| 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 | 32.4 | Very low | 30.9 | Very low | 253 Ų | 253 | 141.6 Ų | 141.6 | 100% | 1.246 | 82% | 0.821 | S | S | * | * | 0 | 88.7 | 0 | -76.5 | 138.6 | 149.7 | 0 | 0 | 105.9 | |||||
| 2 | G | 30.6 | Very low | 31 | Very low | 83 Ų | 83 | 135.8 Ų | 135.8 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | 114.4 | 136.3 | 71.7 | 0 | 0 | 0 | 0 | 0 | 105 | |||||
| 3 | S | 28.7 | Very low | 30.9 | Very low | 108 Ų | 108 | 137.3 Ų | 137.3 | 76% | 0.755 | 82% | 0.816 | S | S | * | * | cis | -150.4 | 136.3 | 12.6 | -168.3 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 4 | V | 29.3 | Very low | 31.5 | Very low | 126 Ų | 126 | 141.9 Ų | 141.9 | 76% | 0.764 | 83% | 0.825 | S | S | * | * | trans | -73.9 | 126.9 | 165.7 | 176.3 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 5 | N | 28.8 | Very low | 32 | Very low | 130 Ų | 130 | 138.2 Ų | 138.2 | 70% | 0.695 | 81% | 0.81 | S | S | * | * | trans | -117.6 | 103.2 | 162.6 | -101.9 | 13.2 | 0 | 0 | 0 | 108 | ||||
| 6 | E | 31.5 | Very low | 32.5 | Very low | 174 Ų | 174 | 139.4 Ų | 139.4 | 81% | 0.813 | 81% | 0.812 | S | S | * | * | trans | -54.7 | 126.6 | 159.6 | -75.6 | 167.2 | 127.6 | 0 | 0 | 109.7 | ||||
| 7 | F | 28.8 | Very low | 33 | Very low | 197 Ų | 197 | 136.9 Ų | 136.9 | 86% | 0.864 | 81% | 0.812 | S | S | * | * | trans | -110.7 | 90.2 | 155.3 | -82.5 | -81.1 | 0 | 0 | 0 | 107.3 | ||||
| 8 | A | 28.4 | Very low | 33.4 | Very low | 70 Ų | 70 | 135.1 Ų | 135.1 | 58% | 0.579 | 81% | 0.807 | S | S | * | * | trans | -81 | 167.6 | 157 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 9 | F | 31 | Very low | 33.9 | Very low | 203 Ų | 203 | 136.7 Ų | 136.7 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | trans | 101.6 | 143.5 | 171.2 | -59.2 | -70.9 | 0 | 0 | 0 | 117.5 | ||||
| 10 | P | 39.1 | Very low | 34.2 | Very low | 112 Ų | 112 | 135.5 Ų | 135.5 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | cis | -127.5 | 142.2 | -32.2 | 31.4 | -14 | 0 | 0 | 0 | 112.7 | G12 | P10-G12 PolarHBondContact O-N 3.15Š| ||
| 11 | A | 31 | Very low | 34.3 | Very low | 102 Ų | 102 | 138 Ų | 138 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | trans | -68.2 | 122.2 | 156.6 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 12 | G | 32.8 | Very low | 34.8 | Very low | 72 Ų | 72 | 131.1 Ų | 131.1 | 74% | 0.742 | 76% | 0.764 | S | S | * | * | trans | -71 | 133.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | P10 E14 | P10-G12 PolarHBondContact O-N 3.15Å; G12-E14 PolarHBondContact O-N 3.39Å | ||
| 13 | D | 30.1 | Very low | 34.9 | Very low | 155 Ų | 155 | 133.8 Ų | 133.8 | 83% | 0.829 | 76% | 0.759 | S | S | * | * | trans | -43.5 | 123.7 | 176.4 | -75.2 | -45.5 | 0 | 0 | 0 | 113.7 | ||||
| 14 | E | 38.3 | Very low | 35.6 | Very low | 202 Ų | 202 | 135.9 Ų | 135.9 | 94% | 0.944 | 76% | 0.76 | S | S | * | * | trans | -111.5 | 103.1 | 147.5 | -69.2 | -157.5 | 177.6 | 0 | 0 | 108.1 | G12 | G12-E14 PolarHBondContact O-N 3.39Š| ||
| 15 | S | 39.5 | Very low | 35.5 | Very low | 86 Ų | 86 | 132.4 Ų | 132.4 | 60% | 0.601 | 75% | 0.75 | S | S | * | * | trans | -148.4 | 108.3 | 156.8 | 62.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 16 | D | 39.4 | Very low | 35.5 | Very low | 157 Ų | 157 | 132.2 Ų | 132.2 | 84% | 0.84 | 76% | 0.759 | S | S | * | * | -170.5 | 114.2 | 108.9 | -95.3 | -16.6 | 0 | 0 | 0 | 112.7 | |||||
| 17 | A | 40.9 | Very low | 35.5 | Very low | 98 Ų | 98 | 134.2 Ų | 134.2 | 81% | 0.81 | 77% | 0.765 | S | S | * | * | trans | 45 | 93.4 | 137.4 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 18 | S | 40.1 | Very low | 35.4 | Very low | 104 Ų | 104 | 130.4 Ų | 130.4 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | trans | -153.7 | 108.5 | 138.4 | -174.4 | 0 | 0 | 0 | 0 | 107.7 | D20 | S18-D20 PolarHBondContact O-N 3.24Š| ||
| 19 | N | 43.8 | Very low | 35.9 | Very low | 165 Ų | 165 | 135.8 Ų | 135.8 | 88% | 0.882 | 78% | 0.776 | S | S | * | * | trans | -64.2 | 94 | 173.5 | -85.9 | -4.3 | 0 | 0 | 0 | 109.7 | ||||
| 20 | D | 39 | Very low | 35.7 | Very low | 112 Ų | 112 | 136 Ų | 136 | 60% | 0.599 | 78% | 0.777 | S | S | * | * | trans | -133.8 | 87.7 | 154.9 | -79.7 | -38.5 | 0 | 0 | 0 | 107.3 | S18 W22 | S18-D20 PolarHBondContact O-N 3.24Å; D20-W22 VanDerWaalsContact O-CD1 3.3Å; D20-W22 PolarHBondContact O-N 3.29Å; D20-W22 VanDerWaalsContact O-N 3.1Å | ||
| 21 | E | 36.1 | Very low | 35.5 | Very low | 188 Ų | 188 | 140.5 Ų | 140.5 | 88% | 0.879 | 79% | 0.785 | S | S | * | * | trans | -64.6 | 98.5 | -179.1 | -166 | 167.7 | -157.5 | 0 | 0 | 109.7 | D23 | E21-D23 PolarHBondContact O-N 3.46Š| ||
| 22 | W | 43.2 | Very low | 35.3 | Very low | 109 Ų | 109 | 142.7 Ų | 142.7 | 41% | 0.413 | 79% | 0.788 | S | S | . | * | trans | -92.3 | 85.9 | 167.9 | -73.4 | 91.6 | 0 | 0 | 0 | 108.8 | D20 I24 K53 Y87 | D20-W22 VanDerWaalsContact O-CD1 3.3Å; D20-W22 PolarHBondContact O-N 3.29Å; D20-W22 VanDerWaalsContact O-N 3.1Å; W22-I24 PolarHBondContact O-N 3.38Å; W22-I24 VanDerWaalsContact O-N 3.09Å; W22-K53 HydrophobicContact CH2-CD 4.2Å; W22-K53 HydrophobicContact CH2-CG 4.15Å; W22-K53 HydrophobicContact CZ2-CD 4.35Å; W22-Y87 HydrophobicContact CH2-CE1 4.03Å; W22-Y87 HydrophobicContact CZ2-CE1 4.25Å | ||
| 23 | D | 33.1 | Very low | 35 | Very low | 139 Ų | 139 | 145 Ų | 145 | 74% | 0.743 | 79% | 0.792 | S | S | * | * | trans | -75 | 95 | 174.4 | -151.2 | 5.6 | 0 | 0 | 0 | 109.1 | E21 G25 | E21-D23 PolarHBondContact O-N 3.46Å; D23-G25 VanDerWaalsContact C-N 3.35Å; D23-G25 PolarHBondContact O-N 3.33Å | ||
| 24 | I | 42.7 | Very low | 34.9 | Very low | 152 Ų | 152 | 140.7 Ų | 140.7 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | trans | -84.2 | 84.5 | 168.5 | -60.8 | -179.3 | 0 | 0 | 0 | 106.7 | W22 | W22-I24 PolarHBondContact O-N 3.38Å; W22-I24 VanDerWaalsContact O-N 3.09Å | ||
| 25 | G | 28.9 | Very low | 34.7 | Very low | 53 Ų | 53 | 138.5 Ų | 138.5 | 55% | 0.546 | 78% | 0.778 | S | S | . | * | trans | -170.3 | 112 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | D23 | D23-G25 VanDerWaalsContact C-N 3.35Å; D23-G25 PolarHBondContact O-N 3.33Å | ||
| 26 | S | 28.3 | Very low | 34.4 | Very low | 126 Ų | 126 | 143 Ų | 143 | 88% | 0.881 | 79% | 0.787 | S | S | * | * | trans | 57.5 | 118.2 | 152.1 | -154.2 | 0 | 0 | 0 | 0 | 120.6 | S28 | S26-S28 PolarHBondContact O-N 3.06Š| ||
| 27 | F | 31 | Very low | 33.8 | Very low | 216 Ų | 216 | 142.4 Ų | 142.4 | 95% | 0.947 | 78% | 0.784 | S | S | * | * | trans | -46.3 | 126.9 | 168.5 | -77.4 | -95.4 | 0 | 0 | 0 | 114.1 | ||||
| 28 | S | 26.8 | Very low | 33.4 | Very low | 118 Ų | 118 | 145.6 Ų | 145.6 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | trans | -155.5 | 121.3 | 146.2 | -173 | 0 | 0 | 0 | 0 | 109.5 | S26 | S26-S28 PolarHBondContact O-N 3.06Š| ||
| 29 | E | 38.3 | Very low | 32.9 | Very low | 183 Ų | 183 | 144.7 Ų | 144.7 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | trans | -57.6 | 135.7 | -178.4 | -64.5 | 177 | 143.6 | 0 | 0 | 112.3 | ||||
| 30 | K | 26.8 | Very low | 32.3 | Very low | 207 Ų | 207 | 142 Ų | 142 | 90% | 0.9 | 78% | 0.779 | S | S | * | * | trans | -155.1 | 114.6 | 147.5 | -108.8 | 163.3 | -167.1 | -179.7 | 0 | 111.4 | ||||
| 31 | K | 35.8 | Very low | 32.3 | Very low | 207 Ų | 207 | 141.1 Ų | 141.1 | 90% | 0.9 | 79% | 0.788 | S | S | * | * | trans | -59 | 139.7 | 163.7 | -78.9 | 173.7 | 172.5 | 171.9 | 0 | 110.4 | ||||
| 32 | T | 26.3 | Very low | 32.4 | Very low | 148 Ų | 148 | 141.5 Ų | 141.5 | 91% | 0.908 | 79% | 0.789 | S | S | * | * | trans | -154 | 146 | 137.8 | 35.8 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 33 | S | 26.6 | Very low | 32.1 | Very low | 119 Ų | 119 | 140.9 Ų | 140.9 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | trans | -94.3 | 150.1 | -170.9 | 48.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 34 | G | 27.5 | Very low | 32.7 | Very low | 66 Ų | 66 | 136.7 Ų | 136.7 | 68% | 0.68 | 79% | 0.787 | S | S | * | * | 118.6 | 120.8 | 126.4 | 0 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 35 | I | 34 | Very low | 33.2 | Very low | 155 Ų | 155 | 133.2 Ų | 133.2 | 80% | 0.795 | 78% | 0.776 | S | S | * | * | trans | 83.6 | 104.8 | 133.8 | -55.6 | 175.3 | 0 | 0 | 0 | 116.9 | ||||
| 36 | K | 32.8 | Very low | 34.7 | Very low | 182 Ų | 182 | 133.1 Ų | 133.1 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | 64.7 | 125.6 | 97.4 | -90.7 | -176.6 | -178.3 | -175.7 | 0 | 113.5 | |||||
| 37 | D | 27.7 | Very low | 37 | Very low | 144 Ų | 144 | 131.8 Ų | 131.8 | 77% | 0.77 | 76% | 0.758 | S | S | * | * | -167.3 | 163.5 | 63 | -90.6 | -40.8 | 0 | 0 | 0 | 114.8 | |||||
| 38 | L | 32.4 | Very low | 39.4 | Very low | 165 Ų | 165 | 125 Ų | 125 | 86% | 0.864 | 73% | 0.732 | S | S | * | * | trans | -40.6 | 143.5 | 175.9 | -104.2 | 64.5 | 0 | 0 | 0 | 119.5 | ||||
| 39 | A | 29.9 | Very low | 42.1 | Very low | 84 Ų | 84 | 121.8 Ų | 121.8 | 69% | 0.694 | 71% | 0.705 | S | S | * | * | 176.9 | 113 | 107.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 40 | S | 31.3 | Very low | 44.4 | Very low | 109 Ų | 109 | 116.1 Ų | 116.1 | 76% | 0.762 | 69% | 0.685 | S | S | * | * | trans | 67.8 | 115.7 | 133.7 | -46.1 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 41 | A | 38.2 | Very low | 47.3 | Very low | 94 Ų | 94 | 109.5 Ų | 109.5 | 78% | 0.777 | 66% | 0.662 | S | S | * | * | S | Bend | trans | 87.9 | 56.1 | 139.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||
| 42 | E | 37.9 | Very low | 49.8 | Very low | 195 Ų | 195 | 99.6 Ų | 99.6 | 91% | 0.911 | 62% | 0.619 | S | S | * | * | S | Bend | trans | 173.5 | 31.7 | 135.5 | -95.1 | -173.4 | -174.2 | 0 | 0 | 109.8 | ||
| 43 | V | 37.6 | Very low | 52.5 | Low | 97 Ų | 97 | 95.7 Ų | 95.7 | 59% | 0.588 | 59% | 0.589 | S | S | * | * | trans | -101.1 | 9 | -150.9 | -175.8 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 44 | G | 45.9 | Very low | 55.4 | Low | 50 Ų | 50 | 96 Ų | 96 | 52% | 0.515 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -80.8 | -27.1 | -173.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | N48 | G44-N48 VanDerWaalsContact O-CG 3.27Å; G44-N48 PolarHBondContact O-ND2 3.2Å |
| 45 | S | 52.6 | Low | 58.4 | Low | 80 Ų | 80 | 93 Ų | 93 | 56% | 0.559 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -93.2 | -34 | -169.2 | -165.2 | 0 | 0 | 0 | 0 | 113.8 | I49 | S45-I49 WeakPolarHBondContact O-CB 3.49Å; S45-I49 WeakPolarHBondContact O-CD1 3.3Å; S45-I49 WeakPolarHBondContact O-CG1 3.24Å; S45-I49 PolarHBondContact O-N 2.81Å; S45-I49 VanDerWaalsContact O-N 3.1Å |
| 46 | G | 61.2 | Low | 60.9 | Low | 50 Ų | 50 | 85.8 Ų | 85.8 | 52% | 0.515 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.1 | -44.3 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | I49 S50 | G46-I49 PolarHBondContact O-N 2.92Å; G46-S50 PolarHBondContact O-N 3.36Å |
| 47 | D | 75.8 | Confident | 63.3 | Low | 98 Ų | 98 | 79.8 Ų | 79.8 | 52% | 0.524 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.3 | -46.6 | 177.9 | -72.2 | -5.2 | 0 | 0 | 0 | 110.8 | I49 S50 V51 | D47-I49 VanDerWaalsContact C-N 3.32Å; D47-I49 PolarHBondContact O-N 3.08Å; D47-S50 PolarHBondContact O-N 3.47Å; D47-S50 VanDerWaalsContact O-N 3.11Å; D47-S50 PolarHBondContact O-OG 3.44Å; D47-V51 VanDerWaalsContact O-CG2 3.26Å; D47-V51 WeakPolarHBondContact O-CG2 3.36Å; D47-V51 PolarHBondContact O-N 3.36Å |
| 48 | N | 82.4 | Confident | 66.1 | Low | 74 Ų | 74 | 79.1 Ų | 79.1 | 40% | 0.396 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.5 | -37.8 | 178.7 | -73.5 | -15.1 | 0 | 0 | 0 | 112.9 | G44 V51 L52 L72 | G44-N48 VanDerWaalsContact O-CG 3.27Å; G44-N48 PolarHBondContact O-ND2 3.2Å; N48-V51 PolarHBondContact O-N 3.26Å; N48-L52 WeakPolarHBondContact O-CB 3.28Å; N48-L52 PolarHBondContact O-N 3.04Å; N48-L72 HydrophobicContact CB-CD1 4.07Å |
| 49 | I | 83.8 | Confident | 68.5 | Low | 50 Ų | 50 | 72.4 Ų | 72.4 | 26% | 0.256 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.2 | -42.5 | 174.5 | -73.4 | 166.9 | 0 | 0 | 0 | 110.9 | S45 G46 D47 L52 K53 T76 L78 | S45-I49 WeakPolarHBondContact O-CB 3.49Å; S45-I49 WeakPolarHBondContact O-CD1 3.3Å; S45-I49 WeakPolarHBondContact O-CG1 3.24Å; S45-I49 PolarHBondContact O-N 2.81Å; S45-I49 VanDerWaalsContact O-N 3.1Å; G46-I49 PolarHBondContact O-N 2.92Å; D47-I49 VanDerWaalsContact C-N 3.32Å; D47-I49 PolarHBondContact O-N 3.08Å; I49-L52 PolarHBondContact O-N 2.72Å; I49-K53 VanDerWaalsContact O-CB 3.28Å; I49-K53 WeakPolarHBondContact O-CB 3.32Å; I49-K53 PolarHBondContact O-N 3.16Å; I49-T76 HydrophobicContact CD1-CG2 4.09Å; I49-T76 HydrophobicContact CG1-CG2 3.84Å; I49-L78 HydrophobicContact CG2-CD2 3.8Å |
| 50 | S | 85.5 | Confident | 71.4 | Confident | 64 Ų | 64 | 71 Ų | 71 | 45% | 0.448 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -65.3 | -40.6 | 177.7 | 78.6 | 0 | 0 | 0 | 0 | 112.1 | G46 D47 K53 K54 | G46-S50 PolarHBondContact O-N 3.36Å; D47-S50 PolarHBondContact O-N 3.47Å; D47-S50 VanDerWaalsContact O-N 3.11Å; D47-S50 PolarHBondContact O-OG 3.44Å; S50-K53 PolarHBondContact O-N 2.9Å; S50-K54 WeakPolarHBondContact O-CB 3.48Å; S50-K54 PolarHBondContact O-N 3.36Å |
| 51 | V | 88.3 | Confident | 74.2 | Confident | 68 Ų | 68 | 68.1 Ų | 68.1 | 41% | 0.412 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -67.4 | -43.6 | 176.5 | 177.5 | 0 | 0 | 0 | 0 | 110.2 | D47 N48 K53 K54 A55 L67 | D47-V51 VanDerWaalsContact O-CG2 3.26Å; D47-V51 WeakPolarHBondContact O-CG2 3.36Å; D47-V51 PolarHBondContact O-N 3.36Å; N48-V51 PolarHBondContact O-N 3.26Å; V51-K53 PolarHBondContact O-N 3.09Å; V51-K54 PolarHBondContact O-N 3.2Å; V51-A55 VanDerWaalsContact O-CB 3.32Å; V51-A55 WeakPolarHBondContact O-CB 3.45Å; V51-A55 PolarHBondContact O-N 3.2Å; V51-L67 HydrophobicContact CG1-CD1 4.11Å |
| 52 | L | 87.8 | Confident | 76.7 | Confident | 0 Ų | 0 | 68.8 Ų | 68.8 | 0% | 0 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -59.5 | -47.3 | 175.6 | -178.1 | 66.5 | 0 | 0 | 0 | 111.3 | N48 I49 K54 A55 I56 V64 L67 L72 L78 P84 | N48-L52 WeakPolarHBondContact O-CB 3.28Å; N48-L52 PolarHBondContact O-N 3.04Å; I49-L52 PolarHBondContact O-N 2.72Å; L52-K54 VanDerWaalsContact C-N 3.31Å; L52-K54 PolarHBondContact O-N 3.29Å; L52-A55 PolarHBondContact O-N 2.75Å; L52-I56 HydrophobicContact CD1-CD1 4.02Å; L52-I56 HydrophobicContact CD1-CG1 4.34Å; L52-I56 HydrophobicContact CD2-CD1 4.46Å; L52-I56 HydrophobicContact CG-CD1 3.78Å; L52-I56 HydrophobicContact CG-CG1 4.47Å; L52-I56 VanDerWaalsContact O-CG1 3.23Å; L52-I56 WeakPolarHBondContact O-CG1 3.49Å; L52-I56 PolarHBondContact O-N 3.23Å; L52-V64 HydrophobicContact CD1-CB 4.47Å; L52-V64 HydrophobicContact CD1-CG1 4.05Å; L52-V64 HydrophobicContact CD1-CG2 4.12Å; L52-L67 HydrophobicContact CB-CD1 3.91Å; L52-L67 HydrophobicContact CD1-CD1 3.96Å; L52-L72 HydrophobicContact CD2-CD1 4.26Å; L52-L72 HydrophobicContact CD2-CD2 3.61Å; L52-L78 HydrophobicContact CD2-CD2 4.25Å; L52-P84 HydrophobicContact CD2-CG 4.05Å |
| 53 | K | 84.2 | Confident | 79.2 | Confident | 65 Ų | 65 | 61.4 Ų | 61.4 | 28% | 0.283 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -57.9 | -45.1 | 177.8 | -178.4 | -174.1 | 178.4 | -174.1 | 0 | 111.4 | W22 I49 S50 V51 S57 L78 | W22-K53 HydrophobicContact CH2-CD 4.2Å; W22-K53 HydrophobicContact CH2-CG 4.15Å; W22-K53 HydrophobicContact CZ2-CD 4.35Å; I49-K53 VanDerWaalsContact O-CB 3.28Å; I49-K53 WeakPolarHBondContact O-CB 3.32Å; I49-K53 PolarHBondContact O-N 3.16Å; S50-K53 PolarHBondContact O-N 2.9Å; V51-K53 PolarHBondContact O-N 3.09Å; K53-S57 WeakPolarHBondContact O-CB 3.43Å; K53-S57 PolarHBondContact O-N 3.16Å; K53-S57 VanDerWaalsContact O-N 3.14Å; K53-S57 PolarHBondContact O-OG 3.46Å; K53-L78 HydrophobicContact CB-CD2 4.49Å |
| 54 | K | 86.5 | Confident | 81.7 | Confident | 126 Ų | 126 | 56.8 Ų | 56.8 | 55% | 0.548 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.7 | -49.1 | 176.7 | -176.3 | 178.2 | 175.7 | -176.9 | 0 | 111.4 | S50 V51 L52 I56 S57 E58 | S50-K54 WeakPolarHBondContact O-CB 3.48Å; S50-K54 PolarHBondContact O-N 3.36Å; V51-K54 PolarHBondContact O-N 3.2Å; L52-K54 VanDerWaalsContact C-N 3.31Å; L52-K54 PolarHBondContact O-N 3.29Å; K54-I56 VanDerWaalsContact C-N 3.34Å; K54-I56 PolarHBondContact O-N 3.24Å; K54-S57 PolarHBondContact O-N 3.12Å; K54-S57 VanDerWaalsContact O-N 3.13Å; K54-E58 VanDerWaalsContact CE-CD 3.5Å; K54-E58 WeakPolarHBondContact CE-OE1 3.42Å; K54-E58 HydrophobicContact CG-CG 4.41Å; K54-E58 IonicContact NZ-OE1 3.84Å; K54-E58 WeakPolarHBondContact O-CG 3.41Å; K54-E58 PolarHBondContact O-N 3.14Å |
| 55 | A | 90.3 | Very high | 83.9 | Confident | 4 Ų | 4 | 58.8 Ų | 58.8 | 3% | 0.033 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58.7 | -43.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | V51 L52 S57 E58 G59 D60 T63 V64 | V51-A55 VanDerWaalsContact O-CB 3.32Å; V51-A55 WeakPolarHBondContact O-CB 3.45Å; V51-A55 PolarHBondContact O-N 3.2Å; L52-A55 PolarHBondContact O-N 2.75Å; A55-S57 PolarHBondContact O-N 3.42Å; A55-E58 PolarHBondContact O-N 2.85Å; A55-G59 CarbonylContact O-C 3.58Å; A55-G59 PolarHBondContact O-N 3.37Å; A55-D60 HydrophobicContact CB-CB 4.45Å; A55-D60 PolarHBondContact O-N 3.24Å; A55-T63 WeakPolarHBondContact CB-OG1 3.39Å; A55-V64 HydrophobicContact CB-CG2 3.73Å |
| 56 | I | 87.4 | Confident | 85.8 | Confident | 2 Ų | 2 | 60.8 Ų | 60.8 | 1% | 0.01 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.7 | -41.9 | 176.4 | -66.5 | 164.6 | 0 | 0 | 0 | 111.3 | L52 K54 G59 V64 L78 P84 L96 | L52-I56 HydrophobicContact CD1-CD1 4.02Å; L52-I56 HydrophobicContact CD1-CG1 4.34Å; L52-I56 HydrophobicContact CD2-CD1 4.46Å; L52-I56 HydrophobicContact CG-CD1 3.78Å; L52-I56 HydrophobicContact CG-CG1 4.47Å; L52-I56 VanDerWaalsContact O-CG1 3.23Å; L52-I56 WeakPolarHBondContact O-CG1 3.49Å; L52-I56 PolarHBondContact O-N 3.23Å; K54-I56 VanDerWaalsContact C-N 3.34Å; K54-I56 PolarHBondContact O-N 3.24Å; I56-G59 PolarHBondContact O-N 3.09Å; I56-V64 HydrophobicContact CG1-CG2 3.96Å; I56-L78 HydrophobicContact CD1-CD1 3.93Å; I56-P84 HydrophobicContact CD1-CB 3.72Å; I56-L96 HydrophobicContact CB-CD2 4.07Å; I56-L96 HydrophobicContact CG1-CD2 4.07Å; I56-L96 HydrophobicContact CG2-CD2 3.81Å |
| 57 | S | 83 | Confident | 87.1 | Confident | 56 Ų | 56 | 59.3 Ų | 59.3 | 39% | 0.392 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -69 | -37 | -179 | -54.3 | 0 | 0 | 0 | 0 | 112.2 | K53 K54 A55 G59 | K53-S57 WeakPolarHBondContact O-CB 3.43Å; K53-S57 PolarHBondContact O-N 3.16Å; K53-S57 VanDerWaalsContact O-N 3.14Å; K53-S57 PolarHBondContact O-OG 3.46Å; K54-S57 PolarHBondContact O-N 3.12Å; K54-S57 VanDerWaalsContact O-N 3.13Å; A55-S57 PolarHBondContact O-N 3.42Å; S57-G59 VanDerWaalsContact C-N 3.27Å |
| 58 | E | 85.3 | Confident | 87.8 | Confident | 130 Ų | 130 | 55.5 Ų | 55.5 | 61% | 0.607 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -79 | -13.3 | 175.2 | -68 | 175.6 | 170.2 | 0 | 0 | 112.2 | K54 A55 D60 | K54-E58 VanDerWaalsContact CE-CD 3.5Å; K54-E58 WeakPolarHBondContact CE-OE1 3.42Å; K54-E58 HydrophobicContact CG-CG 4.41Å; K54-E58 IonicContact NZ-OE1 3.84Å; K54-E58 WeakPolarHBondContact O-CG 3.41Å; K54-E58 PolarHBondContact O-N 3.14Å; A55-E58 PolarHBondContact O-N 2.85Å; E58-D60 VanDerWaalsContact C-N 3.3Å |
| 59 | G | 84.5 | Confident | 88.1 | Confident | 24 Ų | 24 | 56.4 Ų | 56.4 | 25% | 0.247 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 73 | 20.6 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114 | A55 I56 S57 T61 N93 | A55-G59 CarbonylContact O-C 3.58Å; A55-G59 PolarHBondContact O-N 3.37Å; I56-G59 PolarHBondContact O-N 3.09Å; S57-G59 VanDerWaalsContact C-N 3.27Å; G59-T61 PolarHBondContact O-N 3.48Å; G59-N93 VanDerWaalsContact CA-ND2 3.3Å; G59-N93 WeakPolarHBondContact CA-ND2 3.42Å |
| 60 | D | 89.1 | Confident | 88.4 | Confident | 55 Ų | 55 | 60.6 Ų | 60.6 | 29% | 0.294 | 32% | 0.324 | S | S | . | . | trans | -74.7 | 94.1 | 178.2 | -178.4 | -0.2 | 0 | 0 | 0 | 110.5 | A55 E58 D62 T63 V64 | A55-D60 HydrophobicContact CB-CB 4.45Å; A55-D60 PolarHBondContact O-N 3.24Å; E58-D60 VanDerWaalsContact C-N 3.3Å; D60-D62 VanDerWaalsContact C-N 3.27Å; D60-D62 PolarHBondContact O-N 3.36Å; D60-D62 PolarHBondContact OD1-N 2.93Å; D60-D62 VanDerWaalsContact OD1-N 3.1Å; D60-T63 WeakPolarHBondContact CB-OG1 3.47Å; D60-T63 PolarHBondContact O-OG1 3.49Å; D60-T63 PolarHBondContact OD1-N 3.01Å; D60-T63 PolarHBondContact OD1-OG1 3.12Å; D60-T63 WeakPolarHBondContact OD2-CB 3.35Å; D60-T63 WeakPolarHBondContact OD2-CG2 3.09Å; D60-T63 PolarHBondContact OD2-OG1 3.33Å; D60-V64 WeakPolarHBondContact O-CG2 3.37Å; D60-V64 PolarHBondContact O-N 3.38Å | ||
| 61 | T | 90.8 | Very high | 88.3 | Confident | 48 Ų | 48 | 60.8 Ų | 60.8 | 29% | 0.294 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -68.6 | -26 | -178.9 | 51.4 | 0 | 0 | 0 | 0 | 113.1 | G59 K65 L96 | G59-T61 PolarHBondContact O-N 3.48Å; T61-K65 VanDerWaalsContact O-CB 3.28Å; T61-K65 WeakPolarHBondContact O-CB 3.34Å; T61-K65 PolarHBondContact O-N 3.35Å; T61-L96 HydrophobicContact CG2-CB 4.2Å; T61-L96 HydrophobicContact CG2-CD1 4.34Å |
| 62 | D | 91.4 | Very high | 88.3 | Confident | 108 Ų | 108 | 59 Ų | 59 | 58% | 0.578 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -76.5 | -43.6 | -174.3 | -70.2 | -32.6 | 0 | 0 | 0 | 110.9 | D60 K65 Q66 | D60-D62 VanDerWaalsContact C-N 3.27Å; D60-D62 PolarHBondContact O-N 3.36Å; D60-D62 PolarHBondContact OD1-N 2.93Å; D60-D62 VanDerWaalsContact OD1-N 3.1Å; D62-K65 WeakPolarHBondContact O-CB 3.33Å; D62-K65 PolarHBondContact O-N 3.17Å; D62-Q66 WeakPolarHBondContact O-CG 3.4Å; D62-Q66 PolarHBondContact O-N 3.01Å |
| 63 | T | 90.6 | Very high | 88.2 | Confident | 40 Ų | 40 | 63.8 Ų | 63.8 | 25% | 0.245 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -67 | -39.3 | 174.4 | 50.1 | 0 | 0 | 0 | 0 | 111.7 | A55 D60 K65 Q66 L67 | A55-T63 WeakPolarHBondContact CB-OG1 3.39Å; D60-T63 WeakPolarHBondContact CB-OG1 3.47Å; D60-T63 PolarHBondContact O-OG1 3.49Å; D60-T63 PolarHBondContact OD1-N 3.01Å; D60-T63 PolarHBondContact OD1-OG1 3.12Å; D60-T63 WeakPolarHBondContact OD2-CB 3.35Å; D60-T63 WeakPolarHBondContact OD2-CG2 3.09Å; D60-T63 PolarHBondContact OD2-OG1 3.33Å; T63-K65 VanDerWaalsContact C-N 3.32Å; T63-K65 PolarHBondContact O-N 3.29Å; T63-Q66 PolarHBondContact O-N 2.99Å; T63-L67 VanDerWaalsContact O-CG 3.27Å; T63-L67 WeakPolarHBondContact O-CG 3.2Å; T63-L67 PolarHBondContact O-N 3.36Å |
| 64 | V | 90.3 | Very high | 88.4 | Confident | 0 Ų | 0 | 61.5 Ų | 61.5 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.8 | -44.7 | 172.9 | 176.6 | 0 | 0 | 0 | 0 | 110.8 | L52 A55 I56 D60 Q66 L67 L68 L96 L99 L100 | L52-V64 HydrophobicContact CD1-CB 4.47Å; L52-V64 HydrophobicContact CD1-CG1 4.05Å; L52-V64 HydrophobicContact CD1-CG2 4.12Å; A55-V64 HydrophobicContact CB-CG2 3.73Å; I56-V64 HydrophobicContact CG1-CG2 3.96Å; D60-V64 WeakPolarHBondContact O-CG2 3.37Å; D60-V64 PolarHBondContact O-N 3.38Å; V64-Q66 PolarHBondContact O-N 3.35Å; V64-L67 PolarHBondContact O-N 2.72Å; V64-L68 HydrophobicContact CG1-CD1 3.95Å; V64-L68 HydrophobicContact CG1-CG 4.38Å; V64-L68 VanDerWaalsContact O-CG 3.3Å; V64-L68 WeakPolarHBondContact O-CG 3.41Å; V64-L68 PolarHBondContact O-N 2.81Å; V64-L96 HydrophobicContact CB-CD1 3.92Å; V64-L96 HydrophobicContact CG1-CD1 3.81Å; V64-L96 HydrophobicContact CG2-CD1 3.87Å; V64-L99 HydrophobicContact CB-CD2 4.49Å; V64-L99 HydrophobicContact CG1-CD2 4.25Å; V64-L100 HydrophobicContact CG1-CD2 4.22Å |
| 65 | K | 91.5 | Very high | 88.4 | Confident | 93 Ų | 93 | 57 Ų | 57 | 40% | 0.404 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.6 | -46.9 | 177.2 | -174.6 | -178.4 | 175.2 | -174.5 | 0 | 111.8 | T61 D62 T63 L67 L68 D69 L99 | T61-K65 VanDerWaalsContact O-CB 3.28Å; T61-K65 WeakPolarHBondContact O-CB 3.34Å; T61-K65 PolarHBondContact O-N 3.35Å; D62-K65 WeakPolarHBondContact O-CB 3.33Å; D62-K65 PolarHBondContact O-N 3.17Å; T63-K65 VanDerWaalsContact C-N 3.32Å; T63-K65 PolarHBondContact O-N 3.29Å; K65-L67 PolarHBondContact O-N 3.3Å; K65-L68 PolarHBondContact O-N 3.46Å; K65-D69 WeakPolarHBondContact O-CB 3.33Å; K65-D69 PolarHBondContact O-N 2.95Å; K65-L99 HydrophobicContact CB-CD2 4.04Å; K65-L99 HydrophobicContact CG-CD1 4.46Å |
| 66 | Q | 91.5 | Very high | 88.2 | Confident | 121 Ų | 121 | 58 Ų | 58 | 57% | 0.565 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -60.9 | -42.5 | 177.5 | -73.8 | 178.1 | -1.1 | 0 | 0 | 112.3 | D62 T63 V64 L68 D69 N70 | D62-Q66 WeakPolarHBondContact O-CG 3.4Å; D62-Q66 PolarHBondContact O-N 3.01Å; T63-Q66 PolarHBondContact O-N 2.99Å; V64-Q66 PolarHBondContact O-N 3.35Å; Q66-L68 VanDerWaalsContact C-N 3.35Å; Q66-L68 PolarHBondContact O-N 2.96Å; Q66-D69 PolarHBondContact O-N 2.78Å; Q66-N70 WeakPolarHBondContact O-CB 3.45Å; Q66-N70 PolarHBondContact O-N 3.1Å; Q66-N70 PolarHBondContact O-ND2 3.39Å |
| 67 | L | 89.4 | Confident | 88.1 | Confident | 19 Ų | 19 | 63.7 Ų | 63.7 | 10% | 0.099 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 178.1 | -71.5 | 170.6 | 0 | 0 | 0 | 111.7 | V51 L52 T63 V64 K65 N70 L72 | V51-L67 HydrophobicContact CG1-CD1 4.11Å; L52-L67 HydrophobicContact CB-CD1 3.91Å; L52-L67 HydrophobicContact CD1-CD1 3.96Å; T63-L67 VanDerWaalsContact O-CG 3.27Å; T63-L67 WeakPolarHBondContact O-CG 3.2Å; T63-L67 PolarHBondContact O-N 3.36Å; V64-L67 PolarHBondContact O-N 2.72Å; K65-L67 PolarHBondContact O-N 3.3Å; L67-N70 PolarHBondContact O-N 3.11Å; L67-L72 WeakPolarHBondContact O-CB 3.44Å; L67-L72 PolarHBondContact O-N 3.28Å |
| 68 | L | 89.2 | Confident | 88.1 | Confident | 18 Ų | 18 | 61.5 Ų | 61.5 | 9% | 0.094 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -67.4 | -40.1 | 175.4 | -64.7 | 172.1 | 0 | 0 | 0 | 111.9 | V64 K65 Q66 N70 G71 L72 V74 L100 R103 | V64-L68 HydrophobicContact CG1-CD1 3.95Å; V64-L68 HydrophobicContact CG1-CG 4.38Å; V64-L68 VanDerWaalsContact O-CG 3.3Å; V64-L68 WeakPolarHBondContact O-CG 3.41Å; V64-L68 PolarHBondContact O-N 2.81Å; K65-L68 PolarHBondContact O-N 3.46Å; Q66-L68 VanDerWaalsContact C-N 3.35Å; Q66-L68 PolarHBondContact O-N 2.96Å; L68-N70 PolarHBondContact O-N 3.41Å; L68-G71 PolarHBondContact O-N 3.46Å; L68-L72 HydrophobicContact CD2-CD2 4.11Å; L68-V74 HydrophobicContact CD2-CB 4.12Å; L68-V74 HydrophobicContact CD2-CG2 4.21Å; L68-L100 HydrophobicContact CD1-CD2 3.95Å; L68-R103 HydrophobicContact CD1-CB 4.25Å; L68-R103 HydrophobicContact CD1-CG 4Å |
| 69 | D | 90.1 | Very high | 87.6 | Confident | 94 Ų | 94 | 56.9 Ų | 56.9 | 50% | 0.503 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -65 | -28.2 | 176.8 | -67 | -9.3 | 0 | 0 | 0 | 111.5 | K65 Q66 G71 R103 | K65-D69 WeakPolarHBondContact O-CB 3.33Å; K65-D69 PolarHBondContact O-N 2.95Å; Q66-D69 PolarHBondContact O-N 2.78Å; D69-G71 PolarHBondContact O-N 3.22Å; D69-R103 IonicContact OD1-CZ 3.23Å; D69-R103 IonicContact OD1-NH1 3.55Å; D69-R103 PolarHBondContact OD1-NH1 3.38Å; D69-R103 IonicContact OD1-NH2 2.83Å; D69-R103 PolarHBondContact OD1-NH2 3.17Å; D69-R103 IonicContact OD2-NH2 3.03Å |
| 70 | N | 88.9 | Confident | 87.1 | Confident | 138 Ų | 138 | 62.4 Ų | 62.4 | 74% | 0.738 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | 5.1 | 173 | -69.2 | -21.9 | 0 | 0 | 0 | 113.9 | Q66 L67 L68 | Q66-N70 WeakPolarHBondContact O-CB 3.45Å; Q66-N70 PolarHBondContact O-N 3.1Å; Q66-N70 PolarHBondContact O-ND2 3.39Å; L67-N70 PolarHBondContact O-N 3.11Å; L68-N70 PolarHBondContact O-N 3.41Å |
| 71 | G | 83.6 | Confident | 86.7 | Confident | 68 Ų | 68 | 61.2 Ų | 61.2 | 70% | 0.701 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 90.1 | 15.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115 | L68 D69 | L68-G71 PolarHBondContact O-N 3.46Å; D69-G71 PolarHBondContact O-N 3.22Å |
| 72 | L | 87.9 | Confident | 86.5 | Confident | 31 Ų | 31 | 61.8 Ų | 61.8 | 16% | 0.162 | 33% | 0.334 | C | S | . | . | trans | -67 | 132.2 | 171.3 | -172.6 | 143.3 | 0 | 0 | 0 | 110.1 | N48 L52 L67 L68 V74 | N48-L72 HydrophobicContact CB-CD1 4.07Å; L52-L72 HydrophobicContact CD2-CD1 4.26Å; L52-L72 HydrophobicContact CD2-CD2 3.61Å; L67-L72 WeakPolarHBondContact O-CB 3.44Å; L67-L72 PolarHBondContact O-N 3.28Å; L68-L72 HydrophobicContact CD2-CD2 4.11Å; L72-V74 PolarHBondContact O-N 3.29Å | ||
| 73 | D | 87.4 | Confident | 86.4 | Confident | 99 Ų | 99 | 56.7 Ų | 56.7 | 53% | 0.529 | 31% | 0.307 | S | S | . | . | trans | -65.1 | 124.6 | 179.3 | 177.8 | 19.4 | 0 | 0 | 0 | 110.9 | E75 T76 | D73-E75 PolarHBondContact O-N 3.46Å; D73-E75 VanDerWaalsContact O-N 3.16Å; D73-E75 PolarHBondContact OD1-N 2.98Å; D73-E75 VanDerWaalsContact OD1-N 3.13Å; D73-T76 VanDerWaalsContact O-CB 3.24Å; D73-T76 WeakPolarHBondContact O-CB 3.49Å; D73-T76 PolarHBondContact O-N 3.07Å; D73-T76 PolarHBondContact O-OG1 2.99Å | ||
| 74 | V | 86.8 | Confident | 86.4 | Confident | 17 Ų | 17 | 54.8 Ų | 54.8 | 10% | 0.103 | 30% | 0.296 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -24 | -179.5 | 73 | 0 | 0 | 0 | 0 | 112.5 | L68 L72 P84 L100 R103 A105 | L68-V74 HydrophobicContact CD2-CB 4.12Å; L68-V74 HydrophobicContact CD2-CG2 4.21Å; L72-V74 PolarHBondContact O-N 3.29Å; V74-P84 VanDerWaalsContact O-CD 3.31Å; V74-P84 WeakPolarHBondContact O-CD 3.4Å; V74-P84 WeakPolarHBondContact O-CG 3.37Å; V74-L100 HydrophobicContact CG2-CD2 3.95Å; V74-R103 HydrophobicContact CG2-CB 4.18Å; V74-A105 HydrophobicContact CG2-CB 3.83Å |
| 75 | E | 86.4 | Confident | 86.5 | Confident | 33 Ų | 33 | 54.9 Ų | 54.9 | 15% | 0.154 | 30% | 0.296 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.1 | 12.1 | 177.6 | -73.2 | -64 | 143.5 | 0 | 0 | 113.5 | D73 R77 T83 A105 S106 | D73-E75 PolarHBondContact O-N 3.46Å; D73-E75 VanDerWaalsContact O-N 3.16Å; D73-E75 PolarHBondContact OD1-N 2.98Å; D73-E75 VanDerWaalsContact OD1-N 3.13Å; E75-R77 PolarHBondContact O-N 2.8Å; E75-R77 VanDerWaalsContact O-N 3.15Å; E75-R77 IonicContact OE2-NH1 2.75Å; E75-R77 PolarHBondContact OE2-NH1 2.97Å; E75-T83 WeakPolarHBondContact OE2-CG2 3.26Å; E75-A105 WeakPolarHBondContact OE1-CA 3.2Å; E75-S106 PolarHBondContact OE1-N 2.84Å |
| 76 | T | 86.3 | Confident | 86.4 | Confident | 24 Ų | 24 | 50.4 Ų | 50.4 | 15% | 0.147 | 28% | 0.277 | C | S | . | . | trans | -49 | 122.6 | 179.7 | -67.5 | 0 | 0 | 0 | 0 | 110.9 | I49 D73 L78 P84 | I49-T76 HydrophobicContact CD1-CG2 4.09Å; I49-T76 HydrophobicContact CG1-CG2 3.84Å; D73-T76 VanDerWaalsContact O-CB 3.24Å; D73-T76 WeakPolarHBondContact O-CB 3.49Å; D73-T76 PolarHBondContact O-N 3.07Å; D73-T76 PolarHBondContact O-OG1 2.99Å; T76-L78 PolarHBondContact O-N 3.48Å; T76-L78 VanDerWaalsContact O-N 3.16Å; T76-P84 VanDerWaalsContact O-CD 3.3Å; T76-P84 WeakPolarHBondContact O-CD 3.22Å | ||
| 77 | R | 85.9 | Confident | 86.3 | Confident | 121 Ų | 121 | 45.6 Ų | 45.6 | 46% | 0.457 | 25% | 0.253 | S | S | . | . | trans | -72.3 | 113.1 | 179 | -59.5 | -60.5 | -178.6 | -136 | -8.8 | 109.6 | E75 | E75-R77 PolarHBondContact O-N 2.8Å; E75-R77 VanDerWaalsContact O-N 3.15Å; E75-R77 IonicContact OE2-NH1 2.75Å; E75-R77 PolarHBondContact OE2-NH1 2.97Å | ||
| 78 | L | 82.8 | Confident | 86.4 | Confident | 11 Ų | 11 | 44.7 Ų | 44.7 | 6% | 0.058 | 25% | 0.249 | C | C | . | . | trans | -82.6 | -170.4 | 171.8 | -66.5 | 176.8 | 0 | 0 | 0 | 109.9 | I49 L52 K53 I56 T76 G81 W82 P84 Y87 | I49-L78 HydrophobicContact CG2-CD2 3.8Å; L52-L78 HydrophobicContact CD2-CD2 4.25Å; K53-L78 HydrophobicContact CB-CD2 4.49Å; I56-L78 HydrophobicContact CD1-CD1 3.93Å; T76-L78 PolarHBondContact O-N 3.48Å; T76-L78 VanDerWaalsContact O-N 3.16Å; L78-G81 PolarHBondContact O-N 2.9Å; L78-W82 WeakPolarHBondContact CB-O 3.36Å; L78-W82 PolarHBondContact N-O 3.46Å; L78-P84 HydrophobicContact CD1-CB 4.45Å; L78-P84 HydrophobicContact CD1-CG 4.19Å; L78-Y87 HydrophobicContact CB-CD2 4.1Å; L78-Y87 HydrophobicContact CB-CE2 3.54Å; L78-Y87 HydrophobicContact CD1-CD2 3.46Å; L78-Y87 VanDerWaalsContact CD1-CD2 3.46Å; L78-Y87 HydrophobicContact CD1-CE2 3.77Å; L78-Y87 HydrophobicContact CD1-CG 4.34Å; L78-Y87 HydrophobicContact CG-CD2 4.41Å; L78-Y87 HydrophobicContact CG-CE2 4.31Å | ||
| 79 | G | 76.2 | Confident | 86.5 | Confident | 32 Ų | 32 | 43.9 Ų | 43.9 | 33% | 0.33 | 24% | 0.244 | S | C | . | . | G | 310 helix | trans | -49.9 | 144.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | G81 W82 Y87 | G79-G81 PolarHBondContact O-N 3.34Å; G79-W82 PolarHBondContact O-N 3.42Å; G79-Y87 PolarHBondContact O-OH 3.37Å |
| 80 | F | 73.7 | Confident | 86.5 | Confident | 141 Ų | 141 | 40.7 Ų | 40.7 | 62% | 0.618 | 23% | 0.229 | S | C | * | . | G | 310 helix | trans | 56.3 | 20 | -175.8 | -51.7 | -82.3 | 0 | 0 | 0 | 114.4 | W82 K111 | F80-W82 PolarHBondContact O-N 2.95Å; F80-K111 VanDerWaalsContact O-CD 3.26Å; F80-K111 WeakPolarHBondContact O-CD 3.47Å; F80-K111 WeakPolarHBondContact O-CE 3.25Å; F80-K111 PolarHBondContact O-NZ 3Å |
| 81 | G | 79.1 | Confident | 86.4 | Confident | 30 Ų | 30 | 37.6 Ų | 37.6 | 31% | 0.309 | 22% | 0.215 | S | C | . | . | G | 310 helix | trans | 69.3 | 19.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | L78 G79 | L78-G81 PolarHBondContact O-N 2.9Å; G79-G81 PolarHBondContact O-N 3.34Å |
