| 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 | 37 | Very low | 35 | Very low | 248 Ų | 248 | 136.6 Ų | 136.6 | 100% | 1.222 | 86% | 0.858 | S | S | * | * | 0 | 172.4 | 0 | -115.8 | 162.2 | 172.4 | 0 | 0 | 109 | |||||
| 2 | R | 34.8 | Very low | 34.7 | Very low | 247 Ų | 247 | 134.1 Ų | 134.1 | 93% | 0.932 | 86% | 0.86 | S | S | * | * | trans | -65.6 | 142.8 | -159.6 | -77.1 | -179.7 | 172.7 | 149.4 | -2.8 | 115.5 | ||||
| 3 | V | 30.5 | Very low | 34.5 | Very low | 133 Ų | 133 | 130.9 Ų | 130.9 | 81% | 0.806 | 85% | 0.853 | S | S | * | * | trans | -126.8 | 138 | 157.1 | 173.3 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 4 | S | 29 | Very low | 35.3 | Very low | 115 Ų | 115 | 130.5 Ų | 130.5 | 80% | 0.804 | 85% | 0.85 | S | S | * | * | trans | -159.2 | 153.8 | 167.8 | -84.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 5 | V | 36.3 | Very low | 35.1 | Very low | 132 Ų | 132 | 128.8 Ų | 128.8 | 80% | 0.8 | 85% | 0.851 | S | S | * | * | trans | -125.4 | -149.8 | -179 | -153.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 6 | P | 44.1 | Very low | 35 | Very low | 121 Ų | 121 | 127.6 Ų | 127.6 | 79% | 0.786 | 85% | 0.854 | S | S | * | * | -119.8 | 169.9 | -124 | 42.3 | -27.4 | 0 | 0 | 0 | 118.7 | |||||
| 7 | G | 31.9 | Very low | 34.7 | Very low | 73 Ų | 73 | 124.5 Ų | 124.5 | 75% | 0.753 | 85% | 0.849 | S | S | * | * | trans | 83.6 | 178.5 | 155.3 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 8 | P | 44.3 | Very low | 34.5 | Very low | 139 Ų | 139 | 131.5 Ų | 131.5 | 90% | 0.903 | 86% | 0.855 | S | S | * | * | cis | -124.9 | -151.2 | -0.3 | 42.6 | -26.4 | 0 | 0 | 0 | 113.7 | ||||
| 9 | A | 31.3 | Very low | 34.5 | Very low | 101 Ų | 101 | 133.5 Ų | 133.5 | 84% | 0.835 | 85% | 0.851 | S | S | * | * | trans | -111.9 | 162.4 | -161.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 10 | A | 33.5 | Very low | 34.8 | Very low | 101 Ų | 101 | 133.5 Ų | 133.5 | 84% | 0.835 | 85% | 0.852 | S | S | * | * | trans | -166.4 | 157.7 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 11 | A | 32.2 | Very low | 34.7 | Very low | 93 Ų | 93 | 131.4 Ų | 131.4 | 77% | 0.769 | 84% | 0.841 | S | S | * | * | cis | -168.2 | 161.7 | -27.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 12 | A | 31.9 | Very low | 34.6 | Very low | 106 Ų | 106 | 125.8 Ų | 125.8 | 88% | 0.876 | 82% | 0.822 | S | S | * | * | trans | 69.2 | 137.9 | 159.3 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 13 | A | 31.2 | Very low | 35.3 | Very low | 93 Ų | 93 | 120 Ų | 120 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | trans | -116.4 | -161 | 158.3 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 14 | P | 46.6 | Very low | 35.2 | Very low | 125 Ų | 125 | 117.6 Ų | 117.6 | 81% | 0.812 | 82% | 0.818 | S | S | * | * | cis | -134.7 | -176.8 | -8.7 | 43.1 | -26.4 | 0 | 0 | 0 | 114.5 | ||||
| 15 | A | 31.6 | Very low | 35.3 | Very low | 105 Ų | 105 | 116 Ų | 116 | 87% | 0.868 | 82% | 0.82 | S | S | * | * | trans | -147.7 | 148.9 | 153.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 16 | A | 33.4 | Very low | 34.9 | Very low | 109 Ų | 109 | 114 Ų | 114 | 90% | 0.901 | 83% | 0.826 | S | S | * | * | trans | -138.5 | 152.4 | -174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 17 | G | 30.2 | Very low | 34.2 | Very low | 75 Ų | 75 | 112 Ų | 112 | 77% | 0.773 | 83% | 0.827 | S | S | * | * | trans | 177.6 | 78.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 18 | R | 32 | Very low | 34.1 | Very low | 251 Ų | 251 | 112.7 Ų | 112.7 | 95% | 0.947 | 83% | 0.834 | S | S | * | * | trans | 62.9 | 125.5 | 139.5 | -113.1 | -180 | 177.5 | 98.2 | 0.5 | 121.7 | ||||
| 19 | E | 33.4 | Very low | 33.4 | Very low | 169 Ų | 169 | 110.1 Ų | 110.1 | 79% | 0.79 | 83% | 0.833 | S | S | * | * | trans | -73 | 170.8 | 149.1 | -56.8 | 177.8 | 108.7 | 0 | 0 | 111.3 | ||||
| 20 | P | 40.8 | Very low | 33.2 | Very low | 133 Ų | 133 | 109.1 Ų | 109.1 | 86% | 0.864 | 83% | 0.833 | S | S | * | * | -140.1 | -176.3 | 96.1 | 40.1 | -27.2 | 0 | 0 | 0 | 114.6 | |||||
| 21 | S | 32.6 | Very low | 33.1 | Very low | 90 Ų | 90 | 108.3 Ų | 108.3 | 63% | 0.629 | 83% | 0.834 | S | S | * | * | trans | -123.4 | 142.6 | -154.5 | 45.5 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 22 | T | 35.3 | Very low | 33 | Very low | 131 Ų | 131 | 108.7 Ų | 108.7 | 80% | 0.804 | 84% | 0.837 | S | S | * | * | trans | 62.8 | 167.5 | 147.4 | 49.4 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 23 | P | 48.8 | Very low | 33.1 | Very low | 124 Ų | 124 | 110.4 Ų | 110.4 | 81% | 0.805 | 84% | 0.837 | S | S | * | * | cis | -135.1 | 168 | -27.2 | 31 | -11.6 | 0 | 0 | 0 | 116.1 | ||||
