 0 | 111.1 | A228 L229 S235 F236 Y389 S434 | A228-L232 PolarHBondContact O-N 3.12Å; L229-L232 HydrophobicContact CD2-CD1 4.09Å; L229-L232 WeakPolarHBondContact O-CB 3.42Å; L229-L232 PolarHBondContact O-N 3.39Å; L229-L232 VanDerWaalsContact O-N 3.15Å; L232-S235 WeakPolarHBondContact O-CB 3.4Å; L232-S235 PolarHBondContact O-N 3.36Å; L232-S235 PolarHBondContact O-OG 2.8Å; L232-F236 PolarHBondContact O-N 2.83Å; L232-Y389 HydrophobicContact CD2-CD2 3.56Å; L232-Y389 HydrophobicContact CD2-CE2 3.91Å; L232-S434 WeakPolarHBondContact CD1-OG 3.46Å |
| 233 | Q | 87.9 | Confident | 86.9 | Confident | 4 Ų | 4 | 18.9 Ų | 18.9 | 2% | 0.019 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -69.3 | -38.3 | 178.4 | -66.2 | -157.7 | 28.3 | 0 | 0 | 113.6 | S54 V58 N61 L229 A230 F231 S235 F236 I381 | S54-Q233 WeakPolarHBondContact CB-O 3.4Å; S54-Q233 PolarHBondContact OG-O 3.36Å; V58-Q233 HydrophobicContact CG2-CB 3.96Å; N61-Q233 PolarHBondContact ND2-NE2 3.47Å; N61-Q233 VanDerWaalsContact ND2-NE2 3.12Å; L229-Q233 WeakPolarHBondContact O-CG 3.2Å; L229-Q233 PolarHBondContact O-N 2.92Å; A230-Q233 PolarHBondContact O-N 3.41Å; F231-Q233 VanDerWaalsContact C-N 3.33Å; F231-Q233 PolarHBondContact O-N 2.83Å; Q233-S235 VanDerWaalsContact C-N 3.32Å; Q233-F236 WeakPolarHBondContact O-CB 3.49Å; Q233-F236 PolarHBondContact O-N 3.2Å; Q233-I381 HydrophobicContact CG-CG2 4.42Å |
| 234 | G | 91.4 | Very high | 86.1 | Confident | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -60.8 | -43.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | A230 F231 F236 A237 Y238 | A230-G234 PolarHBondContact O-N 3.08Å; F231-G234 PolarHBondContact O-N 3.13Å; G234-F236 PolarHBondContact O-N 2.99Å; G234-A237 WeakPolarHBondContact O-CB 3.44Å; G234-A237 PolarHBondContact O-N 3.16Å; G234-A237 VanDerWaalsContact O-N 3.11Å; G234-Y238 WeakPolarHBondContact O-CD2 3.35Å; G234-Y238 PolarHBondContact O-N 3.5Å |
| 235 | S | 88.9 | Confident | 85.4 | Confident | 15 Ų | 15 | 12.9 Ų | 12.9 | 11% | 0.105 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -60.9 | -33.5 | 179.7 | 81.4 | 0 | 0 | 0 | 0 | 113.9 | F231 L232 Q233 A237 Y238 G239 Y389 | F231-S235 VanDerWaalsContact O-CB 3.31Å; F231-S235 WeakPolarHBondContact O-CB 3.25Å; F231-S235 PolarHBondContact O-N 2.96Å; L232-S235 WeakPolarHBondContact O-CB 3.4Å; L232-S235 PolarHBondContact O-N 3.36Å; L232-S235 PolarHBondContact O-OG 2.8Å; Q233-S235 VanDerWaalsContact C-N 3.32Å; S235-A237 PolarHBondContact O-N 3.21Å; S235-Y238 CarbonylContact O-C 3.46Å; S235-Y238 WeakPolarHBondContact O-CA 3.4Å; S235-Y238 PolarHBondContact O-N 3.14Å; S235-G239 PolarHBondContact O-N 3.14Å; S235-Y389 VanDerWaalsContact CB-CZ 3.42Å; S235-Y389 WeakPolarHBondContact CB-OH 3.25Å; S235-Y389 WeakPolarHBondContact OG-CE2 3.45Å |
| 236 | F | 87.7 | Confident | 84.7 | Confident | 29 Ų | 29 | 14.5 Ų | 14.5 | 13% | 0.127 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -60.4 | -40.4 | 178.2 | 175 | -98.6 | 0 | 0 | 0 | 110.3 | N127 V130 L232 Q233 G234 Y238 G239 I381 | N127-F236 WeakPolarHBondContact OD1-CE2 3.43Å; V130-F236 HydrophobicContact CB-CZ 4.16Å; V130-F236 HydrophobicContact CG1-CE1 3.98Å; V130-F236 HydrophobicContact CG1-CE2 4.3Å; V130-F236 HydrophobicContact CG1-CZ 3.51Å; L232-F236 PolarHBondContact O-N 2.83Å; Q233-F236 WeakPolarHBondContact O-CB 3.49Å; Q233-F236 PolarHBondContact O-N 3.2Å; G234-F236 PolarHBondContact O-N 2.99Å; F236-Y238 VanDerWaalsContact C-N 3.31Å; F236-Y238 PolarHBondContact O-N 3Å; F236-G239 PolarHBondContact O-N 2.89Å; F236-G239 VanDerWaalsContact O-N 3.16Å; F236-I381 HydrophobicContact CB-CG2 3.85Å; F236-I381 HydrophobicContact CD1-CD1 4.37Å; F236-I381 HydrophobicContact CD1-CG1 4.43Å; F236-I381 HydrophobicContact CD1-CG2 4.37Å; F236-I381 HydrophobicContact CD2-CG1 4.46Å; F236-I381 HydrophobicContact CD2-CG2 4.18Å; F236-I381 HydrophobicContact CE1-CD1 4.36Å; F236-I381 HydrophobicContact CE1-CG1 4.41Å; F236-I381 HydrophobicContact CE2-CG1 4.44Å; F236-I381 HydrophobicContact CG-CG1 4.46Å; F236-I381 HydrophobicContact CG-CG2 3.87Å; F236-I381 HydrophobicContact CZ-CG1 4.43Å |
| 237 | A | 90.9 | Very high | 83.8 | Confident | 2 Ų | 2 | 12.9 Ų | 12.9 | 2% | 0.017 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -69.2 | -27.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | W72 G234 S235 G239 Y273 | W72-A237 HydrophobicContact CH2-CB 3.52Å; W72-A237 HydrophobicContact CZ3-CB 3.63Å; G234-A237 WeakPolarHBondContact O-CB 3.44Å; G234-A237 PolarHBondContact O-N 3.16Å; G234-A237 VanDerWaalsContact O-N 3.11Å; S235-A237 PolarHBondContact O-N 3.21Å; A237-G239 VanDerWaalsContact C-N 3.33Å; A237-Y273 HydrophobicContact CB-CE2 4.08Å; A237-Y273 VanDerWaalsContact O-CE2 3.27Å; A237-Y273 WeakPolarHBondContact O-CE2 3.32Å; A237-Y273 PolarHBondContact O-OH 3.03Å |
| 238 | Y | 90.1 | Very high | 82.9 | Confident | 1 Ų | 1 | 11.6 Ų | 11.6 | 0% | 0.004 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -84.4 | -6.4 | 172.8 | -78.2 | -86.1 | 0 | 0 | 0 | 113.5 | I46 W72 T75 T79 G234 S235 F236 W241 V269 T270 Y273 | I46-Y238 HydrophobicContact CG2-CD1 4.5Å; I46-Y238 WeakPolarHBondContact CG2-O 3.45Å; W72-Y238 HydrophobicContact CE3-CD2 4.43Å; W72-Y238 AromaticContact CE3-CE2 3.6Å; W72-Y238 HydrophobicContact CE3-CE2 3.6Å; W72-Y238 HydrophobicContact CZ3-CD2 4.35Å; W72-Y238 AromaticContact CZ3-CE2 3.9Å; W72-Y238 HydrophobicContact CZ3-CE2 3.9Å; W72-Y238 PolarHBondContact O-OH 3.42Å; T75-Y238 HydrophobicContact CG2-CD2 3.44Å; T75-Y238 VanDerWaalsContact CG2-CD2 3.44Å; T75-Y238 HydrophobicContact CG2-CE2 3.87Å; T75-Y238 HydrophobicContact CG2-CG 4.16Å; T79-Y238 HydrophobicContact CG2-CD1 4.4Å; G234-Y238 WeakPolarHBondContact O-CD2 3.35Å; G234-Y238 PolarHBondContact O-N 3.5Å; S235-Y238 CarbonylContact O-C 3.46Å; S235-Y238 WeakPolarHBondContact O-CA 3.4Å; S235-Y238 PolarHBondContact O-N 3.14Å; F236-Y238 VanDerWaalsContact C-N 3.31Å; F236-Y238 PolarHBondContact O-N 3Å; Y238-W241 VanDerWaalsContact O-CD1 3.24Å; Y238-V269 HydrophobicContact CD1-CG1 4.22Å; Y238-V269 HydrophobicContact CE1-CG1 4Å; Y238-T270 WeakPolarHBondContact CE1-OG1 3.36Å; Y238-T270 VanDerWaalsContact OH-CA 3.3Å; Y238-T270 WeakPolarHBondContact OH-CA 3.46Å; Y238-T270 WeakPolarHBondContact OH-CG2 3.47Å; Y238-T270 PolarHBondContact OH-OG1 3.26Å; Y238-Y273 HydrophobicContact CD1-CD2 4.34Å; Y238-Y273 HydrophobicContact CD1-CE2 4.2Å; Y238-Y273 HydrophobicContact CD2-CD2 4.19Å; Y238-Y273 HydrophobicContact CD2-CE2 4.25Å; Y238-Y273 AromaticContact CE1-CD2 3.87Å; Y238-Y273 HydrophobicContact CE1-CD2 3.87Å; Y238-Y273 HydrophobicContact CE1-CE2 4.17Å; Y238-Y273 AromaticContact CE2-CD2 3.73Å; Y238-Y273 HydrophobicContact CE2-CD2 3.73Å; Y238-Y273 HydrophobicContact CE2-CE2 4.25Å; Y238-Y273 HydrophobicContact CG-CD2 4.49Å; Y238-Y273 HydrophobicContact CG-CE2 4.24Å; Y238-Y273 AromaticContact CZ-CD2 3.55Å |
| 239 | G | 85.8 | Confident | 82 | Confident | 27 Ų | 27 | 14.9 Ų | 14.9 | 28% | 0.278 | 8% | 0.08 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.2 | 146.6 | -176 | 0 | 0 | 0 | 0 | 0 | 113.5 | S235 F236 A237 | S235-G239 PolarHBondContact O-N 3.14Å; F236-G239 PolarHBondContact O-N 2.89Å; F236-G239 VanDerWaalsContact O-N 3.16Å; A237-G239 VanDerWaalsContact C-N 3.33Å |
| 240 | G | 80.1 | Confident | 81.6 | Confident | 7 Ų | 7 | 16.6 Ų | 16.6 | 7% | 0.072 | 9% | 0.088 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 97.2 | 3.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 116 | N242 F243 | G240-N242 PolarHBondContact O-N 3.07Å; G240-F243 WeakPolarHBondContact O-CB 3.41Å; G240-F243 WeakPolarHBondContact O-CD2 3.37Å; G240-F243 PolarHBondContact O-N 2.89Å |
| 241 | W | 85.1 | Confident | 81 | Confident | 12 Ų | 12 | 16.7 Ų | 16.7 | 5% | 0.045 | 9% | 0.088 | C | C | . | . | G | 310 helix | trans | -61.1 | -27.1 | 170.4 | 55.2 | -95.5 | 0 | 0 | 0 | 113.2 | I46 T79 A83 Y86 Y238 F243 Y392 | I46-W241 HydrophobicContact CD1-CB 3.69Å; I46-W241 HydrophobicContact CG1-CB 4.13Å; T79-W241 HydrophobicContact CG2-CB 4.02Å; T79-W241 HydrophobicContact CG2-CD2 4.23Å; T79-W241 HydrophobicContact CG2-CG 3.6Å; A83-W241 HydrophobicContact CB-CD2 4.43Å; A83-W241 HydrophobicContact CB-CE3 3.73Å; A83-W241 HydrophobicContact CB-CZ3 4.25Å; Y86-W241 HydrophobicContact CD1-CZ3 4.27Å; Y86-W241 AromaticContact CD2-CH2 3.61Å; Y86-W241 HydrophobicContact CD2-CH2 3.61Å; Y86-W241 AromaticContact CD2-CZ3 3.58Å; Y86-W241 HydrophobicContact CD2-CZ3 3.58Å; Y86-W241 AromaticContact CE2-CH2 3.63Å; Y86-W241 HydrophobicContact CE2-CH2 3.63Å; Y86-W241 HydrophobicContact CE2-CZ3 4.05Å; Y86-W241 HydrophobicContact CG-CH2 4.14Å; Y86-W241 AromaticContact CG-CZ3 3.68Å; Y86-W241 HydrophobicContact CG-CZ3 3.68Å; Y238-W241 VanDerWaalsContact O-CD1 3.24Å; W241-F243 VanDerWaalsContact C-N 3.27Å; W241-F243 PolarHBondContact O-N 2.74Å; W241-Y392 HydrophobicContact CZ2-CD1 4.41Å; W241-Y392 AromaticContact CZ2-CD2 3.96Å; W241-Y392 HydrophobicContact CZ2-CD2 3.96Å; W241-Y392 HydrophobicContact CZ2-CE1 4.32Å; W241-Y392 AromaticContact CZ2-CE2 3.87Å; W241-Y392 HydrophobicContact CZ2-CE2 3.87Å; W241-Y392 HydrophobicContact CZ2-CG 4.23Å |
| 242 | N | 82.2 | Confident | 80.6 | Confident | 7 Ų | 7 | 18.3 Ų | 18.3 | 4% | 0.037 | 10% | 0.099 | C | C | . | . | G | 310 helix | trans | -75.4 | -12.1 | 180 | 62.5 | -36 | 0 | 0 | 0 | 113.2 | Y86 D99 G240 L244 N245 Y246 | Y86-N242 HydrophobicContact CD1-CB 4.4Å; Y86-N242 HydrophobicContact CE1-CB 4.45Å; D99-N242 PolarHBondContact OD1-ND2 2.62Å; D99-N242 PolarHBondContact OD2-ND2 3.49Å; G240-N242 PolarHBondContact O-N 3.07Å; N242-L244 VanDerWaalsContact C-N 3.32Å; N242-L244 PolarHBondContact O-N 2.92Å; N242-N245 WeakPolarHBondContact O-CB 3.44Å; N242-N245 PolarHBondContact O-N 3.49Å; N242-N245 VanDerWaalsContact O-N 3.14Å; N242-N245 PolarHBondContact O-ND2 2.72Å; N242-Y246 WeakPolarHBondContact O-CD2 3.11Å |
| 243 | F | 69.9 | Low | 80.4 | Confident | 46 Ų | 46 | 23.1 Ų | 23.1 | 20% | 0.202 | 13% | 0.125 | C | C | . | . | G | 310 helix | trans | -62.2 | -33 | -176.3 | -75.7 | -57.2 | 0 | 0 | 0 | 114.3 | N45 G240 W241 N245 Y246 T329 | N45-F243 HydrophobicContact CB-CD2 4.07Å; G240-F243 WeakPolarHBondContact O-CB 3.41Å; G240-F243 WeakPolarHBondContact O-CD2 3.37Å; G240-F243 PolarHBondContact O-N 2.89Å; W241-F243 VanDerWaalsContact C-N 3.27Å; W241-F243 PolarHBondContact O-N 2.74Å; F243-N245 PolarHBondContact O-N 3.27Å; F243-Y246 HydrophobicContact CD1-CD2 4.3Å; F243-Y246 HydrophobicContact CD1-CE2 4.46Å; F243-Y246 WeakPolarHBondContact O-CB 3.5Å; F243-Y246 PolarHBondContact O-N 3.43Å; F243-T329 HydrophobicContact CD1-CG2 4.02Å; F243-T329 HydrophobicContact CE1-CG2 3.94Å |
| 244 | L | 70.2 | Confident | 80.1 | Confident | 4 Ų | 4 | 23.6 Ų | 23.6 | 2% | 0.021 | 13% | 0.129 | C | C | . | . | G | 310 helix | trans | -61.9 | -27.7 | 179.6 | -166.8 | 67 | 0 | 0 | 0 | 111.5 | A38 I41 I42 N242 Y246 V247 T248 L258 A261 | A38-L244 HydrophobicContact CB-CD1 4.07Å; A38-L244 HydrophobicContact CB-CD2 4.19Å; I41-L244 HydrophobicContact CG2-CD1 4.4Å; I42-L244 HydrophobicContact CD1-CB 4.48Å; I42-L244 HydrophobicContact CD1-CD2 3.55Å; I42-L244 HydrophobicContact CG1-CB 4.03Å; I42-L244 HydrophobicContact CG1-CD2 3.82Å; I42-L244 HydrophobicContact CG1-CG 4.38Å; N242-L244 VanDerWaalsContact C-N 3.32Å; N242-L244 PolarHBondContact O-N 2.92Å; L244-Y246 PolarHBondContact O-N 2.99Å; L244-V247 HydrophobicContact CD1-CG2 3.82Å; L244-V247 CarbonylContact O-C 3.54Å; L244-V247 WeakPolarHBondContact O-CG2 3.38Å; L244-V247 PolarHBondContact O-N 2.98Å; L244-V247 VanDerWaalsContact O-N 3.16Å; L244-T248 PolarHBondContact O-N 3.46Å; L244-T248 PolarHBondContact O-OG1 3.33Å; L244-L258 HydrophobicContact CB-CD1 4.36Å; L244-L258 HydrophobicContact CD2-CD1 3.51Å; L244-L258 HydrophobicContact CG-CD1 3.77Å; L244-A261 HydrophobicContact CD2-CB 3.99Å |
| 245 | N | 74.6 | Confident | 79.9 | Confident | 4 Ų | 4 | 29.5 Ų | 29.5 | 2% | 0.021 | 15% | 0.152 | C | C | . | . | G | 310 helix | trans | -66.4 | -27 | 176.9 | -61.9 | -67.2 | 0 | 0 | 0 | 112.9 | Y86 Y102 N242 F243 V247 T248 | Y86-N245 PolarHBondContact O-OD1 3.42Å; Y102-N245 HydrophobicContact CE2-CB 4.41Å; N242-N245 WeakPolarHBondContact O-CB 3.44Å; N242-N245 PolarHBondContact O-N 3.49Å; N242-N245 VanDerWaalsContact O-N 3.14Å; N242-N245 PolarHBondContact O-ND2 2.72Å; F243-N245 PolarHBondContact O-N 3.27Å; N245-V247 VanDerWaalsContact C-N 3.28Å; N245-V247 PolarHBondContact O-N 3.22Å; N245-T248 VanDerWaalsContact C-OG1 3.3Å; N245-T248 VanDerWaalsContact CA-OG1 3.25Å; N245-T248 WeakPolarHBondContact CA-OG1 3.45Å; N245-T248 PolarHBondContact O-OG1 3.06Å |
| 246 | Y | 69.7 | Low | 79.7 | Confident | 34 Ų | 34 | 31.8 Ų | 31.8 | 13% | 0.133 | 17% | 0.165 | C | C | . | . | G | 310 helix | trans | -75.7 | -17.1 | 177.2 | -65.2 | -99.5 | 0 | 0 | 0 | 112.9 | G97 D99 N242 F243 L244 | G97-Y246 VanDerWaalsContact C-CD1 3.45Å; G97-Y246 VanDerWaalsContact C-CE1 3.49Å; G97-Y246 WeakPolarHBondContact O-CE1 3.31Å; D99-Y246 PolarHBondContact N-OH 3.48Å; D99-Y246 PolarHBondContact OD1-OH 2.82Å; D99-Y246 VanDerWaalsContact OD1-OH 3.13Å; D99-Y246 PolarHBondContact OD2-OH 2.8Å; D99-Y246 VanDerWaalsContact OD2-OH 3.08Å; N242-Y246 WeakPolarHBondContact O-CD2 3.11Å; F243-Y246 HydrophobicContact CD1-CD2 4.3Å; F243-Y246 HydrophobicContact CD1-CE2 4.46Å; F243-Y246 WeakPolarHBondContact O-CB 3.5Å; F243-Y246 PolarHBondContact O-N 3.43Å; L244-Y246 PolarHBondContact O-N 2.99Å |
| 247 | V | 69 | Low | 79.7 | Confident | 14 Ų | 14 | 31.5 Ų | 31.5 | 9% | 0.085 | 17% | 0.165 | C | C | . | . | G | 310 helix | trans | -115.6 | 19.7 | 178.7 | -65.8 | 0 | 0 | 0 | 0 | 112.1 | I33 L244 N245 E249 E250 L251 | I33-V247 HydrophobicContact CD1-CB 4.32Å; I33-V247 HydrophobicContact CD1-CG2 4.42Å; L244-V247 HydrophobicContact CD1-CG2 3.82Å; L244-V247 CarbonylContact O-C 3.54Å; L244-V247 WeakPolarHBondContact O-CG2 3.38Å; L244-V247 PolarHBondContact O-N 2.98Å; L244-V247 VanDerWaalsContact O-N 3.16Å; N245-V247 VanDerWaalsContact C-N 3.28Å; N245-V247 PolarHBondContact O-N 3.22Å; V247-E249 PolarHBondContact O-N 3.12Å; V247-E250 PolarHBondContact O-N 3.12Å; V247-L251 PolarHBondContact O-N 2.98Å |
| 248 | T | 70.8 | Confident | 79.4 | Confident | 8 Ų | 8 | 31.4 Ų | 31.4 | 5% | 0.049 | 16% | 0.164 | C | C | . | . | G | 310 helix | trans | -59.6 | -32.4 | -179.7 | -50.6 | 0 | 0 | 0 | 0 | 112 | L244 N245 E250 L251 P254 L258 | L244-T248 PolarHBondContact O-N 3.46Å; L244-T248 PolarHBondContact O-OG1 3.33Å; N245-T248 VanDerWaalsContact C-OG1 3.3Å; N245-T248 VanDerWaalsContact CA-OG1 3.25Å; N245-T248 WeakPolarHBondContact CA-OG1 3.45Å; N245-T248 PolarHBondContact O-OG1 3.06Å; T248-E250 VanDerWaalsContact C-N 3.27Å; T248-E250 PolarHBondContact O-N 3.37Å; T248-L251 WeakPolarHBondContact O-CB 3.5Å; T248-L251 PolarHBondContact O-N 3.5Å; T248-P254 HydrophobicContact CG2-CB 3.75Å; T248-L258 HydrophobicContact CG2-CD2 4.38Å |
| 249 | E | 71.1 | Confident | 79.3 | Confident | 69 Ų | 69 | 32.4 Ų | 32.4 | 32% | 0.322 | 17% | 0.17 | S | C | . | . | G | 310 helix | trans | -66 | -28 | 177.2 | -67.6 | 178.6 | -176.1 | 0 | 0 | 112.9 | L29 K95 S96 V247 | L29-E249 HydrophobicContact CD1-CB 4.24Å; L29-E249 WeakPolarHBondContact CD1-OE2 3.3Å; K95-E249 WeakPolarHBondContact CA-OE1 3.46Å; S96-E249 PolarHBondContact N-OE1 3.37Å; V247-E249 PolarHBondContact O-N 3.12Å |
| 250 | E | 77.3 | Confident | 79.4 | Confident | 47 Ų | 47 | 37.9 Ų | 37.9 | 22% | 0.22 | 18% | 0.183 | C | C | . | . | G | 310 helix | trans | -89.1 | -7.2 | 179.6 | -61.6 | 172.2 | -148.6 | 0 | 0 | 112.5 | L29 K31 E32 I33 V247 T248 R332 | L29-E250 HydrophobicContact CB-CG 4.31Å; L29-E250 HydrophobicContact CD1-CG 4.33Å; K31-E250 CarbonylContact C-O 3.16Å; K31-E250 WeakPolarHBondContact CA-O 3.28Å; E32-E250 PolarHBondContact N-O 2.96Å; E32-E250 VanDerWaalsContact N-O 3.12Å; I33-E250 HydrophobicContact CD1-CB 3.76Å; I33-E250 HydrophobicContact CG1-CB 4.18Å; I33-E250 PolarHBondContact N-O 3.49Å; V247-E250 PolarHBondContact O-N 3.12Å; T248-E250 VanDerWaalsContact C-N 3.27Å; T248-E250 PolarHBondContact O-N 3.37Å; E250-R332 IonicContact OE1-NH2 3.13Å |
| 251 | L | 79.3 | Confident | 79.9 | Confident | 1 Ų | 1 | 37.5 Ų | 37.5 | 1% | 0.005 | 18% | 0.179 | C | C | . | . | B | Isolated β-bridge | trans | -82.4 | 131.6 | -176.3 | -170 | 69.5 | 0 | 0 | 0 | 111.4 | I33 A38 V247 T248 D253 P254 N257 L258 | I33-L251 HydrophobicContact CB-CD1 4.27Å; I33-L251 HydrophobicContact CG2-CD1 3.91Å; I33-L251 WeakPolarHBondContact O-CD1 3.41Å; A38-L251 HydrophobicContact CB-CD1 3.6Å; V247-L251 PolarHBondContact O-N 2.98Å; T248-L251 WeakPolarHBondContact O-CB 3.5Å; T248-L251 PolarHBondContact O-N 3.5Å; L251-D253 PolarHBondContact O-N 3.29Å; L251-P254 HydrophobicContact CB-CB 4.42Å; L251-P254 HydrophobicContact CD2-CB 4.08Å; L251-N257 HydrophobicContact CD2-CB 4.41Å; L251-L258 HydrophobicContact CD2-CB 3.9Å; L251-L258 HydrophobicContact CD2-CD1 4.22Å |
| 252 | V | 83.9 | Confident | 80.1 | Confident | 51 Ų | 51 | 37.2 Ų | 37.2 | 31% | 0.309 | 18% | 0.179 | S | C | . | . | S | Bend | trans | -70.2 | 127.2 | 171.3 | -179.3 | 0 | 0 | 0 | 0 | 108.7 | K31 I33 N257 | K31-V252 HydrophobicContact CB-CG2 4.29Å; K31-V252 WeakPolarHBondContact O-CG2 3.22Å; I33-V252 WeakPolarHBondContact O-CG2 3.43Å; I33-V252 PolarHBondContact O-N 3.21Å; V252-N257 PolarHBondContact O-ND2 2.81Å |
| 253 | D | 83.7 | Confident | 80.4 | Confident | 103 Ų | 103 | 43 Ų | 43 | 55% | 0.551 | 20% | 0.204 | S | C | * | . | S | Bend | trans | 44.3 | 67.4 | -178.4 | -64 | -24.5 | 0 | 0 | 0 | 114.4 | L251 Y255 V256 N257 | L251-D253 PolarHBondContact O-N 3.29Å; D253-Y255 PolarHBondContact O-N 3.36Å; D253-Y255 VanDerWaalsContact O-N 3.15Å; D253-V256 PolarHBondContact O-N 3.17Å; D253-V256 VanDerWaalsContact O-N 3.14Å; D253-N257 PolarHBondContact O-N 3.44Å |
| 254 | P | 81.7 | Confident | 81.4 | Confident | 15 Ų | 15 | 45.2 Ų | 45.2 | 10% | 0.097 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.2 | -30.8 | -171.7 | 24.1 | -33.5 | 0 | 0 | 0 | 113 | T248 L251 V256 L258 | T248-P254 HydrophobicContact CG2-CB 3.75Å; L251-P254 HydrophobicContact CB-CB 4.42Å; L251-P254 HydrophobicContact CD2-CB 4.08Å; P254-V256 PolarHBondContact O-N 3.27Å; P254-V256 VanDerWaalsContact O-N 3.15Å; P254-L258 WeakPolarHBondContact O-CB 3.5Å; P254-L258 PolarHBondContact O-N 2.94Å; P254-L258 VanDerWaalsContact O-N 3.11Å |
| 255 | Y | 85.3 | Confident | 82.4 | Confident | 123 Ų | 123 | 45 Ų | 45 | 48% | 0.482 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -59.9 | -27.2 | 179.6 | -50.6 | -51.3 | 0 | 0 | 0 | 114.1 | V91 D253 P412 I413 | V91-Y255 HydrophobicContact CB-CD1 3.83Å; V91-Y255 HydrophobicContact CB-CE1 4.04Å; V91-Y255 HydrophobicContact CG1-CD1 3.91Å; V91-Y255 HydrophobicContact CG1-CE1 4.43Å; D253-Y255 PolarHBondContact O-N 3.36Å; D253-Y255 VanDerWaalsContact O-N 3.15Å; Y255-P412 HydrophobicContact CD1-CB 3.36Å; Y255-P412 HydrophobicContact CD1-CG 3.62Å; Y255-P412 HydrophobicContact CE1-CB 3.79Å; Y255-P412 HydrophobicContact CE1-CG 3.46Å; Y255-P412 VanDerWaalsContact CE1-CG 3.46Å; Y255-P412 HydrophobicContact CG-CB 3.91Å; Y255-P412 HydrophobicContact CG-CG 4.45Å; Y255-I413 WeakPolarHBondContact O-CD1 3.47Å |
| 256 | V | 86.1 | Confident | 83.2 | Confident | 64 Ų | 64 | 45 Ų | 45 | 39% | 0.388 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -110.7 | -43.4 | -177.3 | 179.2 | 0 | 0 | 0 | 0 | 110.8 | D253 P254 P259 R260 | D253-V256 PolarHBondContact O-N 3.17Å; D253-V256 VanDerWaalsContact O-N 3.14Å; P254-V256 PolarHBondContact O-N 3.27Å; P254-V256 VanDerWaalsContact O-N 3.15Å; V256-P259 WeakPolarHBondContact O-CD 3.44Å; V256-P259 WeakPolarHBondContact O-CG 3.23Å; V256-R260 WeakPolarHBondContact O-CB 3.27Å; V256-R260 WeakPolarHBondContact O-CD 3.23Å; V256-R260 VanDerWaalsContact O-CG 3.23Å; V256-R260 WeakPolarHBondContact O-CG 3.42Å; V256-R260 PolarHBondContact O-N 3.46Å |
| 257 | N | 86.7 | Confident | 84.4 | Confident | 22 Ų | 22 | 46.6 Ų | 46.6 | 12% | 0.118 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -78.4 | -30 | -173 | -71.7 | -27.3 | 0 | 0 | 0 | 113 | L35 L251 V252 D253 A261 | L35-N257 HydrophobicContact CB-CB 4.5Å; L35-N257 HydrophobicContact CD1-CB 4.15Å; L35-N257 WeakPolarHBondContact CD1-O 3.41Å; L251-N257 HydrophobicContact CD2-CB 4.41Å; V252-N257 PolarHBondContact O-ND2 2.81Å; D253-N257 PolarHBondContact O-N 3.44Å; N257-A261 WeakPolarHBondContact O-CB 3.35Å; N257-A261 PolarHBondContact O-N 3.07Å |
| 258 | L | 85.4 | Confident | 85.5 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.4 | -55.3 | 177.1 | -173.7 | 65.9 | 0 | 0 | 0 | 112.5 | A87 V91 L244 T248 L251 P254 R260 A261 I262 | A87-L258 HydrophobicContact CB-CD2 3.94Å; A87-L258 HydrophobicContact CB-CG 4.09Å; V91-L258 HydrophobicContact CG1-CD2 3.97Å; L244-L258 HydrophobicContact CB-CD1 4.36Å; L244-L258 HydrophobicContact CD2-CD1 3.51Å; L244-L258 HydrophobicContact CG-CD1 3.77Å; T248-L258 HydrophobicContact CG2-CD2 4.38Å; L251-L258 HydrophobicContact CD2-CB 3.9Å; L251-L258 HydrophobicContact CD2-CD1 4.22Å; P254-L258 WeakPolarHBondContact O-CB 3.5Å; P254-L258 PolarHBondContact O-N 2.94Å; P254-L258 VanDerWaalsContact O-N 3.11Å; L258-R260 PolarHBondContact O-N 3.11Å; L258-A261 PolarHBondContact O-N 2.99Å; L258-I262 HydrophobicContact CG-CD1 4.44Å; L258-I262 WeakPolarHBondContact O-CG1 3.41Å; L258-I262 PolarHBondContact O-N 2.84Å |
| 259 | P | 87.1 | Confident | 86.6 | Confident | 22 Ų | 22 | 49.6 Ų | 49.6 | 14% | 0.143 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -66 | -37.6 | 178.9 | 25.2 | -34.3 | 0 | 0 | 0 | 112.1 | V256 A261 I262 F263 I413 | V256-P259 WeakPolarHBondContact O-CD 3.44Å; V256-P259 WeakPolarHBondContact O-CG 3.23Å; P259-A261 PolarHBondContact O-N 3.47Å; P259-I262 PolarHBondContact O-N 3.12Å; P259-F263 WeakPolarHBondContact O-CD2 3.15Å; P259-F263 PolarHBondContact O-N 3.34Å; P259-I413 HydrophobicContact CB-CD1 4.47Å; P259-I413 HydrophobicContact CG-CD1 3.83Å |
| 260 | R | 89.4 | Confident | 87.7 | Confident | 142 Ų | 142 | 47.3 Ų | 47.3 | 54% | 0.536 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.7 | -42.9 | 176.3 | -74.5 | 178.1 | -179.8 | 179.2 | 0.6 | 111.9 | L35 V256 L258 I262 F263 I264 | L35-R260 HydrophobicContact CD1-CB 3.83Å; L35-R260 HydrophobicContact CD2-CB 4.49Å; V256-R260 WeakPolarHBondContact O-CB 3.27Å; V256-R260 WeakPolarHBondContact O-CD 3.23Å; V256-R260 VanDerWaalsContact O-CG 3.23Å; V256-R260 WeakPolarHBondContact O-CG 3.42Å; V256-R260 PolarHBondContact O-N 3.46Å; L258-R260 PolarHBondContact O-N 3.11Å; R260-I262 VanDerWaalsContact C-N 3.29Å; R260-I262 PolarHBondContact O-N 3.34Å; R260-F263 PolarHBondContact O-N 3.29Å; R260-I264 VanDerWaalsContact O-CG1 3.3Å; R260-I264 WeakPolarHBondContact O-CG1 3.28Å; R260-I264 PolarHBondContact O-N 3.09Å; R260-I264 VanDerWaalsContact O-N 3.09Å |
| 261 | A | 88.9 | Confident | 88.5 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61 | -41.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | L35 A38 I42 L244 N257 L258 P259 I264 S265 | L35-A261 HydrophobicContact CD1-CB 4.03Å; A38-A261 HydrophobicContact CB-CB 4.08Å; I42-A261 HydrophobicContact CD1-CB 3.75Å; L244-A261 HydrophobicContact CD2-CB 3.99Å; N257-A261 WeakPolarHBondContact O-CB 3.35Å; N257-A261 PolarHBondContact O-N 3.07Å; L258-A261 PolarHBondContact O-N 2.99Å; P259-A261 PolarHBondContact O-N 3.47Å; A261-I264 PolarHBondContact O-N 3.38Å; A261-S265 WeakPolarHBondContact O-CB 3.44Å; A261-S265 PolarHBondContact O-N 3.17Å; A261-S265 PolarHBondContact O-OG 3.26Å |
| 262 | I | 89.1 | Confident | 89.2 | Confident | 6 Ų | 6 | 51.6 Ų | 51.6 | 3% | 0.031 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.2 | -49.3 | 177.2 | -70.6 | 168.1 | 0 | 0 | 0 | 111.6 | I42 A83 L84 A87 L258 P259 R260 I264 S265 I266 | I42-I262 HydrophobicContact CD1-CG1 4.21Å; A83-I262 HydrophobicContact CB-CD1 4.15Å; A83-I262 HydrophobicContact CB-CG1 4.33Å; A83-I262 HydrophobicContact CB-CG2 3.66Å; L84-I262 HydrophobicContact CD2-CG2 4.25Å; L84-I262 HydrophobicContact CG-CG2 4.38Å; A87-I262 HydrophobicContact CB-CD1 3.65Å; L258-I262 HydrophobicContact CG-CD1 4.44Å; L258-I262 WeakPolarHBondContact O-CG1 3.41Å; L258-I262 PolarHBondContact O-N 2.84Å; P259-I262 PolarHBondContact O-N 3.12Å; R260-I262 VanDerWaalsContact C-N 3.29Å; R260-I262 PolarHBondContact O-N 3.34Å; I262-I264 VanDerWaalsContact C-N 3.25Å; I262-I264 PolarHBondContact O-N 2.95Å; I262-S265 PolarHBondContact O-N 3.3Å; I262-I266 HydrophobicContact CG2-CD1 3.7Å; I262-I266 PolarHBondContact O-N 3.02Å; I262-I266 VanDerWaalsContact O-N 3.12Å |
| 263 | F | 89.6 | Confident | 89.8 | Confident | 128 Ų | 128 | 49.1 Ų | 49.1 | 56% | 0.561 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -64.4 | -26.9 | -179.5 | -84 | -64.5 | 0 | 0 | 0 | 113.7 | L84 P259 R260 P267 | L84-F263 HydrophobicContact CD1-CE1 4.01Å; L84-F263 HydrophobicContact CD1-CE2 4.45Å; L84-F263 HydrophobicContact CD1-CZ 3.69Å; L84-F263 HydrophobicContact CD2-CD2 4.21Å; L84-F263 HydrophobicContact CD2-CE1 4.4Å; L84-F263 HydrophobicContact CD2-CE2 3.54Å; L84-F263 HydrophobicContact CD2-CZ 3.65Å; L84-F263 HydrophobicContact CG-CZ 4.29Å; P259-F263 WeakPolarHBondContact O-CD2 3.15Å; P259-F263 PolarHBondContact O-N 3.34Å; R260-F263 PolarHBondContact O-N 3.29Å; F263-P267 VanDerWaalsContact O-CD 3.23Å; F263-P267 WeakPolarHBondContact O-CD 3.45Å; F263-P267 VanDerWaalsContact O-CG 3.24Å; F263-P267 WeakPolarHBondContact O-CG 3.07Å |
| 264 | I | 91.2 | Very high | 90.3 | Very high | 93 Ų | 93 | 45.1 Ų | 45.1 | 48% | 0.477 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -84.7 | -46.6 | 176 | -65.2 | 166.9 | 0 | 0 | 0 | 110.2 | R260 A261 I262 L268 | R260-I264 VanDerWaalsContact O-CG1 3.3Å; R260-I264 WeakPolarHBondContact O-CG1 3.28Å; R260-I264 PolarHBondContact O-N 3.09Å; R260-I264 VanDerWaalsContact O-N 3.09Å; A261-I264 PolarHBondContact O-N 3.38Å; I262-I264 VanDerWaalsContact C-N 3.25Å; I262-I264 PolarHBondContact O-N 2.95Å; I264-L268 VanDerWaalsContact O-CB 3.31Å; I264-L268 WeakPolarHBondContact O-CB 3.32Å; I264-L268 PolarHBondContact O-N 3.46Å |