| 82 | W | 86.5 | Confident | 86.7 | Confident | 60 Ų | 60 | 34.7 Ų | 34.7 | 23% | 0.227 | 18% | 0.184 | C | C | . | . | trans | -77.5 | 151.6 | 174.7 | -81.9 | 31.6 | 0 | 0 | 0 | 111.2 | L78 G79 F80 M86 Y87 | L78-W82 WeakPolarHBondContact CB-O 3.36Å; L78-W82 PolarHBondContact N-O 3.46Å; G79-W82 PolarHBondContact O-N 3.42Å; F80-W82 PolarHBondContact O-N 2.95Å; W82-M86 HydrophobicContact CB-CB 4.3Å; W82-M86 HydrophobicContact CB-SD 4.29Å; W82-M86 HydrophobicContact CD2-CB 4.16Å; W82-M86 HydrophobicContact CE3-CB 3.92Å; W82-M86 HydrophobicContact CG-CB 4.36Å; W82-M86 HydrophobicContact CG-SD 4.13Å; W82-Y87 HydrophobicContact CB-CD2 3.74Å; W82-Y87 HydrophobicContact CB-CE2 3.3Å; W82-Y87 HydrophobicContact CD2-CE2 4.23Å; W82-Y87 AromaticContact CE3-CD1 3.85Å; W82-Y87 HydrophobicContact CE3-CD1 3.85Å; W82-Y87 AromaticContact CE3-CD2 3.86Å; W82-Y87 HydrophobicContact CE3-CD2 3.86Å; W82-Y87 AromaticContact CE3-CE1 3.86Å; W82-Y87 HydrophobicContact CE3-CE1 3.86Å; W82-Y87 AromaticContact CE3-CE2 3.9Å; W82-Y87 HydrophobicContact CE3-CE2 3.9Å; W82-Y87 AromaticContact CE3-CG 3.86Å; W82-Y87 HydrophobicContact CE3-CG 3.86Å; W82-Y87 AromaticContact CE3-CZ 3.89Å; W82-Y87 HydrophobicContact CG-CE2 4.07Å; W82-Y87 HydrophobicContact CZ3-CD1 4.18Å; W82-Y87 HydrophobicContact CZ3-CE1 4.29Å; W82-Y87 HydrophobicContact CZ3-CG 4.48Å | ||
| 83 | T | 89.8 | Confident | 86.8 | Confident | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 19% | 0.185 | C | C | . | . | trans | -84.3 | 159.5 | 170.4 | 55.6 | 0 | 0 | 0 | 0 | 111.2 | E75 L85 M86 Y87 F109 | E75-T83 WeakPolarHBondContact OE2-CG2 3.26Å; T83-L85 PolarHBondContact O-N 3.46Å; T83-M86 WeakPolarHBondContact O-CB 3.47Å; T83-M86 PolarHBondContact O-N 3.13Å; T83-M86 VanDerWaalsContact O-N 3.12Å; T83-M86 VanDerWaalsContact OG1-CG 3.32Å; T83-M86 WeakPolarHBondContact OG1-CG 3.44Å; T83-M86 PolarHBondContact OG1-N 2.86Å; T83-M86 VanDerWaalsContact OG1-N 3.1Å; T83-Y87 WeakPolarHBondContact O-CD2 3.48Å; T83-Y87 PolarHBondContact O-N 3.43Å; T83-F109 HydrophobicContact CG2-CB 4.37Å; T83-F109 HydrophobicContact CG2-CD1 3.43Å; T83-F109 VanDerWaalsContact CG2-CD1 3.43Å; T83-F109 HydrophobicContact CG2-CD2 4.28Å; T83-F109 HydrophobicContact CG2-CE1 3.72Å; T83-F109 HydrophobicContact CG2-CG 3.73Å; T83-F109 HydrophobicContact CG2-CZ 4.29Å | ||
| 84 | P | 90.4 | Very high | 86.9 | Confident | 1 Ų | 1 | 30.8 Ų | 30.8 | 1% | 0.006 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -52.5 | -38.1 | 168.6 | -29.1 | 40.3 | 0 | 0 | 0 | 111.9 | L52 I56 V74 T76 L78 Y87 A88 L100 | L52-P84 HydrophobicContact CD2-CG 4.05Å; I56-P84 HydrophobicContact CD1-CB 3.72Å; V74-P84 VanDerWaalsContact O-CD 3.31Å; V74-P84 WeakPolarHBondContact O-CD 3.4Å; V74-P84 WeakPolarHBondContact O-CG 3.37Å; T76-P84 VanDerWaalsContact O-CD 3.3Å; T76-P84 WeakPolarHBondContact O-CD 3.22Å; L78-P84 HydrophobicContact CD1-CB 4.45Å; L78-P84 HydrophobicContact CD1-CG 4.19Å; P84-Y87 PolarHBondContact O-N 3.35Å; P84-A88 PolarHBondContact O-N 3.4Å; P84-L100 HydrophobicContact CB-CD1 3.98Å; P84-L100 HydrophobicContact CB-CD2 3.94Å |
| 85 | L | 92.3 | Very high | 87.1 | Confident | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.005 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.9 | -43 | 178.3 | -177.9 | 63.1 | 0 | 0 | 0 | 112.1 | T83 Y87 A88 V89 A97 L100 L101 A105 V117 L138 | T83-L85 PolarHBondContact O-N 3.46Å; L85-Y87 VanDerWaalsContact C-N 3.32Å; L85-Y87 PolarHBondContact O-N 2.98Å; L85-A88 PolarHBondContact O-N 3.43Å; L85-V89 HydrophobicContact CD1-CG1 4.19Å; L85-V89 WeakPolarHBondContact O-CG1 3.28Å; L85-V89 WeakPolarHBondContact O-CG2 3.26Å; L85-V89 PolarHBondContact O-N 3.28Å; L85-A97 HydrophobicContact CD1-CB 3.93Å; L85-L100 HydrophobicContact CB-CD1 4.41Å; L85-L100 HydrophobicContact CD1-CB 4.18Å; L85-L101 HydrophobicContact CD1-CD1 4.4Å; L85-L101 HydrophobicContact CD1-CD2 4.37Å; L85-L101 HydrophobicContact CD1-CG 3.96Å; L85-L101 HydrophobicContact CD2-CD2 3.6Å; L85-L101 HydrophobicContact CD2-CG 4.13Å; L85-A105 HydrophobicContact CB-CB 4.13Å; L85-A105 HydrophobicContact CD2-CB 3.95Å; L85-V117 HydrophobicContact CD2-CG1 3.84Å; L85-V117 HydrophobicContact CD2-CG2 4.26Å; L85-V117 HydrophobicContact CG-CG1 3.73Å; L85-L138 HydrophobicContact CD2-CD2 4.32Å |
| 86 | M | 90.9 | Very high | 87.4 | Confident | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -58 | -42.9 | 175.5 | -77.5 | 178.3 | 138.9 | 0 | 0 | 112.3 | W82 T83 V89 S90 F109 W115 V117 | W82-M86 HydrophobicContact CB-CB 4.3Å; W82-M86 HydrophobicContact CB-SD 4.29Å; W82-M86 HydrophobicContact CD2-CB 4.16Å; W82-M86 HydrophobicContact CE3-CB 3.92Å; W82-M86 HydrophobicContact CG-CB 4.36Å; W82-M86 HydrophobicContact CG-SD 4.13Å; T83-M86 WeakPolarHBondContact O-CB 3.47Å; T83-M86 PolarHBondContact O-N 3.13Å; T83-M86 VanDerWaalsContact O-N 3.12Å; T83-M86 VanDerWaalsContact OG1-CG 3.32Å; T83-M86 WeakPolarHBondContact OG1-CG 3.44Å; T83-M86 PolarHBondContact OG1-N 2.86Å; T83-M86 VanDerWaalsContact OG1-N 3.1Å; M86-V89 VanDerWaalsContact O-CG2 3.3Å; M86-V89 WeakPolarHBondContact O-CG2 3.4Å; M86-S90 WeakPolarHBondContact O-CB 3.23Å; M86-S90 PolarHBondContact O-N 3.18Å; M86-S90 PolarHBondContact O-OG 3.45Å; M86-F109 HydrophobicContact CE-CD1 3.97Å; M86-F109 HydrophobicContact CE-CE1 4.21Å; M86-F109 HydrophobicContact SD-CD1 3.72Å; M86-F109 HydrophobicContact SD-CE1 3.78Å; M86-W115 WeakPolarHBondContact CE-O 3.39Å; M86-V117 HydrophobicContact CG-CB 4.47Å; M86-V117 HydrophobicContact CG-CG2 3.95Å |
| 87 | Y | 88.9 | Confident | 87.8 | Confident | 20 Ų | 20 | 32.2 Ų | 32.2 | 8% | 0.078 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -67.5 | -41.9 | 176 | -81.6 | -78.4 | 0 | 0 | 0 | 112.5 | W22 L78 G79 W82 T83 P84 L85 V89 S90 V91 | W22-Y87 HydrophobicContact CH2-CE1 4.03Å; W22-Y87 HydrophobicContact CZ2-CE1 4.25Å; L78-Y87 HydrophobicContact CB-CD2 4.1Å; L78-Y87 HydrophobicContact CB-CE2 3.54Å; L78-Y87 HydrophobicContact CD1-CD2 3.46Å; L78-Y87 VanDerWaalsContact CD1-CD2 3.46Å; L78-Y87 HydrophobicContact CD1-CE2 3.77Å; L78-Y87 HydrophobicContact CD1-CG 4.34Å; L78-Y87 HydrophobicContact CG-CD2 4.41Å; L78-Y87 HydrophobicContact CG-CE2 4.31Å; G79-Y87 PolarHBondContact O-OH 3.37Å; W82-Y87 HydrophobicContact CB-CD2 3.74Å; W82-Y87 HydrophobicContact CB-CE2 3.3Å; W82-Y87 HydrophobicContact CD2-CE2 4.23Å; W82-Y87 AromaticContact CE3-CD1 3.85Å; W82-Y87 HydrophobicContact CE3-CD1 3.85Å; W82-Y87 AromaticContact CE3-CD2 3.86Å; W82-Y87 HydrophobicContact CE3-CD2 3.86Å; W82-Y87 AromaticContact CE3-CE1 3.86Å; W82-Y87 HydrophobicContact CE3-CE1 3.86Å; W82-Y87 AromaticContact CE3-CE2 3.9Å; W82-Y87 HydrophobicContact CE3-CE2 3.9Å; W82-Y87 AromaticContact CE3-CG 3.86Å; W82-Y87 HydrophobicContact CE3-CG 3.86Å; W82-Y87 AromaticContact CE3-CZ 3.89Å; W82-Y87 HydrophobicContact CG-CE2 4.07Å; W82-Y87 HydrophobicContact CZ3-CD1 4.18Å; W82-Y87 HydrophobicContact CZ3-CE1 4.29Å; W82-Y87 HydrophobicContact CZ3-CG 4.48Å; T83-Y87 WeakPolarHBondContact O-CD2 3.48Å; T83-Y87 PolarHBondContact O-N 3.43Å; P84-Y87 PolarHBondContact O-N 3.35Å; L85-Y87 VanDerWaalsContact C-N 3.32Å; L85-Y87 PolarHBondContact O-N 2.98Å; Y87-V89 VanDerWaalsContact C-N 3.3Å; Y87-V89 PolarHBondContact O-N 3.49Å; Y87-S90 WeakPolarHBondContact CA-OG 3.37Å; Y87-S90 PolarHBondContact O-N 2.85Å; Y87-S90 PolarHBondContact O-OG 3.11Å; Y87-V91 PolarHBondContact O-N 3.39Å |
| 88 | A | 91.6 | Very high | 88.1 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -59.9 | -42 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | P84 L85 A92 N93 L96 A97 L100 | P84-A88 PolarHBondContact O-N 3.4Å; L85-A88 PolarHBondContact O-N 3.43Å; A88-A92 PolarHBondContact O-N 3.31Å; A88-N93 PolarHBondContact O-N 3.44Å; A88-L96 HydrophobicContact CB-CB 4.22Å; A88-L96 HydrophobicContact CB-CD2 3.83Å; A88-L96 HydrophobicContact CB-CG 3.78Å; A88-A97 HydrophobicContact CB-CB 4.4Å; A88-L100 HydrophobicContact CB-CD1 3.83Å |
| 89 | V | 91.6 | Very high | 88.5 | Confident | 1 Ų | 1 | 31.2 Ų | 31.2 | 1% | 0.006 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -78.2 | -27.7 | 179.5 | -56.6 | 0 | 0 | 0 | 0 | 113.1 | L85 M86 Y87 V91 A92 A97 V117 A120 A124 L138 | L85-V89 HydrophobicContact CD1-CG1 4.19Å; L85-V89 WeakPolarHBondContact O-CG1 3.28Å; L85-V89 WeakPolarHBondContact O-CG2 3.26Å; L85-V89 PolarHBondContact O-N 3.28Å; M86-V89 VanDerWaalsContact O-CG2 3.3Å; M86-V89 WeakPolarHBondContact O-CG2 3.4Å; Y87-V89 VanDerWaalsContact C-N 3.3Å; Y87-V89 PolarHBondContact O-N 3.49Å; V89-V91 PolarHBondContact O-N 3.17Å; V89-A92 WeakPolarHBondContact O-CA 3.42Å; V89-A92 PolarHBondContact O-N 3.13Å; V89-A97 HydrophobicContact CG1-CB 3.8Å; V89-V117 HydrophobicContact CG1-CG1 4.28Å; V89-V117 HydrophobicContact CG2-CG1 3.81Å; V89-A120 HydrophobicContact CG2-CB 4.07Å; V89-A124 WeakPolarHBondContact O-CB 3.31Å; V89-L138 HydrophobicContact CG1-CD1 4.15Å |
| 90 | S | 89.1 | Confident | 89.3 | Confident | 27 Ų | 27 | 29.7 Ų | 29.7 | 19% | 0.189 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -68.3 | -23.3 | 175.7 | 69 | 0 | 0 | 0 | 0 | 113.2 | M86 Y87 A124 | M86-S90 WeakPolarHBondContact O-CB 3.23Å; M86-S90 PolarHBondContact O-N 3.18Å; M86-S90 PolarHBondContact O-OG 3.45Å; Y87-S90 WeakPolarHBondContact CA-OG 3.37Å; Y87-S90 PolarHBondContact O-N 2.85Å; Y87-S90 PolarHBondContact O-OG 3.11Å; S90-A124 WeakPolarHBondContact O-CA 3.45Å; S90-A124 WeakPolarHBondContact O-CB 3.21Å |
| 91 | V | 87.6 | Confident | 90.1 | Very high | 73 Ų | 73 | 23.4 Ų | 23.4 | 44% | 0.442 | 13% | 0.127 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -96.7 | 5.5 | 171.8 | -168.2 | 0 | 0 | 0 | 0 | 111.2 | Y87 V89 N93 | Y87-V91 PolarHBondContact O-N 3.39Å; V89-V91 PolarHBondContact O-N 3.17Å; V91-N93 PolarHBondContact O-N 3.38Å |
| 92 | A | 89.1 | Confident | 90.7 | Very high | 6 Ų | 6 | 24.9 Ų | 24.9 | 5% | 0.05 | 13% | 0.127 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 51.8 | 36 | -176 | 0 | 0 | 0 | 0 | 0 | 114 | A88 V89 C94 A124 S126 K130 I131 | A88-A92 PolarHBondContact O-N 3.31Å; V89-A92 WeakPolarHBondContact O-CA 3.42Å; V89-A92 PolarHBondContact O-N 3.13Å; A92-C94 PolarHBondContact O-N 3.2Å; A92-A124 HydrophobicContact CB-CB 4.25Å; A92-S126 VanDerWaalsContact CB-CB 3.49Å; A92-K130 HydrophobicContact CB-CB 3.79Å; A92-I131 HydrophobicContact CB-CG1 4.28Å |
| 93 | N | 90.1 | Very high | 90.7 | Very high | 32 Ų | 32 | 26.1 Ų | 26.1 | 17% | 0.171 | 13% | 0.132 | C | C | . | . | trans | -87.4 | 87.1 | 174.7 | -171.6 | -19.4 | 0 | 0 | 0 | 110.4 | G59 A88 V91 N95 L96 A97 | G59-N93 VanDerWaalsContact CA-ND2 3.3Å; G59-N93 WeakPolarHBondContact CA-ND2 3.42Å; A88-N93 PolarHBondContact O-N 3.44Å; V91-N93 PolarHBondContact O-N 3.38Å; N93-N95 VanDerWaalsContact C-N 3.31Å; N93-N95 PolarHBondContact O-N 2.87Å; N93-N95 PolarHBondContact OD1-N 3.46Å; N93-L96 HydrophobicContact CB-CB 4.09Å; N93-L96 VanDerWaalsContact CG-CB 3.48Å; N93-L96 PolarHBondContact O-N 2.67Å; N93-L96 WeakPolarHBondContact OD1-CB 3.08Å; N93-L96 PolarHBondContact OD1-N 2.85Å; N93-L96 VanDerWaalsContact OD1-N 3.13Å; N93-A97 WeakPolarHBondContact O-CB 3.49Å; N93-A97 PolarHBondContact O-N 3.32Å | ||
| 94 | C | 90.4 | Very high | 90.5 | Very high | 16 Ų | 16 | 28.8 Ų | 28.8 | 11% | 0.108 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -72.1 | -22.9 | -173.6 | -48.4 | 0 | 0 | 0 | 0 | 113.7 | A92 R98 K130 H133 C134 | A92-C94 PolarHBondContact O-N 3.2Å; C94-R98 VanDerWaalsContact O-CB 3.28Å; C94-R98 WeakPolarHBondContact O-CB 3.36Å; C94-R98 PolarHBondContact O-N 3.37Å; C94-K130 PolarHBondContact SG-O 3.23Å; C94-H133 HydrophobicContact CB-CB 4.46Å; C94-C134 WeakPolarHBondContact CA-SG 3.3Å; C94-C134 HydrophobicContact CB-CB 4.4Å; C94-C134 WeakPolarHBondContact CB-SG 3.3Å; C94-C134 PolarHBondContact N-SG 2.95Å; C94-C134 VanDerWaalsContact N-SG 3.41Å; C94-C134 VanDerWaalsContact SG-CA 3.5Å; C94-C134 WeakPolarHBondContact SG-CB 3.17Å; C94-C134 PolarHBondContact SG-N 2.84Å; C94-C134 CovalentContact SG-SG 2.07Å; C94-C134 PolarHBondContact SG-SG 3.25Å |
| 95 | N | 91.7 | Very high | 90.4 | Very high | 105 Ų | 105 | 29.2 Ų | 29.2 | 56% | 0.561 | 16% | 0.163 | S | C | * | . | H | α-helix | trans | -68.5 | -44.6 | 173.7 | -72.2 | -24.2 | 0 | 0 | 0 | 110.9 | N93 R98 L99 | N93-N95 VanDerWaalsContact C-N 3.31Å; N93-N95 PolarHBondContact O-N 2.87Å; N93-N95 PolarHBondContact OD1-N 3.46Å; N95-R98 PolarHBondContact O-N 2.81Å; N95-R98 PolarHBondContact OD1-NH1 3.47Å; N95-L99 PolarHBondContact O-N 3.27Å |
| 96 | L | 92.4 | Very high | 90.1 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -67.3 | -42.2 | 175.9 | -177.8 | 59.8 | 0 | 0 | 0 | 111.8 | I56 T61 V64 A88 N93 R98 L99 L100 | I56-L96 HydrophobicContact CB-CD2 4.07Å; I56-L96 HydrophobicContact CG1-CD2 4.07Å; I56-L96 HydrophobicContact CG2-CD2 3.81Å; T61-L96 HydrophobicContact CG2-CB 4.2Å; T61-L96 HydrophobicContact CG2-CD1 4.34Å; V64-L96 HydrophobicContact CB-CD1 3.92Å; V64-L96 HydrophobicContact CG1-CD1 3.81Å; V64-L96 HydrophobicContact CG2-CD1 3.87Å; A88-L96 HydrophobicContact CB-CB 4.22Å; A88-L96 HydrophobicContact CB-CD2 3.83Å; A88-L96 HydrophobicContact CB-CG 3.78Å; N93-L96 HydrophobicContact CB-CB 4.09Å; N93-L96 VanDerWaalsContact CG-CB 3.48Å; N93-L96 PolarHBondContact O-N 2.67Å; N93-L96 WeakPolarHBondContact OD1-CB 3.08Å; N93-L96 PolarHBondContact OD1-N 2.85Å; N93-L96 VanDerWaalsContact OD1-N 3.13Å; L96-R98 VanDerWaalsContact C-N 3.29Å; L96-R98 PolarHBondContact O-N 3.29Å; L96-L99 HydrophobicContact CD1-CD2 4.37Å; L96-L99 PolarHBondContact O-N 3.27Å; L96-L100 HydrophobicContact CD1-CD1 4.39Å; L96-L100 HydrophobicContact CD1-CG 4.48Å; L96-L100 HydrophobicContact CG-CD1 4.16Å; L96-L100 WeakPolarHBondContact O-CG 3.46Å; L96-L100 PolarHBondContact O-N 3.49Å |
| 97 | A | 92.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -58.8 | -41.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L85 A88 V89 N93 L100 L101 L137 | L85-A97 HydrophobicContact CD1-CB 3.93Å; A88-A97 HydrophobicContact CB-CB 4.4Å; V89-A97 HydrophobicContact CG1-CB 3.8Å; N93-A97 WeakPolarHBondContact O-CB 3.49Å; N93-A97 PolarHBondContact O-N 3.32Å; A97-L100 PolarHBondContact O-N 2.87Å; A97-L101 WeakPolarHBondContact O-CB 3.45Å; A97-L101 WeakPolarHBondContact O-CD1 3.33Å; A97-L101 VanDerWaalsContact O-CG 3.25Å; A97-L101 WeakPolarHBondContact O-CG 3.28Å; A97-L101 PolarHBondContact O-N 3.18Å; A97-L137 HydrophobicContact CB-CD2 4.2Å |
| 98 | R | 92.9 | Very high | 89.1 | Confident | 81 Ų | 81 | 35.1 Ų | 35.1 | 31% | 0.306 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -62 | -48.4 | 175.6 | -166.3 | -177.9 | -62.2 | 123.9 | -5.3 | 111.6 | C94 N95 L96 L100 L101 D102 L137 | C94-R98 VanDerWaalsContact O-CB 3.28Å; C94-R98 WeakPolarHBondContact O-CB 3.36Å; C94-R98 PolarHBondContact O-N 3.37Å; N95-R98 PolarHBondContact O-N 2.81Å; N95-R98 PolarHBondContact OD1-NH1 3.47Å; L96-R98 VanDerWaalsContact C-N 3.29Å; L96-R98 PolarHBondContact O-N 3.29Å; R98-L100 VanDerWaalsContact C-N 3.32Å; R98-L100 PolarHBondContact O-N 3.35Å; R98-L101 PolarHBondContact O-N 3.19Å; R98-D102 WeakPolarHBondContact O-CB 3.35Å; R98-D102 PolarHBondContact O-N 3.34Å; R98-L137 HydrophobicContact CB-CD2 3.88Å; R98-L137 HydrophobicContact CG-CD1 4.46Å; R98-L137 HydrophobicContact CG-CD2 4.45Å |
| 99 | L | 92.4 | Very high | 88.4 | Confident | 30 Ų | 30 | 36.6 Ų | 36.6 | 16% | 0.157 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -54.8 | -48.3 | 175.9 | 179 | 69.8 | 0 | 0 | 0 | 111.3 | V64 K65 N95 L96 D102 R103 | V64-L99 HydrophobicContact CB-CD2 4.49Å; V64-L99 HydrophobicContact CG1-CD2 4.25Å; K65-L99 HydrophobicContact CB-CD2 4.04Å; K65-L99 HydrophobicContact CG-CD1 4.46Å; N95-L99 PolarHBondContact O-N 3.27Å; L96-L99 HydrophobicContact CD1-CD2 4.37Å; L96-L99 PolarHBondContact O-N 3.27Å; L99-D102 PolarHBondContact O-N 3.42Å; L99-R103 WeakPolarHBondContact O-CG 3.28Å; L99-R103 PolarHBondContact O-N 2.81Å; L99-R103 VanDerWaalsContact O-N 3.08Å |
| 100 | L | 91.8 | Very high | 87.4 | Confident | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.2 | -42.9 | -179.2 | -69.6 | 167.4 | 0 | 0 | 0 | 112.1 | V64 L68 V74 P84 L85 A88 L96 A97 R98 D102 R103 G104 A105 | V64-L100 HydrophobicContact CG1-CD2 4.22Å; L68-L100 HydrophobicContact CD1-CD2 3.95Å; V74-L100 HydrophobicContact CG2-CD2 3.95Å; P84-L100 HydrophobicContact CB-CD1 3.98Å; P84-L100 HydrophobicContact CB-CD2 3.94Å; L85-L100 HydrophobicContact CB-CD1 4.41Å; L85-L100 HydrophobicContact CD1-CB 4.18Å; A88-L100 HydrophobicContact CB-CD1 3.83Å; L96-L100 HydrophobicContact CD1-CD1 4.39Å; L96-L100 HydrophobicContact CD1-CG 4.48Å; L96-L100 HydrophobicContact CG-CD1 4.16Å; L96-L100 WeakPolarHBondContact O-CG 3.46Å; L96-L100 PolarHBondContact O-N 3.49Å; A97-L100 PolarHBondContact O-N 2.87Å; R98-L100 VanDerWaalsContact C-N 3.32Å; R98-L100 PolarHBondContact O-N 3.35Å; L100-D102 PolarHBondContact O-N 3.19Å; L100-R103 CarbonylContact O-C 3.59Å; L100-R103 PolarHBondContact O-N 2.9Å; L100-G104 PolarHBondContact O-N 2.88Å; L100-A105 HydrophobicContact CB-CB 4.1Å; L100-A105 WeakPolarHBondContact O-CB 3.19Å; L100-A105 PolarHBondContact O-N 2.78Å |
| 101 | L | 90.8 | Very high | 86.6 | Confident | 9 Ų | 9 | 40.2 Ų | 40.2 | 5% | 0.047 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.3 | -37.3 | 175.7 | -71.9 | 166.1 | 0 | 0 | 0 | 112.5 | L85 A97 R98 R103 G104 A107 L137 L138 R141 | L85-L101 HydrophobicContact CD1-CD1 4.4Å; L85-L101 HydrophobicContact CD1-CD2 4.37Å; L85-L101 HydrophobicContact CD1-CG 3.96Å; L85-L101 HydrophobicContact CD2-CD2 3.6Å; L85-L101 HydrophobicContact CD2-CG 4.13Å; A97-L101 WeakPolarHBondContact O-CB 3.45Å; A97-L101 WeakPolarHBondContact O-CD1 3.33Å; A97-L101 VanDerWaalsContact O-CG 3.25Å; A97-L101 WeakPolarHBondContact O-CG 3.28Å; A97-L101 PolarHBondContact O-N 3.18Å; R98-L101 PolarHBondContact O-N 3.19Å; L101-R103 PolarHBondContact O-N 3.09Å; L101-G104 PolarHBondContact O-N 3.44Å; L101-A107 HydrophobicContact CD2-CB 3.9Å; L101-L137 HydrophobicContact CD1-CD1 4.32Å; L101-L137 HydrophobicContact CD1-CD2 3.84Å; L101-L137 HydrophobicContact CD1-CG 3.72Å; L101-L138 HydrophobicContact CD1-CD2 4.26Å; L101-R141 HydrophobicContact CD1-CG 4.21Å; L101-R141 HydrophobicContact CD2-CG 4.4Å; L101-R141 PolarHBondContact O-NH1 3.38Å |
| 102 | D | 91 | Very high | 85.6 | Confident | 60 Ų | 60 | 40.2 Ų | 40.2 | 32% | 0.321 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -69.5 | -23.6 | 176.2 | -63.1 | -23.2 | 0 | 0 | 0 | 112.3 | R98 L99 L100 G104 R141 Q386 | R98-D102 WeakPolarHBondContact O-CB 3.35Å; R98-D102 PolarHBondContact O-N 3.34Å; L99-D102 PolarHBondContact O-N 3.42Å; L100-D102 PolarHBondContact O-N 3.19Å; D102-G104 VanDerWaalsContact C-N 3.31Å; D102-R141 IonicContact OD1-CZ 3.54Å; D102-R141 IonicContact OD1-NH1 2.6Å; D102-R141 IonicContact OD1-NH2 3.23Å; D102-R141 PolarHBondContact OD1-NH2 3.33Å; D102-Q386 PolarHBondContact OD2-NE2 3.13Å; D102-Q386 PolarHBondContact OD2-OE1 3.22Å |
| 103 | R | 87.9 | Confident | 84.5 | Confident | 87 Ų | 87 | 42 Ų | 42 | 33% | 0.328 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | 8.8 | 174.1 | -60.5 | -61.7 | -179.8 | 85.2 | -16.8 | 113.4 | L68 D69 V74 L99 L100 L101 | L68-R103 HydrophobicContact CD1-CB 4.25Å; L68-R103 HydrophobicContact CD1-CG 4Å; D69-R103 IonicContact OD1-CZ 3.23Å; D69-R103 IonicContact OD1-NH1 3.55Å; D69-R103 PolarHBondContact OD1-NH1 3.38Å; D69-R103 IonicContact OD1-NH2 2.83Å; D69-R103 PolarHBondContact OD1-NH2 3.17Å; D69-R103 IonicContact OD2-NH2 3.03Å; V74-R103 HydrophobicContact CG2-CB 4.18Å; L99-R103 WeakPolarHBondContact O-CG 3.28Å; L99-R103 PolarHBondContact O-N 2.81Å; L99-R103 VanDerWaalsContact O-N 3.08Å; L100-R103 CarbonylContact O-C 3.59Å; L100-R103 PolarHBondContact O-N 2.9Å; L101-R103 PolarHBondContact O-N 3.09Å |
| 104 | G | 84.7 | Confident | 84 | Confident | 55 Ų | 55 | 41.9 Ų | 41.9 | 57% | 0.567 | 24% | 0.243 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 93.9 | 14.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | L100 L101 D102 | L100-G104 PolarHBondContact O-N 2.88Å; L101-G104 PolarHBondContact O-N 3.44Å; D102-G104 VanDerWaalsContact C-N 3.31Å |
| 105 | A | 88.1 | Confident | 83.7 | Confident | 10 Ų | 10 | 44 Ų | 44 | 8% | 0.083 | 25% | 0.249 | C | C | . | . | trans | -59.3 | 141.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | V74 E75 L85 L100 A107 | V74-A105 HydrophobicContact CG2-CB 3.83Å; E75-A105 WeakPolarHBondContact OE1-CA 3.2Å; L85-A105 HydrophobicContact CB-CB 4.13Å; L85-A105 HydrophobicContact CD2-CB 3.95Å; L100-A105 HydrophobicContact CB-CB 4.1Å; L100-A105 WeakPolarHBondContact O-CB 3.19Å; L100-A105 PolarHBondContact O-N 2.78Å; A105-A107 PolarHBondContact O-N 3.33Å | ||
| 106 | S | 85.7 | Confident | 83.6 | Confident | 52 Ų | 52 | 39.3 Ų | 39.3 | 36% | 0.364 | 22% | 0.224 | S | C | . | . | trans | -83.6 | 114.8 | 179.1 | -178.6 | 0 | 0 | 0 | 0 | 111.3 | E75 N108 F109 | E75-S106 PolarHBondContact OE1-N 2.84Å; S106-N108 PolarHBondContact O-N 3.3Å; S106-N108 PolarHBondContact OG-N 2.86Å; S106-F109 PolarHBondContact O-N 2.83Å; S106-F109 PolarHBondContact OG-N 3.4Å | ||
| 107 | A | 80.6 | Confident | 83.5 | Confident | 7 Ų | 7 | 39.3 Ų | 39.3 | 6% | 0.058 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -22.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L101 A105 L138 R141 A143 | L101-A107 HydrophobicContact CD2-CB 3.9Å; A105-A107 PolarHBondContact O-N 3.33Å; A107-L138 HydrophobicContact CB-CD2 4.08Å; A107-R141 HydrophobicContact CB-CB 3.98Å; A107-A143 HydrophobicContact CB-CB 4.38Å |
| 108 | N | 78.9 | Confident | 83.4 | Confident | 87 Ų | 87 | 39.3 Ų | 39.3 | 47% | 0.465 | 23% | 0.225 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -93.4 | 7.5 | -179.3 | -75 | -44.3 | 0 | 0 | 0 | 113.3 | S106 S110 S142 A143 D144 | S106-N108 PolarHBondContact O-N 3.3Å; S106-N108 PolarHBondContact OG-N 2.86Å; N108-S110 PolarHBondContact O-N 3.21Å; N108-S142 PolarHBondContact ND2-O 3.01Å; N108-S142 PolarHBondContact OD1-O 2.96Å; N108-A143 VanDerWaalsContact OD1-CA 3.31Å; N108-A143 WeakPolarHBondContact OD1-CA 3.34Å; N108-D144 PolarHBondContact OD1-N 3.28Å |
| 109 | F | 75.8 | Confident | 83.4 | Confident | 31 Ų | 31 | 35.5 Ų | 35.5 | 14% | 0.136 | 21% | 0.21 | C | C | . | . | trans | -60 | 130.8 | 178.6 | 179.1 | -101.9 | 0 | 0 | 0 | 110.9 | T83 M86 S106 K111 T116 V117 | T83-F109 HydrophobicContact CG2-CB 4.37Å; T83-F109 HydrophobicContact CG2-CD1 3.43Å; T83-F109 VanDerWaalsContact CG2-CD1 3.43Å; T83-F109 HydrophobicContact CG2-CD2 4.28Å; T83-F109 HydrophobicContact CG2-CE1 3.72Å; T83-F109 HydrophobicContact CG2-CG 3.73Å; T83-F109 HydrophobicContact CG2-CZ 4.29Å; M86-F109 HydrophobicContact CE-CD1 3.97Å; M86-F109 HydrophobicContact CE-CE1 4.21Å; M86-F109 HydrophobicContact SD-CD1 3.72Å; M86-F109 HydrophobicContact SD-CE1 3.78Å; S106-F109 PolarHBondContact O-N 2.83Å; S106-F109 PolarHBondContact OG-N 3.4Å; F109-K111 HydrophobicContact CE1-CB 4.43Å; F109-T116 WeakPolarHBondContact O-CA 3.35Å; F109-V117 HydrophobicContact CB-CG2 3.99Å; F109-V117 PolarHBondContact O-N 2.76Å | ||
| 110 | S | 71.8 | Confident | 83.3 | Confident | 48 Ų | 48 | 34 Ų | 34 | 34% | 0.336 | 20% | 0.203 | S | C | . | . | B | Isolated β-bridge | trans | -124.9 | 132.2 | 171.2 | 71 | 0 | 0 | 0 | 0 | 110.1 | N108 W115 | N108-S110 PolarHBondContact O-N 3.21Å; S110-W115 VanDerWaalsContact CA-O 3.3Å; S110-W115 WeakPolarHBondContact CA-O 3.35Å |
| 111 | K | 72.4 | Confident | 83.3 | Confident | 56 Ų | 56 | 34 Ų | 34 | 24% | 0.243 | 20% | 0.203 | C | C | . | . | trans | -66.8 | 168.4 | 170.2 | -175.5 | 176.6 | 167.8 | -172.6 | 0 | 110 | F80 F109 D113 C114 W115 | F80-K111 VanDerWaalsContact O-CD 3.26Å; F80-K111 WeakPolarHBondContact O-CD 3.47Å; F80-K111 WeakPolarHBondContact O-CE 3.25Å; F80-K111 PolarHBondContact O-NZ 3Å; F109-K111 HydrophobicContact CE1-CB 4.43Å; K111-D113 PolarHBondContact O-N 3.08Å; K111-C114 WeakPolarHBondContact O-CA 3.35Å; K111-C114 PolarHBondContact O-N 3.47Å; K111-W115 PolarHBondContact N-O 3.23Å | ||
| 112 | A | 67 | Low | 83.3 | Confident | 73 Ų | 73 | 33.6 Ų | 33.6 | 60% | 0.603 | 20% | 0.2 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -45.1 | -28.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | C114 R150 | A112-C114 VanDerWaalsContact C-N 3.28Å; A112-C114 PolarHBondContact O-N 3.47Å; A112-R150 PolarHBondContact O-NE 3.42Å; A112-R150 VanDerWaalsContact O-NE 3.16Å; A112-R150 PolarHBondContact O-NH2 3.48Å |
| 113 | D | 65.1 | Low | 83.2 | Confident | 42 Ų | 42 | 32.7 Ų | 32.7 | 23% | 0.225 | 20% | 0.197 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 13.7 | 175 | -69.7 | -57.6 | 0 | 0 | 0 | 114.1 | K111 W115 R150 R151 | K111-D113 PolarHBondContact O-N 3.08Å; D113-W115 PolarHBondContact O-N 2.91Å; D113-R150 WeakPolarHBondContact O-CB 3.03Å; D113-R150 PolarHBondContact O-N 3.21Å; D113-R151 VanDerWaalsContact CG-NE 3.35Å; D113-R151 IonicContact OD1-CZ 2.72Å; D113-R151 IonicContact OD1-NE 3.66Å; D113-R151 PolarHBondContact OD1-NE 3.32Å; D113-R151 IonicContact OD1-NH2 3.88Å; D113-R151 PolarHBondContact OD1-NH2 3.32Å; D113-R151 IonicContact OD2-CZ 3.44Å; D113-R151 IonicContact OD2-NE 3.66Å; D113-R151 IonicContact OD2-NH2 3.14Å; D113-R151 PolarHBondContact OD2-NH2 3.21Å |
| 114 | C | 78.8 | Confident | 83.3 | Confident | 30 Ų | 30 | 29 Ų | 29 | 20% | 0.203 | 19% | 0.185 | C | C | . | . | trans | 56.8 | 15.4 | -171.9 | -55.4 | 0 | 0 | 0 | 0 | 114.4 | K111 A112 T116 V148 R150 | K111-C114 WeakPolarHBondContact O-CA 3.35Å; K111-C114 PolarHBondContact O-N 3.47Å; A112-C114 VanDerWaalsContact C-N 3.28Å; A112-C114 PolarHBondContact O-N 3.47Å; C114-T116 WeakPolarHBondContact O-CG2 3.46Å; C114-T116 PolarHBondContact O-N 3.49Å; C114-V148 WeakPolarHBondContact CB-O 2.83Å; C114-R150 HydrophobicContact CB-CB 4.18Å | ||
| 115 | W | 85 | Confident | 83.1 | Confident | 60 Ų | 60 | 31.5 Ų | 31.5 | 23% | 0.227 | 19% | 0.194 | C | C | . | . | trans | -68.8 | 116.5 | 173.5 | -167.5 | -95.8 | 0 | 0 | 0 | 109.3 | M86 S110 K111 D113 M119 T123 D149 L159 | M86-W115 WeakPolarHBondContact CE-O 3.39Å; S110-W115 VanDerWaalsContact CA-O 3.3Å; S110-W115 WeakPolarHBondContact CA-O 3.35Å; K111-W115 PolarHBondContact N-O 3.23Å; D113-W115 PolarHBondContact O-N 2.91Å; W115-M119 HydrophobicContact CD2-CB 3.97Å; W115-M119 HydrophobicContact CD2-SD 4.24Å; W115-M119 HydrophobicContact CE3-CB 4.29Å; W115-M119 HydrophobicContact CE3-SD 3.94Å; W115-M119 HydrophobicContact CH2-CB 4.16Å; W115-M119 HydrophobicContact CZ2-CB 3.81Å; W115-M119 HydrophobicContact CZ3-CB 4.38Å; W115-M119 HydrophobicContact CZ3-SD 4.33Å; W115-T123 HydrophobicContact CH2-CG2 3.87Å; W115-T123 HydrophobicContact CZ2-CG2 3.73Å; W115-D149 HydrophobicContact CE3-CB 4.11Å; W115-D149 HydrophobicContact CZ3-CB 4.44Å; W115-L159 HydrophobicContact CH2-CD1 3.65Å; W115-L159 HydrophobicContact CH2-CD2 4.18Å; W115-L159 HydrophobicContact CZ2-CD1 4.31Å; W115-L159 HydrophobicContact CZ3-CD1 4.15Å | ||
| 116 | T | 89.2 | Confident | 83.1 | Confident | 7 Ų | 7 | 33.2 Ų | 33.2 | 4% | 0.043 | 21% | 0.205 | C | C | . | . | B | Isolated β-bridge | trans | -92.6 | 164 | -174.5 | 69.2 | 0 | 0 | 0 | 0 | 112.3 | F109 C114 L118 M119 A120 M147 | F109-T116 WeakPolarHBondContact O-CA 3.35Å; C114-T116 WeakPolarHBondContact O-CG2 3.46Å; C114-T116 PolarHBondContact O-N 3.49Å; T116-L118 PolarHBondContact O-N 3.3Å; T116-L118 PolarHBondContact OG1-N 2.91Å; T116-M119 HydrophobicContact CG2-CE 4.44Å; T116-M119 HydrophobicContact CG2-SD 4.45Å; T116-M119 PolarHBondContact O-N 3.23Å; T116-M119 WeakPolarHBondContact OG1-CG 3.27Å; T116-M119 PolarHBondContact OG1-N 3.08Å; T116-M119 VanDerWaalsContact OG1-N 3.11Å; T116-A120 PolarHBondContact O-N 3.21Å; T116-A120 VanDerWaalsContact O-N 3.08Å; T116-M147 HydrophobicContact CG2-CB 3.74Å; T116-M147 HydrophobicContact CG2-CG 4.13Å |
| 117 | V | 89.9 | Confident | 83.3 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -57.5 | -39.8 | 170.7 | -174 | 0 | 0 | 0 | 0 | 111.1 | L85 M86 V89 F109 A120 S121 L138 | L85-V117 HydrophobicContact CD2-CG1 3.84Å; L85-V117 HydrophobicContact CD2-CG2 4.26Å; L85-V117 HydrophobicContact CG-CG1 3.73Å; M86-V117 HydrophobicContact CG-CB 4.47Å; M86-V117 HydrophobicContact CG-CG2 3.95Å; V89-V117 HydrophobicContact CG1-CG1 4.28Å; V89-V117 HydrophobicContact CG2-CG1 3.81Å; F109-V117 HydrophobicContact CB-CG2 3.99Å; F109-V117 PolarHBondContact O-N 2.76Å; V117-A120 WeakPolarHBondContact O-CB 3.47Å; V117-A120 PolarHBondContact O-N 3.02Å; V117-S121 PolarHBondContact O-N 3.49Å; V117-L138 HydrophobicContact CB-CD2 4.46Å; V117-L138 HydrophobicContact CG1-CD1 3.91Å; V117-L138 HydrophobicContact CG1-CD2 3.65Å; V117-L138 HydrophobicContact CG1-CG 4.45Å |
| 118 | L | 92.1 | Very high | 83.7 | Confident | 1 Ų | 1 | 35.8 Ų | 35.8 | 1% | 0.005 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.9 | -42.7 | 178.3 | -168.6 | 64.8 | 0 | 0 | 0 | 111.6 | T116 A120 S121 C122 V135 L138 L139 A143 P145 C156 L172 | T116-L118 PolarHBondContact O-N 3.3Å; T116-L118 PolarHBondContact OG1-N 2.91Å; L118-A120 PolarHBondContact O-N 2.84Å; L118-S121 WeakPolarHBondContact O-CB 3.39Å; L118-S121 PolarHBondContact O-N 3.47Å; L118-S121 PolarHBondContact O-OG 3.3Å; L118-C122 PolarHBondContact O-N 3.32Å; L118-C122 VanDerWaalsContact O-N 3.11Å; L118-C122 PolarHBondContact O-SG 3.08Å; L118-V135 HydrophobicContact CD1-CB 4.49Å; L118-V135 HydrophobicContact CD1-CG1 4.14Å; L118-V135 HydrophobicContact CD1-CG2 4.42Å; L118-L138 HydrophobicContact CD1-CB 3.94Å; L118-L138 HydrophobicContact CD1-CD1 3.99Å; L118-L139 HydrophobicContact CD1-CD2 4.4Å; L118-L139 HydrophobicContact CD1-CG 4.33Å; L118-L139 HydrophobicContact CD2-CD2 3.91Å; L118-A143 HydrophobicContact CD2-CB 4.42Å; L118-P145 HydrophobicContact CD2-CB 4.19Å; L118-C156 HydrophobicContact CD2-CB 4.36Å; L118-C156 HydrophobicContact CG-CB 4.45Å; L118-L172 HydrophobicContact CD2-CD2 4.06Å |
| 119 | M | 91.6 | Very high | 84.2 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.6 | -43.5 | 173.8 | -69.8 | 172.4 | -175.8 | 0 | 0 | 112 | W115 T116 S121 C122 T123 M147 D149 M154 C156 L159 | W115-M119 HydrophobicContact CD2-CB 3.97Å; W115-M119 HydrophobicContact CD2-SD 4.24Å; W115-M119 HydrophobicContact CE3-CB 4.29Å; W115-M119 HydrophobicContact CE3-SD 3.94Å; W115-M119 HydrophobicContact CH2-CB 4.16Å; W115-M119 HydrophobicContact CZ2-CB 3.81Å; W115-M119 HydrophobicContact CZ3-CB 4.38Å; W115-M119 HydrophobicContact CZ3-SD 4.33Å; T116-M119 HydrophobicContact CG2-CE 4.44Å; T116-M119 HydrophobicContact CG2-SD 4.45Å; T116-M119 PolarHBondContact O-N 3.23Å; T116-M119 WeakPolarHBondContact OG1-CG 3.27Å; T116-M119 PolarHBondContact OG1-N 3.08Å; T116-M119 VanDerWaalsContact OG1-N 3.11Å; M119-S121 VanDerWaalsContact C-N 3.26Å; M119-S121 PolarHBondContact O-N 3.04Å; M119-C122 PolarHBondContact O-N 3.46Å; M119-T123 PolarHBondContact O-N 3.22Å; M119-T123 PolarHBondContact O-OG1 3.45Å; M119-M147 VanDerWaalsContact CE-C 3.5Å; M119-M147 HydrophobicContact CE-CB 4.29Å; M119-M147 WeakPolarHBondContact CE-O 3.3Å; M119-D149 HydrophobicContact CE-CB 4.35Å; M119-D149 HydrophobicContact SD-CB 4.05Å; M119-M154 WeakPolarHBondContact CE-O 3.19Å; M119-C156 VanDerWaalsContact CG-SG 3.53Å; M119-L159 HydrophobicContact CB-CD1 3.81Å; M119-L159 HydrophobicContact CG-CD1 3.84Å |
| 120 | A | 90.4 | Very high | 84.9 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.5 | -37.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | V89 T116 V117 L118 T123 A124 | V89-A120 HydrophobicContact CG2-CB 4.07Å; T116-A120 PolarHBondContact O-N 3.21Å; T116-A120 VanDerWaalsContact O-N 3.08Å; V117-A120 WeakPolarHBondContact O-CB 3.47Å; V117-A120 PolarHBondContact O-N 3.02Å; L118-A120 PolarHBondContact O-N 2.84Å; A120-T123 PolarHBondContact O-N 3.15Å; A120-T123 PolarHBondContact O-OG1 2.99Å; A120-A124 PolarHBondContact O-N 3.48Å |
| 121 | S | 92.4 | Very high | 85.8 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -66.2 | -41.5 | 175.8 | 79 | 0 | 0 | 0 | 0 | 112.5 | V117 L118 M119 T123 A124 I131 V135 | V117-S121 PolarHBondContact O-N 3.49Å; L118-S121 WeakPolarHBondContact O-CB 3.39Å; L118-S121 PolarHBondContact O-N 3.47Å; L118-S121 PolarHBondContact O-OG 3.3Å; M119-S121 VanDerWaalsContact C-N 3.26Å; M119-S121 PolarHBondContact O-N 3.04Å; S121-T123 PolarHBondContact O-N 2.86Å; S121-A124 VanDerWaalsContact O-CB 3.27Å; S121-A124 WeakPolarHBondContact O-CB 3.31Å; S121-A124 PolarHBondContact O-N 3.14Å; S121-I131 VanDerWaalsContact O-CG2 3.29Å; S121-I131 WeakPolarHBondContact O-CG2 3.34Å; S121-V135 VanDerWaalsContact OG-CG2 3.3Å; S121-V135 WeakPolarHBondContact OG-CG2 3.47Å |
| 122 | C | 90.7 | Very high | 86.7 | Confident | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.6 | -25.1 | 179 | -64.9 | 0 | 0 | 0 | 0 | 113 | L118 M119 L159 L165 | L118-C122 PolarHBondContact O-N 3.32Å; L118-C122 VanDerWaalsContact O-N 3.11Å; L118-C122 PolarHBondContact O-SG 3.08Å; M119-C122 PolarHBondContact O-N 3.46Å; C122-L159 HydrophobicContact CB-CB 4.15Å; C122-L165 WeakPolarHBondContact O-CD1 3.05Å |
| 123 | T | 89.5 | Confident | 87.9 | Confident | 40 Ų | 40 | 37 Ų | 37 | 25% | 0.245 | 21% | 0.206 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -92.8 | 5.5 | 177.8 | 57.3 | 0 | 0 | 0 | 0 | 114.3 | W115 M119 A120 S121 L159 | W115-T123 HydrophobicContact CH2-CG2 3.87Å; W115-T123 HydrophobicContact CZ2-CG2 3.73Å; M119-T123 PolarHBondContact O-N 3.22Å; M119-T123 PolarHBondContact O-OG1 3.45Å; A120-T123 PolarHBondContact O-N 3.15Å; A120-T123 PolarHBondContact O-OG1 2.99Å; S121-T123 PolarHBondContact O-N 2.86Å; T123-L159 HydrophobicContact CG2-CD1 4.2Å; T123-L159 HydrophobicContact CG2-CD2 4.26Å |