| 24 | G | 29.4 | Very low | 33.2 | Very low | 84 Ų | 84 | 111.1 Ų | 111.1 | 87% | 0.866 | 84% | 0.843 | S | S | * | * | trans | 97.8 | 146.6 | 153.4 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 25 | G | 30 | Very low | 32.6 | Very low | 82 Ų | 82 | 109.4 Ų | 109.4 | 85% | 0.845 | 84% | 0.839 | S | S | * | * | cis | 177.3 | 147.8 | -8.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 26 | G | 28.9 | Very low | 32.8 | Very low | 89 Ų | 89 | 109 Ų | 109 | 92% | 0.918 | 84% | 0.835 | S | S | * | * | trans | 83.8 | 149.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 27 | G | 29.4 | Very low | 32.5 | Very low | 78 Ų | 78 | 109.8 Ų | 109.8 | 80% | 0.804 | 83% | 0.834 | S | S | * | * | cis | 168.7 | 117.1 | -9.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 28 | G | 29.1 | Very low | 32.5 | Very low | 88 Ų | 88 | 109.5 Ų | 109.5 | 91% | 0.907 | 83% | 0.832 | S | S | * | * | trans | 77 | 147.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 29 | G | 29.3 | Very low | 32.5 | Very low | 85 Ų | 85 | 102.2 Ų | 102.2 | 88% | 0.876 | 83% | 0.825 | S | S | * | * | cis | 132.4 | 129.2 | 1.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 30 | G | 28.4 | Very low | 32.8 | Very low | 81 Ų | 81 | 97.8 Ų | 97.8 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | cis | -162.2 | 161.6 | -6.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 31 | G | 30.1 | Very low | 33 | Very low | 84 Ų | 84 | 94 Ų | 94 | 87% | 0.866 | 79% | 0.791 | S | S | * | * | trans | -94.1 | 139.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 32 | A | 31.9 | Very low | 33.9 | Very low | 100 Ų | 100 | 94 Ų | 94 | 83% | 0.826 | 79% | 0.789 | S | S | * | * | trans | -150.8 | 82.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 33 | V | 32.5 | Very low | 35.1 | Very low | 143 Ų | 143 | 90 Ų | 90 | 87% | 0.867 | 77% | 0.774 | S | S | * | * | trans | -73.2 | 129.9 | 168.8 | 175.1 | 0 | 0 | 0 | 0 | 108.1 | A35 | V33-A35 PolarHBondContact O-N 3.08Å; V33-A35 VanDerWaalsContact O-N 3.08Å | ||
| 34 | A | 34.3 | Very low | 35.9 | Very low | 108 Ų | 108 | 87.6 Ų | 87.6 | 89% | 0.893 | 76% | 0.76 | S | S | * | * | trans | -70.6 | 103.3 | -176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 35 | A | 34.3 | Very low | 37.9 | Very low | 88 Ų | 88 | 86.2 Ų | 86.2 | 73% | 0.727 | 74% | 0.735 | S | S | * | * | trans | -152.4 | 156.2 | 168.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | V33 | V33-A35 PolarHBondContact O-N 3.08Å; V33-A35 VanDerWaalsContact O-N 3.08Å | ||
| 36 | A | 34.8 | Very low | 39.8 | Very low | 96 Ų | 96 | 86.6 Ų | 86.6 | 79% | 0.793 | 71% | 0.714 | S | S | * | * | trans | 58.4 | 102.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 37 | S | 28.3 | Very low | 42 | Very low | 127 Ų | 127 | 87.1 Ų | 87.1 | 89% | 0.888 | 70% | 0.696 | S | S | * | * | trans | -163.5 | 82.3 | 144.4 | -79.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 38 | G | 30.2 | Very low | 44.3 | Very low | 69 Ų | 69 | 86.2 Ų | 86.2 | 71% | 0.711 | 68% | 0.681 | S | S | * | * | trans | -62.8 | 147.8 | 159.5 | 0 | 0 | 0 | 0 | 0 | 109 | A40 | G38-A40 PolarHBondContact O-N 2.81Š| ||
| 39 | A | 31.8 | Very low | 46.6 | Very low | 97 Ų | 97 | 83.5 Ų | 83.5 | 80% | 0.802 | 65% | 0.645 | S | S | * | * | trans | -76.4 | 72.7 | -174.1 | 0 | 0 | 0 | 0 | 0 | 112 | V41 | A39-V41 PolarHBondContact O-N 3.03Š| ||
| 40 | A | 39.4 | Very low | 48.9 | Very low | 76 Ų | 76 | 80.1 Ų | 80.1 | 63% | 0.628 | 61% | 0.608 | S | S | * | * | trans | -60.7 | 106.4 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | G38 | G38-A40 PolarHBondContact O-N 2.81Š| ||
| 41 | V | 44.3 | Very low | 51.5 | Low | 54 Ų | 54 | 79.2 Ų | 79.2 | 33% | 0.327 | 59% | 0.586 | S | S | . | * | trans | -71.4 | 128.2 | -179.5 | 171.6 | 0 | 0 | 0 | 0 | 108.7 | A39 G43 V45 | A39-V41 PolarHBondContact O-N 3.03Å; V41-G43 PolarHBondContact O-N 3.5Å; V41-V45 HydrophobicContact CG1-CB 3.6Å; V41-V45 HydrophobicContact CG1-CG1 4.16Å; V41-V45 HydrophobicContact CG1-CG2 3.51Å | ||
| 42 | P | 51.1 | Low | 54.3 | Low | 89 Ų | 89 | 79.5 Ų | 79.5 | 58% | 0.578 | 57% | 0.568 | S | S | * | * | trans | -62.1 | 136 | -179.6 | 25.1 | -34.2 | 0 | 0 | 0 | 110.5 | S44 V45 | P42-S44 PolarHBondContact O-N 3.25Å; P42-S44 PolarHBondContact O-OG 3.41Å; P42-V45 PolarHBondContact O-N 3.5Å | ||
| 43 | G | 61.1 | Low | 56.7 | Low | 47 Ų | 47 | 75.1 Ų | 75.1 | 49% | 0.485 | 53% | 0.53 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | -11.2 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | V41 V45 Q46 L47 | V41-G43 PolarHBondContact O-N 3.5Å; G43-V45 PolarHBondContact O-N 3.3Å; G43-Q46 PolarHBondContact O-N 3.28Å; G43-L47 WeakPolarHBondContact O-CB 3.37Å; G43-L47 PolarHBondContact O-N 2.58Å |
| 44 | S | 65.3 | Low | 59.3 | Low | 74 Ų | 74 | 69.4 Ų | 69.4 | 52% | 0.517 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -52 | -34.2 | 164 | 50.4 | 0 | 0 | 0 | 0 | 113.8 | P42 A48 | P42-S44 PolarHBondContact O-N 3.25Å; P42-S44 PolarHBondContact O-OG 3.41Å; S44-A48 WeakPolarHBondContact O-CB 3.45Å; S44-A48 PolarHBondContact O-N 2.85Å |
| 45 | V | 71.8 | Confident | 61.9 | Low | 55 Ų | 55 | 69.5 Ų | 69.5 | 33% | 0.333 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -74.2 | -44.4 | 178.7 | -178.8 | 0 | 0 | 0 | 0 | 111 | V41 P42 G43 L47 A48 L49 I301 | V41-V45 HydrophobicContact CG1-CB 3.6Å; V41-V45 HydrophobicContact CG1-CG1 4.16Å; V41-V45 HydrophobicContact CG1-CG2 3.51Å; P42-V45 PolarHBondContact O-N 3.5Å; G43-V45 PolarHBondContact O-N 3.3Å; V45-L47 VanDerWaalsContact C-N 3.31Å; V45-L47 PolarHBondContact O-N 2.82Å; V45-A48 PolarHBondContact O-N 3.24Å; V45-L49 WeakPolarHBondContact O-CB 3.33Å; V45-L49 PolarHBondContact O-N 3.29Å; V45-I301 HydrophobicContact CG1-CD1 4.47Å; V45-I301 HydrophobicContact CG1-CG1 4.49Å |
| 46 | Q | 70.1 | Confident | 64.6 | Low | 90 Ų | 90 | 67.3 Ų | 67.3 | 42% | 0.421 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -59.1 | -44.3 | 174.6 | -169.4 | -174.4 | 8.9 | 0 | 0 | 111 | G43 S50 Y300 | G43-Q46 PolarHBondContact O-N 3.28Å; Q46-S50 WeakPolarHBondContact O-CB 3.35Å; Q46-S50 PolarHBondContact O-N 2.91Å; Q46-S50 PolarHBondContact O-OG 3.25Å; Q46-Y300 HydrophobicContact CB-CD1 4.19Å; Q46-Y300 HydrophobicContact CB-CE1 4.12Å; Q46-Y300 HydrophobicContact CG-CD1 3.86Å; Q46-Y300 HydrophobicContact CG-CD2 4.19Å; Q46-Y300 HydrophobicContact CG-CE1 3.57Å; Q46-Y300 HydrophobicContact CG-CE2 3.92Å; Q46-Y300 HydrophobicContact CG-CG 4.17Å |