| 265 | S | 90.4 | Very high | 91 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -76 | -45.2 | -167.2 | -55.8 | 0 | 0 | 0 | 0 | 113.4 | C39 I42 A261 I262 L268 V269 | C39-S265 WeakPolarHBondContact CA-OG 3.04Å; I42-S265 VanDerWaalsContact CG2-CB 3.48Å; A261-S265 WeakPolarHBondContact O-CB 3.44Å; A261-S265 PolarHBondContact O-N 3.17Å; A261-S265 PolarHBondContact O-OG 3.26Å; I262-S265 PolarHBondContact O-N 3.3Å; S265-L268 WeakPolarHBondContact O-CB 3.15Å; S265-L268 PolarHBondContact O-N 3.22Å; S265-V269 VanDerWaalsContact O-CG2 3.31Å; S265-V269 WeakPolarHBondContact O-CG2 3.46Å; S265-V269 PolarHBondContact O-N 3.06Å |
| 266 | I | 92.5 | Very high | 91.4 | Very high | 2 Ų | 2 | 41.7 Ų | 41.7 | 1% | 0.01 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -69.2 | -43.5 | -173.9 | -62.2 | 173.9 | 0 | 0 | 0 | 112.3 | I46 T79 A80 A83 I262 L268 V269 T270 | I46-I266 HydrophobicContact CD1-CG1 4.33Å; T79-I266 HydrophobicContact CG2-CD1 4.23Å; T79-I266 HydrophobicContact CG2-CG2 4.26Å; A80-I266 HydrophobicContact CB-CB 4.44Å; A80-I266 HydrophobicContact CB-CD1 4.41Å; A80-I266 HydrophobicContact CB-CG2 3.92Å; A83-I266 HydrophobicContact CB-CD1 3.38Å; I262-I266 HydrophobicContact CG2-CD1 3.7Å; I262-I266 PolarHBondContact O-N 3.02Å; I262-I266 VanDerWaalsContact O-N 3.12Å; I266-L268 VanDerWaalsContact C-N 3.32Å; I266-L268 PolarHBondContact O-N 2.95Å; I266-V269 PolarHBondContact O-N 3.46Å; I266-T270 WeakPolarHBondContact O-CB 3.43Å; I266-T270 PolarHBondContact O-N 3.4Å; I266-T270 PolarHBondContact O-OG1 2.92Å |
| 267 | P | 93.9 | Very high | 91.8 | Very high | 68 Ų | 68 | 39 Ų | 39 | 44% | 0.442 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -62.9 | -38.1 | 173.2 | -26.5 | 38.7 | 0 | 0 | 0 | 112.7 | F263 T270 F271 | F263-P267 VanDerWaalsContact O-CD 3.23Å; F263-P267 WeakPolarHBondContact O-CD 3.45Å; F263-P267 VanDerWaalsContact O-CG 3.24Å; F263-P267 WeakPolarHBondContact O-CG 3.07Å; P267-T270 PolarHBondContact O-N 2.7Å; P267-F271 WeakPolarHBondContact O-CB 3.48Å; P267-F271 PolarHBondContact O-N 3.02Å |
| 268 | L | 92.6 | Very high | 92.2 | Very high | 86 Ų | 86 | 39.3 Ų | 39.3 | 45% | 0.45 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -60.8 | -46.3 | 175.3 | 179.6 | 68.6 | 0 | 0 | 0 | 111.5 | V43 I264 S265 I266 T270 F271 V272 | V43-L268 HydrophobicContact CG2-CD2 4.11Å; I264-L268 VanDerWaalsContact O-CB 3.31Å; I264-L268 WeakPolarHBondContact O-CB 3.32Å; I264-L268 PolarHBondContact O-N 3.46Å; S265-L268 WeakPolarHBondContact O-CB 3.15Å; S265-L268 PolarHBondContact O-N 3.22Å; I266-L268 VanDerWaalsContact C-N 3.32Å; I266-L268 PolarHBondContact O-N 2.95Å; L268-T270 VanDerWaalsContact C-N 3.32Å; L268-T270 PolarHBondContact O-N 3.02Å; L268-F271 WeakPolarHBondContact O-CB 3.43Å; L268-F271 PolarHBondContact O-N 3.07Å; L268-V272 WeakPolarHBondContact O-CG2 3.25Å; L268-V272 PolarHBondContact O-N 3.11Å |
| 269 | V | 93.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.6 | -43.6 | 175.5 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | V43 I46 I47 Y238 S265 I266 F271 V272 Y273 | V43-V269 HydrophobicContact CG1-CG2 4.38Å; V43-V269 HydrophobicContact CG2-CG2 4.3Å; I46-V269 HydrophobicContact CB-CG1 4.5Å; I46-V269 HydrophobicContact CB-CG2 4.31Å; I46-V269 HydrophobicContact CD1-CG2 4.49Å; I46-V269 HydrophobicContact CG2-CG1 3.66Å; I46-V269 HydrophobicContact CG2-CG2 4.33Å; I47-V269 HydrophobicContact CD1-CG2 4.19Å; I47-V269 HydrophobicContact CG1-CG1 4.26Å; I47-V269 HydrophobicContact CG1-CG2 3.9Å; Y238-V269 HydrophobicContact CD1-CG1 4.22Å; Y238-V269 HydrophobicContact CE1-CG1 4Å; S265-V269 VanDerWaalsContact O-CG2 3.31Å; S265-V269 WeakPolarHBondContact O-CG2 3.46Å; S265-V269 PolarHBondContact O-N 3.06Å; I266-V269 PolarHBondContact O-N 3.46Å; V269-F271 VanDerWaalsContact C-N 3.3Å; V269-F271 PolarHBondContact O-N 2.94Å; V269-V272 PolarHBondContact O-N 3.41Å; V269-Y273 HydrophobicContact CG1-CD1 4.23Å; V269-Y273 HydrophobicContact CG1-CD2 3.78Å; V269-Y273 HydrophobicContact CG1-CE1 3.95Å; V269-Y273 HydrophobicContact CG1-CE2 3.48Å; V269-Y273 VanDerWaalsContact CG1-CE2 3.48Å; V269-Y273 HydrophobicContact CG1-CG 4.17Å; V269-Y273 WeakPolarHBondContact O-CB 3.18Å; V269-Y273 PolarHBondContact O-N 3.06Å |
| 270 | T | 94.9 | Very high | 92.9 | Very high | 20 Ų | 20 | 38.3 Ų | 38.3 | 12% | 0.123 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60.6 | -42.8 | 178.9 | -57.1 | 0 | 0 | 0 | 0 | 111.7 | G76 Y238 I266 P267 L268 Y273 V274 | G76-T270 WeakPolarHBondContact CA-OG1 3.46Å; Y238-T270 WeakPolarHBondContact CE1-OG1 3.36Å; Y238-T270 VanDerWaalsContact OH-CA 3.3Å; Y238-T270 WeakPolarHBondContact OH-CA 3.46Å; Y238-T270 WeakPolarHBondContact OH-CG2 3.47Å; Y238-T270 PolarHBondContact OH-OG1 3.26Å; I266-T270 WeakPolarHBondContact O-CB 3.43Å; I266-T270 PolarHBondContact O-N 3.4Å; I266-T270 PolarHBondContact O-OG1 2.92Å; P267-T270 PolarHBondContact O-N 2.7Å; L268-T270 VanDerWaalsContact C-N 3.32Å; L268-T270 PolarHBondContact O-N 3.02Å; T270-Y273 PolarHBondContact O-N 3.14Å; T270-V274 HydrophobicContact CG2-CG2 4.45Å; T270-V274 WeakPolarHBondContact O-CB 3.4Å; T270-V274 VanDerWaalsContact O-CG2 3.27Å; T270-V274 WeakPolarHBondContact O-CG2 3.44Å; T270-V274 PolarHBondContact O-N 3.26Å |
| 271 | F | 94.5 | Very high | 93.1 | Very high | 115 Ų | 115 | 31.8 Ų | 31.8 | 50% | 0.504 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -57.7 | -55.6 | 172.4 | -175.3 | -87 | 0 | 0 | 0 | 110.3 | P267 L268 V269 Y273 V274 F275 | P267-F271 WeakPolarHBondContact O-CB 3.48Å; P267-F271 PolarHBondContact O-N 3.02Å; L268-F271 WeakPolarHBondContact O-CB 3.43Å; L268-F271 PolarHBondContact O-N 3.07Å; V269-F271 VanDerWaalsContact C-N 3.3Å; V269-F271 PolarHBondContact O-N 2.94Å; F271-Y273 VanDerWaalsContact C-N 3.27Å; F271-Y273 PolarHBondContact O-N 3.43Å; F271-V274 PolarHBondContact O-N 3.42Å; F271-F275 AromaticContact CD1-CD2 3.62Å; F271-F275 HydrophobicContact CD1-CD2 3.62Å; F271-F275 AromaticContact CD1-CE2 3.99Å; F271-F275 HydrophobicContact CD1-CE2 3.99Å; F271-F275 HydrophobicContact CD1-CG 4.49Å; F271-F275 AromaticContact CD2-CD2 3.8Å; F271-F275 HydrophobicContact CD2-CD2 3.8Å; F271-F275 AromaticContact CD2-CE2 3.39Å; F271-F275 HydrophobicContact CD2-CE2 3.39Å; F271-F275 HydrophobicContact CD2-CZ 4.43Å; F271-F275 AromaticContact CE1-CD2 3.48Å; F271-F275 HydrophobicContact CE1-CD2 3.48Å; F271-F275 VanDerWaalsContact CE1-CD2 3.48Å; F271-F275 AromaticContact CE1-CE2 3.63Å; F271-F275 HydrophobicContact CE1-CE2 3.63Å; F271-F275 HydrophobicContact CE1-CG 4.16Å; F271-F275 HydrophobicContact CE1-CZ 4.33Å; F271-F275 AromaticContact CE2-CD2 3.7Å; F271-F275 HydrophobicContact CE2-CD2 3.7Å; F271-F275 AromaticContact CE2-CE2 3Å; F271-F275 HydrophobicContact CE2-CE2 3Å; F271-F275 AromaticContact CE2-CZ 3.66Å; F271-F275 HydrophobicContact CE2-CZ 3.66Å; F271-F275 AromaticContact CG-CD2 3.77Å; F271-F275 HydrophobicContact CG-CD2 3.77Å; F271-F275 AromaticContact CG-CE2 3.87Å; F271-F275 HydrophobicContact CG-CE2 3.87Å; F271-F275 AromaticContact CZ-CD2 3.52Å; F271-F275 HydrophobicContact CZ-CD2 3.52Å; F271-F275 HydrophobicContact CZ-CE1 4.38Å; F271-F275 AromaticContact CZ-CE2 3.12Å; F271-F275 HydrophobicContact CZ-CE2 3.12Å; F271-F275 HydrophobicContact CZ-CG 4.35Å; F271-F275 AromaticContact CZ-CZ 3.58Å; F271-F275 HydrophobicContact CZ-CZ 3.58Å; F271-F275 VanDerWaalsContact O-CD2 3.24Å; F271-F275 WeakPolarHBondContact O-CD2 3.36Å; F271-F275 PolarHBondContact O-N 2.89Å |
| 272 | V | 93.8 | Very high | 93.2 | Very high | 23 Ų | 23 | 32.5 Ų | 32.5 | 14% | 0.139 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -54.2 | -43.4 | 179.9 | 170.1 | 0 | 0 | 0 | 0 | 112.1 | I47 L191 I195 L268 V269 A276 | I47-V272 HydrophobicContact CD1-CG1 4.31Å; L191-V272 HydrophobicContact CB-CG1 4.48Å; L191-V272 HydrophobicContact CD1-CG1 4.04Å; I195-V272 HydrophobicContact CD1-CG1 4.13Å; L268-V272 WeakPolarHBondContact O-CG2 3.25Å; L268-V272 PolarHBondContact O-N 3.11Å; V269-V272 PolarHBondContact O-N 3.41Å; V272-A276 VanDerWaalsContact O-CB 3.27Å; V272-A276 WeakPolarHBondContact O-CB 3.4Å; V272-A276 PolarHBondContact O-N 3.14Å |
| 273 | Y | 95 | Very high | 93.3 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69 | -43.6 | -179.4 | -71.2 | -4.1 | 0 | 0 | 0 | 112.9 | I46 I47 I51 W72 A237 Y238 V269 T270 F271 A276 N277 | I46-Y273 HydrophobicContact CG2-CE2 4.45Å; I46-Y273 PolarHBondContact O-OH 3.39Å; I47-Y273 WeakPolarHBondContact CA-OH 3.37Å; I47-Y273 HydrophobicContact CG1-CE1 4.18Å; I51-Y273 HydrophobicContact CB-CD1 4.07Å; I51-Y273 HydrophobicContact CB-CE1 3.76Å; I51-Y273 HydrophobicContact CD1-CD1 3.62Å; I51-Y273 HydrophobicContact CD1-CE1 4.19Å; I51-Y273 HydrophobicContact CD1-CG 3.81Å; I51-Y273 HydrophobicContact CG1-CD1 3.71Å; I51-Y273 HydrophobicContact CG1-CE1 3.95Å; I51-Y273 HydrophobicContact CG1-CG 4.42Å; I51-Y273 HydrophobicContact CG2-CE1 4.36Å; W72-Y273 AromaticContact CE3-CD2 3.84Å; W72-Y273 HydrophobicContact CE3-CD2 3.84Å; W72-Y273 HydrophobicContact CE3-CG 4.2Å; W72-Y273 HydrophobicContact CH2-CD2 4.49Å; W72-Y273 AromaticContact CZ3-CD2 3.42Å; W72-Y273 HydrophobicContact CZ3-CD2 3.42Å; W72-Y273 VanDerWaalsContact CZ3-CD2 3.42Å; W72-Y273 HydrophobicContact CZ3-CE2 4.07Å; W72-Y273 AromaticContact CZ3-CG 3.91Å; W72-Y273 HydrophobicContact CZ3-CG 3.91Å; A237-Y273 HydrophobicContact CB-CE2 4.08Å; A237-Y273 VanDerWaalsContact O-CE2 3.27Å; A237-Y273 WeakPolarHBondContact O-CE2 3.32Å; A237-Y273 PolarHBondContact O-OH 3.03Å; Y238-Y273 HydrophobicContact CD1-CD2 4.34Å; Y238-Y273 HydrophobicContact CD1-CE2 4.2Å; Y238-Y273 HydrophobicContact CD2-CD2 4.19Å; Y238-Y273 HydrophobicContact CD2-CE2 4.25Å; Y238-Y273 AromaticContact CE1-CD2 3.87Å; Y238-Y273 HydrophobicContact CE1-CD2 3.87Å; Y238-Y273 HydrophobicContact CE1-CE2 4.17Å; Y238-Y273 AromaticContact CE2-CD2 3.73Å; Y238-Y273 HydrophobicContact CE2-CD2 3.73Å; Y238-Y273 HydrophobicContact CE2-CE2 4.25Å; Y238-Y273 HydrophobicContact CG-CD2 4.49Å; Y238-Y273 HydrophobicContact CG-CE2 4.24Å; Y238-Y273 AromaticContact CZ-CD2 3.55Å; V269-Y273 HydrophobicContact CG1-CD1 4.23Å; V269-Y273 HydrophobicContact CG1-CD2 3.78Å; V269-Y273 HydrophobicContact CG1-CE1 3.95Å; V269-Y273 HydrophobicContact CG1-CE2 3.48Å; V269-Y273 VanDerWaalsContact CG1-CE2 3.48Å; V269-Y273 HydrophobicContact CG1-CG 4.17Å; V269-Y273 WeakPolarHBondContact O-CB 3.18Å; V269-Y273 PolarHBondContact O-N 3.06Å; T270-Y273 PolarHBondContact O-N 3.14Å; F271-Y273 VanDerWaalsContact C-N 3.27Å; F271-Y273 PolarHBondContact O-N 3.43Å; Y273-A276 PolarHBondContact O-N 3.44Å; Y273-N277 PolarHBondContact O-N 3.09Å; Y273-N277 PolarHBondContact O-ND2 3.37Å |
| 274 | V | 95.5 | Very high | 93.3 | Very high | 19 Ų | 19 | 26.9 Ų | 26.9 | 12% | 0.115 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63 | -46.7 | 176.4 | 171.8 | 0 | 0 | 0 | 0 | 110.3 | W72 I73 T270 F271 A276 N277 I278 | W72-V274 HydrophobicContact CB-CG2 4.1Å; I73-V274 HydrophobicContact CG1-CG2 3.71Å; T270-V274 HydrophobicContact CG2-CG2 4.45Å; T270-V274 WeakPolarHBondContact O-CB 3.4Å; T270-V274 VanDerWaalsContact O-CG2 3.27Å; T270-V274 WeakPolarHBondContact O-CG2 3.44Å; T270-V274 PolarHBondContact O-N 3.26Å; F271-V274 PolarHBondContact O-N 3.42Å; V274-A276 VanDerWaalsContact C-N 3.35Å; V274-A276 PolarHBondContact O-N 2.91Å; V274-N277 PolarHBondContact O-N 3.46Å; V274-I278 HydrophobicContact CG1-CD1 3.82Å; V274-I278 HydrophobicContact CG1-CG1 4.42Å; V274-I278 VanDerWaalsContact O-CG1 3.28Å; V274-I278 WeakPolarHBondContact O-CG1 3.31Å; V274-I278 PolarHBondContact O-N 2.96Å |
| 275 | F | 95.1 | Very high | 93.3 | Very high | 66 Ų | 66 | 24 Ų | 24 | 29% | 0.289 | 13% | 0.13 | S | C | . | . | H | α-helix | trans | -65 | -36 | 178.5 | -83.3 | -85.1 | 0 | 0 | 0 | 113.1 | I195 F271 I278 A279 | I195-F275 HydrophobicContact CD1-CB 4.31Å; I195-F275 HydrophobicContact CG1-CB 4.14Å; I195-F275 HydrophobicContact CG2-CB 4.31Å; F271-F275 AromaticContact CD1-CD2 3.62Å; F271-F275 HydrophobicContact CD1-CD2 3.62Å; F271-F275 AromaticContact CD1-CE2 3.99Å; F271-F275 HydrophobicContact CD1-CE2 3.99Å; F271-F275 HydrophobicContact CD1-CG 4.49Å; F271-F275 AromaticContact CD2-CD2 3.8Å; F271-F275 HydrophobicContact CD2-CD2 3.8Å; F271-F275 AromaticContact CD2-CE2 3.39Å; F271-F275 HydrophobicContact CD2-CE2 3.39Å; F271-F275 HydrophobicContact CD2-CZ 4.43Å; F271-F275 AromaticContact CE1-CD2 3.48Å; F271-F275 HydrophobicContact CE1-CD2 3.48Å; F271-F275 VanDerWaalsContact CE1-CD2 3.48Å; F271-F275 AromaticContact CE1-CE2 3.63Å; F271-F275 HydrophobicContact CE1-CE2 3.63Å; F271-F275 HydrophobicContact CE1-CG 4.16Å; F271-F275 HydrophobicContact CE1-CZ 4.33Å; F271-F275 AromaticContact CE2-CD2 3.7Å; F271-F275 HydrophobicContact CE2-CD2 3.7Å; F271-F275 AromaticContact CE2-CE2 3Å; F271-F275 HydrophobicContact CE2-CE2 3Å; F271-F275 AromaticContact CE2-CZ 3.66Å; F271-F275 HydrophobicContact CE2-CZ 3.66Å; F271-F275 AromaticContact CG-CD2 3.77Å; F271-F275 HydrophobicContact CG-CD2 3.77Å; F271-F275 AromaticContact CG-CE2 3.87Å; F271-F275 HydrophobicContact CG-CE2 3.87Å; F271-F275 AromaticContact CZ-CD2 3.52Å; F271-F275 HydrophobicContact CZ-CD2 3.52Å; F271-F275 HydrophobicContact CZ-CE1 4.38Å; F271-F275 AromaticContact CZ-CE2 3.12Å; F271-F275 HydrophobicContact CZ-CE2 3.12Å; F271-F275 HydrophobicContact CZ-CG 4.35Å; F271-F275 AromaticContact CZ-CZ 3.58Å; F271-F275 HydrophobicContact CZ-CZ 3.58Å; F271-F275 VanDerWaalsContact O-CD2 3.24Å; F271-F275 WeakPolarHBondContact O-CD2 3.36Å; F271-F275 PolarHBondContact O-N 2.89Å; F275-I278 PolarHBondContact O-N 2.92Å; F275-A279 WeakPolarHBondContact O-CB 3.09Å; F275-A279 PolarHBondContact O-N 3.45Å |
| 276 | A | 94.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -65.6 | -42.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112 | I51 L191 I194 V272 Y273 V274 A279 Y280 | I51-A276 HydrophobicContact CD1-CB 4.39Å; I51-A276 HydrophobicContact CG1-CB 4.3Å; L191-A276 HydrophobicContact CD2-CB 4.44Å; I194-A276 HydrophobicContact CG2-CB 4.39Å; V272-A276 VanDerWaalsContact O-CB 3.27Å; V272-A276 WeakPolarHBondContact O-CB 3.4Å; V272-A276 PolarHBondContact O-N 3.14Å; Y273-A276 PolarHBondContact O-N 3.44Å; V274-A276 VanDerWaalsContact C-N 3.35Å; V274-A276 PolarHBondContact O-N 2.91Å; A276-A279 WeakPolarHBondContact O-CB 3.33Å; A276-A279 PolarHBondContact O-N 3.16Å; A276-Y280 WeakPolarHBondContact O-CD2 3.35Å; A276-Y280 PolarHBondContact O-N 3.5Å |
| 277 | N | 95 | Very high | 93.2 | Very high | 6 Ų | 6 | 28.6 Ų | 28.6 | 3% | 0.032 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -66.7 | -39.4 | 176.5 | -79.9 | -85.6 | 0 | 0 | 0 | 112.1 | P55 L69 W72 Y273 V274 A279 Y280 V281 | P55-N277 WeakPolarHBondContact CB-OD1 3.39Å; L69-N277 HydrophobicContact CD2-CB 3.82Å; W72-N277 VanDerWaalsContact NE1-CG 3.34Å; W72-N277 PolarHBondContact NE1-ND2 3.24Å; W72-N277 PolarHBondContact NE1-OD1 3.49Å; Y273-N277 PolarHBondContact O-N 3.09Å; Y273-N277 PolarHBondContact O-ND2 3.37Å; V274-N277 PolarHBondContact O-N 3.46Å; N277-A279 VanDerWaalsContact C-N 3.31Å; N277-A279 PolarHBondContact O-N 2.99Å; N277-Y280 PolarHBondContact O-N 3.07Å; N277-V281 PolarHBondContact O-N 3.06Å; N277-V281 VanDerWaalsContact O-N 3.16Å |
| 278 | I | 94.4 | Very high | 93 | Very high | 30 Ų | 30 | 28.4 Ų | 28.4 | 15% | 0.154 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -57 | -47.5 | 171.2 | -71.3 | 170.7 | 0 | 0 | 0 | 109.9 | L69 I202 L210 V274 F275 Y280 V281 T282 | L69-I278 HydrophobicContact CD1-CG1 4.15Å; L69-I278 HydrophobicContact CD2-CG1 4.03Å; I202-I278 HydrophobicContact CD1-CG2 3.89Å; L210-I278 HydrophobicContact CD1-CG2 3.78Å; L210-I278 HydrophobicContact CD2-CG1 4.27Å; L210-I278 HydrophobicContact CD2-CG2 4.28Å; V274-I278 HydrophobicContact CG1-CD1 3.82Å; V274-I278 HydrophobicContact CG1-CG1 4.42Å; V274-I278 VanDerWaalsContact O-CG1 3.28Å; V274-I278 WeakPolarHBondContact O-CG1 3.31Å; V274-I278 PolarHBondContact O-N 2.96Å; F275-I278 PolarHBondContact O-N 2.92Å; I278-Y280 VanDerWaalsContact C-N 3.3Å; I278-Y280 PolarHBondContact O-N 3.27Å; I278-V281 VanDerWaalsContact O-CG2 3.25Å; I278-V281 WeakPolarHBondContact O-CG2 3.48Å; I278-V281 PolarHBondContact O-N 2.86Å; I278-T282 WeakPolarHBondContact O-CG2 3.48Å; I278-T282 PolarHBondContact O-N 3Å; I278-T282 VanDerWaalsContact O-N 3.1Å |
| 279 | A | 94.4 | Very high | 93 | Very high | 1 Ų | 1 | 24.4 Ų | 24.4 | 1% | 0.008 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.1 | -36.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113 | I194 F275 A276 N277 T282 A283 F299 | I194-A279 HydrophobicContact CG2-CB 3.7Å; I194-A279 WeakPolarHBondContact O-CB 2.89Å; F275-A279 WeakPolarHBondContact O-CB 3.09Å; F275-A279 PolarHBondContact O-N 3.45Å; A276-A279 WeakPolarHBondContact O-CB 3.33Å; A276-A279 PolarHBondContact O-N 3.16Å; N277-A279 VanDerWaalsContact C-N 3.31Å; N277-A279 PolarHBondContact O-N 2.99Å; A279-T282 PolarHBondContact O-OG1 3.27Å; A279-A283 WeakPolarHBondContact O-CB 3.48Å; A279-A283 PolarHBondContact O-N 3.45Å; A279-F299 HydrophobicContact CB-CE2 4.17Å; A279-F299 WeakPolarHBondContact O-CE2 3.45Å |
| 280 | Y | 93.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -63.7 | -45.3 | 175.8 | -64.6 | -37.8 | 0 | 0 | 0 | 111.8 | P55 I194 A276 N277 I278 T282 A283 M284 V295 A296 F299 | P55-Y280 HydrophobicContact CB-CD2 4.22Å; P55-Y280 HydrophobicContact CB-CE2 4.37Å; P55-Y280 HydrophobicContact CG-CD2 4.18Å; P55-Y280 HydrophobicContact CG-CE2 3.86Å; I194-Y280 HydrophobicContact CD1-CE1 4.1Å; I194-Y280 HydrophobicContact CG1-CE1 4.5Å; I194-Y280 HydrophobicContact CG2-CD1 4.42Å; I194-Y280 HydrophobicContact CG2-CE1 3.99Å; A276-Y280 WeakPolarHBondContact O-CD2 3.35Å; A276-Y280 PolarHBondContact O-N 3.5Å; N277-Y280 PolarHBondContact O-N 3.07Å; I278-Y280 VanDerWaalsContact C-N 3.3Å; I278-Y280 PolarHBondContact O-N 3.27Å; Y280-T282 PolarHBondContact O-N 3.4Å; Y280-A283 PolarHBondContact O-N 3.16Å; Y280-M284 WeakPolarHBondContact O-CG 3.38Å; Y280-M284 PolarHBondContact O-N 3.31Å; Y280-M284 VanDerWaalsContact O-N 3.12Å; Y280-V295 HydrophobicContact CD1-CG1 3.96Å; Y280-V295 HydrophobicContact CD2-CG1 4Å; Y280-V295 HydrophobicContact CE1-CG1 4.24Å; Y280-V295 HydrophobicContact CE2-CG1 4.28Å; Y280-V295 HydrophobicContact CG-CG1 3.84Å; Y280-A296 HydrophobicContact CE1-CB 4.21Å; Y280-F299 HydrophobicContact CD1-CB 4.17Å; Y280-F299 AromaticContact CD1-CD2 3.94Å; Y280-F299 HydrophobicContact CD1-CD2 3.94Å; Y280-F299 HydrophobicContact CD1-CG 4.2Å; Y280-F299 HydrophobicContact CE1-CB 4.31Å; Y280-F299 HydrophobicContact CE1-CG 4.39Å |
| 281 | V | 93 | Very high | 92.6 | Very high | 5 Ų | 5 | 29.4 Ų | 29.4 | 3% | 0.03 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -76.9 | -17.4 | -177.1 | -57.8 | 0 | 0 | 0 | 0 | 114.4 | M59 V65 L210 N277 I278 | M59-V281 HydrophobicContact CE-CG1 3.85Å; V65-V281 HydrophobicContact CG1-CB 4.23Å; V65-V281 HydrophobicContact CG1-CG1 3.93Å; V65-V281 HydrophobicContact CG1-CG2 4.1Å; L210-V281 HydrophobicContact CD2-CG2 3.59Å; L210-V281 HydrophobicContact CG-CG2 4.02Å; N277-V281 PolarHBondContact O-N 3.06Å; N277-V281 VanDerWaalsContact O-N 3.16Å; I278-V281 VanDerWaalsContact O-CG2 3.25Å; I278-V281 WeakPolarHBondContact O-CG2 3.48Å; I278-V281 PolarHBondContact O-N 2.86Å |
| 282 | T | 92 | Very high | 92.2 | Very high | 15 Ų | 15 | 24.3 Ų | 24.3 | 9% | 0.092 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -76.2 | -27.1 | 168 | 58.2 | 0 | 0 | 0 | 0 | 112 | Q201 I202 D206 L210 I278 A279 Y280 | Q201-T282 PolarHBondContact NE2-O 3.29Å; Q201-T282 VanDerWaalsContact OE1-CB 3.25Å; Q201-T282 PolarHBondContact OE1-O 3.41Å; Q201-T282 VanDerWaalsContact OE1-O 3.14Å; Q201-T282 PolarHBondContact OE1-OG1 2.84Å; I202-T282 HydrophobicContact CG1-CG2 3.94Å; D206-T282 VanDerWaalsContact O-CB 3.32Å; D206-T282 WeakPolarHBondContact O-CB 3.2Å; D206-T282 WeakPolarHBondContact O-CG2 3.48Å; L210-T282 HydrophobicContact CD1-CG2 3.49Å; L210-T282 VanDerWaalsContact CD1-CG2 3.49Å; L210-T282 HydrophobicContact CG-CG2 4.47Å; I278-T282 WeakPolarHBondContact O-CG2 3.48Å; I278-T282 PolarHBondContact O-N 3Å; I278-T282 VanDerWaalsContact O-N 3.1Å; A279-T282 PolarHBondContact O-OG1 3.27Å; Y280-T282 PolarHBondContact O-N 3.4Å |
| 283 | A | 90.6 | Very high | 91.7 | Very high | 11 Ų | 11 | 25.5 Ų | 25.5 | 9% | 0.091 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -86.7 | -33.8 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q201 A279 Y280 F299 K302 L303 | Q201-A283 VanDerWaalsContact OE1-CA 3.24Å; A279-A283 WeakPolarHBondContact O-CB 3.48Å; A279-A283 PolarHBondContact O-N 3.45Å; Y280-A283 PolarHBondContact O-N 3.16Å; A283-F299 HydrophobicContact CB-CD2 3.4Å; A283-F299 HydrophobicContact CB-CE2 3.7Å; A283-F299 HydrophobicContact CB-CG 4.45Å; A283-K302 WeakPolarHBondContact O-CD 3.38Å; A283-L303 HydrophobicContact CB-CD1 3.62Å; A283-L303 HydrophobicContact CB-CG 4.28Å |
| 284 | M | 90.2 | Very high | 91.3 | Very high | 5 Ų | 5 | 25.5 Ų | 25.5 | 3% | 0.025 | 14% | 0.144 | C | C | . | . | S | Bend | trans | -142.4 | 158.7 | -174.6 | 68 | -168.5 | 74.3 | 0 | 0 | 112.2 | Y280 E288 L289 V295 T298 F299 K302 | Y280-M284 WeakPolarHBondContact O-CG 3.38Å; Y280-M284 PolarHBondContact O-N 3.31Å; Y280-M284 VanDerWaalsContact O-N 3.12Å; M284-E288 HydrophobicContact CB-CB 4.38Å; M284-E288 HydrophobicContact CB-CG 4.26Å; M284-L289 HydrophobicContact CG-CB 4.14Å; M284-L289 HydrophobicContact SD-CB 3.96Å; M284-L289 HydrophobicContact SD-CG 4.37Å; M284-V295 HydrophobicContact CE-CG1 4.43Å; M284-V295 HydrophobicContact SD-CG1 4.32Å; M284-T298 HydrophobicContact CE-CG2 4.04Å; M284-T298 HydrophobicContact SD-CG2 4.2Å; M284-F299 HydrophobicContact CE-CB 3.83Å; M284-K302 HydrophobicContact CB-CD 4.34Å |
| 285 | S | 91.4 | Very high | 91.1 | Very high | 32 Ų | 32 | 24.7 Ų | 24.7 | 22% | 0.224 | 14% | 0.139 | C | C | . | . | trans | -71.2 | 155.9 | 174.6 | 66.1 | 0 | 0 | 0 | 0 | 111.3 | Q287 E288 L289 | S285-Q287 VanDerWaalsContact C-N 3.27Å; S285-Q287 PolarHBondContact O-N 3.23Å; S285-E288 WeakPolarHBondContact O-CB 3.48Å; S285-E288 PolarHBondContact O-N 3.16Å; S285-E288 VanDerWaalsContact O-N 3.15Å; S285-E288 VanDerWaalsContact OG-CB 3.25Å; S285-E288 WeakPolarHBondContact OG-CB 3.34Å; S285-E288 PolarHBondContact OG-N 3.47Å; S285-L289 PolarHBondContact O-N 3.27Å | ||
| 286 | P | 89.6 | Confident | 90.8 | Very high | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -56 | -40.1 | 175.3 | -27.1 | 36.9 | 0 | 0 | 0 | 113 | V65 W209 F219 E288 L289 L290 | V65-P286 HydrophobicContact CG2-CB 4.26Å; V65-P286 HydrophobicContact CG2-CG 3.53Å; W209-P286 HydrophobicContact CD2-CG 4.07Å; W209-P286 HydrophobicContact CE3-CG 3.99Å; W209-P286 HydrophobicContact CG-CG 4.48Å; W209-P286 HydrophobicContact CZ3-CG 4.38Å; F219-P286 HydrophobicContact CE1-CB 4.14Å; F219-P286 HydrophobicContact CE1-CG 4.25Å; F219-P286 HydrophobicContact CE2-CB 3.6Å; F219-P286 HydrophobicContact CE2-CG 4.19Å; F219-P286 HydrophobicContact CZ-CB 3.37Å; F219-P286 HydrophobicContact CZ-CG 3.52Å; P286-E288 VanDerWaalsContact C-N 3.32Å; P286-E288 PolarHBondContact O-N 3.33Å; P286-L289 WeakPolarHBondContact O-CB 3.48Å; P286-L289 PolarHBondContact O-N 3.17Å; P286-L290 VanDerWaalsContact O-CG 3.29Å; P286-L290 WeakPolarHBondContact O-CG 3.22Å; P286-L290 PolarHBondContact O-N 3.4Å |
| 287 | Q | 89.9 | Confident | 90.6 | Very high | 99 Ų | 99 | 21.6 Ų | 21.6 | 46% | 0.463 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -65 | -37.6 | 178.8 | -63.3 | 79.7 | 3.3 | 0 | 0 | 111.8 | S285 L290 A291 | S285-Q287 VanDerWaalsContact C-N 3.27Å; S285-Q287 PolarHBondContact O-N 3.23Å; Q287-L290 PolarHBondContact O-N 3.4Å; Q287-A291 WeakPolarHBondContact O-CB 3.35Å; Q287-A291 PolarHBondContact O-N 3.27Å |
| 288 | E | 90.6 | Very high | 90.3 | Very high | 64 Ų | 64 | 22 Ų | 22 | 30% | 0.299 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -72.4 | -36.2 | 177.2 | -174.3 | 174.2 | -166.7 | 0 | 0 | 112.5 | M284 S285 P286 L290 A291 S292 K302 | M284-E288 HydrophobicContact CB-CB 4.38Å; M284-E288 HydrophobicContact CB-CG 4.26Å; S285-E288 WeakPolarHBondContact O-CB 3.48Å; S285-E288 PolarHBondContact O-N 3.16Å; S285-E288 VanDerWaalsContact O-N 3.15Å; S285-E288 VanDerWaalsContact OG-CB 3.25Å; S285-E288 WeakPolarHBondContact OG-CB 3.34Å; S285-E288 PolarHBondContact OG-N 3.47Å; P286-E288 VanDerWaalsContact C-N 3.32Å; P286-E288 PolarHBondContact O-N 3.33Å; E288-L290 VanDerWaalsContact C-N 3.3Å; E288-L290 PolarHBondContact O-N 3.03Å; E288-A291 PolarHBondContact O-N 3.27Å; E288-S292 PolarHBondContact O-N 3.39Å; E288-K302 VanDerWaalsContact CD-CE 3.42Å; E288-K302 WeakPolarHBondContact OE1-CE 3.42Å; E288-K302 IonicContact OE1-NZ 2.9Å; E288-K302 PolarHBondContact OE1-NZ 3Å; E288-K302 WeakPolarHBondContact OE2-CE 3.26Å; E288-K302 IonicContact OE2-NZ 2.6Å; E288-K302 PolarHBondContact OE2-NZ 3.41Å |
| 289 | L | 91.4 | Very high | 90.1 | Very high | 2 Ų | 2 | 20.6 Ų | 20.6 | 1% | 0.01 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -60.6 | -42.4 | 171.8 | -173.5 | 152.4 | 0 | 0 | 0 | 111 | K56 M59 M284 S285 P286 S292 V295 | K56-L289 HydrophobicContact CB-CD2 4.3Å; M59-L289 HydrophobicContact CB-CD2 3.97Å; M59-L289 HydrophobicContact CG-CD2 4.25Å; M284-L289 HydrophobicContact CG-CB 4.14Å; M284-L289 HydrophobicContact SD-CB 3.96Å; M284-L289 HydrophobicContact SD-CG 4.37Å; S285-L289 PolarHBondContact O-N 3.27Å; P286-L289 WeakPolarHBondContact O-CB 3.48Å; P286-L289 PolarHBondContact O-N 3.17Å; L289-S292 PolarHBondContact O-N 3.35Å; L289-V295 HydrophobicContact CD1-CG1 4.07Å; L289-V295 HydrophobicContact CD2-CG2 4.43Å; L289-V295 HydrophobicContact CG-CG1 4.01Å; L289-V295 HydrophobicContact CG-CG2 4.21Å |