| 124 | A | 89.4 | Confident | 89.2 | Confident | 10 Ų | 10 | 35.1 Ų | 35.1 | 8% | 0.083 | 20% | 0.196 | C | C | . | . | trans | -66.2 | 136.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112 | V89 S90 A92 A120 S121 S126 I131 | V89-A124 WeakPolarHBondContact O-CB 3.31Å; S90-A124 WeakPolarHBondContact O-CA 3.45Å; S90-A124 WeakPolarHBondContact O-CB 3.21Å; A92-A124 HydrophobicContact CB-CB 4.25Å; A120-A124 PolarHBondContact O-N 3.48Å; S121-A124 VanDerWaalsContact O-CB 3.27Å; S121-A124 WeakPolarHBondContact O-CB 3.31Å; S121-A124 PolarHBondContact O-N 3.14Å; A124-S126 VanDerWaalsContact C-N 3.27Å; A124-S126 PolarHBondContact O-N 3.14Å; A124-I131 HydrophobicContact CB-CD1 4.37Å; A124-I131 HydrophobicContact CB-CG1 4.14Å; A124-I131 VanDerWaalsContact O-CD1 3.22Å; A124-I131 WeakPolarHBondContact O-CD1 3.08Å | ||
| 125 | S | 81.6 | Confident | 89.9 | Confident | 108 Ų | 108 | 33.7 Ų | 33.7 | 76% | 0.755 | 19% | 0.186 | S | C | * | . | S | Bend | trans | -84.8 | 64.6 | 178.8 | -61.1 | 0 | 0 | 0 | 0 | 111.3 | ||
| 126 | S | 88 | Confident | 90.2 | Very high | 46 Ų | 46 | 34.5 Ų | 34.5 | 32% | 0.322 | 19% | 0.192 | S | C | . | . | S | Bend | trans | -141.3 | 177.5 | -177.5 | -87.6 | 0 | 0 | 0 | 0 | 112.3 | A92 A124 I131 | A92-S126 VanDerWaalsContact CB-CB 3.49Å; A124-S126 VanDerWaalsContact C-N 3.27Å; A124-S126 PolarHBondContact O-N 3.14Å; S126-I131 WeakPolarHBondContact O-CD1 3.33Å |
| 127 | S | 89 | Confident | 90.3 | Very high | 60 Ų | 60 | 34.7 Ų | 34.7 | 42% | 0.42 | 19% | 0.193 | S | C | . | . | trans | -61.8 | 142.3 | 174.7 | 61.8 | 0 | 0 | 0 | 0 | 110.9 | D129 K130 I131 | S127-D129 PolarHBondContact O-N 3.32Å; S127-D129 VanDerWaalsContact O-N 3.11Å; S127-K130 PolarHBondContact O-N 3.5Å; S127-K130 WeakPolarHBondContact OG-CG 3.34Å; S127-I131 WeakPolarHBondContact O-CG1 3.21Å; S127-I131 PolarHBondContact O-N 3.18Å; S127-I131 VanDerWaalsContact O-N 3.12Å | ||
| 128 | E | 88.9 | Confident | 90.4 | Very high | 53 Ų | 53 | 34.7 Ų | 34.7 | 25% | 0.248 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -52.4 | -35.9 | 179 | -178.9 | -177.9 | -150.5 | 0 | 0 | 112.2 | I131 G132 L165 C166 K167 | E128-I131 PolarHBondContact O-N 3.29Å; E128-G132 PolarHBondContact O-N 3.05Å; E128-L165 HydrophobicContact CB-CD2 4.12Å; E128-L165 HydrophobicContact CG-CB 4.48Å; E128-L165 HydrophobicContact CG-CD2 4.07Å; E128-L165 VanDerWaalsContact OE1-CA 3.3Å; E128-L165 WeakPolarHBondContact OE1-CA 3.45Å; E128-C166 PolarHBondContact OE1-N 3.43Å; E128-K167 HydrophobicContact CG-CB 4.09Å; E128-K167 HydrophobicContact CG-CD 4.31Å; E128-K167 HydrophobicContact CG-CG 4.35Å; E128-K167 WeakPolarHBondContact OE1-CB 3.4Å; E128-K167 PolarHBondContact OE1-N 3.19Å |
| 129 | D | 89.1 | Confident | 90.2 | Very high | 81 Ų | 81 | 35.1 Ų | 35.1 | 43% | 0.433 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.5 | -47.6 | 177.1 | -65.7 | -35.2 | 0 | 0 | 0 | 112 | S127 I131 G132 H133 K167 | S127-D129 PolarHBondContact O-N 3.32Å; S127-D129 VanDerWaalsContact O-N 3.11Å; D129-I131 VanDerWaalsContact C-N 3.34Å; D129-I131 PolarHBondContact O-N 3.02Å; D129-G132 PolarHBondContact O-N 3.26Å; D129-H133 PolarHBondContact O-N 3.43Å; D129-H133 PolarHBondContact O-ND1 2.95Å; D129-K167 IonicContact OD1-NZ 3.28Å; D129-K167 PolarHBondContact OD1-NZ 2.95Å |
| 130 | K | 90.6 | Very high | 90.1 | Very high | 116 Ų | 116 | 36.8 Ų | 36.8 | 50% | 0.504 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -65 | -42.1 | 178.8 | -69.7 | -178.8 | 178.9 | -176.2 | 0 | 110.8 | A92 C94 S127 G132 H133 C134 | A92-K130 HydrophobicContact CB-CB 3.79Å; C94-K130 PolarHBondContact SG-O 3.23Å; S127-K130 PolarHBondContact O-N 3.5Å; S127-K130 WeakPolarHBondContact OG-CG 3.34Å; K130-G132 VanDerWaalsContact C-N 3.33Å; K130-G132 PolarHBondContact O-N 2.89Å; K130-H133 PolarHBondContact O-N 3.38Å; K130-C134 PolarHBondContact O-N 3.49Å; K130-C134 VanDerWaalsContact O-N 3.15Å |
| 131 | I | 91.7 | Very high | 89.8 | Confident | 3 Ų | 3 | 41.1 Ų | 41.1 | 2% | 0.015 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60 | -47.2 | 176.2 | -59.2 | 173.6 | 0 | 0 | 0 | 110.1 | A92 S121 A124 S126 S127 E128 D129 H133 C134 V135 L165 V168 | A92-I131 HydrophobicContact CB-CG1 4.28Å; S121-I131 VanDerWaalsContact O-CG2 3.29Å; S121-I131 WeakPolarHBondContact O-CG2 3.34Å; A124-I131 HydrophobicContact CB-CD1 4.37Å; A124-I131 HydrophobicContact CB-CG1 4.14Å; A124-I131 VanDerWaalsContact O-CD1 3.22Å; A124-I131 WeakPolarHBondContact O-CD1 3.08Å; S126-I131 WeakPolarHBondContact O-CD1 3.33Å; S127-I131 WeakPolarHBondContact O-CG1 3.21Å; S127-I131 PolarHBondContact O-N 3.18Å; S127-I131 VanDerWaalsContact O-N 3.12Å; E128-I131 PolarHBondContact O-N 3.29Å; D129-I131 VanDerWaalsContact C-N 3.34Å; D129-I131 PolarHBondContact O-N 3.02Å; I131-H133 PolarHBondContact O-N 3.46Å; I131-C134 PolarHBondContact O-N 2.9Å; I131-C134 VanDerWaalsContact O-N 3.15Å; I131-V135 HydrophobicContact CG2-CG2 4.11Å; I131-V135 WeakPolarHBondContact O-CB 3.45Å; I131-V135 VanDerWaalsContact O-CG2 3.32Å; I131-V135 WeakPolarHBondContact O-CG2 3.44Å; I131-V135 PolarHBondContact O-N 3.23Å; I131-L165 HydrophobicContact CD1-CD1 4.15Å; I131-L165 HydrophobicContact CD1-CD2 4.22Å; I131-L165 HydrophobicContact CG2-CD1 4.17Å; I131-V168 HydrophobicContact CB-CG2 4.46Å; I131-V168 HydrophobicContact CG2-CG2 3.87Å |
| 132 | G | 89.8 | Confident | 89.2 | Confident | 7 Ų | 7 | 45.7 Ų | 45.7 | 7% | 0.072 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -56.9 | -46.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113 | E128 D129 K130 C134 V135 E136 | E128-G132 PolarHBondContact O-N 3.05Å; D129-G132 PolarHBondContact O-N 3.26Å; K130-G132 VanDerWaalsContact C-N 3.33Å; K130-G132 PolarHBondContact O-N 2.89Å; G132-C134 VanDerWaalsContact C-N 3.31Å; G132-C134 PolarHBondContact O-N 3.05Å; G132-V135 PolarHBondContact O-N 2.95Å; G132-E136 VanDerWaalsContact O-CB 3.3Å; G132-E136 WeakPolarHBondContact O-CB 3.44Å; G132-E136 PolarHBondContact O-N 2.9Å |
| 133 | H | 92.5 | Very high | 89 | Confident | 114 Ų | 114 | 46 Ų | 46 | 53% | 0.528 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.3 | -38.6 | 176.7 | -73.7 | 89.3 | 0 | 0 | 0 | 112.4 | C94 D129 K130 I131 L137 | C94-H133 HydrophobicContact CB-CB 4.46Å; D129-H133 PolarHBondContact O-N 3.43Å; D129-H133 PolarHBondContact O-ND1 2.95Å; K130-H133 PolarHBondContact O-N 3.38Å; I131-H133 PolarHBondContact O-N 3.46Å; H133-L137 VanDerWaalsContact O-CB 3.28Å; H133-L137 WeakPolarHBondContact O-CB 3.24Å; H133-L137 PolarHBondContact O-N 3.15Å |
| 134 | C | 92.5 | Very high | 88.8 | Confident | 1 Ų | 1 | 47.4 Ų | 47.4 | 1% | 0.007 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -71.8 | -40.8 | 178.7 | -77.7 | 0 | 0 | 0 | 0 | 111.1 | C94 K130 I131 G132 L137 L138 | C94-C134 WeakPolarHBondContact CA-SG 3.3Å; C94-C134 HydrophobicContact CB-CB 4.4Å; C94-C134 WeakPolarHBondContact CB-SG 3.3Å; C94-C134 PolarHBondContact N-SG 2.95Å; C94-C134 VanDerWaalsContact N-SG 3.41Å; C94-C134 VanDerWaalsContact SG-CA 3.5Å; C94-C134 WeakPolarHBondContact SG-CB 3.17Å; C94-C134 PolarHBondContact SG-N 2.84Å; C94-C134 CovalentContact SG-SG 2.07Å; C94-C134 PolarHBondContact SG-SG 3.25Å; K130-C134 PolarHBondContact O-N 3.49Å; K130-C134 VanDerWaalsContact O-N 3.15Å; I131-C134 PolarHBondContact O-N 2.9Å; I131-C134 VanDerWaalsContact O-N 3.15Å; G132-C134 VanDerWaalsContact C-N 3.31Å; G132-C134 PolarHBondContact O-N 3.05Å; C134-L137 PolarHBondContact O-N 3.4Å; C134-L138 VanDerWaalsContact O-CG 3.28Å; C134-L138 WeakPolarHBondContact O-CG 3.45Å; C134-L138 PolarHBondContact O-N 3.2Å |
| 135 | V | 93.2 | Very high | 88.8 | Confident | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.7 | -49 | 173.2 | 166.9 | 0 | 0 | 0 | 0 | 110.6 | L118 S121 I131 G132 L137 L138 L139 V168 L171 L172 | L118-V135 HydrophobicContact CD1-CB 4.49Å; L118-V135 HydrophobicContact CD1-CG1 4.14Å; L118-V135 HydrophobicContact CD1-CG2 4.42Å; S121-V135 VanDerWaalsContact OG-CG2 3.3Å; S121-V135 WeakPolarHBondContact OG-CG2 3.47Å; I131-V135 HydrophobicContact CG2-CG2 4.11Å; I131-V135 WeakPolarHBondContact O-CB 3.45Å; I131-V135 VanDerWaalsContact O-CG2 3.32Å; I131-V135 WeakPolarHBondContact O-CG2 3.44Å; I131-V135 PolarHBondContact O-N 3.23Å; G132-V135 PolarHBondContact O-N 2.95Å; V135-L137 VanDerWaalsContact C-N 3.31Å; V135-L137 PolarHBondContact O-N 3.25Å; V135-L138 PolarHBondContact O-N 3.37Å; V135-L139 HydrophobicContact CG1-CD1 3.63Å; V135-L139 HydrophobicContact CG1-CG 4.24Å; V135-L139 WeakPolarHBondContact O-CB 3.27Å; V135-L139 VanDerWaalsContact O-CG 3.27Å; V135-L139 WeakPolarHBondContact O-CG 3.4Å; V135-L139 PolarHBondContact O-N 3.17Å; V135-V168 HydrophobicContact CG1-CG1 4.28Å; V135-V168 HydrophobicContact CG2-CG1 4.02Å; V135-L171 HydrophobicContact CG1-CB 4.46Å; V135-L172 HydrophobicContact CG1-CD2 4.25Å |
| 136 | E | 91.8 | Very high | 89.2 | Confident | 77 Ų | 77 | 44.4 Ų | 44.4 | 36% | 0.36 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60 | -41.2 | 177.7 | -175.9 | -176.8 | -165.9 | 0 | 0 | 111.9 | G132 S140 L171 | G132-E136 VanDerWaalsContact O-CB 3.3Å; G132-E136 WeakPolarHBondContact O-CB 3.44Å; G132-E136 PolarHBondContact O-N 2.9Å; E136-S140 WeakPolarHBondContact O-CB 3.45Å; E136-S140 PolarHBondContact O-N 3.01Å; E136-L171 HydrophobicContact CB-CD1 4.37Å |
| 137 | L | 91.4 | Very high | 89.2 | Confident | 12 Ų | 12 | 45.4 Ų | 45.4 | 6% | 0.063 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.8 | -46 | 175.3 | 178.2 | 64 | 0 | 0 | 0 | 111.4 | A97 R98 L101 H133 C134 V135 S140 R141 | A97-L137 HydrophobicContact CB-CD2 4.2Å; R98-L137 HydrophobicContact CB-CD2 3.88Å; R98-L137 HydrophobicContact CG-CD1 4.46Å; R98-L137 HydrophobicContact CG-CD2 4.45Å; L101-L137 HydrophobicContact CD1-CD1 4.32Å; L101-L137 HydrophobicContact CD1-CD2 3.84Å; L101-L137 HydrophobicContact CD1-CG 3.72Å; H133-L137 VanDerWaalsContact O-CB 3.28Å; H133-L137 WeakPolarHBondContact O-CB 3.24Å; H133-L137 PolarHBondContact O-N 3.15Å; C134-L137 PolarHBondContact O-N 3.4Å; V135-L137 VanDerWaalsContact C-N 3.31Å; V135-L137 PolarHBondContact O-N 3.25Å; L137-S140 PolarHBondContact O-N 3.38Å; L137-S140 PolarHBondContact O-OG 3.42Å; L137-R141 PolarHBondContact O-N 2.99Å |
| 138 | L | 91.2 | Very high | 89.2 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -65.2 | -46.2 | 178.7 | -69.4 | 170.9 | 0 | 0 | 0 | 111.8 | L85 V89 L101 A107 V117 L118 C134 V135 S140 R141 A143 | L85-L138 HydrophobicContact CD2-CD2 4.32Å; V89-L138 HydrophobicContact CG1-CD1 4.15Å; L101-L138 HydrophobicContact CD1-CD2 4.26Å; A107-L138 HydrophobicContact CB-CD2 4.08Å; V117-L138 HydrophobicContact CB-CD2 4.46Å; V117-L138 HydrophobicContact CG1-CD1 3.91Å; V117-L138 HydrophobicContact CG1-CD2 3.65Å; V117-L138 HydrophobicContact CG1-CG 4.45Å; L118-L138 HydrophobicContact CD1-CB 3.94Å; L118-L138 HydrophobicContact CD1-CD1 3.99Å; C134-L138 VanDerWaalsContact O-CG 3.28Å; C134-L138 WeakPolarHBondContact O-CG 3.45Å; C134-L138 PolarHBondContact O-N 3.2Å; V135-L138 PolarHBondContact O-N 3.37Å; L138-S140 PolarHBondContact O-N 3.35Å; L138-R141 CarbonylContact O-C 3.53Å; L138-R141 WeakPolarHBondContact O-CA 3.22Å; L138-R141 PolarHBondContact O-N 3.13Å; L138-A143 HydrophobicContact CB-CB 4.08Å; L138-A143 WeakPolarHBondContact O-CB 3.29Å; L138-A143 PolarHBondContact O-N 2.89Å |
| 139 | L | 88.4 | Confident | 89.1 | Confident | 10 Ų | 10 | 42.2 Ų | 42.2 | 5% | 0.052 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.2 | -37.2 | 177 | -69 | 170.2 | 0 | 0 | 0 | 111.4 | L118 V135 R141 S142 P145 L171 L172 H175 | L118-L139 HydrophobicContact CD1-CD2 4.4Å; L118-L139 HydrophobicContact CD1-CG 4.33Å; L118-L139 HydrophobicContact CD2-CD2 3.91Å; V135-L139 HydrophobicContact CG1-CD1 3.63Å; V135-L139 HydrophobicContact CG1-CG 4.24Å; V135-L139 WeakPolarHBondContact O-CB 3.27Å; V135-L139 VanDerWaalsContact O-CG 3.27Å; V135-L139 WeakPolarHBondContact O-CG 3.4Å; V135-L139 PolarHBondContact O-N 3.17Å; L139-R141 PolarHBondContact O-N 3.32Å; L139-S142 PolarHBondContact O-N 3.37Å; L139-P145 HydrophobicContact CD2-CB 4.11Å; L139-P145 HydrophobicContact CD2-CG 4.4Å; L139-L171 HydrophobicContact CD1-CB 4.47Å; L139-L172 HydrophobicContact CD1-CD2 4.32Å; L139-L172 HydrophobicContact CD2-CD2 4.42Å; L139-H175 HydrophobicContact CD1-CB 4.01Å; L139-H175 HydrophobicContact CD2-CB 4.06Å; L139-H175 HydrophobicContact CG-CB 4.43Å |
| 140 | S | 89.1 | Confident | 89 | Confident | 34 Ų | 34 | 45.8 Ų | 45.8 | 24% | 0.238 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.7 | -19.3 | 175 | 78.4 | 0 | 0 | 0 | 0 | 115.4 | E136 L137 L138 S142 R385 | E136-S140 WeakPolarHBondContact O-CB 3.45Å; E136-S140 PolarHBondContact O-N 3.01Å; L137-S140 PolarHBondContact O-N 3.38Å; L137-S140 PolarHBondContact O-OG 3.42Å; L138-S140 PolarHBondContact O-N 3.35Å; S140-S142 VanDerWaalsContact C-N 3.25Å; S140-R385 VanDerWaalsContact CB-NH2 3.32Å; S140-R385 PolarHBondContact OG-NH1 3.34Å |
| 141 | R | 84.6 | Confident | 88.6 | Confident | 92 Ų | 92 | 49.1 Ų | 49.1 | 35% | 0.347 | 24% | 0.237 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -96.5 | 27.9 | 172.3 | -60.4 | -60.1 | -178.3 | 96.6 | 1.7 | 111.2 | L101 D102 A107 L137 L138 L139 A143 | L101-R141 HydrophobicContact CD1-CG 4.21Å; L101-R141 HydrophobicContact CD2-CG 4.4Å; L101-R141 PolarHBondContact O-NH1 3.38Å; D102-R141 IonicContact OD1-CZ 3.54Å; D102-R141 IonicContact OD1-NH1 2.6Å; D102-R141 IonicContact OD1-NH2 3.23Å; D102-R141 PolarHBondContact OD1-NH2 3.33Å; A107-R141 HydrophobicContact CB-CB 3.98Å; L137-R141 PolarHBondContact O-N 2.99Å; L138-R141 CarbonylContact O-C 3.53Å; L138-R141 WeakPolarHBondContact O-CA 3.22Å; L138-R141 PolarHBondContact O-N 3.13Å; L139-R141 PolarHBondContact O-N 3.32Å; R141-A143 VanDerWaalsContact C-N 3.31Å; R141-A143 PolarHBondContact O-N 3.48Å |
| 142 | S | 81 | Confident | 88.4 | Confident | 95 Ų | 95 | 50.8 Ų | 50.8 | 66% | 0.664 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 58.9 | 38.2 | 176.9 | -52.9 | 0 | 0 | 0 | 0 | 113.4 | N108 L139 S140 | N108-S142 PolarHBondContact ND2-O 3.01Å; N108-S142 PolarHBondContact OD1-O 2.96Å; L139-S142 PolarHBondContact O-N 3.37Å; S140-S142 VanDerWaalsContact C-N 3.25Å |
| 143 | A | 86 | Confident | 88.4 | Confident | 6 Ų | 6 | 54.1 Ų | 54.1 | 5% | 0.05 | 26% | 0.262 | C | S | . | . | trans | -69.8 | 126.7 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110 | A107 N108 L118 L138 R141 P145 | A107-A143 HydrophobicContact CB-CB 4.38Å; N108-A143 VanDerWaalsContact OD1-CA 3.31Å; N108-A143 WeakPolarHBondContact OD1-CA 3.34Å; L118-A143 HydrophobicContact CD2-CB 4.42Å; L138-A143 HydrophobicContact CB-CB 4.08Å; L138-A143 WeakPolarHBondContact O-CB 3.29Å; L138-A143 PolarHBondContact O-N 2.89Å; R141-A143 VanDerWaalsContact C-N 3.31Å; R141-A143 PolarHBondContact O-N 3.48Å; A143-P145 WeakPolarHBondContact O-CD 3.27Å | ||
| 144 | D | 85.6 | Confident | 88.4 | Confident | 70 Ų | 70 | 50 Ų | 50 | 37% | 0.374 | 24% | 0.244 | S | C | . | . | trans | -75.7 | 116.6 | 179.2 | -178 | -1.6 | 0 | 0 | 0 | 111.4 | N108 N146 M147 | N108-D144 PolarHBondContact OD1-N 3.28Å; D144-N146 VanDerWaalsContact C-N 3.29Å; D144-N146 PolarHBondContact O-N 2.9Å; D144-N146 WeakPolarHBondContact OD1-CB 3.33Å; D144-N146 PolarHBondContact OD1-N 3.13Å; D144-M147 HydrophobicContact CB-CG 3.87Å | ||
| 145 | P | 89.3 | Confident | 88.5 | Confident | 9 Ų | 9 | 50.1 Ų | 50.1 | 6% | 0.058 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.1 | -14.6 | 179.2 | 32.3 | -35.8 | 0 | 0 | 0 | 114.4 | L118 L139 A143 L172 A177 | L118-P145 HydrophobicContact CD2-CB 4.19Å; L139-P145 HydrophobicContact CD2-CB 4.11Å; L139-P145 HydrophobicContact CD2-CG 4.4Å; A143-P145 WeakPolarHBondContact O-CD 3.27Å; P145-L172 HydrophobicContact CB-CD2 3.98Å; P145-A177 HydrophobicContact CB-CB 4.03Å; P145-A177 HydrophobicContact CG-CB 4.36Å |
| 146 | N | 88.8 | Confident | 88.4 | Confident | 47 Ų | 47 | 50.1 Ų | 50.1 | 25% | 0.251 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92.6 | -0.1 | -175.1 | -65.3 | -49.1 | 0 | 0 | 0 | 113.5 | D144 V148 G176 A177 E178 | D144-N146 VanDerWaalsContact C-N 3.29Å; D144-N146 PolarHBondContact O-N 2.9Å; D144-N146 WeakPolarHBondContact OD1-CB 3.33Å; D144-N146 PolarHBondContact OD1-N 3.13Å; N146-V148 PolarHBondContact O-N 2.78Å; N146-G176 PolarHBondContact ND2-O 3.35Å; N146-A177 WeakPolarHBondContact OD1-CA 2.93Å; N146-E178 PolarHBondContact OD1-N 3.2Å |
| 147 | M | 88.4 | Confident | 88.7 | Confident | 66 Ų | 66 | 46.5 Ų | 46.5 | 33% | 0.325 | 23% | 0.228 | S | C | . | . | trans | -58.8 | 140.6 | 173.4 | -69 | -61.6 | -64.5 | 0 | 0 | 111.1 | T116 M119 D144 | T116-M147 HydrophobicContact CG2-CB 3.74Å; T116-M147 HydrophobicContact CG2-CG 4.13Å; M119-M147 VanDerWaalsContact CE-C 3.5Å; M119-M147 HydrophobicContact CE-CB 4.29Å; M119-M147 WeakPolarHBondContact CE-O 3.3Å; D144-M147 HydrophobicContact CB-CG 3.87Å | ||
| 148 | V | 88.8 | Confident | 88.9 | Confident | 40 Ų | 40 | 46 Ų | 46 | 24% | 0.242 | 23% | 0.225 | C | C | . | . | B | Isolated β-bridge | trans | -115.4 | 140.8 | 179 | -69.3 | 0 | 0 | 0 | 0 | 110.7 | C114 N146 M154 T155 | C114-V148 WeakPolarHBondContact CB-O 2.83Å; N146-V148 PolarHBondContact O-N 2.78Å; V148-M154 WeakPolarHBondContact CA-O 3.31Å; V148-T155 HydrophobicContact CG1-CG2 3.67Å |
| 149 | D | 87.1 | Confident | 89 | Confident | 7 Ų | 7 | 46.1 Ų | 46.1 | 4% | 0.037 | 23% | 0.226 | C | C | . | . | trans | -70.4 | 147.9 | 175 | 92.6 | -86.4 | 0 | 0 | 0 | 110.4 | W115 M119 R151 S152 Q153 M154 | W115-D149 HydrophobicContact CE3-CB 4.11Å; W115-D149 HydrophobicContact CZ3-CB 4.44Å; M119-D149 HydrophobicContact CE-CB 4.35Å; M119-D149 HydrophobicContact SD-CB 4.05Å; D149-R151 VanDerWaalsContact C-N 3.32Å; D149-R151 PolarHBondContact O-N 3.43Å; D149-R151 WeakPolarHBondContact OD2-CA 3.42Å; D149-R151 WeakPolarHBondContact OD2-CB 3.35Å; D149-R151 PolarHBondContact OD2-N 2.94Å; D149-S152 WeakPolarHBondContact OD1-CB 3.36Å; D149-S152 PolarHBondContact OD1-N 3.06Å; D149-S152 PolarHBondContact OD1-OG 3.43Å; D149-S152 PolarHBondContact OD2-N 3.21Å; D149-S152 PolarHBondContact OD2-OG 3.08Å; D149-Q153 WeakPolarHBondContact O-CA 3.37Å; D149-Q153 PolarHBondContact O-N 3.18Å; D149-Q153 PolarHBondContact O-NE2 2.96Å; D149-Q153 PolarHBondContact OD1-N 3.23Å; D149-M154 PolarHBondContact N-O 3.32Å; D149-M154 VanDerWaalsContact N-O 3.07Å; D149-M154 WeakPolarHBondContact OD1-CB 3.41Å; D149-M154 PolarHBondContact OD1-N 3Å | ||
| 150 | R | 86.6 | Confident | 89.3 | Confident | 156 Ų | 156 | 45.6 Ų | 45.6 | 59% | 0.589 | 22% | 0.223 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -67.4 | -32.4 | -175.1 | -174.1 | 179 | -67.2 | -155.7 | 0 | 112.9 | A112 D113 C114 | A112-R150 PolarHBondContact O-NE 3.42Å; A112-R150 VanDerWaalsContact O-NE 3.16Å; A112-R150 PolarHBondContact O-NH2 3.48Å; D113-R150 WeakPolarHBondContact O-CB 3.03Å; D113-R150 PolarHBondContact O-N 3.21Å; C114-R150 HydrophobicContact CB-CB 4.18Å |
| 151 | R | 83.8 | Confident | 89.7 | Confident | 185 Ų | 185 | 44 Ų | 44 | 70% | 0.698 | 21% | 0.212 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | -52.9 | -169.4 | -60.6 | -174.4 | -175.2 | -177.6 | 3.6 | 111.4 | D113 D149 | D113-R151 VanDerWaalsContact CG-NE 3.35Å; D113-R151 IonicContact OD1-CZ 2.72Å; D113-R151 IonicContact OD1-NE 3.66Å; D113-R151 PolarHBondContact OD1-NE 3.32Å; D113-R151 IonicContact OD1-NH2 3.88Å; D113-R151 PolarHBondContact OD1-NH2 3.32Å; D113-R151 IonicContact OD2-CZ 3.44Å; D113-R151 IonicContact OD2-NE 3.66Å; D113-R151 IonicContact OD2-NH2 3.14Å; D113-R151 PolarHBondContact OD2-NH2 3.21Å; D149-R151 VanDerWaalsContact C-N 3.32Å; D149-R151 PolarHBondContact O-N 3.43Å; D149-R151 WeakPolarHBondContact OD2-CA 3.42Å; D149-R151 WeakPolarHBondContact OD2-CB 3.35Å; D149-R151 PolarHBondContact OD2-N 2.94Å |
| 152 | S | 86.1 | Confident | 90.2 | Very high | 38 Ų | 38 | 42.5 Ų | 42.5 | 27% | 0.266 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -103.3 | -12 | -176.9 | 41.5 | 0 | 0 | 0 | 0 | 114.3 | D149 M154 D183 S184 | D149-S152 WeakPolarHBondContact OD1-CB 3.36Å; D149-S152 PolarHBondContact OD1-N 3.06Å; D149-S152 PolarHBondContact OD1-OG 3.43Å; D149-S152 PolarHBondContact OD2-N 3.21Å; D149-S152 PolarHBondContact OD2-OG 3.08Å; S152-M154 PolarHBondContact O-N 3.45Å; S152-M154 WeakPolarHBondContact OG-CG 3.42Å; S152-D183 WeakPolarHBondContact O-CB 2.99Å; S152-S184 WeakPolarHBondContact O-CB 3.48Å; S152-S184 PolarHBondContact O-N 3.46Å; S152-S184 PolarHBondContact O-OG 3.45Å |
| 153 | Q | 91 | Very high | 90.7 | Very high | 77 Ų | 77 | 40.8 Ų | 40.8 | 36% | 0.36 | 19% | 0.19 | S | C | . | . | trans | 58.9 | 30.4 | -171.4 | -57.2 | -73.3 | -70.9 | 0 | 0 | 112.7 | D149 D183 | D149-Q153 WeakPolarHBondContact O-CA 3.37Å; D149-Q153 PolarHBondContact O-N 3.18Å; D149-Q153 PolarHBondContact O-NE2 2.96Å; D149-Q153 PolarHBondContact OD1-N 3.23Å; Q153-D183 WeakPolarHBondContact O-CA 3.36Å | ||
| 154 | M | 92.3 | Very high | 90.9 | Very high | 28 Ų | 28 | 41.6 Ų | 41.6 | 14% | 0.138 | 20% | 0.198 | C | C | . | . | trans | -78.5 | 138.3 | 174.9 | -69.2 | -172.1 | 77.1 | 0 | 0 | 110.6 | M119 V148 D149 S152 M158 L159 D183 T192 | M119-M154 WeakPolarHBondContact CE-O 3.19Å; V148-M154 WeakPolarHBondContact CA-O 3.31Å; D149-M154 PolarHBondContact N-O 3.32Å; D149-M154 VanDerWaalsContact N-O 3.07Å; D149-M154 WeakPolarHBondContact OD1-CB 3.41Å; D149-M154 PolarHBondContact OD1-N 3Å; S152-M154 PolarHBondContact O-N 3.45Å; S152-M154 WeakPolarHBondContact OG-CG 3.42Å; M154-M158 HydrophobicContact CB-SD 4.24Å; M154-M158 HydrophobicContact CE-CB 3.75Å; M154-M158 HydrophobicContact CG-SD 4.33Å; M154-L159 HydrophobicContact CE-CD2 3.96Å; M154-L159 HydrophobicContact SD-CD2 4.25Å; M154-D183 HydrophobicContact CG-CB 4.3Å; M154-T192 HydrophobicContact CE-CG2 4.34Å | ||
| 155 | T | 93.4 | Very high | 91.2 | Very high | 4 Ų | 4 | 39.2 Ų | 39.2 | 3% | 0.025 | 19% | 0.186 | C | C | . | . | B | Isolated β-bridge | trans | -89.7 | 164.2 | 171.5 | 64 | 0 | 0 | 0 | 0 | 111.3 | V148 L157 M158 L159 V181 | V148-T155 HydrophobicContact CG1-CG2 3.67Å; T155-L157 PolarHBondContact O-N 3.01Å; T155-M158 HydrophobicContact CG2-CE 4.36Å; T155-M158 PolarHBondContact O-N 3.49Å; T155-M158 VanDerWaalsContact O-N 3.11Å; T155-M158 WeakPolarHBondContact OG1-CG 3.18Å; T155-M158 PolarHBondContact OG1-N 3.5Å; T155-L159 PolarHBondContact O-N 3.42Å; T155-L159 VanDerWaalsContact O-N 3.15Å; T155-V181 HydrophobicContact CG2-CB 4.05Å; T155-V181 HydrophobicContact CG2-CG1 3.72Å; T155-V181 HydrophobicContact CG2-CG2 4.48Å |
| 156 | C | 93.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -54.4 | -37.3 | 170.4 | -64.3 | 0 | 0 | 0 | 0 | 112 | L118 M119 M158 L159 A160 L172 | L118-C156 HydrophobicContact CD2-CB 4.36Å; L118-C156 HydrophobicContact CG-CB 4.45Å; M119-C156 VanDerWaalsContact CG-SG 3.53Å; C156-M158 PolarHBondContact O-N 3.11Å; C156-L159 PolarHBondContact O-N 3.26Å; C156-A160 WeakPolarHBondContact O-CB 3.26Å; C156-A160 PolarHBondContact O-N 3.48Å; C156-L172 HydrophobicContact CB-CD1 4.03Å; C156-L172 HydrophobicContact CB-CD2 4.07Å |
| 157 | L | 96.1 | Very high | 91.4 | Very high | 1 Ų | 1 | 42.8 Ų | 42.8 | 1% | 0.005 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -64.8 | -39.3 | 178.5 | -170.6 | 67.1 | 0 | 0 | 0 | 112 | T155 A160 A161 I169 L172 V173 I179 A189 L205 | T155-L157 PolarHBondContact O-N 3.01Å; L157-A160 PolarHBondContact O-N 3.42Å; L157-A161 WeakPolarHBondContact O-CB 3.45Å; L157-A161 PolarHBondContact O-N 3.31Å; L157-I169 HydrophobicContact CD1-CB 4.31Å; L157-I169 HydrophobicContact CD1-CG1 4.25Å; L157-I169 HydrophobicContact CD1-CG2 4.04Å; L157-L172 HydrophobicContact CB-CD1 4.5Å; L157-L172 HydrophobicContact CD1-CB 4.21Å; L157-L172 HydrophobicContact CD1-CD1 4.32Å; L157-V173 HydrophobicContact CD1-CG2 3.92Å; L157-V173 HydrophobicContact CD2-CG2 4.26Å; L157-I179 HydrophobicContact CD2-CB 4.39Å; L157-I179 HydrophobicContact CD2-CG1 4.33Å; L157-A189 HydrophobicContact CB-CB 4.46Å; L157-A189 HydrophobicContact CD2-CB 3.89Å; L157-A189 HydrophobicContact CG-CB 3.77Å; L157-L205 HydrophobicContact CD1-CD2 4.37Å; L157-L205 HydrophobicContact CD2-CD2 4.4Å; L157-L205 HydrophobicContact CG-CD2 4.44Å |
| 158 | M | 96 | Very high | 91.6 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -66.7 | -38.5 | 175.1 | -66.2 | 168.9 | -172.1 | 0 | 0 | 112.2 | M154 T155 C156 A161 R162 V181 D183 Y187 A189 | M154-M158 HydrophobicContact CB-SD 4.24Å; M154-M158 HydrophobicContact CE-CB 3.75Å; M154-M158 HydrophobicContact CG-SD 4.33Å; T155-M158 HydrophobicContact CG2-CE 4.36Å; T155-M158 PolarHBondContact O-N 3.49Å; T155-M158 VanDerWaalsContact O-N 3.11Å; T155-M158 WeakPolarHBondContact OG1-CG 3.18Å; T155-M158 PolarHBondContact OG1-N 3.5Å; C156-M158 PolarHBondContact O-N 3.11Å; M158-A161 PolarHBondContact O-N 3.04Å; M158-R162 WeakPolarHBondContact O-CB 3.28Å; M158-R162 PolarHBondContact O-N 2.6Å; M158-V181 HydrophobicContact CE-CB 4.21Å; M158-V181 HydrophobicContact CE-CG1 4.16Å; M158-V181 WeakPolarHBondContact CE-O 3.36Å; M158-D183 HydrophobicContact CE-CB 4.21Å; M158-D183 HydrophobicContact SD-CB 3.85Å; M158-Y187 VanDerWaalsContact CE-O 3.28Å; M158-Y187 WeakPolarHBondContact CE-O 3.41Å; M158-A189 HydrophobicContact CG-CB 4.22Å |
| 159 | L | 94.5 | Very high | 91.8 | Very high | 3 Ų | 3 | 37.8 Ų | 37.8 | 2% | 0.016 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.8 | -45.7 | 175.2 | -64.3 | 172.1 | 0 | 0 | 0 | 111.1 | W115 M119 C122 T123 M154 T155 C156 A161 R162 D163 | W115-L159 HydrophobicContact CH2-CD1 3.65Å; W115-L159 HydrophobicContact CH2-CD2 4.18Å; W115-L159 HydrophobicContact CZ2-CD1 4.31Å; W115-L159 HydrophobicContact CZ3-CD1 4.15Å; M119-L159 HydrophobicContact CB-CD1 3.81Å; M119-L159 HydrophobicContact CG-CD1 3.84Å; C122-L159 HydrophobicContact CB-CB 4.15Å; T123-L159 HydrophobicContact CG2-CD1 4.2Å; T123-L159 HydrophobicContact CG2-CD2 4.26Å; M154-L159 HydrophobicContact CE-CD2 3.96Å; M154-L159 HydrophobicContact SD-CD2 4.25Å; T155-L159 PolarHBondContact O-N 3.42Å; T155-L159 VanDerWaalsContact O-N 3.15Å; C156-L159 PolarHBondContact O-N 3.26Å; L159-A161 VanDerWaalsContact C-N 3.31Å; L159-A161 PolarHBondContact O-N 3.27Å; L159-R162 WeakPolarHBondContact O-CB 3.49Å; L159-R162 PolarHBondContact O-N 3.44Å; L159-D163 PolarHBondContact O-N 3.39Å |
| 160 | A | 95.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62 | -39.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | C156 L157 D163 G164 L165 V168 I169 L172 | C156-A160 WeakPolarHBondContact O-CB 3.26Å; C156-A160 PolarHBondContact O-N 3.48Å; L157-A160 PolarHBondContact O-N 3.42Å; A160-D163 PolarHBondContact O-N 3.22Å; A160-G164 PolarHBondContact O-N 2.78Å; A160-L165 HydrophobicContact CB-CB 4.35Å; A160-L165 PolarHBondContact O-N 3.07Å; A160-V168 HydrophobicContact CB-CB 4.27Å; A160-V168 HydrophobicContact CB-CG1 3.78Å; A160-I169 HydrophobicContact CB-CG1 3.92Å; A160-L172 HydrophobicContact CB-CD1 4.04Å |
| 161 | A | 95.9 | Very high | 92 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -66.1 | -39.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | L157 M158 L159 D163 G164 I169 A189 A193 L205 | L157-A161 WeakPolarHBondContact O-CB 3.45Å; L157-A161 PolarHBondContact O-N 3.31Å; M158-A161 PolarHBondContact O-N 3.04Å; L159-A161 VanDerWaalsContact C-N 3.31Å; L159-A161 PolarHBondContact O-N 3.27Å; A161-D163 VanDerWaalsContact C-N 3.31Å; A161-D163 PolarHBondContact O-N 2.97Å; A161-G164 PolarHBondContact O-N 3.44Å; A161-I169 HydrophobicContact CB-CD1 4.44Å; A161-A189 HydrophobicContact CB-CB 4.11Å; A161-A189 VanDerWaalsContact CB-O 3.28Å; A161-A189 WeakPolarHBondContact CB-O 3.3Å; A161-A193 HydrophobicContact CB-CB 4.15Å; A161-L205 HydrophobicContact CB-CD1 3.93Å |
| 162 | R | 95 | Very high | 92.3 | Very high | 61 Ų | 61 | 25.9 Ų | 25.9 | 23% | 0.23 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -57.6 | -44.7 | 174.6 | -176.3 | -170.9 | 71 | -171.3 | -4.5 | 111.6 | M158 L159 T192 Y196 K198 | M158-R162 WeakPolarHBondContact O-CB 3.28Å; M158-R162 PolarHBondContact O-N 2.6Å; L159-R162 WeakPolarHBondContact O-CB 3.49Å; L159-R162 PolarHBondContact O-N 3.44Å; R162-T192 HydrophobicContact CB-CG2 3.78Å; R162-T192 HydrophobicContact CG-CG2 4.4Å; R162-Y196 HydrophobicContact CB-CD2 4.35Å; R162-Y196 HydrophobicContact CB-CE2 4.47Å; R162-Y196 HydrophobicContact CG-CD1 3.77Å; R162-Y196 HydrophobicContact CG-CD2 3.66Å; R162-Y196 HydrophobicContact CG-CE1 3.67Å; R162-Y196 HydrophobicContact CG-CE2 3.57Å; R162-Y196 HydrophobicContact CG-CG 3.75Å; R162-K198 WeakPolarHBondContact O-CE 3.11Å; R162-K198 WeakPolarHBondContact O-CG 3.38Å |
| 163 | D | 91.6 | Very high | 92.4 | Very high | 59 Ų | 59 | 25.5 Ų | 25.5 | 32% | 0.316 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -88.6 | -17.6 | -173.5 | -62.7 | -20.4 | 0 | 0 | 0 | 111.8 | L159 A160 A161 L165 K198 | L159-D163 PolarHBondContact O-N 3.39Å; A160-D163 PolarHBondContact O-N 3.22Å; A161-D163 VanDerWaalsContact C-N 3.31Å; A161-D163 PolarHBondContact O-N 2.97Å; D163-L165 HydrophobicContact CB-CD1 4.37Å; D163-L165 HydrophobicContact CB-CG 4.14Å; D163-K198 WeakPolarHBondContact O-CE 3.34Å; D163-K198 PolarHBondContact O-NZ 2.83Å |
| 164 | G | 90.6 | Very high | 92.3 | Very high | 23 Ų | 23 | 24.9 Ų | 24.9 | 24% | 0.237 | 14% | 0.136 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 91.9 | 22.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114 | A160 A161 C166 | A160-G164 PolarHBondContact O-N 2.78Å; A161-G164 PolarHBondContact O-N 3.44Å; G164-C166 PolarHBondContact O-N 3.4Å; G164-C166 PolarHBondContact O-SG 3.45Å |
| 165 | L | 92.8 | Very high | 91.9 | Very high | 20 Ų | 20 | 26.4 Ų | 26.4 | 11% | 0.105 | 14% | 0.143 | C | C | . | . | trans | -79 | 78 | -172.9 | -55.6 | 175.6 | 0 | 0 | 0 | 111.1 | C122 E128 I131 A160 D163 K167 V168 I169 | C122-L165 WeakPolarHBondContact O-CD1 3.05Å; E128-L165 HydrophobicContact CB-CD2 4.12Å; E128-L165 HydrophobicContact CG-CB 4.48Å; E128-L165 HydrophobicContact CG-CD2 4.07Å; E128-L165 VanDerWaalsContact OE1-CA 3.3Å; E128-L165 WeakPolarHBondContact OE1-CA 3.45Å; I131-L165 HydrophobicContact CD1-CD1 4.15Å; I131-L165 HydrophobicContact CD1-CD2 4.22Å; I131-L165 HydrophobicContact CG2-CD1 4.17Å; A160-L165 HydrophobicContact CB-CB 4.35Å; A160-L165 PolarHBondContact O-N 3.07Å; D163-L165 HydrophobicContact CB-CD1 4.37Å; D163-L165 HydrophobicContact CB-CG 4.14Å; L165-K167 VanDerWaalsContact C-N 3.35Å; L165-K167 PolarHBondContact O-N 2.89Å; L165-V168 HydrophobicContact CB-CB 3.72Å; L165-V168 HydrophobicContact CB-CG2 3.83Å; L165-V168 HydrophobicContact CD1-CB 4.47Å; L165-V168 HydrophobicContact CD1-CG2 4.17Å; L165-V168 PolarHBondContact O-N 2.88Å; L165-V168 VanDerWaalsContact O-N 3.13Å; L165-I169 VanDerWaalsContact O-CG1 3.29Å; L165-I169 WeakPolarHBondContact O-CG1 3.24Å; L165-I169 PolarHBondContact O-N 3.14Å | ||
| 166 | C | 91.2 | Very high | 91.3 | Very high | 28 Ų | 28 | 28.5 Ų | 28.5 | 19% | 0.189 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -57.1 | -39 | -176.4 | -63.5 | 0 | 0 | 0 | 0 | 114.4 | E128 G164 N170 | E128-C166 PolarHBondContact OE1-N 3.43Å; G164-C166 PolarHBondContact O-N 3.4Å; G164-C166 PolarHBondContact O-SG 3.45Å; C166-N170 PolarHBondContact O-N 2.93Å; C166-N170 VanDerWaalsContact O-N 3.12Å |
| 167 | K | 90.9 | Very high | 91.2 | Very high | 103 Ų | 103 | 28.9 Ų | 28.9 | 45% | 0.448 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -66.8 | -41.4 | 175.3 | -64 | -176.1 | -174.3 | -176.3 | 0 | 111 | E128 D129 L165 N170 L171 | E128-K167 HydrophobicContact CG-CB 4.09Å; E128-K167 HydrophobicContact CG-CD 4.31Å; E128-K167 HydrophobicContact CG-CG 4.35Å; E128-K167 WeakPolarHBondContact OE1-CB 3.4Å; E128-K167 PolarHBondContact OE1-N 3.19Å; D129-K167 IonicContact OD1-NZ 3.28Å; D129-K167 PolarHBondContact OD1-NZ 2.95Å; L165-K167 VanDerWaalsContact C-N 3.35Å; L165-K167 PolarHBondContact O-N 2.89Å; K167-N170 WeakPolarHBondContact O-CB 3.48Å; K167-N170 PolarHBondContact O-N 2.71Å; K167-L171 WeakPolarHBondContact O-CG 3.31Å; K167-L171 PolarHBondContact O-N 3.26Å |
| 168 | V | 92.6 | Very high | 90.8 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -67.5 | -41 | 177.4 | 177.2 | 0 | 0 | 0 | 0 | 110.8 | I131 V135 A160 L165 N170 L171 L172 | I131-V168 HydrophobicContact CB-CG2 4.46Å; I131-V168 HydrophobicContact CG2-CG2 3.87Å; V135-V168 HydrophobicContact CG1-CG1 4.28Å; V135-V168 HydrophobicContact CG2-CG1 4.02Å; A160-V168 HydrophobicContact CB-CB 4.27Å; A160-V168 HydrophobicContact CB-CG1 3.78Å; L165-V168 HydrophobicContact CB-CB 3.72Å; L165-V168 HydrophobicContact CB-CG2 3.83Å; L165-V168 HydrophobicContact CD1-CB 4.47Å; L165-V168 HydrophobicContact CD1-CG2 4.17Å; L165-V168 PolarHBondContact O-N 2.88Å; L165-V168 VanDerWaalsContact O-N 3.13Å; V168-N170 VanDerWaalsContact C-N 3.32Å; V168-N170 PolarHBondContact O-N 2.96Å; V168-L171 PolarHBondContact O-N 3.14Å; V168-L172 HydrophobicContact CG1-CD1 3.83Å; V168-L172 HydrophobicContact CG1-CG 4.18Å; V168-L172 WeakPolarHBondContact O-CB 3.47Å; V168-L172 VanDerWaalsContact O-CG 3.29Å; V168-L172 WeakPolarHBondContact O-CG 3.41Å; V168-L172 PolarHBondContact O-N 3.19Å |