| 47 | L | 73.9 | Confident | 67.2 | Low | 101 Ų | 101 | 62.7 Ų | 62.7 | 53% | 0.529 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -62.7 | -49.4 | 174.6 | -169.5 | 77.7 | 0 | 0 | 0 | 111.6 | G43 V45 L49 S50 V51 F104 | G43-L47 WeakPolarHBondContact O-CB 3.37Å; G43-L47 PolarHBondContact O-N 2.58Å; V45-L47 VanDerWaalsContact C-N 3.31Å; V45-L47 PolarHBondContact O-N 2.82Å; L47-L49 PolarHBondContact O-N 3.48Å; L47-S50 WeakPolarHBondContact O-CB 3.3Å; L47-S50 PolarHBondContact O-N 2.92Å; L47-V51 WeakPolarHBondContact O-CB 3.39Å; L47-V51 VanDerWaalsContact O-CG2 3.3Å; L47-V51 WeakPolarHBondContact O-CG2 3.16Å; L47-V51 PolarHBondContact O-N 3.4Å; L47-F104 HydrophobicContact CD1-CD1 4.28Å; L47-F104 HydrophobicContact CD1-CE1 3.93Å |
| 48 | A | 77.9 | Confident | 70.1 | Confident | 59 Ų | 59 | 58.8 Ų | 58.8 | 49% | 0.488 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.7 | -41.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | S44 V45 V51 L52 | S44-A48 WeakPolarHBondContact O-CB 3.45Å; S44-A48 PolarHBondContact O-N 2.85Å; V45-A48 PolarHBondContact O-N 3.24Å; A48-V51 PolarHBondContact O-N 3.38Å; A48-L52 WeakPolarHBondContact O-CB 3.17Å; A48-L52 PolarHBondContact O-N 3.21Å |
| 49 | L | 78.4 | Confident | 73 | Confident | 31 Ų | 31 | 57.7 Ų | 57.7 | 16% | 0.162 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -69 | -37.6 | 177.6 | -172.8 | 59.8 | 0 | 0 | 0 | 111.6 | V45 L47 L52 H53 Y300 | V45-L49 WeakPolarHBondContact O-CB 3.33Å; V45-L49 PolarHBondContact O-N 3.29Å; L47-L49 PolarHBondContact O-N 3.48Å; L49-L52 HydrophobicContact CD1-CD2 4.44Å; L49-L52 PolarHBondContact O-N 3Å; L49-H53 PolarHBondContact O-N 3.04Å; L49-H53 PolarHBondContact O-ND1 2.89Å; L49-Y300 HydrophobicContact CB-CE1 4.14Å; L49-Y300 HydrophobicContact CD2-CD1 3.81Å; L49-Y300 HydrophobicContact CD2-CE1 3.86Å; L49-Y300 WeakPolarHBondContact CD2-O 3.32Å; L49-Y300 HydrophobicContact CG-CE1 4.27Å |
| 50 | S | 77.9 | Confident | 75.8 | Confident | 13 Ų | 13 | 53.1 Ų | 53.1 | 9% | 0.091 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -62.5 | -44.3 | 171.3 | -61.6 | 0 | 0 | 0 | 0 | 112 | Q46 L47 H53 A54 F104 Y300 | Q46-S50 WeakPolarHBondContact O-CB 3.35Å; Q46-S50 PolarHBondContact O-N 2.91Å; Q46-S50 PolarHBondContact O-OG 3.25Å; L47-S50 WeakPolarHBondContact O-CB 3.3Å; L47-S50 PolarHBondContact O-N 2.92Å; S50-H53 PolarHBondContact O-N 3.39Å; S50-A54 WeakPolarHBondContact O-CB 3.47Å; S50-A54 PolarHBondContact O-N 3.08Å; S50-F104 VanDerWaalsContact CB-CZ 3.48Å; S50-Y300 PolarHBondContact OG-OH 2.86Å |
| 51 | V | 82.9 | Confident | 78.3 | Confident | 62 Ų | 62 | 52.9 Ų | 52.9 | 38% | 0.376 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -66.7 | -41.1 | 179.1 | 167.5 | 0 | 0 | 0 | 0 | 110.4 | L47 A48 H53 A54 L55 F104 | L47-V51 WeakPolarHBondContact O-CB 3.39Å; L47-V51 VanDerWaalsContact O-CG2 3.3Å; L47-V51 WeakPolarHBondContact O-CG2 3.16Å; L47-V51 PolarHBondContact O-N 3.4Å; A48-V51 PolarHBondContact O-N 3.38Å; V51-H53 PolarHBondContact O-N 3.46Å; V51-A54 PolarHBondContact O-N 3.15Å; V51-L55 HydrophobicContact CG1-CD1 3.87Å; V51-L55 HydrophobicContact CG1-CG 4.32Å; V51-L55 WeakPolarHBondContact O-CB 3.11Å; V51-L55 VanDerWaalsContact O-CG 3.27Å; V51-L55 WeakPolarHBondContact O-CG 3.45Å; V51-L55 PolarHBondContact O-N 2.99Å; V51-F104 HydrophobicContact CB-CZ 4.46Å; V51-F104 HydrophobicContact CG2-CE1 3.99Å; V51-F104 HydrophobicContact CG2-CZ 3.65Å |
| 52 | L | 87.1 | Confident | 80.5 | Confident | 91 Ų | 91 | 52.4 Ų | 52.4 | 48% | 0.476 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -58.6 | -46.1 | 173.6 | 178.8 | 60.5 | 0 | 0 | 0 | 111.5 | A48 L49 L55 L56 | A48-L52 WeakPolarHBondContact O-CB 3.17Å; A48-L52 PolarHBondContact O-N 3.21Å; L49-L52 HydrophobicContact CD1-CD2 4.44Å; L49-L52 PolarHBondContact O-N 3Å; L52-L55 PolarHBondContact O-N 2.86Å; L52-L56 HydrophobicContact CD1-CD1 4.26Å; L52-L56 HydrophobicContact CD1-CG 4.35Å; L52-L56 HydrophobicContact CG-CD1 4.11Å; L52-L56 WeakPolarHBondContact O-CB 3.48Å; L52-L56 VanDerWaalsContact O-CG 3.25Å; L52-L56 WeakPolarHBondContact O-CG 3.14Å; L52-L56 PolarHBondContact O-N 2.78Å |
| 53 | H | 84 | Confident | 82.4 | Confident | 8 Ų | 8 | 50.5 Ų | 50.5 | 4% | 0.037 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.1 | -48.8 | 175.1 | -80.5 | 71.8 | 0 | 0 | 0 | 111.7 | L49 S50 V51 L55 L56 Y57 F100 G304 H312 | L49-H53 PolarHBondContact O-N 3.04Å; L49-H53 PolarHBondContact O-ND1 2.89Å; S50-H53 PolarHBondContact O-N 3.39Å; V51-H53 PolarHBondContact O-N 3.46Å; H53-L55 VanDerWaalsContact C-N 3.31Å; H53-L55 PolarHBondContact O-N 3.3Å; H53-L56 PolarHBondContact O-N 3.37Å; H53-L56 VanDerWaalsContact O-N 3.13Å; H53-Y57 HydrophobicContact CB-CE2 4.19Å; H53-Y57 WeakPolarHBondContact O-CD2 3.36Å; H53-Y57 PolarHBondContact O-N 2.95Å; H53-F100 HydrophobicContact CB-CD1 4.46Å; H53-F100 HydrophobicContact CB-CE1 3.95Å; H53-F100 HydrophobicContact CB-CZ 4.13Å; H53-G304 PolarHBondContact NE2-O 3.28Å; H53-H312 AromaticContact CD2-CE1 3.59Å |