| 290 | L | 90.6 | Very high | 89.9 | Confident | 49 Ų | 49 | 20.6 Ų | 20.6 | 26% | 0.257 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -69 | -35.2 | 177 | -66.6 | 174.6 | 0 | 0 | 0 | 112.6 | K56 M59 E60 P286 Q287 E288 S292 | K56-L290 WeakPolarHBondContact CE-O 3.5Å; K56-L290 PolarHBondContact NZ-O 3.23Å; K56-L290 WeakPolarHBondContact O-CD2 3.41Å; M59-L290 HydrophobicContact CB-CD2 4.08Å; M59-L290 HydrophobicContact CG-CD2 4.19Å; M59-L290 HydrophobicContact CG-CG 4.43Å; E60-L290 HydrophobicContact CB-CD2 3.68Å; E60-L290 HydrophobicContact CG-CD2 4.38Å; P286-L290 VanDerWaalsContact O-CG 3.29Å; P286-L290 WeakPolarHBondContact O-CG 3.22Å; P286-L290 PolarHBondContact O-N 3.4Å; Q287-L290 PolarHBondContact O-N 3.4Å; E288-L290 VanDerWaalsContact C-N 3.3Å; E288-L290 PolarHBondContact O-N 3.03Å; L290-S292 VanDerWaalsContact C-N 3.33Å |
| 291 | A | 89.2 | Confident | 89.6 | Confident | 76 Ų | 76 | 24.4 Ų | 24.4 | 63% | 0.628 | 14% | 0.139 | S | C | * | . | H | α-helix | trans | -71.5 | -26.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | Q287 E288 | Q287-A291 WeakPolarHBondContact O-CB 3.35Å; Q287-A291 PolarHBondContact O-N 3.27Å; E288-A291 PolarHBondContact O-N 3.27Å |
| 292 | S | 87.3 | Confident | 89.3 | Confident | 7 Ų | 7 | 28.8 Ų | 28.8 | 5% | 0.049 | 16% | 0.157 | C | C | . | . | trans | -74.5 | 140.9 | -179 | -176.5 | 0 | 0 | 0 | 0 | 112.5 | K56 E288 L289 L290 A294 T298 | K56-S292 WeakPolarHBondContact CD-O 3.43Å; K56-S292 PolarHBondContact NZ-O 3.12Å; E288-S292 PolarHBondContact O-N 3.39Å; L289-S292 PolarHBondContact O-N 3.35Å; L290-S292 VanDerWaalsContact C-N 3.33Å; S292-A294 VanDerWaalsContact OG-C 3.3Å; S292-A294 PolarHBondContact OG-N 3.37Å; S292-A294 VanDerWaalsContact OG-N 3.16Å; S292-A294 PolarHBondContact OG-O 3.11Å; S292-T298 PolarHBondContact OG-OG1 3.13Å | ||
| 293 | N | 82.4 | Confident | 89.1 | Confident | 49 Ų | 49 | 30 Ų | 30 | 26% | 0.262 | 16% | 0.163 | S | C | . | . | S | Bend | trans | -90.3 | -15.7 | 169.6 | -66 | -38.5 | 0 | 0 | 0 | 112.6 | K56 | K56-N293 PolarHBondContact NZ-OD1 3.37Š|
| 294 | A | 87.4 | Confident | 88.7 | Confident | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 17% | 0.168 | C | C | . | . | S | Bend | trans | -141.7 | 81.2 | -178 | 0 | 0 | 0 | 0 | 0 | 109.9 | Y138 Q141 S292 A296 V297 T298 | Y138-A294 HydrophobicContact CD1-CB 3.98Å; Y138-A294 HydrophobicContact CD2-CB 4.02Å; Y138-A294 HydrophobicContact CE1-CB 3.79Å; Y138-A294 HydrophobicContact CE2-CB 3.85Å; Y138-A294 HydrophobicContact CG-CB 4.1Å; Q141-A294 HydrophobicContact CB-CB 3.97Å; Q141-A294 HydrophobicContact CG-CB 3.9Å; S292-A294 VanDerWaalsContact OG-C 3.3Å; S292-A294 PolarHBondContact OG-N 3.37Å; S292-A294 VanDerWaalsContact OG-N 3.16Å; S292-A294 PolarHBondContact OG-O 3.11Å; A294-A296 VanDerWaalsContact C-N 3.25Å; A294-A296 PolarHBondContact O-N 3.22Å; A294-A296 VanDerWaalsContact O-N 3.13Å; A294-V297 HydrophobicContact CB-CB 4.12Å; A294-V297 HydrophobicContact CB-CG2 3.96Å; A294-V297 PolarHBondContact O-N 2.76Å; A294-T298 PolarHBondContact O-N 3.17Å; A294-T298 PolarHBondContact O-OG1 3.4Å |
| 295 | V | 90.1 | Very high | 88.4 | Confident | 2 Ų | 2 | 33.3 Ų | 33.3 | 1% | 0.012 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -51.7 | -42.5 | -171.3 | -179.4 | 0 | 0 | 0 | 0 | 112.4 | K56 Y138 Y280 M284 L289 V297 T298 F299 | K56-V295 HydrophobicContact CB-CG2 4.21Å; Y138-V295 PolarHBondContact OH-N 3.26Å; Y280-V295 HydrophobicContact CD1-CG1 3.96Å; Y280-V295 HydrophobicContact CD2-CG1 4Å; Y280-V295 HydrophobicContact CE1-CG1 4.24Å; Y280-V295 HydrophobicContact CE2-CG1 4.28Å; Y280-V295 HydrophobicContact CG-CG1 3.84Å; M284-V295 HydrophobicContact CE-CG1 4.43Å; M284-V295 HydrophobicContact SD-CG1 4.32Å; L289-V295 HydrophobicContact CD1-CG1 4.07Å; L289-V295 HydrophobicContact CD2-CG2 4.43Å; L289-V295 HydrophobicContact CG-CG1 4.01Å; L289-V295 HydrophobicContact CG-CG2 4.21Å; V295-V297 PolarHBondContact O-N 2.95Å; V295-T298 PolarHBondContact O-N 3.14Å; V295-F299 WeakPolarHBondContact O-CB 3.43Å; V295-F299 PolarHBondContact O-N 3.1Å |
| 296 | A | 89.8 | Confident | 87.7 | Confident | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -73.4 | -24.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | F52 Y138 I194 Y280 A294 G300 M311 V315 | F52-A296 HydrophobicContact CD1-CB 3.75Å; F52-A296 HydrophobicContact CE1-CB 4.16Å; Y138-A296 HydrophobicContact CE1-CB 4.04Å; I194-A296 HydrophobicContact CD1-CB 4.36Å; Y280-A296 HydrophobicContact CE1-CB 4.21Å; A294-A296 VanDerWaalsContact C-N 3.25Å; A294-A296 PolarHBondContact O-N 3.22Å; A294-A296 VanDerWaalsContact O-N 3.13Å; A296-G300 PolarHBondContact O-N 3.24Å; A296-M311 HydrophobicContact CB-CE 3.79Å; A296-M311 WeakPolarHBondContact O-CE 3.39Å; A296-V315 HydrophobicContact CB-CG2 4.19Å |
| 297 | V | 89.1 | Confident | 87.1 | Confident | 1 Ų | 1 | 42.2 Ų | 42.2 | 1% | 0.006 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -74.1 | -47 | 173.3 | 179 | 0 | 0 | 0 | 0 | 109.4 | Y138 Q141 P142 A294 V295 F299 G300 E301 P312 | Y138-V297 HydrophobicContact CD1-CG2 3.61Å; Y138-V297 HydrophobicContact CE1-CG2 3.94Å; Q141-V297 HydrophobicContact CB-CG1 4.39Å; Q141-V297 HydrophobicContact CG-CB 4.32Å; Q141-V297 HydrophobicContact CG-CG1 4.11Å; P142-V297 HydrophobicContact CG-CG1 4.34Å; A294-V297 HydrophobicContact CB-CB 4.12Å; A294-V297 HydrophobicContact CB-CG2 3.96Å; A294-V297 PolarHBondContact O-N 2.76Å; V295-V297 PolarHBondContact O-N 2.95Å; V297-F299 VanDerWaalsContact C-N 3.26Å; V297-F299 PolarHBondContact O-N 3.03Å; V297-G300 CarbonylContact O-C 3.56Å; V297-G300 WeakPolarHBondContact O-CA 3.08Å; V297-G300 PolarHBondContact O-N 3.23Å; V297-E301 PolarHBondContact O-N 3.49Å; V297-P312 HydrophobicContact CG2-CB 3.97Å |
| 298 | T | 89.4 | Confident | 86.6 | Confident | 14 Ų | 14 | 38.4 Ų | 38.4 | 9% | 0.086 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.3 | -38.6 | 174.8 | -53.8 | 0 | 0 | 0 | 0 | 111.9 | M284 S292 A294 V295 G300 E301 K302 | M284-T298 HydrophobicContact CE-CG2 4.04Å; M284-T298 HydrophobicContact SD-CG2 4.2Å; S292-T298 PolarHBondContact OG-OG1 3.13Å; A294-T298 PolarHBondContact O-N 3.17Å; A294-T298 PolarHBondContact O-OG1 3.4Å; V295-T298 PolarHBondContact O-N 3.14Å; T298-G300 VanDerWaalsContact C-N 3.35Å; T298-G300 PolarHBondContact O-N 3.4Å; T298-E301 PolarHBondContact O-N 2.79Å; T298-K302 PolarHBondContact O-N 2.77Å |
| 299 | F | 91.1 | Very high | 86.3 | Confident | 1 Ų | 1 | 42.6 Ų | 42.6 | 0% | 0.004 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58.1 | -46.3 | 171.1 | 174.9 | -88.9 | 0 | 0 | 0 | 111.9 | I194 M197 A279 Y280 A283 M284 V295 V297 K302 L303 | I194-F299 HydrophobicContact CB-CE1 4.29Å; I194-F299 HydrophobicContact CB-CZ 4.46Å; I194-F299 HydrophobicContact CG1-CD1 4.2Å; I194-F299 HydrophobicContact CG1-CE1 4.03Å; I194-F299 HydrophobicContact CG2-CE1 4.36Å; I194-F299 HydrophobicContact CG2-CE2 4.45Å; I194-F299 HydrophobicContact CG2-CZ 4.15Å; M197-F299 HydrophobicContact CB-CE1 4.17Å; M197-F299 HydrophobicContact CB-CZ 3.78Å; A279-F299 HydrophobicContact CB-CE2 4.17Å; A279-F299 WeakPolarHBondContact O-CE2 3.45Å; Y280-F299 HydrophobicContact CD1-CB 4.17Å; Y280-F299 AromaticContact CD1-CD2 3.94Å; Y280-F299 HydrophobicContact CD1-CD2 3.94Å; Y280-F299 HydrophobicContact CD1-CG 4.2Å; Y280-F299 HydrophobicContact CE1-CB 4.31Å; Y280-F299 HydrophobicContact CE1-CG 4.39Å; A283-F299 HydrophobicContact CB-CD2 3.4Å; A283-F299 HydrophobicContact CB-CE2 3.7Å; A283-F299 HydrophobicContact CB-CG 4.45Å; M284-F299 HydrophobicContact CE-CB 3.83Å; V295-F299 WeakPolarHBondContact O-CB 3.43Å; V295-F299 PolarHBondContact O-N 3.1Å; V297-F299 VanDerWaalsContact C-N 3.26Å; V297-F299 PolarHBondContact O-N 3.03Å; F299-K302 PolarHBondContact O-N 2.9Å; F299-L303 HydrophobicContact CD2-CD1 3.87Å; F299-L303 HydrophobicContact CE1-CD1 4.06Å; F299-L303 HydrophobicContact CE2-CD1 3.31Å; F299-L303 HydrophobicContact CG-CD1 4.46Å; F299-L303 HydrophobicContact CZ-CD1 3.42Å; F299-L303 VanDerWaalsContact CZ-CD1 3.42Å; F299-L303 PolarHBondContact O-N 3.15Å; F299-L303 VanDerWaalsContact O-N 3.13Å |
| 300 | G | 88.6 | Confident | 86 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.8 | -43.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A296 V297 T298 K302 L303 L304 | A296-G300 PolarHBondContact O-N 3.24Å; V297-G300 CarbonylContact O-C 3.56Å; V297-G300 WeakPolarHBondContact O-CA 3.08Å; V297-G300 PolarHBondContact O-N 3.23Å; T298-G300 VanDerWaalsContact C-N 3.35Å; T298-G300 PolarHBondContact O-N 3.4Å; G300-K302 VanDerWaalsContact C-N 3.28Å; G300-K302 PolarHBondContact O-N 2.96Å; G300-L303 PolarHBondContact O-N 3.34Å; G300-L304 WeakPolarHBondContact O-CA 3.46Å; G300-L304 VanDerWaalsContact O-CB 3.27Å; G300-L304 WeakPolarHBondContact O-CB 3.35Å; G300-L304 PolarHBondContact O-N 2.86Å |
| 301 | E | 88.1 | Confident | 85.9 | Confident | 81 Ų | 81 | 42.1 Ų | 42.1 | 38% | 0.379 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -59.9 | -38.4 | 178.6 | -71.7 | 171.9 | 169.1 | 0 | 0 | 112.2 | V297 T298 A308 | V297-E301 PolarHBondContact O-N 3.49Å; T298-E301 PolarHBondContact O-N 2.79Å; E301-A308 HydrophobicContact CG-CB 4.27Å |
| 302 | K | 87.4 | Confident | 85.9 | Confident | 96 Ų | 96 | 39.1 Ų | 39.1 | 42% | 0.417 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -74.3 | -43.2 | 178.8 | -74.7 | -161.2 | 171.4 | -163.6 | 0 | 114.6 | A283 M284 E288 T298 F299 G300 | A283-K302 WeakPolarHBondContact O-CD 3.38Å; M284-K302 HydrophobicContact CB-CD 4.34Å; E288-K302 VanDerWaalsContact CD-CE 3.42Å; E288-K302 WeakPolarHBondContact OE1-CE 3.42Å; E288-K302 IonicContact OE1-NZ 2.9Å; E288-K302 PolarHBondContact OE1-NZ 3Å; E288-K302 WeakPolarHBondContact OE2-CE 3.26Å; E288-K302 IonicContact OE2-NZ 2.6Å; E288-K302 PolarHBondContact OE2-NZ 3.41Å; T298-K302 PolarHBondContact O-N 2.77Å; F299-K302 PolarHBondContact O-N 2.9Å; G300-K302 VanDerWaalsContact C-N 3.28Å; G300-K302 PolarHBondContact O-N 2.96Å |
| 303 | L | 87.9 | Confident | 85.9 | Confident | 42 Ų | 42 | 42.8 Ų | 42.8 | 22% | 0.22 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -103.8 | -32 | -166.8 | -76.8 | 172.9 | 0 | 0 | 0 | 114.5 | M197 Q201 A283 F299 G300 | M197-L303 HydrophobicContact CB-CD1 4.49Å; M197-L303 HydrophobicContact CE-CB 4.12Å; Q201-L303 HydrophobicContact CG-CD1 4.25Å; Q201-L303 HydrophobicContact CG-CD2 3.79Å; A283-L303 HydrophobicContact CB-CD1 3.62Å; A283-L303 HydrophobicContact CB-CG 4.28Å; F299-L303 HydrophobicContact CD2-CD1 3.87Å; F299-L303 HydrophobicContact CE1-CD1 4.06Å; F299-L303 HydrophobicContact CE2-CD1 3.31Å; F299-L303 HydrophobicContact CG-CD1 4.46Å; F299-L303 HydrophobicContact CZ-CD1 3.42Å; F299-L303 VanDerWaalsContact CZ-CD1 3.42Å; F299-L303 PolarHBondContact O-N 3.15Å; F299-L303 VanDerWaalsContact O-N 3.13Å; G300-L303 PolarHBondContact O-N 3.34Å |
| 304 | L | 81.9 | Confident | 86.1 | Confident | 36 Ų | 36 | 41 Ų | 41 | 19% | 0.188 | 22% | 0.218 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -97.5 | -15.1 | -172.1 | -64.9 | 176.2 | 0 | 0 | 0 | 112.7 | M197 G300 V306 M307 M311 | M197-L304 HydrophobicContact CE-CD2 4.12Å; M197-L304 HydrophobicContact CG-CD2 4.05Å; M197-L304 HydrophobicContact SD-CD2 4.2Å; G300-L304 WeakPolarHBondContact O-CA 3.46Å; G300-L304 VanDerWaalsContact O-CB 3.27Å; G300-L304 WeakPolarHBondContact O-CB 3.35Å; G300-L304 PolarHBondContact O-N 2.86Å; L304-V306 PolarHBondContact O-N 3.49Å; L304-M307 HydrophobicContact CB-CB 3.99Å; L304-M307 PolarHBondContact O-N 3.35Å; L304-M311 HydrophobicContact CD1-CG 3.84Å; L304-M311 HydrophobicContact CD1-SD 4.01Å |
| 305 | G | 82.8 | Confident | 86.1 | Confident | 49 Ų | 49 | 41 Ų | 41 | 51% | 0.505 | 22% | 0.218 | S | C | . | . | G | 310 helix | trans | 52.5 | -110.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | M307 A308 | G305-M307 PolarHBondContact O-N 2.59Å; G305-M307 VanDerWaalsContact O-N 3.13Å; G305-A308 WeakPolarHBondContact O-CB 3.38Å; G305-A308 PolarHBondContact O-N 3.35Å |
| 306 | V | 77.3 | Confident | 86 | Confident | 128 Ų | 128 | 41.4 Ų | 41.4 | 78% | 0.776 | 22% | 0.221 | S | C | * | . | G | 310 helix | trans | -58.5 | -25.9 | 178.1 | -177.4 | 0 | 0 | 0 | 0 | 112.9 | L304 A308 W309 | L304-V306 PolarHBondContact O-N 3.49Å; V306-A308 VanDerWaalsContact C-N 3.34Å; V306-W309 PolarHBondContact O-NE1 3.31Å |
| 307 | M | 77 | Confident | 85.9 | Confident | 91 Ų | 91 | 44.1 Ų | 44.1 | 45% | 0.448 | 24% | 0.236 | S | C | . | . | G | 310 helix | trans | -91.4 | 9.7 | 179.9 | -60.9 | -59.8 | 160.5 | 0 | 0 | 113.4 | L304 G305 W309 I310 | L304-M307 HydrophobicContact CB-CB 3.99Å; L304-M307 PolarHBondContact O-N 3.35Å; G305-M307 PolarHBondContact O-N 2.59Å; G305-M307 VanDerWaalsContact O-N 3.13Å; M307-W309 PolarHBondContact O-N 3.48Å; M307-W309 VanDerWaalsContact O-N 3.15Å; M307-I310 HydrophobicContact CB-CD1 3.93Å; M307-I310 HydrophobicContact CB-CG1 4.46Å; M307-I310 HydrophobicContact CG-CD1 4.35Å; M307-I310 WeakPolarHBondContact O-CB 3.26Å; M307-I310 WeakPolarHBondContact O-CG1 3.47Å; M307-I310 PolarHBondContact O-N 3.02Å; M307-I310 VanDerWaalsContact O-N 3.08Å; M307-I310 HydrophobicContact SD-CD1 4.04Å |
| 308 | A | 80.4 | Confident | 85.8 | Confident | 19 Ų | 19 | 44.2 Ų | 44.2 | 16% | 0.157 | 24% | 0.236 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | -27.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | E301 G305 V306 I310 M311 P312 | E301-A308 HydrophobicContact CG-CB 4.27Å; G305-A308 WeakPolarHBondContact O-CB 3.38Å; G305-A308 PolarHBondContact O-N 3.35Å; V306-A308 VanDerWaalsContact C-N 3.34Å; A308-I310 PolarHBondContact O-N 2.82Å; A308-M311 PolarHBondContact O-N 3.08Å; A308-P312 WeakPolarHBondContact O-CD 3.23Å |
| 309 | W | 83.1 | Confident | 85.8 | Confident | 152 Ų | 152 | 43.6 Ų | 43.6 | 58% | 0.576 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -20.4 | 177.3 | 67 | -92.5 | 0 | 0 | 0 | 113.9 | V306 M307 M311 P312 I313 | V306-W309 PolarHBondContact O-NE1 3.31Å; M307-W309 PolarHBondContact O-N 3.48Å; M307-W309 VanDerWaalsContact O-N 3.15Å; W309-M311 VanDerWaalsContact C-N 3.32Å; W309-M311 PolarHBondContact O-N 2.81Å; W309-P312 WeakPolarHBondContact O-CD 3.21Å; W309-P312 WeakPolarHBondContact O-CG 3.29Å; W309-I313 HydrophobicContact CE3-CD1 3.56Å; W309-I313 HydrophobicContact CZ3-CD1 3.84Å; W309-I313 WeakPolarHBondContact O-CG1 3.42Å |
| 310 | I | 86.1 | Confident | 85.6 | Confident | 41 Ų | 41 | 45.3 Ų | 45.3 | 21% | 0.21 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67 | -36.5 | 178.9 | -61.4 | 179.6 | 0 | 0 | 0 | 110.7 | L193 M307 A308 S314 | L193-I310 HydrophobicContact CD1-CG2 4.04Å; M307-I310 HydrophobicContact CB-CD1 3.93Å; M307-I310 HydrophobicContact CB-CG1 4.46Å; M307-I310 HydrophobicContact CG-CD1 4.35Å; M307-I310 WeakPolarHBondContact O-CB 3.26Å; M307-I310 WeakPolarHBondContact O-CG1 3.47Å; M307-I310 PolarHBondContact O-N 3.02Å; M307-I310 VanDerWaalsContact O-N 3.08Å; M307-I310 HydrophobicContact SD-CD1 4.04Å; A308-I310 PolarHBondContact O-N 2.82Å; I310-S314 VanDerWaalsContact O-CB 3.31Å; I310-S314 WeakPolarHBondContact O-CB 3.31Å; I310-S314 PolarHBondContact O-N 3.5Å; I310-S314 PolarHBondContact O-OG 3Å |
| 311 | M | 87.4 | Confident | 85.4 | Confident | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.6 | -56.2 | -176.4 | -66.7 | -51.3 | -60 | 0 | 0 | 113.8 | I194 A296 L304 A308 W309 I313 S314 V315 | I194-M311 HydrophobicContact CD1-CE 3.66Å; I194-M311 HydrophobicContact CG1-CE 3.69Å; A296-M311 HydrophobicContact CB-CE 3.79Å; A296-M311 WeakPolarHBondContact O-CE 3.39Å; L304-M311 HydrophobicContact CD1-CG 3.84Å; L304-M311 HydrophobicContact CD1-SD 4.01Å; A308-M311 PolarHBondContact O-N 3.08Å; W309-M311 VanDerWaalsContact C-N 3.32Å; W309-M311 PolarHBondContact O-N 2.81Å; M311-I313 VanDerWaalsContact C-N 3.3Å; M311-I313 PolarHBondContact O-N 3.48Å; M311-S314 PolarHBondContact O-N 3.14Å; M311-V315 WeakPolarHBondContact O-CG2 3.39Å; M311-V315 PolarHBondContact O-N 3.03Å |
| 312 | P | 88.7 | Confident | 85.2 | Confident | 12 Ų | 12 | 42.6 Ų | 42.6 | 8% | 0.078 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.9 | -37.4 | -179.9 | 24.1 | -33.4 | 0 | 0 | 0 | 111.9 | Y138 P142 V297 A308 W309 A316 | Y138-P312 WeakPolarHBondContact O-CB 3.3Å; P142-P312 HydrophobicContact CG-CB 3.9Å; P142-P312 HydrophobicContact CG-CG 3.8Å; V297-P312 HydrophobicContact CG2-CB 3.97Å; A308-P312 WeakPolarHBondContact O-CD 3.23Å; W309-P312 WeakPolarHBondContact O-CD 3.21Å; W309-P312 WeakPolarHBondContact O-CG 3.29Å; P312-A316 WeakPolarHBondContact O-CB 3.31Å; P312-A316 PolarHBondContact O-N 3.37Å |
| 313 | I | 88 | Confident | 85.3 | Confident | 85 Ų | 85 | 38 Ų | 38 | 44% | 0.436 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -64 | -48.2 | 175.9 | -64.5 | -175.6 | 0 | 0 | 0 | 110.8 | W309 M311 V315 A316 L317 | W309-I313 HydrophobicContact CE3-CD1 3.56Å; W309-I313 HydrophobicContact CZ3-CD1 3.84Å; W309-I313 WeakPolarHBondContact O-CG1 3.42Å; M311-I313 VanDerWaalsContact C-N 3.3Å; M311-I313 PolarHBondContact O-N 3.48Å; I313-V315 PolarHBondContact O-N 3.2Å; I313-A316 PolarHBondContact O-N 3.45Å; I313-L317 HydrophobicContact CG2-CD1 4.02Å; I313-L317 HydrophobicContact CG2-CG 4.42Å; I313-L317 VanDerWaalsContact O-CG 3.26Å; I313-L317 WeakPolarHBondContact O-CG 3.43Å; I313-L317 PolarHBondContact O-N 3.03Å |
| 314 | S | 86.4 | Confident | 85.2 | Confident | 10 Ų | 10 | 36.2 Ų | 36.2 | 7% | 0.07 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -67.7 | -37.8 | -176 | -52.3 | 0 | 0 | 0 | 0 | 112 | I310 M311 S318 | I310-S314 VanDerWaalsContact O-CB 3.31Å; I310-S314 WeakPolarHBondContact O-CB 3.31Å; I310-S314 PolarHBondContact O-N 3.5Å; I310-S314 PolarHBondContact O-OG 3Å; M311-S314 PolarHBondContact O-N 3.14Å; S314-S318 PolarHBondContact O-N 3.11Å |
| 315 | V | 87.3 | Confident | 85.2 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -69.2 | -41.4 | 174.1 | 179.4 | 0 | 0 | 0 | 0 | 111.3 | F52 Y138 A296 M311 I313 L317 S318 T319 | F52-V315 HydrophobicContact CB-CG1 4.15Å; F52-V315 HydrophobicContact CD1-CG1 4.46Å; F52-V315 HydrophobicContact CD1-CG2 3.84Å; F52-V315 HydrophobicContact CD2-CB 4.38Å; F52-V315 HydrophobicContact CD2-CG1 3.59Å; F52-V315 HydrophobicContact CD2-CG2 4.12Å; F52-V315 HydrophobicContact CE1-CG2 3.75Å; F52-V315 HydrophobicContact CE2-CB 4.45Å; F52-V315 HydrophobicContact CE2-CG1 4.1Å; F52-V315 HydrophobicContact CE2-CG2 4.04Å; F52-V315 HydrophobicContact CG-CG1 3.81Å; F52-V315 HydrophobicContact CG-CG2 4.03Å; F52-V315 HydrophobicContact CZ-CG2 3.86Å; Y138-V315 HydrophobicContact CD1-CB 3.54Å; Y138-V315 HydrophobicContact CD1-CG1 3.29Å; Y138-V315 HydrophobicContact CD1-CG2 3.89Å; Y138-V315 HydrophobicContact CD2-CG1 4.11Å; Y138-V315 HydrophobicContact CE1-CB 3.97Å; Y138-V315 HydrophobicContact CE1-CG1 3.58Å; Y138-V315 HydrophobicContact CE1-CG2 3.86Å; Y138-V315 HydrophobicContact CE2-CG1 4.34Å; Y138-V315 HydrophobicContact CG-CB 4.18Å; Y138-V315 HydrophobicContact CG-CG1 3.58Å; A296-V315 HydrophobicContact CB-CG2 4.19Å; M311-V315 WeakPolarHBondContact O-CG2 3.39Å; M311-V315 PolarHBondContact O-N 3.03Å; I313-V315 PolarHBondContact O-N 3.2Å; V315-L317 VanDerWaalsContact C-N 3.33Å; V315-L317 PolarHBondContact O-N 3.08Å; V315-S318 WeakPolarHBondContact O-CA 3.46Å; V315-S318 VanDerWaalsContact O-CB 3.31Å; V315-S318 WeakPolarHBondContact O-CB 3.48Å; V315-S318 PolarHBondContact O-N 3.44Å; V315-T319 HydrophobicContact CG1-CG2 4.38Å; V315-T319 PolarHBondContact O-N 3.49Å; V315-T319 PolarHBondContact O-OG1 3.09Å |
| 316 | A | 88.9 | Confident | 85.2 | Confident | 11 Ų | 11 | 33.6 Ų | 33.6 | 9% | 0.091 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -57.1 | -46.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | F135 V139 P312 I313 S318 T319 F320 | F135-A316 HydrophobicContact CD2-CB 3.9Å; F135-A316 HydrophobicContact CE2-CB 3.87Å; V139-A316 HydrophobicContact CG2-CB 3.86Å; P312-A316 WeakPolarHBondContact O-CB 3.31Å; P312-A316 PolarHBondContact O-N 3.37Å; I313-A316 PolarHBondContact O-N 3.45Å; A316-S318 VanDerWaalsContact C-N 3.31Å; A316-S318 PolarHBondContact O-N 3.37Å; A316-T319 WeakPolarHBondContact CA-OG1 3.3Å; A316-T319 PolarHBondContact O-N 2.63Å; A316-T319 PolarHBondContact O-OG1 3.41Å; A316-F320 WeakPolarHBondContact O-CB 3.18Å; A316-F320 WeakPolarHBondContact O-CD2 3.11Å; A316-F320 PolarHBondContact O-N 3.36Å |
| 317 | L | 87.1 | Confident | 85.6 | Confident | 58 Ų | 58 | 27.5 Ų | 27.5 | 30% | 0.304 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -59.9 | -40.5 | 174.4 | -66.4 | 170.6 | 0 | 0 | 0 | 111.9 | F183 I313 V315 F320 G321 | F183-L317 WeakPolarHBondContact CB-O 3.27Å; F183-L317 HydrophobicContact CD1-CB 4.07Å; F183-L317 HydrophobicContact CD1-CD2 3.67Å; F183-L317 HydrophobicContact CD1-CG 4.43Å; F183-L317 HydrophobicContact CE1-CD2 3.39Å; F183-L317 WeakPolarHBondContact CG-O 3.35Å; F183-L317 HydrophobicContact CZ-CD2 4.37Å; I313-L317 HydrophobicContact CG2-CD1 4.02Å; I313-L317 HydrophobicContact CG2-CG 4.42Å; I313-L317 VanDerWaalsContact O-CG 3.26Å; I313-L317 WeakPolarHBondContact O-CG 3.43Å; I313-L317 PolarHBondContact O-N 3.03Å; V315-L317 VanDerWaalsContact C-N 3.33Å; V315-L317 PolarHBondContact O-N 3.08Å; L317-F320 PolarHBondContact O-N 3.27Å; L317-G321 PolarHBondContact O-N 3.11Å |
| 318 | S | 87.9 | Confident | 85.6 | Confident | 3 Ų | 3 | 26.4 Ų | 26.4 | 2% | 0.021 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.2 | -47.4 | 175.2 | -171.7 | 0 | 0 | 0 | 0 | 112.1 | K187 S314 V315 A316 F320 G321 G322 | K187-S318 WeakPolarHBondContact CB-OG 3.48Å; S314-S318 PolarHBondContact O-N 3.11Å; V315-S318 WeakPolarHBondContact O-CA 3.46Å; V315-S318 VanDerWaalsContact O-CB 3.31Å; V315-S318 WeakPolarHBondContact O-CB 3.48Å; V315-S318 PolarHBondContact O-N 3.44Å; A316-S318 VanDerWaalsContact C-N 3.31Å; A316-S318 PolarHBondContact O-N 3.37Å; S318-F320 PolarHBondContact O-N 3.17Å; S318-G321 PolarHBondContact O-N 3.42Å; S318-G322 PolarHBondContact O-N 3.46Å |
| 319 | T | 88.9 | Confident | 85.5 | Confident | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -64.2 | -39.8 | 178.3 | 52.5 | 0 | 0 | 0 | 0 | 112.3 | I131 T134 F135 V315 A316 G321 G322 V323 | I131-T319 HydrophobicContact CG2-CG2 4.34Å; I131-T319 WeakPolarHBondContact CG2-O 3.44Å; T134-T319 HydrophobicContact CG2-CG2 3.67Å; F135-T319 WeakPolarHBondContact CA-OG1 3.24Å; F135-T319 HydrophobicContact CB-CG2 4.47Å; F135-T319 VanDerWaalsContact CB-OG1 3.29Å; F135-T319 WeakPolarHBondContact CB-OG1 3.48Å; V315-T319 HydrophobicContact CG1-CG2 4.38Å; V315-T319 PolarHBondContact O-N 3.49Å; V315-T319 PolarHBondContact O-OG1 3.09Å; A316-T319 WeakPolarHBondContact CA-OG1 3.3Å; A316-T319 PolarHBondContact O-N 2.63Å; A316-T319 PolarHBondContact O-OG1 3.41Å; T319-G321 PolarHBondContact O-N 3.05Å; T319-G322 PolarHBondContact O-N 2.85Å; T319-G322 VanDerWaalsContact O-N 3.14Å; T319-V323 PolarHBondContact O-N 3.4Å; T319-V323 VanDerWaalsContact O-N 3.07Å |
| 320 | F | 86.8 | Confident | 85.5 | Confident | 37 Ų | 37 | 19.3 Ų | 19.3 | 16% | 0.162 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -58.7 | -45.4 | 172.9 | -100.9 | -76.4 | 0 | 0 | 0 | 111.8 | F135 C161 L164 L165 F183 A316 L317 S318 G322 V323 N324 | F135-F320 AromaticContact CD2-CD2 3.71Å; F135-F320 HydrophobicContact CD2-CD2 3.71Å; F135-F320 AromaticContact CD2-CE2 3.71Å; F135-F320 HydrophobicContact CD2-CE2 3.71Å; F135-F320 HydrophobicContact CE1-CE2 4.15Å; F135-F320 HydrophobicContact CE1-CZ 4.42Å; F135-F320 AromaticContact CE2-CD2 3.52Å; F135-F320 HydrophobicContact CE2-CD2 3.52Å; F135-F320 AromaticContact CE2-CE2 3.09Å; F135-F320 HydrophobicContact CE2-CE2 3.09Å; F135-F320 HydrophobicContact CE2-CZ 4.08Å; F135-F320 HydrophobicContact CG-CE2 4.46Å; F135-F320 HydrophobicContact CZ-CD2 4.21Å; F135-F320 AromaticContact CZ-CE2 3.34Å; F135-F320 HydrophobicContact CZ-CE2 3.34Å; F135-F320 AromaticContact CZ-CZ 3.92Å; F135-F320 HydrophobicContact CZ-CZ 3.92Å; C161-F320 HydrophobicContact CB-CE1 4.41Å; C161-F320 HydrophobicContact CB-CZ 4.26Å; C161-F320 WeakPolarHBondContact SG-CE1 3.42Å; C161-F320 VanDerWaalsContact SG-CZ 3.58Å; L164-F320 HydrophobicContact CD2-CE1 4.39Å; L165-F320 HydrophobicContact CD1-CD1 3.72Å; L165-F320 HydrophobicContact CD1-CE1 4.28Å; L165-F320 WeakPolarHBondContact CD1-O 3.43Å; L165-F320 HydrophobicContact CD2-CD1 3.89Å; L165-F320 HydrophobicContact CD2-CE1 4.34Å; L165-F320 HydrophobicContact CG-CD1 3.82Å; L165-F320 HydrophobicContact CG-CE1 4.05Å; F183-F320 HydrophobicContact CD2-CB 4.06Å; F183-F320 HydrophobicContact CE2-CB 3.67Å; F183-F320 HydrophobicContact CE2-CG 4.43Å; F183-F320 HydrophobicContact CZ-CB 4.09Å; A316-F320 WeakPolarHBondContact O-CB 3.18Å; A316-F320 WeakPolarHBondContact O-CD2 3.11Å; A316-F320 PolarHBondContact O-N 3.36Å; L317-F320 PolarHBondContact O-N 3.27Å; S318-F320 PolarHBondContact O-N 3.17Å; F320-G322 VanDerWaalsContact C-N 3.33Å; F320-G322 PolarHBondContact O-N 3.41Å; F320-V323 PolarHBondContact O-N 3.36Å; F320-N324 WeakPolarHBondContact O-CB 3.26Å; F320-N324 PolarHBondContact O-N 2.94Å; F320-N324 VanDerWaalsContact O-N 3.08Å |
| 321 | G | 84.1 | Confident | 85.3 | Confident | 5 Ų | 5 | 18.1 Ų | 18.1 | 5% | 0.052 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -64.9 | -33.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q180 L317 S318 T319 G325 | Q180-G321 PolarHBondContact NE2-O 3.38Å; Q180-G321 PolarHBondContact OE1-O 2.89Å; L317-G321 PolarHBondContact O-N 3.11Å; S318-G321 PolarHBondContact O-N 3.42Å; T319-G321 PolarHBondContact O-N 3.05Å; G321-G325 PolarHBondContact O-N 2.88Å |