| 169 | I | 92.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -56.1 | -47.3 | 173.9 | -71.9 | 166.8 | 0 | 0 | 0 | 110.7 | L157 A160 A161 L165 V173 A201 K204 L205 L208 | L157-I169 HydrophobicContact CD1-CB 4.31Å; L157-I169 HydrophobicContact CD1-CG1 4.25Å; L157-I169 HydrophobicContact CD1-CG2 4.04Å; A160-I169 HydrophobicContact CB-CG1 3.92Å; A161-I169 HydrophobicContact CB-CD1 4.44Å; L165-I169 VanDerWaalsContact O-CG1 3.29Å; L165-I169 WeakPolarHBondContact O-CG1 3.24Å; L165-I169 PolarHBondContact O-N 3.14Å; I169-V173 WeakPolarHBondContact O-CG2 3.43Å; I169-V173 PolarHBondContact O-N 3.38Å; I169-A201 HydrophobicContact CD1-CB 3.72Å; I169-K204 HydrophobicContact CG2-CG 4.3Å; I169-L205 HydrophobicContact CD1-CG 4.47Å; I169-L205 HydrophobicContact CG2-CD2 3.77Å; I169-L205 HydrophobicContact CG2-CG 4.25Å; I169-L208 HydrophobicContact CG2-CD1 3.73Å |
| 170 | N | 89.5 | Confident | 90.5 | Very high | 60 Ų | 60 | 38.7 Ų | 38.7 | 32% | 0.321 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -58 | -50.6 | 174.7 | -88 | -34.6 | 0 | 0 | 0 | 112.6 | C166 K167 V168 L172 V173 S174 K204 | C166-N170 PolarHBondContact O-N 2.93Å; C166-N170 VanDerWaalsContact O-N 3.12Å; K167-N170 WeakPolarHBondContact O-CB 3.48Å; K167-N170 PolarHBondContact O-N 2.71Å; V168-N170 VanDerWaalsContact C-N 3.32Å; V168-N170 PolarHBondContact O-N 2.96Å; N170-L172 PolarHBondContact O-N 2.71Å; N170-V173 PolarHBondContact O-N 3.15Å; N170-S174 WeakPolarHBondContact O-CB 3.42Å; N170-S174 PolarHBondContact O-N 3.31Å; N170-S174 PolarHBondContact O-OG 2.93Å; N170-K204 VanDerWaalsContact ND2-CE 3.25Å; N170-K204 WeakPolarHBondContact ND2-CE 3.18Å; N170-K204 WeakPolarHBondContact OD1-CE 3.46Å; N170-K204 PolarHBondContact OD1-NZ 3.15Å; N170-K204 VanDerWaalsContact OD1-NZ 3.11Å |
| 171 | L | 89.3 | Confident | 90.4 | Very high | 39 Ų | 39 | 40.3 Ų | 40.3 | 20% | 0.204 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -59.7 | -47.4 | -177.8 | -73.8 | 169.8 | 0 | 0 | 0 | 111 | V135 E136 L139 K167 V168 V173 S174 H175 | V135-L171 HydrophobicContact CG1-CB 4.46Å; E136-L171 HydrophobicContact CB-CD1 4.37Å; L139-L171 HydrophobicContact CD1-CB 4.47Å; K167-L171 WeakPolarHBondContact O-CG 3.31Å; K167-L171 PolarHBondContact O-N 3.26Å; V168-L171 PolarHBondContact O-N 3.14Å; L171-V173 PolarHBondContact O-N 3.07Å; L171-S174 WeakPolarHBondContact CA-OG 3.14Å; L171-S174 PolarHBondContact O-N 3.33Å; L171-S174 PolarHBondContact O-OG 3.3Å; L171-H175 PolarHBondContact O-CD2 2.69Å; L171-H175 PolarHBondContact O-N 3.43Å; L171-H175 VanDerWaalsContact O-N 3.1Å |
| 172 | L | 90.3 | Very high | 90.3 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.2 | -48.3 | 178.1 | -70.3 | 171.7 | 0 | 0 | 0 | 111.4 | L118 V135 L139 P145 C156 L157 A160 V168 N170 S174 H175 G176 A177 | L118-L172 HydrophobicContact CD2-CD2 4.06Å; V135-L172 HydrophobicContact CG1-CD2 4.25Å; L139-L172 HydrophobicContact CD1-CD2 4.32Å; L139-L172 HydrophobicContact CD2-CD2 4.42Å; P145-L172 HydrophobicContact CB-CD2 3.98Å; C156-L172 HydrophobicContact CB-CD1 4.03Å; C156-L172 HydrophobicContact CB-CD2 4.07Å; L157-L172 HydrophobicContact CB-CD1 4.5Å; L157-L172 HydrophobicContact CD1-CB 4.21Å; L157-L172 HydrophobicContact CD1-CD1 4.32Å; A160-L172 HydrophobicContact CB-CD1 4.04Å; V168-L172 HydrophobicContact CG1-CD1 3.83Å; V168-L172 HydrophobicContact CG1-CG 4.18Å; V168-L172 WeakPolarHBondContact O-CB 3.47Å; V168-L172 VanDerWaalsContact O-CG 3.29Å; V168-L172 WeakPolarHBondContact O-CG 3.41Å; V168-L172 PolarHBondContact O-N 3.19Å; N170-L172 PolarHBondContact O-N 2.71Å; L172-S174 PolarHBondContact O-N 3.14Å; L172-H175 CarbonylContact O-C 3.47Å; L172-H175 PolarHBondContact O-N 2.7Å; L172-H175 VanDerWaalsContact O-N 3.14Å; L172-G176 PolarHBondContact O-N 3.1Å; L172-A177 HydrophobicContact CB-CB 3.87Å; L172-A177 WeakPolarHBondContact O-CB 3.26Å; L172-A177 PolarHBondContact O-N 3.36Å |
| 173 | V | 87.4 | Confident | 90.2 | Very high | 30 Ų | 30 | 42.6 Ų | 42.6 | 18% | 0.182 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -65.9 | -39.2 | 179.8 | 173.5 | 0 | 0 | 0 | 0 | 111.9 | L157 I169 N170 L171 H175 G176 I179 L208 | L157-V173 HydrophobicContact CD1-CG2 3.92Å; L157-V173 HydrophobicContact CD2-CG2 4.26Å; I169-V173 WeakPolarHBondContact O-CG2 3.43Å; I169-V173 PolarHBondContact O-N 3.38Å; N170-V173 PolarHBondContact O-N 3.15Å; L171-V173 PolarHBondContact O-N 3.07Å; V173-H175 PolarHBondContact O-N 3.1Å; V173-G176 PolarHBondContact O-N 2.67Å; V173-I179 HydrophobicContact CG1-CD1 3.88Å; V173-I179 HydrophobicContact CG1-CG1 4.27Å; V173-I179 HydrophobicContact CG2-CD1 4.17Å; V173-I179 HydrophobicContact CG2-CG1 3.85Å; V173-L208 HydrophobicContact CB-CD1 4.17Å; V173-L208 HydrophobicContact CG1-CD1 4.33Å; V173-L208 HydrophobicContact CG1-CD2 4.27Å; V173-L208 HydrophobicContact CG2-CD1 3.98Å |
| 174 | S | 88.1 | Confident | 90.3 | Very high | 64 Ų | 64 | 41.8 Ų | 41.8 | 45% | 0.448 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64 | -22.2 | 174.8 | 64.4 | 0 | 0 | 0 | 0 | 113.7 | N170 L171 L172 Q377 | N170-S174 WeakPolarHBondContact O-CB 3.42Å; N170-S174 PolarHBondContact O-N 3.31Å; N170-S174 PolarHBondContact O-OG 2.93Å; L171-S174 WeakPolarHBondContact CA-OG 3.14Å; L171-S174 PolarHBondContact O-N 3.33Å; L171-S174 PolarHBondContact O-OG 3.3Å; L172-S174 PolarHBondContact O-N 3.14Å; S174-Q377 PolarHBondContact O-NE2 3.46Å |
| 175 | H | 84.1 | Confident | 90.4 | Very high | 60 Ų | 60 | 47.2 Ų | 47.2 | 28% | 0.278 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99 | 19.9 | 175.2 | -80.7 | -85.2 | 0 | 0 | 0 | 112.7 | L139 L171 L172 V173 | L139-H175 HydrophobicContact CD1-CB 4.01Å; L139-H175 HydrophobicContact CD2-CB 4.06Å; L139-H175 HydrophobicContact CG-CB 4.43Å; L171-H175 PolarHBondContact O-CD2 2.69Å; L171-H175 PolarHBondContact O-N 3.43Å; L171-H175 VanDerWaalsContact O-N 3.1Å; L172-H175 CarbonylContact O-C 3.47Å; L172-H175 PolarHBondContact O-N 2.7Å; L172-H175 VanDerWaalsContact O-N 3.14Å; V173-H175 PolarHBondContact O-N 3.1Å |
| 176 | G | 81.6 | Confident | 90.4 | Very high | 47 Ų | 47 | 46.4 Ų | 46.4 | 49% | 0.485 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86 | 21.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | N146 L172 V173 E178 | N146-G176 PolarHBondContact ND2-O 3.35Å; L172-G176 PolarHBondContact O-N 3.1Å; V173-G176 PolarHBondContact O-N 2.67Å; G176-E178 PolarHBondContact O-N 3.23Å |
| 177 | A | 89.7 | Confident | 90.6 | Very high | 8 Ų | 8 | 46.5 Ų | 46.5 | 7% | 0.066 | 25% | 0.249 | C | C | . | . | trans | -64.9 | 126.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | P145 N146 L172 I179 | P145-A177 HydrophobicContact CB-CB 4.03Å; P145-A177 HydrophobicContact CG-CB 4.36Å; N146-A177 WeakPolarHBondContact OD1-CA 2.93Å; L172-A177 HydrophobicContact CB-CB 3.87Å; L172-A177 WeakPolarHBondContact O-CB 3.26Å; L172-A177 PolarHBondContact O-N 3.36Å; A177-I179 PolarHBondContact O-N 3.41Å | ||
| 178 | E | 88.6 | Confident | 90.9 | Very high | 120 Ų | 120 | 41.6 Ų | 41.6 | 56% | 0.561 | 23% | 0.228 | S | C | * | . | trans | -71.4 | 118.1 | 176.8 | -68.6 | -178.3 | -159.8 | 0 | 0 | 111 | N146 G176 V181 | N146-E178 PolarHBondContact OD1-N 3.2Å; G176-E178 PolarHBondContact O-N 3.23Å; E178-V181 HydrophobicContact CB-CG2 3.39Å; E178-V181 HydrophobicContact CG-CG2 4.37Å; E178-V181 VanDerWaalsContact OE2-CG2 3.3Å; E178-V181 WeakPolarHBondContact OE2-CG2 3.3Å | ||
| 179 | I | 92.2 | Very high | 91.1 | Very high | 26 Ų | 26 | 41.6 Ų | 41.6 | 13% | 0.133 | 23% | 0.228 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -33.9 | -170.8 | -60.5 | 175.2 | 0 | 0 | 0 | 112.8 | L157 V173 A177 L208 A210 | L157-I179 HydrophobicContact CD2-CB 4.39Å; L157-I179 HydrophobicContact CD2-CG1 4.33Å; V173-I179 HydrophobicContact CG1-CD1 3.88Å; V173-I179 HydrophobicContact CG1-CG1 4.27Å; V173-I179 HydrophobicContact CG2-CD1 4.17Å; V173-I179 HydrophobicContact CG2-CG1 3.85Å; A177-I179 PolarHBondContact O-N 3.41Å; I179-L208 HydrophobicContact CD1-CB 3.92Å; I179-L208 WeakPolarHBondContact CD1-O 3.33Å; I179-A210 HydrophobicContact CG2-CB 3.52Å |
| 180 | N | 91.9 | Very high | 91.2 | Very high | 65 Ų | 65 | 41.6 Ų | 41.6 | 35% | 0.348 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104 | 12.3 | -167.5 | -68.7 | -32.8 | 0 | 0 | 0 | 113.7 | D211 I214 | N180-D211 PolarHBondContact OD1-N 3.33Å; N180-I214 HydrophobicContact CB-CD1 3.63Å |
| 181 | V | 93.1 | Very high | 91.5 | Very high | 33 Ų | 33 | 38.8 Ų | 38.8 | 20% | 0.2 | 21% | 0.213 | C | C | . | . | trans | -58.4 | 143.8 | 173.3 | 179.4 | 0 | 0 | 0 | 0 | 109.5 | T155 M158 E178 T188 | T155-V181 HydrophobicContact CG2-CB 4.05Å; T155-V181 HydrophobicContact CG2-CG1 3.72Å; T155-V181 HydrophobicContact CG2-CG2 4.48Å; M158-V181 HydrophobicContact CE-CB 4.21Å; M158-V181 HydrophobicContact CE-CG1 4.16Å; M158-V181 WeakPolarHBondContact CE-O 3.36Å; E178-V181 HydrophobicContact CB-CG2 3.39Å; E178-V181 HydrophobicContact CG-CG2 4.37Å; E178-V181 VanDerWaalsContact OE2-CG2 3.3Å; E178-V181 WeakPolarHBondContact OE2-CG2 3.3Å; V181-T188 WeakPolarHBondContact O-CA 3.34Å | ||
| 182 | Q | 93.8 | Very high | 91.9 | Very high | 92 Ų | 92 | 37 Ų | 37 | 43% | 0.43 | 20% | 0.204 | S | C | . | . | trans | -111.2 | 135.9 | 177.6 | -69.9 | -170.4 | -73.5 | 0 | 0 | 111.2 | G186 Y187 T188 I214 R215 | Q182-G186 PolarHBondContact NE2-O 2.93Å; Q182-Y187 WeakPolarHBondContact CA-O 3.12Å; Q182-T188 HydrophobicContact CG-CG2 3.81Å; Q182-I214 HydrophobicContact CG-CG2 3.95Å; Q182-R215 PolarHBondContact NE2-O 2.86Å | ||
| 183 | D | 93.3 | Very high | 92.1 | Very high | 17 Ų | 17 | 37 Ų | 37 | 9% | 0.091 | 20% | 0.204 | C | C | . | . | trans | -73.3 | -178.2 | 173.3 | 84.6 | -14 | 0 | 0 | 0 | 111.9 | S152 Q153 M154 M158 K185 G186 Y187 | S152-D183 WeakPolarHBondContact O-CB 2.99Å; Q153-D183 WeakPolarHBondContact O-CA 3.36Å; M154-D183 HydrophobicContact CG-CB 4.3Å; M158-D183 HydrophobicContact CE-CB 4.21Å; M158-D183 HydrophobicContact SD-CB 3.85Å; D183-K185 PolarHBondContact O-N 2.98Å; D183-K185 VanDerWaalsContact OD1-C 3.26Å; D183-K185 VanDerWaalsContact OD1-CA 3.27Å; D183-K185 WeakPolarHBondContact OD1-CA 3.22Å; D183-K185 WeakPolarHBondContact OD1-CB 3.32Å; D183-K185 PolarHBondContact OD1-N 3.41Å; D183-G186 PolarHBondContact O-N 3.27Å; D183-G186 PolarHBondContact OD1-N 2.97Å; D183-Y187 PolarHBondContact N-O 3.42Å; D183-Y187 WeakPolarHBondContact OD1-CB 3.42Å; D183-Y187 PolarHBondContact OD1-N 2.91Å | ||
| 184 | S | 93.6 | Very high | 92.5 | Very high | 43 Ų | 43 | 35.6 Ų | 35.6 | 30% | 0.301 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -16.9 | 178 | 61.9 | 0 | 0 | 0 | 0 | 114.3 | S152 K217 | S152-S184 WeakPolarHBondContact O-CB 3.48Å; S152-S184 PolarHBondContact O-N 3.46Å; S152-S184 PolarHBondContact O-OG 3.45Å; S184-K217 VanDerWaalsContact O-CD 3.29Å; S184-K217 WeakPolarHBondContact O-CD 3.14Å; S184-K217 WeakPolarHBondContact O-CE 3.45Å; S184-K217 PolarHBondContact O-NZ 3.11Å |
| 185 | K | 92.9 | Very high | 92.8 | Very high | 137 Ų | 137 | 35.4 Ų | 35.4 | 60% | 0.596 | 19% | 0.187 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -106.2 | 1.8 | 177.4 | -65 | 176 | -176.5 | 173 | 0 | 112.5 | D183 Y187 K217 | D183-K185 PolarHBondContact O-N 2.98Å; D183-K185 VanDerWaalsContact OD1-C 3.26Å; D183-K185 VanDerWaalsContact OD1-CA 3.27Å; D183-K185 WeakPolarHBondContact OD1-CA 3.22Å; D183-K185 WeakPolarHBondContact OD1-CB 3.32Å; D183-K185 PolarHBondContact OD1-N 3.41Å; K185-Y187 HydrophobicContact CB-CD2 3.7Å; K185-Y187 HydrophobicContact CB-CE2 4.04Å; K185-K217 WeakPolarHBondContact O-CB 3.47Å; K185-K217 WeakPolarHBondContact O-CG 3.29Å; K185-K217 PolarHBondContact O-N 3.22Å |
| 186 | G | 92.7 | Very high | 93.3 | Very high | 2 Ų | 2 | 38.1 Ų | 38.1 | 2% | 0.021 | 20% | 0.196 | C | C | . | . | S | Bend | trans | 82.8 | 11.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q182 D183 T216 | Q182-G186 PolarHBondContact NE2-O 2.93Å; D183-G186 PolarHBondContact O-N 3.27Å; D183-G186 PolarHBondContact OD1-N 2.97Å; G186-T216 WeakPolarHBondContact O-CA 3.4Å |
| 187 | Y | 95.9 | Very high | 93.7 | Very high | 30 Ų | 30 | 36.9 Ų | 36.9 | 12% | 0.118 | 18% | 0.183 | C | C | . | . | trans | -78.7 | 131.7 | 176.4 | -77 | -108.7 | 0 | 0 | 0 | 110 | M158 Q182 D183 K185 Q195 T216 L225 | M158-Y187 VanDerWaalsContact CE-O 3.28Å; M158-Y187 WeakPolarHBondContact CE-O 3.41Å; Q182-Y187 WeakPolarHBondContact CA-O 3.12Å; D183-Y187 PolarHBondContact N-O 3.42Å; D183-Y187 WeakPolarHBondContact OD1-CB 3.42Å; D183-Y187 PolarHBondContact OD1-N 2.91Å; K185-Y187 HydrophobicContact CB-CD2 3.7Å; K185-Y187 HydrophobicContact CB-CE2 4.04Å; Y187-Q195 HydrophobicContact CE1-CB 4.32Å; Y187-T216 HydrophobicContact CD1-CG2 4.28Å; Y187-T216 HydrophobicContact CD2-CG2 3.81Å; Y187-T216 HydrophobicContact CE1-CG2 4.18Å; Y187-T216 HydrophobicContact CE2-CG2 3.69Å; Y187-T216 HydrophobicContact CG-CG2 4.1Å; Y187-L225 HydrophobicContact CD1-CD1 4.25Å; Y187-L225 HydrophobicContact CE1-CD1 3.7Å; Y187-L225 HydrophobicContact CE1-CD2 4.32Å | ||
| 188 | T | 96.2 | Very high | 93.9 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.196 | C | C | . | . | trans | -91 | 170.1 | 166.1 | 64.2 | 0 | 0 | 0 | 0 | 110.4 | V181 Q182 L190 S191 T192 I214 | V181-T188 WeakPolarHBondContact O-CA 3.34Å; Q182-T188 HydrophobicContact CG-CG2 3.81Å; T188-L190 PolarHBondContact O-N 2.91Å; T188-L190 PolarHBondContact OG1-N 3.34Å; T188-S191 PolarHBondContact O-N 3.47Å; T188-S191 PolarHBondContact OG1-N 3.07Å; T188-S191 PolarHBondContact OG1-OG 3.11Å; T188-T192 PolarHBondContact O-N 3.24Å; T188-T192 PolarHBondContact O-OG1 3.43Å; T188-I214 HydrophobicContact CG2-CB 4.06Å; T188-I214 HydrophobicContact CG2-CD1 4.04Å; T188-I214 HydrophobicContact CG2-CG2 3.58Å | ||
| 189 | A | 96 | Very high | 94 | Very high | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.008 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -53.3 | -37.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L157 M158 A161 T192 A193 L205 | L157-A189 HydrophobicContact CB-CB 4.46Å; L157-A189 HydrophobicContact CD2-CB 3.89Å; L157-A189 HydrophobicContact CG-CB 3.77Å; M158-A189 HydrophobicContact CG-CB 4.22Å; A161-A189 HydrophobicContact CB-CB 4.11Å; A161-A189 VanDerWaalsContact CB-O 3.28Å; A161-A189 WeakPolarHBondContact CB-O 3.3Å; A189-T192 PolarHBondContact O-N 3.25Å; A189-A193 PolarHBondContact O-N 2.76Å; A189-L205 HydrophobicContact CB-CD1 4.15Å; A189-L205 HydrophobicContact CB-CD2 4.11Å; A189-L205 WeakPolarHBondContact O-CD1 3.22Å |
| 190 | L | 96 | Very high | 93.8 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.3 | -50.6 | 174.9 | -179.3 | 66.3 | 0 | 0 | 0 | 111.4 | T188 T192 A193 V194 V202 L205 L206 A210 K212 P222 L238 | T188-L190 PolarHBondContact O-N 2.91Å; T188-L190 PolarHBondContact OG1-N 3.34Å; L190-T192 VanDerWaalsContact C-N 3.25Å; L190-T192 PolarHBondContact O-N 3.39Å; L190-A193 PolarHBondContact O-N 3.22Å; L190-V194 VanDerWaalsContact O-CG2 3.24Å; L190-V194 WeakPolarHBondContact O-CG2 3.35Å; L190-V194 PolarHBondContact O-N 2.93Å; L190-V202 HydrophobicContact CD1-CB 4.42Å; L190-V202 HydrophobicContact CD1-CG1 3.92Å; L190-V202 HydrophobicContact CD1-CG2 4.47Å; L190-L205 HydrophobicContact CD1-CB 4.21Å; L190-L206 HydrophobicContact CD1-CD2 4.12Å; L190-L206 HydrophobicContact CD1-CG 4.05Å; L190-L206 HydrophobicContact CD2-CD2 3.92Å; L190-A210 HydrophobicContact CB-CB 4.08Å; L190-A210 HydrophobicContact CD2-CB 4.19Å; L190-K212 HydrophobicContact CD2-CB 3.82Å; L190-P222 HydrophobicContact CD2-CB 4.36Å; L190-P222 HydrophobicContact CD2-CG 4.23Å; L190-P222 HydrophobicContact CG-CB 4.47Å; L190-L238 HydrophobicContact CD2-CD2 4.45Å |
| 191 | S | 95.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -59.8 | -36.4 | 177.6 | -56.7 | 0 | 0 | 0 | 0 | 112.3 | T188 V194 Q195 | T188-S191 PolarHBondContact O-N 3.47Å; T188-S191 PolarHBondContact OG1-N 3.07Å; T188-S191 PolarHBondContact OG1-OG 3.11Å; S191-V194 PolarHBondContact O-N 3.38Å; S191-Q195 WeakPolarHBondContact O-CB 3.42Å; S191-Q195 PolarHBondContact O-N 3.41Å |
| 192 | T | 96 | Very high | 93.6 | Very high | 3 Ų | 3 | 38.2 Ų | 38.2 | 2% | 0.018 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -66.3 | -49.7 | 174.4 | -52.7 | 0 | 0 | 0 | 0 | 111.1 | M154 R162 T188 A189 L190 V194 Q195 Y196 | M154-T192 HydrophobicContact CE-CG2 4.34Å; R162-T192 HydrophobicContact CB-CG2 3.78Å; R162-T192 HydrophobicContact CG-CG2 4.4Å; T188-T192 PolarHBondContact O-N 3.24Å; T188-T192 PolarHBondContact O-OG1 3.43Å; A189-T192 PolarHBondContact O-N 3.25Å; L190-T192 VanDerWaalsContact C-N 3.25Å; L190-T192 PolarHBondContact O-N 3.39Å; T192-V194 PolarHBondContact O-N 2.77Å; T192-Q195 PolarHBondContact O-N 3.21Å; T192-Q195 VanDerWaalsContact O-N 3.14Å; T192-Y196 HydrophobicContact CG2-CD2 4Å; T192-Y196 HydrophobicContact CG2-CE2 4.08Å; T192-Y196 VanDerWaalsContact O-CD2 3.31Å; T192-Y196 WeakPolarHBondContact O-CD2 3.25Å; T192-Y196 PolarHBondContact O-N 3.34Å; T192-Y196 VanDerWaalsContact O-N 3.11Å |
| 193 | A | 96.1 | Very high | 93.3 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -56.7 | -39 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | A161 A189 L190 G197 K198 A201 V202 L205 | A161-A193 HydrophobicContact CB-CB 4.15Å; A189-A193 PolarHBondContact O-N 2.76Å; L190-A193 PolarHBondContact O-N 3.22Å; A193-G197 PolarHBondContact O-N 2.96Å; A193-G197 VanDerWaalsContact O-N 3.13Å; A193-K198 HydrophobicContact CB-CB 4.35Å; A193-K198 PolarHBondContact O-N 2.98Å; A193-A201 HydrophobicContact CB-CB 4.06Å; A193-V202 HydrophobicContact CB-CG2 3.69Å; A193-L205 HydrophobicContact CB-CD1 3.96Å |
| 194 | V | 95.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.4 | -49.4 | 175.4 | 173.1 | 0 | 0 | 0 | 0 | 111.5 | L190 S191 T192 Y196 G197 V202 P222 L225 A226 H231 I234 L238 | L190-V194 VanDerWaalsContact O-CG2 3.24Å; L190-V194 WeakPolarHBondContact O-CG2 3.35Å; L190-V194 PolarHBondContact O-N 2.93Å; S191-V194 PolarHBondContact O-N 3.38Å; T192-V194 PolarHBondContact O-N 2.77Å; V194-Y196 PolarHBondContact O-N 2.91Å; V194-G197 PolarHBondContact O-N 3.48Å; V194-V202 HydrophobicContact CG2-CG2 3.75Å; V194-P222 WeakPolarHBondContact CG1-O 3.2Å; V194-P222 HydrophobicContact CG2-CB 4.35Å; V194-L225 HydrophobicContact CG1-CB 3.98Å; V194-A226 HydrophobicContact CG1-CB 3.63Å; V194-H231 PolarHBondContact O-CD2 3.47Å; V194-H231 PolarHBondContact O-NE2 2.98Å; V194-I234 HydrophobicContact CB-CG2 4.28Å; V194-I234 HydrophobicContact CG1-CG2 4Å; V194-I234 HydrophobicContact CG2-CG2 3.75Å; V194-L238 HydrophobicContact CG2-CD1 3.8Å |
| 195 | Q | 94.9 | Very high | 92.5 | Very high | 59 Ų | 59 | 36.5 Ų | 36.5 | 28% | 0.276 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -54.1 | -42.5 | 179.6 | 174.2 | 176.3 | 19.1 | 0 | 0 | 111.7 | Y187 S191 T192 G197 F229 H231 | Y187-Q195 HydrophobicContact CE1-CB 4.32Å; S191-Q195 WeakPolarHBondContact O-CB 3.42Å; S191-Q195 PolarHBondContact O-N 3.41Å; T192-Q195 PolarHBondContact O-N 3.21Å; T192-Q195 VanDerWaalsContact O-N 3.14Å; Q195-G197 VanDerWaalsContact C-N 3.34Å; Q195-F229 HydrophobicContact CB-CD2 4.32Å; Q195-F229 HydrophobicContact CB-CE2 4Å; Q195-F229 HydrophobicContact CG-CD2 4.3Å; Q195-F229 HydrophobicContact CG-CE1 4.32Å; Q195-F229 HydrophobicContact CG-CE2 3.73Å; Q195-F229 HydrophobicContact CG-CZ 3.76Å; Q195-H231 PolarHBondContact O-NE2 2.81Å |
| 196 | Y | 93.8 | Very high | 92.1 | Very high | 117 Ų | 117 | 31.8 Ų | 31.8 | 46% | 0.459 | 15% | 0.151 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.6 | 6.3 | -177.9 | -71.9 | -93.6 | 0 | 0 | 0 | 114.1 | R162 T192 V194 K198 | R162-Y196 HydrophobicContact CB-CD2 4.35Å; R162-Y196 HydrophobicContact CB-CE2 4.47Å; R162-Y196 HydrophobicContact CG-CD1 3.77Å; R162-Y196 HydrophobicContact CG-CD2 3.66Å; R162-Y196 HydrophobicContact CG-CE1 3.67Å; R162-Y196 HydrophobicContact CG-CE2 3.57Å; R162-Y196 HydrophobicContact CG-CG 3.75Å; T192-Y196 HydrophobicContact CG2-CD2 4Å; T192-Y196 HydrophobicContact CG2-CE2 4.08Å; T192-Y196 VanDerWaalsContact O-CD2 3.31Å; T192-Y196 WeakPolarHBondContact O-CD2 3.25Å; T192-Y196 PolarHBondContact O-N 3.34Å; T192-Y196 VanDerWaalsContact O-N 3.11Å; V194-Y196 PolarHBondContact O-N 2.91Å; Y196-K198 VanDerWaalsContact C-N 3.31Å; Y196-K198 PolarHBondContact O-N 2.64Å |
| 197 | G | 90.8 | Very high | 91.8 | Very high | 22 Ų | 22 | 38.5 Ų | 38.5 | 23% | 0.227 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 69.8 | 23.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | A193 V194 Q195 E199 H231 | A193-G197 PolarHBondContact O-N 2.96Å; A193-G197 VanDerWaalsContact O-N 3.13Å; V194-G197 PolarHBondContact O-N 3.48Å; Q195-G197 VanDerWaalsContact C-N 3.34Å; G197-E199 PolarHBondContact O-N 2.87Å; G197-H231 WeakPolarHBondContact CA-CE1 3.44Å; G197-H231 WeakPolarHBondContact CA-NE2 3.3Å; G197-H231 PolarHBondContact N-NE2 3.39Å |
| 198 | K | 93.9 | Very high | 91 | Very high | 74 Ų | 74 | 39.4 Ų | 39.4 | 32% | 0.322 | 19% | 0.189 | S | C | . | . | trans | -85.5 | 77.2 | -175 | -57.5 | -59.8 | -177.6 | 158.6 | 0 | 111.1 | R162 D163 A193 Y196 Q200 A201 V202 | R162-K198 WeakPolarHBondContact O-CE 3.11Å; R162-K198 WeakPolarHBondContact O-CG 3.38Å; D163-K198 WeakPolarHBondContact O-CE 3.34Å; D163-K198 PolarHBondContact O-NZ 2.83Å; A193-K198 HydrophobicContact CB-CB 4.35Å; A193-K198 PolarHBondContact O-N 2.98Å; Y196-K198 VanDerWaalsContact C-N 3.31Å; Y196-K198 PolarHBondContact O-N 2.64Å; K198-Q200 PolarHBondContact O-N 2.98Å; K198-A201 HydrophobicContact CB-CB 3.85Å; K198-A201 PolarHBondContact O-N 3.38Å; K198-A201 VanDerWaalsContact O-N 3.11Å; K198-V202 WeakPolarHBondContact O-CG2 2.68Å; K198-V202 PolarHBondContact O-N 3.34Å | ||
| 199 | E | 89.4 | Confident | 90.3 | Very high | 78 Ų | 78 | 41.8 Ų | 41.8 | 36% | 0.364 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -51.9 | -47 | -174.8 | -60.5 | -171.6 | 175.7 | 0 | 0 | 114.2 | G197 V202 L203 Q233 I234 | G197-E199 PolarHBondContact O-N 2.87Å; E199-V202 WeakPolarHBondContact O-CB 3.49Å; E199-V202 PolarHBondContact O-N 2.87Å; E199-L203 PolarHBondContact O-N 2.81Å; E199-Q233 WeakPolarHBondContact OE1-CB 3.46Å; E199-Q233 WeakPolarHBondContact OE1-CG 3.24Å; E199-I234 HydrophobicContact CB-CG1 4.42Å; E199-I234 HydrophobicContact CG-CD1 3.99Å; E199-I234 HydrophobicContact CG-CG1 3.69Å |
| 200 | Q | 88.5 | Confident | 90 | Very high | 126 Ų | 126 | 42.2 Ų | 42.2 | 59% | 0.589 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -66.1 | -39.5 | -179.3 | -62.9 | -58 | -36.1 | 0 | 0 | 111.7 | K198 V202 L203 K204 | K198-Q200 PolarHBondContact O-N 2.98Å; Q200-V202 VanDerWaalsContact C-N 3.35Å; Q200-L203 PolarHBondContact O-N 3.21Å; Q200-K204 VanDerWaalsContact O-CB 3.24Å; Q200-K204 WeakPolarHBondContact O-CB 3.25Å; Q200-K204 PolarHBondContact O-N 2.92Å |
| 201 | A | 90.9 | Very high | 89.6 | Confident | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.008 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -66.4 | -37.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | I169 A193 K198 K204 L205 | I169-A201 HydrophobicContact CD1-CB 3.72Å; A193-A201 HydrophobicContact CB-CB 4.06Å; K198-A201 HydrophobicContact CB-CB 3.85Å; K198-A201 PolarHBondContact O-N 3.38Å; K198-A201 VanDerWaalsContact O-N 3.11Å; A201-K204 PolarHBondContact O-N 2.8Å; A201-L205 WeakPolarHBondContact O-CB 3.24Å; A201-L205 WeakPolarHBondContact O-CD1 3.46Å; A201-L205 VanDerWaalsContact O-CG 3.22Å; A201-L205 WeakPolarHBondContact O-CG 3.29Å; A201-L205 PolarHBondContact O-N 3.14Å |
| 202 | V | 90.1 | Very high | 89.2 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60.6 | -52.2 | 173.4 | 169.7 | 0 | 0 | 0 | 0 | 111 | L190 A193 V194 K198 E199 Q200 K204 L205 L206 I234 I237 L238 | L190-V202 HydrophobicContact CD1-CB 4.42Å; L190-V202 HydrophobicContact CD1-CG1 3.92Å; L190-V202 HydrophobicContact CD1-CG2 4.47Å; A193-V202 HydrophobicContact CB-CG2 3.69Å; V194-V202 HydrophobicContact CG2-CG2 3.75Å; K198-V202 WeakPolarHBondContact O-CG2 2.68Å; K198-V202 PolarHBondContact O-N 3.34Å; E199-V202 WeakPolarHBondContact O-CB 3.49Å; E199-V202 PolarHBondContact O-N 2.87Å; Q200-V202 VanDerWaalsContact C-N 3.35Å; V202-K204 PolarHBondContact O-N 3.1Å; V202-L205 PolarHBondContact O-N 2.97Å; V202-L206 HydrophobicContact CG1-CD1 3.88Å; V202-L206 HydrophobicContact CG1-CG 4.41Å; V202-L206 WeakPolarHBondContact O-CB 3.38Å; V202-L206 VanDerWaalsContact O-CG 3.25Å; V202-L206 WeakPolarHBondContact O-CG 3.49Å; V202-L206 PolarHBondContact O-N 3.04Å; V202-I234 HydrophobicContact CG1-CG2 4.24Å; V202-I234 HydrophobicContact CG2-CD1 4.26Å; V202-I234 HydrophobicContact CG2-CG2 4.12Å; V202-I237 HydrophobicContact CG1-CG2 4.41Å; V202-L238 HydrophobicContact CG1-CD2 4.35Å |
| 203 | L | 86.8 | Confident | 88.8 | Confident | 74 Ų | 74 | 51.9 Ų | 51.9 | 39% | 0.387 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -57.1 | -41 | 177.1 | -73.4 | 172.3 | 0 | 0 | 0 | 111.2 | E199 Q200 L206 Q207 I237 | E199-L203 PolarHBondContact O-N 2.81Å; Q200-L203 PolarHBondContact O-N 3.21Å; L203-L206 PolarHBondContact O-N 3.38Å; L203-Q207 WeakPolarHBondContact O-CB 3.44Å; L203-Q207 PolarHBondContact O-N 3.06Å; L203-I237 HydrophobicContact CD1-CD1 4.39Å; L203-I237 HydrophobicContact CD2-CD1 3.99Å; L203-I237 HydrophobicContact CD2-CG1 4.23Å; L203-I237 HydrophobicContact CD2-CG2 3.6Å; L203-I237 HydrophobicContact CG-CD1 4.11Å; L203-I237 HydrophobicContact CG-CG2 4.47Å |
| 204 | K | 85.1 | Confident | 88.4 | Confident | 42 Ų | 42 | 53.4 Ų | 53.4 | 18% | 0.183 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67.8 | -45.4 | -178.8 | -167.3 | 67.2 | -163.7 | 168.9 | 0 | 112.8 | I169 N170 Q200 A201 V202 L206 Q207 L208 | I169-K204 HydrophobicContact CG2-CG 4.3Å; N170-K204 VanDerWaalsContact ND2-CE 3.25Å; N170-K204 WeakPolarHBondContact ND2-CE 3.18Å; N170-K204 WeakPolarHBondContact OD1-CE 3.46Å; N170-K204 PolarHBondContact OD1-NZ 3.15Å; N170-K204 VanDerWaalsContact OD1-NZ 3.11Å; Q200-K204 VanDerWaalsContact O-CB 3.24Å; Q200-K204 WeakPolarHBondContact O-CB 3.25Å; Q200-K204 PolarHBondContact O-N 2.92Å; A201-K204 PolarHBondContact O-N 2.8Å; V202-K204 PolarHBondContact O-N 3.1Å; K204-L206 VanDerWaalsContact C-N 3.33Å; K204-L206 PolarHBondContact O-N 3.33Å; K204-Q207 WeakPolarHBondContact O-CB 3.41Å; K204-Q207 PolarHBondContact O-N 3.23Å; K204-L208 HydrophobicContact CG-CD1 4.27Å; K204-L208 VanDerWaalsContact O-CG 3.3Å; K204-L208 WeakPolarHBondContact O-CG 3.33Å; K204-L208 PolarHBondContact O-N 3.46Å |
| 205 | L | 85.1 | Confident | 88.2 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.6 | -39.8 | 176.3 | -72.2 | 165.1 | 0 | 0 | 0 | 111.2 | L157 A161 I169 A189 L190 A193 A201 V202 L208 G209 A210 | L157-L205 HydrophobicContact CD1-CD2 4.37Å; L157-L205 HydrophobicContact CD2-CD2 4.4Å; L157-L205 HydrophobicContact CG-CD2 4.44Å; A161-L205 HydrophobicContact CB-CD1 3.93Å; I169-L205 HydrophobicContact CD1-CG 4.47Å; I169-L205 HydrophobicContact CG2-CD2 3.77Å; I169-L205 HydrophobicContact CG2-CG 4.25Å; A189-L205 HydrophobicContact CB-CD1 4.15Å; A189-L205 HydrophobicContact CB-CD2 4.11Å; A189-L205 WeakPolarHBondContact O-CD1 3.22Å; L190-L205 HydrophobicContact CD1-CB 4.21Å; A193-L205 HydrophobicContact CB-CD1 3.96Å; A201-L205 WeakPolarHBondContact O-CB 3.24Å; A201-L205 WeakPolarHBondContact O-CD1 3.46Å; A201-L205 VanDerWaalsContact O-CG 3.22Å; A201-L205 WeakPolarHBondContact O-CG 3.29Å; A201-L205 PolarHBondContact O-N 3.14Å; V202-L205 PolarHBondContact O-N 2.97Å; L205-L208 CarbonylContact O-C 3.46Å; L205-L208 PolarHBondContact O-N 3.49Å; L205-G209 PolarHBondContact O-N 3.29Å; L205-A210 HydrophobicContact CB-CB 3.96Å; L205-A210 WeakPolarHBondContact O-CB 3.42Å; L205-A210 PolarHBondContact O-N 3.42Å |
| 206 | L | 85.3 | Confident | 88.1 | Confident | 38 Ų | 38 | 57.4 Ų | 57.4 | 20% | 0.199 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.1 | -41.4 | 173.3 | -69 | 171.6 | 0 | 0 | 0 | 112 | L190 V202 L203 K204 L208 G209 K212 I237 L238 | L190-L206 HydrophobicContact CD1-CD2 4.12Å; L190-L206 HydrophobicContact CD1-CG 4.05Å; L190-L206 HydrophobicContact CD2-CD2 3.92Å; V202-L206 HydrophobicContact CG1-CD1 3.88Å; V202-L206 HydrophobicContact CG1-CG 4.41Å; V202-L206 WeakPolarHBondContact O-CB 3.38Å; V202-L206 VanDerWaalsContact O-CG 3.25Å; V202-L206 WeakPolarHBondContact O-CG 3.49Å; V202-L206 PolarHBondContact O-N 3.04Å; L203-L206 PolarHBondContact O-N 3.38Å; K204-L206 VanDerWaalsContact C-N 3.33Å; K204-L206 PolarHBondContact O-N 3.33Å; L206-L208 VanDerWaalsContact C-N 3.25Å; L206-L208 PolarHBondContact O-N 3.25Å; L206-G209 PolarHBondContact O-N 3.35Å; L206-G209 VanDerWaalsContact O-N 3.11Å; L206-K212 HydrophobicContact CD2-CB 4.21Å; L206-I237 HydrophobicContact CD1-CG2 3.79Å; L206-L238 HydrophobicContact CD1-CD2 4.1Å; L206-L238 HydrophobicContact CD2-CD2 4.27Å |
| 207 | Q | 87 | Confident | 88.1 | Confident | 143 Ų | 143 | 59.4 Ų | 59.4 | 67% | 0.668 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -61.6 | -35.4 | 174.8 | -172.4 | -173.4 | 20.7 | 0 | 0 | 111.9 | L203 K204 G209 | L203-Q207 WeakPolarHBondContact O-CB 3.44Å; L203-Q207 PolarHBondContact O-N 3.06Å; K204-Q207 WeakPolarHBondContact O-CB 3.41Å; K204-Q207 PolarHBondContact O-N 3.23Å; Q207-G209 PolarHBondContact O-N 2.79Å |
| 208 | L | 79.1 | Confident | 88.1 | Confident | 50 Ų | 50 | 63.3 Ų | 63.3 | 26% | 0.262 | 32% | 0.322 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | 1.5 | 178.1 | -65.2 | 171 | 0 | 0 | 0 | 113.1 | I169 V173 I179 K204 L205 L206 | I169-L208 HydrophobicContact CG2-CD1 3.73Å; V173-L208 HydrophobicContact CB-CD1 4.17Å; V173-L208 HydrophobicContact CG1-CD1 4.33Å; V173-L208 HydrophobicContact CG1-CD2 4.27Å; V173-L208 HydrophobicContact CG2-CD1 3.98Å; I179-L208 HydrophobicContact CD1-CB 3.92Å; I179-L208 WeakPolarHBondContact CD1-O 3.33Å; K204-L208 HydrophobicContact CG-CD1 4.27Å; K204-L208 VanDerWaalsContact O-CG 3.3Å; K204-L208 WeakPolarHBondContact O-CG 3.33Å; K204-L208 PolarHBondContact O-N 3.46Å; L205-L208 CarbonylContact O-C 3.46Å; L205-L208 PolarHBondContact O-N 3.49Å; L206-L208 VanDerWaalsContact C-N 3.25Å; L206-L208 PolarHBondContact O-N 3.25Å |
| 209 | G | 81.5 | Confident | 88 | Confident | 50 Ų | 50 | 61.5 Ų | 61.5 | 52% | 0.515 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91.2 | 23.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | L205 L206 Q207 D211 | L205-G209 PolarHBondContact O-N 3.29Å; L206-G209 PolarHBondContact O-N 3.35Å; L206-G209 VanDerWaalsContact O-N 3.11Å; Q207-G209 PolarHBondContact O-N 2.79Å; G209-D211 PolarHBondContact O-N 3.07Å |
| 210 | A | 89 | Confident | 88.1 | Confident | 10 Ų | 10 | 61.7 Ų | 61.7 | 8% | 0.083 | 32% | 0.323 | C | S | . | . | trans | -61.1 | 132 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | I179 L190 L205 K212 | I179-A210 HydrophobicContact CG2-CB 3.52Å; L190-A210 HydrophobicContact CB-CB 4.08Å; L190-A210 HydrophobicContact CD2-CB 4.19Å; L205-A210 HydrophobicContact CB-CB 3.96Å; L205-A210 WeakPolarHBondContact O-CB 3.42Å; L205-A210 PolarHBondContact O-N 3.42Å; A210-K212 PolarHBondContact O-N 3.33Å | ||
| 211 | D | 86.7 | Confident | 88.2 | Confident | 58 Ų | 58 | 56.3 Ų | 56.3 | 31% | 0.31 | 30% | 0.3 | S | S | . | . | trans | -79.3 | 109 | -179.5 | -175.1 | -3.6 | 0 | 0 | 0 | 110.7 | N180 G209 T213 I214 | N180-D211 PolarHBondContact OD1-N 3.33Å; G209-D211 PolarHBondContact O-N 3.07Å; D211-T213 VanDerWaalsContact CG-OG1 3.24Å; D211-T213 PolarHBondContact O-N 2.86Å; D211-T213 WeakPolarHBondContact OD1-CA 2.94Å; D211-T213 VanDerWaalsContact OD1-CB 3.26Å; D211-T213 WeakPolarHBondContact OD1-CB 3.36Å; D211-T213 WeakPolarHBondContact OD1-CG2 3.42Å; D211-T213 PolarHBondContact OD1-N 2.72Å; D211-T213 PolarHBondContact OD1-OG1 3.49Å; D211-T213 PolarHBondContact OD2-OG1 3.19Å; D211-T213 VanDerWaalsContact OD2-OG1 3.1Å; D211-I214 HydrophobicContact CB-CD1 3.77Å; D211-I214 HydrophobicContact CB-CG1 3.91Å | ||
| 212 | K | 89.1 | Confident | 88.2 | Confident | 51 Ų | 51 | 56.2 Ų | 56.2 | 22% | 0.222 | 30% | 0.299 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -1.3 | 176.8 | 66.5 | 176 | 176 | 178.5 | 0 | 114.4 | L190 L206 A210 P222 L238 S241 S242 | L190-K212 HydrophobicContact CD2-CB 3.82Å; L206-K212 HydrophobicContact CD2-CB 4.21Å; A210-K212 PolarHBondContact O-N 3.33Å; K212-P222 VanDerWaalsContact O-CD 3.22Å; K212-P222 WeakPolarHBondContact O-CD 3.46Å; K212-L238 HydrophobicContact CB-CD2 4.31Å; K212-S241 WeakPolarHBondContact CD-OG 3.2Å; K212-S241 PolarHBondContact NZ-O 3.48Å; K212-S241 PolarHBondContact NZ-OG 3.06Å; K212-S242 VanDerWaalsContact NZ-N 3.15Å |
| 213 | T | 86.6 | Confident | 88.3 | Confident | 96 Ų | 96 | 57.7 Ų | 57.7 | 59% | 0.589 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | -18.6 | 178.8 | 74.5 | 0 | 0 | 0 | 0 | 112.8 | D211 R215 | D211-T213 VanDerWaalsContact CG-OG1 3.24Å; D211-T213 PolarHBondContact O-N 2.86Å; D211-T213 WeakPolarHBondContact OD1-CA 2.94Å; D211-T213 VanDerWaalsContact OD1-CB 3.26Å; D211-T213 WeakPolarHBondContact OD1-CB 3.36Å; D211-T213 WeakPolarHBondContact OD1-CG2 3.42Å; D211-T213 PolarHBondContact OD1-N 2.72Å; D211-T213 PolarHBondContact OD1-OG1 3.49Å; D211-T213 PolarHBondContact OD2-OG1 3.19Å; D211-T213 VanDerWaalsContact OD2-OG1 3.1Å; T213-R215 PolarHBondContact O-N 3.47Å |