| 54 | A | 86.2 | Confident | 83.7 | Confident | 22 Ų | 22 | 48.3 Ų | 48.3 | 18% | 0.182 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -58.9 | -40.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | S50 V51 A58 F100 F104 | S50-A54 WeakPolarHBondContact O-CB 3.47Å; S50-A54 PolarHBondContact O-N 3.08Å; V51-A54 PolarHBondContact O-N 3.15Å; A54-A58 VanDerWaalsContact O-CB 3.28Å; A54-A58 WeakPolarHBondContact O-CB 3.34Å; A54-A58 PolarHBondContact O-N 2.88Å; A54-F100 HydrophobicContact CB-CB 4.18Å; A54-F104 HydrophobicContact CB-CE2 4.01Å |
| 55 | L | 88.9 | Confident | 84.9 | Confident | 110 Ų | 110 | 50 Ų | 50 | 58% | 0.576 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -66.1 | -39.2 | 174.4 | -72.1 | 171.5 | 0 | 0 | 0 | 112.4 | V51 L52 H53 A58 A59 | V51-L55 HydrophobicContact CG1-CD1 3.87Å; V51-L55 HydrophobicContact CG1-CG 4.32Å; V51-L55 WeakPolarHBondContact O-CB 3.11Å; V51-L55 VanDerWaalsContact O-CG 3.27Å; V51-L55 WeakPolarHBondContact O-CG 3.45Å; V51-L55 PolarHBondContact O-N 2.99Å; L52-L55 PolarHBondContact O-N 2.86Å; H53-L55 VanDerWaalsContact C-N 3.31Å; H53-L55 PolarHBondContact O-N 3.3Å; L55-A58 PolarHBondContact O-N 3.45Å; L55-A59 VanDerWaalsContact O-CB 3.25Å; L55-A59 WeakPolarHBondContact O-CB 3.36Å; L55-A59 PolarHBondContact O-N 3.01Å |
| 56 | L | 90.1 | Very high | 85.7 | Confident | 42 Ų | 42 | 51.6 Ų | 51.6 | 22% | 0.22 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.3 | -42.5 | 176.4 | -73.8 | 168.5 | 0 | 0 | 0 | 112.2 | L52 H53 L60 F308 H312 | L52-L56 HydrophobicContact CD1-CD1 4.26Å; L52-L56 HydrophobicContact CD1-CG 4.35Å; L52-L56 HydrophobicContact CG-CD1 4.11Å; L52-L56 WeakPolarHBondContact O-CB 3.48Å; L52-L56 VanDerWaalsContact O-CG 3.25Å; L52-L56 WeakPolarHBondContact O-CG 3.14Å; L52-L56 PolarHBondContact O-N 2.78Å; H53-L56 PolarHBondContact O-N 3.37Å; H53-L56 VanDerWaalsContact O-N 3.13Å; L56-L60 WeakPolarHBondContact O-CB 3.37Å; L56-L60 PolarHBondContact O-N 3.02Å; L56-F308 HydrophobicContact CD1-CD2 4.05Å; L56-F308 HydrophobicContact CD1-CE2 4.03Å; L56-H312 WeakPolarHBondContact CB-NE2 3.04Å |
| 57 | Y | 90.3 | Very high | 86.5 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.9 | -41.8 | 172.7 | -67.5 | -63.3 | 0 | 0 | 0 | 111.9 | H53 L60 F61 W92 R96 F100 E311 H312 | H53-Y57 HydrophobicContact CB-CE2 4.19Å; H53-Y57 WeakPolarHBondContact O-CD2 3.36Å; H53-Y57 PolarHBondContact O-N 2.95Å; Y57-L60 PolarHBondContact O-N 3.38Å; Y57-F61 WeakPolarHBondContact O-CB 3.28Å; Y57-F61 PolarHBondContact O-N 3.42Å; Y57-W92 HydrophobicContact CD1-CH2 4.22Å; Y57-W92 HydrophobicContact CD1-CZ3 4.04Å; Y57-W92 AromaticContact CE1-CH2 3.62Å; Y57-W92 HydrophobicContact CE1-CH2 3.62Å; Y57-W92 HydrophobicContact CE1-CZ2 4.28Å; Y57-W92 AromaticContact CE1-CZ3 3.92Å; Y57-W92 HydrophobicContact CE1-CZ3 3.92Å; Y57-R96 HydrophobicContact CD1-CB 3.5Å; Y57-R96 HydrophobicContact CD1-CG 4.02Å; Y57-R96 HydrophobicContact CD2-CB 4.03Å; Y57-R96 HydrophobicContact CE1-CB 3.57Å; Y57-R96 HydrophobicContact CE1-CG 3.57Å; Y57-R96 HydrophobicContact CE2-CB 4.12Å; Y57-R96 HydrophobicContact CG-CB 3.75Å; Y57-F100 HydrophobicContact CD2-CD2 4.04Å; Y57-F100 HydrophobicContact CD2-CE2 4.16Å; Y57-F100 AromaticContact CE2-CD2 3.75Å; Y57-F100 HydrophobicContact CE2-CD2 3.75Å; Y57-F100 AromaticContact CE2-CE2 3.4Å; Y57-F100 HydrophobicContact CE2-CE2 3.4Å; Y57-F100 HydrophobicContact CE2-CZ 4.08Å; Y57-E311 PolarHBondContact OH-OE2 3.43Å; Y57-H312 AromaticContact CD1-NE2 3.74Å; Y57-H312 AromaticContact CD2-NE2 3.99Å; Y57-H312 AromaticContact CE1-CE1 3.54Å; Y57-H312 AromaticContact CE1-NE2 3.58Å; Y57-H312 AromaticContact CE2-CE1 3.63Å; Y57-H312 AromaticContact CE2-NE2 3.82Å; Y57-H312 AromaticContact CG-NE2 3.93Å; Y57-H312 AromaticContact CZ-CE1 3.22Å; Y57-H312 AromaticContact CZ-NE2 3.62Å; Y57-H312 PolarHBondContact OH-CE1 3.39Å |
| 58 | A | 89.1 | Confident | 87 | Confident | 44 Ų | 44 | 45.1 Ų | 45.1 | 36% | 0.364 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.7 | -39.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | A54 L55 F61 A62 T97 | A54-A58 VanDerWaalsContact O-CB 3.28Å; A54-A58 WeakPolarHBondContact O-CB 3.34Å; A54-A58 PolarHBondContact O-N 2.88Å; L55-A58 PolarHBondContact O-N 3.45Å; A58-F61 PolarHBondContact O-N 3.23Å; A58-A62 WeakPolarHBondContact O-CB 3.5Å; A58-A62 PolarHBondContact O-N 3.26Å; A58-T97 HydrophobicContact CB-CG2 4.17Å |
| 59 | A | 91.4 | Very high | 87.4 | Confident | 47 Ų | 47 | 48.2 Ų | 48.2 | 39% | 0.388 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -64.9 | -41.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L55 F63 W316 | L55-A59 VanDerWaalsContact O-CB 3.25Å; L55-A59 WeakPolarHBondContact O-CB 3.36Å; L55-A59 PolarHBondContact O-N 3.01Å; A59-F63 VanDerWaalsContact O-CB 3.23Å; A59-F63 WeakPolarHBondContact O-CB 3.45Å; A59-F63 PolarHBondContact O-N 3.38Å; A59-W316 HydrophobicContact CB-CH2 4.35Å; A59-W316 HydrophobicContact CB-CZ2 4.09Å |
| 60 | L | 90.7 | Very high | 87.5 | Confident | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.6 | -44.8 | 174.5 | -177.5 | 71 | 0 | 0 | 0 | 111.4 | L56 Y57 F63 A64 W92 A93 A315 W316 V319 | L56-L60 WeakPolarHBondContact O-CB 3.37Å; L56-L60 PolarHBondContact O-N 3.02Å; Y57-L60 PolarHBondContact O-N 3.38Å; L60-F63 PolarHBondContact O-N 2.91Å; L60-A64 WeakPolarHBondContact O-CB 3.5Å; L60-A64 PolarHBondContact O-N 2.91Å; L60-W92 HydrophobicContact CD2-CE3 4.04Å; L60-W92 HydrophobicContact CD2-CZ3 3.6Å; L60-A93 HydrophobicContact CD2-CB 4.18Å; L60-A93 HydrophobicContact CG-CB 4.41Å; L60-A315 HydrophobicContact CD2-CB 3.8Å; L60-W316 HydrophobicContact CB-CH2 4.48Å; L60-W316 HydrophobicContact CB-CZ2 3.79Å; L60-W316 HydrophobicContact CD1-CD2 3.69Å; L60-W316 HydrophobicContact CD1-CE3 4.04Å; L60-W316 HydrophobicContact CD1-CG 3.99Å; L60-W316 HydrophobicContact CD1-CZ2 4.2Å; L60-W316 HydrophobicContact CD1-CZ3 4.43Å; L60-V319 HydrophobicContact CD1-CB 4.09Å; L60-V319 HydrophobicContact CD1-CG1 4.33Å; L60-V319 HydrophobicContact CD1-CG2 4.02Å |