| 322 | G | 84.9 | Confident | 84.8 | Confident | 19 Ų | 19 | 22.9 Ų | 22.9 | 20% | 0.196 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63 | -48.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S318 T319 F320 S326 | S318-G322 PolarHBondContact O-N 3.46Å; T319-G322 PolarHBondContact O-N 2.85Å; T319-G322 VanDerWaalsContact O-N 3.14Å; F320-G322 VanDerWaalsContact C-N 3.33Å; F320-G322 PolarHBondContact O-N 3.41Å; G322-S326 WeakPolarHBondContact O-CB 3.48Å; G322-S326 PolarHBondContact O-N 3.07Å |
| 323 | V | 88.8 | Confident | 84.5 | Confident | 1 Ų | 1 | 22.5 Ų | 22.5 | 1% | 0.006 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -65 | -43.8 | 177.6 | 177.5 | 0 | 0 | 0 | 0 | 110.9 | I131 A132 L162 L165 T319 F320 S326 L327 | I131-V323 HydrophobicContact CB-CG2 3.84Å; I131-V323 HydrophobicContact CG2-CG2 3.61Å; A132-V323 HydrophobicContact CB-CG2 4.4Å; L162-V323 HydrophobicContact CD1-CG1 3.91Å; L165-V323 HydrophobicContact CB-CG1 4.47Å; L165-V323 HydrophobicContact CD1-CB 3.51Å; L165-V323 HydrophobicContact CD1-CG1 3.54Å; T319-V323 PolarHBondContact O-N 3.4Å; T319-V323 VanDerWaalsContact O-N 3.07Å; F320-V323 PolarHBondContact O-N 3.36Å; V323-S326 PolarHBondContact O-N 2.93Å; V323-L327 HydrophobicContact CG1-CD1 4.2Å; V323-L327 HydrophobicContact CG1-CG 4.49Å; V323-L327 WeakPolarHBondContact O-CG 3.27Å; V323-L327 PolarHBondContact O-N 3.49Å |
| 324 | N | 86.5 | Confident | 84.4 | Confident | 4 Ų | 4 | 18.5 Ų | 18.5 | 2% | 0.021 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61.4 | -45.8 | 178.9 | -175.5 | 65.2 | 0 | 0 | 0 | 112.3 | L165 N169 A176 Q180 F320 S326 L327 F328 | L165-N324 HydrophobicContact CD1-CB 4.4Å; L165-N324 HydrophobicContact CD2-CB 4.13Å; N169-N324 PolarHBondContact ND2-OD1 2.84Å; A176-N324 PolarHBondContact O-ND2 3.3Å; Q180-N324 PolarHBondContact OE1-ND2 3.14Å; F320-N324 WeakPolarHBondContact O-CB 3.26Å; F320-N324 PolarHBondContact O-N 2.94Å; F320-N324 VanDerWaalsContact O-N 3.08Å; N324-S326 VanDerWaalsContact C-N 3.34Å; N324-S326 PolarHBondContact O-N 3.25Å; N324-L327 PolarHBondContact O-N 2.93Å; N324-F328 PolarHBondContact O-N 3.36Å; N324-F328 VanDerWaalsContact O-N 3.09Å |
| 325 | G | 80 | Confident | 84 | Confident | 15 Ų | 15 | 21.8 Ų | 21.8 | 16% | 0.155 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -63.5 | -37.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | G321 F328 T329 | G321-G325 PolarHBondContact O-N 2.88Å; G325-F328 PolarHBondContact O-N 3.29Å; G325-T329 WeakPolarHBondContact O-CG2 3.31Å; G325-T329 PolarHBondContact O-N 3.39Å; G325-T329 VanDerWaalsContact O-N 3.07Å; G325-T329 PolarHBondContact O-OG1 3.12Å; G325-T329 VanDerWaalsContact O-OG1 3.07Å |
| 326 | S | 83.6 | Confident | 83.7 | Confident | 14 Ų | 14 | 22.5 Ų | 22.5 | 10% | 0.098 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -65.6 | -40.8 | 174.9 | -171.7 | 0 | 0 | 0 | 0 | 112.5 | Q128 G322 V323 N324 T329 S330 | Q128-S326 VanDerWaalsContact CG-OG 3.32Å; Q128-S326 WeakPolarHBondContact CG-OG 3.16Å; Q128-S326 PolarHBondContact NE2-OG 2.93Å; G322-S326 WeakPolarHBondContact O-CB 3.48Å; G322-S326 PolarHBondContact O-N 3.07Å; V323-S326 PolarHBondContact O-N 2.93Å; N324-S326 VanDerWaalsContact C-N 3.34Å; N324-S326 PolarHBondContact O-N 3.25Å; S326-T329 PolarHBondContact O-N 3.49Å; S326-T329 PolarHBondContact O-OG1 3.33Å; S326-T329 VanDerWaalsContact O-OG1 3.04Å; S326-S330 WeakPolarHBondContact O-CB 3.46Å; S326-S330 PolarHBondContact O-N 3.4Å; S326-S330 PolarHBondContact O-OG 2.9Å |
| 327 | L | 85.6 | Confident | 83.4 | Confident | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -62.3 | -44.1 | 175.2 | -74 | 169.6 | 0 | 0 | 0 | 111.2 | L165 V323 N324 T329 S330 S331 L361 | L165-L327 HydrophobicContact CB-CD1 4Å; V323-L327 HydrophobicContact CG1-CD1 4.2Å; V323-L327 HydrophobicContact CG1-CG 4.49Å; V323-L327 WeakPolarHBondContact O-CG 3.27Å; V323-L327 PolarHBondContact O-N 3.49Å; N324-L327 PolarHBondContact O-N 2.93Å; L327-T329 PolarHBondContact O-N 3.34Å; L327-S330 PolarHBondContact O-N 2.87Å; L327-S330 PolarHBondContact O-OG 2.96Å; L327-S331 PolarHBondContact O-N 3.23Å; L327-L361 HydrophobicContact CB-CD2 4.17Å; L327-L361 HydrophobicContact CD2-CD2 4.22Å |
| 328 | F | 77.2 | Confident | 83.3 | Confident | 68 Ų | 68 | 19.6 Ų | 19.6 | 30% | 0.298 | 11% | 0.105 | S | C | . | . | H | α-helix | trans | -59.5 | -49.6 | 177.8 | -171.2 | -103.1 | 0 | 0 | 0 | 112 | V173 N324 G325 S331 | V173-F328 HydrophobicContact CG1-CE2 3.82Å; N324-F328 PolarHBondContact O-N 3.36Å; N324-F328 VanDerWaalsContact O-N 3.09Å; G325-F328 PolarHBondContact O-N 3.29Å; F328-S331 PolarHBondContact O-N 3.46Å; F328-S331 PolarHBondContact O-OG 3.08Å |
| 329 | T | 77.6 | Confident | 83 | Confident | 22 Ų | 22 | 26.9 Ų | 26.9 | 14% | 0.135 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -67.9 | -36.5 | -179.9 | 52.4 | 0 | 0 | 0 | 0 | 113.2 | F243 G325 S326 L327 S331 R332 | F243-T329 HydrophobicContact CD1-CG2 4.02Å; F243-T329 HydrophobicContact CE1-CG2 3.94Å; G325-T329 WeakPolarHBondContact O-CG2 3.31Å; G325-T329 PolarHBondContact O-N 3.39Å; G325-T329 VanDerWaalsContact O-N 3.07Å; G325-T329 PolarHBondContact O-OG1 3.12Å; G325-T329 VanDerWaalsContact O-OG1 3.07Å; S326-T329 PolarHBondContact O-N 3.49Å; S326-T329 PolarHBondContact O-OG1 3.33Å; S326-T329 VanDerWaalsContact O-OG1 3.04Å; L327-T329 PolarHBondContact O-N 3.34Å; T329-S331 VanDerWaalsContact C-N 3.28Å; T329-S331 PolarHBondContact O-N 3.35Å; T329-R332 PolarHBondContact O-N 2.93Å |
| 330 | S | 83.8 | Confident | 82.7 | Confident | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -57.9 | -42.4 | 179.2 | 71.7 | 0 | 0 | 0 | 0 | 111.7 | S326 L327 R332 L333 F334 | S326-S330 WeakPolarHBondContact O-CB 3.46Å; S326-S330 PolarHBondContact O-N 3.4Å; S326-S330 PolarHBondContact O-OG 2.9Å; L327-S330 PolarHBondContact O-N 2.87Å; L327-S330 PolarHBondContact O-OG 2.96Å; S330-R332 VanDerWaalsContact C-N 3.32Å; S330-R332 PolarHBondContact O-N 3.45Å; S330-L333 PolarHBondContact O-N 3.44Å; S330-L333 VanDerWaalsContact O-N 3.09Å; S330-F334 WeakPolarHBondContact O-CD2 3.33Å; S330-F334 PolarHBondContact O-N 3.24Å |
| 331 | S | 81.2 | Confident | 82.4 | Confident | 17 Ų | 17 | 31.9 Ų | 31.9 | 12% | 0.119 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -59.8 | -37.9 | -178.2 | 74.5 | 0 | 0 | 0 | 0 | 113.8 | L327 F328 T329 L333 F334 F335 | L327-S331 PolarHBondContact O-N 3.23Å; F328-S331 PolarHBondContact O-N 3.46Å; F328-S331 PolarHBondContact O-OG 3.08Å; T329-S331 VanDerWaalsContact C-N 3.28Å; T329-S331 PolarHBondContact O-N 3.35Å; S331-L333 VanDerWaalsContact C-N 3.31Å; S331-L333 PolarHBondContact O-N 3.29Å; S331-F334 PolarHBondContact O-N 3.08Å; S331-F335 PolarHBondContact O-N 2.76Å; S331-F335 VanDerWaalsContact O-N 3.12Å |
| 332 | R | 77.6 | Confident | 82.4 | Confident | 99 Ų | 99 | 32.5 Ų | 32.5 | 37% | 0.374 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -63.8 | -35.5 | 176.9 | -65.9 | 179.7 | 172.2 | -163.9 | -11.1 | 112.3 | E250 T329 S330 F335 A336 | E250-R332 IonicContact OE1-NH2 3.13Å; T329-R332 PolarHBondContact O-N 2.93Å; S330-R332 VanDerWaalsContact C-N 3.32Å; S330-R332 PolarHBondContact O-N 3.45Å; R332-F335 PolarHBondContact O-N 3.45Å; R332-A336 PolarHBondContact O-N 3.07Å; R332-A336 VanDerWaalsContact O-N 3.07Å |
| 333 | L | 81.9 | Confident | 82.4 | Confident | 5 Ų | 5 | 32.9 Ų | 32.9 | 3% | 0.026 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -70.9 | -38.6 | 177.4 | -173 | 67.7 | 0 | 0 | 0 | 112 | L116 A119 V120 Y124 S330 S331 F335 A336 G337 | L116-L333 HydrophobicContact CD1-CD1 3.89Å; L116-L333 HydrophobicContact CD1-CD2 3.9Å; L116-L333 HydrophobicContact CD1-CG 3.58Å; A119-L333 HydrophobicContact CB-CD2 3.35Å; V120-L333 HydrophobicContact CG2-CD2 4.44Å; Y124-L333 HydrophobicContact CD2-CD2 4.32Å; Y124-L333 HydrophobicContact CE2-CB 4.34Å; Y124-L333 HydrophobicContact CE2-CD2 3.64Å; S330-L333 PolarHBondContact O-N 3.44Å; S330-L333 VanDerWaalsContact O-N 3.09Å; S331-L333 VanDerWaalsContact C-N 3.31Å; S331-L333 PolarHBondContact O-N 3.29Å; L333-F335 VanDerWaalsContact C-N 3.28Å; L333-F335 PolarHBondContact O-N 2.93Å; L333-A336 PolarHBondContact O-N 3.06Å; L333-G337 PolarHBondContact O-N 3.08Å |
| 334 | F | 85.7 | Confident | 82.3 | Confident | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.3 | -41.4 | 172.9 | -73.5 | -82.1 | 0 | 0 | 0 | 111.5 | V120 S330 S331 G337 A338 L343 L347 A360 F363 T364 | V120-F334 HydrophobicContact CB-CE1 4.3Å; V120-F334 HydrophobicContact CB-CZ 4.2Å; V120-F334 HydrophobicContact CG1-CE1 3.51Å; V120-F334 HydrophobicContact CG1-CZ 3.56Å; V120-F334 HydrophobicContact CG2-CD1 4.34Å; V120-F334 HydrophobicContact CG2-CE1 3.81Å; V120-F334 HydrophobicContact CG2-CE2 4.38Å; V120-F334 HydrophobicContact CG2-CZ 3.82Å; S330-F334 WeakPolarHBondContact O-CD2 3.33Å; S330-F334 PolarHBondContact O-N 3.24Å; S331-F334 PolarHBondContact O-N 3.08Å; F334-G337 PolarHBondContact O-N 3.38Å; F334-A338 VanDerWaalsContact O-CB 3.31Å; F334-A338 WeakPolarHBondContact O-CB 3.29Å; F334-A338 PolarHBondContact O-N 3.4Å; F334-L343 HydrophobicContact CD1-CD1 3.98Å; F334-L347 HydrophobicContact CD1-CB 4.12Å; F334-L347 HydrophobicContact CD1-CD1 3.92Å; F334-L347 HydrophobicContact CD1-CG 4.47Å; F334-L347 HydrophobicContact CE1-CD1 4.13Å; F334-A360 HydrophobicContact CB-CB 3.95Å; F334-A360 HydrophobicContact CD2-CB 3.84Å; F334-A360 HydrophobicContact CG-CB 3.86Å; F334-F363 AromaticContact CE1-CD1 3.73Å; F334-F363 HydrophobicContact CE1-CD1 3.73Å; F334-F363 HydrophobicContact CE1-CE1 4.22Å; F334-F363 HydrophobicContact CE1-CG 4.48Å; F334-F363 AromaticContact CZ-CD1 3.7Å; F334-F363 HydrophobicContact CZ-CD1 3.7Å; F334-F363 HydrophobicContact CZ-CE1 4.28Å; F334-T364 HydrophobicContact CD2-CG2 4.4Å; F334-T364 HydrophobicContact CE2-CG2 3.25Å; F334-T364 HydrophobicContact CZ-CG2 3.53Å |
| 335 | F | 78.6 | Confident | 82.1 | Confident | 80 Ų | 80 | 38 Ų | 38 | 35% | 0.351 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -60.5 | -50.1 | 177.1 | -173.2 | -104.1 | 0 | 0 | 0 | 112 | S331 R332 L333 G337 A338 R339 A348 P489 | S331-F335 PolarHBondContact O-N 2.76Å; S331-F335 VanDerWaalsContact O-N 3.12Å; R332-F335 PolarHBondContact O-N 3.45Å; L333-F335 VanDerWaalsContact C-N 3.28Å; L333-F335 PolarHBondContact O-N 2.93Å; F335-G337 PolarHBondContact O-N 2.72Å; F335-A338 PolarHBondContact O-N 3.13Å; F335-R339 WeakPolarHBondContact O-CB 3.47Å; F335-R339 PolarHBondContact O-N 3.16Å; F335-A348 HydrophobicContact CD2-CB 3.94Å; F335-A348 HydrophobicContact CE2-CB 4.45Å; F335-P489 HydrophobicContact CE2-CG 3.51Å; F335-P489 HydrophobicContact CZ-CG 4.14Å |
| 336 | A | 80.1 | Confident | 82.4 | Confident | 14 Ų | 14 | 38.4 Ų | 38.4 | 12% | 0.116 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.5 | -43.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | R332 L333 E340 | R332-A336 PolarHBondContact O-N 3.07Å; R332-A336 VanDerWaalsContact O-N 3.07Å; L333-A336 PolarHBondContact O-N 3.06Å; A336-E340 WeakPolarHBondContact O-CG 3.45Å; A336-E340 PolarHBondContact O-N 2.77Å |
| 337 | G | 84.1 | Confident | 82.5 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -67.8 | -36.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | L333 F334 F335 H342 L343 | L333-G337 PolarHBondContact O-N 3.08Å; F334-G337 PolarHBondContact O-N 3.38Å; F335-G337 PolarHBondContact O-N 2.72Å; G337-H342 WeakPolarHBondContact O-CB 3.42Å; G337-H342 PolarHBondContact O-N 3.5Å; G337-H342 VanDerWaalsContact O-N 3.09Å; G337-L343 PolarHBondContact O-N 2.77Å |
| 338 | A | 84.4 | Confident | 82.4 | Confident | 9 Ų | 9 | 38.9 Ų | 38.9 | 7% | 0.074 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -76.7 | -34.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F334 F335 E340 G341 L343 A348 | F334-A338 VanDerWaalsContact O-CB 3.31Å; F334-A338 WeakPolarHBondContact O-CB 3.29Å; F334-A338 PolarHBondContact O-N 3.4Å; F335-A338 PolarHBondContact O-N 3.13Å; A338-E340 PolarHBondContact O-N 3.36Å; A338-G341 PolarHBondContact O-N 2.79Å; A338-L343 HydrophobicContact CB-CB 4.11Å; A338-A348 HydrophobicContact CB-CB 3.48Å; A338-A348 VanDerWaalsContact CB-CB 3.48Å |
| 339 | R | 80.9 | Confident | 82.8 | Confident | 156 Ų | 156 | 35.9 Ų | 35.9 | 59% | 0.589 | 19% | 0.19 | S | C | * | . | H | α-helix | trans | -58.4 | -35 | 173.6 | -170.3 | 178.8 | -170.2 | -164.7 | 1.4 | 112.1 | F335 G341 E491 | F335-R339 WeakPolarHBondContact O-CB 3.47Å; F335-R339 PolarHBondContact O-N 3.16Å; R339-G341 VanDerWaalsContact C-N 3.26Å; R339-G341 PolarHBondContact O-N 2.83Å; R339-E491 IonicContact CZ-OE1 2.58Å; R339-E491 IonicContact NE-OE1 3.65Å; R339-E491 PolarHBondContact NE-OE1 3.09Å; R339-E491 VanDerWaalsContact NE-OE1 3.13Å; R339-E491 IonicContact NH2-OE1 3.79Å; R339-E491 PolarHBondContact NH2-OE1 3.29Å |
| 340 | E | 82.3 | Confident | 83.2 | Confident | 91 Ų | 91 | 36.7 Ų | 36.7 | 43% | 0.425 | 19% | 0.193 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.7 | 6.1 | 179.4 | -68.4 | -72.9 | -167.9 | 0 | 0 | 113.7 | Y100 K104 A336 A338 H342 | Y100-E340 HydrophobicContact CE1-CG 4.1Å; Y100-E340 VanDerWaalsContact OH-CB 3.25Å; Y100-E340 WeakPolarHBondContact OH-CB 3.44Å; K104-E340 IonicContact NZ-OE1 2.79Å; K104-E340 IonicContact NZ-OE2 2.76Å; K104-E340 PolarHBondContact NZ-OE2 2.56Å; A336-E340 WeakPolarHBondContact O-CG 3.45Å; A336-E340 PolarHBondContact O-N 2.77Å; A338-E340 PolarHBondContact O-N 3.36Å; E340-H342 PolarHBondContact O-CD2 3.15Å; E340-H342 PolarHBondContact O-N 3.44Å |
| 341 | G | 82.1 | Confident | 83.3 | Confident | 51 Ų | 51 | 38 Ų | 38 | 53% | 0.526 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 72.8 | 6.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | A338 R339 | A338-G341 PolarHBondContact O-N 2.79Å; R339-G341 VanDerWaalsContact C-N 3.26Å; R339-G341 PolarHBondContact O-N 2.83Å |
| 342 | H | 84.1 | Confident | 83.4 | Confident | 18 Ų | 18 | 39.6 Ų | 39.6 | 8% | 0.083 | 21% | 0.208 | C | C | . | . | S | Bend | trans | -82.6 | -23.6 | -179.3 | -72.7 | -161.8 | 0 | 0 | 0 | 112.8 | Y100 G109 F113 L116 G337 E340 | Y100-H342 AromaticContact CE2-ND1 3.68Å; Y100-H342 AromaticContact CZ-ND1 3.79Å; Y100-H342 PolarHBondContact OH-CE1 3.2Å; Y100-H342 VanDerWaalsContact OH-CE1 3.28Å; Y100-H342 PolarHBondContact OH-ND1 2.91Å; G109-H342 PolarHBondContact O-CE1 3.36Å; F113-H342 HydrophobicContact CD2-CB 3.97Å; F113-H342 WeakPolarHBondContact CE2-O 3.29Å; L116-H342 HydrophobicContact CD2-CB 3.85Å; G337-H342 WeakPolarHBondContact O-CB 3.42Å; G337-H342 PolarHBondContact O-N 3.5Å; G337-H342 VanDerWaalsContact O-N 3.09Å; E340-H342 PolarHBondContact O-CD2 3.15Å; E340-H342 PolarHBondContact O-N 3.44Å |
| 343 | L | 85 | Confident | 83.4 | Confident | 27 Ų | 27 | 44 Ų | 44 | 14% | 0.141 | 23% | 0.23 | C | C | . | . | S | Bend | trans | -121.5 | 154.3 | 177.1 | -73.5 | 169.8 | 0 | 0 | 0 | 111 | L116 F334 G337 A338 S345 L347 | L116-L343 HydrophobicContact CD1-CD1 4.14Å; L116-L343 HydrophobicContact CD2-CD1 3.77Å; L116-L343 HydrophobicContact CD2-CG 3.82Å; L116-L343 HydrophobicContact CG-CD1 4.11Å; L116-L343 HydrophobicContact CG-CG 4.49Å; F334-L343 HydrophobicContact CD1-CD1 3.98Å; G337-L343 PolarHBondContact O-N 2.77Å; A338-L343 HydrophobicContact CB-CB 4.11Å; L343-S345 PolarHBondContact O-N 2.86Å; L343-L347 HydrophobicContact CD2-CD1 4.35Å |
| 344 | P | 85 | Confident | 83.1 | Confident | 60 Ų | 60 | 49.7 Ų | 49.7 | 39% | 0.39 | 25% | 0.251 | S | S | . | . | trans | -55.3 | 137.9 | 174.1 | -24.4 | 33.5 | 0 | 0 | 0 | 112.1 | L346 L347 | P344-L346 PolarHBondContact O-N 3.39Å; P344-L346 VanDerWaalsContact O-N 3.11Å; P344-L347 PolarHBondContact O-N 3.3Å | ||
| 345 | S | 84 | Confident | 82.9 | Confident | 53 Ų | 53 | 52.2 Ų | 52.2 | 37% | 0.371 | 27% | 0.268 | S | S | . | . | G | 310 helix | trans | -57.5 | -29.7 | -177.9 | 57.8 | 0 | 0 | 0 | 0 | 113.2 | L343 L347 A348 M349 | L343-S345 PolarHBondContact O-N 2.86Å; S345-L347 PolarHBondContact O-N 3.03Å; S345-A348 PolarHBondContact O-N 3.12Å; S345-M349 WeakPolarHBondContact O-CG 3.32Å |
| 346 | L | 85.9 | Confident | 83.1 | Confident | 23 Ų | 23 | 48.4 Ų | 48.4 | 12% | 0.12 | 25% | 0.252 | C | S | . | . | G | 310 helix | trans | -53 | -36 | 175.3 | -177.9 | 63.2 | 0 | 0 | 0 | 112.8 | P344 A348 M349 P359 T477 V486 | P344-L346 PolarHBondContact O-N 3.39Å; P344-L346 VanDerWaalsContact O-N 3.11Å; L346-A348 VanDerWaalsContact C-N 3.29Å; L346-A348 PolarHBondContact O-N 2.82Å; L346-M349 HydrophobicContact CD1-SD 3.97Å; L346-M349 PolarHBondContact O-N 2.87Å; L346-P359 HydrophobicContact CD1-CG 4.24Å; L346-P359 HydrophobicContact CG-CB 4.22Å; L346-P359 HydrophobicContact CG-CG 4.44Å; L346-P359 WeakPolarHBondContact O-CB 3.37Å; L346-T477 HydrophobicContact CB-CG2 4.35Å; L346-V486 HydrophobicContact CD1-CG2 4.45Å |
| 347 | L | 85.6 | Confident | 83.4 | Confident | 21 Ų | 21 | 49 Ų | 49 | 11% | 0.11 | 25% | 0.254 | C | S | . | . | G | 310 helix | trans | -74.4 | -17.1 | -177.7 | -64.1 | 178.2 | 0 | 0 | 0 | 113.4 | F334 L343 P344 S345 P359 F363 | F334-L347 HydrophobicContact CD1-CB 4.12Å; F334-L347 HydrophobicContact CD1-CD1 3.92Å; F334-L347 HydrophobicContact CD1-CG 4.47Å; F334-L347 HydrophobicContact CE1-CD1 4.13Å; L343-L347 HydrophobicContact CD2-CD1 4.35Å; P344-L347 PolarHBondContact O-N 3.3Å; S345-L347 PolarHBondContact O-N 3.03Å; L347-P359 HydrophobicContact CD2-CB 4.46Å; L347-F363 HydrophobicContact CD2-CB 4.08Å; L347-F363 HydrophobicContact CD2-CG 4.42Å |
| 348 | A | 82.6 | Confident | 83.7 | Confident | 2 Ų | 2 | 50 Ų | 50 | 2% | 0.017 | 26% | 0.259 | C | S | . | . | G | 310 helix | trans | -92.9 | -3.3 | 173 | 0 | 0 | 0 | 0 | 0 | 113.9 | F335 A338 S345 L346 Y488 | F335-A348 HydrophobicContact CD2-CB 3.94Å; F335-A348 HydrophobicContact CE2-CB 4.45Å; A338-A348 HydrophobicContact CB-CB 3.48Å; A338-A348 VanDerWaalsContact CB-CB 3.48Å; S345-A348 PolarHBondContact O-N 3.12Å; L346-A348 VanDerWaalsContact C-N 3.29Å; L346-A348 PolarHBondContact O-N 2.82Å; A348-Y488 HydrophobicContact CB-CE2 3.79Å |
| 349 | M | 85.3 | Confident | 84 | Confident | 5 Ų | 5 | 50.1 Ų | 50.1 | 3% | 0.025 | 26% | 0.26 | C | S | . | . | trans | -75.6 | 147.9 | -176.1 | -62.2 | -176.5 | -174.7 | 0 | 0 | 112.6 | S345 L346 T477 Q481 V486 V487 Y488 | S345-M349 WeakPolarHBondContact O-CG 3.32Å; L346-M349 HydrophobicContact CD1-SD 3.97Å; L346-M349 PolarHBondContact O-N 2.87Å; M349-T477 HydrophobicContact CE-CG2 3.54Å; M349-Q481 HydrophobicContact CE-CG 4.06Å; M349-Q481 HydrophobicContact SD-CG 3.34Å; M349-Q481 WeakPolarHBondContact SD-CG 3.37Å; M349-Q481 PolarHBondContact SD-NE2 2.97Å; M349-V486 HydrophobicContact CB-CB 3.85Å; M349-V486 HydrophobicContact CB-CG2 3.74Å; M349-V486 HydrophobicContact SD-CG2 4.16Å; M349-V487 CarbonylContact C-O 3.45Å; M349-V487 WeakPolarHBondContact CA-O 3.22Å; M349-V487 WeakPolarHBondContact CB-O 3.2Å; M349-Y488 HydrophobicContact CE-CD2 4.47Å; M349-Y488 HydrophobicContact CG-CD2 4.12Å | ||
| 350 | I | 86.3 | Confident | 84.4 | Confident | 39 Ų | 39 | 42.7 Ų | 42.7 | 20% | 0.2 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 143.4 | -173.1 | -54.4 | -176.2 | 0 | 0 | 0 | 109.6 | C355 V486 V487 P489 | I350-C355 HydrophobicContact CG2-CB 4.34Å; I350-V486 WeakPolarHBondContact O-CA 3.49Å; I350-V487 PolarHBondContact N-O 3.22Å; I350-V487 PolarHBondContact O-N 2.89Å; I350-P489 HydrophobicContact CD1-CB 4.04Å; I350-P489 HydrophobicContact CD1-CG 3.95Å; I350-P489 HydrophobicContact CG1-CG 4.32Å |
| 351 | H | 86.8 | Confident | 84.8 | Confident | 27 Ų | 27 | 38.6 Ų | 38.6 | 13% | 0.125 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 129.6 | 178.3 | -177 | -80.9 | 0 | 0 | 0 | 112.7 | K353 R354 C355 T356 I358 C484 V485 V486 | H351-K353 PolarHBondContact ND1-N 3.43Å; H351-K353 VanDerWaalsContact ND1-N 3.19Å; H351-K353 PolarHBondContact O-N 3.03Å; H351-R354 HydrophobicContact CB-CB 4.34Å; H351-R354 PolarHBondContact ND1-N 3.48Å; H351-R354 PolarHBondContact O-N 3.31Å; H351-C355 PolarHBondContact O-N 3.43Å; H351-T356 WeakPolarHBondContact CB-O 3.08Å; H351-T356 PolarHBondContact N-O 2.83Å; H351-I358 HydrophobicContact CB-CD1 3.79Å; H351-I358 HydrophobicContact CB-CG1 4.26Å; H351-C484 PolarHBondContact CD2-O 3.18Å; H351-V485 PolarHBondContact CD2-O 3.38Å; H351-V486 HydrophobicContact CB-CG1 4.27Å |
| 352 | V | 82.3 | Confident | 85.3 | Confident | 52 Ų | 52 | 40.4 Ų | 40.4 | 32% | 0.315 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -53.6 | -45 | -170.8 | -176.6 | 0 | 0 | 0 | 0 | 113.7 | V485 V487 A523 | V352-V485 HydrophobicContact CG2-CG1 4.43Å; V352-V485 PolarHBondContact N-O 3.25Å; V352-V487 HydrophobicContact CG2-CB 4.4Å; V352-V487 HydrophobicContact CG2-CG1 3.72Å; V352-V487 HydrophobicContact CG2-CG2 3.85Å; V352-A523 HydrophobicContact CG1-CB 4.49Å; V352-A523 WeakPolarHBondContact O-CB 3.39Å |
| 353 | K | 79.2 | Confident | 85.7 | Confident | 192 Ų | 192 | 42.9 Ų | 42.9 | 84% | 0.835 | 22% | 0.22 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -16.7 | -175.8 | -59.6 | -175.2 | 177.5 | 179.6 | 0 | 115 | H351 | H351-K353 PolarHBondContact ND1-N 3.43Å; H351-K353 VanDerWaalsContact ND1-N 3.19Å; H351-K353 PolarHBondContact O-N 3.03Å |
| 354 | R | 75.7 | Confident | 86 | Confident | 123 Ų | 123 | 41.6 Ų | 41.6 | 46% | 0.464 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -117.6 | -12.9 | -164.9 | -67.5 | 175.1 | 179.8 | -171.8 | 1.9 | 112.7 | C170 S171 H351 T356 | C170-R354 PolarHBondContact O-NH1 3.2Å; S171-R354 VanDerWaalsContact O-CD 3.31Å; S171-R354 WeakPolarHBondContact O-CD 3.42Å; H351-R354 HydrophobicContact CB-CB 4.34Å; H351-R354 PolarHBondContact ND1-N 3.48Å; H351-R354 PolarHBondContact O-N 3.31Å; R354-T356 HydrophobicContact CB-CG2 4.13Å; R354-T356 PolarHBondContact O-N 3.03Å |
| 355 | C | 80.9 | Confident | 86.4 | Confident | 53 Ų | 53 | 39.1 Ų | 39.1 | 36% | 0.358 | 20% | 0.197 | S | C | . | . | trans | 52.5 | 33.6 | -172.9 | -52.1 | 0 | 0 | 0 | 0 | 112.3 | I350 H351 C525 | I350-C355 HydrophobicContact CG2-CB 4.34Å; H351-C355 PolarHBondContact O-N 3.43Å; C355-C525 HydrophobicContact CB-CB 4.15Å; C355-C525 WeakPolarHBondContact CB-SG 3.33Å; C355-C525 WeakPolarHBondContact SG-CB 3.02Å; C355-C525 CovalentContact SG-SG 2.06Å; C355-C525 PolarHBondContact SG-SG 3.48Å | ||
| 356 | T | 82.8 | Confident | 86.8 | Confident | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | trans | -110 | 134.2 | -178.7 | 50.6 | 0 | 0 | 0 | 0 | 112.4 | N169 C170 V173 H351 R354 I358 | N169-T356 VanDerWaalsContact O-CG2 3.31Å; N169-T356 WeakPolarHBondContact O-CG2 3.4Å; C170-T356 PolarHBondContact O-OG1 3.26Å; V173-T356 HydrophobicContact CG2-CG2 3.56Å; H351-T356 WeakPolarHBondContact CB-O 3.08Å; H351-T356 PolarHBondContact N-O 2.83Å; R354-T356 HydrophobicContact CB-CG2 4.13Å; R354-T356 PolarHBondContact O-N 3.03Å; T356-I358 PolarHBondContact O-N 3.05Å | ||
| 357 | P | 87.3 | Confident | 87.1 | Confident | 26 Ų | 26 | 41.2 Ų | 41.2 | 17% | 0.169 | 21% | 0.205 | C | C | . | . | trans | -83.2 | 78.1 | 179.9 | 32.6 | -33.3 | 0 | 0 | 0 | 112.1 | A360 L361 | P357-A360 HydrophobicContact CB-CB 4.36Å; P357-L361 WeakPolarHBondContact O-CG 3.26Å; P357-L361 PolarHBondContact O-N 2.9Å | ||
| 358 | I | 88.9 | Confident | 87.5 | Confident | 22 Ų | 22 | 40.3 Ų | 40.3 | 11% | 0.113 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.6 | -47.9 | -173.7 | -60 | 174.7 | 0 | 0 | 0 | 113 | C170 H351 T356 A360 L361 L362 C484 V486 | C170-I358 HydrophobicContact CB-CG1 4.38Å; H351-I358 HydrophobicContact CB-CD1 3.79Å; H351-I358 HydrophobicContact CB-CG1 4.26Å; T356-I358 PolarHBondContact O-N 3.05Å; I358-A360 VanDerWaalsContact C-N 3.33Å; I358-A360 PolarHBondContact O-N 2.75Å; I358-L361 PolarHBondContact O-N 2.87Å; I358-L362 HydrophobicContact CG2-CD1 3.83Å; I358-L362 HydrophobicContact CG2-CG 4.1Å; I358-L362 WeakPolarHBondContact O-CG 3.3Å; I358-L362 PolarHBondContact O-N 3.47Å; I358-C484 HydrophobicContact CG2-CB 4.38Å; I358-V486 HydrophobicContact CB-CG1 4.4Å |
| 359 | P | 90.5 | Very high | 87.9 | Confident | 12 Ų | 12 | 42.5 Ų | 42.5 | 8% | 0.078 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.1 | -38.3 | -175.9 | -23.7 | 35.4 | 0 | 0 | 0 | 113 | L346 L347 L362 F363 V486 | L346-P359 HydrophobicContact CD1-CG 4.24Å; L346-P359 HydrophobicContact CG-CB 4.22Å; L346-P359 HydrophobicContact CG-CG 4.44Å; L346-P359 WeakPolarHBondContact O-CB 3.37Å; L347-P359 HydrophobicContact CD2-CB 4.46Å; P359-L362 PolarHBondContact O-N 3.23Å; P359-F363 WeakPolarHBondContact O-CB 3.4Å; P359-F363 PolarHBondContact O-N 3.25Å; P359-V486 HydrophobicContact CG-CG1 4.35Å; P359-V486 HydrophobicContact CG-CG2 4.03Å |
| 360 | A | 89.1 | Confident | 88.2 | Confident | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.2 | -45.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | F334 P357 I358 L362 F363 T364 | F334-A360 HydrophobicContact CB-CB 3.95Å; F334-A360 HydrophobicContact CD2-CB 3.84Å; F334-A360 HydrophobicContact CG-CB 3.86Å; P357-A360 HydrophobicContact CB-CB 4.36Å; I358-A360 VanDerWaalsContact C-N 3.33Å; I358-A360 PolarHBondContact O-N 2.75Å; A360-L362 VanDerWaalsContact C-N 3.35Å; A360-F363 PolarHBondContact O-N 2.97Å; A360-T364 PolarHBondContact O-N 2.84Å; A360-T364 PolarHBondContact O-OG1 3.34Å |
| 361 | L | 90.8 | Very high | 88.2 | Confident | 4 Ų | 4 | 47.7 Ų | 47.7 | 2% | 0.021 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -66.4 | -35.7 | 179 | -68.3 | 174.3 | 0 | 0 | 0 | 112.5 | T166 N169 L327 P357 I358 T364 C365 | T166-L361 HydrophobicContact CG2-CB 4.31Å; N169-L361 HydrophobicContact CB-CD1 3.88Å; N169-L361 HydrophobicContact CB-CD2 4.49Å; L327-L361 HydrophobicContact CB-CD2 4.17Å; L327-L361 HydrophobicContact CD2-CD2 4.22Å; P357-L361 WeakPolarHBondContact O-CG 3.26Å; P357-L361 PolarHBondContact O-N 2.9Å; I358-L361 PolarHBondContact O-N 2.87Å; L361-T364 WeakPolarHBondContact CA-OG1 3.28Å; L361-T364 PolarHBondContact O-OG1 2.98Å; L361-C365 WeakPolarHBondContact O-CB 3.43Å; L361-C365 PolarHBondContact O-N 3.41Å |