| 214 | I | 88.1 | Confident | 88.5 | Confident | 32 Ų | 32 | 56.7 Ų | 56.7 | 16% | 0.164 | 31% | 0.306 | C | S | . | . | P | Polyproline II helix | trans | -62.6 | 127.3 | -179.8 | -63.2 | 175.6 | 0 | 0 | 0 | 110.2 | N180 Q182 T188 D211 P222 | N180-I214 HydrophobicContact CB-CD1 3.63Å; Q182-I214 HydrophobicContact CG-CG2 3.95Å; T188-I214 HydrophobicContact CG2-CB 4.06Å; T188-I214 HydrophobicContact CG2-CD1 4.04Å; T188-I214 HydrophobicContact CG2-CG2 3.58Å; D211-I214 HydrophobicContact CB-CD1 3.77Å; D211-I214 HydrophobicContact CB-CG1 3.91Å; I214-P222 WeakPolarHBondContact O-CD 3.28Å |
| 215 | R | 91.3 | Very high | 88.9 | Confident | 137 Ų | 137 | 54.7 Ų | 54.7 | 52% | 0.517 | 30% | 0.297 | S | S | . | . | P | Polyproline II helix | trans | -101.5 | 146.4 | -177.1 | -64.7 | 179.4 | 175.8 | -89.5 | -4.1 | 111.3 | Q182 T213 G219 K220 D224 | Q182-R215 PolarHBondContact NE2-O 2.86Å; T213-R215 PolarHBondContact O-N 3.47Å; R215-G219 PolarHBondContact NH1-O 3.42Å; R215-K220 WeakPolarHBondContact CA-O 3.41Å; R215-D224 IonicContact NH1-OD2 3.98Å |
| 216 | T | 92.9 | Very high | 89.2 | Confident | 7 Ų | 7 | 54.7 Ų | 54.7 | 4% | 0.043 | 30% | 0.297 | C | S | . | . | P | Polyproline II helix | trans | -64.5 | 168.8 | 169 | 65.2 | 0 | 0 | 0 | 0 | 111.2 | G186 Y187 T218 G219 K220 L225 | G186-T216 WeakPolarHBondContact O-CA 3.4Å; Y187-T216 HydrophobicContact CD1-CG2 4.28Å; Y187-T216 HydrophobicContact CD2-CG2 3.81Å; Y187-T216 HydrophobicContact CE1-CG2 4.18Å; Y187-T216 HydrophobicContact CE2-CG2 3.69Å; Y187-T216 HydrophobicContact CG-CG2 4.1Å; T216-T218 PolarHBondContact O-N 3.46Å; T216-T218 VanDerWaalsContact O-N 3.13Å; T216-T218 PolarHBondContact OG1-N 2.91Å; T216-T218 PolarHBondContact OG1-OG1 2.83Å; T216-G219 WeakPolarHBondContact O-CA 3.27Å; T216-G219 PolarHBondContact O-N 2.95Å; T216-K220 PolarHBondContact N-O 2.88Å; T216-K220 PolarHBondContact OG1-N 3.34Å; T216-K220 PolarHBondContact OG1-O 3.38Å; T216-L225 HydrophobicContact CG2-CD1 3.91Å |
| 217 | K | 92.9 | Very high | 89.5 | Confident | 159 Ų | 159 | 59.6 Ų | 59.6 | 69% | 0.691 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | -20.9 | 173.2 | -70.8 | -174.4 | -179 | -178.6 | 0 | 113.4 | S184 K185 G219 | S184-K217 VanDerWaalsContact O-CD 3.29Å; S184-K217 WeakPolarHBondContact O-CD 3.14Å; S184-K217 WeakPolarHBondContact O-CE 3.45Å; S184-K217 PolarHBondContact O-NZ 3.11Å; K185-K217 WeakPolarHBondContact O-CB 3.47Å; K185-K217 WeakPolarHBondContact O-CG 3.29Å; K185-K217 PolarHBondContact O-N 3.22Å; K217-G219 PolarHBondContact O-N 2.96Å |
| 218 | T | 91.1 | Very high | 89.8 | Confident | 104 Ų | 104 | 57.5 Ų | 57.5 | 64% | 0.638 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | 5 | 172.7 | 58.1 | 0 | 0 | 0 | 0 | 113.1 | T216 K220 | T216-T218 PolarHBondContact O-N 3.46Å; T216-T218 VanDerWaalsContact O-N 3.13Å; T216-T218 PolarHBondContact OG1-N 2.91Å; T216-T218 PolarHBondContact OG1-OG1 2.83Å; T218-K220 VanDerWaalsContact C-N 3.29Å; T218-K220 PolarHBondContact O-N 3.3Å |
| 219 | G | 90.9 | Very high | 90.3 | Very high | 36 Ų | 36 | 58.8 Ų | 58.8 | 37% | 0.371 | 31% | 0.314 | S | S | . | . | trans | 77.4 | 9.1 | 179 | 0 | 0 | 0 | 0 | 0 | 114.4 | R215 T216 K217 | R215-G219 PolarHBondContact NH1-O 3.42Å; T216-G219 WeakPolarHBondContact O-CA 3.27Å; T216-G219 PolarHBondContact O-N 2.95Å; K217-G219 PolarHBondContact O-N 2.96Å | ||
| 220 | K | 91.4 | Very high | 90.8 | Very high | 81 Ų | 81 | 66.6 Ų | 66.6 | 35% | 0.352 | 33% | 0.328 | S | S | . | . | trans | -84.7 | 129.2 | -176.7 | -61.6 | -68.3 | 176.7 | 178.6 | 0 | 110.8 | R215 T216 T218 D224 L225 M228 | R215-K220 WeakPolarHBondContact CA-O 3.41Å; T216-K220 PolarHBondContact N-O 2.88Å; T216-K220 PolarHBondContact OG1-N 3.34Å; T216-K220 PolarHBondContact OG1-O 3.38Å; T218-K220 VanDerWaalsContact C-N 3.29Å; T218-K220 PolarHBondContact O-N 3.3Å; K220-D224 HydrophobicContact CB-CB 4.25Å; K220-D224 HydrophobicContact CD-CB 3.98Å; K220-L225 HydrophobicContact CB-CD2 3.87Å; K220-L225 HydrophobicContact CB-CG 4.14Å; K220-L225 HydrophobicContact CG-CD2 4.45Å; K220-M228 HydrophobicContact CD-CE 3.68Å; K220-M228 HydrophobicContact CG-CE 3.92Å | ||
| 221 | S | 92.3 | Very high | 90.9 | Very high | 13 Ų | 13 | 68.6 Ų | 68.6 | 9% | 0.091 | 34% | 0.336 | C | S | . | . | trans | -74.1 | 160.7 | 169 | 83 | 0 | 0 | 0 | 0 | 110.6 | A223 D224 L225 | S221-A223 PolarHBondContact O-N 3.3Å; S221-A223 PolarHBondContact OG-N 2.98Å; S221-D224 PolarHBondContact N-OD2 3.13Å; S221-D224 WeakPolarHBondContact O-CB 3.28Å; S221-D224 PolarHBondContact O-N 3.5Å; S221-D224 PolarHBondContact OG-N 2.92Å; S221-D224 VanDerWaalsContact OG-N 3.07Å; S221-D224 PolarHBondContact OG-OD1 2.82Å; S221-D224 PolarHBondContact OG-OD2 2.91Å; S221-L225 WeakPolarHBondContact O-CG 3.42Å; S221-L225 PolarHBondContact O-N 2.91Å | ||
| 222 | P | 90.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 71.3 Ų | 71.3 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -54.3 | -35.9 | 170.9 | -26.1 | 35.7 | 0 | 0 | 0 | 112.5 | L190 V194 K212 I214 L225 A226 L238 | L190-P222 HydrophobicContact CD2-CB 4.36Å; L190-P222 HydrophobicContact CD2-CG 4.23Å; L190-P222 HydrophobicContact CG-CB 4.47Å; V194-P222 WeakPolarHBondContact CG1-O 3.2Å; V194-P222 HydrophobicContact CG2-CB 4.35Å; K212-P222 VanDerWaalsContact O-CD 3.22Å; K212-P222 WeakPolarHBondContact O-CD 3.46Å; I214-P222 WeakPolarHBondContact O-CD 3.28Å; P222-L225 PolarHBondContact O-N 2.84Å; P222-A226 PolarHBondContact O-N 3.36Å; P222-L238 HydrophobicContact CB-CD1 4.07Å; P222-L238 HydrophobicContact CB-CD2 4.48Å; P222-L238 WeakPolarHBondContact O-CD1 3.46Å |
| 223 | A | 91.6 | Very high | 90.8 | Very high | 30 Ų | 30 | 71.7 Ų | 71.7 | 25% | 0.248 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -66.5 | -43 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | S221 L225 A226 E227 L238 | S221-A223 PolarHBondContact O-N 3.3Å; S221-A223 PolarHBondContact OG-N 2.98Å; A223-L225 VanDerWaalsContact C-N 3.26Å; A223-L225 PolarHBondContact O-N 3.13Å; A223-A226 WeakPolarHBondContact O-CB 3.26Å; A223-A226 PolarHBondContact O-N 3.47Å; A223-A226 VanDerWaalsContact O-N 3.13Å; A223-E227 PolarHBondContact O-N 3.4Å; A223-L238 HydrophobicContact CB-CB 4.24Å |
| 224 | D | 92.1 | Very high | 90.9 | Very high | 53 Ų | 53 | 67.1 Ų | 67.1 | 28% | 0.283 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62.2 | -37.1 | 176.8 | -49.1 | -12.3 | 0 | 0 | 0 | 110.9 | R215 K220 S221 M228 | R215-D224 IonicContact NH1-OD2 3.98Å; K220-D224 HydrophobicContact CB-CB 4.25Å; K220-D224 HydrophobicContact CD-CB 3.98Å; S221-D224 PolarHBondContact N-OD2 3.13Å; S221-D224 WeakPolarHBondContact O-CB 3.28Å; S221-D224 PolarHBondContact O-N 3.5Å; S221-D224 PolarHBondContact OG-N 2.92Å; S221-D224 VanDerWaalsContact OG-N 3.07Å; S221-D224 PolarHBondContact OG-OD1 2.82Å; S221-D224 PolarHBondContact OG-OD2 2.91Å; D224-M228 VanDerWaalsContact O-CB 3.26Å; D224-M228 WeakPolarHBondContact O-CB 3.43Å; D224-M228 PolarHBondContact O-N 2.89Å |
| 225 | L | 91.5 | Very high | 91 | Very high | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -66 | -43.4 | 174.7 | -66.4 | 175 | 0 | 0 | 0 | 111 | Y187 V194 T216 K220 S221 P222 A223 E227 M228 F229 | Y187-L225 HydrophobicContact CD1-CD1 4.25Å; Y187-L225 HydrophobicContact CE1-CD1 3.7Å; Y187-L225 HydrophobicContact CE1-CD2 4.32Å; V194-L225 HydrophobicContact CG1-CB 3.98Å; T216-L225 HydrophobicContact CG2-CD1 3.91Å; K220-L225 HydrophobicContact CB-CD2 3.87Å; K220-L225 HydrophobicContact CB-CG 4.14Å; K220-L225 HydrophobicContact CG-CD2 4.45Å; S221-L225 WeakPolarHBondContact O-CG 3.42Å; S221-L225 PolarHBondContact O-N 2.91Å; P222-L225 PolarHBondContact O-N 2.84Å; A223-L225 VanDerWaalsContact C-N 3.26Å; A223-L225 PolarHBondContact O-N 3.13Å; L225-E227 VanDerWaalsContact C-N 3.29Å; L225-E227 PolarHBondContact O-N 3.21Å; L225-M228 PolarHBondContact O-N 3.26Å; L225-F229 HydrophobicContact CB-CD2 4.32Å; L225-F229 HydrophobicContact CB-CE2 4.43Å; L225-F229 HydrophobicContact CD2-CE2 4.07Å; L225-F229 WeakPolarHBondContact O-CD2 3.45Å; L225-F229 PolarHBondContact O-N 3.04Å |
| 226 | A | 92.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -60 | -40.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | V194 P222 A223 R230 H231 I234 A235 L238 | V194-A226 HydrophobicContact CG1-CB 3.63Å; P222-A226 PolarHBondContact O-N 3.36Å; A223-A226 WeakPolarHBondContact O-CB 3.26Å; A223-A226 PolarHBondContact O-N 3.47Å; A223-A226 VanDerWaalsContact O-N 3.13Å; A226-R230 PolarHBondContact O-N 3.45Å; A226-R230 VanDerWaalsContact O-N 3.12Å; A226-H231 PolarHBondContact O-N 3.39Å; A226-I234 HydrophobicContact CB-CB 4.22Å; A226-I234 HydrophobicContact CB-CG2 3.88Å; A226-A235 HydrophobicContact CB-CB 3.78Å; A226-L238 HydrophobicContact CB-CD1 4.1Å |
| 227 | E | 92 | Very high | 90.2 | Very high | 141 Ų | 141 | 67.9 Ų | 67.9 | 66% | 0.659 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -67.7 | -45 | 174.1 | -69.2 | -177.7 | 178 | 0 | 0 | 112.2 | A223 L225 F229 R230 A235 | A223-E227 PolarHBondContact O-N 3.4Å; L225-E227 VanDerWaalsContact C-N 3.29Å; L225-E227 PolarHBondContact O-N 3.21Å; E227-F229 VanDerWaalsContact C-N 3.35Å; E227-F229 PolarHBondContact O-N 2.85Å; E227-R230 PolarHBondContact O-N 3.39Å; E227-A235 HydrophobicContact CG-CB 4.2Å |
| 228 | M | 91.8 | Very high | 89.8 | Confident | 99 Ų | 99 | 60.7 Ų | 60.7 | 49% | 0.488 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59.3 | -43.7 | 179.4 | -175.3 | -175.9 | -56.8 | 0 | 0 | 112.3 | K220 D224 L225 R230 | K220-M228 HydrophobicContact CD-CE 3.68Å; K220-M228 HydrophobicContact CG-CE 3.92Å; D224-M228 VanDerWaalsContact O-CB 3.26Å; D224-M228 WeakPolarHBondContact O-CB 3.43Å; D224-M228 PolarHBondContact O-N 2.89Å; L225-M228 PolarHBondContact O-N 3.26Å; M228-R230 VanDerWaalsContact C-N 3.27Å; M228-R230 PolarHBondContact O-N 3.46Å |
| 229 | F | 90.9 | Very high | 89.2 | Confident | 77 Ų | 77 | 58.7 Ų | 58.7 | 34% | 0.338 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.8 | 3.7 | 177.5 | -66.4 | -68.9 | 0 | 0 | 0 | 113.4 | Q195 L225 E227 H231 | Q195-F229 HydrophobicContact CB-CD2 4.32Å; Q195-F229 HydrophobicContact CB-CE2 4Å; Q195-F229 HydrophobicContact CG-CD2 4.3Å; Q195-F229 HydrophobicContact CG-CE1 4.32Å; Q195-F229 HydrophobicContact CG-CE2 3.73Å; Q195-F229 HydrophobicContact CG-CZ 3.76Å; L225-F229 HydrophobicContact CB-CD2 4.32Å; L225-F229 HydrophobicContact CB-CE2 4.43Å; L225-F229 HydrophobicContact CD2-CE2 4.07Å; L225-F229 WeakPolarHBondContact O-CD2 3.45Å; L225-F229 PolarHBondContact O-N 3.04Å; E227-F229 VanDerWaalsContact C-N 3.35Å; E227-F229 PolarHBondContact O-N 2.85Å; F229-H231 VanDerWaalsContact C-N 3.28Å; F229-H231 VanDerWaalsContact CB-CD2 3.47Å; F229-H231 WeakPolarHBondContact CB-CD2 3.38Å; F229-H231 PolarHBondContact O-N 3.29Å |
| 230 | R | 91.1 | Very high | 88.1 | Confident | 215 Ų | 215 | 60.3 Ų | 60.3 | 81% | 0.811 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.9 | 29.2 | 177.9 | -53.5 | -177.4 | 176.8 | -168.3 | -0.8 | 114.7 | A226 E227 M228 T232 | A226-R230 PolarHBondContact O-N 3.45Å; A226-R230 VanDerWaalsContact O-N 3.12Å; E227-R230 PolarHBondContact O-N 3.39Å; M228-R230 VanDerWaalsContact C-N 3.27Å; M228-R230 PolarHBondContact O-N 3.46Å; R230-T232 VanDerWaalsContact C-N 3.31Å; R230-T232 PolarHBondContact O-N 3.19Å |
| 231 | H | 90.8 | Very high | 86.3 | Confident | 52 Ų | 52 | 57.2 Ų | 57.2 | 24% | 0.241 | 29% | 0.291 | C | S | . | . | trans | -83.3 | 74.4 | 172.7 | -61.5 | -53.4 | 0 | 0 | 0 | 110.3 | V194 Q195 G197 A226 F229 Q233 I234 A235 | V194-H231 PolarHBondContact O-CD2 3.47Å; V194-H231 PolarHBondContact O-NE2 2.98Å; Q195-H231 PolarHBondContact O-NE2 2.81Å; G197-H231 WeakPolarHBondContact CA-CE1 3.44Å; G197-H231 WeakPolarHBondContact CA-NE2 3.3Å; G197-H231 PolarHBondContact N-NE2 3.39Å; A226-H231 PolarHBondContact O-N 3.39Å; F229-H231 VanDerWaalsContact C-N 3.28Å; F229-H231 VanDerWaalsContact CB-CD2 3.47Å; F229-H231 WeakPolarHBondContact CB-CD2 3.38Å; F229-H231 PolarHBondContact O-N 3.29Å; H231-Q233 VanDerWaalsContact C-N 3.28Å; H231-Q233 PolarHBondContact O-N 2.77Å; H231-I234 HydrophobicContact CB-CB 3.88Å; H231-I234 HydrophobicContact CB-CD1 3.88Å; H231-I234 HydrophobicContact CB-CG1 4.02Å; H231-I234 PolarHBondContact O-N 2.96Å; H231-I234 VanDerWaalsContact O-N 3.09Å; H231-A235 PolarHBondContact O-N 3.31Å | ||
| 232 | T | 87.7 | Confident | 83.8 | Confident | 114 Ų | 114 | 59.7 Ų | 59.7 | 70% | 0.699 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -56.4 | -39.1 | -172.2 | 54.8 | 0 | 0 | 0 | 0 | 113.5 | R230 A235 R236 | R230-T232 VanDerWaalsContact C-N 3.31Å; R230-T232 PolarHBondContact O-N 3.19Å; T232-A235 PolarHBondContact O-N 3.37Å; T232-R236 WeakPolarHBondContact O-CB 3.29Å; T232-R236 PolarHBondContact O-N 2.99Å |
| 233 | Q | 87 | Confident | 81.3 | Confident | 59 Ų | 59 | 68.6 Ų | 68.6 | 28% | 0.276 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -67.5 | -41.8 | 178.2 | -177.1 | 57.1 | 21.5 | 0 | 0 | 111.9 | E199 H231 R236 I237 | E199-Q233 WeakPolarHBondContact OE1-CB 3.46Å; E199-Q233 WeakPolarHBondContact OE1-CG 3.24Å; H231-Q233 VanDerWaalsContact C-N 3.28Å; H231-Q233 PolarHBondContact O-N 2.77Å; Q233-R236 VanDerWaalsContact CD-NH2 3.34Å; Q233-R236 VanDerWaalsContact NE2-NH2 3.19Å; Q233-R236 WeakPolarHBondContact O-CB 3.47Å; Q233-R236 PolarHBondContact O-N 3.28Å; Q233-I237 HydrophobicContact CG-CD1 4.19Å; Q233-I237 VanDerWaalsContact O-CG1 3.29Å; Q233-I237 WeakPolarHBondContact O-CG1 3.44Å; Q233-I237 PolarHBondContact O-N 3.47Å |
| 234 | I | 89.3 | Confident | 78.7 | Confident | 0 Ų | 0 | 74.8 Ų | 74.8 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.9 | -43.8 | 176.2 | -62 | -176.3 | 0 | 0 | 0 | 110.6 | V194 E199 V202 A226 H231 R236 I237 L238 | V194-I234 HydrophobicContact CB-CG2 4.28Å; V194-I234 HydrophobicContact CG1-CG2 4Å; V194-I234 HydrophobicContact CG2-CG2 3.75Å; E199-I234 HydrophobicContact CB-CG1 4.42Å; E199-I234 HydrophobicContact CG-CD1 3.99Å; E199-I234 HydrophobicContact CG-CG1 3.69Å; V202-I234 HydrophobicContact CG1-CG2 4.24Å; V202-I234 HydrophobicContact CG2-CD1 4.26Å; V202-I234 HydrophobicContact CG2-CG2 4.12Å; A226-I234 HydrophobicContact CB-CB 4.22Å; A226-I234 HydrophobicContact CB-CG2 3.88Å; H231-I234 HydrophobicContact CB-CB 3.88Å; H231-I234 HydrophobicContact CB-CD1 3.88Å; H231-I234 HydrophobicContact CB-CG1 4.02Å; H231-I234 PolarHBondContact O-N 2.96Å; H231-I234 VanDerWaalsContact O-N 3.09Å; I234-R236 VanDerWaalsContact C-N 3.26Å; I234-R236 PolarHBondContact O-N 3.32Å; I234-I237 PolarHBondContact O-N 2.9Å; I234-I237 VanDerWaalsContact O-N 3.13Å; I234-L238 HydrophobicContact CG2-CD1 3.81Å; I234-L238 HydrophobicContact CG2-CG 4.31Å; I234-L238 WeakPolarHBondContact O-CB 3.45Å; I234-L238 WeakPolarHBondContact O-CG 3.38Å; I234-L238 PolarHBondContact O-N 3.46Å |
| 235 | A | 88.4 | Confident | 75.9 | Confident | 15 Ų | 15 | 76.8 Ų | 76.8 | 12% | 0.124 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -57.8 | -43.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | A226 E227 H231 T232 L238 A239 | A226-A235 HydrophobicContact CB-CB 3.78Å; E227-A235 HydrophobicContact CG-CB 4.2Å; H231-A235 PolarHBondContact O-N 3.31Å; T232-A235 PolarHBondContact O-N 3.37Å; A235-L238 PolarHBondContact O-N 3.18Å; A235-A239 VanDerWaalsContact O-CB 3.26Å; A235-A239 WeakPolarHBondContact O-CB 3.45Å; A235-A239 PolarHBondContact O-N 2.92Å |
| 236 | R | 85.1 | Confident | 72.9 | Confident | 152 Ų | 152 | 80 Ų | 80 | 57% | 0.574 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -63.2 | -42.5 | 175.1 | -172.2 | 170 | 66.5 | 131.6 | -5.5 | 112.4 | T232 Q233 I234 S240 | T232-R236 WeakPolarHBondContact O-CB 3.29Å; T232-R236 PolarHBondContact O-N 2.99Å; Q233-R236 VanDerWaalsContact CD-NH2 3.34Å; Q233-R236 VanDerWaalsContact NE2-NH2 3.19Å; Q233-R236 WeakPolarHBondContact O-CB 3.47Å; Q233-R236 PolarHBondContact O-N 3.28Å; I234-R236 VanDerWaalsContact C-N 3.26Å; I234-R236 PolarHBondContact O-N 3.32Å; R236-S240 WeakPolarHBondContact O-CB 3.42Å; R236-S240 PolarHBondContact O-N 3.45Å; R236-S240 PolarHBondContact O-OG 2.86Å |
| 237 | I | 84.3 | Confident | 70.1 | Confident | 25 Ų | 25 | 86.5 Ų | 86.5 | 13% | 0.128 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -61.6 | -46.9 | 176.2 | -71.3 | 162.7 | 0 | 0 | 0 | 110.6 | V202 L203 L206 Q233 I234 S240 S241 | V202-I237 HydrophobicContact CG1-CG2 4.41Å; L203-I237 HydrophobicContact CD1-CD1 4.39Å; L203-I237 HydrophobicContact CD2-CD1 3.99Å; L203-I237 HydrophobicContact CD2-CG1 4.23Å; L203-I237 HydrophobicContact CD2-CG2 3.6Å; L203-I237 HydrophobicContact CG-CD1 4.11Å; L203-I237 HydrophobicContact CG-CG2 4.47Å; L206-I237 HydrophobicContact CD1-CG2 3.79Å; Q233-I237 HydrophobicContact CG-CD1 4.19Å; Q233-I237 VanDerWaalsContact O-CG1 3.29Å; Q233-I237 WeakPolarHBondContact O-CG1 3.44Å; Q233-I237 PolarHBondContact O-N 3.47Å; I234-I237 PolarHBondContact O-N 2.9Å; I234-I237 VanDerWaalsContact O-N 3.13Å; I237-S240 PolarHBondContact O-N 3.25Å; I237-S241 WeakPolarHBondContact O-CB 3.36Å; I237-S241 PolarHBondContact O-N 3.33Å; I237-S241 PolarHBondContact O-OG 3.01Å |
| 238 | L | 82.9 | Confident | 67.2 | Low | 9 Ų | 9 | 85.1 Ų | 85.1 | 5% | 0.047 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -67.1 | -38.5 | -179.5 | -68.5 | 170 | 0 | 0 | 0 | 112.2 | L190 V194 V202 L206 K212 P222 A223 A226 I234 A235 S241 | L190-L238 HydrophobicContact CD2-CD2 4.45Å; V194-L238 HydrophobicContact CG2-CD1 3.8Å; V202-L238 HydrophobicContact CG1-CD2 4.35Å; L206-L238 HydrophobicContact CD1-CD2 4.1Å; L206-L238 HydrophobicContact CD2-CD2 4.27Å; K212-L238 HydrophobicContact CB-CD2 4.31Å; P222-L238 HydrophobicContact CB-CD1 4.07Å; P222-L238 HydrophobicContact CB-CD2 4.48Å; P222-L238 WeakPolarHBondContact O-CD1 3.46Å; A223-L238 HydrophobicContact CB-CB 4.24Å; A226-L238 HydrophobicContact CB-CD1 4.1Å; I234-L238 HydrophobicContact CG2-CD1 3.81Å; I234-L238 HydrophobicContact CG2-CG 4.31Å; I234-L238 WeakPolarHBondContact O-CB 3.45Å; I234-L238 WeakPolarHBondContact O-CG 3.38Å; I234-L238 PolarHBondContact O-N 3.46Å; A235-L238 PolarHBondContact O-N 3.18Å; L238-S241 PolarHBondContact O-OG 2.94Å |
| 239 | A | 79.6 | Confident | 64.3 | Low | 61 Ų | 61 | 84.6 Ų | 84.6 | 50% | 0.504 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -69.3 | -42.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | A235 S241 S242 | A235-A239 VanDerWaalsContact O-CB 3.26Å; A235-A239 WeakPolarHBondContact O-CB 3.45Å; A235-A239 PolarHBondContact O-N 2.92Å; A239-S241 VanDerWaalsContact C-N 3.34Å; A239-S241 PolarHBondContact O-N 3.28Å; A239-S242 WeakPolarHBondContact O-CB 3.09Å; A239-S242 PolarHBondContact O-N 3.36Å; A239-S242 PolarHBondContact O-OG 2.94Å |
| 240 | S | 68.3 | Low | 61.3 | Low | 70 Ų | 70 | 86.3 Ų | 86.3 | 49% | 0.49 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -72.4 | -27.4 | -177 | -56.6 | 0 | 0 | 0 | 0 | 112.7 | R236 I237 S242 K243 | R236-S240 WeakPolarHBondContact O-CB 3.42Å; R236-S240 PolarHBondContact O-N 3.45Å; R236-S240 PolarHBondContact O-OG 2.86Å; I237-S240 PolarHBondContact O-N 3.25Å; S240-S242 PolarHBondContact O-N 3.39Å; S240-K243 PolarHBondContact O-N 3.06Å; S240-K243 VanDerWaalsContact O-N 3.1Å |
| 241 | S | 51.8 | Low | 58.8 | Low | 17 Ų | 17 | 81.7 Ų | 81.7 | 12% | 0.119 | 50% | 0.495 | C | S | . | . | G | 310 helix | trans | -68.2 | -2.5 | 175.5 | 66.8 | 0 | 0 | 0 | 0 | 113.5 | K212 I237 L238 A239 K243 L244 | K212-S241 WeakPolarHBondContact CD-OG 3.2Å; K212-S241 PolarHBondContact NZ-O 3.48Å; K212-S241 PolarHBondContact NZ-OG 3.06Å; I237-S241 WeakPolarHBondContact O-CB 3.36Å; I237-S241 PolarHBondContact O-N 3.33Å; I237-S241 PolarHBondContact O-OG 3.01Å; L238-S241 PolarHBondContact O-OG 2.94Å; A239-S241 VanDerWaalsContact C-N 3.34Å; A239-S241 PolarHBondContact O-N 3.28Å; S241-K243 PolarHBondContact O-N 2.93Å; S241-L244 PolarHBondContact O-N 3.26Å |
| 242 | S | 40.8 | Very low | 56.1 | Low | 64 Ų | 64 | 84.5 Ų | 84.5 | 45% | 0.448 | 52% | 0.52 | S | S | . | . | G | 310 helix | trans | -64.1 | -23.7 | 166.6 | 57.9 | 0 | 0 | 0 | 0 | 112.6 | K212 A239 S240 | K212-S242 VanDerWaalsContact NZ-N 3.15Å; A239-S242 WeakPolarHBondContact O-CB 3.09Å; A239-S242 PolarHBondContact O-N 3.36Å; A239-S242 PolarHBondContact O-OG 2.94Å; S240-S242 PolarHBondContact O-N 3.39Å |
| 243 | K | 38.8 | Very low | 54 | Low | 187 Ų | 187 | 82.1 Ų | 82.1 | 81% | 0.813 | 51% | 0.508 | S | S | * | . | G | 310 helix | trans | -88.8 | 1.2 | 174.7 | -74.1 | -176.6 | 176.7 | -178 | 0 | 114.8 | S240 S241 | S240-K243 PolarHBondContact O-N 3.06Å; S240-K243 VanDerWaalsContact O-N 3.1Å; S241-K243 PolarHBondContact O-N 2.93Å |
| 244 | L | 36.4 | Very low | 51.9 | Low | 161 Ų | 161 | 84.9 Ų | 84.9 | 84% | 0.843 | 52% | 0.522 | S | S | * | . | G | 310 helix | trans | -98.4 | -2.9 | 168.3 | -83.1 | 131.6 | 0 | 0 | 0 | 112.3 | S241 | S241-L244 PolarHBondContact O-N 3.26Š|
| 245 | S | 33.9 | Very low | 49.7 | Very low | 95 Ų | 95 | 91.2 Ų | 91.2 | 66% | 0.664 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -132.3 | 17.3 | 179.6 | 87.1 | 0 | 0 | 0 | 0 | 114.9 | ||
| 246 | A | 28.5 | Very low | 47.5 | Very low | 66 Ų | 66 | 96.3 Ų | 96.3 | 55% | 0.545 | 57% | 0.573 | S | S | . | * | trans | -132 | 108.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | P248 | A246-P248 VanDerWaalsContact O-CD 3.29Å; A246-P248 WeakPolarHBondContact O-CD 3.47Å | ||
| 247 | V | 32.6 | Very low | 45.6 | Very low | 138 Ų | 138 | 93.1 Ų | 93.1 | 84% | 0.836 | 57% | 0.571 | S | S | * | * | trans | -57.8 | 121 | 151.9 | 173.8 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 248 | P | 31.5 | Very low | 43.5 | Very low | 112 Ų | 112 | 95.5 Ų | 95.5 | 73% | 0.727 | 58% | 0.583 | S | S | * | * | trans | -85.6 | 110.4 | 155 | 29.8 | -17.5 | 0 | 0 | 0 | 107.3 | A246 | A246-P248 VanDerWaalsContact O-CD 3.29Å; A246-P248 WeakPolarHBondContact O-CD 3.47Å | ||
| 249 | A | 29.9 | Very low | 41.5 | Very low | 88 Ų | 88 | 97.7 Ų | 97.7 | 73% | 0.727 | 60% | 0.603 | S | S | * | * | trans | -64.5 | 123.2 | 141.8 | 0 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 250 | C | 28.6 | Very low | 39.8 | Very low | 112 Ų | 112 | 101.3 Ų | 101.3 | 76% | 0.757 | 61% | 0.608 | S | S | * | * | S | Bend | cis | -152.1 | 159.1 | 32 | -80.2 | 0 | 0 | 0 | 0 | 112.6 | ||
| 251 | S | 38.3 | Very low | 38.5 | Very low | 119 Ų | 119 | 102.9 Ų | 102.9 | 83% | 0.832 | 61% | 0.61 | S | S | * | * | trans | 69.5 | 69.4 | 151.2 | 74.7 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 252 | S | 35.1 | Very low | 37.7 | Very low | 110 Ų | 110 | 108.4 Ų | 108.4 | 77% | 0.769 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -156.3 | 126.5 | 131 | 55.8 | 0 | 0 | 0 | 0 | 108.9 | ||
| 253 | S | 43.3 | Very low | 37.8 | Very low | 64 Ų | 64 | 113.3 Ų | 113.3 | 45% | 0.448 | 65% | 0.645 | S | S | . | * | trans | -42.6 | 132.2 | -156.7 | -172.9 | 0 | 0 | 0 | 0 | 117.1 | E255 E256 | S253-E255 PolarHBondContact O-N 3.04Å; S253-E255 VanDerWaalsContact O-N 3.15Å; S253-E255 WeakPolarHBondContact OG-CB 3.42Å; S253-E255 PolarHBondContact OG-N 3.22Å; S253-E255 PolarHBondContact OG-OE2 3.42Å; S253-E256 PolarHBondContact O-N 3.08Å | ||
| 254 | M | 42.3 | Very low | 37.6 | Very low | 117 Ų | 117 | 108.6 Ų | 108.6 | 58% | 0.576 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -56.7 | -23.5 | 173.1 | -163.6 | 176.3 | -82.4 | 0 | 0 | 112.6 | E256 T257 L258 | M254-E256 VanDerWaalsContact C-N 3.34Å; M254-E256 PolarHBondContact O-N 2.88Å; M254-T257 PolarHBondContact O-N 3.2Å; M254-T257 PolarHBondContact O-OG1 2.85Å; M254-L258 PolarHBondContact O-N 3.31Å |
| 255 | E | 44 | Very low | 37.8 | Very low | 134 Ų | 134 | 105 Ų | 105 | 63% | 0.626 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -65.7 | -31.5 | 174.7 | -64.1 | 167.6 | 130.7 | 0 | 0 | 113 | S253 T257 L258 A259 | S253-E255 PolarHBondContact O-N 3.04Å; S253-E255 VanDerWaalsContact O-N 3.15Å; S253-E255 WeakPolarHBondContact OG-CB 3.42Å; S253-E255 PolarHBondContact OG-N 3.22Å; S253-E255 PolarHBondContact OG-OE2 3.42Å; E255-T257 VanDerWaalsContact C-N 3.34Å; E255-T257 PolarHBondContact O-N 3.12Å; E255-L258 PolarHBondContact O-N 2.96Å; E255-A259 WeakPolarHBondContact O-CB 3.46Å; E255-A259 PolarHBondContact O-N 3.05Å |
| 256 | E | 42.4 | Very low | 37.8 | Very low | 121 Ų | 121 | 104.2 Ų | 104.2 | 57% | 0.565 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -74.3 | -29.2 | -177.3 | -131.2 | -178 | -165.1 | 0 | 0 | 111.9 | S253 M254 K260 | S253-E256 PolarHBondContact O-N 3.08Å; M254-E256 VanDerWaalsContact C-N 3.34Å; M254-E256 PolarHBondContact O-N 2.88Å; E256-K260 WeakPolarHBondContact O-CB 3.45Å; E256-K260 WeakPolarHBondContact O-CG 3.14Å; E256-K260 PolarHBondContact O-N 3.37Å |
| 257 | T | 43.6 | Very low | 38.1 | Very low | 86 Ų | 86 | 107.6 Ų | 107.6 | 53% | 0.528 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -76.5 | -38.8 | 172.9 | 21.3 | 0 | 0 | 0 | 0 | 112.6 | M254 E255 L261 | M254-T257 PolarHBondContact O-N 3.2Å; M254-T257 PolarHBondContact O-OG1 2.85Å; E255-T257 VanDerWaalsContact C-N 3.34Å; E255-T257 PolarHBondContact O-N 3.12Å; T257-L261 PolarHBondContact O-N 3.13Å |
| 258 | L | 40.4 | Very low | 38.5 | Very low | 74 Ų | 74 | 106.2 Ų | 106.2 | 39% | 0.387 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -71.4 | -42.5 | 175.8 | -72.4 | 169.6 | 0 | 0 | 0 | 111.3 | M254 E255 K260 L261 F262 | M254-L258 PolarHBondContact O-N 3.31Å; E255-L258 PolarHBondContact O-N 2.96Å; L258-K260 VanDerWaalsContact C-N 3.27Å; L258-K260 PolarHBondContact O-N 3.24Å; L258-L261 PolarHBondContact O-N 3.23Å; L258-L261 VanDerWaalsContact O-N 3.14Å; L258-F262 WeakPolarHBondContact O-CD2 3.27Å; L258-F262 PolarHBondContact O-N 2.99Å |
| 259 | A | 42.3 | Very low | 38.7 | Very low | 56 Ų | 56 | 106 Ų | 106 | 46% | 0.463 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -62.9 | -31.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | E255 K263 | E255-A259 WeakPolarHBondContact O-CB 3.46Å; E255-A259 PolarHBondContact O-N 3.05Å; A259-K263 WeakPolarHBondContact O-CB 3.19Å; A259-K263 PolarHBondContact O-N 3.38Å |
| 260 | K | 43.3 | Very low | 38.9 | Very low | 137 Ų | 137 | 106.7 Ų | 106.7 | 60% | 0.596 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -69.9 | -37.5 | 173.1 | -84.1 | 171.8 | -177.8 | 161.1 | 0 | 112.7 | E256 L258 T264 | E256-K260 WeakPolarHBondContact O-CB 3.45Å; E256-K260 WeakPolarHBondContact O-CG 3.14Å; E256-K260 PolarHBondContact O-N 3.37Å; L258-K260 VanDerWaalsContact C-N 3.27Å; L258-K260 PolarHBondContact O-N 3.24Å; K260-T264 WeakPolarHBondContact O-CG2 3.44Å; K260-T264 PolarHBondContact O-N 3.12Å; K260-T264 PolarHBondContact O-OG1 2.83Å |
| 261 | L | 40.3 | Very low | 39.3 | Very low | 103 Ų | 103 | 106.3 Ų | 106.3 | 54% | 0.539 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -70.2 | -38.3 | 176.3 | -84.6 | 160.6 | 0 | 0 | 0 | 112.8 | T257 L258 T264 N265 | T257-L261 PolarHBondContact O-N 3.13Å; L258-L261 PolarHBondContact O-N 3.23Å; L258-L261 VanDerWaalsContact O-N 3.14Å; L261-T264 PolarHBondContact O-OG1 3.27Å; L261-T264 VanDerWaalsContact O-OG1 3.06Å; L261-N265 PolarHBondContact O-N 3.13Å; L261-N265 PolarHBondContact O-ND2 2.99Å |
| 262 | F | 36 | Very low | 39.3 | Very low | 133 Ų | 133 | 106.4 Ų | 106.4 | 58% | 0.583 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -75.5 | -32.7 | 176.2 | -74.8 | -70.1 | 0 | 0 | 0 | 113 | L258 N265 S266 | L258-F262 WeakPolarHBondContact O-CD2 3.27Å; L258-F262 PolarHBondContact O-N 2.99Å; F262-N265 PolarHBondContact O-N 3.35Å; F262-S266 PolarHBondContact O-N 2.79Å |
| 263 | K | 41.5 | Very low | 39.3 | Very low | 166 Ų | 166 | 109.2 Ų | 109.2 | 72% | 0.722 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66.8 | -39.8 | 173.5 | -105.6 | 176.3 | 173.3 | 172.1 | 0 | 113.1 | A259 N265 | A259-K263 WeakPolarHBondContact O-CB 3.19Å; A259-K263 PolarHBondContact O-N 3.38Å; K263-N265 VanDerWaalsContact C-N 3.29Å; K263-N265 PolarHBondContact O-N 2.73Å |
| 264 | T | 36 | Very low | 39 | Very low | 88 Ų | 88 | 112.2 Ų | 112.2 | 54% | 0.54 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -70.2 | -25.9 | 179.3 | 46.4 | 0 | 0 | 0 | 0 | 113.2 | K260 L261 | K260-T264 WeakPolarHBondContact O-CG2 3.44Å; K260-T264 PolarHBondContact O-N 3.12Å; K260-T264 PolarHBondContact O-OG1 2.83Å; L261-T264 PolarHBondContact O-OG1 3.27Å; L261-T264 VanDerWaalsContact O-OG1 3.06Å |
| 265 | N | 40.3 | Very low | 38.9 | Very low | 87 Ų | 87 | 110.4 Ų | 110.4 | 47% | 0.465 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -89.4 | -17.1 | 179.5 | -74.7 | -31.8 | 0 | 0 | 0 | 113.7 | L261 F262 K263 D267 L269 | L261-N265 PolarHBondContact O-N 3.13Å; L261-N265 PolarHBondContact O-ND2 2.99Å; F262-N265 PolarHBondContact O-N 3.35Å; K263-N265 VanDerWaalsContact C-N 3.29Å; K263-N265 PolarHBondContact O-N 2.73Å; N265-D267 VanDerWaalsContact C-N 3.34Å; N265-L269 PolarHBondContact O-N 3.49Å |
| 266 | S | 33.2 | Very low | 39 | Very low | 77 Ų | 77 | 109.1 Ų | 109.1 | 54% | 0.538 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -67.2 | -32.6 | 174.2 | -178.3 | 0 | 0 | 0 | 0 | 113 | F262 | F262-S266 PolarHBondContact O-N 2.79Å |
| 267 | D | 36.2 | Very low | 39.1 | Very low | 138 Ų | 138 | 112.9 Ų | 112.9 | 74% | 0.738 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -11.2 | -176.8 | -75 | -24.5 | 0 | 0 | 0 | 113.5 | N265 | N265-D267 VanDerWaalsContact C-N 3.34Š|
| 268 | V | 39.1 | Very low | 39.2 | Very low | 109 Ų | 109 | 113 Ų | 113 | 66% | 0.661 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.3 | -25.5 | 179.9 | -177.7 | 0 | 0 | 0 | 0 | 112.4 | ||
| 269 | L | 36.7 | Very low | 39.9 | Very low | 107 Ų | 107 | 114.3 Ų | 114.3 | 56% | 0.56 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -92.5 | -6.5 | -174.1 | -95.9 | 138.8 | 0 | 0 | 0 | 115.8 | N265 S271 | N265-L269 PolarHBondContact O-N 3.49Å; L269-S271 PolarHBondContact O-N 3.24Å; L269-S271 VanDerWaalsContact O-N 3.08Å |
| 270 | S | 34.1 | Very low | 40.4 | Very low | 103 Ų | 103 | 116.4 Ų | 116.4 | 72% | 0.72 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | 4.5 | -177.7 | 65.1 | 0 | 0 | 0 | 0 | 115.5 | ||
| 271 | S | 36.4 | Very low | 40.9 | Very low | 104 Ų | 104 | 110.4 Ų | 110.4 | 73% | 0.727 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.4 | 1.2 | 178.2 | 75.5 | 0 | 0 | 0 | 0 | 116.2 | L269 | L269-S271 PolarHBondContact O-N 3.24Å; L269-S271 VanDerWaalsContact O-N 3.08Å |
| 272 | V | 39 | Very low | 41.6 | Very low | 121 Ų | 121 | 109.7 Ų | 109.7 | 73% | 0.733 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -135.7 | 34 | -172.5 | -159 | 0 | 0 | 0 | 0 | 114.7 | ||
| 273 | E | 35.8 | Very low | 42.8 | Very low | 169 Ų | 169 | 109.9 Ų | 109.9 | 79% | 0.79 | 62% | 0.615 | S | S | * | * | trans | -121.8 | 39.7 | -170.7 | -144 | 174.8 | -153.1 | 0 | 0 | 116.2 | ||||
| 274 | S | 36.6 | Very low | 43.8 | Very low | 126 Ų | 126 | 103.3 Ų | 103.3 | 88% | 0.881 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -132.4 | 7.9 | 174.5 | 53.9 | 0 | 0 | 0 | 0 | 117 | ||
| 275 | A | 39.7 | Very low | 45 | Very low | 79 Ų | 79 | 99.1 Ų | 99.1 | 65% | 0.653 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -107.6 | -4.4 | -172.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 276 | T | 46.3 | Very low | 45.8 | Very low | 108 Ų | 108 | 100.9 Ų | 100.9 | 66% | 0.663 | 57% | 0.567 | S | S | * | * | trans | -107.4 | 7.2 | -162.5 | 52.8 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 277 | K | 43.8 | Very low | 46.7 | Very low | 200 Ų | 200 | 100.4 Ų | 100.4 | 87% | 0.87 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -75.4 | -22.5 | -171.1 | -86.2 | -174.5 | 176.3 | -177.4 | 0 | 116.2 | ||
| 278 | L | 46.6 | Very low | 47.7 | Very low | 88 Ų | 88 | 96 Ų | 96 | 46% | 0.461 | 55% | 0.551 | S | S | . | * | S | Bend | trans | -109.5 | -26.4 | -172.7 | -93.3 | 151.1 | 0 | 0 | 0 | 114 | E280 E282 A298 | L278-E280 PolarHBondContact O-N 2.92Å; L278-E282 VanDerWaalsContact O-CB 3.3Å; L278-E282 WeakPolarHBondContact O-CB 3.29Å; L278-E282 PolarHBondContact O-N 3.07Å; L278-A298 HydrophobicContact CD2-CB 3.99Å |
| 279 | D | 54.1 | Low | 48.6 | Very low | 102 Ų | 102 | 97.6 Ų | 97.6 | 55% | 0.545 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.2 | -34.7 | -167 | -63 | -7.2 | 0 | 0 | 0 | 114 | L283 | D279-L283 VanDerWaalsContact O-CB 3.3Å; D279-L283 WeakPolarHBondContact O-CB 3.38Å; D279-L283 PolarHBondContact O-N 3.09Å; D279-L283 VanDerWaalsContact O-N 3.13Å |
| 280 | E | 53.1 | Low | 50.1 | Low | 99 Ų | 99 | 92.7 Ų | 92.7 | 46% | 0.463 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -78.8 | -37.1 | -174.5 | -59.8 | -159.6 | 152.3 | 0 | 0 | 113.6 | L278 L284 K412 | L278-E280 PolarHBondContact O-N 2.92Å; E280-L284 PolarHBondContact O-N 3.49Å; E280-K412 IonicContact OE1-NZ 3.7Å; E280-K412 PolarHBondContact OE1-NZ 3.41Å; E280-K412 IonicContact OE2-NZ 2.87Å; E280-K412 PolarHBondContact OE2-NZ 3.07Å |
| 281 | L | 54 | Low | 51.4 | Low | 12 Ų | 12 | 89.1 Ų | 89.1 | 6% | 0.063 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -72.3 | -43.1 | 178 | 177.8 | 66.6 | 0 | 0 | 0 | 110.6 | L283 L284 L285 M297 I302 W304 L307 | L281-L283 VanDerWaalsContact C-N 3.31Å; L281-L283 PolarHBondContact O-N 3.11Å; L281-L284 PolarHBondContact O-N 3.27Å; L281-L285 HydrophobicContact CD1-CD1 4.15Å; L281-L285 HydrophobicContact CD1-CG 4.38Å; L281-L285 HydrophobicContact CG-CD1 4Å; L281-L285 WeakPolarHBondContact O-CG 3.31Å; L281-L285 PolarHBondContact O-N 2.6Å; L281-M297 HydrophobicContact CD1-SD 4.01Å; L281-M297 HydrophobicContact CD2-CB 4.04Å; L281-M297 HydrophobicContact CD2-SD 4.15Å; L281-M297 HydrophobicContact CG-SD 4.39Å; L281-I302 VanDerWaalsContact CD2-O 3.23Å; L281-I302 WeakPolarHBondContact CD2-O 3.49Å; L281-W304 HydrophobicContact CB-CE3 4.2Å; L281-W304 HydrophobicContact CD1-CE3 3.66Å; L281-W304 HydrophobicContact CD1-CZ3 3.85Å; L281-L307 HydrophobicContact CD1-CD2 3.58Å |