| 61 | F | 91.8 | Very high | 87.5 | Confident | 71 Ų | 71 | 54.7 Ų | 54.7 | 31% | 0.311 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -57.7 | -51.7 | 175.4 | 174.8 | -92.7 | 0 | 0 | 0 | 111.1 | Y57 A58 F63 A64 Y65 L90 A93 A94 | Y57-F61 WeakPolarHBondContact O-CB 3.28Å; Y57-F61 PolarHBondContact O-N 3.42Å; A58-F61 PolarHBondContact O-N 3.23Å; F61-F63 VanDerWaalsContact C-N 3.32Å; F61-F63 PolarHBondContact O-N 2.91Å; F61-A64 PolarHBondContact O-N 3.15Å; F61-Y65 VanDerWaalsContact O-CB 3.22Å; F61-Y65 WeakPolarHBondContact O-CB 3.35Å; F61-Y65 PolarHBondContact O-N 2.86Å; F61-L90 HydrophobicContact CD2-CD2 4.25Å; F61-L90 HydrophobicContact CD2-CG 3.94Å; F61-L90 HydrophobicContact CE2-CD1 4.48Å; F61-L90 HydrophobicContact CE2-CD2 3.65Å; F61-L90 HydrophobicContact CE2-CG 3.75Å; F61-L90 HydrophobicContact CZ-CD2 4.48Å; F61-A93 HydrophobicContact CB-CB 3.87Å; F61-A94 HydrophobicContact CD2-CB 3.97Å; F61-A94 HydrophobicContact CE2-CB 3.88Å |
| 62 | A | 91.1 | Very high | 87.3 | Confident | 44 Ų | 44 | 56.7 Ų | 56.7 | 36% | 0.364 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.4 | -40 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112 | A58 L66 | A58-A62 WeakPolarHBondContact O-CB 3.5Å; A58-A62 PolarHBondContact O-N 3.26Å; A62-L66 WeakPolarHBondContact O-CB 3.26Å; A62-L66 WeakPolarHBondContact O-CG 3.3Å; A62-L66 PolarHBondContact O-N 2.92Å |
| 63 | F | 90.1 | Very high | 86.7 | Confident | 50 Ų | 50 | 58 Ų | 58 | 22% | 0.219 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -68 | -45.9 | 178.1 | -174 | -124.8 | 0 | 0 | 0 | 112.3 | A59 L60 F61 L66 Q67 W316 V319 L320 R323 | A59-F63 VanDerWaalsContact O-CB 3.23Å; A59-F63 WeakPolarHBondContact O-CB 3.45Å; A59-F63 PolarHBondContact O-N 3.38Å; L60-F63 PolarHBondContact O-N 2.91Å; F61-F63 VanDerWaalsContact C-N 3.32Å; F61-F63 PolarHBondContact O-N 2.91Å; F63-L66 PolarHBondContact O-N 2.73Å; F63-Q67 VanDerWaalsContact CZ-NE2 3.3Å; F63-Q67 WeakPolarHBondContact O-CG 3.45Å; F63-Q67 PolarHBondContact O-N 2.83Å; F63-W316 HydrophobicContact CB-CH2 4.3Å; F63-W316 HydrophobicContact CB-CZ3 4.37Å; F63-W316 HydrophobicContact CD1-CE3 4.28Å; F63-W316 HydrophobicContact CD1-CH2 4.35Å; F63-W316 AromaticContact CD1-CZ3 3.6Å; F63-W316 HydrophobicContact CD1-CZ3 3.6Å; F63-W316 HydrophobicContact CE1-CZ3 4.15Å; F63-W316 HydrophobicContact CG-CZ3 4.17Å; F63-V319 HydrophobicContact CD1-CG1 3.58Å; F63-V319 HydrophobicContact CE1-CG1 3.86Å; F63-L320 HydrophobicContact CE1-CD2 3.78Å; F63-L320 HydrophobicContact CE1-CG 4.37Å; F63-L320 HydrophobicContact CZ-CD2 3.99Å; F63-R323 HydrophobicContact CZ-CG 4.25Å |
| 64 | A | 89.3 | Confident | 86 | Confident | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.3 | -40.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L60 F61 Q67 L68 L90 V319 | L60-A64 WeakPolarHBondContact O-CB 3.5Å; L60-A64 PolarHBondContact O-N 2.91Å; F61-A64 PolarHBondContact O-N 3.15Å; A64-Q67 PolarHBondContact O-N 3.18Å; A64-L68 WeakPolarHBondContact O-CB 3.4Å; A64-L68 PolarHBondContact O-N 2.91Å; A64-L90 HydrophobicContact CB-CB 4.18Å; A64-V319 HydrophobicContact CB-CG1 4.28Å |
| 65 | Y | 90.1 | Very high | 84.6 | Confident | 110 Ų | 110 | 76.2 Ų | 76.2 | 43% | 0.431 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -61.7 | -47.6 | 174.7 | 177.7 | -99 | 0 | 0 | 0 | 111.8 | F61 Q67 L68 W69 L90 | F61-Y65 VanDerWaalsContact O-CB 3.22Å; F61-Y65 WeakPolarHBondContact O-CB 3.35Å; F61-Y65 PolarHBondContact O-N 2.86Å; Y65-Q67 VanDerWaalsContact C-N 3.28Å; Y65-Q67 PolarHBondContact O-N 2.89Å; Y65-L68 PolarHBondContact O-N 3.46Å; Y65-W69 VanDerWaalsContact O-CB 3.23Å; Y65-W69 WeakPolarHBondContact O-CB 3.4Å; Y65-W69 PolarHBondContact O-N 2.72Å; Y65-L90 HydrophobicContact CD2-CD1 4.1Å; Y65-L90 HydrophobicContact CG-CD1 4.48Å |
| 66 | L | 88.6 | Confident | 83.1 | Confident | 88 Ų | 88 | 76.7 Ų | 76.7 | 46% | 0.461 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.8 | -31.7 | 176.9 | -74.1 | 170.2 | 0 | 0 | 0 | 112.7 | A62 F63 R70 | A62-L66 WeakPolarHBondContact O-CB 3.26Å; A62-L66 WeakPolarHBondContact O-CG 3.3Å; A62-L66 PolarHBondContact O-N 2.92Å; F63-L66 PolarHBondContact O-N 2.73Å; L66-R70 WeakPolarHBondContact O-CD 3.3Å; L66-R70 WeakPolarHBondContact O-CG 3.39Å; L66-R70 PolarHBondContact O-N 3.47Å |
| 67 | Q | 86.8 | Confident | 81.5 | Confident | 13 Ų | 13 | 85 Ų | 85 | 6% | 0.061 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -69 | -50.4 | 171.3 | -71.7 | -169.3 | 37.1 | 0 | 0 | 112 | F63 A64 Y65 W69 R70 L71 L86 V319 F322 R323 | F63-Q67 VanDerWaalsContact CZ-NE2 3.3Å; F63-Q67 WeakPolarHBondContact O-CG 3.45Å; F63-Q67 PolarHBondContact O-N 2.83Å; A64-Q67 PolarHBondContact O-N 3.18Å; Y65-Q67 VanDerWaalsContact C-N 3.28Å; Y65-Q67 PolarHBondContact O-N 2.89Å; Q67-W69 VanDerWaalsContact C-N 3.32Å; Q67-W69 PolarHBondContact O-N 3.26Å; Q67-R70 PolarHBondContact O-N 3.47Å; Q67-L71 PolarHBondContact O-N 3.34Å; Q67-L86 HydrophobicContact CB-CD1 4.01Å; Q67-L86 HydrophobicContact CB-CD2 4.5Å; Q67-V319 PolarHBondContact NE2-O 2.92Å; Q67-F322 PolarHBondContact OE1-O 2.98Å; Q67-R323 VanDerWaalsContact OE1-CA 3.28Å |