| 362 | L | 92.5 | Very high | 88.2 | Confident | 89 Ų | 89 | 46.9 Ų | 46.9 | 47% | 0.466 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -68.9 | -41.1 | 174.7 | -69.3 | 178.5 | 0 | 0 | 0 | 111.6 | I358 P359 A360 C365 L366 | I358-L362 HydrophobicContact CG2-CD1 3.83Å; I358-L362 HydrophobicContact CG2-CG 4.1Å; I358-L362 WeakPolarHBondContact O-CG 3.3Å; I358-L362 PolarHBondContact O-N 3.47Å; P359-L362 PolarHBondContact O-N 3.23Å; A360-L362 VanDerWaalsContact C-N 3.35Å; L362-C365 PolarHBondContact O-N 2.9Å; L362-L366 WeakPolarHBondContact O-CB 3.48Å; L362-L366 PolarHBondContact O-N 2.8Å |
| 363 | F | 92.4 | Very high | 88.2 | Confident | 71 Ų | 71 | 48.7 Ų | 48.7 | 31% | 0.311 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63.1 | -45.1 | 177.7 | -177.7 | -88 | 0 | 0 | 0 | 111.9 | V120 L121 F334 L347 P359 A360 S367 | V120-F363 HydrophobicContact CG1-CD1 4.12Å; V120-F363 HydrophobicContact CG1-CE1 3.42Å; V120-F363 VanDerWaalsContact CG1-CE1 3.42Å; V120-F363 HydrophobicContact CG1-CZ 4.28Å; L121-F363 HydrophobicContact CD2-CE1 4.13Å; L121-F363 HydrophobicContact CD2-CZ 3.84Å; F334-F363 AromaticContact CE1-CD1 3.73Å; F334-F363 HydrophobicContact CE1-CD1 3.73Å; F334-F363 HydrophobicContact CE1-CE1 4.22Å; F334-F363 HydrophobicContact CE1-CG 4.48Å; F334-F363 AromaticContact CZ-CD1 3.7Å; F334-F363 HydrophobicContact CZ-CD1 3.7Å; F334-F363 HydrophobicContact CZ-CE1 4.28Å; L347-F363 HydrophobicContact CD2-CB 4.08Å; L347-F363 HydrophobicContact CD2-CG 4.42Å; P359-F363 WeakPolarHBondContact O-CB 3.4Å; P359-F363 PolarHBondContact O-N 3.25Å; A360-F363 PolarHBondContact O-N 2.97Å; F363-S367 WeakPolarHBondContact O-CB 3.44Å; F363-S367 PolarHBondContact O-N 3.45Å; F363-S367 PolarHBondContact O-OG 2.65Å |
| 364 | T | 91.6 | Very high | 87.8 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -65.3 | -45.1 | 175.6 | 48.9 | 0 | 0 | 0 | 0 | 111.4 | F334 A360 L361 L366 S367 T368 | F334-T364 HydrophobicContact CD2-CG2 4.4Å; F334-T364 HydrophobicContact CE2-CG2 3.25Å; F334-T364 HydrophobicContact CZ-CG2 3.53Å; A360-T364 PolarHBondContact O-N 2.84Å; A360-T364 PolarHBondContact O-OG1 3.34Å; L361-T364 WeakPolarHBondContact CA-OG1 3.28Å; L361-T364 PolarHBondContact O-OG1 2.98Å; T364-L366 PolarHBondContact O-N 2.89Å; T364-S367 PolarHBondContact O-N 3.44Å; T364-T368 WeakPolarHBondContact O-CB 3.02Å; T364-T368 PolarHBondContact O-N 2.72Å; T364-T368 PolarHBondContact O-OG1 2.88Å |
| 365 | C | 93.6 | Very high | 87.1 | Confident | 7 Ų | 7 | 40.6 Ų | 40.6 | 5% | 0.047 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.4 | -48.4 | 177.1 | -173.1 | 0 | 0 | 0 | 0 | 111.8 | T166 L361 L362 S367 T368 L369 | T166-C365 HydrophobicContact CG2-CB 3.84Å; T166-C365 PolarHBondContact OG1-SG 3.15Å; L361-C365 WeakPolarHBondContact O-CB 3.43Å; L361-C365 PolarHBondContact O-N 3.41Å; L362-C365 PolarHBondContact O-N 2.9Å; C365-S367 PolarHBondContact O-N 2.86Å; C365-T368 PolarHBondContact O-N 3.11Å; C365-L369 WeakPolarHBondContact O-CG 3.38Å; C365-L369 PolarHBondContact O-N 3.15Å |
| 366 | L | 93.6 | Very high | 86.8 | Confident | 107 Ų | 107 | 42.5 Ų | 42.5 | 56% | 0.56 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -60.8 | -45.5 | 177.5 | -178.7 | 62.2 | 0 | 0 | 0 | 111.7 | L362 T364 T368 L369 L370 | L362-L366 WeakPolarHBondContact O-CB 3.48Å; L362-L366 PolarHBondContact O-N 2.8Å; T364-L366 PolarHBondContact O-N 2.89Å; L366-T368 VanDerWaalsContact C-N 3.32Å; L366-T368 PolarHBondContact O-N 3.24Å; L366-L369 PolarHBondContact O-N 2.86Å; L366-L370 WeakPolarHBondContact O-CG 3.39Å; L366-L370 PolarHBondContact O-N 3.39Å; L366-L370 VanDerWaalsContact O-N 3.07Å |
| 367 | S | 91.9 | Very high | 86.5 | Confident | 14 Ų | 14 | 43.1 Ų | 43.1 | 10% | 0.098 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.9 | -39.8 | 178.2 | -56.6 | 0 | 0 | 0 | 0 | 111.7 | F363 T364 C365 L370 M371 | F363-S367 WeakPolarHBondContact O-CB 3.44Å; F363-S367 PolarHBondContact O-N 3.45Å; F363-S367 PolarHBondContact O-OG 2.65Å; T364-S367 PolarHBondContact O-N 3.44Å; C365-S367 PolarHBondContact O-N 2.86Å; S367-L370 PolarHBondContact O-N 2.87Å; S367-M371 WeakPolarHBondContact O-CG 3.46Å; S367-M371 PolarHBondContact O-N 3.32Å |
| 368 | T | 92.8 | Very high | 86 | Confident | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.006 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -66.8 | -40 | 176.8 | -57.5 | 0 | 0 | 0 | 0 | 111.3 | P125 Q128 A129 L162 T364 C365 L366 L370 M371 L372 | P125-T368 VanDerWaalsContact CA-OG1 3.31Å; P125-T368 WeakPolarHBondContact CA-OG1 3.37Å; P125-T368 WeakPolarHBondContact O-CG2 3.47Å; Q128-T368 HydrophobicContact CB-CG2 3.64Å; Q128-T368 PolarHBondContact OE1-OG1 3.47Å; A129-T368 HydrophobicContact CB-CG2 4.1Å; L162-T368 HydrophobicContact CD1-CG2 3.96Å; L162-T368 HydrophobicContact CD2-CG2 3.46Å; L162-T368 VanDerWaalsContact CD2-CG2 3.46Å; L162-T368 HydrophobicContact CG-CG2 4.34Å; T364-T368 WeakPolarHBondContact O-CB 3.02Å; T364-T368 PolarHBondContact O-N 2.72Å; T364-T368 PolarHBondContact O-OG1 2.88Å; C365-T368 PolarHBondContact O-N 3.11Å; L366-T368 VanDerWaalsContact C-N 3.32Å; L366-T368 PolarHBondContact O-N 3.24Å; T368-L370 VanDerWaalsContact C-N 3.31Å; T368-L370 PolarHBondContact O-N 3.37Å; T368-M371 PolarHBondContact O-N 2.82Å; T368-L372 WeakPolarHBondContact O-CB 3.35Å; T368-L372 PolarHBondContact O-N 3.41Å |
| 369 | L | 92.4 | Very high | 85.6 | Confident | 48 Ų | 48 | 45.1 Ų | 45.1 | 25% | 0.251 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -63 | -37.8 | 175.3 | -72.1 | 174.6 | 0 | 0 | 0 | 112.1 | A159 L162 L163 C365 L366 L372 C373 | A159-L369 HydrophobicContact CB-CD2 3.83Å; L162-L369 HydrophobicContact CD2-CD2 3.91Å; L162-L369 HydrophobicContact CD2-CG 3.99Å; L163-L369 HydrophobicContact CD2-CD1 4.25Å; C365-L369 WeakPolarHBondContact O-CG 3.38Å; C365-L369 PolarHBondContact O-N 3.15Å; L366-L369 PolarHBondContact O-N 2.86Å; L369-L372 HydrophobicContact CD2-CD2 4.46Å; L369-L372 WeakPolarHBondContact O-CB 3.34Å; L369-L372 PolarHBondContact O-N 3.13Å; L369-C373 PolarHBondContact O-N 3.24Å; L369-C373 PolarHBondContact O-SG 3.28Å |
| 370 | L | 90.7 | Very high | 85.1 | Confident | 113 Ų | 113 | 45 Ų | 45 | 59% | 0.592 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -62.9 | -46.7 | 173 | -68.6 | 174 | 0 | 0 | 0 | 111 | L366 S367 T368 L372 C373 T374 | L366-L370 WeakPolarHBondContact O-CG 3.39Å; L366-L370 PolarHBondContact O-N 3.39Å; L366-L370 VanDerWaalsContact O-N 3.07Å; S367-L370 PolarHBondContact O-N 2.87Å; T368-L370 VanDerWaalsContact C-N 3.31Å; T368-L370 PolarHBondContact O-N 3.37Å; L370-L372 VanDerWaalsContact C-N 3.29Å; L370-L372 PolarHBondContact O-N 3.38Å; L370-C373 WeakPolarHBondContact O-CB 3.48Å; L370-C373 PolarHBondContact O-N 3.36Å; L370-C373 VanDerWaalsContact O-N 3.15Å; L370-T374 PolarHBondContact O-OG1 3Å |
| 371 | M | 87 | Confident | 84.7 | Confident | 40 Ų | 40 | 45 Ų | 45 | 20% | 0.197 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.3 | -35.7 | 176.8 | -69.2 | -60 | -177.9 | 0 | 0 | 112.5 | L121 P125 A129 S367 T368 C373 T374 | L121-M371 VanDerWaalsContact O-CE 3.29Å; L121-M371 WeakPolarHBondContact O-CE 3.24Å; P125-M371 HydrophobicContact CB-CG 4Å; A129-M371 HydrophobicContact CB-CB 4.28Å; S367-M371 WeakPolarHBondContact O-CG 3.46Å; S367-M371 PolarHBondContact O-N 3.32Å; T368-M371 PolarHBondContact O-N 2.82Å; M371-C373 PolarHBondContact O-N 3.31Å; M371-T374 WeakPolarHBondContact CA-OG1 3.44Å; M371-T374 PolarHBondContact O-N 3.28Å; M371-T374 VanDerWaalsContact O-N 3.12Å; M371-T374 PolarHBondContact O-OG1 2.88Å |
| 372 | L | 86.5 | Confident | 84.3 | Confident | 10 Ų | 10 | 45.2 Ų | 45.2 | 5% | 0.052 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65.7 | -26 | 177.4 | -165.6 | 73.3 | 0 | 0 | 0 | 113.2 | A129 L133 R155 A158 A159 T368 L369 L370 | A129-L372 HydrophobicContact CB-CD1 4.37Å; L133-L372 HydrophobicContact CD1-CD1 4.14Å; L133-L372 HydrophobicContact CD2-CD1 3.65Å; L133-L372 HydrophobicContact CG-CD1 3.6Å; R155-L372 WeakPolarHBondContact O-CD2 3.38Å; A158-L372 HydrophobicContact CB-CD1 3.87Å; A158-L372 HydrophobicContact CB-CD2 4.07Å; A159-L372 HydrophobicContact CB-CD2 3.8Å; T368-L372 WeakPolarHBondContact O-CB 3.35Å; T368-L372 PolarHBondContact O-N 3.41Å; L369-L372 HydrophobicContact CD2-CD2 4.46Å; L369-L372 WeakPolarHBondContact O-CB 3.34Å; L369-L372 PolarHBondContact O-N 3.13Å; L370-L372 VanDerWaalsContact C-N 3.29Å; L370-L372 PolarHBondContact O-N 3.38Å |
| 373 | C | 81.8 | Confident | 83.7 | Confident | 91 Ų | 91 | 42.1 Ų | 42.1 | 62% | 0.615 | 23% | 0.233 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -76 | -16 | 176 | -64.6 | 0 | 0 | 0 | 0 | 112.6 | L369 L370 M371 | L369-C373 PolarHBondContact O-N 3.24Å; L369-C373 PolarHBondContact O-SG 3.28Å; L370-C373 WeakPolarHBondContact O-CB 3.48Å; L370-C373 PolarHBondContact O-N 3.36Å; L370-C373 VanDerWaalsContact O-N 3.15Å; M371-C373 PolarHBondContact O-N 3.31Å |
| 374 | T | 70.8 | Confident | 83.3 | Confident | 69 Ų | 69 | 38.8 Ų | 38.8 | 42% | 0.423 | 22% | 0.218 | S | C | . | . | S | Bend | trans | -109.7 | 136.8 | -173.5 | 29.4 | 0 | 0 | 0 | 0 | 112.4 | L370 M371 L380 | L370-T374 PolarHBondContact O-OG1 3Å; M371-T374 WeakPolarHBondContact CA-OG1 3.44Å; M371-T374 PolarHBondContact O-N 3.28Å; M371-T374 VanDerWaalsContact O-N 3.12Å; M371-T374 PolarHBondContact O-OG1 2.88Å; T374-L380 WeakPolarHBondContact O-CD1 3.42Å |
| 375 | S | 60.7 | Low | 83 | Confident | 76 Ų | 76 | 38.9 Ų | 38.9 | 53% | 0.531 | 22% | 0.219 | S | C | . | . | S | Bend | trans | 60.7 | 172 | 161 | -55 | 0 | 0 | 0 | 0 | 117.7 | ||
| 376 | D | 74.8 | Confident | 82.7 | Confident | 93 Ų | 93 | 38.7 Ų | 38.7 | 50% | 0.497 | 22% | 0.218 | S | C | . | . | trans | -78.3 | 149.5 | 176.7 | 177.2 | 47.1 | 0 | 0 | 0 | 111.9 | Y378 T379 L380 | D376-Y378 VanDerWaalsContact C-N 3.31Å; D376-Y378 PolarHBondContact O-N 3.17Å; D376-Y378 PolarHBondContact OD2-N 2.63Å; D376-T379 PolarHBondContact O-N 3.11Å; D376-L380 WeakPolarHBondContact O-CD1 3.21Å; D376-L380 PolarHBondContact O-N 2.9Å; D376-L380 VanDerWaalsContact O-N 3.07Å | ||
| 377 | M | 76.9 | Confident | 82.4 | Confident | 13 Ų | 13 | 33.6 Ų | 33.6 | 6% | 0.064 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -57.6 | -39.5 | -175.6 | -178.8 | 179.1 | 163.9 | 0 | 0 | 112.9 | V53 V130 L133 T134 L380 I381 | V53-M377 HydrophobicContact CB-CE 4.02Å; V53-M377 HydrophobicContact CG1-CE 3.34Å; V53-M377 HydrophobicContact CG2-CE 3.42Å; V53-M377 VanDerWaalsContact CG2-CE 3.42Å; V130-M377 HydrophobicContact CG1-CE 3.74Å; V130-M377 HydrophobicContact CG1-CG 4.2Å; L133-M377 HydrophobicContact CB-CG 4.45Å; L133-M377 HydrophobicContact CB-SD 4.13Å; L133-M377 HydrophobicContact CD1-CB 4.27Å; T134-M377 WeakPolarHBondContact OG1-CE 3.31Å; M377-L380 WeakPolarHBondContact O-CB 3.44Å; M377-L380 PolarHBondContact O-N 2.78Å; M377-I381 WeakPolarHBondContact O-CG1 3.21Å; M377-I381 PolarHBondContact O-N 2.95Å |
| 378 | Y | 76.3 | Confident | 82.2 | Confident | 44 Ų | 44 | 33.8 Ų | 33.8 | 17% | 0.173 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -73.3 | -36.2 | -179.8 | -70.9 | -81.7 | 0 | 0 | 0 | 112.2 | V53 K56 D376 L380 I381 N382 | V53-Y378 HydrophobicContact CG1-CE1 4.15Å; K56-Y378 WeakPolarHBondContact CD-OH 3.39Å; D376-Y378 VanDerWaalsContact C-N 3.31Å; D376-Y378 PolarHBondContact O-N 3.17Å; D376-Y378 PolarHBondContact OD2-N 2.63Å; Y378-L380 VanDerWaalsContact C-N 3.29Å; Y378-L380 PolarHBondContact O-N 3.42Å; Y378-I381 HydrophobicContact CD1-CD1 4.33Å; Y378-I381 WeakPolarHBondContact O-CB 3.4Å; Y378-I381 PolarHBondContact O-N 3.09Å; Y378-I381 VanDerWaalsContact O-N 3.12Å; Y378-N382 PolarHBondContact O-N 3.32Å |
| 379 | T | 80.9 | Confident | 82 | Confident | 45 Ų | 45 | 34.3 Ų | 34.3 | 28% | 0.276 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -62.2 | -38.4 | 172 | -48.8 | 0 | 0 | 0 | 0 | 111.5 | D376 I381 N382 Y383 V441 | D376-T379 PolarHBondContact O-N 3.11Å; T379-I381 VanDerWaalsContact C-N 3.3Å; T379-I381 PolarHBondContact O-N 2.79Å; T379-N382 PolarHBondContact O-N 3.42Å; T379-Y383 WeakPolarHBondContact O-CB 3.29Å; T379-Y383 PolarHBondContact O-N 3.24Å; T379-V441 HydrophobicContact CG2-CG1 4.17Å; T379-V441 HydrophobicContact CG2-CG2 3.67Å |
| 380 | L | 79.9 | Confident | 82 | Confident | 10 Ų | 10 | 33.1 Ų | 33.1 | 5% | 0.052 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.1 | -39.3 | 173.4 | -92.6 | 73.1 | 0 | 0 | 0 | 111.8 | T126 A129 V130 T374 D376 M377 Y378 Y383 V384 | T126-L380 HydrophobicContact CG2-CB 3.68Å; T126-L380 HydrophobicContact CG2-CD2 3.76Å; T126-L380 HydrophobicContact CG2-CG 3.64Å; A129-L380 HydrophobicContact CB-CD2 4.04Å; V130-L380 HydrophobicContact CG2-CB 3.68Å; V130-L380 HydrophobicContact CG2-CD2 4.21Å; T374-L380 WeakPolarHBondContact O-CD1 3.42Å; D376-L380 WeakPolarHBondContact O-CD1 3.21Å; D376-L380 PolarHBondContact O-N 2.9Å; D376-L380 VanDerWaalsContact O-N 3.07Å; M377-L380 WeakPolarHBondContact O-CB 3.44Å; M377-L380 PolarHBondContact O-N 2.78Å; Y378-L380 VanDerWaalsContact C-N 3.29Å; Y378-L380 PolarHBondContact O-N 3.42Å; L380-Y383 WeakPolarHBondContact O-CB 3.31Å; L380-Y383 PolarHBondContact O-N 2.98Å; L380-V384 WeakPolarHBondContact O-CG2 3.45Å; L380-V384 PolarHBondContact O-N 3.38Å; L380-V384 VanDerWaalsContact O-N 3.09Å |
| 381 | I | 80.6 | Confident | 82 | Confident | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.2 | -45.8 | 176.4 | -67.6 | 167.4 | 0 | 0 | 0 | 110.5 | V53 V130 Q233 F236 M377 Y378 T379 Y383 V384 G385 | V53-I381 HydrophobicContact CG1-CD1 3.66Å; V130-I381 HydrophobicContact CG1-CD1 3.89Å; V130-I381 HydrophobicContact CG1-CG1 3.72Å; V130-I381 HydrophobicContact CG2-CG1 3.96Å; Q233-I381 HydrophobicContact CG-CG2 4.42Å; F236-I381 HydrophobicContact CB-CG2 3.85Å; F236-I381 HydrophobicContact CD1-CD1 4.37Å; F236-I381 HydrophobicContact CD1-CG1 4.43Å; F236-I381 HydrophobicContact CD1-CG2 4.37Å; F236-I381 HydrophobicContact CD2-CG1 4.46Å; F236-I381 HydrophobicContact CD2-CG2 4.18Å; F236-I381 HydrophobicContact CE1-CD1 4.36Å; F236-I381 HydrophobicContact CE1-CG1 4.41Å; F236-I381 HydrophobicContact CE2-CG1 4.44Å; F236-I381 HydrophobicContact CG-CG1 4.46Å; F236-I381 HydrophobicContact CG-CG2 3.87Å; F236-I381 HydrophobicContact CZ-CG1 4.43Å; M377-I381 WeakPolarHBondContact O-CG1 3.21Å; M377-I381 PolarHBondContact O-N 2.95Å; Y378-I381 HydrophobicContact CD1-CD1 4.33Å; Y378-I381 WeakPolarHBondContact O-CB 3.4Å; Y378-I381 PolarHBondContact O-N 3.09Å; Y378-I381 VanDerWaalsContact O-N 3.12Å; T379-I381 VanDerWaalsContact C-N 3.3Å; T379-I381 PolarHBondContact O-N 2.79Å; I381-Y383 VanDerWaalsContact C-N 3.32Å; I381-Y383 PolarHBondContact O-N 3.32Å; I381-V384 PolarHBondContact O-N 3.37Å; I381-G385 PolarHBondContact O-N 3.45Å |
| 382 | N | 82.4 | Confident | 82.2 | Confident | 9 Ų | 9 | 27.1 Ų | 27.1 | 5% | 0.048 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.8 | -42.3 | 178.4 | -67.6 | -9.2 | 0 | 0 | 0 | 111.3 | Y378 T379 V384 G385 F386 E438 V441 | Y378-N382 PolarHBondContact O-N 3.32Å; T379-N382 PolarHBondContact O-N 3.42Å; N382-V384 PolarHBondContact O-N 3.23Å; N382-G385 PolarHBondContact O-N 3.15Å; N382-F386 WeakPolarHBondContact O-CB 3.43Å; N382-F386 PolarHBondContact O-N 3.31Å; N382-E438 WeakPolarHBondContact CB-OE2 3.38Å; N382-E438 VanDerWaalsContact ND2-CD 3.29Å; N382-E438 PolarHBondContact ND2-OE1 3.05Å; N382-E438 PolarHBondContact ND2-OE2 3.47Å; N382-V441 HydrophobicContact CB-CG1 4.42Å |
| 383 | Y | 81.3 | Confident | 82.5 | Confident | 24 Ų | 24 | 26.7 Ų | 26.7 | 9% | 0.094 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -57.1 | -50.1 | 176.5 | -176.8 | -106.3 | 0 | 0 | 0 | 112.5 | V122 T379 L380 I381 I387 V441 I444 I448 | V122-Y383 HydrophobicContact CB-CE1 3.99Å; V122-Y383 HydrophobicContact CG1-CD1 3.79Å; V122-Y383 HydrophobicContact CG1-CE1 3.17Å; V122-Y383 HydrophobicContact CG2-CE1 3.83Å; V122-Y383 VanDerWaalsContact CG2-OH 3.24Å; V122-Y383 WeakPolarHBondContact CG2-OH 3.48Å; T379-Y383 WeakPolarHBondContact O-CB 3.29Å; T379-Y383 PolarHBondContact O-N 3.24Å; L380-Y383 WeakPolarHBondContact O-CB 3.31Å; L380-Y383 PolarHBondContact O-N 2.98Å; I381-Y383 VanDerWaalsContact C-N 3.32Å; I381-Y383 PolarHBondContact O-N 3.32Å; Y383-I387 WeakPolarHBondContact O-CG1 3.39Å; Y383-I387 PolarHBondContact O-N 3.37Å; Y383-V441 HydrophobicContact CD2-CG1 4.22Å; Y383-I444 HydrophobicContact CE2-CB 4.35Å; Y383-I444 HydrophobicContact CE2-CG2 4.03Å; Y383-I448 WeakPolarHBondContact OH-CD1 3.33Å |
| 384 | V | 83.3 | Confident | 83 | Confident | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -70.2 | -42.9 | 179 | 173.8 | 0 | 0 | 0 | 0 | 111.8 | T126 N127 L380 I381 N382 F386 I387 N388 | T126-V384 HydrophobicContact CG2-CG2 3.25Å; N127-V384 WeakPolarHBondContact OD1-CG1 3.31Å; L380-V384 WeakPolarHBondContact O-CG2 3.45Å; L380-V384 PolarHBondContact O-N 3.38Å; L380-V384 VanDerWaalsContact O-N 3.09Å; I381-V384 PolarHBondContact O-N 3.37Å; N382-V384 PolarHBondContact O-N 3.23Å; V384-F386 PolarHBondContact O-N 3.15Å; V384-I387 PolarHBondContact O-N 2.71Å; V384-N388 WeakPolarHBondContact CG1-ND2 3.48Å; V384-N388 VanDerWaalsContact O-CB 3.27Å; V384-N388 WeakPolarHBondContact O-CB 3.44Å; V384-N388 PolarHBondContact O-N 2.9Å |
| 385 | G | 84.1 | Confident | 84 | Confident | 3 Ų | 3 | 21.1 Ų | 21.1 | 3% | 0.031 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -57.1 | -50.6 | -179 | 0 | 0 | 0 | 0 | 0 | 111 | I381 N382 I387 N388 Y389 | I381-G385 PolarHBondContact O-N 3.45Å; N382-G385 PolarHBondContact O-N 3.15Å; G385-I387 PolarHBondContact O-N 3.08Å; G385-N388 PolarHBondContact O-N 3.41Å; G385-Y389 WeakPolarHBondContact O-CB 2.78Å; G385-Y389 VanDerWaalsContact O-CD2 3.3Å; G385-Y389 WeakPolarHBondContact O-CD2 3.48Å; G385-Y389 PolarHBondContact O-N 3.09Å |
| 386 | F | 87.3 | Confident | 85.6 | Confident | 2 Ų | 2 | 17.5 Ų | 17.5 | 1% | 0.009 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -56.7 | -51.7 | 178 | 175.5 | -99.4 | 0 | 0 | 0 | 112.1 | N382 V384 Y389 L390 L431 L435 C442 L446 | N382-F386 WeakPolarHBondContact O-CB 3.43Å; N382-F386 PolarHBondContact O-N 3.31Å; V384-F386 PolarHBondContact O-N 3.15Å; F386-Y389 PolarHBondContact O-N 3.24Å; F386-L390 HydrophobicContact CE1-CD1 4.39Å; F386-L390 HydrophobicContact CZ-CD1 4.49Å; F386-L390 PolarHBondContact O-N 3.04Å; F386-L431 HydrophobicContact CD2-CD2 3.52Å; F386-L431 HydrophobicContact CE2-CD2 3.27Å; F386-L431 HydrophobicContact CE2-CG 4.44Å; F386-L431 HydrophobicContact CG-CD2 4.38Å; F386-L431 HydrophobicContact CZ-CD2 3.96Å; F386-L435 HydrophobicContact CE2-CD1 4.1Å; F386-L435 HydrophobicContact CE2-CD2 4.19Å; F386-L435 HydrophobicContact CE2-CG 3.71Å; F386-L435 HydrophobicContact CZ-CD1 4.15Å; F386-L435 HydrophobicContact CZ-CD2 3.98Å; F386-L435 HydrophobicContact CZ-CG 3.94Å; F386-C442 HydrophobicContact CD1-CB 4.02Å; F386-C442 HydrophobicContact CD2-CB 4.11Å; F386-C442 VanDerWaalsContact CD2-SG 3.6Å; F386-C442 HydrophobicContact CE1-CB 3.97Å; F386-C442 HydrophobicContact CE2-CB 4.04Å; F386-C442 HydrophobicContact CG-CB 4.11Å; F386-C442 HydrophobicContact CZ-CB 3.98Å; F386-L446 HydrophobicContact CE1-CD1 4.44Å; F386-L446 HydrophobicContact CE1-CD2 3.94Å; F386-L446 HydrophobicContact CE1-CG 3.91Å; F386-L446 HydrophobicContact CZ-CD1 4.33Å; F386-L446 HydrophobicContact CZ-CD2 4.27Å; F386-L446 HydrophobicContact CZ-CG 4.27Å |
| 387 | I | 88.6 | Confident | 86.5 | Confident | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -69.1 | -39.2 | -176.3 | -70.1 | -64 | 0 | 0 | 0 | 112.4 | I118 V122 I123 Y383 V384 G385 L390 F391 | I118-I387 HydrophobicContact CB-CG2 4.46Å; I118-I387 HydrophobicContact CD1-CG2 4.44Å; I118-I387 HydrophobicContact CG2-CG2 3.15Å; V122-I387 HydrophobicContact CG1-CB 4.48Å; V122-I387 HydrophobicContact CG1-CG2 4.24Å; I123-I387 HydrophobicContact CG1-CG2 4.41Å; Y383-I387 WeakPolarHBondContact O-CG1 3.39Å; Y383-I387 PolarHBondContact O-N 3.37Å; V384-I387 PolarHBondContact O-N 2.71Å; G385-I387 PolarHBondContact O-N 3.08Å; I387-L390 WeakPolarHBondContact O-CB 3.48Å; I387-L390 PolarHBondContact O-N 3.48Å; I387-F391 HydrophobicContact CG2-CD2 4.3Å; I387-F391 HydrophobicContact CG2-CE2 4.36Å; I387-F391 WeakPolarHBondContact O-CD2 3.29Å; I387-F391 PolarHBondContact O-N 2.7Å |
| 388 | N | 88.1 | Confident | 87.2 | Confident | 19 Ų | 19 | 14 Ų | 14 | 10% | 0.102 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -59.6 | -48.5 | 173.6 | -88.1 | -25.6 | 0 | 0 | 0 | 111.1 | I123 V384 G385 L390 F391 Y392 | I123-N388 WeakPolarHBondContact CD1-OD1 3.17Å; I123-N388 VanDerWaalsContact CG1-OD1 3.26Å; I123-N388 WeakPolarHBondContact CG1-OD1 3.25Å; I123-N388 VanDerWaalsContact CG2-OD1 3.3Å; I123-N388 WeakPolarHBondContact CG2-OD1 3.31Å; V384-N388 WeakPolarHBondContact CG1-ND2 3.48Å; V384-N388 VanDerWaalsContact O-CB 3.27Å; V384-N388 WeakPolarHBondContact O-CB 3.44Å; V384-N388 PolarHBondContact O-N 2.9Å; G385-N388 PolarHBondContact O-N 3.41Å; N388-L390 VanDerWaalsContact C-N 3.32Å; N388-L390 PolarHBondContact O-N 3.05Å; N388-F391 PolarHBondContact O-N 3.31Å; N388-Y392 HydrophobicContact CB-CE2 4.17Å; N388-Y392 VanDerWaalsContact O-CG 3.26Å; N388-Y392 PolarHBondContact O-N 3.41Å |
| 389 | Y | 88.6 | Confident | 88 | Confident | 11 Ų | 11 | 12 Ų | 12 | 4% | 0.043 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -62.8 | -39.9 | 179.4 | -90.5 | -65.6 | 0 | 0 | 0 | 112.4 | L232 S235 G385 F386 F391 Y392 G393 W427 L430 | L232-Y389 HydrophobicContact CD2-CD2 3.56Å; L232-Y389 HydrophobicContact CD2-CE2 3.91Å; S235-Y389 VanDerWaalsContact CB-CZ 3.42Å; S235-Y389 WeakPolarHBondContact CB-OH 3.25Å; S235-Y389 WeakPolarHBondContact OG-CE2 3.45Å; G385-Y389 WeakPolarHBondContact O-CB 2.78Å; G385-Y389 VanDerWaalsContact O-CD2 3.3Å; G385-Y389 WeakPolarHBondContact O-CD2 3.48Å; G385-Y389 PolarHBondContact O-N 3.09Å; F386-Y389 PolarHBondContact O-N 3.24Å; Y389-F391 VanDerWaalsContact C-N 3.29Å; Y389-F391 PolarHBondContact O-N 3.22Å; Y389-Y392 HydrophobicContact CD1-CD2 4.15Å; Y389-Y392 HydrophobicContact CE1-CD2 4.46Å; Y389-Y392 PolarHBondContact O-N 3.49Å; Y389-Y392 VanDerWaalsContact O-N 3.16Å; Y389-G393 PolarHBondContact O-N 2.9Å; Y389-W427 PolarHBondContact O-NE1 3.42Å; Y389-L430 HydrophobicContact CE1-CD1 4.42Å; Y389-L430 HydrophobicContact CE2-CD1 4.2Å |
| 390 | L | 91.4 | Very high | 88.6 | Confident | 24 Ų | 24 | 11.5 Ų | 11.5 | 13% | 0.126 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -51.6 | -50.4 | 174.4 | -173.5 | 151.6 | 0 | 0 | 0 | 111 | F386 I387 N388 G393 V394 L431 L446 M449 | F386-L390 HydrophobicContact CE1-CD1 4.39Å; F386-L390 HydrophobicContact CZ-CD1 4.49Å; F386-L390 PolarHBondContact O-N 3.04Å; I387-L390 WeakPolarHBondContact O-CB 3.48Å; I387-L390 PolarHBondContact O-N 3.48Å; N388-L390 VanDerWaalsContact C-N 3.32Å; N388-L390 PolarHBondContact O-N 3.05Å; L390-G393 PolarHBondContact O-N 3.3Å; L390-V394 HydrophobicContact CD2-CG2 4.37Å; L390-V394 WeakPolarHBondContact O-CG2 3.49Å; L390-V394 PolarHBondContact O-N 3.42Å; L390-V394 VanDerWaalsContact O-N 3.09Å; L390-L431 HydrophobicContact CB-CD2 4.31Å; L390-L446 HydrophobicContact CD1-CD2 3.56Å; L390-M449 HydrophobicContact CD2-SD 4.02Å |
| 391 | F | 90.5 | Very high | 89.2 | Confident | 9 Ų | 9 | 13.9 Ų | 13.9 | 4% | 0.039 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -72.9 | -31.9 | 178.9 | -78.6 | -72.5 | 0 | 0 | 0 | 113.9 | L114 R115 I118 I387 N388 Y389 G393 V394 T395 M449 | L114-F391 HydrophobicContact CB-CZ 4.49Å; R115-F391 HydrophobicContact CB-CD1 3.99Å; R115-F391 HydrophobicContact CB-CE1 3.82Å; R115-F391 VanDerWaalsContact CD-CG 3.47Å; R115-F391 HydrophobicContact CG-CD1 4.23Å; I118-F391 HydrophobicContact CB-CE2 3.76Å; I118-F391 HydrophobicContact CB-CZ 4.25Å; I118-F391 HydrophobicContact CG1-CE2 3.85Å; I118-F391 HydrophobicContact CG1-CZ 4.2Å; I118-F391 HydrophobicContact CG2-CD2 4.02Å; I118-F391 HydrophobicContact CG2-CE2 3.6Å; I387-F391 HydrophobicContact CG2-CD2 4.3Å; I387-F391 HydrophobicContact CG2-CE2 4.36Å; I387-F391 WeakPolarHBondContact O-CD2 3.29Å; I387-F391 PolarHBondContact O-N 2.7Å; N388-F391 PolarHBondContact O-N 3.31Å; Y389-F391 VanDerWaalsContact C-N 3.29Å; Y389-F391 PolarHBondContact O-N 3.22Å; F391-G393 VanDerWaalsContact C-N 3.3Å; F391-G393 PolarHBondContact O-N 2.95Å; F391-V394 PolarHBondContact O-N 3.44Å; F391-T395 PolarHBondContact O-N 3.45Å; F391-T395 PolarHBondContact O-OG1 2.9Å; F391-T395 VanDerWaalsContact O-OG1 3.07Å; F391-M449 HydrophobicContact CE2-SD 4.23Å; F391-M449 HydrophobicContact CZ-CG 4.39Å; F391-M449 HydrophobicContact CZ-SD 3.95Å |
| 392 | Y | 91.1 | Very high | 89.7 | Confident | 18 Ų | 18 | 14.6 Ų | 14.6 | 7% | 0.071 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -61 | -42.2 | 172.3 | -65.4 | -21.1 | 0 | 0 | 0 | 111.7 | Y86 W241 N388 Y389 T395 V396 | Y86-Y392 WeakPolarHBondContact OH-CD1 3.49Å; W241-Y392 HydrophobicContact CZ2-CD1 4.41Å; W241-Y392 AromaticContact CZ2-CD2 3.96Å; W241-Y392 HydrophobicContact CZ2-CD2 3.96Å; W241-Y392 HydrophobicContact CZ2-CE1 4.32Å; W241-Y392 AromaticContact CZ2-CE2 3.87Å; W241-Y392 HydrophobicContact CZ2-CE2 3.87Å; W241-Y392 HydrophobicContact CZ2-CG 4.23Å; N388-Y392 HydrophobicContact CB-CE2 4.17Å; N388-Y392 VanDerWaalsContact O-CG 3.26Å; N388-Y392 PolarHBondContact O-N 3.41Å; Y389-Y392 HydrophobicContact CD1-CD2 4.15Å; Y389-Y392 HydrophobicContact CE1-CD2 4.46Å; Y389-Y392 PolarHBondContact O-N 3.49Å; Y389-Y392 VanDerWaalsContact O-N 3.16Å; Y392-T395 PolarHBondContact O-N 3.48Å; Y392-V396 WeakPolarHBondContact O-CG2 3.49Å; Y392-V396 PolarHBondContact O-N 2.96Å |
| 393 | G | 92.5 | Very high | 90.1 | Very high | 1 Ų | 1 | 15.4 Ų | 15.4 | 1% | 0.01 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -62.9 | -43.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y389 L390 F391 T395 V396 A397 | Y389-G393 PolarHBondContact O-N 2.9Å; L390-G393 PolarHBondContact O-N 3.3Å; F391-G393 VanDerWaalsContact C-N 3.3Å; F391-G393 PolarHBondContact O-N 2.95Å; G393-T395 VanDerWaalsContact C-N 3.35Å; G393-T395 PolarHBondContact O-N 3.09Å; G393-V396 PolarHBondContact O-N 3.12Å; G393-A397 VanDerWaalsContact O-CB 3.24Å; G393-A397 WeakPolarHBondContact O-CB 3.4Å; G393-A397 PolarHBondContact O-N 3.2Å |