| 282 | E | 55.3 | Low | 53.1 | Low | 88 Ų | 88 | 89.5 Ų | 89.5 | 41% | 0.411 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.9 | -40.9 | 175.5 | -175.9 | 164.7 | -167.6 | 0 | 0 | 111.2 | L278 L284 L285 H286 T294 | L278-E282 VanDerWaalsContact O-CB 3.3Å; L278-E282 WeakPolarHBondContact O-CB 3.29Å; L278-E282 PolarHBondContact O-N 3.07Å; E282-L284 PolarHBondContact O-N 2.9Å; E282-L285 PolarHBondContact O-N 2.89Å; E282-H286 WeakPolarHBondContact O-CB 3.2Å; E282-H286 PolarHBondContact O-N 2.69Å; E282-T294 HydrophobicContact CB-CG2 3.65Å; E282-T294 HydrophobicContact CG-CG2 3.58Å |
| 283 | L | 59.9 | Low | 54.6 | Low | 137 Ų | 137 | 83.8 Ų | 83.8 | 72% | 0.717 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -63.4 | -41.1 | 177.2 | -153.1 | 88.8 | 0 | 0 | 0 | 112.9 | D279 L281 G287 | D279-L283 VanDerWaalsContact O-CB 3.3Å; D279-L283 WeakPolarHBondContact O-CB 3.38Å; D279-L283 PolarHBondContact O-N 3.09Å; D279-L283 VanDerWaalsContact O-N 3.13Å; L281-L283 VanDerWaalsContact C-N 3.31Å; L281-L283 PolarHBondContact O-N 3.11Å; L283-G287 PolarHBondContact O-N 3Å |
| 284 | L | 62.5 | Low | 56.1 | Low | 28 Ų | 28 | 76 Ų | 76 | 15% | 0.147 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -67.5 | -50.8 | 176.7 | 178.6 | 109.5 | 0 | 0 | 0 | 111.2 | E280 L281 E282 H286 G287 L288 W304 L307 M336 | E280-L284 PolarHBondContact O-N 3.49Å; L281-L284 PolarHBondContact O-N 3.27Å; E282-L284 PolarHBondContact O-N 2.9Å; L284-H286 PolarHBondContact O-N 3.07Å; L284-G287 PolarHBondContact O-N 3.24Å; L284-G287 VanDerWaalsContact O-N 3.13Å; L284-L288 HydrophobicContact CD2-CD1 3.88Å; L284-L288 HydrophobicContact CG-CD1 4.1Å; L284-L288 WeakPolarHBondContact O-CG 2.97Å; L284-L288 PolarHBondContact O-N 3.07Å; L284-W304 HydrophobicContact CB-CH2 3.59Å; L284-W304 HydrophobicContact CB-CZ3 3.63Å; L284-W304 HydrophobicContact CD1-CH2 3.46Å; L284-W304 VanDerWaalsContact CD1-CH2 3.46Å; L284-W304 HydrophobicContact CD1-CZ2 4.33Å; L284-W304 HydrophobicContact CD1-CZ3 4.3Å; L284-W304 HydrophobicContact CD2-CH2 3.64Å; L284-W304 HydrophobicContact CD2-CZ3 3.68Å; L284-W304 HydrophobicContact CG-CH2 3.65Å; L284-W304 HydrophobicContact CG-CZ3 3.99Å; L284-L307 HydrophobicContact CD2-CD2 4.31Å; L284-M336 HydrophobicContact CD1-CE 3.7Å |
| 285 | L | 61.4 | Low | 57.7 | Low | 0 Ų | 0 | 75.2 Ų | 75.2 | 0% | 0 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -61.7 | -37.3 | -178.6 | -66.3 | 170.8 | 0 | 0 | 0 | 110.6 | L281 E282 L288 N289 L290 L293 M297 V329 | L281-L285 HydrophobicContact CD1-CD1 4.15Å; L281-L285 HydrophobicContact CD1-CG 4.38Å; L281-L285 HydrophobicContact CG-CD1 4Å; L281-L285 WeakPolarHBondContact O-CG 3.31Å; L281-L285 PolarHBondContact O-N 2.6Å; E282-L285 PolarHBondContact O-N 2.89Å; L285-L288 PolarHBondContact O-N 3.42Å; L285-N289 PolarHBondContact O-N 2.92Å; L285-L290 CarbonylContact O-C 3.58Å; L285-L290 WeakPolarHBondContact O-CA 3.47Å; L285-L290 PolarHBondContact O-N 3.01Å; L285-L293 HydrophobicContact CD1-CB 4.27Å; L285-L293 HydrophobicContact CD2-CB 4.3Å; L285-M297 HydrophobicContact CD1-CG 4.43Å; L285-M297 HydrophobicContact CD1-SD 3.47Å; L285-M297 WeakPolarHBondContact CD1-SD 3.28Å; L285-M297 HydrophobicContact CD2-CE 4.39Å; L285-M297 HydrophobicContact CD2-SD 4.11Å; L285-M297 HydrophobicContact CG-SD 4.32Å; L285-V329 HydrophobicContact CD2-CG2 4.17Å |
| 286 | H | 58.3 | Low | 59.3 | Low | 123 Ų | 123 | 73.5 Ų | 73.5 | 57% | 0.569 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -69.8 | -38.6 | 176.2 | -149.6 | 8.4 | 0 | 0 | 0 | 112.3 | E282 L284 L288 N289 | E282-H286 WeakPolarHBondContact O-CB 3.2Å; E282-H286 PolarHBondContact O-N 2.69Å; L284-H286 PolarHBondContact O-N 3.07Å; H286-L288 VanDerWaalsContact C-N 3.25Å; H286-L288 PolarHBondContact O-N 2.8Å; H286-N289 PolarHBondContact O-N 2.89Å |
| 287 | G | 52.3 | Low | 60.5 | Low | 68 Ų | 68 | 68.4 Ų | 68.4 | 70% | 0.701 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -63.8 | -26.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | L283 L284 N289 | L283-G287 PolarHBondContact O-N 3Å; L284-G287 PolarHBondContact O-N 3.24Å; L284-G287 VanDerWaalsContact O-N 3.13Å; G287-N289 VanDerWaalsContact C-N 3.31Å |
| 288 | L | 55.8 | Low | 61.7 | Low | 44 Ų | 44 | 60.8 Ų | 60.8 | 23% | 0.23 | 33% | 0.333 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.5 | 3.7 | 172.9 | -64.8 | 174.6 | 0 | 0 | 0 | 113.5 | L284 L285 H286 L290 V329 A332 | L284-L288 HydrophobicContact CD2-CD1 3.88Å; L284-L288 HydrophobicContact CG-CD1 4.1Å; L284-L288 WeakPolarHBondContact O-CG 2.97Å; L284-L288 PolarHBondContact O-N 3.07Å; L285-L288 PolarHBondContact O-N 3.42Å; H286-L288 VanDerWaalsContact C-N 3.25Å; H286-L288 PolarHBondContact O-N 2.8Å; L288-L290 VanDerWaalsContact C-N 3.27Å; L288-L290 HydrophobicContact CB-CD1 4.08Å; L288-L290 HydrophobicContact CB-CG 4.16Å; L288-L290 PolarHBondContact O-N 2.86Å; L288-V329 HydrophobicContact CD1-CG2 4.13Å; L288-A332 HydrophobicContact CD1-CB 3.96Å; L288-A332 HydrophobicContact CD2-CB 4Å |
| 289 | N | 58.1 | Low | 63 | Low | 144 Ų | 144 | 64.4 Ų | 64.4 | 77% | 0.77 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.7 | 32.3 | -171.3 | -89.3 | -13.3 | 0 | 0 | 0 | 113.9 | L285 H286 G287 | L285-N289 PolarHBondContact O-N 2.92Å; H286-N289 PolarHBondContact O-N 2.89Å; G287-N289 VanDerWaalsContact C-N 3.31Å |
| 290 | L | 69.3 | Low | 63.8 | Low | 4 Ų | 4 | 63.3 Ų | 63.3 | 2% | 0.021 | 34% | 0.342 | C | S | . | . | trans | -118.3 | 33.2 | -178.3 | -59.7 | 177.4 | 0 | 0 | 0 | 112.4 | L285 L288 Y292 L293 D325 K328 V329 | L285-L290 CarbonylContact O-C 3.58Å; L285-L290 WeakPolarHBondContact O-CA 3.47Å; L285-L290 PolarHBondContact O-N 3.01Å; L288-L290 VanDerWaalsContact C-N 3.27Å; L288-L290 HydrophobicContact CB-CD1 4.08Å; L288-L290 HydrophobicContact CB-CG 4.16Å; L288-L290 PolarHBondContact O-N 2.86Å; L290-Y292 HydrophobicContact CD2-CE1 4.03Å; L290-Y292 PolarHBondContact O-N 2.79Å; L290-Y292 VanDerWaalsContact O-N 3.08Å; L290-L293 HydrophobicContact CB-CD1 3.8Å; L290-L293 HydrophobicContact CB-CG 4.16Å; L290-L293 HydrophobicContact CD1-CD1 4.02Å; L290-L293 HydrophobicContact CD2-CD1 4.5Å; L290-L293 HydrophobicContact CG-CD1 4.32Å; L290-L293 VanDerWaalsContact O-CB 3.28Å; L290-L293 WeakPolarHBondContact O-CB 3.48Å; L290-L293 PolarHBondContact O-N 3.31Å; L290-D325 HydrophobicContact CD1-CB 3.99Å; L290-D325 HydrophobicContact CD2-CB 3.59Å; L290-D325 WeakPolarHBondContact CD2-OD1 3.39Å; L290-D325 HydrophobicContact CG-CB 4.46Å; L290-K328 HydrophobicContact CD1-CB 4.36Å; L290-V329 HydrophobicContact CD1-CG2 3.56Å | ||
| 291 | G | 60.4 | Low | 64.3 | Low | 27 Ų | 27 | 65.6 Ų | 65.6 | 28% | 0.278 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -21 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115 | L293 T294 | G291-L293 PolarHBondContact O-N 3.4Å; G291-T294 VanDerWaalsContact O-CB 3.28Å; G291-T294 WeakPolarHBondContact O-CB 3.5Å; G291-T294 PolarHBondContact O-N 2.98Å; G291-T294 VanDerWaalsContact O-N 3.14Å; G291-T294 PolarHBondContact O-OG1 2.75Å; G291-T294 VanDerWaalsContact O-OG1 3.08Å |
| 292 | Y | 72.9 | Confident | 64.7 | Low | 112 Ų | 112 | 65.6 Ų | 65.6 | 44% | 0.439 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -68.2 | -18.3 | 173.4 | 76.4 | -88.1 | 0 | 0 | 0 | 113.1 | L290 T294 I296 D325 | L290-Y292 HydrophobicContact CD2-CE1 4.03Å; L290-Y292 PolarHBondContact O-N 2.79Å; L290-Y292 VanDerWaalsContact O-N 3.08Å; Y292-T294 VanDerWaalsContact C-N 3.31Å; Y292-I296 HydrophobicContact CD2-CD1 4.34Å; Y292-D325 PolarHBondContact OH-OD2 3.49Å |
| 293 | L | 69.6 | Low | 64.9 | Low | 1 Ų | 1 | 64.8 Ų | 64.8 | 1% | 0.005 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -79.3 | -17.9 | 175 | -59.2 | -176.9 | 0 | 0 | 0 | 111.9 | L285 L290 G291 I296 M297 I320 | L285-L293 HydrophobicContact CD1-CB 4.27Å; L285-L293 HydrophobicContact CD2-CB 4.3Å; L290-L293 HydrophobicContact CB-CD1 3.8Å; L290-L293 HydrophobicContact CB-CG 4.16Å; L290-L293 HydrophobicContact CD1-CD1 4.02Å; L290-L293 HydrophobicContact CD2-CD1 4.5Å; L290-L293 HydrophobicContact CG-CD1 4.32Å; L290-L293 VanDerWaalsContact O-CB 3.28Å; L290-L293 WeakPolarHBondContact O-CB 3.48Å; L290-L293 PolarHBondContact O-N 3.31Å; G291-L293 PolarHBondContact O-N 3.4Å; L293-I296 HydrophobicContact CD2-CD1 4.14Å; L293-I296 PolarHBondContact O-N 2.88Å; L293-M297 VanDerWaalsContact O-CB 3.28Å; L293-M297 WeakPolarHBondContact O-CB 3.45Å; L293-M297 VanDerWaalsContact O-CG 3.22Å; L293-M297 WeakPolarHBondContact O-CG 3.28Å; L293-M297 PolarHBondContact O-N 3.19Å; L293-I320 HydrophobicContact CB-CD1 4.38Å; L293-I320 HydrophobicContact CD1-CD1 4.16Å; L293-I320 HydrophobicContact CD1-CG2 4.09Å; L293-I320 HydrophobicContact CD2-CB 4.27Å; L293-I320 HydrophobicContact CD2-CD1 3.77Å; L293-I320 HydrophobicContact CD2-CG1 3.7Å; L293-I320 HydrophobicContact CD2-CG2 3.77Å; L293-I320 HydrophobicContact CG-CD1 4.34Å |
| 294 | T | 69.1 | Low | 64.8 | Low | 6 Ų | 6 | 61.7 Ų | 61.7 | 4% | 0.037 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62.2 | -45.9 | 178.6 | -51.5 | 0 | 0 | 0 | 0 | 110.8 | E282 G291 Y292 I296 M297 A298 | E282-T294 HydrophobicContact CB-CG2 3.65Å; E282-T294 HydrophobicContact CG-CG2 3.58Å; G291-T294 VanDerWaalsContact O-CB 3.28Å; G291-T294 WeakPolarHBondContact O-CB 3.5Å; G291-T294 PolarHBondContact O-N 2.98Å; G291-T294 VanDerWaalsContact O-N 3.14Å; G291-T294 PolarHBondContact O-OG1 2.75Å; G291-T294 VanDerWaalsContact O-OG1 3.08Å; Y292-T294 VanDerWaalsContact C-N 3.31Å; T294-I296 PolarHBondContact O-N 3.29Å; T294-M297 PolarHBondContact O-N 3.15Å; T294-A298 VanDerWaalsContact O-CB 3.25Å; T294-A298 WeakPolarHBondContact O-CB 3.32Å; T294-A298 PolarHBondContact O-N 2.93Å |
| 295 | D | 69.9 | Low | 64.3 | Low | 110 Ų | 110 | 64.2 Ų | 64.2 | 59% | 0.588 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -64.7 | -42.1 | 178.5 | -64.1 | -30.6 | 0 | 0 | 0 | 111.1 | M297 A298 E299 | D295-M297 VanDerWaalsContact C-N 3.34Å; D295-M297 PolarHBondContact O-N 3.49Å; D295-A298 PolarHBondContact O-N 2.64Å; D295-E299 WeakPolarHBondContact O-CB 3.5Å; D295-E299 WeakPolarHBondContact O-CG 3.4Å; D295-E299 PolarHBondContact O-N 3.44Å |
| 296 | I | 73.8 | Confident | 64.2 | Low | 43 Ų | 43 | 69.6 Ų | 69.6 | 22% | 0.221 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.2 | -41 | 177.3 | -61.6 | 174.1 | 0 | 0 | 0 | 110.7 | Y292 L293 T294 N300 I318 I320 | Y292-I296 HydrophobicContact CD2-CD1 4.34Å; L293-I296 HydrophobicContact CD2-CD1 4.14Å; L293-I296 PolarHBondContact O-N 2.88Å; T294-I296 PolarHBondContact O-N 3.29Å; I296-N300 PolarHBondContact O-N 2.87Å; I296-N300 PolarHBondContact O-ND2 3.39Å; I296-I318 HydrophobicContact CG2-CG2 3.95Å; I296-I318 WeakPolarHBondContact CG2-O 3.18Å; I296-I320 HydrophobicContact CG2-CG1 4.25Å |
| 297 | M | 70.3 | Confident | 64.5 | Low | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -73 | -34.2 | 178.8 | -73.5 | -172.2 | 167 | 0 | 0 | 112.4 | L281 L285 L293 T294 D295 N300 D301 I302 L307 F315 I320 | L281-M297 HydrophobicContact CD1-SD 4.01Å; L281-M297 HydrophobicContact CD2-CB 4.04Å; L281-M297 HydrophobicContact CD2-SD 4.15Å; L281-M297 HydrophobicContact CG-SD 4.39Å; L285-M297 HydrophobicContact CD1-CG 4.43Å; L285-M297 HydrophobicContact CD1-SD 3.47Å; L285-M297 WeakPolarHBondContact CD1-SD 3.28Å; L285-M297 HydrophobicContact CD2-CE 4.39Å; L285-M297 HydrophobicContact CD2-SD 4.11Å; L285-M297 HydrophobicContact CG-SD 4.32Å; L293-M297 VanDerWaalsContact O-CB 3.28Å; L293-M297 WeakPolarHBondContact O-CB 3.45Å; L293-M297 VanDerWaalsContact O-CG 3.22Å; L293-M297 WeakPolarHBondContact O-CG 3.28Å; L293-M297 PolarHBondContact O-N 3.19Å; T294-M297 PolarHBondContact O-N 3.15Å; D295-M297 VanDerWaalsContact C-N 3.34Å; D295-M297 PolarHBondContact O-N 3.49Å; M297-N300 CarbonylContact O-C 3.39Å; M297-N300 PolarHBondContact O-N 3.39Å; M297-D301 PolarHBondContact O-N 3.37Å; M297-I302 HydrophobicContact CB-CB 4.14Å; M297-I302 HydrophobicContact CB-CD1 4.35Å; M297-I302 HydrophobicContact CG-CB 4.39Å; M297-I302 HydrophobicContact CG-CD1 4.03Å; M297-I302 PolarHBondContact O-N 3.11Å; M297-I302 HydrophobicContact SD-CG2 4.48Å; M297-L307 HydrophobicContact CE-CD1 3.4Å; M297-L307 VanDerWaalsContact CE-CD1 3.4Å; M297-L307 HydrophobicContact SD-CD1 4.23Å; M297-F315 HydrophobicContact CE-CD1 4.36Å; M297-F315 HydrophobicContact CE-CE1 3.89Å; M297-I320 HydrophobicContact CE-CD1 3.73Å; M297-I320 HydrophobicContact CG-CD1 4.45Å |
| 298 | A | 70 | Confident | 64.6 | Low | 40 Ų | 40 | 64.6 Ų | 64.6 | 33% | 0.331 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -67.7 | -42.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | L278 T294 D295 N300 D301 | L278-A298 HydrophobicContact CD2-CB 3.99Å; T294-A298 VanDerWaalsContact O-CB 3.25Å; T294-A298 WeakPolarHBondContact O-CB 3.32Å; T294-A298 PolarHBondContact O-N 2.93Å; D295-A298 PolarHBondContact O-N 2.64Å; A298-N300 PolarHBondContact O-N 3.2Å; A298-D301 PolarHBondContact O-N 2.83Å |
| 299 | E | 74.1 | Confident | 64.7 | Low | 164 Ų | 164 | 67.4 Ų | 67.4 | 77% | 0.766 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -64.2 | -28.7 | 175.7 | -78.2 | -177.8 | 176.6 | 0 | 0 | 112.9 | D295 | D295-E299 WeakPolarHBondContact O-CB 3.5Å; D295-E299 WeakPolarHBondContact O-CG 3.4Å; D295-E299 PolarHBondContact O-N 3.44Å |
| 300 | N | 69.8 | Low | 65 | Low | 80 Ų | 80 | 61 Ų | 61 | 43% | 0.428 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | 10 | 177.5 | -71.6 | -82.4 | 0 | 0 | 0 | 113.6 | I296 M297 A298 I302 I318 | I296-N300 PolarHBondContact O-N 2.87Å; I296-N300 PolarHBondContact O-ND2 3.39Å; M297-N300 CarbonylContact O-C 3.39Å; M297-N300 PolarHBondContact O-N 3.39Å; A298-N300 PolarHBondContact O-N 3.2Å; N300-I302 HydrophobicContact CB-CD1 3.83Å; N300-I302 HydrophobicContact CB-CG1 3.96Å; N300-I302 PolarHBondContact O-N 2.98Å; N300-I302 VanDerWaalsContact O-N 3.17Å; N300-I318 HydrophobicContact CB-CG2 4.25Å |
| 301 | D | 63.8 | Low | 65 | Low | 146 Ų | 146 | 67.1 Ų | 67.1 | 78% | 0.781 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.7 | 34.2 | -178.7 | -84 | -34.1 | 0 | 0 | 0 | 114.1 | M297 A298 T303 | M297-D301 PolarHBondContact O-N 3.37Å; A298-D301 PolarHBondContact O-N 2.83Å; D301-T303 PolarHBondContact O-N 2.84Å |
| 302 | I | 63.1 | Low | 65.3 | Low | 12 Ų | 12 | 70.3 Ų | 70.3 | 6% | 0.062 | 36% | 0.359 | C | S | . | . | trans | -77.2 | 117.7 | -176.9 | -66.3 | 167.2 | 0 | 0 | 0 | 109.5 | L281 M297 N300 Y306 L307 M310 I318 | L281-I302 VanDerWaalsContact CD2-O 3.23Å; L281-I302 WeakPolarHBondContact CD2-O 3.49Å; M297-I302 HydrophobicContact CB-CB 4.14Å; M297-I302 HydrophobicContact CB-CD1 4.35Å; M297-I302 HydrophobicContact CG-CB 4.39Å; M297-I302 HydrophobicContact CG-CD1 4.03Å; M297-I302 PolarHBondContact O-N 3.11Å; M297-I302 HydrophobicContact SD-CG2 4.48Å; N300-I302 HydrophobicContact CB-CD1 3.83Å; N300-I302 HydrophobicContact CB-CG1 3.96Å; N300-I302 PolarHBondContact O-N 2.98Å; N300-I302 VanDerWaalsContact O-N 3.17Å; I302-Y306 HydrophobicContact CG1-CD1 4.19Å; I302-Y306 HydrophobicContact CG2-CD1 4.09Å; I302-L307 HydrophobicContact CG2-CB 4.45Å; I302-M310 HydrophobicContact CG2-SD 4.22Å; I302-I318 HydrophobicContact CD1-CB 4.07Å; I302-I318 HydrophobicContact CD1-CD1 3.2Å; I302-I318 HydrophobicContact CD1-CG1 3.64Å; I302-I318 HydrophobicContact CD1-CG2 3.31Å; I302-I318 HydrophobicContact CG1-CD1 4.08Å | ||
| 303 | T | 59.2 | Low | 65 | Low | 72 Ų | 72 | 71.3 Ų | 71.3 | 44% | 0.442 | 37% | 0.368 | S | S | . | . | trans | -92.6 | 159.3 | 177.2 | 52.7 | 0 | 0 | 0 | 0 | 111.2 | D301 S305 Y306 L307 | D301-T303 PolarHBondContact O-N 2.84Å; T303-S305 PolarHBondContact O-N 3.15Å; T303-S305 PolarHBondContact OG1-OG 3.43Å; T303-Y306 WeakPolarHBondContact O-CA 3.47Å; T303-Y306 WeakPolarHBondContact O-CB 3.37Å; T303-Y306 PolarHBondContact O-N 2.94Å; T303-L307 PolarHBondContact O-N 3.2Å | ||
| 304 | W | 57.4 | Low | 65.1 | Low | 72 Ų | 72 | 72.9 Ų | 72.9 | 27% | 0.273 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -53.1 | -41.1 | 177.7 | -169.9 | -110.4 | 0 | 0 | 0 | 113.3 | L281 L284 Y306 L307 L308 | L281-W304 HydrophobicContact CB-CE3 4.2Å; L281-W304 HydrophobicContact CD1-CE3 3.66Å; L281-W304 HydrophobicContact CD1-CZ3 3.85Å; L284-W304 HydrophobicContact CB-CH2 3.59Å; L284-W304 HydrophobicContact CB-CZ3 3.63Å; L284-W304 HydrophobicContact CD1-CH2 3.46Å; L284-W304 VanDerWaalsContact CD1-CH2 3.46Å; L284-W304 HydrophobicContact CD1-CZ2 4.33Å; L284-W304 HydrophobicContact CD1-CZ3 4.3Å; L284-W304 HydrophobicContact CD2-CH2 3.64Å; L284-W304 HydrophobicContact CD2-CZ3 3.68Å; L284-W304 HydrophobicContact CG-CH2 3.65Å; L284-W304 HydrophobicContact CG-CZ3 3.99Å; W304-Y306 VanDerWaalsContact C-N 3.32Å; W304-Y306 PolarHBondContact O-N 3.33Å; W304-L307 HydrophobicContact CE3-CD2 4.16Å; W304-L307 HydrophobicContact CZ3-CD2 3.95Å; W304-L307 PolarHBondContact O-N 3.28Å; W304-L308 WeakPolarHBondContact O-CG 3.31Å; W304-L308 PolarHBondContact O-N 3.41Å |
| 305 | S | 52.9 | Low | 65.3 | Low | 81 Ų | 81 | 72.7 Ų | 72.7 | 57% | 0.566 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -64.7 | -36 | 176.1 | 48.7 | 0 | 0 | 0 | 0 | 112.8 | T303 T309 | T303-S305 PolarHBondContact O-N 3.15Å; T303-S305 PolarHBondContact OG1-OG 3.43Å; S305-T309 PolarHBondContact O-OG1 3.13Å |
| 306 | Y | 57.9 | Low | 65.3 | Low | 113 Ų | 113 | 72.9 Ų | 72.9 | 44% | 0.443 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -69.4 | -42.9 | 177 | -165.8 | -110 | 0 | 0 | 0 | 110.6 | I302 T303 W304 L308 T309 M310 I318 | I302-Y306 HydrophobicContact CG1-CD1 4.19Å; I302-Y306 HydrophobicContact CG2-CD1 4.09Å; T303-Y306 WeakPolarHBondContact O-CA 3.47Å; T303-Y306 WeakPolarHBondContact O-CB 3.37Å; T303-Y306 PolarHBondContact O-N 2.94Å; W304-Y306 VanDerWaalsContact C-N 3.32Å; W304-Y306 PolarHBondContact O-N 3.33Å; Y306-L308 VanDerWaalsContact C-N 3.3Å; Y306-L308 PolarHBondContact O-N 2.93Å; Y306-T309 PolarHBondContact O-N 3.46Å; Y306-T309 PolarHBondContact O-OG1 3.44Å; Y306-M310 HydrophobicContact CD1-CG 4.01Å; Y306-M310 HydrophobicContact CD1-SD 3.89Å; Y306-M310 HydrophobicContact CE1-CG 4.05Å; Y306-M310 HydrophobicContact CE1-SD 4.09Å; Y306-M310 WeakPolarHBondContact O-CG 3.42Å; Y306-M310 PolarHBondContact O-N 3.35Å; Y306-M310 VanDerWaalsContact O-N 3.17Å; Y306-I318 HydrophobicContact CE1-CD1 4.35Å |
| 307 | L | 64 | Low | 65.2 | Low | 2 Ų | 2 | 78.3 Ų | 78.3 | 1% | 0.01 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -58.3 | -37.8 | 177.4 | -171.6 | 71.1 | 0 | 0 | 0 | 113.4 | L281 L284 M297 I302 T303 W304 T309 M310 F315 V329 | L281-L307 HydrophobicContact CD1-CD2 3.58Å; L284-L307 HydrophobicContact CD2-CD2 4.31Å; M297-L307 HydrophobicContact CE-CD1 3.4Å; M297-L307 VanDerWaalsContact CE-CD1 3.4Å; M297-L307 HydrophobicContact SD-CD1 4.23Å; I302-L307 HydrophobicContact CG2-CB 4.45Å; T303-L307 PolarHBondContact O-N 3.2Å; W304-L307 HydrophobicContact CE3-CD2 4.16Å; W304-L307 HydrophobicContact CZ3-CD2 3.95Å; W304-L307 PolarHBondContact O-N 3.28Å; L307-T309 PolarHBondContact O-N 3.45Å; L307-M310 HydrophobicContact CD1-SD 4Å; L307-M310 PolarHBondContact O-N 3.06Å; L307-F315 HydrophobicContact CD1-CE1 3.59Å; L307-F315 HydrophobicContact CD1-CZ 3.71Å; L307-V329 HydrophobicContact CD1-CG1 4.06Å; L307-V329 HydrophobicContact CD2-CG1 4.19Å; L307-V329 HydrophobicContact CG-CG1 4.37Å |
| 308 | L | 56.4 | Low | 65.1 | Low | 83 Ų | 83 | 79.2 Ų | 79.2 | 44% | 0.435 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -19.8 | 177.8 | -68.9 | 172.5 | 0 | 0 | 0 | 113.4 | W304 Y306 V333 | W304-L308 WeakPolarHBondContact O-CG 3.31Å; W304-L308 PolarHBondContact O-N 3.41Å; Y306-L308 VanDerWaalsContact C-N 3.3Å; Y306-L308 PolarHBondContact O-N 2.93Å; L308-V333 HydrophobicContact CD2-CG1 3.7Å; L308-V333 HydrophobicContact CD2-CG2 4.26Å |
| 309 | T | 57.8 | Low | 64.7 | Low | 104 Ų | 104 | 79.4 Ų | 79.4 | 64% | 0.638 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.2 | -2.3 | -179.6 | 57.1 | 0 | 0 | 0 | 0 | 113.6 | S305 Y306 L307 | S305-T309 PolarHBondContact O-OG1 3.13Å; Y306-T309 PolarHBondContact O-N 3.46Å; Y306-T309 PolarHBondContact O-OG1 3.44Å; L307-T309 PolarHBondContact O-N 3.45Å |
| 310 | M | 63.4 | Low | 64.5 | Low | 9 Ų | 9 | 71.8 Ų | 71.8 | 4% | 0.044 | 37% | 0.369 | C | S | . | . | trans | -75.7 | 133.2 | -176.4 | -82 | 177.1 | 66.1 | 0 | 0 | 112 | I302 Y306 L307 D314 F315 I318 | I302-M310 HydrophobicContact CG2-SD 4.22Å; Y306-M310 HydrophobicContact CD1-CG 4.01Å; Y306-M310 HydrophobicContact CD1-SD 3.89Å; Y306-M310 HydrophobicContact CE1-CG 4.05Å; Y306-M310 HydrophobicContact CE1-SD 4.09Å; Y306-M310 WeakPolarHBondContact O-CG 3.42Å; Y306-M310 PolarHBondContact O-N 3.35Å; Y306-M310 VanDerWaalsContact O-N 3.17Å; L307-M310 HydrophobicContact CD1-SD 4Å; L307-M310 PolarHBondContact O-N 3.06Å; M310-D314 HydrophobicContact CB-CB 4.35Å; M310-D314 HydrophobicContact CE-CB 3.91Å; M310-D314 HydrophobicContact CG-CB 4.15Å; M310-F315 HydrophobicContact CB-CD2 4.4Å; M310-F315 HydrophobicContact CB-CE2 3.71Å; M310-F315 HydrophobicContact CB-CZ 3.9Å; M310-F315 HydrophobicContact CE-CB 4.32Å; M310-F315 HydrophobicContact CE-CD1 3.52Å; M310-F315 HydrophobicContact CE-CD2 3.89Å; M310-F315 HydrophobicContact CE-CE1 3.63Å; M310-F315 HydrophobicContact CE-CE2 3.98Å; M310-F315 HydrophobicContact CE-CG 3.66Å; M310-F315 HydrophobicContact CE-CZ 3.85Å; M310-F315 HydrophobicContact SD-CE1 4.29Å; M310-F315 HydrophobicContact SD-CZ 4.31Å; M310-I318 HydrophobicContact CE-CD1 3.27Å; M310-I318 HydrophobicContact SD-CD1 3.91Å | ||
| 311 | E | 68.8 | Low | 64.6 | Low | 132 Ų | 132 | 73.4 Ų | 73.4 | 62% | 0.617 | 38% | 0.382 | S | S | * | . | trans | -93.4 | 167.5 | 169.1 | -64 | -170.7 | 175.8 | 0 | 0 | 110.7 | E313 D314 F315 | E311-E313 PolarHBondContact O-N 2.86Å; E311-E313 VanDerWaalsContact O-N 3.08Å; E311-D314 PolarHBondContact N-OD2 3.42Å; E311-D314 WeakPolarHBondContact O-CB 3.15Å; E311-D314 PolarHBondContact O-N 3.14Å; E311-F315 VanDerWaalsContact O-CD2 3.24Å; E311-F315 WeakPolarHBondContact O-CD2 3.47Å | ||
| 312 | K | 66.5 | Low | 65.2 | Low | 95 Ų | 95 | 69.6 Ų | 69.6 | 41% | 0.413 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -54.6 | -33.5 | -177 | -166 | 178.5 | 177.2 | -177.9 | 0 | 112.8 | D314 F315 Q326 L330 | K312-D314 VanDerWaalsContact C-N 3.29Å; K312-D314 PolarHBondContact O-N 3.11Å; K312-F315 PolarHBondContact O-N 3.25Å; K312-Q326 VanDerWaalsContact CG-OE1 3.27Å; K312-L330 HydrophobicContact CB-CD1 4.37Å |
| 313 | E | 66.8 | Low | 65.5 | Low | 133 Ų | 133 | 72.3 Ų | 72.3 | 62% | 0.621 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -68.9 | -25.6 | 179.2 | -57.5 | -179.4 | -177.7 | 0 | 0 | 113 | E311 | E311-E313 PolarHBondContact O-N 2.86Å; E311-E313 VanDerWaalsContact O-N 3.08Å |
| 314 | D | 73 | Confident | 66 | Low | 34 Ų | 34 | 72.8 Ų | 72.8 | 18% | 0.182 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -81 | -31.8 | 180 | -60.4 | -43.4 | 0 | 0 | 0 | 111.6 | M310 E311 K312 E316 K317 I318 | M310-D314 HydrophobicContact CB-CB 4.35Å; M310-D314 HydrophobicContact CE-CB 3.91Å; M310-D314 HydrophobicContact CG-CB 4.15Å; E311-D314 PolarHBondContact N-OD2 3.42Å; E311-D314 WeakPolarHBondContact O-CB 3.15Å; E311-D314 PolarHBondContact O-N 3.14Å; K312-D314 VanDerWaalsContact C-N 3.29Å; K312-D314 PolarHBondContact O-N 3.11Å; D314-E316 VanDerWaalsContact C-N 3.25Å; D314-E316 PolarHBondContact O-N 2.98Å; D314-K317 PolarHBondContact O-N 3.05Å; D314-K317 IonicContact OD1-NZ 3.51Å; D314-K317 PolarHBondContact OD1-NZ 3.27Å; D314-I318 VanDerWaalsContact O-CD1 3.3Å; D314-I318 WeakPolarHBondContact O-CD1 3.37Å; D314-I318 WeakPolarHBondContact O-CG1 3.3Å; D314-I318 PolarHBondContact O-N 2.9Å |
| 315 | F | 71.6 | Confident | 66.6 | Low | 2 Ų | 2 | 70 Ų | 70 | 1% | 0.009 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -61.5 | -35.7 | 172.3 | -70.9 | -80.6 | 0 | 0 | 0 | 112.2 | M297 L307 M310 E311 K312 I318 G319 I320 Q326 V329 L330 | M297-F315 HydrophobicContact CE-CD1 4.36Å; M297-F315 HydrophobicContact CE-CE1 3.89Å; L307-F315 HydrophobicContact CD1-CE1 3.59Å; L307-F315 HydrophobicContact CD1-CZ 3.71Å; M310-F315 HydrophobicContact CB-CD2 4.4Å; M310-F315 HydrophobicContact CB-CE2 3.71Å; M310-F315 HydrophobicContact CB-CZ 3.9Å; M310-F315 HydrophobicContact CE-CB 4.32Å; M310-F315 HydrophobicContact CE-CD1 3.52Å; M310-F315 HydrophobicContact CE-CD2 3.89Å; M310-F315 HydrophobicContact CE-CE1 3.63Å; M310-F315 HydrophobicContact CE-CE2 3.98Å; M310-F315 HydrophobicContact CE-CG 3.66Å; M310-F315 HydrophobicContact CE-CZ 3.85Å; M310-F315 HydrophobicContact SD-CE1 4.29Å; M310-F315 HydrophobicContact SD-CZ 4.31Å; E311-F315 VanDerWaalsContact O-CD2 3.24Å; E311-F315 WeakPolarHBondContact O-CD2 3.47Å; K312-F315 PolarHBondContact O-N 3.25Å; F315-I318 PolarHBondContact O-N 3.42Å; F315-G319 PolarHBondContact O-N 3.48Å; F315-I320 CarbonylContact C-O 3.59Å; F315-I320 HydrophobicContact CB-CB 4.3Å; F315-I320 HydrophobicContact CD1-CD1 4.04Å; F315-I320 WeakPolarHBondContact O-CB 3.3Å; F315-I320 PolarHBondContact O-N 3.13Å; F315-Q326 HydrophobicContact CB-CG 3.8Å; F315-Q326 HydrophobicContact CG-CG 4.21Å; F315-V329 HydrophobicContact CE1-CG1 4.11Å; F315-V329 HydrophobicContact CZ-CG1 4.07Å; F315-L330 HydrophobicContact CE2-CD1 4.41Å; F315-L330 HydrophobicContact CE2-CD2 3.91Å; F315-L330 HydrophobicContact CE2-CG 4.05Å; F315-L330 HydrophobicContact CZ-CD2 4.49Å |
| 316 | E | 71.3 | Confident | 67.5 | Low | 114 Ų | 114 | 66.2 Ų | 66.2 | 53% | 0.533 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -67.8 | -36.9 | 176.7 | -65.9 | -176.8 | -179.4 | 0 | 0 | 112.1 | D314 I318 G319 | D314-E316 VanDerWaalsContact C-N 3.25Å; D314-E316 PolarHBondContact O-N 2.98Å; E316-I318 PolarHBondContact O-N 3.22Å; E316-G319 PolarHBondContact O-N 3.5Å |
| 317 | K | 70.9 | Confident | 67.9 | Low | 157 Ų | 157 | 65.4 Ų | 65.4 | 68% | 0.683 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -66.1 | -28 | 176.7 | -66.6 | 171.9 | -163.2 | 152.9 | 0 | 113 | D314 G319 | D314-K317 PolarHBondContact O-N 3.05Å; D314-K317 IonicContact OD1-NZ 3.51Å; D314-K317 PolarHBondContact OD1-NZ 3.27Å; K317-G319 VanDerWaalsContact C-N 3.3Å |
| 318 | I | 67.7 | Low | 68.2 | Low | 19 Ų | 19 | 69.5 Ų | 69.5 | 10% | 0.097 | 36% | 0.364 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.4 | -3.5 | -179 | -71.3 | 156.7 | 0 | 0 | 0 | 111.5 | I296 N300 I302 Y306 M310 D314 F315 E316 I320 | I296-I318 HydrophobicContact CG2-CG2 3.95Å; I296-I318 WeakPolarHBondContact CG2-O 3.18Å; N300-I318 HydrophobicContact CB-CG2 4.25Å; I302-I318 HydrophobicContact CD1-CB 4.07Å; I302-I318 HydrophobicContact CD1-CD1 3.2Å; I302-I318 HydrophobicContact CD1-CG1 3.64Å; I302-I318 HydrophobicContact CD1-CG2 3.31Å; I302-I318 HydrophobicContact CG1-CD1 4.08Å; Y306-I318 HydrophobicContact CE1-CD1 4.35Å; M310-I318 HydrophobicContact CE-CD1 3.27Å; M310-I318 HydrophobicContact SD-CD1 3.91Å; D314-I318 VanDerWaalsContact O-CD1 3.3Å; D314-I318 WeakPolarHBondContact O-CD1 3.37Å; D314-I318 WeakPolarHBondContact O-CG1 3.3Å; D314-I318 PolarHBondContact O-N 2.9Å; F315-I318 PolarHBondContact O-N 3.42Å; E316-I318 PolarHBondContact O-N 3.22Å; I318-I320 HydrophobicContact CG2-CD1 4.2Å; I318-I320 HydrophobicContact CG2-CG1 4.28Å |
| 319 | G | 63.2 | Low | 68.6 | Low | 44 Ų | 44 | 65.6 Ų | 65.6 | 45% | 0.454 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 94.9 | 7.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | F315 E316 K317 T321 | F315-G319 PolarHBondContact O-N 3.48Å; E316-G319 PolarHBondContact O-N 3.5Å; K317-G319 VanDerWaalsContact C-N 3.3Å; G319-T321 PolarHBondContact O-N 3.4Å |
| 320 | I | 69.7 | Low | 69 | Low | 3 Ų | 3 | 61.9 Ų | 61.9 | 2% | 0.015 | 32% | 0.32 | C | S | . | . | trans | -91.1 | 95 | 178.3 | -51.4 | 179.9 | 0 | 0 | 0 | 108 | L293 I296 M297 F315 I318 Q326 | L293-I320 HydrophobicContact CB-CD1 4.38Å; L293-I320 HydrophobicContact CD1-CD1 4.16Å; L293-I320 HydrophobicContact CD1-CG2 4.09Å; L293-I320 HydrophobicContact CD2-CB 4.27Å; L293-I320 HydrophobicContact CD2-CD1 3.77Å; L293-I320 HydrophobicContact CD2-CG1 3.7Å; L293-I320 HydrophobicContact CD2-CG2 3.77Å; L293-I320 HydrophobicContact CG-CD1 4.34Å; I296-I320 HydrophobicContact CG2-CG1 4.25Å; M297-I320 HydrophobicContact CE-CD1 3.73Å; M297-I320 HydrophobicContact CG-CD1 4.45Å; F315-I320 CarbonylContact C-O 3.59Å; F315-I320 HydrophobicContact CB-CB 4.3Å; F315-I320 HydrophobicContact CD1-CD1 4.04Å; F315-I320 WeakPolarHBondContact O-CB 3.3Å; F315-I320 PolarHBondContact O-N 3.13Å; I318-I320 HydrophobicContact CG2-CD1 4.2Å; I318-I320 HydrophobicContact CG2-CG1 4.28Å; I320-Q326 HydrophobicContact CG2-CG 4.1Å; I320-Q326 PolarHBondContact O-NE2 3.38Å | ||
| 321 | T | 71.3 | Confident | 69 | Low | 115 Ų | 115 | 63.8 Ų | 63.8 | 71% | 0.706 | 33% | 0.334 | S | S | * | . | trans | -97.9 | -8.1 | -171 | 52.1 | 0 | 0 | 0 | 0 | 114.2 | G319 P323 | G319-T321 PolarHBondContact O-N 3.4Å; T321-P323 VanDerWaalsContact O-CD 3.32Å; T321-P323 WeakPolarHBondContact O-CD 3.39Å | ||
| 322 | N | 75.8 | Confident | 68.5 | Low | 65 Ų | 65 | 58.2 Ų | 58.2 | 35% | 0.348 | 31% | 0.311 | S | S | . | . | trans | -84.6 | 112 | -178.7 | -173 | -6.2 | 0 | 0 | 0 | 111.5 | V324 D325 Q326 | N322-V324 VanDerWaalsContact C-N 3.26Å; N322-V324 PolarHBondContact O-N 3.31Å; N322-V324 PolarHBondContact OD1-N 3.47Å; N322-D325 HydrophobicContact CB-CB 4.23Å; N322-D325 PolarHBondContact ND2-OD2 3.03Å; N322-D325 PolarHBondContact O-N 3.15Å; N322-D325 VanDerWaalsContact O-N 3.16Å; N322-Q326 WeakPolarHBondContact O-CG 3.5Å; N322-Q326 PolarHBondContact O-N 3.23Å; N322-Q326 VanDerWaalsContact O-N 3.12Å | ||
| 323 | P | 69.8 | Low | 68.1 | Low | 69 Ų | 69 | 54.6 Ų | 54.6 | 45% | 0.448 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -67.9 | -23.6 | -173.9 | 27.8 | -36 | 0 | 0 | 0 | 113.6 | T321 Q327 | T321-P323 VanDerWaalsContact O-CD 3.32Å; T321-P323 WeakPolarHBondContact O-CD 3.39Å; P323-Q327 WeakPolarHBondContact O-CB 3.34Å; P323-Q327 PolarHBondContact O-N 3.39Å; P323-Q327 VanDerWaalsContact O-N 3.09Å |
| 324 | V | 69.3 | Low | 67.5 | Low | 82 Ų | 82 | 54.2 Ų | 54.2 | 50% | 0.497 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -71.3 | -37.4 | 177.1 | 177.8 | 0 | 0 | 0 | 0 | 110.6 | N322 Q327 K328 | N322-V324 VanDerWaalsContact C-N 3.26Å; N322-V324 PolarHBondContact O-N 3.31Å; N322-V324 PolarHBondContact OD1-N 3.47Å; V324-Q327 PolarHBondContact O-N 3.36Å; V324-K328 WeakPolarHBondContact O-CG 3.07Å; V324-K328 PolarHBondContact O-N 3.39Å; V324-K328 VanDerWaalsContact O-N 3.07Å |
| 325 | D | 71.1 | Confident | 66.4 | Low | 14 Ų | 14 | 60.5 Ų | 60.5 | 8% | 0.075 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -78.5 | -39.1 | -177.2 | -63.6 | -17.8 | 0 | 0 | 0 | 110.4 | L290 Y292 N322 Q327 K328 V329 | L290-D325 HydrophobicContact CD1-CB 3.99Å; L290-D325 HydrophobicContact CD2-CB 3.59Å; L290-D325 WeakPolarHBondContact CD2-OD1 3.39Å; L290-D325 HydrophobicContact CG-CB 4.46Å; Y292-D325 PolarHBondContact OH-OD2 3.49Å; N322-D325 HydrophobicContact CB-CB 4.23Å; N322-D325 PolarHBondContact ND2-OD2 3.03Å; N322-D325 PolarHBondContact O-N 3.15Å; N322-D325 VanDerWaalsContact O-N 3.16Å; D325-Q327 VanDerWaalsContact C-N 3.32Å; D325-Q327 PolarHBondContact O-N 3.24Å; D325-K328 PolarHBondContact O-N 3.27Å; D325-K328 IonicContact OD1-NZ 2.79Å; D325-K328 PolarHBondContact OD1-NZ 2.78Å; D325-V329 WeakPolarHBondContact O-CG2 3.44Å; D325-V329 PolarHBondContact O-N 3.24Å; D325-V329 VanDerWaalsContact O-N 3.11Å |
| 326 | Q | 71.4 | Confident | 65.4 | Low | 1 Ų | 1 | 65.6 Ų | 65.6 | 1% | 0.005 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -54.8 | -47.1 | 167.6 | -67.2 | 176.2 | -12.8 | 0 | 0 | 111.8 | K312 F315 I320 N322 K328 V329 L330 | K312-Q326 VanDerWaalsContact CG-OE1 3.27Å; F315-Q326 HydrophobicContact CB-CG 3.8Å; F315-Q326 HydrophobicContact CG-CG 4.21Å; I320-Q326 HydrophobicContact CG2-CG 4.1Å; I320-Q326 PolarHBondContact O-NE2 3.38Å; N322-Q326 WeakPolarHBondContact O-CG 3.5Å; N322-Q326 PolarHBondContact O-N 3.23Å; N322-Q326 VanDerWaalsContact O-N 3.12Å; Q326-K328 PolarHBondContact O-N 3.06Å; Q326-V329 PolarHBondContact O-N 2.72Å; Q326-L330 WeakPolarHBondContact O-CB 3.41Å; Q326-L330 WeakPolarHBondContact O-CG 3.47Å; Q326-L330 PolarHBondContact O-N 3.34Å |
| 327 | Q | 66.4 | Low | 64.2 | Low | 97 Ų | 97 | 66.8 Ų | 66.8 | 45% | 0.453 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -67.6 | -35.2 | -178.3 | -169.3 | 64.7 | 29.5 | 0 | 0 | 112.4 | P323 V324 D325 L330 S331 | P323-Q327 WeakPolarHBondContact O-CB 3.34Å; P323-Q327 PolarHBondContact O-N 3.39Å; P323-Q327 VanDerWaalsContact O-N 3.09Å; V324-Q327 PolarHBondContact O-N 3.36Å; D325-Q327 VanDerWaalsContact C-N 3.32Å; D325-Q327 PolarHBondContact O-N 3.24Å; Q327-L330 PolarHBondContact O-N 3.16Å; Q327-S331 WeakPolarHBondContact O-CB 3.42Å; Q327-S331 PolarHBondContact O-N 3.42Å; Q327-S331 PolarHBondContact O-OG 3.29Å |