| 68 | L | 84.9 | Confident | 79.8 | Confident | 42 Ų | 42 | 95 Ų | 95 | 22% | 0.22 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -63.4 | -38.8 | -179 | -171.9 | 64.3 | 0 | 0 | 0 | 111.7 | A64 Y65 L71 L72 F87 L90 | A64-L68 WeakPolarHBondContact O-CB 3.4Å; A64-L68 PolarHBondContact O-N 2.91Å; Y65-L68 PolarHBondContact O-N 3.46Å; L68-L71 WeakPolarHBondContact O-CB 3.46Å; L68-L71 PolarHBondContact O-N 2.87Å; L68-L72 WeakPolarHBondContact O-CB 3.35Å; L68-L72 PolarHBondContact O-N 3.06Å; L68-F87 HydrophobicContact CD2-CB 4.48Å; L68-F87 HydrophobicContact CD2-CD2 4.28Å; L68-L90 HydrophobicContact CD2-CD1 4.29Å |
| 69 | W | 84.8 | Confident | 78.5 | Confident | 124 Ų | 124 | 99.7 Ų | 99.7 | 47% | 0.47 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60 | -46.3 | 172.7 | -179.8 | -101.2 | 0 | 0 | 0 | 112.1 | Y65 Q67 L71 L72 L73 | Y65-W69 VanDerWaalsContact O-CB 3.23Å; Y65-W69 WeakPolarHBondContact O-CB 3.4Å; Y65-W69 PolarHBondContact O-N 2.72Å; Q67-W69 VanDerWaalsContact C-N 3.32Å; Q67-W69 PolarHBondContact O-N 3.26Å; W69-L71 VanDerWaalsContact C-N 3.34Å; W69-L71 PolarHBondContact O-N 3.31Å; W69-L72 PolarHBondContact O-N 3.35Å; W69-L73 HydrophobicContact CZ2-CD1 4.31Å; W69-L73 WeakPolarHBondContact O-CB 3.49Å; W69-L73 PolarHBondContact O-N 3.44Å |
| 70 | R | 80.7 | Confident | 77.9 | Confident | 147 Ų | 147 | 99.5 Ų | 99.5 | 56% | 0.555 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -61.3 | -43 | 174.5 | -73.1 | 167 | -174.1 | -149.2 | -0.2 | 111.5 | L66 Q67 L72 L73 Y74 | L66-R70 WeakPolarHBondContact O-CD 3.3Å; L66-R70 WeakPolarHBondContact O-CG 3.39Å; L66-R70 PolarHBondContact O-N 3.47Å; Q67-R70 PolarHBondContact O-N 3.47Å; R70-L72 VanDerWaalsContact C-N 3.3Å; R70-L72 PolarHBondContact O-N 3.48Å; R70-L73 PolarHBondContact O-N 3.03Å; R70-Y74 HydrophobicContact CB-CD2 4.42Å; R70-Y74 HydrophobicContact CB-CE2 4.33Å; R70-Y74 WeakPolarHBondContact O-CD2 3.11Å; R70-Y74 PolarHBondContact O-N 3.31Å |
| 71 | L | 78.8 | Confident | 77.5 | Confident | 33 Ų | 33 | 101.9 Ų | 101.9 | 17% | 0.173 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -60.4 | -40.7 | 178.2 | -139.2 | 73.4 | 0 | 0 | 0 | 111.7 | Q67 L68 W69 Q82 | Q67-L71 PolarHBondContact O-N 3.34Å; L68-L71 WeakPolarHBondContact O-CB 3.46Å; L68-L71 PolarHBondContact O-N 2.87Å; W69-L71 VanDerWaalsContact C-N 3.34Å; W69-L71 PolarHBondContact O-N 3.31Å; L71-Q82 HydrophobicContact CD2-CG 4.41Å |
| 72 | L | 77.6 | Confident | 77.1 | Confident | 104 Ų | 104 | 100.9 Ų | 100.9 | 55% | 0.545 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -66.8 | -43.3 | 173.8 | -175.9 | 66.5 | 0 | 0 | 0 | 112.1 | L68 W69 R70 R75 | L68-L72 WeakPolarHBondContact O-CB 3.35Å; L68-L72 PolarHBondContact O-N 3.06Å; W69-L72 PolarHBondContact O-N 3.35Å; R70-L72 VanDerWaalsContact C-N 3.3Å; R70-L72 PolarHBondContact O-N 3.48Å; L72-R75 PolarHBondContact O-N 3.49Å; L72-R75 VanDerWaalsContact O-N 3.11Å |
| 73 | L | 74.6 | Confident | 76.9 | Confident | 119 Ų | 119 | 99.3 Ų | 99.3 | 62% | 0.623 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -66.5 | -38.1 | -177.4 | -153.6 | 80 | 0 | 0 | 0 | 112.6 | W69 R70 R75 | W69-L73 HydrophobicContact CZ2-CD1 4.31Å; W69-L73 WeakPolarHBondContact O-CB 3.49Å; W69-L73 PolarHBondContact O-N 3.44Å; R70-L73 PolarHBondContact O-N 3.03Å; L73-R75 PolarHBondContact O-N 2.88Å |
| 74 | Y | 69.4 | Low | 76.8 | Confident | 183 Ų | 183 | 100 Ų | 100 | 72% | 0.718 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.9 | 3 | 174.3 | -69.5 | -60.1 | 0 | 0 | 0 | 113.9 | R70 E76 | R70-Y74 HydrophobicContact CB-CD2 4.42Å; R70-Y74 HydrophobicContact CB-CE2 4.33Å; R70-Y74 WeakPolarHBondContact O-CD2 3.11Å; R70-Y74 PolarHBondContact O-N 3.31Å; Y74-E76 PolarHBondContact O-N 3.36Å; Y74-E76 VanDerWaalsContact O-N 3.1Å |
| 75 | R | 57 | Low | 76.8 | Confident | 230 Ų | 230 | 100 Ų | 100 | 87% | 0.868 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.9 | 23.3 | 169.5 | -149.7 | 173.1 | -173.4 | 157.3 | 0.4 | 114.5 | L72 L73 | L72-R75 PolarHBondContact O-N 3.49Å; L72-R75 VanDerWaalsContact O-N 3.11Å; L73-R75 PolarHBondContact O-N 2.88Å |
| 76 | E | 57.4 | Low | 76.7 | Confident | 119 Ų | 119 | 94.9 Ų | 94.9 | 56% | 0.556 | 42% | 0.418 | S | S | * | . | trans | -60.9 | 165.3 | 174 | -100.4 | -67.2 | 178 | 0 | 0 | 112.4 | Y74 R78 | Y74-E76 PolarHBondContact O-N 3.36Å; Y74-E76 VanDerWaalsContact O-N 3.1Å; E76-R78 PolarHBondContact O-N 2.92Å | ||
| 77 | R | 56.7 | Low | 76.7 | Confident | 216 Ų | 216 | 95.6 Ų | 95.6 | 82% | 0.815 | 42% | 0.417 | S | S | * | . | trans | -61.7 | 103.2 | -173.2 | -154.7 | 175.1 | -169.2 | 173.2 | 2.8 | 110.2 | L79 | R77-L79 CarbonylContact O-C 3.48Å; R77-L79 PolarHBondContact O-N 3.28Å | ||
| 78 | R | 55.7 | Low | 76.9 | Confident | 210 Ų | 210 | 96.3 Ų | 96.3 | 79% | 0.792 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -48.7 | -33 | -161 | -56.3 | -169 | -168.5 | -159.1 | 6.7 | 115.9 | E76 S83 | E76-R78 PolarHBondContact O-N 2.92Å; R78-S83 PolarHBondContact O-OG 3.06Å |
| 79 | L | 60.8 | Low | 77.2 | Confident | 143 Ų | 143 | 94.6 Ų | 94.6 | 75% | 0.749 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -110.2 | 105.7 | 176.9 | -63.3 | 174.9 | 0 | 0 | 0 | 109.8 | R77 L84 | R77-L79 CarbonylContact O-C 3.48Å; R77-L79 PolarHBondContact O-N 3.28Å; L79-L84 HydrophobicContact CD2-CD2 4.22Å |