| 394 | V | 93.1 | Very high | 90.5 | Very high | 42 Ų | 42 | 20.6 Ų | 20.6 | 26% | 0.255 | 11% | 0.113 | S | C | . | . | H | α-helix | trans | -59 | -45 | 176.6 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | V103 F107 L390 F391 A397 G398 | V103-V394 HydrophobicContact CG1-CG1 4.49Å; V103-V394 HydrophobicContact CG2-CG1 4.39Å; F107-V394 HydrophobicContact CD2-CG1 4.14Å; F107-V394 HydrophobicContact CE2-CG1 3.84Å; F107-V394 WeakPolarHBondContact CE2-O 3.37Å; L390-V394 HydrophobicContact CD2-CG2 4.37Å; L390-V394 WeakPolarHBondContact O-CG2 3.49Å; L390-V394 PolarHBondContact O-N 3.42Å; L390-V394 VanDerWaalsContact O-N 3.09Å; F391-V394 PolarHBondContact O-N 3.44Å; V394-A397 PolarHBondContact O-N 3.17Å; V394-G398 PolarHBondContact O-N 3.31Å |
| 395 | T | 92.1 | Very high | 90.9 | Very high | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.006 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -65.8 | -43.2 | 179 | -53.9 | 0 | 0 | 0 | 0 | 112.1 | Y86 L89 Y102 F391 Y392 G393 G398 Q399 | Y86-T395 HydrophobicContact CE1-CG2 3.78Å; Y86-T395 HydrophobicContact CE2-CG2 4.02Å; Y86-T395 WeakPolarHBondContact OH-CB 3.33Å; Y86-T395 WeakPolarHBondContact OH-CG2 3.49Å; Y86-T395 PolarHBondContact OH-OG1 2.6Å; Y86-T395 VanDerWaalsContact OH-OG1 3.14Å; L89-T395 HydrophobicContact CD1-CG2 3.46Å; L89-T395 VanDerWaalsContact CD1-CG2 3.46Å; Y102-T395 HydrophobicContact CD2-CG2 4.11Å; F391-T395 PolarHBondContact O-N 3.45Å; F391-T395 PolarHBondContact O-OG1 2.9Å; F391-T395 VanDerWaalsContact O-OG1 3.07Å; Y392-T395 PolarHBondContact O-N 3.48Å; G393-T395 VanDerWaalsContact C-N 3.35Å; G393-T395 PolarHBondContact O-N 3.09Å; T395-G398 WeakPolarHBondContact O-CA 3.31Å; T395-G398 PolarHBondContact O-N 3.37Å; T395-Q399 PolarHBondContact O-N 3.47Å |
| 396 | V | 93.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -68.7 | -39 | 177.8 | 176 | 0 | 0 | 0 | 0 | 111.5 | C85 Y86 Y392 G393 G398 Q399 I400 P420 Y423 L424 | C85-V396 HydrophobicContact CB-CG1 4.4Å; C85-V396 HydrophobicContact CB-CG2 4.06Å; Y86-V396 HydrophobicContact CD2-CG2 4.38Å; Y86-V396 HydrophobicContact CE2-CG2 4.03Å; Y392-V396 WeakPolarHBondContact O-CG2 3.49Å; Y392-V396 PolarHBondContact O-N 2.96Å; G393-V396 PolarHBondContact O-N 3.12Å; V396-G398 VanDerWaalsContact C-N 3.29Å; V396-G398 PolarHBondContact O-N 3.24Å; V396-Q399 WeakPolarHBondContact O-CB 3.22Å; V396-Q399 PolarHBondContact O-N 3.44Å; V396-I400 PolarHBondContact O-N 2.93Å; V396-P420 HydrophobicContact CG1-CB 3.89Å; V396-Y423 HydrophobicContact CB-CD1 4.15Å; V396-Y423 HydrophobicContact CG1-CD1 4.09Å; V396-Y423 HydrophobicContact CG2-CD1 3.85Å; V396-Y423 HydrophobicContact CG2-CE1 3.92Å; V396-L424 HydrophobicContact CB-CD2 4.43Å; V396-L424 HydrophobicContact CG1-CD2 4.4Å; V396-L424 HydrophobicContact CG1-CG 4.13Å |
| 397 | A | 94.1 | Very high | 91.2 | Very high | 32 Ų | 32 | 36.9 Ų | 36.9 | 26% | 0.264 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -61.7 | -40.6 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111 | G393 V394 Q399 I400 V401 L424 | G393-A397 VanDerWaalsContact O-CB 3.24Å; G393-A397 WeakPolarHBondContact O-CB 3.4Å; G393-A397 PolarHBondContact O-N 3.2Å; V394-A397 PolarHBondContact O-N 3.17Å; A397-Q399 VanDerWaalsContact C-N 3.27Å; A397-Q399 PolarHBondContact O-N 3.48Å; A397-I400 PolarHBondContact O-N 2.87Å; A397-I400 VanDerWaalsContact O-N 3.11Å; A397-V401 WeakPolarHBondContact O-CG2 3.33Å; A397-V401 PolarHBondContact O-N 3.39Å; A397-L424 HydrophobicContact CB-CD1 4.24Å; A397-L424 HydrophobicContact CB-CD2 4.15Å |
| 398 | G | 91.9 | Very high | 91.2 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -56.3 | -40.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | V394 T395 V396 I400 V401 L402 | V394-G398 PolarHBondContact O-N 3.31Å; T395-G398 WeakPolarHBondContact O-CA 3.31Å; T395-G398 PolarHBondContact O-N 3.37Å; V396-G398 VanDerWaalsContact C-N 3.29Å; V396-G398 PolarHBondContact O-N 3.24Å; G398-I400 VanDerWaalsContact C-N 3.34Å; G398-I400 PolarHBondContact O-N 3.24Å; G398-V401 PolarHBondContact O-N 3.29Å; G398-L402 VanDerWaalsContact O-CB 3.25Å; G398-L402 WeakPolarHBondContact O-CB 3.13Å; G398-L402 PolarHBondContact O-N 2.85Å |
| 399 | Q | 92.4 | Very high | 91.2 | Very high | 2 Ų | 2 | 46.1 Ų | 46.1 | 1% | 0.009 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.8 | -41.5 | 175.1 | -174.2 | -91.1 | -7.9 | 0 | 0 | 112.4 | E88 L89 T395 V396 A397 L402 R403 | E88-Q399 VanDerWaalsContact CD-NE2 3.29Å; E88-Q399 PolarHBondContact OE1-NE2 3.12Å; L89-Q399 HydrophobicContact CD1-CB 4.06Å; L89-Q399 HydrophobicContact CD2-CB 3.88Å; L89-Q399 HydrophobicContact CD2-CG 3.96Å; L89-Q399 HydrophobicContact CG-CB 4.01Å; L89-Q399 HydrophobicContact CG-CG 4.03Å; T395-Q399 PolarHBondContact O-N 3.47Å; V396-Q399 WeakPolarHBondContact O-CB 3.22Å; V396-Q399 PolarHBondContact O-N 3.44Å; A397-Q399 VanDerWaalsContact C-N 3.27Å; A397-Q399 PolarHBondContact O-N 3.48Å; Q399-L402 PolarHBondContact O-N 3.43Å; Q399-R403 VanDerWaalsContact NE2-CZ 3.26Å; Q399-R403 WeakPolarHBondContact O-CG 3.45Å; Q399-R403 PolarHBondContact O-N 3.23Å; Q399-R403 VanDerWaalsContact O-N 3.14Å |
| 400 | I | 93.4 | Very high | 91.1 | Very high | 34 Ų | 34 | 53 Ų | 53 | 17% | 0.174 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -66.6 | -45.6 | 175.3 | -59 | 179.1 | 0 | 0 | 0 | 110.5 | V396 A397 G398 L402 R403 I404 P420 V421 L424 | V396-I400 PolarHBondContact O-N 2.93Å; A397-I400 PolarHBondContact O-N 2.87Å; A397-I400 VanDerWaalsContact O-N 3.11Å; G398-I400 VanDerWaalsContact C-N 3.34Å; G398-I400 PolarHBondContact O-N 3.24Å; I400-L402 VanDerWaalsContact C-N 3.29Å; I400-L402 PolarHBondContact O-N 3.15Å; I400-R403 WeakPolarHBondContact O-CB 3.39Å; I400-R403 PolarHBondContact O-N 3.32Å; I400-R403 VanDerWaalsContact O-N 3.12Å; I400-I404 HydrophobicContact CG2-CD1 4.11Å; I400-I404 WeakPolarHBondContact O-CG1 3.4Å; I400-I404 PolarHBondContact O-N 3.41Å; I400-I404 VanDerWaalsContact O-N 3.17Å; I400-P420 HydrophobicContact CD1-CB 3.84Å; I400-P420 HydrophobicContact CG1-CB 3.87Å; I400-V421 HydrophobicContact CD1-CG2 4.29Å; I400-L424 HydrophobicContact CD1-CD1 3.48Å; I400-L424 VanDerWaalsContact CD1-CD1 3.48Å |
| 401 | V | 93.4 | Very high | 90.9 | Very high | 61 Ų | 61 | 53.7 Ų | 53.7 | 37% | 0.37 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.4 | -41.9 | 177.5 | 171.7 | 0 | 0 | 0 | 0 | 111 | I106 A397 G398 R403 I404 K405 | I106-V401 HydrophobicContact CG2-CG1 4.48Å; A397-V401 WeakPolarHBondContact O-CG2 3.33Å; A397-V401 PolarHBondContact O-N 3.39Å; G398-V401 PolarHBondContact O-N 3.29Å; V401-R403 VanDerWaalsContact C-N 3.29Å; V401-R403 PolarHBondContact O-N 3.4Å; V401-I404 PolarHBondContact O-N 2.99Å; V401-I404 VanDerWaalsContact O-N 3.12Å; V401-K405 WeakPolarHBondContact O-CB 3.3Å; V401-K405 PolarHBondContact O-N 2.78Å |
| 402 | L | 91.3 | Very high | 90.6 | Very high | 14 Ų | 14 | 55.6 Ų | 55.6 | 7% | 0.073 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63 | -35.9 | 177.8 | -172.1 | 63.3 | 0 | 0 | 0 | 111.8 | L89 I93 I106 G398 Q399 I400 I404 Q406 M409 R411 | L89-L402 HydrophobicContact CD2-CD2 4.03Å; I93-L402 HydrophobicContact CD1-CD2 4.07Å; I106-L402 HydrophobicContact CD1-CD2 4.25Å; I106-L402 HydrophobicContact CG1-CD1 4.42Å; I106-L402 HydrophobicContact CG1-CD2 4.36Å; G398-L402 VanDerWaalsContact O-CB 3.25Å; G398-L402 WeakPolarHBondContact O-CB 3.13Å; G398-L402 PolarHBondContact O-N 2.85Å; Q399-L402 PolarHBondContact O-N 3.43Å; I400-L402 VanDerWaalsContact C-N 3.29Å; I400-L402 PolarHBondContact O-N 3.15Å; L402-I404 VanDerWaalsContact C-N 3.34Å; L402-Q406 HydrophobicContact CD1-CB 4.4Å; L402-Q406 CarbonylContact O-C 3.59Å; L402-Q406 PolarHBondContact O-N 2.97Å; L402-M409 HydrophobicContact CD1-CE 3.87Å; L402-M409 HydrophobicContact CD2-CE 3.69Å; L402-M409 HydrophobicContact CG-CE 3.78Å; L402-R411 PolarHBondContact O-NH2 3.3Å |
| 403 | R | 89.9 | Confident | 90.3 | Very high | 26 Ų | 26 | 55.9 Ų | 55.9 | 10% | 0.098 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.7 | -36.5 | 173.1 | -72.9 | -176.2 | 168.1 | -162.4 | 4.6 | 113.2 | E88 Q399 I400 V401 I415 | E88-R403 IonicContact OE1-CZ 3.27Å; E88-R403 VanDerWaalsContact OE1-CZ 3.27Å; E88-R403 IonicContact OE1-NE 2.95Å; E88-R403 PolarHBondContact OE1-NE 3Å; E88-R403 IonicContact OE1-NH2 2.78Å; E88-R403 PolarHBondContact OE1-NH2 3.22Å; E88-R403 IonicContact OE2-CZ 3.75Å; E88-R403 IonicContact OE2-NH2 2.63Å; E88-R403 PolarHBondContact OE2-NH2 2.9Å; Q399-R403 VanDerWaalsContact NE2-CZ 3.26Å; Q399-R403 WeakPolarHBondContact O-CG 3.45Å; Q399-R403 PolarHBondContact O-N 3.23Å; Q399-R403 VanDerWaalsContact O-N 3.14Å; I400-R403 WeakPolarHBondContact O-CB 3.39Å; I400-R403 PolarHBondContact O-N 3.32Å; I400-R403 VanDerWaalsContact O-N 3.12Å; V401-R403 VanDerWaalsContact C-N 3.29Å; V401-R403 PolarHBondContact O-N 3.4Å; R403-I415 VanDerWaalsContact CZ-O 3.28Å; R403-I415 PolarHBondContact NH1-O 2.95Å; R403-I415 PolarHBondContact NH2-O 3.34Å |
| 404 | I | 91.1 | Very high | 90 | Very high | 134 Ų | 134 | 63.3 Ų | 63.3 | 69% | 0.687 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -78.1 | -47.3 | -179.4 | -62.6 | 167.7 | 0 | 0 | 0 | 110.7 | I400 V401 L402 | I400-I404 HydrophobicContact CG2-CD1 4.11Å; I400-I404 WeakPolarHBondContact O-CG1 3.4Å; I400-I404 PolarHBondContact O-N 3.41Å; I400-I404 VanDerWaalsContact O-N 3.17Å; V401-I404 PolarHBondContact O-N 2.99Å; V401-I404 VanDerWaalsContact O-N 3.12Å; L402-I404 VanDerWaalsContact C-N 3.34Å |
| 405 | K | 90.8 | Very high | 89.9 | Confident | 166 Ų | 166 | 62.4 Ų | 62.4 | 72% | 0.722 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -77.5 | -34.4 | -173.5 | -164.2 | 177.1 | -178.1 | -176.6 | 0 | 112.9 | V401 | V401-K405 WeakPolarHBondContact O-CB 3.3Å; V401-K405 PolarHBondContact O-N 2.78Å |
| 406 | Q | 90.4 | Very high | 89.9 | Confident | 99 Ų | 99 | 65.2 Ų | 65.2 | 46% | 0.463 | 34% | 0.335 | S | S | . | . | trans | -130.7 | 77.1 | -179.3 | -68.2 | -178.2 | -14.5 | 0 | 0 | 110.5 | L402 R411 | L402-Q406 HydrophobicContact CD1-CB 4.4Å; L402-Q406 CarbonylContact O-C 3.59Å; L402-Q406 PolarHBondContact O-N 2.97Å; Q406-R411 PolarHBondContact O-NH2 2.87Å | ||
| 407 | P | 88 | Confident | 89.8 | Confident | 81 Ų | 81 | 69.6 Ų | 69.6 | 53% | 0.526 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | -29.8 | -177.1 | 27.6 | -34.2 | 0 | 0 | 0 | 113.2 | M409 | P407-M409 VanDerWaalsContact C-N 3.35Å; P407-M409 PolarHBondContact O-N 3.22Å |
| 408 | N | 87.8 | Confident | 89.7 | Confident | 156 Ų | 156 | 73.3 Ų | 73.3 | 83% | 0.834 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | -0.7 | -173 | -63.4 | -21.2 | 0 | 0 | 0 | 114.3 | ||
| 409 | M | 87.4 | Confident | 89.8 | Confident | 58 Ų | 58 | 78.9 Ų | 78.9 | 29% | 0.286 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -66.5 | 136.8 | 178.6 | -172.2 | 166.6 | 58.6 | 0 | 0 | 110.3 | T92 L402 P407 R411 | T92-M409 HydrophobicContact CG2-CE 3.1Å; T92-M409 HydrophobicContact CG2-CG 4.39Å; T92-M409 HydrophobicContact CG2-SD 3.99Å; L402-M409 HydrophobicContact CD1-CE 3.87Å; L402-M409 HydrophobicContact CD2-CE 3.69Å; L402-M409 HydrophobicContact CG-CE 3.78Å; P407-M409 VanDerWaalsContact C-N 3.35Å; P407-M409 PolarHBondContact O-N 3.22Å; M409-R411 PolarHBondContact O-N 3.43Å |
| 410 | H | 86.6 | Confident | 89.8 | Confident | 154 Ų | 154 | 78.8 Ų | 78.8 | 71% | 0.713 | 39% | 0.393 | S | S | * | . | trans | -64.4 | 120.8 | 179.1 | -172.4 | 68.9 | 0 | 0 | 0 | 110.2 | ||||
| 411 | R | 87.1 | Confident | 89.9 | Confident | 40 Ų | 40 | 80.5 Ų | 80.5 | 15% | 0.151 | 41% | 0.405 | C | S | . | . | trans | -122.7 | 100.2 | 179.6 | -67.3 | -175.6 | -176.1 | 116.7 | 8.9 | 109.3 | T92 L402 Q406 M409 I413 | T92-R411 HydrophobicContact CG2-CG 4.05Å; L402-R411 PolarHBondContact O-NH2 3.3Å; Q406-R411 PolarHBondContact O-NH2 2.87Å; M409-R411 PolarHBondContact O-N 3.43Å; R411-I413 VanDerWaalsContact C-N 3.28Å; R411-I413 PolarHBondContact O-N 3.19Å | ||
| 412 | P | 84.7 | Confident | 90 | Very high | 49 Ų | 49 | 80.8 Ų | 80.8 | 32% | 0.318 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -62.7 | -35.4 | 179.4 | -26.8 | 37.1 | 0 | 0 | 0 | 113 | V91 Y255 | V91-P412 HydrophobicContact CG2-CB 4.49Å; Y255-P412 HydrophobicContact CD1-CB 3.36Å; Y255-P412 HydrophobicContact CD1-CG 3.62Å; Y255-P412 HydrophobicContact CE1-CB 3.79Å; Y255-P412 HydrophobicContact CE1-CG 3.46Å; Y255-P412 VanDerWaalsContact CE1-CG 3.46Å; Y255-P412 HydrophobicContact CG-CB 3.91Å; Y255-P412 HydrophobicContact CG-CG 4.45Å |
| 413 | I | 85.4 | Confident | 90.1 | Very high | 24 Ų | 24 | 80.3 Ų | 80.3 | 12% | 0.123 | 40% | 0.401 | C | S | . | . | S | Bend | trans | -111.4 | 131.6 | 173 | -58.5 | 171.4 | 0 | 0 | 0 | 107.8 | E88 V91 Y255 P259 R411 I415 | E88-I413 WeakPolarHBondContact CG-O 3.42Å; V91-I413 HydrophobicContact CB-CD1 4.34Å; V91-I413 HydrophobicContact CG1-CD1 3.68Å; V91-I413 HydrophobicContact CG1-CG1 4.43Å; V91-I413 HydrophobicContact CG2-CB 3.79Å; V91-I413 HydrophobicContact CG2-CD1 3.79Å; V91-I413 HydrophobicContact CG2-CG1 3.81Å; Y255-I413 WeakPolarHBondContact O-CD1 3.47Å; P259-I413 HydrophobicContact CB-CD1 4.47Å; P259-I413 HydrophobicContact CG-CD1 3.83Å; R411-I413 VanDerWaalsContact C-N 3.28Å; R411-I413 PolarHBondContact O-N 3.19Å; I413-I415 HydrophobicContact CG2-CG2 4.46Å |
| 414 | K | 86.4 | Confident | 90.3 | Very high | 156 Ų | 156 | 80.8 Ų | 80.8 | 68% | 0.678 | 41% | 0.405 | S | S | * | . | trans | -134.5 | 110 | 176.6 | -171.3 | 178.7 | -178.9 | 179.7 | 0 | 110.1 | E88 | E88-K414 WeakPolarHBondContact OE2-CA 3.2Š| ||
| 415 | I | 90 | Very high | 90.5 | Very high | 23 Ų | 23 | 80.1 Ų | 80.1 | 12% | 0.118 | 40% | 0.402 | C | S | . | . | trans | -86.5 | 157.2 | 174.6 | 69.5 | 178.1 | 0 | 0 | 0 | 111.4 | C85 E88 R403 I413 W419 P420 | C85-I415 HydrophobicContact CB-CD1 4.16Å; C85-I415 VanDerWaalsContact SG-CD1 3.55Å; E88-I415 WeakPolarHBondContact OE2-CG1 3.45Å; E88-I415 PolarHBondContact OE2-N 3.41Å; R403-I415 VanDerWaalsContact CZ-O 3.28Å; R403-I415 PolarHBondContact NH1-O 2.95Å; R403-I415 PolarHBondContact NH2-O 3.34Å; I413-I415 HydrophobicContact CG2-CG2 4.46Å; I415-W419 HydrophobicContact CD1-CB 4.36Å; I415-P420 HydrophobicContact CD1-CG 3.98Å; I415-P420 HydrophobicContact CG1-CG 4.43Å | ||
| 416 | S | 92 | Very high | 90.6 | Very high | 61 Ų | 61 | 73.7 Ų | 73.7 | 43% | 0.427 | 37% | 0.374 | S | S | . | . | trans | -62 | 142.3 | 171.9 | -177.4 | 0 | 0 | 0 | 0 | 110.8 | I418 W419 P420 | S416-I418 PolarHBondContact O-N 2.69Å; S416-I418 VanDerWaalsContact O-N 3.15Å; S416-W419 PolarHBondContact O-N 3.35Å; S416-P420 WeakPolarHBondContact O-CD 3.23Å | ||
| 417 | L | 90.9 | Very high | 90.7 | Very high | 92 Ų | 92 | 71.9 Ų | 71.9 | 48% | 0.482 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -20.6 | 176.9 | -80.4 | 163.8 | 0 | 0 | 0 | 113.2 | W419 P420 V421 | L417-W419 VanDerWaalsContact C-N 3.26Å; L417-W419 PolarHBondContact O-N 2.89Å; L417-P420 WeakPolarHBondContact O-CD 3.45Å; L417-V421 VanDerWaalsContact O-CG2 3.29Å; L417-V421 WeakPolarHBondContact O-CG2 3.45Å; L417-V421 PolarHBondContact O-N 3.47Å |
| 418 | I | 93.5 | Very high | 90.9 | Very high | 110 Ų | 110 | 69.6 Ų | 69.6 | 56% | 0.564 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -60.7 | -38.1 | 178.4 | -61.5 | 170.7 | 0 | 0 | 0 | 110.8 | S416 V421 I422 | S416-I418 PolarHBondContact O-N 2.69Å; S416-I418 VanDerWaalsContact O-N 3.15Å; I418-V421 PolarHBondContact O-N 3.18Å; I418-I422 HydrophobicContact CG2-CD1 3.67Å; I418-I422 HydrophobicContact CG2-CG1 4.27Å; I418-I422 VanDerWaalsContact O-CG1 3.31Å; I418-I422 WeakPolarHBondContact O-CG1 3.46Å; I418-I422 PolarHBondContact O-N 3.33Å |
| 419 | W | 93.3 | Very high | 91 | Very high | 116 Ų | 116 | 65.8 Ų | 65.8 | 44% | 0.439 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -67.2 | -52 | -175.5 | -65.4 | 118.2 | 0 | 0 | 0 | 113.4 | I81 I415 S416 L417 V421 I422 Y423 | I81-W419 HydrophobicContact CD1-CE3 3.76Å; I81-W419 HydrophobicContact CD1-CZ3 3.78Å; I81-W419 HydrophobicContact CG1-CE3 3.7Å; I81-W419 HydrophobicContact CG1-CZ3 3.94Å; I81-W419 HydrophobicContact CG2-CB 4.12Å; I81-W419 HydrophobicContact CG2-CE3 4.24Å; I81-W419 WeakPolarHBondContact CG2-O 3.44Å; I415-W419 HydrophobicContact CD1-CB 4.36Å; S416-W419 PolarHBondContact O-N 3.35Å; L417-W419 VanDerWaalsContact C-N 3.26Å; L417-W419 PolarHBondContact O-N 2.89Å; W419-V421 VanDerWaalsContact C-N 3.27Å; W419-V421 PolarHBondContact O-N 3.26Å; W419-I422 HydrophobicContact CE3-CD1 4.38Å; W419-I422 PolarHBondContact O-N 2.85Å; W419-Y423 PolarHBondContact O-N 3.25Å; W419-Y423 VanDerWaalsContact O-N 3.09Å |
| 420 | P | 93.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -55.9 | -38 | 171.6 | -26.7 | 32.5 | 0 | 0 | 0 | 113.9 | V396 I400 I415 S416 L417 Y423 L424 | V396-P420 HydrophobicContact CG1-CB 3.89Å; I400-P420 HydrophobicContact CD1-CB 3.84Å; I400-P420 HydrophobicContact CG1-CB 3.87Å; I415-P420 HydrophobicContact CD1-CG 3.98Å; I415-P420 HydrophobicContact CG1-CG 4.43Å; S416-P420 WeakPolarHBondContact O-CD 3.23Å; L417-P420 WeakPolarHBondContact O-CD 3.45Å; P420-Y423 PolarHBondContact O-N 2.77Å; P420-L424 WeakPolarHBondContact O-CG 3.4Å; P420-L424 PolarHBondContact O-N 3.15Å |
| 421 | V | 94.5 | Very high | 91.2 | Very high | 71 Ų | 71 | 56.6 Ų | 56.6 | 43% | 0.43 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -67.6 | -44 | -179.7 | 173.1 | 0 | 0 | 0 | 0 | 111.3 | I400 L417 I418 W419 Y423 L424 L425 | I400-V421 HydrophobicContact CD1-CG2 4.29Å; L417-V421 VanDerWaalsContact O-CG2 3.29Å; L417-V421 WeakPolarHBondContact O-CG2 3.45Å; L417-V421 PolarHBondContact O-N 3.47Å; I418-V421 PolarHBondContact O-N 3.18Å; W419-V421 VanDerWaalsContact C-N 3.27Å; W419-V421 PolarHBondContact O-N 3.26Å; V421-Y423 VanDerWaalsContact C-N 3.29Å; V421-Y423 PolarHBondContact O-N 2.92Å; V421-L424 PolarHBondContact O-N 3.47Å; V421-L425 HydrophobicContact CG1-CD1 4.23Å; V421-L425 HydrophobicContact CG1-CG 4.49Å; V421-L425 WeakPolarHBondContact O-CG 3.44Å; V421-L425 PolarHBondContact O-N 3.39Å |
| 422 | I | 94.7 | Very high | 91.4 | Very high | 67 Ų | 67 | 60 Ų | 60 | 34% | 0.344 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -58.7 | -44.3 | 174.3 | -70.2 | 168.9 | 0 | 0 | 0 | 110.4 | I81 I418 W419 L424 L425 F426 | I81-I422 HydrophobicContact CD1-CG2 4.25Å; I418-I422 HydrophobicContact CG2-CD1 3.67Å; I418-I422 HydrophobicContact CG2-CG1 4.27Å; I418-I422 VanDerWaalsContact O-CG1 3.31Å; I418-I422 WeakPolarHBondContact O-CG1 3.46Å; I418-I422 PolarHBondContact O-N 3.33Å; W419-I422 HydrophobicContact CE3-CD1 4.38Å; W419-I422 PolarHBondContact O-N 2.85Å; I422-L424 PolarHBondContact O-N 3.12Å; I422-L425 PolarHBondContact O-N 2.98Å; I422-F426 PolarHBondContact O-N 3.38Å |
| 423 | Y | 94.3 | Very high | 91.6 | Very high | 4 Ų | 4 | 60.9 Ų | 60.9 | 2% | 0.016 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.6 | -44.2 | 177.9 | -169.8 | -88.4 | 0 | 0 | 0 | 111.9 | I78 I81 V396 W419 P420 V421 F426 W427 | I78-Y423 HydrophobicContact CG2-CD2 3.86Å; I78-Y423 HydrophobicContact CG2-CE2 3.67Å; I78-Y423 WeakPolarHBondContact O-CE2 3.07Å; I81-Y423 HydrophobicContact CG2-CD2 4.32Å; V396-Y423 HydrophobicContact CB-CD1 4.15Å; V396-Y423 HydrophobicContact CG1-CD1 4.09Å; V396-Y423 HydrophobicContact CG2-CD1 3.85Å; V396-Y423 HydrophobicContact CG2-CE1 3.92Å; W419-Y423 PolarHBondContact O-N 3.25Å; W419-Y423 VanDerWaalsContact O-N 3.09Å; P420-Y423 PolarHBondContact O-N 2.77Å; V421-Y423 VanDerWaalsContact C-N 3.29Å; V421-Y423 PolarHBondContact O-N 2.92Å; Y423-F426 PolarHBondContact O-N 3.31Å; Y423-W427 VanDerWaalsContact O-CB 3.22Å; Y423-W427 WeakPolarHBondContact O-CB 3.48Å; Y423-W427 PolarHBondContact O-N 2.91Å |
| 424 | L | 94.4 | Very high | 91.6 | Very high | 35 Ų | 35 | 59.7 Ų | 59.7 | 18% | 0.183 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -67.4 | -35.2 | 178.3 | -74.7 | 175.8 | 0 | 0 | 0 | 113.2 | V396 A397 I400 P420 V421 I422 W427 A428 | V396-L424 HydrophobicContact CB-CD2 4.43Å; V396-L424 HydrophobicContact CG1-CD2 4.4Å; V396-L424 HydrophobicContact CG1-CG 4.13Å; A397-L424 HydrophobicContact CB-CD1 4.24Å; A397-L424 HydrophobicContact CB-CD2 4.15Å; I400-L424 HydrophobicContact CD1-CD1 3.48Å; I400-L424 VanDerWaalsContact CD1-CD1 3.48Å; P420-L424 WeakPolarHBondContact O-CG 3.4Å; P420-L424 PolarHBondContact O-N 3.15Å; V421-L424 PolarHBondContact O-N 3.47Å; I422-L424 PolarHBondContact O-N 3.12Å; L424-W427 HydrophobicContact CD2-CE3 4.2Å; L424-W427 PolarHBondContact O-N 3.5Å; L424-A428 WeakPolarHBondContact O-CB 3.39Å; L424-A428 PolarHBondContact O-N 3.48Å |
| 425 | L | 94.4 | Very high | 91.7 | Very high | 121 Ų | 121 | 55.5 Ų | 55.5 | 63% | 0.634 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -64.1 | -46.8 | 174.1 | -74.2 | 172.8 | 0 | 0 | 0 | 111.1 | V421 I422 W427 A428 F429 | V421-L425 HydrophobicContact CG1-CD1 4.23Å; V421-L425 HydrophobicContact CG1-CG 4.49Å; V421-L425 WeakPolarHBondContact O-CG 3.44Å; V421-L425 PolarHBondContact O-N 3.39Å; I422-L425 PolarHBondContact O-N 2.98Å; L425-W427 VanDerWaalsContact C-N 3.34Å; L425-A428 PolarHBondContact O-N 3.34Å; L425-F429 WeakPolarHBondContact O-CB 3.44Å; L425-F429 PolarHBondContact O-N 2.87Å |
| 426 | F | 92.8 | Very high | 91.6 | Very high | 30 Ų | 30 | 62.9 Ų | 62.9 | 13% | 0.132 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.6 | -41 | 176.1 | -179.2 | -98.9 | 0 | 0 | 0 | 112 | I74 I78 F231 I422 Y423 F429 L430 | I74-F426 HydrophobicContact CG2-CE2 4.41Å; I78-F426 HydrophobicContact CB-CD1 4.32Å; I78-F426 HydrophobicContact CB-CE1 4.22Å; I78-F426 HydrophobicContact CD1-CB 3.97Å; I78-F426 HydrophobicContact CD1-CD1 3.95Å; I78-F426 HydrophobicContact CD1-CD2 4.14Å; I78-F426 HydrophobicContact CD1-CE1 4.48Å; I78-F426 HydrophobicContact CD1-CG 3.74Å; I78-F426 HydrophobicContact CG1-CD1 3.86Å; I78-F426 HydrophobicContact CG1-CD2 4.26Å; I78-F426 HydrophobicContact CG1-CE1 3.89Å; I78-F426 HydrophobicContact CG1-CE2 4.31Å; I78-F426 HydrophobicContact CG1-CG 4.03Å; I78-F426 HydrophobicContact CG1-CZ 4.12Å; I78-F426 HydrophobicContact CG2-CD1 3.59Å; I78-F426 HydrophobicContact CG2-CE1 3.71Å; I78-F426 HydrophobicContact CG2-CG 4.46Å; F231-F426 HydrophobicContact CB-CZ 4.34Å; F231-F426 HydrophobicContact CD1-CE2 4.3Å; F231-F426 AromaticContact CD1-CZ 3.72Å; F231-F426 HydrophobicContact CD1-CZ 3.72Å; F231-F426 HydrophobicContact CD2-CE2 4.44Å; F231-F426 HydrophobicContact CD2-CZ 4.35Å; F231-F426 HydrophobicContact CE1-CE2 4.27Å; F231-F426 HydrophobicContact CE1-CZ 4.08Å; F231-F426 HydrophobicContact CE2-CE2 4.4Å; F231-F426 HydrophobicContact CG-CE2 4.4Å; F231-F426 AromaticContact CG-CZ 3.89Å; F231-F426 HydrophobicContact CG-CZ 3.89Å; F231-F426 HydrophobicContact CZ-CE2 4.33Å; I422-F426 PolarHBondContact O-N 3.38Å; Y423-F426 PolarHBondContact O-N 3.31Å; F426-F429 WeakPolarHBondContact O-CB 3.45Å; F426-F429 PolarHBondContact O-N 3.45Å; F426-L430 HydrophobicContact CD1-CD1 3.93Å; F426-L430 HydrophobicContact CD1-CG 4.29Å; F426-L430 HydrophobicContact CE1-CD1 3.22Å; F426-L430 HydrophobicContact CE1-CG 3.84Å; F426-L430 HydrophobicContact CE2-CG 4.46Å; F426-L430 HydrophobicContact CZ-CD1 3.62Å; F426-L430 HydrophobicContact CZ-CD2 4.21Å; F426-L430 HydrophobicContact CZ-CG 3.93Å; F426-L430 PolarHBondContact O-N 3.42Å |
| 427 | W | 92.5 | Very high | 91.3 | Very high | 61 Ų | 61 | 61.8 Ų | 61.8 | 23% | 0.231 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.2 | -46.6 | 174.6 | 167.6 | 83.8 | 0 | 0 | 0 | 112.8 | Y389 Y423 L424 L425 F429 L430 L431 | Y389-W427 PolarHBondContact O-NE1 3.42Å; Y423-W427 VanDerWaalsContact O-CB 3.22Å; Y423-W427 WeakPolarHBondContact O-CB 3.48Å; Y423-W427 PolarHBondContact O-N 2.91Å; L424-W427 HydrophobicContact CD2-CE3 4.2Å; L424-W427 PolarHBondContact O-N 3.5Å; L425-W427 VanDerWaalsContact C-N 3.34Å; W427-F429 VanDerWaalsContact C-N 3.33Å; W427-F429 PolarHBondContact O-N 3.28Å; W427-L430 PolarHBondContact O-N 3.2Å; W427-L431 HydrophobicContact CD2-CD1 3.91Å; W427-L431 HydrophobicContact CE3-CD1 4.5Å; W427-L431 HydrophobicContact CH2-CD1 3.82Å; W427-L431 HydrophobicContact CZ2-CD1 3.13Å; W427-L431 HydrophobicContact CZ2-CG 4.45Å; W427-L431 HydrophobicContact CZ3-CD1 4.44Å; W427-L431 VanDerWaalsContact NE1-CD1 3.34Å; W427-L431 PolarHBondContact O-N 2.86Å |
| 428 | A | 92.7 | Very high | 91 | Very high | 33 Ų | 33 | 59.9 Ų | 59.9 | 27% | 0.273 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.6 | -42.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111 | L424 L425 I432 | L424-A428 WeakPolarHBondContact O-CB 3.39Å; L424-A428 PolarHBondContact O-N 3.48Å; L425-A428 PolarHBondContact O-N 3.34Å; A428-I432 WeakPolarHBondContact O-CB 3.29Å; A428-I432 WeakPolarHBondContact O-CD1 3.41Å; A428-I432 VanDerWaalsContact O-CG1 3.23Å; A428-I432 WeakPolarHBondContact O-CG1 3.38Å; A428-I432 PolarHBondContact O-N 3.49Å; A428-I432 VanDerWaalsContact O-N 3.12Å |