| 328 | K | 69.1 | Low | 62.6 | Low | 87 Ų | 87 | 66.3 Ų | 66.3 | 38% | 0.378 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -63 | -46.9 | 174.9 | -76.1 | 169.6 | -173.6 | 164.3 | 0 | 111.3 | L290 V324 D325 Q326 S331 A332 | L290-K328 HydrophobicContact CD1-CB 4.36Å; V324-K328 WeakPolarHBondContact O-CG 3.07Å; V324-K328 PolarHBondContact O-N 3.39Å; V324-K328 VanDerWaalsContact O-N 3.07Å; D325-K328 PolarHBondContact O-N 3.27Å; D325-K328 IonicContact OD1-NZ 2.79Å; D325-K328 PolarHBondContact OD1-NZ 2.78Å; Q326-K328 PolarHBondContact O-N 3.06Å; K328-S331 PolarHBondContact O-N 3.36Å; K328-S331 PolarHBondContact O-OG 2.59Å; K328-A332 WeakPolarHBondContact O-CB 3.34Å; K328-A332 PolarHBondContact O-N 2.73Å |
| 329 | V | 66.1 | Low | 61.1 | Low | 1 Ų | 1 | 73.4 Ų | 73.4 | 1% | 0.006 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -61.4 | -48.3 | 176.7 | 177.8 | 0 | 0 | 0 | 0 | 110.3 | L285 L288 L290 L307 F315 D325 Q326 S331 A332 V333 | L285-V329 HydrophobicContact CD2-CG2 4.17Å; L288-V329 HydrophobicContact CD1-CG2 4.13Å; L290-V329 HydrophobicContact CD1-CG2 3.56Å; L307-V329 HydrophobicContact CD1-CG1 4.06Å; L307-V329 HydrophobicContact CD2-CG1 4.19Å; L307-V329 HydrophobicContact CG-CG1 4.37Å; F315-V329 HydrophobicContact CE1-CG1 4.11Å; F315-V329 HydrophobicContact CZ-CG1 4.07Å; D325-V329 WeakPolarHBondContact O-CG2 3.44Å; D325-V329 PolarHBondContact O-N 3.24Å; D325-V329 VanDerWaalsContact O-N 3.11Å; Q326-V329 PolarHBondContact O-N 2.72Å; V329-S331 PolarHBondContact O-N 2.83Å; V329-A332 PolarHBondContact O-N 3.03Å; V329-V333 WeakPolarHBondContact O-CB 3.46Å; V329-V333 VanDerWaalsContact O-CG2 3.26Å; V329-V333 WeakPolarHBondContact O-CG2 3.47Å; V329-V333 PolarHBondContact O-N 3.38Å |
| 330 | L | 66.7 | Low | 60 | Low | 27 Ų | 27 | 78.2 Ų | 78.2 | 14% | 0.141 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -63.2 | -41.1 | 178.2 | -75 | 170.6 | 0 | 0 | 0 | 113.2 | K312 F315 Q326 Q327 V333 Q334 | K312-L330 HydrophobicContact CB-CD1 4.37Å; F315-L330 HydrophobicContact CE2-CD1 4.41Å; F315-L330 HydrophobicContact CE2-CD2 3.91Å; F315-L330 HydrophobicContact CE2-CG 4.05Å; F315-L330 HydrophobicContact CZ-CD2 4.49Å; Q326-L330 WeakPolarHBondContact O-CB 3.41Å; Q326-L330 WeakPolarHBondContact O-CG 3.47Å; Q326-L330 PolarHBondContact O-N 3.34Å; Q327-L330 PolarHBondContact O-N 3.16Å; L330-V333 PolarHBondContact O-N 2.77Å; L330-Q334 WeakPolarHBondContact O-CB 3.25Å; L330-Q334 VanDerWaalsContact O-CG 3.28Å; L330-Q334 WeakPolarHBondContact O-CG 3.48Å; L330-Q334 PolarHBondContact O-N 2.82Å |
| 331 | S | 62.3 | Low | 58.5 | Low | 48 Ų | 48 | 83.5 Ų | 83.5 | 34% | 0.336 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -68.8 | -36.3 | 178.8 | 66.4 | 0 | 0 | 0 | 0 | 112.7 | Q327 K328 V329 Q334 Q335 | Q327-S331 WeakPolarHBondContact O-CB 3.42Å; Q327-S331 PolarHBondContact O-N 3.42Å; Q327-S331 PolarHBondContact O-OG 3.29Å; K328-S331 PolarHBondContact O-N 3.36Å; K328-S331 PolarHBondContact O-OG 2.59Å; V329-S331 PolarHBondContact O-N 2.83Å; S331-Q334 PolarHBondContact O-N 3.19Å; S331-Q335 WeakPolarHBondContact O-CG 3.3Å; S331-Q335 PolarHBondContact O-N 2.79Å |
| 332 | A | 57.7 | Low | 57 | Low | 15 Ų | 15 | 82.7 Ų | 82.7 | 12% | 0.124 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -66.9 | -40 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111 | L288 K328 V329 M336 | L288-A332 HydrophobicContact CD1-CB 3.96Å; L288-A332 HydrophobicContact CD2-CB 4Å; K328-A332 WeakPolarHBondContact O-CB 3.34Å; K328-A332 PolarHBondContact O-N 2.73Å; V329-A332 PolarHBondContact O-N 3.03Å; A332-M336 WeakPolarHBondContact O-CG 3.42Å; A332-M336 PolarHBondContact O-N 2.77Å |
| 333 | V | 59.3 | Low | 55.3 | Low | 20 Ų | 20 | 85 Ų | 85 | 12% | 0.121 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -65.2 | -38.4 | 173.2 | 168.9 | 0 | 0 | 0 | 0 | 111.7 | L308 V329 L330 M336 | L308-V333 HydrophobicContact CD2-CG1 3.7Å; L308-V333 HydrophobicContact CD2-CG2 4.26Å; V329-V333 WeakPolarHBondContact O-CB 3.46Å; V329-V333 VanDerWaalsContact O-CG2 3.26Å; V329-V333 WeakPolarHBondContact O-CG2 3.47Å; V329-V333 PolarHBondContact O-N 3.38Å; L330-V333 PolarHBondContact O-N 2.77Å; V333-M336 WeakPolarHBondContact O-CB 3.43Å; V333-M336 PolarHBondContact O-N 3.47Å |
| 334 | Q | 54.4 | Low | 53.8 | Low | 124 Ų | 124 | 88.7 Ų | 88.7 | 58% | 0.579 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -74 | -34.7 | 178.6 | -76.2 | 176.2 | -12.4 | 0 | 0 | 113.8 | L330 S331 M336 H337 | L330-Q334 WeakPolarHBondContact O-CB 3.25Å; L330-Q334 VanDerWaalsContact O-CG 3.28Å; L330-Q334 WeakPolarHBondContact O-CG 3.48Å; L330-Q334 PolarHBondContact O-N 2.82Å; S331-Q334 PolarHBondContact O-N 3.19Å; Q334-M336 PolarHBondContact O-N 2.97Å; Q334-H337 WeakPolarHBondContact O-CB 3.3Å; Q334-H337 PolarHBondContact O-N 3.19Å |
| 335 | Q | 49.8 | Very low | 52.4 | Low | 167 Ų | 167 | 94 Ų | 94 | 78% | 0.78 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -65.5 | -20 | 173.6 | -81.1 | -170.7 | -18.3 | 0 | 0 | 112.8 | S331 H337 | S331-Q335 WeakPolarHBondContact O-CG 3.3Å; S331-Q335 PolarHBondContact O-N 2.79Å; Q335-H337 PolarHBondContact O-N 3.32Å |
| 336 | M | 49.4 | Very low | 51 | Low | 109 Ų | 109 | 97.5 Ų | 97.5 | 54% | 0.537 | 49% | 0.49 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | 4.5 | 170.1 | -64.1 | 177.1 | -177.2 | 0 | 0 | 113.5 | L284 A332 V333 Q334 | L284-M336 HydrophobicContact CD1-CE 3.7Å; A332-M336 WeakPolarHBondContact O-CG 3.42Å; A332-M336 PolarHBondContact O-N 2.77Å; V333-M336 WeakPolarHBondContact O-CB 3.43Å; V333-M336 PolarHBondContact O-N 3.47Å; Q334-M336 PolarHBondContact O-N 2.97Å |
| 337 | H | 46.4 | Very low | 49.4 | Very low | 138 Ų | 138 | 106 Ų | 106 | 64% | 0.639 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -118.8 | 12.9 | -169.6 | -141.2 | -61.2 | 0 | 0 | 0 | 117.1 | Q334 Q335 | Q334-H337 WeakPolarHBondContact O-CB 3.3Å; Q334-H337 PolarHBondContact O-N 3.19Å; Q335-H337 PolarHBondContact O-N 3.32Å |
| 338 | L | 37.4 | Very low | 48.2 | Very low | 148 Ų | 148 | 108.7 Ų | 108.7 | 78% | 0.775 | 55% | 0.546 | S | S | * | . | trans | -141.2 | 119.8 | 172.8 | -76.6 | 150 | 0 | 0 | 0 | 108 | ||||
| 339 | D | 36.2 | Very low | 46.5 | Very low | 167 Ų | 167 | 107.3 Ų | 107.3 | 89% | 0.893 | 56% | 0.556 | S | S | * | * | cis | -105.9 | 114.3 | 43.2 | -75.3 | -40.2 | 0 | 0 | 0 | 115.3 | V341 | D339-V341 PolarHBondContact O-N 2.99Š| ||
| 340 | K | 40.9 | Very low | 45.3 | Very low | 146 Ų | 146 | 114.6 Ų | 114.6 | 64% | 0.635 | 60% | 0.601 | S | S | * | * | trans | -85 | 105.5 | 171.8 | -155.1 | -176.2 | -173.3 | -163.4 | 0 | 107.2 | D342 | K340-D342 PolarHBondContact O-N 3.24Å; K340-D342 VanDerWaalsContact O-N 3.09Å | ||
| 341 | V | 37.2 | Very low | 44.1 | Very low | 114 Ų | 114 | 115.7 Ų | 115.7 | 69% | 0.691 | 62% | 0.619 | S | S | * | * | trans | -62.9 | 110.3 | 158.2 | 176.8 | 0 | 0 | 0 | 0 | 105.6 | D339 L343 | D339-V341 PolarHBondContact O-N 2.99Å; V341-L343 PolarHBondContact O-N 3.11Å | ||
| 342 | D | 40.8 | Very low | 43.1 | Very low | 98 Ų | 98 | 122.8 Ų | 122.8 | 52% | 0.524 | 65% | 0.647 | S | S | . | * | trans | -67.5 | 97.7 | 177 | -106.8 | -17.1 | 0 | 0 | 0 | 108.9 | K340 D344 | K340-D342 PolarHBondContact O-N 3.24Å; K340-D342 VanDerWaalsContact O-N 3.09Å; D342-D344 PolarHBondContact O-N 3.48Å; D342-D344 VanDerWaalsContact O-N 3.16Å | ||
| 343 | L | 40.3 | Very low | 42.4 | Very low | 112 Ų | 112 | 126.8 Ų | 126.8 | 59% | 0.586 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -63.9 | -11.2 | 178.4 | -74.2 | 154.4 | 0 | 0 | 0 | 113 | V341 K345 I346 | V341-L343 PolarHBondContact O-N 3.11Å; L343-K345 PolarHBondContact O-N 3.08Å; L343-I346 PolarHBondContact O-N 3.39Å |
| 344 | D | 37.2 | Very low | 41.6 | Very low | 148 Ų | 148 | 127.9 Ų | 127.9 | 79% | 0.791 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -73 | -9.7 | 180 | -69.3 | -22.4 | 0 | 0 | 0 | 114.1 | D342 | D342-D344 PolarHBondContact O-N 3.48Å; D342-D344 VanDerWaalsContact O-N 3.16Å |
| 345 | K | 40.5 | Very low | 41.1 | Very low | 193 Ų | 193 | 126 Ų | 126 | 84% | 0.839 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -95.4 | -11.1 | 176.4 | -86.6 | -176.5 | 179.4 | 174 | 0 | 115.1 | L343 Q347 | L343-K345 PolarHBondContact O-N 3.08Å; K345-Q347 PolarHBondContact O-N 3.27Å |
| 346 | I | 41.7 | Very low | 40.7 | Very low | 88 Ų | 88 | 123.3 Ų | 123.3 | 45% | 0.451 | 67% | 0.668 | S | S | . | * | trans | -86.9 | 74.3 | 176.4 | -51.7 | 179 | 0 | 0 | 0 | 107.8 | L343 L348 | L343-I346 PolarHBondContact O-N 3.39Å; I346-L348 PolarHBondContact O-N 3.08Å; I346-L348 VanDerWaalsContact O-N 3.14Å | ||
| 347 | Q | 37.7 | Very low | 40.4 | Very low | 180 Ų | 180 | 122.2 Ų | 122.2 | 84% | 0.841 | 67% | 0.665 | S | S | * | * | trans | -66.6 | 109 | 162.3 | -83.1 | 175.7 | -17.6 | 0 | 0 | 107.3 | K345 G349 | K345-Q347 PolarHBondContact O-N 3.27Å; Q347-G349 PolarHBondContact O-N 3.41Å | ||
| 348 | L | 41.6 | Very low | 40.3 | Very low | 152 Ų | 152 | 119.7 Ų | 119.7 | 80% | 0.796 | 66% | 0.656 | S | S | * | * | trans | -63.2 | 82.1 | 162.5 | -91.5 | 102.8 | 0 | 0 | 0 | 108.6 | I346 T350 | I346-L348 PolarHBondContact O-N 3.08Å; I346-L348 VanDerWaalsContact O-N 3.14Å; L348-T350 PolarHBondContact O-N 3.31Å | ||
| 349 | G | 33 | Very low | 40.5 | Very low | 58 Ų | 58 | 118 Ų | 118 | 60% | 0.598 | 64% | 0.644 | S | S | * | * | trans | -68.6 | 118.2 | 159.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | Q347 G351 | Q347-G349 PolarHBondContact O-N 3.41Å; G349-G351 PolarHBondContact O-N 3.18Å | ||
| 350 | T | 41.2 | Very low | 40.9 | Very low | 154 Ų | 154 | 114.6 Ų | 114.6 | 95% | 0.945 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -44.8 | 98.8 | 167.5 | 45 | 0 | 0 | 0 | 0 | 110.5 | L348 | L348-T350 PolarHBondContact O-N 3.31Š|
| 351 | G | 40.4 | Very low | 41.1 | Very low | 50 Ų | 50 | 110.7 Ų | 110.7 | 52% | 0.515 | 61% | 0.609 | S | S | . | * | S | Bend | trans | 173.6 | 149.5 | -177 | 0 | 0 | 0 | 0 | 0 | 109.7 | G349 N353 | G349-G351 PolarHBondContact O-N 3.18Å; G351-N353 PolarHBondContact O-N 2.88Å |
| 352 | E | 42.3 | Very low | 41.4 | Very low | 197 Ų | 197 | 109.2 Ų | 109.2 | 92% | 0.921 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | 4.6 | -164.1 | -63.9 | 173.4 | 142.5 | 0 | 0 | 117 | ||
| 353 | N | 42.6 | Very low | 41.6 | Very low | 100 Ų | 100 | 107.8 Ų | 107.8 | 54% | 0.535 | 59% | 0.588 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.7 | -8 | -177.8 | -86.3 | 43.5 | 0 | 0 | 0 | 115.9 | G351 C355 E356 D357 | G351-N353 PolarHBondContact O-N 2.88Å; N353-C355 PolarHBondContact O-N 3.49Å; N353-C355 VanDerWaalsContact O-N 3.11Å; N353-E356 PolarHBondContact O-N 3.26Å; N353-E356 VanDerWaalsContact O-N 3.1Å; N353-D357 PolarHBondContact O-N 2.97Å |
| 354 | G | 43.8 | Very low | 41.8 | Very low | 42 Ų | 42 | 105.2 Ų | 105.2 | 43% | 0.433 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.7 | -19.8 | 178 | 0 | 0 | 0 | 0 | 0 | 114.3 | L358 | G354-L358 WeakPolarHBondContact O-CB 3.48Å; G354-L358 PolarHBondContact O-N 2.64Å |
| 355 | C | 43.4 | Very low | 42.2 | Very low | 85 Ų | 85 | 99 Ų | 99 | 57% | 0.574 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -75.5 | -36.5 | 175.8 | -159.9 | 0 | 0 | 0 | 0 | 111.9 | N353 Q359 | N353-C355 PolarHBondContact O-N 3.49Å; N353-C355 VanDerWaalsContact O-N 3.11Å; C355-Q359 WeakPolarHBondContact O-CB 3.28Å; C355-Q359 PolarHBondContact O-N 3.27Å |
| 356 | E | 41.3 | Very low | 42.3 | Very low | 111 Ų | 111 | 96.7 Ų | 96.7 | 52% | 0.519 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -70.4 | -38 | 178.1 | -71.3 | -173.7 | 157.4 | 0 | 0 | 111.3 | N353 Q359 N360 | N353-E356 PolarHBondContact O-N 3.26Å; N353-E356 VanDerWaalsContact O-N 3.1Å; E356-Q359 PolarHBondContact O-N 3.34Å; E356-N360 VanDerWaalsContact O-CB 3.31Å; E356-N360 WeakPolarHBondContact O-CB 3.22Å; E356-N360 PolarHBondContact O-N 3.45Å; E356-N360 PolarHBondContact O-ND2 3.21Å; E356-N360 VanDerWaalsContact O-ND2 3.09Å |
| 357 | D | 43 | Very low | 42.5 | Very low | 86 Ų | 86 | 98.4 Ų | 98.4 | 46% | 0.46 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -70 | -38 | 176.5 | -68.5 | -29.3 | 0 | 0 | 0 | 112.3 | N353 N360 F361 | N353-D357 PolarHBondContact O-N 2.97Å; D357-N360 PolarHBondContact O-N 3.3Å; D357-F361 WeakPolarHBondContact O-CB 3.49Å; D357-F361 PolarHBondContact O-N 3.18Å |
| 358 | L | 44.1 | Very low | 42.8 | Very low | 85 Ų | 85 | 93.4 Ų | 93.4 | 45% | 0.445 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.1 | -36.6 | 171.6 | -174.9 | 67.1 | 0 | 0 | 0 | 111.7 | G354 F361 L362 L421 | G354-L358 WeakPolarHBondContact O-CB 3.48Å; G354-L358 PolarHBondContact O-N 2.64Å; L358-F361 PolarHBondContact O-N 3.11Å; L358-L362 HydrophobicContact CG-CD1 4.26Å; L358-L362 WeakPolarHBondContact O-CB 3.14Å; L358-L362 VanDerWaalsContact O-CG 3.26Å; L358-L362 WeakPolarHBondContact O-CG 3.31Å; L358-L362 PolarHBondContact O-N 3.04Å; L358-L421 HydrophobicContact CD1-CD1 4.42Å |
| 359 | Q | 40.5 | Very low | 42.9 | Very low | 112 Ų | 112 | 88 Ų | 88 | 52% | 0.523 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69.6 | -36.4 | 176 | -170.7 | 170.7 | 3.7 | 0 | 0 | 111.3 | C355 E356 L362 L363 | C355-Q359 WeakPolarHBondContact O-CB 3.28Å; C355-Q359 PolarHBondContact O-N 3.27Å; E356-Q359 PolarHBondContact O-N 3.34Å; Q359-L362 PolarHBondContact O-N 3.18Å; Q359-L363 HydrophobicContact CG-CD1 4.33Å; Q359-L363 VanDerWaalsContact O-CB 3.27Å; Q359-L363 WeakPolarHBondContact O-CB 3.27Å; Q359-L363 WeakPolarHBondContact O-CD1 3.48Å; Q359-L363 WeakPolarHBondContact O-CG 3.44Å; Q359-L363 PolarHBondContact O-N 2.73Å |
| 360 | N | 44.5 | Very low | 43.4 | Very low | 96 Ų | 96 | 88.1 Ų | 88.1 | 51% | 0.513 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67.9 | -39 | 171.6 | -73.6 | -31.7 | 0 | 0 | 0 | 111.7 | E356 D357 L363 S364 | E356-N360 VanDerWaalsContact O-CB 3.31Å; E356-N360 WeakPolarHBondContact O-CB 3.22Å; E356-N360 PolarHBondContact O-N 3.45Å; E356-N360 PolarHBondContact O-ND2 3.21Å; E356-N360 VanDerWaalsContact O-ND2 3.09Å; D357-N360 PolarHBondContact O-N 3.3Å; N360-L363 PolarHBondContact O-N 3.26Å; N360-S364 WeakPolarHBondContact O-CB 3.47Å; N360-S364 PolarHBondContact O-N 2.95Å |
| 361 | F | 46.5 | Very low | 43.4 | Very low | 64 Ų | 64 | 87.1 Ų | 87.1 | 28% | 0.281 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -61.8 | -50 | 171.8 | -179.6 | -105.5 | 0 | 0 | 0 | 111.1 | D357 L358 L363 S364 V365 L421 | D357-F361 WeakPolarHBondContact O-CB 3.49Å; D357-F361 PolarHBondContact O-N 3.18Å; L358-F361 PolarHBondContact O-N 3.11Å; F361-L363 VanDerWaalsContact C-N 3.32Å; F361-L363 PolarHBondContact O-N 3Å; F361-S364 WeakPolarHBondContact O-CA 3.22Å; F361-S364 WeakPolarHBondContact O-CB 3.45Å; F361-S364 PolarHBondContact O-N 2.07Å; F361-V365 HydrophobicContact CD1-CG2 4.28Å; F361-V365 HydrophobicContact CE1-CG2 3.96Å; F361-V365 HydrophobicContact CE2-CG2 4.33Å; F361-V365 HydrophobicContact CZ-CG2 3.99Å; F361-V365 WeakPolarHBondContact O-CG2 3.47Å; F361-V365 PolarHBondContact O-N 3.24Å; F361-L421 HydrophobicContact CD1-CD1 3.99Å; F361-L421 HydrophobicContact CE1-CB 4.39Å; F361-L421 HydrophobicContact CE1-CD1 3.64Å |
| 362 | L | 43.9 | Very low | 43.4 | Very low | 83 Ų | 83 | 85 Ų | 85 | 44% | 0.435 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -64.2 | -34.5 | 177.5 | -71.7 | 169.4 | 0 | 0 | 0 | 112.8 | L358 Q359 R366 L421 | L358-L362 HydrophobicContact CG-CD1 4.26Å; L358-L362 WeakPolarHBondContact O-CB 3.14Å; L358-L362 VanDerWaalsContact O-CG 3.26Å; L358-L362 WeakPolarHBondContact O-CG 3.31Å; L358-L362 PolarHBondContact O-N 3.04Å; Q359-L362 PolarHBondContact O-N 3.18Å; L362-R366 WeakPolarHBondContact O-CB 3.29Å; L362-R366 PolarHBondContact O-N 3.12Å; L362-L421 HydrophobicContact CD2-CD1 4.13Å |
| 363 | L | 44.2 | Very low | 43.4 | Very low | 67 Ų | 67 | 79 Ų | 79 | 35% | 0.351 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66.1 | -37.6 | 171.5 | -79.1 | 165.4 | 0 | 0 | 0 | 111.5 | Q359 N360 F361 H367 | Q359-L363 HydrophobicContact CG-CD1 4.33Å; Q359-L363 VanDerWaalsContact O-CB 3.27Å; Q359-L363 WeakPolarHBondContact O-CB 3.27Å; Q359-L363 WeakPolarHBondContact O-CD1 3.48Å; Q359-L363 WeakPolarHBondContact O-CG 3.44Å; Q359-L363 PolarHBondContact O-N 2.73Å; N360-L363 PolarHBondContact O-N 3.26Å; F361-L363 VanDerWaalsContact C-N 3.32Å; F361-L363 PolarHBondContact O-N 3Å; L363-H367 WeakPolarHBondContact O-CB 3.07Å; L363-H367 PolarHBondContact O-CD2 3.37Å; L363-H367 VanDerWaalsContact O-CD2 3.26Å; L363-H367 PolarHBondContact O-N 3.39Å |
| 364 | S | 45 | Very low | 43.5 | Very low | 58 Ų | 58 | 80.6 Ų | 80.6 | 41% | 0.406 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -67.2 | -45.6 | 175.7 | -165 | 0 | 0 | 0 | 0 | 112.1 | N360 F361 R366 H367 Q368 | N360-S364 WeakPolarHBondContact O-CB 3.47Å; N360-S364 PolarHBondContact O-N 2.95Å; F361-S364 WeakPolarHBondContact O-CA 3.22Å; F361-S364 WeakPolarHBondContact O-CB 3.45Å; F361-S364 PolarHBondContact O-N 2.07Å; S364-R366 VanDerWaalsContact C-N 3.34Å; S364-R366 PolarHBondContact O-N 3.41Å; S364-H367 PolarHBondContact O-N 3.3Å; S364-Q368 PolarHBondContact O-N 3.21Å |
| 365 | V | 45.7 | Very low | 43.3 | Very low | 19 Ų | 19 | 79.7 Ų | 79.7 | 12% | 0.115 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 174.5 | 179.3 | 0 | 0 | 0 | 0 | 111.1 | F361 H367 Q368 C369 L414 E417 | F361-V365 HydrophobicContact CD1-CG2 4.28Å; F361-V365 HydrophobicContact CE1-CG2 3.96Å; F361-V365 HydrophobicContact CE2-CG2 4.33Å; F361-V365 HydrophobicContact CZ-CG2 3.99Å; F361-V365 WeakPolarHBondContact O-CG2 3.47Å; F361-V365 PolarHBondContact O-N 3.24Å; V365-H367 VanDerWaalsContact C-N 3.33Å; V365-H367 PolarHBondContact O-N 3Å; V365-Q368 PolarHBondContact O-N 3.41Å; V365-C369 PolarHBondContact O-N 3.08Å; V365-C369 PolarHBondContact O-SG 3.26Å; V365-L414 HydrophobicContact CG1-CD1 3.77Å; V365-E417 WeakPolarHBondContact CA-OE2 3.32Å; V365-E417 WeakPolarHBondContact CB-OE2 3.44Å; V365-E417 HydrophobicContact CG1-CB 4.17Å; V365-E417 WeakPolarHBondContact CG1-OE2 3.47Å; V365-E417 HydrophobicContact CG2-CB 3.88Å; V365-E417 HydrophobicContact CG2-CG 4.35Å; V365-E417 VanDerWaalsContact CG2-OE2 3.31Å; V365-E417 WeakPolarHBondContact CG2-OE2 2.97Å |
| 366 | R | 43 | Very low | 43.2 | Very low | 144 Ų | 144 | 78.5 Ų | 78.5 | 54% | 0.543 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.5 | -38.8 | 175.5 | -168.1 | -175.4 | 75 | 122.6 | 4.3 | 111.9 | L362 S364 C369 C370 | L362-R366 WeakPolarHBondContact O-CB 3.29Å; L362-R366 PolarHBondContact O-N 3.12Å; S364-R366 VanDerWaalsContact C-N 3.34Å; S364-R366 PolarHBondContact O-N 3.41Å; R366-C369 WeakPolarHBondContact O-CB 3.16Å; R366-C369 PolarHBondContact O-N 3.23Å; R366-C370 PolarHBondContact O-N 2.93Å; R366-C370 PolarHBondContact O-SG 3.11Å |
| 367 | H | 45.6 | Very low | 43.4 | Very low | 123 Ų | 123 | 76.6 Ų | 76.6 | 57% | 0.569 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -66.4 | -37.8 | 175.3 | -96.2 | -74.1 | 0 | 0 | 0 | 112.2 | L363 S364 V365 C370 Y371 | L363-H367 WeakPolarHBondContact O-CB 3.07Å; L363-H367 PolarHBondContact O-CD2 3.37Å; L363-H367 VanDerWaalsContact O-CD2 3.26Å; L363-H367 PolarHBondContact O-N 3.39Å; S364-H367 PolarHBondContact O-N 3.3Å; V365-H367 VanDerWaalsContact C-N 3.33Å; V365-H367 PolarHBondContact O-N 3Å; H367-C370 PolarHBondContact O-N 3.01Å; H367-Y371 WeakPolarHBondContact O-CB 3.37Å; H367-Y371 PolarHBondContact O-N 3.44Å |
| 368 | Q | 43.8 | Very low | 43.3 | Very low | 76 Ų | 76 | 75.5 Ų | 75.5 | 36% | 0.355 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -67.8 | -38.4 | 173.9 | -71 | -173.6 | 19.9 | 0 | 0 | 112.5 | S364 V365 C370 Y371 L372 E417 | S364-Q368 PolarHBondContact O-N 3.21Å; V365-Q368 PolarHBondContact O-N 3.41Å; Q368-C370 VanDerWaalsContact C-N 3.35Å; Q368-C370 PolarHBondContact O-N 3.03Å; Q368-Y371 PolarHBondContact O-N 2.79Å; Q368-L372 VanDerWaalsContact O-CB 3.24Å; Q368-L372 WeakPolarHBondContact O-CB 3.06Å; Q368-L372 PolarHBondContact O-N 3.44Å; Q368-E417 VanDerWaalsContact CD-CD 3.46Å; Q368-E417 PolarHBondContact NE2-OE1 3.48Å; Q368-E417 PolarHBondContact OE1-OE1 2.7Å; Q368-E417 PolarHBondContact OE1-OE2 3.44Å; Q368-E417 VanDerWaalsContact OE1-OE2 3.05Å |
| 369 | C | 42.3 | Very low | 43.2 | Very low | 38 Ų | 38 | 71.6 Ų | 71.6 | 26% | 0.257 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -58.7 | -44.3 | 169.4 | -63.1 | 0 | 0 | 0 | 0 | 112.6 | V365 R366 L372 T373 L414 | V365-C369 PolarHBondContact O-N 3.08Å; V365-C369 PolarHBondContact O-SG 3.26Å; R366-C369 WeakPolarHBondContact O-CB 3.16Å; R366-C369 PolarHBondContact O-N 3.23Å; C369-L372 WeakPolarHBondContact O-CB 3.31Å; C369-L372 PolarHBondContact O-N 3.16Å; C369-T373 WeakPolarHBondContact O-CB 3.32Å; C369-T373 PolarHBondContact O-N 2.72Å; C369-T373 PolarHBondContact O-OG1 3.06Å; C369-L414 HydrophobicContact CB-CD1 4.46Å; C369-L414 HydrophobicContact CB-CD2 4.14Å; C369-L414 WeakPolarHBondContact SG-CD1 3.39Å; C369-L414 WeakPolarHBondContact SG-CD2 3.16Å |
| 370 | C | 43.8 | Very low | 43.3 | Very low | 61 Ų | 61 | 70.3 Ų | 70.3 | 41% | 0.412 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -68.2 | -42.5 | -177.7 | -74.7 | 0 | 0 | 0 | 0 | 111.1 | R366 H367 Q368 L372 T373 E374 | R366-C370 PolarHBondContact O-N 2.93Å; R366-C370 PolarHBondContact O-SG 3.11Å; H367-C370 PolarHBondContact O-N 3.01Å; Q368-C370 VanDerWaalsContact C-N 3.35Å; Q368-C370 PolarHBondContact O-N 3.03Å; C370-L372 VanDerWaalsContact C-N 3.32Å; C370-L372 PolarHBondContact O-N 3.1Å; C370-T373 PolarHBondContact O-N 2.96Å; C370-T373 VanDerWaalsContact O-N 3.14Å; C370-E374 PolarHBondContact O-N 3.37Å |
| 371 | Y | 42.8 | Very low | 43.4 | Very low | 132 Ų | 132 | 69.4 Ų | 69.4 | 52% | 0.518 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -64.1 | -38 | 175.5 | -170.6 | -120.9 | 0 | 0 | 0 | 111.9 | H367 Q368 M375 | H367-Y371 WeakPolarHBondContact O-CB 3.37Å; H367-Y371 PolarHBondContact O-N 3.44Å; Q368-Y371 PolarHBondContact O-N 2.79Å; Y371-M375 WeakPolarHBondContact O-CB 3.48Å; Y371-M375 VanDerWaalsContact O-CG 3.3Å; Y371-M375 WeakPolarHBondContact O-CG 3.49Å; Y371-M375 PolarHBondContact O-N 3.38Å |
| 372 | L | 39.7 | Very low | 43 | Very low | 7 Ų | 7 | 72.2 Ų | 72.2 | 4% | 0.037 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60 | -42.9 | 169.8 | 170.3 | 58.5 | 0 | 0 | 0 | 113.6 | Q368 C369 C370 L376 L407 Q410 T411 L414 | Q368-L372 VanDerWaalsContact O-CB 3.24Å; Q368-L372 WeakPolarHBondContact O-CB 3.06Å; Q368-L372 PolarHBondContact O-N 3.44Å; C369-L372 WeakPolarHBondContact O-CB 3.31Å; C369-L372 PolarHBondContact O-N 3.16Å; C370-L372 VanDerWaalsContact C-N 3.32Å; C370-L372 PolarHBondContact O-N 3.1Å; L372-L376 HydrophobicContact CD1-CD1 4.39Å; L372-L376 WeakPolarHBondContact O-CB 3.46Å; L372-L376 PolarHBondContact O-N 3.41Å; L372-L407 HydrophobicContact CD1-CD2 3.75Å; L372-L407 VanDerWaalsContact CD1-O 3.22Å; L372-L407 WeakPolarHBondContact CD1-O 3.37Å; L372-Q410 HydrophobicContact CB-CB 3.78Å; L372-Q410 HydrophobicContact CD1-CB 3.12Å; L372-Q410 HydrophobicContact CD1-CG 4.4Å; L372-Q410 HydrophobicContact CD2-CB 4.39Å; L372-Q410 WeakPolarHBondContact CD2-O 3.22Å; L372-Q410 HydrophobicContact CG-CB 3.87Å; L372-T411 HydrophobicContact CD1-CG2 3.96Å; L372-T411 HydrophobicContact CD2-CG2 3.64Å; L372-T411 HydrophobicContact CG-CG2 4.29Å; L372-L414 HydrophobicContact CD2-CB 4.31Å; L372-L414 HydrophobicContact CD2-CD2 3.91Å |
| 373 | T | 41.4 | Very low | 42.9 | Very low | 71 Ų | 71 | 72.6 Ų | 72.6 | 44% | 0.436 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -72.8 | -38.1 | -177.9 | -54.3 | 0 | 0 | 0 | 0 | 111.4 | C369 C370 L376 Q377 | C369-T373 WeakPolarHBondContact O-CB 3.32Å; C369-T373 PolarHBondContact O-N 2.72Å; C369-T373 PolarHBondContact O-OG1 3.06Å; C370-T373 PolarHBondContact O-N 2.96Å; C370-T373 VanDerWaalsContact O-N 3.14Å; T373-L376 WeakPolarHBondContact O-CA 3.22Å; T373-L376 WeakPolarHBondContact O-CB 3.36Å; T373-L376 PolarHBondContact O-N 3.22Å; T373-Q377 PolarHBondContact O-N 3.37Å |
| 374 | E | 45.8 | Very low | 42.7 | Very low | 132 Ų | 132 | 73.6 Ų | 73.6 | 62% | 0.617 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -68.7 | -40.8 | 174.4 | -76.6 | -177.9 | 167.2 | 0 | 0 | 112 | C370 L376 Q377 D378 | C370-E374 PolarHBondContact O-N 3.37Å; E374-L376 VanDerWaalsContact C-N 3.27Å; E374-L376 PolarHBondContact O-N 2.96Å; E374-Q377 PolarHBondContact O-N 3.25Å; E374-D378 WeakPolarHBondContact O-CB 3.3Å; E374-D378 PolarHBondContact O-N 3.43Å |
| 375 | M | 39.5 | Very low | 42.8 | Very low | 24 Ų | 24 | 76.1 Ų | 76.1 | 12% | 0.118 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -61.2 | -38.6 | 168.8 | -75.2 | -64.7 | -55 | 0 | 0 | 110.5 | Y371 Q377 D378 V379 Q406 Q410 | Y371-M375 WeakPolarHBondContact O-CB 3.48Å; Y371-M375 VanDerWaalsContact O-CG 3.3Å; Y371-M375 WeakPolarHBondContact O-CG 3.49Å; Y371-M375 PolarHBondContact O-N 3.38Å; M375-Q377 VanDerWaalsContact C-N 3.33Å; M375-Q377 PolarHBondContact O-N 3.12Å; M375-D378 PolarHBondContact O-N 3.23Å; M375-V379 VanDerWaalsContact O-CB 3.31Å; M375-V379 WeakPolarHBondContact O-CB 3.41Å; M375-V379 WeakPolarHBondContact O-CG2 3.49Å; M375-V379 PolarHBondContact O-N 3.03Å; M375-Q406 HydrophobicContact CE-CB 3.86Å; M375-Q406 HydrophobicContact CE-CG 3.59Å; M375-Q410 VanDerWaalsContact CG-OE1 3.29Å |
| 376 | L | 41.7 | Very low | 42.4 | Very low | 60 Ų | 60 | 77.8 Ų | 77.8 | 31% | 0.314 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -55.7 | -46.7 | 173.8 | -136.5 | 121.3 | 0 | 0 | 0 | 112.6 | L372 T373 E374 V379 I380 L407 | L372-L376 HydrophobicContact CD1-CD1 4.39Å; L372-L376 WeakPolarHBondContact O-CB 3.46Å; L372-L376 PolarHBondContact O-N 3.41Å; T373-L376 WeakPolarHBondContact O-CA 3.22Å; T373-L376 WeakPolarHBondContact O-CB 3.36Å; T373-L376 PolarHBondContact O-N 3.22Å; E374-L376 VanDerWaalsContact C-N 3.27Å; E374-L376 PolarHBondContact O-N 2.96Å; L376-V379 WeakPolarHBondContact O-CB 2.92Å; L376-V379 PolarHBondContact O-N 3.37Å; L376-I380 HydrophobicContact CD2-CD1 3.87Å; L376-I380 VanDerWaalsContact O-CD1 3.31Å; L376-I380 WeakPolarHBondContact O-CD1 3.44Å; L376-I380 WeakPolarHBondContact O-CG1 3.26Å; L376-I380 PolarHBondContact O-N 3.42Å; L376-L407 HydrophobicContact CB-CD1 4.33Å; L376-L407 HydrophobicContact CB-CD2 3.4Å; L376-L407 HydrophobicContact CB-CG 4.16Å; L376-L407 HydrophobicContact CD1-CD2 3.06Å; L376-L407 HydrophobicContact CD1-CG 4.38Å; L376-L407 HydrophobicContact CD2-CD1 3.28Å; L376-L407 HydrophobicContact CD2-CD2 3.28Å; L376-L407 HydrophobicContact CD2-CG 3.78Å; L376-L407 HydrophobicContact CG-CD1 4.12Å; L376-L407 HydrophobicContact CG-CD2 3.19Å; L376-L407 HydrophobicContact CG-CG 4.12Å |
| 377 | Q | 43.8 | Very low | 42.2 | Very low | 71 Ų | 71 | 75.3 Ų | 75.3 | 33% | 0.332 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -76.8 | -36 | -177.8 | -98.4 | 160.2 | -35.4 | 0 | 0 | 113 | S174 T373 E374 M375 V379 I380 S381 | S174-Q377 PolarHBondContact O-NE2 3.46Å; T373-Q377 PolarHBondContact O-N 3.37Å; E374-Q377 PolarHBondContact O-N 3.25Å; M375-Q377 VanDerWaalsContact C-N 3.33Å; M375-Q377 PolarHBondContact O-N 3.12Å; Q377-V379 PolarHBondContact O-N 3.32Å; Q377-I380 PolarHBondContact O-N 3.44Å; Q377-S381 WeakPolarHBondContact O-CB 3.19Å; Q377-S381 PolarHBondContact O-N 3.01Å; Q377-S381 PolarHBondContact O-OG 3.01Å |
| 378 | D | 42.8 | Very low | 41.9 | Very low | 63 Ų | 63 | 74.1 Ų | 74.1 | 34% | 0.337 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -65.9 | -24.8 | 171.3 | -167.6 | 53.8 | 0 | 0 | 0 | 111.6 | E374 M375 S381 R382 | E374-D378 WeakPolarHBondContact O-CB 3.3Å; E374-D378 PolarHBondContact O-N 3.43Å; M375-D378 PolarHBondContact O-N 3.23Å; D378-S381 WeakPolarHBondContact CA-OG 3.34Å; D378-S381 PolarHBondContact O-OG 2.94Å; D378-R382 VanDerWaalsContact O-CG 3.28Å; D378-R382 WeakPolarHBondContact O-CG 3.24Å; D378-R382 IonicContact OD1-NE 3.69Å; D378-R382 IonicContact OD2-CZ 2.78Å; D378-R382 VanDerWaalsContact OD2-CZ 3.28Å; D378-R382 IonicContact OD2-NE 2.69Å; D378-R382 PolarHBondContact OD2-NE 3.33Å; D378-R382 IonicContact OD2-NH2 2.9Å; D378-R382 PolarHBondContact OD2-NH2 3.31Å |
| 379 | V | 40.3 | Very low | 41.8 | Very low | 3 Ų | 3 | 77.3 Ų | 77.3 | 2% | 0.018 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -76.9 | -46.8 | 174.8 | 160.5 | 0 | 0 | 0 | 0 | 113.3 | M375 L376 Q377 S381 R382 F383 V403 L407 | M375-V379 VanDerWaalsContact O-CB 3.31Å; M375-V379 WeakPolarHBondContact O-CB 3.41Å; M375-V379 WeakPolarHBondContact O-CG2 3.49Å; M375-V379 PolarHBondContact O-N 3.03Å; L376-V379 WeakPolarHBondContact O-CB 2.92Å; L376-V379 PolarHBondContact O-N 3.37Å; Q377-V379 PolarHBondContact O-N 3.32Å; V379-S381 PolarHBondContact O-N 2.97Å; V379-R382 PolarHBondContact O-N 3.36Å; V379-F383 WeakPolarHBondContact O-CD2 3.3Å; V379-V403 HydrophobicContact CB-CB 4.19Å; V379-V403 HydrophobicContact CB-CG1 3.18Å; V379-V403 HydrophobicContact CG1-CB 4.12Å; V379-V403 HydrophobicContact CG1-CG1 3.33Å; V379-V403 HydrophobicContact CG2-CB 3.74Å; V379-V403 HydrophobicContact CG2-CG1 3.12Å; V379-V403 WeakPolarHBondContact CG2-O 3.49Å; V379-L407 HydrophobicContact CB-CD1 3.51Å; V379-L407 HydrophobicContact CB-CG 4.4Å; V379-L407 HydrophobicContact CG1-CD1 3.3Å; V379-L407 HydrophobicContact CG2-CD1 3.61Å; V379-L407 HydrophobicContact CG2-CG 4Å |
| 380 | I | 43.1 | Very low | 41.9 | Very low | 84 Ų | 84 | 81.4 Ų | 81.4 | 43% | 0.431 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68.2 | -26.5 | 179.3 | -67.9 | 164.7 | 0 | 0 | 0 | 110.8 | L376 Q377 | L376-I380 HydrophobicContact CD2-CD1 3.87Å; L376-I380 VanDerWaalsContact O-CD1 3.31Å; L376-I380 WeakPolarHBondContact O-CD1 3.44Å; L376-I380 WeakPolarHBondContact O-CG1 3.26Å; L376-I380 PolarHBondContact O-N 3.42Å; Q377-I380 PolarHBondContact O-N 3.44Å |
| 381 | S | 46.5 | Very low | 41.8 | Very low | 78 Ų | 78 | 83.8 Ų | 83.8 | 55% | 0.545 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -75 | -21.9 | 175.1 | 73.5 | 0 | 0 | 0 | 0 | 113.9 | Q377 D378 V379 | Q377-S381 WeakPolarHBondContact O-CB 3.19Å; Q377-S381 PolarHBondContact O-N 3.01Å; Q377-S381 PolarHBondContact O-OG 3.01Å; D378-S381 WeakPolarHBondContact CA-OG 3.34Å; D378-S381 PolarHBondContact O-OG 2.94Å; V379-S381 PolarHBondContact O-N 2.97Å |
| 382 | R | 39.4 | Very low | 41.7 | Very low | 122 Ų | 122 | 85 Ų | 85 | 46% | 0.46 | 45% | 0.454 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.3 | -4.6 | 177.5 | -70.5 | 176.3 | -165.9 | -157.8 | 8.6 | 114.3 | D378 V379 V403 | D378-R382 VanDerWaalsContact O-CG 3.28Å; D378-R382 WeakPolarHBondContact O-CG 3.24Å; D378-R382 IonicContact OD1-NE 3.69Å; D378-R382 IonicContact OD2-CZ 2.78Å; D378-R382 VanDerWaalsContact OD2-CZ 3.28Å; D378-R382 IonicContact OD2-NE 2.69Å; D378-R382 PolarHBondContact OD2-NE 3.33Å; D378-R382 IonicContact OD2-NH2 2.9Å; D378-R382 PolarHBondContact OD2-NH2 3.31Å; V379-R382 PolarHBondContact O-N 3.36Å; R382-V403 HydrophobicContact CB-CG1 4.27Å |
| 383 | F | 40.4 | Very low | 41.8 | Very low | 92 Ų | 92 | 90 Ų | 90 | 40% | 0.404 | 49% | 0.49 | S | S | . | . | S | Bend | trans | -92.9 | 129.6 | 173.4 | -86.7 | -90 | 0 | 0 | 0 | 111.9 | V379 R385 A400 | V379-F383 WeakPolarHBondContact O-CD2 3.3Å; F383-R385 PolarHBondContact O-N 3.37Å; F383-A400 HydrophobicContact CD1-CB 4.27Å; F383-A400 HydrophobicContact CE1-CB 3.46Å; F383-A400 VanDerWaalsContact CE1-CB 3.46Å; F383-A400 HydrophobicContact CE2-CB 3.8Å; F383-A400 HydrophobicContact CZ-CB 3.21Å |
| 384 | P | 39.9 | Very low | 41.6 | Very low | 88 Ų | 88 | 94.6 Ų | 94.6 | 57% | 0.571 | 51% | 0.511 | S | S | * | . | trans | -71 | 128.2 | -177.4 | -11.4 | 25.3 | 0 | 0 | 0 | 111.9 | Q386 | P384-Q386 VanDerWaalsContact C-N 3.29Å; P384-Q386 PolarHBondContact O-N 2.94Å | ||
| 385 | R | 47.2 | Very low | 41.9 | Very low | 110 Ų | 110 | 94.2 Ų | 94.2 | 42% | 0.415 | 51% | 0.513 | S | S | . | . | S | Bend | trans | -81.7 | 11.8 | -176.8 | -66.6 | -173.6 | 176.7 | -145.4 | -0.9 | 115.4 | S140 F383 | S140-R385 VanDerWaalsContact CB-NH2 3.32Å; S140-R385 PolarHBondContact OG-NH1 3.34Å; F383-R385 PolarHBondContact O-N 3.37Å |
| 386 | Q | 37.3 | Very low | 42.1 | Very low | 55 Ų | 55 | 96.6 Ų | 96.6 | 26% | 0.257 | 53% | 0.531 | S | S | . | . | trans | -143.2 | 128.3 | 177.6 | -91 | 173 | -20.7 | 0 | 0 | 112.9 | D102 P384 S388 Q389 | D102-Q386 PolarHBondContact OD2-NE2 3.13Å; D102-Q386 PolarHBondContact OD2-OE1 3.22Å; P384-Q386 VanDerWaalsContact C-N 3.29Å; P384-Q386 PolarHBondContact O-N 2.94Å; Q386-S388 PolarHBondContact O-N 3.02Å; Q386-S388 VanDerWaalsContact O-N 3.13Å; Q386-Q389 PolarHBondContact O-N 3.13Å | ||
| 387 | A | 38.9 | Very low | 42.3 | Very low | 91 Ų | 91 | 101.3 Ų | 101.3 | 75% | 0.752 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | -11.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 388 | S | 39.9 | Very low | 42.6 | Very low | 98 Ų | 98 | 105.8 Ų | 105.8 | 69% | 0.685 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | -6.1 | -176.8 | 51.5 | 0 | 0 | 0 | 0 | 115.1 | Q386 | Q386-S388 PolarHBondContact O-N 3.02Å; Q386-S388 VanDerWaalsContact O-N 3.13Å |
| 389 | Q | 41.1 | Very low | 42.7 | Very low | 144 Ų | 144 | 108.6 Ų | 108.6 | 67% | 0.673 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -94.1 | 1.7 | 170.8 | -77.3 | -174.4 | -9.1 | 0 | 0 | 113.3 | Q386 V391 | Q386-Q389 PolarHBondContact O-N 3.13Å; Q389-V391 PolarHBondContact O-N 3.15Å; Q389-V391 VanDerWaalsContact O-N 3.08Å |