| 80 | S | 79.1 | Confident | 77.6 | Confident | 44 Ų | 44 | 89.8 Ų | 89.8 | 31% | 0.308 | 40% | 0.396 | S | S | . | . | trans | -138.6 | 153.4 | 176.9 | 172.7 | 0 | 0 | 0 | 0 | 108.2 | Q82 S83 L84 | S80-Q82 PolarHBondContact O-N 3.15Å; S80-Q82 VanDerWaalsContact O-N 3.1Å; S80-S83 PolarHBondContact N-OG 3.22Å; S80-S83 PolarHBondContact O-N 3.35Å; S80-S83 PolarHBondContact O-OG 2.83Å; S80-S83 VanDerWaalsContact O-OG 3.1Å; S80-L84 WeakPolarHBondContact O-CG 3.43Å; S80-L84 PolarHBondContact O-N 2.96Å | ||
| 81 | Y | 82.3 | Confident | 78.1 | Confident | 50 Ų | 50 | 85.4 Ų | 85.4 | 20% | 0.196 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -53 | -34.3 | 175.7 | -58 | -79.8 | 0 | 0 | 0 | 112 | C85 L141 L144 Y145 E148 H167 | Y81-C85 WeakPolarHBondContact O-CB 2.87Å; Y81-C85 PolarHBondContact O-N 2.95Å; Y81-L141 HydrophobicContact CD1-CD2 4.21Å; Y81-L144 HydrophobicContact CD1-CB 4.23Å; Y81-L144 HydrophobicContact CE1-CB 4.1Å; Y81-Y145 HydrophobicContact CD2-CD2 4.45Å; Y81-Y145 HydrophobicContact CG-CD2 4.43Å; Y81-E148 HydrophobicContact CE2-CB 4.42Å; Y81-E148 HydrophobicContact CE2-CG 4.17Å; Y81-H167 AromaticContact CZ-NE2 3.75Å; Y81-H167 PolarHBondContact OH-CD2 3.05Å; Y81-H167 PolarHBondContact OH-NE2 3.32Å |
| 82 | Q | 84.2 | Confident | 78.7 | Confident | 49 Ų | 49 | 84.1 Ų | 84.1 | 23% | 0.229 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -65 | -46.5 | 173.7 | -178.7 | 175.5 | 17.1 | 0 | 0 | 112.9 | L71 S80 C85 L86 F322 | L71-Q82 HydrophobicContact CD2-CG 4.41Å; S80-Q82 PolarHBondContact O-N 3.15Å; S80-Q82 VanDerWaalsContact O-N 3.1Å; Q82-C85 PolarHBondContact O-N 3.39Å; Q82-L86 HydrophobicContact CG-CD1 4.25Å; Q82-L86 WeakPolarHBondContact O-CB 3.48Å; Q82-L86 WeakPolarHBondContact O-CG 3.41Å; Q82-L86 PolarHBondContact O-N 3.48Å; Q82-F322 HydrophobicContact CB-CD1 3.89Å; Q82-F322 HydrophobicContact CB-CE1 4.3Å; Q82-F322 HydrophobicContact CG-CB 4.1Å; Q82-F322 HydrophobicContact CG-CD1 3.76Å; Q82-F322 HydrophobicContact CG-CG 4.24Å; Q82-F322 PolarHBondContact NE2-O 3.06Å |
| 83 | S | 86.1 | Confident | 79.3 | Confident | 11 Ų | 11 | 79.1 Ų | 79.1 | 8% | 0.077 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -70.9 | -38.2 | -179.2 | 67.4 | 0 | 0 | 0 | 0 | 111.8 | R78 S80 F87 | R78-S83 PolarHBondContact O-OG 3.06Å; S80-S83 PolarHBondContact N-OG 3.22Å; S80-S83 PolarHBondContact O-N 3.35Å; S80-S83 PolarHBondContact O-OG 2.83Å; S80-S83 VanDerWaalsContact O-OG 3.1Å; S83-F87 VanDerWaalsContact O-CB 3.29Å; S83-F87 WeakPolarHBondContact O-CB 3.26Å; S83-F87 PolarHBondContact O-N 2.93Å |
| 84 | L | 88.6 | Confident | 80.1 | Confident | 66 Ų | 66 | 74.6 Ų | 74.6 | 35% | 0.346 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.8 | -45.9 | 173.2 | -67 | 172.9 | 0 | 0 | 0 | 111.6 | L79 S80 F87 L88 L141 | L79-L84 HydrophobicContact CD2-CD2 4.22Å; S80-L84 WeakPolarHBondContact O-CG 3.43Å; S80-L84 PolarHBondContact O-N 2.96Å; L84-F87 PolarHBondContact O-N 3.22Å; L84-L88 WeakPolarHBondContact O-CG 3.44Å; L84-L88 PolarHBondContact O-N 2.94Å; L84-L141 HydrophobicContact CB-CD1 3.69Å |
| 85 | C | 88 | Confident | 80.9 | Confident | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.9 | -48.6 | 178.6 | -176.7 | 0 | 0 | 0 | 0 | 111.8 | Y81 Q82 F87 L88 C89 L141 V318 F322 | Y81-C85 WeakPolarHBondContact O-CB 2.87Å; Y81-C85 PolarHBondContact O-N 2.95Å; Q82-C85 PolarHBondContact O-N 3.39Å; C85-F87 VanDerWaalsContact C-N 3.28Å; C85-F87 PolarHBondContact O-N 3.26Å; C85-L88 PolarHBondContact O-N 3.37Å; C85-C89 PolarHBondContact O-N 2.9Å; C85-C89 PolarHBondContact O-SG 2.91Å; C85-L141 HydrophobicContact CB-CD1 4.31Å; C85-V318 WeakPolarHBondContact SG-CG1 3.36Å; C85-F322 HydrophobicContact CB-CD2 4.02Å; C85-F322 HydrophobicContact CB-CE2 3.89Å; C85-F322 HydrophobicContact CB-CZ 4.47Å; C85-F322 WeakPolarHBondContact SG-CD2 3.3Å; C85-F322 WeakPolarHBondContact SG-CE2 3.44Å |
| 86 | L | 88.1 | Confident | 82.3 | Confident | 2 Ų | 2 | 56.4 Ų | 56.4 | 1% | 0.01 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61.6 | -35.2 | 175.5 | -70.2 | 172.5 | 0 | 0 | 0 | 112.5 | Q67 Q82 L90 V319 F322 | Q67-L86 HydrophobicContact CB-CD1 4.01Å; Q67-L86 HydrophobicContact CB-CD2 4.5Å; Q82-L86 HydrophobicContact CG-CD1 4.25Å; Q82-L86 WeakPolarHBondContact O-CB 3.48Å; Q82-L86 WeakPolarHBondContact O-CG 3.41Å; Q82-L86 PolarHBondContact O-N 3.48Å; L86-L90 VanDerWaalsContact O-CB 3.26Å; L86-L90 WeakPolarHBondContact O-CB 3.34Å; L86-L90 PolarHBondContact O-N 3.08Å; L86-V319 HydrophobicContact CD2-CB 4.47Å; L86-V319 HydrophobicContact CD2-CG1 4.06Å; L86-V319 HydrophobicContact CD2-CG2 4.31Å; L86-F322 HydrophobicContact CD2-CB 4.19Å; L86-F322 HydrophobicContact CG-CB 4.26Å |
| 87 | F | 90.1 | Very high | 83.6 | Confident | 103 Ų | 103 | 52.5 Ų | 52.5 | 45% | 0.452 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -67.4 | -42.8 | 174.8 | -179.8 | -97 | 0 | 0 | 0 | 112.7 | L68 S83 L84 C85 L90 L91 | L68-F87 HydrophobicContact CD2-CB 4.48Å; L68-F87 HydrophobicContact CD2-CD2 4.28Å; S83-F87 VanDerWaalsContact O-CB 3.29Å; S83-F87 WeakPolarHBondContact O-CB 3.26Å; S83-F87 PolarHBondContact O-N 2.93Å; L84-F87 PolarHBondContact O-N 3.22Å; C85-F87 VanDerWaalsContact C-N 3.28Å; C85-F87 PolarHBondContact O-N 3.26Å; F87-L90 PolarHBondContact O-N 3.24Å; F87-L91 HydrophobicContact CE1-CD2 4.4Å; F87-L91 WeakPolarHBondContact O-CB 3.27Å; F87-L91 PolarHBondContact O-N 3.05Å |