| 429 | F | 90.6 | Very high | 90.7 | Very high | 76 Ų | 76 | 58.3 Ų | 58.3 | 33% | 0.333 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -55.4 | -55.4 | 172 | 173.6 | -93.4 | 0 | 0 | 0 | 110.9 | V224 L425 F426 W427 L431 I432 F433 | V224-F429 HydrophobicContact CG1-CE2 3.78Å; V224-F429 HydrophobicContact CG1-CZ 3.59Å; L425-F429 WeakPolarHBondContact O-CB 3.44Å; L425-F429 PolarHBondContact O-N 2.87Å; F426-F429 WeakPolarHBondContact O-CB 3.45Å; F426-F429 PolarHBondContact O-N 3.45Å; W427-F429 VanDerWaalsContact C-N 3.33Å; W427-F429 PolarHBondContact O-N 3.28Å; F429-L431 PolarHBondContact O-N 3.22Å; F429-I432 PolarHBondContact O-N 2.99Å; F429-F433 HydrophobicContact CD1-CD2 4.45Å; F429-F433 AromaticContact CD2-CD2 3.47Å; F429-F433 HydrophobicContact CD2-CD2 3.47Å; F429-F433 VanDerWaalsContact CD2-CD2 3.47Å; F429-F433 AromaticContact CD2-CE2 3.34Å; F429-F433 HydrophobicContact CD2-CE2 3.34Å; F429-F433 HydrophobicContact CD2-CZ 4.5Å; F429-F433 HydrophobicContact CE1-CD2 4.38Å; F429-F433 AromaticContact CE2-CD2 3.38Å; F429-F433 HydrophobicContact CE2-CD2 3.38Å; F429-F433 AromaticContact CE2-CE2 3.21Å; F429-F433 HydrophobicContact CE2-CE2 3.21Å; F429-F433 HydrophobicContact CE2-CG 4.37Å; F429-F433 HydrophobicContact CE2-CZ 4.06Å; F429-F433 HydrophobicContact CG-CD2 4.02Å; F429-F433 HydrophobicContact CG-CE2 4.3Å; F429-F433 AromaticContact CZ-CD2 3.87Å; F429-F433 HydrophobicContact CZ-CD2 3.87Å; F429-F433 HydrophobicContact CZ-CE2 4.09Å; F429-F433 VanDerWaalsContact O-CD2 3.26Å; F429-F433 WeakPolarHBondContact O-CD2 3.33Å; F429-F433 PolarHBondContact O-N 2.83Å; F429-F433 VanDerWaalsContact O-N 3.12Å |
| 430 | L | 89.3 | Confident | 90.5 | Very high | 1 Ų | 1 | 58 Ų | 58 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58.7 | -46.5 | -178.7 | -76.2 | -173.9 | 0 | 0 | 0 | 113.1 | A228 F231 Y389 F426 W427 I432 S434 | A228-L430 HydrophobicContact CB-CD2 3.96Å; F231-L430 HydrophobicContact CB-CD1 4.18Å; F231-L430 HydrophobicContact CB-CD2 3.51Å; F231-L430 HydrophobicContact CB-CG 4.49Å; F231-L430 HydrophobicContact CD2-CD2 4.13Å; F231-L430 HydrophobicContact CG-CD2 4.09Å; Y389-L430 HydrophobicContact CE1-CD1 4.42Å; Y389-L430 HydrophobicContact CE2-CD1 4.2Å; F426-L430 HydrophobicContact CD1-CD1 3.93Å; F426-L430 HydrophobicContact CD1-CG 4.29Å; F426-L430 HydrophobicContact CE1-CD1 3.22Å; F426-L430 HydrophobicContact CE1-CG 3.84Å; F426-L430 HydrophobicContact CE2-CG 4.46Å; F426-L430 HydrophobicContact CZ-CD1 3.62Å; F426-L430 HydrophobicContact CZ-CD2 4.21Å; F426-L430 HydrophobicContact CZ-CG 3.93Å; F426-L430 PolarHBondContact O-N 3.42Å; W427-L430 PolarHBondContact O-N 3.2Å; L430-I432 PolarHBondContact O-N 2.97Å; L430-S434 WeakPolarHBondContact O-CB 3.25Å; L430-S434 PolarHBondContact O-N 3.14Å; L430-S434 PolarHBondContact O-OG 3.43Å |
| 431 | L | 89.3 | Confident | 90.1 | Very high | 19 Ų | 19 | 59 Ų | 59 | 10% | 0.099 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.6 | -43.6 | -177.9 | -78.4 | -178.7 | 0 | 0 | 0 | 112.7 | F386 L390 W427 F429 S434 L435 | F386-L431 HydrophobicContact CD2-CD2 3.52Å; F386-L431 HydrophobicContact CE2-CD2 3.27Å; F386-L431 HydrophobicContact CE2-CG 4.44Å; F386-L431 HydrophobicContact CG-CD2 4.38Å; F386-L431 HydrophobicContact CZ-CD2 3.96Å; L390-L431 HydrophobicContact CB-CD2 4.31Å; W427-L431 HydrophobicContact CD2-CD1 3.91Å; W427-L431 HydrophobicContact CE3-CD1 4.5Å; W427-L431 HydrophobicContact CH2-CD1 3.82Å; W427-L431 HydrophobicContact CZ2-CD1 3.13Å; W427-L431 HydrophobicContact CZ2-CG 4.45Å; W427-L431 HydrophobicContact CZ3-CD1 4.44Å; W427-L431 VanDerWaalsContact NE1-CD1 3.34Å; W427-L431 PolarHBondContact O-N 2.86Å; F429-L431 PolarHBondContact O-N 3.22Å; L431-S434 PolarHBondContact O-N 3.26Å; L431-L435 WeakPolarHBondContact O-CB 3.22Å; L431-L435 WeakPolarHBondContact O-CG 3.36Å; L431-L435 PolarHBondContact O-N 3.06Å |
| 432 | I | 91 | Very high | 89.7 | Confident | 112 Ų | 112 | 55.8 Ų | 55.8 | 57% | 0.574 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -65.1 | -48.1 | -178 | -67.9 | 168 | 0 | 0 | 0 | 110.1 | A428 F429 L430 L435 Y436 | A428-I432 WeakPolarHBondContact O-CB 3.29Å; A428-I432 WeakPolarHBondContact O-CD1 3.41Å; A428-I432 VanDerWaalsContact O-CG1 3.23Å; A428-I432 WeakPolarHBondContact O-CG1 3.38Å; A428-I432 PolarHBondContact O-N 3.49Å; A428-I432 VanDerWaalsContact O-N 3.12Å; F429-I432 PolarHBondContact O-N 2.99Å; L430-I432 PolarHBondContact O-N 2.97Å; I432-L435 PolarHBondContact O-N 3.49Å; I432-Y436 PolarHBondContact O-N 3.16Å |
| 433 | F | 88.8 | Confident | 89.5 | Confident | 66 Ų | 66 | 54.1 Ų | 54.1 | 29% | 0.289 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -71.3 | -31 | -179.3 | -77.3 | -76.8 | 0 | 0 | 0 | 112.8 | V224 A228 F429 Y436 S437 | V224-F433 HydrophobicContact CB-CD1 4.15Å; V224-F433 HydrophobicContact CB-CE1 3.9Å; V224-F433 HydrophobicContact CB-CZ 4.48Å; V224-F433 HydrophobicContact CG1-CD1 3.74Å; V224-F433 HydrophobicContact CG1-CD2 4.25Å; V224-F433 HydrophobicContact CG1-CE1 3.5Å; V224-F433 VanDerWaalsContact CG1-CE1 3.5Å; V224-F433 HydrophobicContact CG1-CE2 4.07Å; V224-F433 HydrophobicContact CG1-CG 4.12Å; V224-F433 HydrophobicContact CG1-CZ 3.69Å; A228-F433 HydrophobicContact CB-CB 3.6Å; F429-F433 HydrophobicContact CD1-CD2 4.45Å; F429-F433 AromaticContact CD2-CD2 3.47Å; F429-F433 HydrophobicContact CD2-CD2 3.47Å; F429-F433 VanDerWaalsContact CD2-CD2 3.47Å; F429-F433 AromaticContact CD2-CE2 3.34Å; F429-F433 HydrophobicContact CD2-CE2 3.34Å; F429-F433 HydrophobicContact CD2-CZ 4.5Å; F429-F433 HydrophobicContact CE1-CD2 4.38Å; F429-F433 AromaticContact CE2-CD2 3.38Å; F429-F433 HydrophobicContact CE2-CD2 3.38Å; F429-F433 AromaticContact CE2-CE2 3.21Å; F429-F433 HydrophobicContact CE2-CE2 3.21Å; F429-F433 HydrophobicContact CE2-CG 4.37Å; F429-F433 HydrophobicContact CE2-CZ 4.06Å; F429-F433 HydrophobicContact CG-CD2 4.02Å; F429-F433 HydrophobicContact CG-CE2 4.3Å; F429-F433 AromaticContact CZ-CD2 3.87Å; F429-F433 HydrophobicContact CZ-CD2 3.87Å; F429-F433 HydrophobicContact CZ-CE2 4.09Å; F429-F433 VanDerWaalsContact O-CD2 3.26Å; F429-F433 WeakPolarHBondContact O-CD2 3.33Å; F429-F433 PolarHBondContact O-N 2.83Å; F429-F433 VanDerWaalsContact O-N 3.12Å; F433-Y436 PolarHBondContact O-N 3.32Å; F433-S437 WeakPolarHBondContact O-CB 3.27Å; F433-S437 PolarHBondContact O-N 3.15Å; F433-S437 PolarHBondContact O-OG 3.48Å |
| 434 | S | 85.4 | Confident | 89.2 | Confident | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67.9 | -41.9 | 173.3 | -56.7 | 0 | 0 | 0 | 0 | 111.9 | L232 L430 L431 Y436 S437 E438 | L232-S434 WeakPolarHBondContact CD1-OG 3.46Å; L430-S434 WeakPolarHBondContact O-CB 3.25Å; L430-S434 PolarHBondContact O-N 3.14Å; L430-S434 PolarHBondContact O-OG 3.43Å; L431-S434 PolarHBondContact O-N 3.26Å; S434-Y436 VanDerWaalsContact C-N 3.3Å; S434-Y436 PolarHBondContact O-N 2.9Å; S434-S437 PolarHBondContact O-N 3.39Å; S434-E438 PolarHBondContact O-N 3.2Å |
| 435 | L | 87.8 | Confident | 88.8 | Confident | 67 Ų | 67 | 56.7 Ų | 56.7 | 35% | 0.351 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.3 | -36.2 | 174.3 | -83.9 | 162.9 | 0 | 0 | 0 | 112.5 | F386 L431 I432 P439 C442 L446 | F386-L435 HydrophobicContact CE2-CD1 4.1Å; F386-L435 HydrophobicContact CE2-CD2 4.19Å; F386-L435 HydrophobicContact CE2-CG 3.71Å; F386-L435 HydrophobicContact CZ-CD1 4.15Å; F386-L435 HydrophobicContact CZ-CD2 3.98Å; F386-L435 HydrophobicContact CZ-CG 3.94Å; L431-L435 WeakPolarHBondContact O-CB 3.22Å; L431-L435 WeakPolarHBondContact O-CG 3.36Å; L431-L435 PolarHBondContact O-N 3.06Å; I432-L435 PolarHBondContact O-N 3.49Å; L435-P439 VanDerWaalsContact O-CA 3.31Å; L435-P439 WeakPolarHBondContact O-CA 3.24Å; L435-P439 WeakPolarHBondContact O-CB 3.35Å; L435-C442 HydrophobicContact CD2-CB 3.51Å; L435-C442 HydrophobicContact CG-CB 4.21Å; L435-L446 HydrophobicContact CD2-CD1 4.24Å |
| 436 | Y | 88.4 | Confident | 88.6 | Confident | 179 Ų | 179 | 53.2 Ų | 53.2 | 70% | 0.702 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -68.1 | -42 | 175.6 | 178.5 | -100.2 | 0 | 0 | 0 | 112 | I432 F433 S434 | I432-Y436 PolarHBondContact O-N 3.16Å; F433-Y436 PolarHBondContact O-N 3.32Å; S434-Y436 VanDerWaalsContact C-N 3.3Å; S434-Y436 PolarHBondContact O-N 2.9Å |
| 437 | S | 85.3 | Confident | 88.5 | Confident | 37 Ų | 37 | 54.1 Ų | 54.1 | 26% | 0.259 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -76.6 | -46.1 | -174.6 | -51.4 | 0 | 0 | 0 | 0 | 112.6 | G225 F433 S434 | G225-S437 WeakPolarHBondContact CA-OG 3.44Å; G225-S437 PolarHBondContact O-OG 2.89Å; F433-S437 WeakPolarHBondContact O-CB 3.27Å; F433-S437 PolarHBondContact O-N 3.15Å; F433-S437 PolarHBondContact O-OG 3.48Å; S434-S437 PolarHBondContact O-N 3.39Å |
| 438 | E | 83.8 | Confident | 88.3 | Confident | 53 Ų | 53 | 53.5 Ų | 53.5 | 25% | 0.248 | 29% | 0.293 | C | S | . | . | trans | -128.6 | 69.5 | -178.8 | -68 | -165.1 | 158.2 | 0 | 0 | 112 | L229 N382 S434 V440 V441 C442 | L229-E438 HydrophobicContact CD1-CG 4.43Å; L229-E438 HydrophobicContact CD2-CG 4.44Å; N382-E438 WeakPolarHBondContact CB-OE2 3.38Å; N382-E438 VanDerWaalsContact ND2-CD 3.29Å; N382-E438 PolarHBondContact ND2-OE1 3.05Å; N382-E438 PolarHBondContact ND2-OE2 3.47Å; S434-E438 PolarHBondContact O-N 3.2Å; E438-V440 VanDerWaalsContact C-N 3.28Å; E438-V440 PolarHBondContact O-N 3.31Å; E438-V441 HydrophobicContact CB-CB 4.25Å; E438-V441 HydrophobicContact CB-CG2 4.33Å; E438-V441 PolarHBondContact O-N 3.17Å; E438-C442 PolarHBondContact O-N 3.39Å; E438-C442 VanDerWaalsContact O-N 3.13Å; E438-C442 PolarHBondContact O-SG 3.16Å | ||
| 439 | P | 89 | Confident | 88.2 | Confident | 77 Ų | 77 | 53.4 Ų | 53.4 | 50% | 0.5 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.6 | -32.8 | -174.2 | 23.3 | -33.6 | 0 | 0 | 0 | 113.1 | L435 G443 | L435-P439 VanDerWaalsContact O-CA 3.31Å; L435-P439 WeakPolarHBondContact O-CA 3.24Å; L435-P439 WeakPolarHBondContact O-CB 3.35Å; P439-G443 WeakPolarHBondContact O-CA 3.44Å; P439-G443 PolarHBondContact O-N 3.41Å |
| 440 | V | 89.1 | Confident | 88.3 | Confident | 109 Ų | 109 | 55 Ų | 55 | 66% | 0.661 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -68.6 | -48.7 | -179.2 | -179.8 | 0 | 0 | 0 | 0 | 110.8 | E438 G443 I444 | E438-V440 VanDerWaalsContact C-N 3.28Å; E438-V440 PolarHBondContact O-N 3.31Å; V440-G443 PolarHBondContact O-N 2.89Å; V440-I444 HydrophobicContact CG1-CD1 4.09Å; V440-I444 VanDerWaalsContact O-CG1 3.29Å; V440-I444 WeakPolarHBondContact O-CG1 3.32Å; V440-I444 PolarHBondContact O-N 3.03Å |
| 441 | V | 84.9 | Confident | 88.5 | Confident | 22 Ų | 22 | 58.2 Ų | 58.2 | 13% | 0.133 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -64.5 | -48.4 | -178.2 | -178.8 | 0 | 0 | 0 | 0 | 110.2 | T379 N382 Y383 E438 G443 I444 G445 | T379-V441 HydrophobicContact CG2-CG1 4.17Å; T379-V441 HydrophobicContact CG2-CG2 3.67Å; N382-V441 HydrophobicContact CB-CG1 4.42Å; Y383-V441 HydrophobicContact CD2-CG1 4.22Å; E438-V441 HydrophobicContact CB-CB 4.25Å; E438-V441 HydrophobicContact CB-CG2 4.33Å; E438-V441 PolarHBondContact O-N 3.17Å; V441-G443 PolarHBondContact O-N 3.2Å; V441-I444 PolarHBondContact O-N 3.14Å; V441-G445 PolarHBondContact O-N 2.93Å |
| 442 | C | 85.6 | Confident | 88.6 | Confident | 3 Ų | 3 | 57.3 Ų | 57.3 | 2% | 0.02 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -65.5 | -39.4 | 178.2 | -60.9 | 0 | 0 | 0 | 0 | 111.9 | F386 L435 E438 G445 L446 | F386-C442 HydrophobicContact CD1-CB 4.02Å; F386-C442 HydrophobicContact CD2-CB 4.11Å; F386-C442 VanDerWaalsContact CD2-SG 3.6Å; F386-C442 HydrophobicContact CE1-CB 3.97Å; F386-C442 HydrophobicContact CE2-CB 4.04Å; F386-C442 HydrophobicContact CG-CB 4.11Å; F386-C442 HydrophobicContact CZ-CB 3.98Å; L435-C442 HydrophobicContact CD2-CB 3.51Å; L435-C442 HydrophobicContact CG-CB 4.21Å; E438-C442 PolarHBondContact O-N 3.39Å; E438-C442 VanDerWaalsContact O-N 3.13Å; E438-C442 PolarHBondContact O-SG 3.16Å; C442-G445 PolarHBondContact O-N 3.39Å; C442-G445 VanDerWaalsContact O-N 3.14Å; C442-L446 PolarHBondContact O-N 3.44Å |
| 443 | G | 89.4 | Confident | 88.7 | Confident | 32 Ų | 32 | 54 Ų | 54 | 33% | 0.33 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -62.8 | -41.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | P439 V440 V441 G445 L446 A447 | P439-G443 WeakPolarHBondContact O-CA 3.44Å; P439-G443 PolarHBondContact O-N 3.41Å; V440-G443 PolarHBondContact O-N 2.89Å; V441-G443 PolarHBondContact O-N 3.2Å; G443-G445 VanDerWaalsContact C-N 3.27Å; G443-G445 PolarHBondContact O-N 2.88Å; G443-L446 PolarHBondContact O-N 2.96Å; G443-A447 WeakPolarHBondContact O-CB 3.12Å; G443-A447 PolarHBondContact O-N 2.99Å |
| 444 | I | 87.9 | Confident | 88.9 | Confident | 92 Ų | 92 | 54.6 Ų | 54.6 | 47% | 0.472 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.1 | -37.9 | 173.8 | -66.7 | 164.2 | 0 | 0 | 0 | 110.6 | Y383 V440 V441 A447 I448 | Y383-I444 HydrophobicContact CE2-CB 4.35Å; Y383-I444 HydrophobicContact CE2-CG2 4.03Å; V440-I444 HydrophobicContact CG1-CD1 4.09Å; V440-I444 VanDerWaalsContact O-CG1 3.29Å; V440-I444 WeakPolarHBondContact O-CG1 3.32Å; V440-I444 PolarHBondContact O-N 3.03Å; V441-I444 PolarHBondContact O-N 3.14Å; I444-A447 PolarHBondContact O-N 3.49Å; I444-I448 HydrophobicContact CG2-CD1 4.03Å; I444-I448 PolarHBondContact O-N 3.2Å |
| 445 | G | 86.1 | Confident | 89.1 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.6 | -46.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | V441 C442 G443 A447 I448 M449 | V441-G445 PolarHBondContact O-N 2.93Å; C442-G445 PolarHBondContact O-N 3.39Å; C442-G445 VanDerWaalsContact O-N 3.14Å; G443-G445 VanDerWaalsContact C-N 3.27Å; G443-G445 PolarHBondContact O-N 2.88Å; G445-A447 VanDerWaalsContact C-N 3.35Å; G445-I448 PolarHBondContact O-N 2.91Å; G445-M449 PolarHBondContact O-N 2.87Å |
| 446 | L | 90.3 | Very high | 89.2 | Confident | 48 Ų | 48 | 55.7 Ų | 55.7 | 25% | 0.251 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.6 | -38.6 | 174.8 | -65.9 | 177 | 0 | 0 | 0 | 112 | F386 L390 L435 C442 G443 M449 L450 | F386-L446 HydrophobicContact CE1-CD1 4.44Å; F386-L446 HydrophobicContact CE1-CD2 3.94Å; F386-L446 HydrophobicContact CE1-CG 3.91Å; F386-L446 HydrophobicContact CZ-CD1 4.33Å; F386-L446 HydrophobicContact CZ-CD2 4.27Å; F386-L446 HydrophobicContact CZ-CG 4.27Å; L390-L446 HydrophobicContact CD1-CD2 3.56Å; L435-L446 HydrophobicContact CD2-CD1 4.24Å; C442-L446 PolarHBondContact O-N 3.44Å; G443-L446 PolarHBondContact O-N 2.96Å; L446-M449 HydrophobicContact CD2-CE 3.76Å; L446-M449 WeakPolarHBondContact O-CB 3.5Å; L446-M449 PolarHBondContact O-N 3.44Å; L446-L450 WeakPolarHBondContact O-CG 3.45Å; L446-L450 PolarHBondContact O-N 3.35Å |
| 447 | A | 91.6 | Very high | 89.2 | Confident | 50 Ų | 50 | 51.8 Ų | 51.8 | 41% | 0.413 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -60.7 | -47.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | G443 I444 G445 M449 L450 T451 | G443-A447 WeakPolarHBondContact O-CB 3.12Å; G443-A447 PolarHBondContact O-N 2.99Å; I444-A447 PolarHBondContact O-N 3.49Å; G445-A447 VanDerWaalsContact C-N 3.35Å; A447-M449 VanDerWaalsContact C-N 3.3Å; A447-M449 PolarHBondContact O-N 3.13Å; A447-L450 PolarHBondContact O-N 3Å; A447-L450 VanDerWaalsContact O-N 3.12Å; A447-T451 WeakPolarHBondContact O-CG2 3.47Å; A447-T451 PolarHBondContact O-N 3.42Å |
| 448 | I | 89.2 | Confident | 89.3 | Confident | 47 Ų | 47 | 54.2 Ų | 54.2 | 24% | 0.241 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.2 | -37.6 | 177 | -71.2 | 167.1 | 0 | 0 | 0 | 111.1 | W117 I118 V122 Y383 I444 G445 L450 T451 | W117-I448 PolarHBondContact NE1-O 2.9Å; I118-I448 HydrophobicContact CD1-CG2 4.04Å; V122-I448 HydrophobicContact CG2-CG2 3.77Å; Y383-I448 WeakPolarHBondContact OH-CD1 3.33Å; I444-I448 HydrophobicContact CG2-CD1 4.03Å; I444-I448 PolarHBondContact O-N 3.2Å; G445-I448 PolarHBondContact O-N 2.91Å; I448-L450 PolarHBondContact O-N 3.13Å; I448-T451 PolarHBondContact O-N 3.33Å; I448-T451 PolarHBondContact O-OG1 3.01Å |
| 449 | M | 90.4 | Very high | 89.2 | Confident | 31 Ų | 31 | 53.1 Ų | 53.1 | 15% | 0.153 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -60.6 | -46.6 | 172.4 | -176.2 | -178.5 | 65.8 | 0 | 0 | 111.2 | L114 I118 L390 F391 G445 L446 A447 T451 G452 | L114-M449 WeakPolarHBondContact CD2-O 3.44Å; I118-M449 HydrophobicContact CD1-CB 3.85Å; I118-M449 HydrophobicContact CG1-CB 3.98Å; I118-M449 HydrophobicContact CG1-CG 4.1Å; L390-M449 HydrophobicContact CD2-SD 4.02Å; F391-M449 HydrophobicContact CE2-SD 4.23Å; F391-M449 HydrophobicContact CZ-CG 4.39Å; F391-M449 HydrophobicContact CZ-SD 3.95Å; G445-M449 PolarHBondContact O-N 2.87Å; L446-M449 HydrophobicContact CD2-CE 3.76Å; L446-M449 WeakPolarHBondContact O-CB 3.5Å; L446-M449 PolarHBondContact O-N 3.44Å; A447-M449 VanDerWaalsContact C-N 3.3Å; A447-M449 PolarHBondContact O-N 3.13Å; M449-T451 VanDerWaalsContact C-N 3.28Å; M449-T451 PolarHBondContact O-N 3.09Å; M449-G452 PolarHBondContact O-N 3.5Å |
| 450 | L | 92.1 | Very high | 88.9 | Confident | 111 Ų | 111 | 51.7 Ų | 51.7 | 58% | 0.581 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -64.7 | -30 | 179 | -70.4 | 173.1 | 0 | 0 | 0 | 112.8 | L446 A447 I448 G452 V453 P454 | L446-L450 WeakPolarHBondContact O-CG 3.45Å; L446-L450 PolarHBondContact O-N 3.35Å; A447-L450 PolarHBondContact O-N 3Å; A447-L450 VanDerWaalsContact O-N 3.12Å; I448-L450 PolarHBondContact O-N 3.13Å; L450-G452 PolarHBondContact O-N 3.48Å; L450-V453 WeakPolarHBondContact O-CB 3.42Å; L450-V453 PolarHBondContact O-N 3.36Å; L450-V453 VanDerWaalsContact O-N 3.08Å; L450-P454 WeakPolarHBondContact O-CD 3.24Å |
| 451 | T | 94.1 | Very high | 88.6 | Confident | 67 Ų | 67 | 54.4 Ų | 54.4 | 41% | 0.411 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.9 | -21.3 | 171.8 | 68.1 | 0 | 0 | 0 | 0 | 113.4 | W117 A447 I448 M449 V453 P454 V455 | W117-T451 PolarHBondContact NE1-OG1 2.97Å; A447-T451 WeakPolarHBondContact O-CG2 3.47Å; A447-T451 PolarHBondContact O-N 3.42Å; I448-T451 PolarHBondContact O-N 3.33Å; I448-T451 PolarHBondContact O-OG1 3.01Å; M449-T451 VanDerWaalsContact C-N 3.28Å; M449-T451 PolarHBondContact O-N 3.09Å; T451-V453 VanDerWaalsContact C-N 3.27Å; T451-V453 PolarHBondContact O-N 2.96Å; T451-P454 VanDerWaalsContact O-CD 3.23Å; T451-P454 WeakPolarHBondContact O-CD 3.36Å; T451-P454 VanDerWaalsContact O-CG 3.29Å; T451-P454 WeakPolarHBondContact O-CG 3.27Å; T451-V455 WeakPolarHBondContact O-CG2 3.44Å |
| 452 | G | 90.9 | Very high | 88.4 | Confident | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -67.4 | -26.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F113 M449 L450 Y456 | F113-G452 WeakPolarHBondContact CE1-O 3.3Å; M449-G452 PolarHBondContact O-N 3.5Å; L450-G452 PolarHBondContact O-N 3.48Å; G452-Y456 WeakPolarHBondContact O-CB 3.31Å; G452-Y456 PolarHBondContact O-N 2.93Å |
| 453 | V | 92.8 | Very high | 87.7 | Confident | 42 Ų | 42 | 66.8 Ų | 66.8 | 26% | 0.255 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64 | -55.9 | 179.8 | -178.3 | 0 | 0 | 0 | 0 | 112.3 | L114 L450 T451 V455 Y456 F457 | L114-V453 HydrophobicContact CD1-CG2 4.3Å; L114-V453 HydrophobicContact CD2-CG2 4Å; L450-V453 WeakPolarHBondContact O-CB 3.42Å; L450-V453 PolarHBondContact O-N 3.36Å; L450-V453 VanDerWaalsContact O-N 3.08Å; T451-V453 VanDerWaalsContact C-N 3.27Å; T451-V453 PolarHBondContact O-N 2.96Å; V453-V455 VanDerWaalsContact C-N 3.28Å; V453-V455 PolarHBondContact O-N 3.31Å; V453-Y456 WeakPolarHBondContact O-CB 3.46Å; V453-Y456 PolarHBondContact O-N 2.92Å; V453-F457 HydrophobicContact CG1-CD2 3.92Å; V453-F457 HydrophobicContact CG1-CE2 3.72Å; V453-F457 VanDerWaalsContact O-CD2 3.24Å; V453-F457 WeakPolarHBondContact O-CD2 3.25Å; V453-F457 PolarHBondContact O-N 3.12Å; V453-F457 VanDerWaalsContact O-N 3.15Å |
| 454 | P | 92.7 | Very high | 86.9 | Confident | 80 Ų | 80 | 72.1 Ų | 72.1 | 52% | 0.519 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.1 | -35.2 | 178.1 | 24.7 | -34 | 0 | 0 | 0 | 112.2 | L450 T451 Y456 F457 L458 | L450-P454 WeakPolarHBondContact O-CD 3.24Å; T451-P454 VanDerWaalsContact O-CD 3.23Å; T451-P454 WeakPolarHBondContact O-CD 3.36Å; T451-P454 VanDerWaalsContact O-CG 3.29Å; T451-P454 WeakPolarHBondContact O-CG 3.27Å; P454-Y456 VanDerWaalsContact C-N 3.35Å; P454-F457 PolarHBondContact O-N 3.46Å; P454-L458 WeakPolarHBondContact O-CB 3.45Å; P454-L458 PolarHBondContact O-N 3.18Å |
| 455 | V | 90.5 | Very high | 86.4 | Confident | 59 Ų | 59 | 70.5 Ų | 70.5 | 36% | 0.358 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66.1 | -37.6 | 176.8 | 178.8 | 0 | 0 | 0 | 0 | 111.4 | F113 W117 T451 V453 L458 G459 | F113-V455 HydrophobicContact CZ-CB 4.47Å; F113-V455 HydrophobicContact CZ-CG1 4Å; W117-V455 HydrophobicContact CE3-CG1 4.5Å; W117-V455 HydrophobicContact CH2-CB 4.27Å; W117-V455 HydrophobicContact CH2-CG1 3.94Å; W117-V455 HydrophobicContact CH2-CG2 3.96Å; W117-V455 HydrophobicContact CZ2-CG2 4.13Å; W117-V455 HydrophobicContact CZ3-CB 4.47Å; W117-V455 HydrophobicContact CZ3-CG1 3.82Å; T451-V455 WeakPolarHBondContact O-CG2 3.44Å; V453-V455 VanDerWaalsContact C-N 3.28Å; V453-V455 PolarHBondContact O-N 3.31Å; V455-L458 PolarHBondContact O-N 3.33Å; V455-G459 WeakPolarHBondContact O-CA 3.28Å; V455-G459 PolarHBondContact O-N 3.1Å |
| 456 | Y | 89.1 | Confident | 86.3 | Confident | 30 Ų | 30 | 73.6 Ų | 73.6 | 12% | 0.118 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -62.6 | -46 | 174.3 | 177.5 | -99.2 | 0 | 0 | 0 | 112 | L110 F113 G452 V453 P454 L458 G459 V460 Y461 | L110-Y456 HydrophobicContact CB-CD1 4.27Å; L110-Y456 HydrophobicContact CB-CE1 3.99Å; L110-Y456 HydrophobicContact CD1-CD1 3.47Å; L110-Y456 VanDerWaalsContact CD1-CD1 3.47Å; L110-Y456 HydrophobicContact CD1-CD2 4.45Å; L110-Y456 HydrophobicContact CD1-CE1 4.07Å; L110-Y456 HydrophobicContact CD1-CG 3.67Å; L110-Y456 HydrophobicContact CG-CD1 4.44Å; L110-Y456 PolarHBondContact N-OH 2.99Å; F113-Y456 HydrophobicContact CB-CD2 3.4Å; F113-Y456 HydrophobicContact CB-CE2 3.83Å; F113-Y456 HydrophobicContact CB-CG 4.31Å; F113-Y456 AromaticContact CD1-CD2 3.93Å; F113-Y456 HydrophobicContact CD1-CD2 3.93Å; F113-Y456 HydrophobicContact CD1-CG 4.23Å; F113-Y456 AromaticContact CD2-CD2 3.84Å; F113-Y456 HydrophobicContact CD2-CD2 3.84Å; F113-Y456 AromaticContact CG-CD2 3.44Å; F113-Y456 HydrophobicContact CG-CD2 3.44Å; F113-Y456 VanDerWaalsContact CG-CD2 3.44Å; F113-Y456 HydrophobicContact CG-CE2 4.3Å; F113-Y456 HydrophobicContact CG-CG 4.19Å; G452-Y456 WeakPolarHBondContact O-CB 3.31Å; G452-Y456 PolarHBondContact O-N 2.93Å; V453-Y456 WeakPolarHBondContact O-CB 3.46Å; V453-Y456 PolarHBondContact O-N 2.92Å; P454-Y456 VanDerWaalsContact C-N 3.35Å; Y456-L458 VanDerWaalsContact C-N 3.35Å; Y456-L458 PolarHBondContact O-N 3.46Å; Y456-G459 PolarHBondContact O-N 3.24Å; Y456-V460 HydrophobicContact CD2-CB 3.97Å; Y456-V460 HydrophobicContact CD2-CG2 3.94Å; Y456-V460 HydrophobicContact CE2-CB 3.85Å; Y456-V460 HydrophobicContact CE2-CG1 3.93Å; Y456-V460 HydrophobicContact CE2-CG2 4.08Å; Y456-V460 PolarHBondContact O-N 3.16Å; Y456-Y461 PolarHBondContact O-N 3.36Å |
| 457 | F | 89.3 | Confident | 85.8 | Confident | 98 Ų | 98 | 79.3 Ų | 79.3 | 43% | 0.43 | 41% | 0.412 | S | S | . | . | I | π-helix | trans | -65.6 | -38.9 | 179.4 | -79 | -71.3 | 0 | 0 | 0 | 112.2 | V453 P454 Y461 W462 | V453-F457 HydrophobicContact CG1-CD2 3.92Å; V453-F457 HydrophobicContact CG1-CE2 3.72Å; V453-F457 VanDerWaalsContact O-CD2 3.24Å; V453-F457 WeakPolarHBondContact O-CD2 3.25Å; V453-F457 PolarHBondContact O-N 3.12Å; V453-F457 VanDerWaalsContact O-N 3.15Å; P454-F457 PolarHBondContact O-N 3.46Å; F457-Y461 AromaticContact CD1-CD1 3.85Å; F457-Y461 HydrophobicContact CD1-CD1 3.85Å; F457-Y461 AromaticContact CD1-CG 3.96Å; F457-Y461 HydrophobicContact CD1-CG 3.96Å; F457-Y461 HydrophobicContact CE1-CD1 4.23Å; F457-Y461 HydrophobicContact CE1-CG 4.3Å; F457-W462 WeakPolarHBondContact O-CB 3.47Å; F457-W462 PolarHBondContact O-N 3.21Å; F457-W462 VanDerWaalsContact O-N 3.1Å |
| 458 | L | 86.7 | Confident | 85.4 | Confident | 87 Ų | 87 | 81.9 Ų | 81.9 | 46% | 0.455 | 43% | 0.426 | S | S | . | . | I | π-helix | trans | -73.6 | -37 | 177.5 | -170.7 | 151.9 | 0 | 0 | 0 | 112.5 | P454 V455 Y456 W462 F469 | P454-L458 WeakPolarHBondContact O-CB 3.45Å; P454-L458 PolarHBondContact O-N 3.18Å; V455-L458 PolarHBondContact O-N 3.33Å; Y456-L458 VanDerWaalsContact C-N 3.35Å; Y456-L458 PolarHBondContact O-N 3.46Å; L458-W462 HydrophobicContact CG-CE3 3.97Å; L458-W462 HydrophobicContact CG-CZ3 4.1Å; L458-W462 WeakPolarHBondContact O-CB 3.48Å; L458-F469 HydrophobicContact CD2-CZ 4.4Å |
| 459 | G | 82.2 | Confident | 85.1 | Confident | 30 Ų | 30 | 83.4 Ų | 83.4 | 31% | 0.309 | 43% | 0.431 | S | S | . | . | I | π-helix | trans | -86.1 | -48.4 | -173.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | V455 Y456 K465 | V455-G459 WeakPolarHBondContact O-CA 3.28Å; V455-G459 PolarHBondContact O-N 3.1Å; Y456-G459 PolarHBondContact O-N 3.24Å; G459-K465 WeakPolarHBondContact O-CE 3.48Å; G459-K465 PolarHBondContact O-NZ 3.25Å |
| 460 | V | 81.3 | Confident | 84.7 | Confident | 48 Ų | 48 | 84.9 Ų | 84.9 | 29% | 0.291 | 44% | 0.439 | S | S | . | . | I | π-helix | trans | -106.2 | -46.1 | -168.7 | -176.5 | 0 | 0 | 0 | 0 | 111.9 | F113 Y456 | F113-V460 HydrophobicContact CD2-CG2 4.47Å; Y456-V460 HydrophobicContact CD2-CB 3.97Å; Y456-V460 HydrophobicContact CD2-CG2 3.94Å; Y456-V460 HydrophobicContact CE2-CB 3.85Å; Y456-V460 HydrophobicContact CE2-CG1 3.93Å; Y456-V460 HydrophobicContact CE2-CG2 4.08Å; Y456-V460 PolarHBondContact O-N 3.16Å |
| 461 | Y | 83.3 | Confident | 84.4 | Confident | 165 Ų | 165 | 83.8 Ų | 83.8 | 65% | 0.647 | 44% | 0.438 | S | S | * | . | I | π-helix | trans | -78.6 | -21.6 | -175.6 | -165 | -104.2 | 0 | 0 | 0 | 113.4 | Y456 F457 E463 | Y456-Y461 PolarHBondContact O-N 3.36Å; F457-Y461 AromaticContact CD1-CD1 3.85Å; F457-Y461 HydrophobicContact CD1-CD1 3.85Å; F457-Y461 AromaticContact CD1-CG 3.96Å; F457-Y461 HydrophobicContact CD1-CG 3.96Å; F457-Y461 HydrophobicContact CE1-CD1 4.23Å; F457-Y461 HydrophobicContact CE1-CG 4.3Å; Y461-E463 PolarHBondContact O-N 2.95Å; Y461-E463 VanDerWaalsContact O-N 3.11Å |