| 390 | L | 44.2 | Very low | 42.8 | Very low | 123 Ų | 123 | 109.1 Ų | 109.1 | 64% | 0.644 | 58% | 0.583 | S | S | * | * | S | Bend | trans | -67.9 | -2.5 | 175.3 | -101.5 | 148.3 | 0 | 0 | 0 | 114 | ||
| 391 | V | 43.2 | Very low | 42.9 | Very low | 112 Ų | 112 | 111.9 Ų | 111.9 | 68% | 0.679 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -115.5 | 101.7 | -179.9 | -179 | 0 | 0 | 0 | 0 | 108.7 | Q389 | Q389-V391 PolarHBondContact O-N 3.15Å; Q389-V391 VanDerWaalsContact O-N 3.08Å |
| 392 | L | 39.3 | Very low | 43 | Very low | 156 Ų | 156 | 111.7 Ų | 111.7 | 82% | 0.817 | 59% | 0.59 | S | S | * | * | S | Bend | trans | 97.6 | 105.2 | 162.2 | -56.5 | 160.2 | 0 | 0 | 0 | 116.7 | ||
| 393 | S | 41.2 | Very low | 43.2 | Very low | 112 Ų | 112 | 106.1 Ų | 106.1 | 78% | 0.783 | 57% | 0.569 | S | S | * | * | S | Bend | trans | 97.9 | 111.6 | 158.5 | 73.1 | 0 | 0 | 0 | 0 | 117.5 | ||
| 394 | L | 38.9 | Very low | 43.1 | Very low | 168 Ų | 168 | 104.5 Ų | 104.5 | 88% | 0.88 | 57% | 0.569 | S | S | * | * | S | Bend | trans | 89.6 | 123.9 | 176.9 | -64.4 | 112.4 | 0 | 0 | 0 | 117 | P396 | L394-P396 VanDerWaalsContact O-CD 3.32Å; L394-P396 WeakPolarHBondContact O-CD 3.5Å |
| 395 | D | 50.7 | Low | 43.1 | Very low | 124 Ų | 124 | 103.3 Ų | 103.3 | 66% | 0.663 | 56% | 0.562 | S | S | * | * | trans | -77.8 | 104.7 | -156.5 | -166.7 | 2.3 | 0 | 0 | 0 | 113.8 | K397 | D395-K397 VanDerWaalsContact C-N 3.31Å; D395-K397 PolarHBondContact O-N 3.05Å | ||
| 396 | P | 43.9 | Very low | 43 | Very low | 74 Ų | 74 | 102.6 Ų | 102.6 | 48% | 0.481 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -78.4 | -3.9 | -163.6 | 30.6 | -35 | 0 | 0 | 0 | 115 | L394 A400 | L394-P396 VanDerWaalsContact O-CD 3.32Å; L394-P396 WeakPolarHBondContact O-CD 3.5Å; P396-A400 VanDerWaalsContact O-CB 3.24Å; P396-A400 WeakPolarHBondContact O-CB 3.41Å |
| 397 | K | 46.8 | Very low | 43.1 | Very low | 159 Ų | 159 | 100.5 Ų | 100.5 | 69% | 0.691 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -84.4 | -30.2 | -176.3 | -78.5 | -176.7 | 176.5 | -178.5 | 0 | 114 | D395 Q401 | D395-K397 VanDerWaalsContact C-N 3.31Å; D395-K397 PolarHBondContact O-N 3.05Å; K397-Q401 WeakPolarHBondContact O-CB 3.3Å |
| 398 | K | 48.7 | Very low | 43.2 | Very low | 165 Ų | 165 | 100.5 Ų | 100.5 | 72% | 0.717 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -80.1 | -47.3 | -173.9 | -90 | -176.9 | 173.3 | 179.6 | 0 | 113.4 | T402 | K398-T402 PolarHBondContact O-N 3.33Å; K398-T402 VanDerWaalsContact O-N 3.15Å; K398-T402 PolarHBondContact O-OG1 2.6Å |
| 399 | E | 46.3 | Very low | 43.5 | Very low | 123 Ų | 123 | 99.9 Ų | 99.9 | 58% | 0.575 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -69.8 | -48.7 | -178.3 | -79.1 | -176.6 | 157.2 | 0 | 0 | 111.7 | Q401 T402 V403 | E399-Q401 PolarHBondContact O-N 2.66Å; E399-Q401 VanDerWaalsContact O-N 3.14Å; E399-T402 WeakPolarHBondContact CA-OG1 3.44Å; E399-T402 PolarHBondContact O-N 3.34Å; E399-T402 PolarHBondContact O-OG1 3Å; E399-V403 WeakPolarHBondContact O-CB 3.47Å; E399-V403 WeakPolarHBondContact O-CG2 3.28Å; E399-V403 PolarHBondContact O-N 2.87Å; E399-V403 VanDerWaalsContact O-N 3.15Å |
| 400 | A | 42.2 | Very low | 43.5 | Very low | 14 Ų | 14 | 94.4 Ų | 94.4 | 12% | 0.116 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -49.1 | -39.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | F383 P396 C404 | F383-A400 HydrophobicContact CD1-CB 4.27Å; F383-A400 HydrophobicContact CE1-CB 3.46Å; F383-A400 VanDerWaalsContact CE1-CB 3.46Å; F383-A400 HydrophobicContact CE2-CB 3.8Å; F383-A400 HydrophobicContact CZ-CB 3.21Å; P396-A400 VanDerWaalsContact O-CB 3.24Å; P396-A400 WeakPolarHBondContact O-CB 3.41Å; A400-C404 PolarHBondContact O-N 3.28Å; A400-C404 VanDerWaalsContact O-N 3.14Å; A400-C404 PolarHBondContact O-SG 3.05Å |
| 401 | Q | 45 | Very low | 43.2 | Very low | 141 Ų | 141 | 91.7 Ų | 91.7 | 66% | 0.659 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -84.4 | -34.3 | -174.5 | -154 | 171 | 17.4 | 0 | 0 | 112.3 | K397 E399 V403 S405 | K397-Q401 WeakPolarHBondContact O-CB 3.3Å; E399-Q401 PolarHBondContact O-N 2.66Å; E399-Q401 VanDerWaalsContact O-N 3.14Å; Q401-V403 PolarHBondContact O-N 3.16Å; Q401-S405 WeakPolarHBondContact O-CB 3.37Å; Q401-S405 PolarHBondContact O-N 3.47Å; Q401-S405 PolarHBondContact O-OG 3.31Å |
| 402 | T | 47.9 | Very low | 43.1 | Very low | 75 Ų | 75 | 90.5 Ų | 90.5 | 46% | 0.46 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64 | -29.9 | 170.7 | 38.8 | 0 | 0 | 0 | 0 | 113 | K398 E399 S405 Q406 | K398-T402 PolarHBondContact O-N 3.33Å; K398-T402 VanDerWaalsContact O-N 3.15Å; K398-T402 PolarHBondContact O-OG1 2.6Å; E399-T402 WeakPolarHBondContact CA-OG1 3.44Å; E399-T402 PolarHBondContact O-N 3.34Å; E399-T402 PolarHBondContact O-OG1 3Å; T402-S405 VanDerWaalsContact C-OG 3.27Å; T402-S405 VanDerWaalsContact CA-OG 3.27Å; T402-S405 WeakPolarHBondContact CA-OG 3.34Å; T402-S405 PolarHBondContact O-OG 2.87Å; T402-Q406 WeakPolarHBondContact O-CB 3.23Å; T402-Q406 PolarHBondContact O-N 3.35Å; T402-Q406 VanDerWaalsContact O-N 3.11Å |
| 403 | V | 43.6 | Very low | 43.4 | Very low | 5 Ų | 5 | 86.3 Ų | 86.3 | 3% | 0.03 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -88.1 | -44.1 | -167.7 | 165.9 | 0 | 0 | 0 | 0 | 107.2 | V379 R382 E399 Q401 S405 Q406 L407 | V379-V403 HydrophobicContact CB-CB 4.19Å; V379-V403 HydrophobicContact CB-CG1 3.18Å; V379-V403 HydrophobicContact CG1-CB 4.12Å; V379-V403 HydrophobicContact CG1-CG1 3.33Å; V379-V403 HydrophobicContact CG2-CB 3.74Å; V379-V403 HydrophobicContact CG2-CG1 3.12Å; V379-V403 WeakPolarHBondContact CG2-O 3.49Å; R382-V403 HydrophobicContact CB-CG1 4.27Å; E399-V403 WeakPolarHBondContact O-CB 3.47Å; E399-V403 WeakPolarHBondContact O-CG2 3.28Å; E399-V403 PolarHBondContact O-N 2.87Å; E399-V403 VanDerWaalsContact O-N 3.15Å; Q401-V403 PolarHBondContact O-N 3.16Å; V403-S405 VanDerWaalsContact C-N 3.29Å; V403-S405 PolarHBondContact O-N 3.47Å; V403-Q406 PolarHBondContact O-N 3.04Å; V403-L407 PolarHBondContact O-N 3.32Å |
| 404 | C | 38.5 | Very low | 43.3 | Very low | 58 Ų | 58 | 82.7 Ų | 82.7 | 39% | 0.392 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -65.1 | -26.9 | 168.4 | -71.8 | 0 | 0 | 0 | 0 | 114.3 | A400 L407 V408 | A400-C404 PolarHBondContact O-N 3.28Å; A400-C404 VanDerWaalsContact O-N 3.14Å; A400-C404 PolarHBondContact O-SG 3.05Å; C404-L407 WeakPolarHBondContact O-CB 3.13Å; C404-V408 WeakPolarHBondContact O-CG2 3.44Å; C404-V408 PolarHBondContact O-N 3.47Å |
| 405 | S | 40.7 | Very low | 43.3 | Very low | 63 Ų | 63 | 81 Ų | 81 | 44% | 0.441 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -79.9 | -35.7 | 178.4 | 41.9 | 0 | 0 | 0 | 0 | 113.1 | Q401 T402 V403 L407 V408 V409 | Q401-S405 WeakPolarHBondContact O-CB 3.37Å; Q401-S405 PolarHBondContact O-N 3.47Å; Q401-S405 PolarHBondContact O-OG 3.31Å; T402-S405 VanDerWaalsContact C-OG 3.27Å; T402-S405 VanDerWaalsContact CA-OG 3.27Å; T402-S405 WeakPolarHBondContact CA-OG 3.34Å; T402-S405 PolarHBondContact O-OG 2.87Å; V403-S405 VanDerWaalsContact C-N 3.29Å; V403-S405 PolarHBondContact O-N 3.47Å; S405-L407 PolarHBondContact O-N 3.49Å; S405-V408 PolarHBondContact O-N 2.83Å; S405-V409 WeakPolarHBondContact O-CG2 3.27Å; S405-V409 PolarHBondContact O-N 3.3Å |
| 406 | Q | 43.8 | Very low | 43.1 | Very low | 94 Ų | 94 | 81.4 Ų | 81.4 | 44% | 0.439 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -65.4 | -26.3 | 175.2 | -146.9 | 156 | -19.3 | 0 | 0 | 112.7 | M375 T402 V403 Q410 | M375-Q406 HydrophobicContact CE-CB 3.86Å; M375-Q406 HydrophobicContact CE-CG 3.59Å; T402-Q406 WeakPolarHBondContact O-CB 3.23Å; T402-Q406 PolarHBondContact O-N 3.35Å; T402-Q406 VanDerWaalsContact O-N 3.11Å; V403-Q406 PolarHBondContact O-N 3.04Å; Q406-Q410 PolarHBondContact O-N 3.43Å |
| 407 | L | 39.6 | Very low | 43 | Very low | 12 Ų | 12 | 79.3 Ų | 79.3 | 6% | 0.063 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -75.6 | -40.3 | 178 | -109.4 | 169.7 | 0 | 0 | 0 | 115.9 | L372 L376 V379 V403 C404 S405 V409 T411 | L372-L407 HydrophobicContact CD1-CD2 3.75Å; L372-L407 VanDerWaalsContact CD1-O 3.22Å; L372-L407 WeakPolarHBondContact CD1-O 3.37Å; L376-L407 HydrophobicContact CB-CD1 4.33Å; L376-L407 HydrophobicContact CB-CD2 3.4Å; L376-L407 HydrophobicContact CB-CG 4.16Å; L376-L407 HydrophobicContact CD1-CD2 3.06Å; L376-L407 HydrophobicContact CD1-CG 4.38Å; L376-L407 HydrophobicContact CD2-CD1 3.28Å; L376-L407 HydrophobicContact CD2-CD2 3.28Å; L376-L407 HydrophobicContact CD2-CG 3.78Å; L376-L407 HydrophobicContact CG-CD1 4.12Å; L376-L407 HydrophobicContact CG-CD2 3.19Å; L376-L407 HydrophobicContact CG-CG 4.12Å; V379-L407 HydrophobicContact CB-CD1 3.51Å; V379-L407 HydrophobicContact CB-CG 4.4Å; V379-L407 HydrophobicContact CG1-CD1 3.3Å; V379-L407 HydrophobicContact CG2-CD1 3.61Å; V379-L407 HydrophobicContact CG2-CG 4Å; V403-L407 PolarHBondContact O-N 3.32Å; C404-L407 WeakPolarHBondContact O-CB 3.13Å; S405-L407 PolarHBondContact O-N 3.49Å; L407-V409 VanDerWaalsContact C-N 3.3Å; L407-T411 PolarHBondContact O-N 3.39Å; L407-T411 PolarHBondContact O-OG1 3.31Å |
| 408 | V | 42.3 | Very low | 42.6 | Very low | 90 Ų | 90 | 75.7 Ų | 75.7 | 55% | 0.545 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -71.7 | -31.5 | 178.4 | 171.5 | 0 | 0 | 0 | 0 | 110.3 | C404 S405 T411 K412 | C404-V408 WeakPolarHBondContact O-CG2 3.44Å; C404-V408 PolarHBondContact O-N 3.47Å; S405-V408 PolarHBondContact O-N 2.83Å; V408-T411 VanDerWaalsContact CA-OG1 3.27Å; V408-T411 WeakPolarHBondContact CA-OG1 3.2Å; V408-T411 PolarHBondContact O-OG1 2.94Å; V408-T411 VanDerWaalsContact O-OG1 3.07Å; V408-K412 PolarHBondContact O-N 2.89Å |
| 409 | V | 46.6 | Very low | 42.3 | Very low | 85 Ų | 85 | 71.1 Ų | 71.1 | 52% | 0.515 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.6 | -48.3 | 174.1 | 169.5 | 0 | 0 | 0 | 0 | 111 | S405 L407 T411 K412 D413 | S405-V409 WeakPolarHBondContact O-CG2 3.27Å; S405-V409 PolarHBondContact O-N 3.3Å; L407-V409 VanDerWaalsContact C-N 3.3Å; V409-T411 VanDerWaalsContact C-N 3.34Å; V409-T411 PolarHBondContact O-N 3.3Å; V409-K412 PolarHBondContact O-N 2.96Å; V409-D413 PolarHBondContact O-N 3.29Å; V409-D413 VanDerWaalsContact O-N 3.15Å |
| 410 | Q | 40.8 | Very low | 42.1 | Very low | 30 Ų | 30 | 67.7 Ų | 67.7 | 14% | 0.14 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -71.9 | -27.3 | -176.5 | -75.6 | -176.1 | -31.6 | 0 | 0 | 113.3 | L372 M375 Q406 K412 L414 | L372-Q410 HydrophobicContact CB-CB 3.78Å; L372-Q410 HydrophobicContact CD1-CB 3.12Å; L372-Q410 HydrophobicContact CD1-CG 4.4Å; L372-Q410 HydrophobicContact CD2-CB 4.39Å; L372-Q410 WeakPolarHBondContact CD2-O 3.22Å; L372-Q410 HydrophobicContact CG-CB 3.87Å; M375-Q410 VanDerWaalsContact CG-OE1 3.29Å; Q406-Q410 PolarHBondContact O-N 3.43Å; Q410-K412 VanDerWaalsContact C-N 3.32Å; Q410-L414 PolarHBondContact O-N 3.17Å |
| 411 | T | 37 | Very low | 42 | Very low | 66 Ų | 66 | 69.7 Ų | 69.7 | 41% | 0.405 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -71.7 | -30.7 | 175.8 | 25.3 | 0 | 0 | 0 | 0 | 111 | L372 L407 V408 V409 Q415 | L372-T411 HydrophobicContact CD1-CG2 3.96Å; L372-T411 HydrophobicContact CD2-CG2 3.64Å; L372-T411 HydrophobicContact CG-CG2 4.29Å; L407-T411 PolarHBondContact O-N 3.39Å; L407-T411 PolarHBondContact O-OG1 3.31Å; V408-T411 VanDerWaalsContact CA-OG1 3.27Å; V408-T411 WeakPolarHBondContact CA-OG1 3.2Å; V408-T411 PolarHBondContact O-OG1 2.94Å; V408-T411 VanDerWaalsContact O-OG1 3.07Å; V409-T411 VanDerWaalsContact C-N 3.34Å; V409-T411 PolarHBondContact O-N 3.3Å; T411-Q415 PolarHBondContact O-N 3.23Å |
| 412 | K | 41.8 | Very low | 41.9 | Very low | 86 Ų | 86 | 67.4 Ų | 67.4 | 37% | 0.374 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -75.7 | -35.6 | 173.9 | -96.4 | -174.9 | 173.9 | 179.3 | 0 | 113.3 | E280 V408 V409 Q410 Q415 K416 | E280-K412 IonicContact OE1-NZ 3.7Å; E280-K412 PolarHBondContact OE1-NZ 3.41Å; E280-K412 IonicContact OE2-NZ 2.87Å; E280-K412 PolarHBondContact OE2-NZ 3.07Å; V408-K412 PolarHBondContact O-N 2.89Å; V409-K412 PolarHBondContact O-N 2.96Å; Q410-K412 VanDerWaalsContact C-N 3.32Å; K412-Q415 PolarHBondContact O-N 3.1Å; K412-K416 PolarHBondContact O-N 3.35Å |
| 413 | D | 44.8 | Very low | 41.6 | Very low | 69 Ų | 69 | 68.8 Ų | 68.8 | 37% | 0.369 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -69.4 | -37.4 | 176.5 | -71.6 | -25.1 | 0 | 0 | 0 | 112 | V409 Q415 K416 E417 | V409-D413 PolarHBondContact O-N 3.29Å; V409-D413 VanDerWaalsContact O-N 3.15Å; D413-Q415 VanDerWaalsContact C-N 3.31Å; D413-Q415 PolarHBondContact O-N 3.03Å; D413-K416 WeakPolarHBondContact O-CB 3.45Å; D413-K416 PolarHBondContact O-N 3.23Å; D413-K416 VanDerWaalsContact O-N 3.17Å; D413-K416 IonicContact OD1-NZ 3.49Å; D413-E417 PolarHBondContact O-N 3.43Å |
| 414 | L | 40.5 | Very low | 41.5 | Very low | 36 Ų | 36 | 72.3 Ų | 72.3 | 19% | 0.188 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -62.3 | -37.5 | 173.3 | 179.9 | 56.2 | 0 | 0 | 0 | 113.2 | V365 C369 L372 Q410 K416 E417 V418 | V365-L414 HydrophobicContact CG1-CD1 3.77Å; C369-L414 HydrophobicContact CB-CD1 4.46Å; C369-L414 HydrophobicContact CB-CD2 4.14Å; C369-L414 WeakPolarHBondContact SG-CD1 3.39Å; C369-L414 WeakPolarHBondContact SG-CD2 3.16Å; L372-L414 HydrophobicContact CD2-CB 4.31Å; L372-L414 HydrophobicContact CD2-CD2 3.91Å; Q410-L414 PolarHBondContact O-N 3.17Å; L414-K416 VanDerWaalsContact C-N 3.28Å; L414-K416 PolarHBondContact O-N 3.27Å; L414-E417 PolarHBondContact O-N 2.91Å; L414-V418 WeakPolarHBondContact O-CG2 3.28Å; L414-V418 PolarHBondContact O-N 3.3Å |
| 415 | Q | 38.8 | Very low | 41.7 | Very low | 131 Ų | 131 | 74.2 Ų | 74.2 | 61% | 0.612 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -69.2 | -27 | 178.3 | -163.7 | 176.6 | -1.8 | 0 | 0 | 112.5 | T411 K412 D413 S419 | T411-Q415 PolarHBondContact O-N 3.23Å; K412-Q415 PolarHBondContact O-N 3.1Å; D413-Q415 VanDerWaalsContact C-N 3.31Å; D413-Q415 PolarHBondContact O-N 3.03Å; Q415-S419 PolarHBondContact O-N 2.94Å; Q415-S419 PolarHBondContact O-OG 3.13Å |
| 416 | K | 44.9 | Very low | 41.8 | Very low | 133 Ų | 133 | 74.2 Ų | 74.2 | 58% | 0.578 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -73.5 | -40.6 | 173.9 | -71.8 | 174.3 | -176.9 | 166.3 | 0 | 112.2 | K412 D413 L414 V418 S419 C420 | K412-K416 PolarHBondContact O-N 3.35Å; D413-K416 WeakPolarHBondContact O-CB 3.45Å; D413-K416 PolarHBondContact O-N 3.23Å; D413-K416 VanDerWaalsContact O-N 3.17Å; D413-K416 IonicContact OD1-NZ 3.49Å; L414-K416 VanDerWaalsContact C-N 3.28Å; L414-K416 PolarHBondContact O-N 3.27Å; K416-V418 VanDerWaalsContact C-N 3.33Å; K416-V418 PolarHBondContact O-N 2.93Å; K416-S419 PolarHBondContact O-N 3.47Å; K416-C420 PolarHBondContact O-N 2.84Å |
| 417 | E | 41.7 | Very low | 41.7 | Very low | 31 Ų | 31 | 76.5 Ų | 76.5 | 15% | 0.145 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -64.8 | -37.7 | 176.1 | -69.3 | -169.7 | 143.5 | 0 | 0 | 112.3 | V365 Q368 D413 L414 S419 C420 L421 | V365-E417 WeakPolarHBondContact CA-OE2 3.32Å; V365-E417 WeakPolarHBondContact CB-OE2 3.44Å; V365-E417 HydrophobicContact CG1-CB 4.17Å; V365-E417 WeakPolarHBondContact CG1-OE2 3.47Å; V365-E417 HydrophobicContact CG2-CB 3.88Å; V365-E417 HydrophobicContact CG2-CG 4.35Å; V365-E417 VanDerWaalsContact CG2-OE2 3.31Å; V365-E417 WeakPolarHBondContact CG2-OE2 2.97Å; Q368-E417 VanDerWaalsContact CD-CD 3.46Å; Q368-E417 PolarHBondContact NE2-OE1 3.48Å; Q368-E417 PolarHBondContact OE1-OE1 2.7Å; Q368-E417 PolarHBondContact OE1-OE2 3.44Å; Q368-E417 VanDerWaalsContact OE1-OE2 3.05Å; D413-E417 PolarHBondContact O-N 3.43Å; L414-E417 PolarHBondContact O-N 2.91Å; E417-S419 VanDerWaalsContact C-N 3.33Å; E417-S419 PolarHBondContact O-N 3.46Å; E417-C420 PolarHBondContact O-N 3.14Å; E417-L421 PolarHBondContact O-N 2.93Å; E417-L421 VanDerWaalsContact O-N 3.08Å |
| 418 | V | 39.6 | Very low | 41.8 | Very low | 83 Ų | 83 | 82.1 Ų | 82.1 | 50% | 0.503 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -65.1 | -35.9 | 174.3 | 173 | 0 | 0 | 0 | 0 | 112.1 | L414 K416 H422 | L414-V418 WeakPolarHBondContact O-CG2 3.28Å; L414-V418 PolarHBondContact O-N 3.3Å; K416-V418 VanDerWaalsContact C-N 3.33Å; K416-V418 PolarHBondContact O-N 2.93Å; V418-H422 PolarHBondContact O-N 2.85Å |
| 419 | S | 41.8 | Very low | 41.6 | Very low | 68 Ų | 68 | 80.2 Ų | 80.2 | 48% | 0.476 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -75.1 | -29.7 | 177 | -58.4 | 0 | 0 | 0 | 0 | 112.7 | Q415 K416 E417 H422 N423 | Q415-S419 PolarHBondContact O-N 2.94Å; Q415-S419 PolarHBondContact O-OG 3.13Å; K416-S419 PolarHBondContact O-N 3.47Å; E417-S419 VanDerWaalsContact C-N 3.33Å; E417-S419 PolarHBondContact O-N 3.46Å; S419-H422 WeakPolarHBondContact O-CB 3.45Å; S419-H422 PolarHBondContact O-N 3.29Å; S419-N423 PolarHBondContact O-N 3.49Å; S419-N423 VanDerWaalsContact O-N 3.17Å |
| 420 | C | 42.5 | Very low | 41.3 | Very low | 52 Ų | 52 | 79 Ų | 79 | 35% | 0.351 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -70 | -39.3 | 173.5 | -164.8 | 0 | 0 | 0 | 0 | 111.9 | K416 E417 H422 N423 L424 | K416-C420 PolarHBondContact O-N 2.84Å; E417-C420 PolarHBondContact O-N 3.14Å; C420-H422 VanDerWaalsContact C-N 3.28Å; C420-H422 PolarHBondContact O-N 3.38Å; C420-N423 PolarHBondContact O-N 2.91Å; C420-L424 PolarHBondContact O-N 3.46Å; C420-L424 VanDerWaalsContact O-N 3.13Å |
| 421 | L | 40.4 | Very low | 41.3 | Very low | 56 Ų | 56 | 81 Ų | 81 | 29% | 0.293 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -59.8 | -39.4 | 171.8 | -166.4 | 86.6 | 0 | 0 | 0 | 111.5 | L358 F361 L362 E417 L424 L425 | L358-L421 HydrophobicContact CD1-CD1 4.42Å; F361-L421 HydrophobicContact CD1-CD1 3.99Å; F361-L421 HydrophobicContact CE1-CB 4.39Å; F361-L421 HydrophobicContact CE1-CD1 3.64Å; L362-L421 HydrophobicContact CD2-CD1 4.13Å; E417-L421 PolarHBondContact O-N 2.93Å; E417-L421 VanDerWaalsContact O-N 3.08Å; L421-L424 PolarHBondContact O-N 3.29Å; L421-L425 PolarHBondContact O-N 3.41Å |
| 422 | H | 42.5 | Very low | 41.5 | Very low | 92 Ų | 92 | 84.4 Ų | 84.4 | 43% | 0.426 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.2 | -39.4 | 177 | -170.5 | -76.4 | 0 | 0 | 0 | 112.6 | V418 S419 C420 L425 C426 | V418-H422 PolarHBondContact O-N 2.85Å; S419-H422 WeakPolarHBondContact O-CB 3.45Å; S419-H422 PolarHBondContact O-N 3.29Å; C420-H422 VanDerWaalsContact C-N 3.28Å; C420-H422 PolarHBondContact O-N 3.38Å; H422-L425 PolarHBondContact O-N 2.75Å; H422-C426 PolarHBondContact O-N 3.09Å; H422-C426 VanDerWaalsContact O-N 3.13Å; H422-C426 PolarHBondContact O-SG 2.88Å; H422-C426 VanDerWaalsContact O-SG 3.38Å |
| 423 | N | 42 | Very low | 41.1 | Very low | 104 Ų | 104 | 86.9 Ų | 86.9 | 56% | 0.556 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -70.5 | -33.5 | 176.6 | -96.1 | -23 | 0 | 0 | 0 | 113.5 | S419 C420 L425 C426 Q427 | S419-N423 PolarHBondContact O-N 3.49Å; S419-N423 VanDerWaalsContact O-N 3.17Å; C420-N423 PolarHBondContact O-N 2.91Å; N423-L425 VanDerWaalsContact C-N 3.35Å; N423-C426 PolarHBondContact O-N 3.23Å; N423-Q427 WeakPolarHBondContact O-CG 3.45Å; N423-Q427 PolarHBondContact O-N 3.23Å |
| 424 | L | 41.8 | Very low | 40.5 | Very low | 80 Ų | 80 | 89.1 Ų | 89.1 | 42% | 0.419 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.7 | -38.3 | 174.3 | -115.7 | 137.9 | 0 | 0 | 0 | 111.8 | C420 L421 Q427 M428 | C420-L424 PolarHBondContact O-N 3.46Å; C420-L424 VanDerWaalsContact O-N 3.13Å; L421-L424 PolarHBondContact O-N 3.29Å; L424-Q427 PolarHBondContact O-N 2.91Å; L424-M428 WeakPolarHBondContact O-CG 3.26Å; L424-M428 PolarHBondContact O-N 2.99Å |
| 425 | L | 41.8 | Very low | 40.1 | Very low | 98 Ų | 98 | 92.3 Ų | 92.3 | 51% | 0.513 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65 | -40 | 172.5 | -77.4 | 160.4 | 0 | 0 | 0 | 112.1 | L421 H422 N423 M428 D429 | L421-L425 PolarHBondContact O-N 3.41Å; H422-L425 PolarHBondContact O-N 2.75Å; N423-L425 VanDerWaalsContact C-N 3.35Å; L425-M428 PolarHBondContact O-N 3.43Å; L425-D429 PolarHBondContact O-N 3.1Å |
| 426 | C | 42.2 | Very low | 39.6 | Very low | 62 Ų | 62 | 95 Ų | 95 | 42% | 0.419 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.8 | -33.9 | 175.8 | -69.5 | 0 | 0 | 0 | 0 | 113.4 | H422 N423 M428 D429 A430 | H422-C426 PolarHBondContact O-N 3.09Å; H422-C426 VanDerWaalsContact O-N 3.13Å; H422-C426 PolarHBondContact O-SG 2.88Å; H422-C426 VanDerWaalsContact O-SG 3.38Å; N423-C426 PolarHBondContact O-N 3.23Å; C426-M428 VanDerWaalsContact C-N 3.35Å; C426-D429 PolarHBondContact O-N 3.34Å; C426-A430 PolarHBondContact O-N 3.07Å; C426-A430 VanDerWaalsContact O-N 3.12Å |
| 427 | Q | 42 | Very low | 38.8 | Very low | 142 Ų | 142 | 96 Ų | 96 | 66% | 0.664 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -69.5 | -30.7 | 175.1 | -75.1 | -177.2 | -0.4 | 0 | 0 | 112.9 | N423 L424 D429 A430 A431 | N423-Q427 WeakPolarHBondContact O-CG 3.45Å; N423-Q427 PolarHBondContact O-N 3.23Å; L424-Q427 PolarHBondContact O-N 2.91Å; Q427-D429 VanDerWaalsContact C-N 3.32Å; Q427-A430 PolarHBondContact O-N 2.93Å; Q427-A431 PolarHBondContact O-N 2.71Å |
| 428 | M | 41.5 | Very low | 38.2 | Very low | 130 Ų | 130 | 100.2 Ų | 100.2 | 64% | 0.64 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.9 | -28.4 | 173.2 | -70.9 | 179.5 | 63.2 | 0 | 0 | 113.1 | L424 L425 C426 | L424-M428 WeakPolarHBondContact O-CG 3.26Å; L424-M428 PolarHBondContact O-N 2.99Å; L425-M428 PolarHBondContact O-N 3.43Å; C426-M428 VanDerWaalsContact C-N 3.35Å |
| 429 | D | 39.3 | Very low | 37.6 | Very low | 50 Ų | 50 | 105.2 Ų | 105.2 | 27% | 0.267 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -79.9 | -36.5 | 173.5 | -86.5 | -25.7 | 0 | 0 | 0 | 112.3 | L425 C426 Q427 A431 K432 | L425-D429 PolarHBondContact O-N 3.1Å; C426-D429 PolarHBondContact O-N 3.34Å; Q427-D429 VanDerWaalsContact C-N 3.32Å; D429-A431 VanDerWaalsContact C-N 3.25Å; D429-A431 PolarHBondContact O-N 3.11Å; D429-K432 WeakPolarHBondContact O-CB 2.81Å; D429-K432 PolarHBondContact O-N 3.02Å; D429-K432 IonicContact OD1-NZ 2.81Å; D429-K432 PolarHBondContact OD1-NZ 3.1Å |
| 430 | A | 40 | Very low | 37.4 | Very low | 61 Ų | 61 | 107.7 Ų | 107.7 | 50% | 0.504 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -64.3 | -26.6 | 174 | 0 | 0 | 0 | 0 | 0 | 113.6 | C426 Q427 K432 D433 | C426-A430 PolarHBondContact O-N 3.07Å; C426-A430 VanDerWaalsContact O-N 3.12Å; Q427-A430 PolarHBondContact O-N 2.93Å; A430-K432 VanDerWaalsContact C-N 3.28Å; A430-K432 PolarHBondContact O-N 3.48Å; A430-D433 PolarHBondContact O-N 2.88Å |
| 431 | A | 40.5 | Very low | 36.5 | Very low | 70 Ų | 70 | 112.8 Ų | 112.8 | 58% | 0.579 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | -15.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q427 D429 | Q427-A431 PolarHBondContact O-N 2.71Å; D429-A431 VanDerWaalsContact C-N 3.25Å; D429-A431 PolarHBondContact O-N 3.11Å |
| 432 | K | 41.5 | Very low | 35.8 | Very low | 139 Ų | 139 | 114.8 Ų | 114.8 | 60% | 0.604 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -25.3 | 171.6 | -77 | 174.5 | -171.8 | 146.3 | 0 | 113 | D429 A430 C434 | D429-K432 WeakPolarHBondContact O-CB 2.81Å; D429-K432 PolarHBondContact O-N 3.02Å; D429-K432 IonicContact OD1-NZ 2.81Å; D429-K432 PolarHBondContact OD1-NZ 3.1Å; A430-K432 VanDerWaalsContact C-N 3.28Å; A430-K432 PolarHBondContact O-N 3.48Å; K432-C434 VanDerWaalsContact C-N 3.25Å; K432-C434 PolarHBondContact O-N 3.44Å |
| 433 | D | 34 | Very low | 35 | Very low | 137 Ų | 137 | 118.9 Ų | 118.9 | 73% | 0.733 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | -9.2 | -177.3 | -75.9 | -26.6 | 0 | 0 | 0 | 113.9 | A430 C435 | A430-D433 PolarHBondContact O-N 2.88Å; D433-C435 VanDerWaalsContact C-N 3.35Å |
| 434 | C | 31.6 | Very low | 34.1 | Very low | 117 Ų | 117 | 121.1 Ų | 121.1 | 79% | 0.791 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | 3.6 | 176.4 | -78.1 | 0 | 0 | 0 | 0 | 114.4 | K432 | K432-C434 VanDerWaalsContact C-N 3.25Å; K432-C434 PolarHBondContact O-N 3.44Å |
| 435 | C | 32.3 | Very low | 33.3 | Very low | 103 Ų | 103 | 128.3 Ų | 128.3 | 70% | 0.696 | 69% | 0.693 | S | S | * | * | trans | -106.6 | 64.4 | 176.5 | -69.7 | 0 | 0 | 0 | 0 | 111.5 | D433 L437 | D433-C435 VanDerWaalsContact C-N 3.35Å; C435-L437 PolarHBondContact O-N 3.42Å; C435-L437 VanDerWaalsContact O-N 3.15Å | ||
| 436 | Q | 28.4 | Very low | 32.4 | Very low | 188 Ų | 188 | 128.9 Ų | 128.9 | 88% | 0.879 | 70% | 0.7 | S | S | * | * | trans | -68 | 106.6 | 159.5 | -77.5 | -164.2 | -9.4 | 0 | 0 | 109 | ||||
| 437 | L | 27.5 | Very low | 31.5 | Very low | 153 Ų | 153 | 135.4 Ų | 135.4 | 80% | 0.801 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 138.8 | 162.9 | -102.7 | 88.7 | 0 | 0 | 0 | 109.7 | C435 | C435-L437 PolarHBondContact O-N 3.42Å; C435-L437 VanDerWaalsContact O-N 3.15Å |
| 438 | P | 28.1 | Very low | 30.7 | Very low | 120 Ų | 120 | 133.2 Ų | 133.2 | 78% | 0.779 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 141.5 | 160.5 | 30.3 | -28.8 | 0 | 0 | 0 | 110.1 | ||
| 439 | E | 27.9 | Very low | 29.9 | Very low | 187 Ų | 187 | 136.4 Ų | 136.4 | 87% | 0.874 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 160.1 | -176.9 | -89.7 | -174.3 | 157.5 | 0 | 0 | 114.7 | ||
| 440 | P | 38.5 | Very low | 29.3 | Very low | 120 Ų | 120 | 138.5 Ų | 138.5 | 78% | 0.779 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -92 | 136.9 | -165 | 35.2 | -29.4 | 0 | 0 | 0 | 111.8 | ||
| 441 | D | 22.4 | Very low | 28.7 | Very low | 159 Ų | 159 | 141.3 Ų | 141.3 | 85% | 0.85 | 75% | 0.752 | S | S | * | * | trans | -134.8 | 126 | 163.2 | -117.4 | -21.7 | 0 | 0 | 0 | 112.6 | ||||
| 442 | S | 25 | Very low | 28.2 | Very low | 99 Ų | 99 | 144.8 Ų | 144.8 | 69% | 0.692 | 77% | 0.767 | S | S | * | * | trans | 76.3 | 103.8 | 153.5 | 72.2 | 0 | 0 | 0 | 0 | 121 | ||||
| 443 | Q | 26.5 | Very low | 27.4 | Very low | 177 Ų | 177 | 141.2 Ų | 141.2 | 83% | 0.827 | 77% | 0.769 | S | S | * | * | 75.6 | 110.5 | 125 | -64.2 | -169.2 | -0.3 | 0 | 0 | 121.4 | |||||
| 444 | L | 23.9 | Very low | 27 | Very low | 152 Ų | 152 | 142 Ų | 142 | 80% | 0.796 | 78% | 0.779 | S | S | * | * | 42.3 | 115.5 | 126.4 | -92.2 | 85.9 | 0 | 0 | 0 | 119.5 | |||||
| 445 | R | 24.1 | Very low | 26.7 | Very low | 231 Ų | 231 | 140 Ų | 140 | 87% | 0.872 | 78% | 0.778 | S | S | * | * | 171 | 116.5 | 118 | -96.4 | 175.5 | -86.9 | -159.4 | -3.5 | 109.7 | |||||
| 446 | V | 22.9 | Very low | 26.5 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 66% | 0.661 | 78% | 0.783 | S | S | * | * | 72.3 | 111.5 | 76.5 | 173.3 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 447 | W | 24.4 | Very low | 26.5 | Very low | 200 Ų | 200 | 137.2 Ų | 137.2 | 76% | 0.758 | 77% | 0.774 | S | S | * | * | trans | 78.6 | 144.6 | 151.8 | -70.1 | 34 | 0 | 0 | 0 | 115.2 | W449 | W447-W449 HydrophobicContact CD2-CZ2 4.27Å; W447-W449 AromaticContact CE3-CH2 3.79Å; W447-W449 HydrophobicContact CE3-CH2 3.79Å; W447-W449 AromaticContact CE3-CZ2 3.5Å; W447-W449 HydrophobicContact CE3-CZ2 3.5Å; W447-W449 HydrophobicContact CH2-CZ2 4.2Å; W447-W449 AromaticContact CZ3-CH2 3.57Å; W447-W449 HydrophobicContact CZ3-CH2 3.57Å; W447-W449 AromaticContact CZ3-CZ2 3.45Å; W447-W449 HydrophobicContact CZ3-CZ2 3.45Å; W447-W449 VanDerWaalsContact CZ3-CZ2 3.45Å | ||
| 448 | T | 23.9 | Very low | 26.6 | Very low | 95 Ų | 95 | 137.6 Ų | 137.6 | 58% | 0.583 | 77% | 0.774 | S | S | * | * | cis | 179 | 178.3 | 36.3 | 0.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 449 | W | 24.3 | Very low | 26.5 | Very low | 198 Ų | 198 | 139.8 Ų | 139.8 | 75% | 0.75 | 78% | 0.778 | S | S | * | * | trans | -80.9 | 173.3 | -157.3 | -25.7 | -63.7 | 0 | 0 | 0 | 119.1 | W447 | W447-W449 HydrophobicContact CD2-CZ2 4.27Å; W447-W449 AromaticContact CE3-CH2 3.79Å; W447-W449 HydrophobicContact CE3-CH2 3.79Å; W447-W449 AromaticContact CE3-CZ2 3.5Å; W447-W449 HydrophobicContact CE3-CZ2 3.5Å; W447-W449 HydrophobicContact CH2-CZ2 4.2Å; W447-W449 AromaticContact CZ3-CH2 3.57Å; W447-W449 HydrophobicContact CZ3-CH2 3.57Å; W447-W449 AromaticContact CZ3-CZ2 3.45Å; W447-W449 HydrophobicContact CZ3-CZ2 3.45Å; W447-W449 VanDerWaalsContact CZ3-CZ2 3.45Å | ||
| 450 | A | 27.5 | Very low | 26.3 | Very low | 94 Ų | 94 | 134.2 Ų | 134.2 | 78% | 0.777 | 77% | 0.772 | S | S | * | * | trans | 82.8 | 155.7 | 142.5 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 451 | V | 27.7 | Very low | 25.7 | Very low | 119 Ų | 119 | 133.7 Ų | 133.7 | 72% | 0.721 | 78% | 0.777 | S | S | * | * | cis | 175.9 | 148 | -21.7 | 147.4 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 452 | T | 29.6 | Very low | 25.9 | Very low | 143 Ų | 143 | 130.2 Ų | 130.2 | 88% | 0.877 | 77% | 0.77 | S | S | * | * | trans | 65 | 147.6 | 164.1 | 57 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 453 | G | 25.1 | Very low | 26.2 | Very low | 64 Ų | 64 | 132.9 Ų | 132.9 | 66% | 0.66 | 78% | 0.776 | S | S | * | * | cis | 163.6 | 161.3 | 2.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 454 | V | 25.6 | Very low | 26.3 | Very low | 155 Ų | 155 | 134.2 Ų | 134.2 | 94% | 0.939 | 78% | 0.78 | S | S | * | * | trans | 79.5 | 127.4 | 155.3 | -168.2 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 455 | G | 25.6 | Very low | 26.6 | Very low | 75 Ų | 75 | 133.8 Ų | 133.8 | 77% | 0.773 | 78% | 0.777 | S | S | * | * | trans | 165.3 | 61.2 | 160 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 456 | V | 28.1 | Very low | 26.9 | Very low | 131 Ų | 131 | 131.4 Ų | 131.4 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | trans | -8.5 | 148.7 | 157.8 | 177.4 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 457 | S | 28 | Very low | 27.1 | Very low | 100 Ų | 100 | 134 Ų | 134 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | trans | 89.6 | 112.3 | 150.5 | -92.6 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 458 | M | 28.8 | Very low | 27.3 | Very low | 162 Ų | 162 | 130.2 Ų | 130.2 | 80% | 0.798 | 79% | 0.786 | S | S | * | * | 84.1 | 115.4 | 77.2 | -87.2 | -105.4 | 149.4 | 0 | 0 | 114.2 | |||||
| 459 | L | 25.9 | Very low | 27.4 | Very low | 165 Ų | 165 | 135.4 Ų | 135.4 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | trans | 58.5 | 123 | 138.6 | -105.2 | 144.4 | 0 | 0 | 0 | 119.5 | ||||
| 460 | G | 24 | Very low | 28.1 | Very low | 71 Ų | 71 | 131.6 Ų | 131.6 | 73% | 0.732 | 80% | 0.801 | S | S | * | * | trans | 152.1 | 93.9 | 152 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 461 | A | 27.1 | Very low | 28.2 | Very low | 108 Ų | 108 | 132.6 Ų | 132.6 | 89% | 0.893 | 80% | 0.802 | S | S | * | * | trans | -53.7 | 142.3 | 170.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 462 | A | 26.9 | Very low | 28.7 | Very low | 86 Ų | 86 | 138.6 Ų | 138.6 | 71% | 0.711 | 81% | 0.812 | S | S | * | * | trans | -168.4 | 117 | 146.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 463 | L | 29.3 | Very low | 29.3 | Very low | 156 Ų | 156 | 136.5 Ų | 136.5 | 82% | 0.817 | 81% | 0.809 | S | S | * | * | trans | 64 | 101.2 | 137.1 | -76 | 106.8 | 0 | 0 | 0 | 121.2 | ||||
| 464 | F | 29.1 | Very low | 30.1 | Very low | 205 Ų | 205 | 141.7 Ų | 141.7 | 90% | 0.899 | 85% | 0.846 | S | S | * | * | 24 | 102.8 | 111.7 | -95.4 | -84 | 0 | 0 | 0 | 117.7 | |||||
| 465 | L | 30.1 | Very low | 30.3 | Very low | 143 Ų | 143 | 141 Ų | 141 | 75% | 0.749 | 84% | 0.841 | S | S | * | * | trans | -160.7 | 134.3 | 157.1 | -80.2 | -175 | 0 | 0 | 0 | 105.7 | ||||
| 466 | F | 30.1 | Very low | 30.6 | Very low | 181 Ų | 181 | 144.5 Ų | 144.5 | 79% | 0.794 | 85% | 0.845 | S | S | * | * | cis | -156.9 | 131.3 | 22 | -114.7 | -74.3 | 0 | 0 | 0 | 108.4 | ||||
| 467 | L | 28.3 | Very low | 30.7 | Very low | 162 Ų | 162 | 145.2 Ų | 145.2 | 85% | 0.848 | 85% | 0.848 | S | S | * | * | trans | -70.7 | 142.6 | 161.3 | -87.3 | 163.3 | 0 | 0 | 0 | 110.2 | ||||
| 468 | C | 27.3 | Very low | 30.9 | Very low | 122 Ų | 122 | 147.9 Ų | 147.9 | 82% | 0.824 | 86% | 0.856 | S | S | * | * | trans | -31.6 | 134.8 | 167.4 | -59.2 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 469 | K | 27.6 | Very low | 31 | Very low | 203 Ų | 203 | 147 Ų | 147 | 88% | 0.883 | 86% | 0.86 | S | S | * | * | trans | -114.9 | 127.5 | 152.4 | -123.7 | -176.9 | -179 | 175.3 | 0 | 108.7 | ||||
| 470 | P | 38.4 | Very low | 31.4 | Very low | 118 Ų | 118 | 145.8 Ų | 145.8 | 77% | 0.766 | 86% | 0.86 | S | S | * | * | trans | -84.5 | 152 | -175.1 | 33.5 | -33.2 | 0 | 0 | 0 | 111.9 | ||||
| 471 | S | 30.6 | Very low | 31.9 | Very low | 116 Ų | 116 | 151.1 Ų | 151.1 | 81% | 0.811 | 87% | 0.869 | S | S | * | * | trans | -67.9 | 138 | 167.1 | 65.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 472 | R | 36.9 | Very low | 32.3 | Very low | 244 Ų | 244 | 154.5 Ų | 154.5 | 92% | 0.921 | 87% | 0.867 | S | S | * | * | trans | -142.9 | 119.2 | 147.7 | -112.2 | -178.6 | -178 | 170.4 | 0.4 | 108.8 | ||||
| 473 | A | 42.1 | Very low | 32.7 | Very low | 99 Ų | 99 | 160.2 Ų | 160.2 | 82% | 0.818 | 88% | 0.88 | S | S | * | * | trans | -104.4 | 138.9 | 157.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 474 | A | 42.7 | Very low | 33 | Very low | 173 Ų | 173 | 160.5 Ų | 160.5 | 100% | 1.43 | 89% | 0.886 | S | S | * | * | trans | 72.8 | 0 | -179.5 | 0 | 0 | 0 | 0 | 0 | 116.5 |
Retrieved 474 of 474 residues in 346.4 ms
(Link to these results)