| 462 | W | 81.1 | Confident | 84.1 | Confident | 107 Ų | 107 | 86.8 Ų | 86.8 | 41% | 0.405 | 45% | 0.445 | S | S | . | . | trans | -78.6 | 95.1 | 178.8 | -165.4 | 2.3 | 0 | 0 | 0 | 110.7 | F457 L458 N464 K465 P466 | F457-W462 WeakPolarHBondContact O-CB 3.47Å; F457-W462 PolarHBondContact O-N 3.21Å; F457-W462 VanDerWaalsContact O-N 3.1Å; L458-W462 HydrophobicContact CG-CE3 3.97Å; L458-W462 HydrophobicContact CG-CZ3 4.1Å; L458-W462 WeakPolarHBondContact O-CB 3.48Å; W462-N464 PolarHBondContact NE1-O 3.01Å; W462-K465 HydrophobicContact CB-CG 4.47Å; W462-K465 HydrophobicContact CD2-CG 4.22Å; W462-K465 HydrophobicContact CE3-CG 4.49Å; W462-K465 HydrophobicContact CG-CG 4.18Å; W462-K465 VanDerWaalsContact O-CE 3.27Å; W462-K465 WeakPolarHBondContact O-CE 3.43Å; W462-K465 WeakPolarHBondContact O-CG 3.27Å; W462-P466 HydrophobicContact CH2-CG 4.11Å; W462-P466 HydrophobicContact CZ2-CG 4.08Å | ||
| 463 | E | 70.1 | Confident | 83.8 | Confident | 179 Ų | 179 | 88.7 Ų | 88.7 | 84% | 0.836 | 46% | 0.456 | S | S | * | . | trans | -74.9 | -40.5 | 179 | -67.3 | -179.1 | 169.8 | 0 | 0 | 112.6 | Y461 K465 | Y461-E463 PolarHBondContact O-N 2.95Å; Y461-E463 VanDerWaalsContact O-N 3.11Å; E463-K465 PolarHBondContact O-N 3.47Å | ||
| 464 | N | 73.4 | Confident | 83.5 | Confident | 144 Ų | 144 | 91.8 Ų | 91.8 | 77% | 0.77 | 47% | 0.472 | S | S | * | . | S | Bend | trans | -92.5 | 64.7 | -177.9 | -68.7 | -33.8 | 0 | 0 | 0 | 112.4 | W462 | W462-N464 PolarHBondContact NE1-O 3.01Š|
| 465 | K | 78.3 | Confident | 83.3 | Confident | 57 Ų | 57 | 95 Ų | 95 | 25% | 0.248 | 48% | 0.478 | C | S | . | . | trans | -68.1 | 145.1 | 177.8 | -69.2 | 174.3 | -174.3 | 168.6 | 0 | 110.9 | G459 W462 E463 Q467 F469 D470 | G459-K465 WeakPolarHBondContact O-CE 3.48Å; G459-K465 PolarHBondContact O-NZ 3.25Å; W462-K465 HydrophobicContact CB-CG 4.47Å; W462-K465 HydrophobicContact CD2-CG 4.22Å; W462-K465 HydrophobicContact CE3-CG 4.49Å; W462-K465 HydrophobicContact CG-CG 4.18Å; W462-K465 VanDerWaalsContact O-CE 3.27Å; W462-K465 WeakPolarHBondContact O-CE 3.43Å; W462-K465 WeakPolarHBondContact O-CG 3.27Å; E463-K465 PolarHBondContact O-N 3.47Å; K465-Q467 PolarHBondContact O-N 3.5Å; K465-F469 HydrophobicContact CD-CD1 3.91Å; K465-F469 HydrophobicContact CD-CE1 4.11Å; K465-D470 WeakPolarHBondContact CD-OD1 3.49Å | ||
| 466 | P | 82.7 | Confident | 83.2 | Confident | 65 Ų | 65 | 96.1 Ų | 96.1 | 42% | 0.422 | 48% | 0.48 | S | S | . | . | trans | -61.1 | 135.5 | 171.9 | -16.6 | 28.7 | 0 | 0 | 0 | 109.5 | W462 C468 F469 D470 | W462-P466 HydrophobicContact CH2-CG 4.11Å; W462-P466 HydrophobicContact CZ2-CG 4.08Å; P466-C468 PolarHBondContact O-N 2.9Å; P466-F469 WeakPolarHBondContact O-CB 3.23Å; P466-F469 PolarHBondContact O-N 3.24Å; P466-D470 PolarHBondContact O-N 2.97Å | ||
| 467 | Q | 79.4 | Confident | 83.2 | Confident | 168 Ų | 168 | 95.3 Ų | 95.3 | 79% | 0.785 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -52.3 | -29.6 | 178.7 | -70.7 | 179.6 | -11.2 | 0 | 0 | 113.3 | K465 F469 T471 | K465-Q467 PolarHBondContact O-N 3.5Å; Q467-F469 VanDerWaalsContact C-N 3.34Å; Q467-F469 PolarHBondContact O-N 2.92Å; Q467-T471 VanDerWaalsContact O-CB 3.3Å; Q467-T471 WeakPolarHBondContact O-CB 3.34Å; Q467-T471 PolarHBondContact O-N 2.93Å; Q467-T471 PolarHBondContact O-OG1 2.98Å |
| 468 | C | 83.7 | Confident | 83.2 | Confident | 105 Ų | 105 | 96.6 Ų | 96.6 | 71% | 0.709 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61 | -39.5 | 174.5 | -174.9 | 0 | 0 | 0 | 0 | 112.8 | P466 F472 | P466-C468 PolarHBondContact O-N 2.9Å; C468-F472 WeakPolarHBondContact O-CB 3.45Å; C468-F472 PolarHBondContact O-N 3.35Å |
| 469 | F | 83.4 | Confident | 83.4 | Confident | 78 Ų | 78 | 95.4 Ų | 95.4 | 34% | 0.342 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -70.6 | -45.8 | 178.9 | -175 | -92 | 0 | 0 | 0 | 111.3 | L458 K465 P466 Q467 T471 F472 V473 | L458-F469 HydrophobicContact CD2-CZ 4.4Å; K465-F469 HydrophobicContact CD-CD1 3.91Å; K465-F469 HydrophobicContact CD-CE1 4.11Å; P466-F469 WeakPolarHBondContact O-CB 3.23Å; P466-F469 PolarHBondContact O-N 3.24Å; Q467-F469 VanDerWaalsContact C-N 3.34Å; Q467-F469 PolarHBondContact O-N 2.92Å; F469-T471 PolarHBondContact O-N 3.21Å; F469-F472 WeakPolarHBondContact O-CB 3.42Å; F469-F472 PolarHBondContact O-N 3.48Å; F469-F472 VanDerWaalsContact O-N 3.14Å; F469-V473 HydrophobicContact CD1-CG2 4.04Å; F469-V473 HydrophobicContact CE1-CG2 3.66Å; F469-V473 HydrophobicContact CZ-CG2 4.05Å; F469-V473 WeakPolarHBondContact O-CG2 3.24Å; F469-V473 PolarHBondContact O-N 2.97Å |
| 470 | D | 81.5 | Confident | 83.6 | Confident | 63 Ų | 63 | 94.5 Ų | 94.5 | 34% | 0.337 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.2 | -42.2 | 177.7 | -66.5 | -27.4 | 0 | 0 | 0 | 111 | K465 P466 F472 V473 D474 | K465-D470 WeakPolarHBondContact CD-OD1 3.49Å; P466-D470 PolarHBondContact O-N 2.97Å; D470-F472 VanDerWaalsContact C-N 3.26Å; D470-F472 PolarHBondContact O-N 3.35Å; D470-V473 PolarHBondContact O-N 2.87Å; D470-V473 VanDerWaalsContact O-N 3.15Å; D470-D474 WeakPolarHBondContact O-CB 3.3Å; D470-D474 PolarHBondContact O-N 3.43Å |
| 471 | T | 86.1 | Confident | 83.9 | Confident | 88 Ų | 88 | 95.2 Ų | 95.2 | 54% | 0.54 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.1 | -37.7 | 173.5 | -54.1 | 0 | 0 | 0 | 0 | 111.9 | Q467 F469 K475 | Q467-T471 VanDerWaalsContact O-CB 3.3Å; Q467-T471 WeakPolarHBondContact O-CB 3.34Å; Q467-T471 PolarHBondContact O-N 2.93Å; Q467-T471 PolarHBondContact O-OG1 2.98Å; F469-T471 PolarHBondContact O-N 3.21Å; T471-K475 VanDerWaalsContact O-CB 3.22Å; T471-K475 WeakPolarHBondContact O-CB 3.4Å; T471-K475 PolarHBondContact O-N 3.4Å |
| 472 | F | 87.1 | Confident | 84.2 | Confident | 129 Ų | 129 | 93.6 Ų | 93.6 | 57% | 0.566 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -67.2 | -45.9 | 175.8 | 173.6 | -96.9 | 0 | 0 | 0 | 111.9 | C468 F469 D470 D474 K475 M476 | C468-F472 WeakPolarHBondContact O-CB 3.45Å; C468-F472 PolarHBondContact O-N 3.35Å; F469-F472 WeakPolarHBondContact O-CB 3.42Å; F469-F472 PolarHBondContact O-N 3.48Å; F469-F472 VanDerWaalsContact O-N 3.14Å; D470-F472 VanDerWaalsContact C-N 3.26Å; D470-F472 PolarHBondContact O-N 3.35Å; F472-D474 VanDerWaalsContact C-N 3.35Å; F472-K475 PolarHBondContact O-N 3.09Å; F472-M476 HydrophobicContact CE1-SD 4.47Å; F472-M476 WeakPolarHBondContact O-CB 3.18Å; F472-M476 PolarHBondContact O-N 3.26Å |
| 473 | V | 85.3 | Confident | 84.6 | Confident | 40 Ų | 40 | 95.7 Ų | 95.7 | 24% | 0.242 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -62.9 | -42.1 | 177.6 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | F469 D470 M476 T477 | F469-V473 HydrophobicContact CD1-CG2 4.04Å; F469-V473 HydrophobicContact CE1-CG2 3.66Å; F469-V473 HydrophobicContact CZ-CG2 4.05Å; F469-V473 WeakPolarHBondContact O-CG2 3.24Å; F469-V473 PolarHBondContact O-N 2.97Å; D470-V473 PolarHBondContact O-N 2.87Å; D470-V473 VanDerWaalsContact O-N 3.15Å; V473-M476 PolarHBondContact O-N 3.31Å; V473-T477 WeakPolarHBondContact O-CB 3.49Å; V473-T477 PolarHBondContact O-N 3.14Å; V473-T477 PolarHBondContact O-OG1 3.44Å |
| 474 | D | 85.9 | Confident | 85.4 | Confident | 108 Ų | 108 | 88.5 Ų | 88.5 | 58% | 0.578 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64.9 | -44.3 | 176.7 | -73.6 | -18.9 | 0 | 0 | 0 | 111.3 | D470 F472 M476 T477 Y478 | D470-D474 WeakPolarHBondContact O-CB 3.3Å; D470-D474 PolarHBondContact O-N 3.43Å; F472-D474 VanDerWaalsContact C-N 3.35Å; D474-M476 PolarHBondContact O-N 2.77Å; D474-T477 PolarHBondContact O-N 3.46Å; D474-Y478 VanDerWaalsContact O-CB 3.3Å; D474-Y478 WeakPolarHBondContact O-CB 3.41Å; D474-Y478 PolarHBondContact O-N 2.92Å |
| 475 | K | 89.8 | Confident | 86.2 | Confident | 148 Ų | 148 | 85.8 Ų | 85.8 | 64% | 0.643 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -62.3 | -43.1 | 175.6 | -171.1 | 177.1 | -175.7 | 179.1 | 0 | 111.6 | T471 F472 T477 Y478 V479 | T471-K475 VanDerWaalsContact O-CB 3.22Å; T471-K475 WeakPolarHBondContact O-CB 3.4Å; T471-K475 PolarHBondContact O-N 3.4Å; F472-K475 PolarHBondContact O-N 3.09Å; K475-T477 VanDerWaalsContact C-N 3.34Å; K475-Y478 PolarHBondContact O-N 3.38Å; K475-V479 WeakPolarHBondContact O-CB 3.35Å; K475-V479 WeakPolarHBondContact O-CG2 3.32Å; K475-V479 PolarHBondContact O-N 3.14Å |
| 476 | M | 87.9 | Confident | 86.7 | Confident | 82 Ų | 82 | 83.3 Ų | 83.3 | 40% | 0.404 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.7 | -43.2 | 176.1 | -174.2 | 179.7 | 69.8 | 0 | 0 | 111.1 | F472 V473 D474 G480 | F472-M476 HydrophobicContact CE1-SD 4.47Å; F472-M476 WeakPolarHBondContact O-CB 3.18Å; F472-M476 PolarHBondContact O-N 3.26Å; V473-M476 PolarHBondContact O-N 3.31Å; D474-M476 PolarHBondContact O-N 2.77Å; M476-G480 PolarHBondContact O-N 3.18Å |
| 477 | T | 88.4 | Confident | 86.9 | Confident | 12 Ų | 12 | 83.5 Ų | 83.5 | 7% | 0.074 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -63.9 | -46.5 | 177.5 | -58.7 | 0 | 0 | 0 | 0 | 111.1 | L346 M349 V473 D474 K475 V479 G480 Q481 | L346-T477 HydrophobicContact CB-CG2 4.35Å; M349-T477 HydrophobicContact CE-CG2 3.54Å; V473-T477 WeakPolarHBondContact O-CB 3.49Å; V473-T477 PolarHBondContact O-N 3.14Å; V473-T477 PolarHBondContact O-OG1 3.44Å; D474-T477 PolarHBondContact O-N 3.46Å; K475-T477 VanDerWaalsContact C-N 3.34Å; T477-V479 PolarHBondContact O-N 3.29Å; T477-G480 PolarHBondContact O-N 3.03Å; T477-Q481 WeakPolarHBondContact O-CB 3.45Å; T477-Q481 WeakPolarHBondContact O-CG 3.45Å; T477-Q481 PolarHBondContact O-N 3.49Å |
| 478 | Y | 88.9 | Confident | 87 | Confident | 126 Ų | 126 | 79.9 Ų | 79.9 | 49% | 0.494 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 178.1 | -177.6 | -104.2 | 0 | 0 | 0 | 112.7 | D474 K475 Q481 K482 | D474-Y478 VanDerWaalsContact O-CB 3.3Å; D474-Y478 WeakPolarHBondContact O-CB 3.41Å; D474-Y478 PolarHBondContact O-N 2.92Å; K475-Y478 PolarHBondContact O-N 3.38Å; Y478-Q481 PolarHBondContact O-N 3.26Å; Y478-K482 HydrophobicContact CD1-CD 4.31Å; Y478-K482 HydrophobicContact CE1-CD 3.74Å; Y478-K482 VanDerWaalsContact CE1-CE 3.46Å; Y478-K482 VanDerWaalsContact CZ-NZ 3.3Å; Y478-K482 PolarHBondContact O-N 2.74Å; Y478-K482 WeakPolarHBondContact OH-CE 3.32Å; Y478-K482 PolarHBondContact OH-NZ 3.31Å |
| 479 | V | 91 | Very high | 86.7 | Confident | 62 Ų | 62 | 76.6 Ų | 76.6 | 38% | 0.376 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -64.1 | -43.2 | 175.5 | 167.8 | 0 | 0 | 0 | 0 | 110.5 | K475 T477 K482 M483 | K475-V479 WeakPolarHBondContact O-CB 3.35Å; K475-V479 WeakPolarHBondContact O-CG2 3.32Å; K475-V479 PolarHBondContact O-N 3.14Å; T477-V479 PolarHBondContact O-N 3.29Å; V479-K482 PolarHBondContact O-N 2.97Å; V479-M483 HydrophobicContact CG1-CE 3.32Å; V479-M483 HydrophobicContact CG1-CG 4.44Å; V479-M483 WeakPolarHBondContact O-CB 3.36Å; V479-M483 WeakPolarHBondContact O-CG 3.39Å; V479-M483 PolarHBondContact O-N 3.4Å |
| 480 | G | 87.3 | Confident | 85.7 | Confident | 10 Ų | 10 | 77.1 Ų | 77.1 | 10% | 0.103 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113 | M476 T477 M483 C484 | M476-G480 PolarHBondContact O-N 3.18Å; T477-G480 PolarHBondContact O-N 3.03Å; G480-M483 PolarHBondContact O-N 3.06Å; G480-C484 WeakPolarHBondContact O-CB 3.26Å; G480-C484 PolarHBondContact O-N 3.03Å |
| 481 | Q | 88.3 | Confident | 84.3 | Confident | 64 Ų | 64 | 80.6 Ų | 80.6 | 30% | 0.299 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58.6 | -48.7 | 175 | -80.4 | 179.6 | -27.3 | 0 | 0 | 111.9 | M349 T477 Y478 V485 V486 | M349-Q481 HydrophobicContact CE-CG 4.06Å; M349-Q481 HydrophobicContact SD-CG 3.34Å; M349-Q481 WeakPolarHBondContact SD-CG 3.37Å; M349-Q481 PolarHBondContact SD-NE2 2.97Å; T477-Q481 WeakPolarHBondContact O-CB 3.45Å; T477-Q481 WeakPolarHBondContact O-CG 3.45Å; T477-Q481 PolarHBondContact O-N 3.49Å; Y478-Q481 PolarHBondContact O-N 3.26Å; Q481-V485 VanDerWaalsContact O-CA 3.23Å; Q481-V485 WeakPolarHBondContact O-CA 3.4Å; Q481-V485 PolarHBondContact O-N 3.32Å; Q481-V486 HydrophobicContact CG-CG2 4.45Å; Q481-V486 PolarHBondContact O-N 3.29Å |
| 482 | K | 88.9 | Confident | 81.9 | Confident | 131 Ų | 131 | 81.6 Ų | 81.6 | 57% | 0.57 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -66.7 | -45 | 178.7 | -79.2 | -170.5 | 169 | -179 | 0 | 112.8 | Y478 V479 | Y478-K482 HydrophobicContact CD1-CD 4.31Å; Y478-K482 HydrophobicContact CE1-CD 3.74Å; Y478-K482 VanDerWaalsContact CE1-CE 3.46Å; Y478-K482 VanDerWaalsContact CZ-NZ 3.3Å; Y478-K482 PolarHBondContact O-N 2.74Å; Y478-K482 WeakPolarHBondContact OH-CE 3.32Å; Y478-K482 PolarHBondContact OH-NZ 3.31Å; V479-K482 PolarHBondContact O-N 2.97Å |
| 483 | M | 89.9 | Confident | 79.2 | Confident | 150 Ų | 150 | 79 Ų | 79 | 74% | 0.739 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -65.4 | -40.7 | -178.7 | -79.4 | -154.5 | -92.1 | 0 | 0 | 112.2 | V479 G480 | V479-M483 HydrophobicContact CG1-CE 3.32Å; V479-M483 HydrophobicContact CG1-CG 4.44Å; V479-M483 WeakPolarHBondContact O-CB 3.36Å; V479-M483 WeakPolarHBondContact O-CG 3.39Å; V479-M483 PolarHBondContact O-N 3.4Å; G480-M483 PolarHBondContact O-N 3.06Å |
| 484 | C | 86.6 | Confident | 76.6 | Confident | 29 Ų | 29 | 80.8 Ų | 80.8 | 20% | 0.196 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -95.9 | -6.3 | -176.2 | -60.7 | 0 | 0 | 0 | 0 | 113.7 | H351 I358 G480 V486 | H351-C484 PolarHBondContact CD2-O 3.18Å; I358-C484 HydrophobicContact CG2-CB 4.38Å; G480-C484 WeakPolarHBondContact O-CB 3.26Å; G480-C484 PolarHBondContact O-N 3.03Å; C484-V486 VanDerWaalsContact C-N 3.3Å; C484-V486 HydrophobicContact CB-CB 4.44Å; C484-V486 HydrophobicContact CB-CG1 3.68Å; C484-V486 HydrophobicContact CB-CG2 4.01Å; C484-V486 WeakPolarHBondContact O-CG1 3.43Å; C484-V486 PolarHBondContact O-N 2.93Å |
| 485 | V | 90.4 | Very high | 73.8 | Confident | 87 Ų | 87 | 79 Ų | 79 | 53% | 0.527 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 49.8 | 53.1 | -172.8 | -165.7 | 0 | 0 | 0 | 0 | 110.8 | H351 V352 Q481 | H351-V485 PolarHBondContact CD2-O 3.38Å; V352-V485 HydrophobicContact CG2-CG1 4.43Å; V352-V485 PolarHBondContact N-O 3.25Å; Q481-V485 VanDerWaalsContact O-CA 3.23Å; Q481-V485 WeakPolarHBondContact O-CA 3.4Å; Q481-V485 PolarHBondContact O-N 3.32Å |
| 486 | V | 87.4 | Confident | 71.1 | Confident | 4 Ų | 4 | 78.1 Ų | 78.1 | 2% | 0.024 | 48% | 0.479 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 147.6 | -177.2 | -63.9 | 0 | 0 | 0 | 0 | 111.5 | L346 M349 I350 H351 I358 P359 Q481 C484 | L346-V486 HydrophobicContact CD1-CG2 4.45Å; M349-V486 HydrophobicContact CB-CB 3.85Å; M349-V486 HydrophobicContact CB-CG2 3.74Å; M349-V486 HydrophobicContact SD-CG2 4.16Å; I350-V486 WeakPolarHBondContact O-CA 3.49Å; H351-V486 HydrophobicContact CB-CG1 4.27Å; I358-V486 HydrophobicContact CB-CG1 4.4Å; P359-V486 HydrophobicContact CG-CG1 4.35Å; P359-V486 HydrophobicContact CG-CG2 4.03Å; Q481-V486 HydrophobicContact CG-CG2 4.45Å; Q481-V486 PolarHBondContact O-N 3.29Å; C484-V486 VanDerWaalsContact C-N 3.3Å; C484-V486 HydrophobicContact CB-CB 4.44Å; C484-V486 HydrophobicContact CB-CG1 3.68Å; C484-V486 HydrophobicContact CB-CG2 4.01Å; C484-V486 WeakPolarHBondContact O-CG1 3.43Å; C484-V486 PolarHBondContact O-N 2.93Å |
| 487 | V | 87 | Confident | 68.2 | Low | 70 Ų | 70 | 78.2 Ų | 78.2 | 42% | 0.424 | 50% | 0.501 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 152.6 | 179.2 | -67.5 | 0 | 0 | 0 | 0 | 109.6 | M349 I350 V352 | M349-V487 CarbonylContact C-O 3.45Å; M349-V487 WeakPolarHBondContact CA-O 3.22Å; M349-V487 WeakPolarHBondContact CB-O 3.2Å; I350-V487 PolarHBondContact N-O 3.22Å; I350-V487 PolarHBondContact O-N 2.89Å; V352-V487 HydrophobicContact CG2-CB 4.4Å; V352-V487 HydrophobicContact CG2-CG1 3.72Å; V352-V487 HydrophobicContact CG2-CG2 3.85Å |
| 488 | Y | 82.3 | Confident | 65.1 | Low | 92 Ų | 92 | 81.4 Ų | 81.4 | 36% | 0.361 | 54% | 0.537 | S | S | . | . | P | Polyproline II helix | trans | -69.7 | 132 | 170.2 | -156 | -93.3 | 0 | 0 | 0 | 108.2 | A348 M349 A490 | A348-Y488 HydrophobicContact CB-CE2 3.79Å; M349-Y488 HydrophobicContact CE-CD2 4.47Å; M349-Y488 HydrophobicContact CG-CD2 4.12Å; Y488-A490 PolarHBondContact O-N 2.85Å |
| 489 | P | 77.2 | Confident | 62.7 | Low | 35 Ų | 35 | 83.1 Ų | 83.1 | 23% | 0.227 | 55% | 0.554 | C | S | . | * | P | Polyproline II helix | trans | -61.4 | 134.1 | 179.2 | 21.2 | -28 | 0 | 0 | 0 | 109.9 | F335 I350 E491 | F335-P489 HydrophobicContact CE2-CG 3.51Å; F335-P489 HydrophobicContact CZ-CG 4.14Å; I350-P489 HydrophobicContact CD1-CB 4.04Å; I350-P489 HydrophobicContact CD1-CG 3.95Å; I350-P489 HydrophobicContact CG1-CG 4.32Å; P489-E491 PolarHBondContact O-N 2.95Å |
| 490 | A | 61.7 | Low | 59.7 | Low | 90 Ų | 90 | 89 Ų | 89 | 74% | 0.744 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 123.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | Y488 T492 | Y488-A490 PolarHBondContact O-N 2.85Å; A490-T492 PolarHBondContact O-N 2.97Å |
| 491 | E | 53.4 | Low | 57 | Low | 135 Ų | 135 | 98.1 Ų | 98.1 | 63% | 0.631 | 62% | 0.618 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 121.1 | 157.4 | -67.1 | -166.8 | 153 | 0 | 0 | 105.6 | R339 P489 G493 | R339-E491 IonicContact CZ-OE1 2.58Å; R339-E491 IonicContact NE-OE1 3.65Å; R339-E491 PolarHBondContact NE-OE1 3.09Å; R339-E491 VanDerWaalsContact NE-OE1 3.13Å; R339-E491 IonicContact NH2-OE1 3.79Å; R339-E491 PolarHBondContact NH2-OE1 3.29Å; P489-E491 PolarHBondContact O-N 2.95Å; E491-G493 VanDerWaalsContact C-N 3.25Å; E491-G493 PolarHBondContact O-N 3Å |
| 492 | T | 35.5 | Very low | 54 | Low | 110 Ų | 110 | 97.2 Ų | 97.2 | 68% | 0.675 | 63% | 0.625 | S | S | * | * | trans | -63.9 | 87.7 | -179.5 | 9.5 | 0 | 0 | 0 | 0 | 109.3 | A490 G494 | A490-T492 PolarHBondContact O-N 2.97Å; T492-G494 PolarHBondContact O-N 3.37Å | ||
| 493 | G | 30.9 | Very low | 51 | Low | 73 Ų | 73 | 99 Ų | 99 | 75% | 0.753 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 121.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110 | E491 | E491-G493 VanDerWaalsContact C-N 3.25Å; E491-G493 PolarHBondContact O-N 3Å |
| 494 | G | 29.3 | Very low | 48.1 | Very low | 79 Ų | 79 | 101 Ų | 101 | 81% | 0.814 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 137.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | T492 | T492-G494 PolarHBondContact O-N 3.37Š|
| 495 | G | 27.3 | Very low | 45.3 | Very low | 70 Ų | 70 | 108 Ų | 108 | 72% | 0.722 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 139.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 496 | S | 33.9 | Very low | 42.4 | Very low | 129 Ų | 129 | 111.8 Ų | 111.8 | 90% | 0.902 | 69% | 0.685 | S | S | * | * | trans | 52 | 103.1 | 151.3 | 63.1 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 497 | G | 26.5 | Very low | 39.5 | Very low | 85 Ų | 85 | 119.9 Ų | 119.9 | 88% | 0.876 | 72% | 0.722 | S | S | * | * | trans | 167.1 | 99.2 | 155.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 498 | G | 24.1 | Very low | 36.8 | Very low | 79 Ų | 79 | 120.8 Ų | 120.8 | 81% | 0.814 | 74% | 0.737 | S | S | * | * | trans | 108.5 | 89.9 | 163.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 499 | D | 37.7 | Very low | 34.6 | Very low | 161 Ų | 161 | 127.5 Ų | 127.5 | 86% | 0.861 | 76% | 0.762 | S | S | * | * | trans | -57.6 | 137.2 | 157.5 | -65.6 | -51.7 | 0 | 0 | 0 | 110 | ||||
| 500 | E | 29.2 | Very low | 32.1 | Very low | 185 Ų | 185 | 129.8 Ų | 129.8 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | S | Bend | trans | 149.6 | -13.5 | 139.4 | -79.4 | -177.2 | 174.9 | 0 | 0 | 116.2 | ||
| 501 | E | 28.9 | Very low | 30.7 | Very low | 203 Ų | 203 | 131 Ų | 131 | 95% | 0.949 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -104.9 | 7.3 | 179.8 | -73 | -173.5 | 162.5 | 0 | 0 | 115.3 | ||
| 502 | G | 26.3 | Very low | 29.6 | Very low | 44 Ų | 44 | 132.9 Ų | 132.9 | 45% | 0.454 | 79% | 0.792 | S | S | . | * | trans | -101.3 | 6.2 | -171.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 503 | E | 26.5 | Very low | 29.4 | Very low | 168 Ų | 168 | 132.8 Ų | 132.8 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | H | α-helix | trans | -82.8 | -30.5 | -172.7 | -77.6 | -167.5 | 145.4 | 0 | 0 | 114.4 | M505 | E503-M505 PolarHBondContact O-N 3.04Å |
| 504 | E | 28.2 | Very low | 29.3 | Very low | 193 Ų | 193 | 141 Ų | 141 | 90% | 0.902 | 80% | 0.804 | S | S | * | * | H | α-helix | trans | -77.1 | -21 | -175.5 | -76.1 | -171.4 | 154.3 | 0 | 0 | 114.8 | ||
| 505 | M | 28.5 | Very low | 29.3 | Very low | 175 Ų | 175 | 145.8 Ų | 145.8 | 86% | 0.862 | 81% | 0.805 | S | S | * | * | H | α-helix | trans | -100.7 | -10.6 | -179.2 | -150.5 | 175.8 | -170.9 | 0 | 0 | 113.9 | E503 | E503-M505 PolarHBondContact O-N 3.04Å |
| 506 | K | 28.7 | Very low | 29.4 | Very low | 168 Ų | 168 | 150.2 Ų | 150.2 | 73% | 0.73 | 81% | 0.812 | S | S | * | * | H | α-helix | trans | -83.2 | -22.7 | 177.8 | -89.7 | 179.8 | 176.7 | 172.4 | 0 | 113.6 | A508 | K506-A508 VanDerWaalsContact C-N 3.32Å; K506-A508 PolarHBondContact O-N 3.21Å |
| 507 | E | 26.7 | Very low | 29.3 | Very low | 174 Ų | 174 | 148 Ų | 148 | 81% | 0.813 | 81% | 0.809 | S | S | * | * | G | 310 helix | trans | -72.8 | -20.4 | 178.7 | -86.1 | -168.9 | 143 | 0 | 0 | 114 | ||
| 508 | A | 30.3 | Very low | 29.4 | Very low | 89 Ų | 89 | 151.3 Ų | 151.3 | 74% | 0.736 | 81% | 0.807 | S | S | * | * | G | 310 helix | trans | -85.5 | -6.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | K506 | K506-A508 VanDerWaalsContact C-N 3.32Å; K506-A508 PolarHBondContact O-N 3.21Å |
| 509 | R | 36.4 | Very low | 29.8 | Very low | 233 Ų | 233 | 155 Ų | 155 | 88% | 0.879 | 81% | 0.808 | S | S | * | * | G | 310 helix | trans | -145.4 | 48.8 | -177.8 | -74 | -170.5 | 178.3 | 175.7 | 1.5 | 113.7 | ||
| 510 | S | 25 | Very low | 29.4 | Very low | 82 Ų | 82 | 156.4 Ų | 156.4 | 57% | 0.573 | 81% | 0.809 | S | S | * | * | trans | -89 | 122 | 162.3 | 61.8 | 0 | 0 | 0 | 0 | 109.7 | L512 | S510-L512 PolarHBondContact O-N 3.41Š| ||
| 511 | P | 32 | Very low | 29.5 | Very low | 116 Ų | 116 | 157 Ų | 157 | 75% | 0.753 | 81% | 0.809 | S | S | * | * | trans | -68.6 | 114.6 | 162.4 | 25.9 | -27.8 | 0 | 0 | 0 | 107.6 | S513 | P511-S513 VanDerWaalsContact C-N 3.28Å; P511-S513 PolarHBondContact O-N 3.36Å | ||
| 512 | L | 30.4 | Very low | 29.7 | Very low | 175 Ų | 175 | 151.5 Ų | 151.5 | 92% | 0.916 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -63.7 | 87.2 | 169.3 | -89.9 | 150.7 | 0 | 0 | 0 | 109.9 | S510 | S510-L512 PolarHBondContact O-N 3.41Š|
| 513 | S | 30.6 | Very low | 29.9 | Very low | 107 Ų | 107 | 151.9 Ų | 151.9 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | trans | -161.6 | 100.9 | 151.2 | 59.1 | 0 | 0 | 0 | 0 | 109.1 | P511 | P511-S513 VanDerWaalsContact C-N 3.28Å; P511-S513 PolarHBondContact O-N 3.36Å | ||
| 514 | R | 28.9 | Very low | 29.9 | Very low | 245 Ų | 245 | 151.5 Ų | 151.5 | 93% | 0.925 | 80% | 0.8 | S | S | * | * | trans | -82 | 148.5 | 163.1 | -115.1 | 178 | 173.5 | 161 | -1.6 | 108.7 | ||||
| 515 | E | 29.3 | Very low | 30 | Very low | 180 Ų | 180 | 148.8 Ų | 148.8 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | trans | 81 | 90.7 | 171.3 | -59.6 | -177.2 | 155.3 | 0 | 0 | 116.7 | ||||
| 516 | D | 29.6 | Very low | 30.1 | Very low | 164 Ų | 164 | 147.5 Ų | 147.5 | 88% | 0.877 | 80% | 0.798 | S | S | * | * | -168.1 | 139 | 92.4 | -99.8 | -31 | 0 | 0 | 0 | 109.5 | D518 | D516-D518 PolarHBondContact O-N 3.32Š| |||
| 517 | G | 32.3 | Very low | 30.2 | Very low | 81 Ų | 81 | 146.4 Ų | 146.4 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | -72.9 | 125 | -173.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 518 | D | 27.8 | Very low | 30.4 | Very low | 155 Ų | 155 | 144.9 Ų | 144.9 | 83% | 0.829 | 80% | 0.801 | S | S | * | * | trans | -152.5 | 136.6 | 147.6 | -144.3 | -8.2 | 0 | 0 | 0 | 111.6 | D516 H520 | D516-D518 PolarHBondContact O-N 3.32Å; D518-H520 PolarHBondContact O-N 2.96Å; D518-H520 VanDerWaalsContact O-N 3.12Å | ||
| 519 | N | 31.6 | Very low | 30.4 | Very low | 157 Ų | 157 | 148.2 Ų | 148.2 | 84% | 0.84 | 81% | 0.805 | S | S | * | * | trans | -65.2 | 105.2 | -174.6 | -101.5 | -29.4 | 0 | 0 | 0 | 111 | ||||
| 520 | H | 30.3 | Very low | 30 | Very low | 191 Ų | 191 | 142.9 Ų | 142.9 | 88% | 0.884 | 80% | 0.801 | S | S | * | * | trans | -89.5 | 108.5 | 166.3 | -101.1 | 14 | 0 | 0 | 0 | 111.3 | D518 A522 | D518-H520 PolarHBondContact O-N 2.96Å; D518-H520 VanDerWaalsContact O-N 3.12Å; H520-A522 PolarHBondContact O-N 3.25Å | ||
| 521 | K | 30.3 | Very low | 30.3 | Very low | 197 Ų | 197 | 146.9 Ų | 146.9 | 86% | 0.857 | 82% | 0.816 | S | S | * | * | trans | -55 | 121.8 | 170.3 | -73.3 | -179.7 | 175.1 | -179.5 | 0 | 110 | ||||
| 522 | A | 32.9 | Very low | 30.2 | Very low | 87 Ų | 87 | 149.1 Ų | 149.1 | 72% | 0.719 | 82% | 0.82 | S | S | * | * | trans | -58 | 135.3 | 165.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | H520 D524 | H520-A522 PolarHBondContact O-N 3.25Å; A522-D524 PolarHBondContact O-N 3Å | ||
| 523 | A | 30.6 | Very low | 30.2 | Very low | 52 Ų | 52 | 147.2 Ų | 147.2 | 43% | 0.43 | 81% | 0.813 | S | S | . | * | trans | -84.9 | 108.1 | 170.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | V352 C525 | V352-A523 HydrophobicContact CG1-CB 4.49Å; V352-A523 WeakPolarHBondContact O-CB 3.39Å; A523-C525 PolarHBondContact O-N 3.06Å | ||
| 524 | D | 27.9 | Very low | 30.2 | Very low | 160 Ų | 160 | 150.5 Ų | 150.5 | 86% | 0.856 | 82% | 0.818 | S | S | * | * | trans | -70 | 96.7 | 165.6 | -71.8 | -29.1 | 0 | 0 | 0 | 108 | A522 | A522-D524 PolarHBondContact O-N 3Š| ||
| 525 | C | 30.4 | Very low | 30.3 | Very low | 137 Ų | 137 | 141.9 Ų | 141.9 | 93% | 0.926 | 81% | 0.808 | S | S | * | * | trans | -99.2 | 0 | 152.7 | -44.5 | 0 | 0 | 0 | 0 | 105.8 | C355 A523 | C355-C525 HydrophobicContact CB-CB 4.15Å; C355-C525 WeakPolarHBondContact CB-SG 3.33Å; C355-C525 WeakPolarHBondContact SG-CB 3.02Å; C355-C525 CovalentContact SG-SG 2.06Å; C355-C525 PolarHBondContact SG-SG 3.48Å; A523-C525 PolarHBondContact O-N 3.06Å |
Retrieved 525 of 525 residues in 158.9 ms
(Link to these results)