| 88 | L | 91.1 | Very high | 84.8 | Confident | 28 Ų | 28 | 45.5 Ų | 45.5 | 15% | 0.147 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63 | -43.8 | 174.1 | -65.2 | -175.6 | 0 | 0 | 0 | 111.5 | L84 C85 L90 L91 W92 L134 T138 L141 | L84-L88 WeakPolarHBondContact O-CG 3.44Å; L84-L88 PolarHBondContact O-N 2.94Å; C85-L88 PolarHBondContact O-N 3.37Å; L88-L90 VanDerWaalsContact C-N 3.33Å; L88-L90 PolarHBondContact O-N 2.84Å; L88-L91 PolarHBondContact O-N 3.25Å; L88-W92 VanDerWaalsContact O-CB 3.23Å; L88-W92 WeakPolarHBondContact O-CB 3.27Å; L88-W92 PolarHBondContact O-N 3.41Å; L88-L134 HydrophobicContact CD2-CD2 3.7Å; L88-T138 WeakPolarHBondContact CB-OG1 3.28Å; L88-L141 HydrophobicContact CD1-CD1 3.6Å; L88-L141 HydrophobicContact CD1-CG 4.41Å; L88-L141 HydrophobicContact CG-CD1 4.34Å |
| 89 | C | 90.6 | Very high | 85.9 | Confident | 6 Ų | 6 | 35.9 Ų | 35.9 | 4% | 0.041 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.5 | -38.1 | 175.7 | -65.4 | 0 | 0 | 0 | 0 | 112.4 | C85 A93 V319 | C85-C89 PolarHBondContact O-N 2.9Å; C85-C89 PolarHBondContact O-SG 2.91Å; C89-A93 VanDerWaalsContact O-CB 3.31Å; C89-A93 WeakPolarHBondContact O-CB 3.39Å; C89-A93 PolarHBondContact O-N 2.93Å; C89-V319 HydrophobicContact CB-CG2 3.61Å |
| 90 | L | 92.2 | Very high | 86.5 | Confident | 23 Ų | 23 | 29.4 Ų | 29.4 | 12% | 0.12 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.6 | -46 | 175.9 | -178.7 | 154.4 | 0 | 0 | 0 | 111.7 | F61 A64 Y65 L68 L86 F87 L88 W92 A93 A94 | F61-L90 HydrophobicContact CD2-CD2 4.25Å; F61-L90 HydrophobicContact CD2-CG 3.94Å; F61-L90 HydrophobicContact CE2-CD1 4.48Å; F61-L90 HydrophobicContact CE2-CD2 3.65Å; F61-L90 HydrophobicContact CE2-CG 3.75Å; F61-L90 HydrophobicContact CZ-CD2 4.48Å; A64-L90 HydrophobicContact CB-CB 4.18Å; Y65-L90 HydrophobicContact CD2-CD1 4.1Å; Y65-L90 HydrophobicContact CG-CD1 4.48Å; L68-L90 HydrophobicContact CD2-CD1 4.29Å; L86-L90 VanDerWaalsContact O-CB 3.26Å; L86-L90 WeakPolarHBondContact O-CB 3.34Å; L86-L90 PolarHBondContact O-N 3.08Å; F87-L90 PolarHBondContact O-N 3.24Å; L88-L90 VanDerWaalsContact C-N 3.33Å; L88-L90 PolarHBondContact O-N 2.84Å; L90-W92 VanDerWaalsContact C-N 3.33Å; L90-A93 PolarHBondContact O-N 3.31Å; L90-A94 WeakPolarHBondContact O-CB 3.49Å; L90-A94 PolarHBondContact O-N 3.39Å |
| 91 | L | 91.6 | Very high | 86.2 | Confident | 54 Ų | 54 | 30.5 Ų | 30.5 | 28% | 0.283 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -65.2 | -38.7 | 177.8 | -176.8 | 57.2 | 0 | 0 | 0 | 111.4 | F87 L88 A94 L95 F130 L134 | F87-L91 HydrophobicContact CE1-CD2 4.4Å; F87-L91 WeakPolarHBondContact O-CB 3.27Å; F87-L91 PolarHBondContact O-N 3.05Å; L88-L91 PolarHBondContact O-N 3.25Å; L91-A94 PolarHBondContact O-N 2.89Å; L91-L95 HydrophobicContact CD1-CD1 4.48Å; L91-L95 HydrophobicContact CG-CD1 4.31Å; L91-L95 WeakPolarHBondContact O-CD1 3.47Å; L91-L95 VanDerWaalsContact O-CG 3.27Å; L91-L95 WeakPolarHBondContact O-CG 3.45Å; L91-L95 PolarHBondContact O-N 3.32Å; L91-F130 HydrophobicContact CD2-CE1 4.02Å; L91-F130 HydrophobicContact CD2-CZ 4.35Å; L91-F130 HydrophobicContact CG-CE1 4.47Å; L91-L134 HydrophobicContact CB-CD1 4.17Å; L91-L134 HydrophobicContact CD2-CD1 4.2Å; L91-L134 HydrophobicContact CD2-CD2 3.98Å; L91-L134 HydrophobicContact CG-CD1 3.83Å; L91-L134 HydrophobicContact CG-CD2 4.48Å |
| 92 | W | 92.4 | Very high | 85.6 | Confident | 6 Ų | 6 | 30.6 Ų | 30.6 | 2% | 0.023 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.2 | -48.5 | 173.5 | 178.6 | 87.2 | 0 | 0 | 0 | 112.1 | Y57 L60 L88 L90 A94 L95 R96 L134 E311 A315 | Y57-W92 HydrophobicContact CD1-CH2 4.22Å; Y57-W92 HydrophobicContact CD1-CZ3 4.04Å; Y57-W92 AromaticContact CE1-CH2 3.62Å; Y57-W92 HydrophobicContact CE1-CH2 3.62Å; Y57-W92 HydrophobicContact CE1-CZ2 4.28Å; Y57-W92 AromaticContact CE1-CZ3 3.92Å; Y57-W92 HydrophobicContact CE1-CZ3 3.92Å; L60-W92 HydrophobicContact CD2-CE3 4.04Å; L60-W92 HydrophobicContact CD2-CZ3 3.6Å; L88-W92 VanDerWaalsContact O-CB 3.23Å; L88-W92 WeakPolarHBondContact O-CB 3.27Å; L88-W92 PolarHBondContact O-N 3.41Å; L90-W92 VanDerWaalsContact C-N 3.33Å; W92-A94 VanDerWaalsContact C-N 3.33Å; W92-A94 PolarHBondContact O-N 2.89Å; W92-L95 PolarHBondContact O-N 3.04Å; W92-R96 HydrophobicContact CZ2-CG 4.34Å; W92-R96 PolarHBondContact O-N 3.06Å; W92-L134 HydrophobicContact CB-CB 4.23Å; W92-L134 HydrophobicContact CB-CD1 4.02Å; W92-E311 HydrophobicContact CH2-CB 3.92Å; W92-E311 HydrophobicContact CZ2-CB 3.81Å; W92-E311 HydrophobicContact CZ2-CG 4.36Å; W92-A315 HydrophobicContact CE3-CB 4.2Å; W92-A315 HydrophobicContact CH2-CB 3.91Å; W92-A315 HydrophobicContact CZ3-CB 3.58Å |
| 93 | A | 90.5 | Very high | 84.7 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.9 | -39.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | L60 F61 C89 L90 R96 T97 | L60-A93 HydrophobicContact CD2-CB 4.18Å; L60-A93 HydrophobicContact CG-CB 4.41Å; F61-A93 HydrophobicContact CB-CB 3.87Å; C89-A93 VanDerWaalsContact O-CB 3.31Å; C89-A93 WeakPolarHBondContact O-CB 3.39Å; C89-A93 PolarHBondContact O-N 2.93Å; L90-A93 PolarHBondContact O-N 3.31Å; A93-R96 PolarHBondContact O-N 3.42Å; A93-T97 WeakPolarHBondContact O-CG2 3.25Å; A93-T97 PolarHBondContact O-N 3.35Å; A93-T97 PolarHBondContact O-OG1 3.18Å |
| 94 | A | 89.7 | Confident | 83.7 | Confident | 24 Ų | 24 | 32.1 Ų | 32.1 | 20% | 0.198 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -58.3 | -51.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | F61 L90 L91 W92 R96 T97 T98 | F61-A94 HydrophobicContact CD2-CB 3.97Å; F61-A94 HydrophobicContact CE2-CB 3.88Å; L90-A94 WeakPolarHBondContact O-CB 3.49Å; L90-A94 PolarHBondContact O-N 3.39Å; L91-A94 PolarHBondContact O-N 2.89Å; W92-A94 VanDerWaalsContact C-N 3.33Å; W92-A94 PolarHBondContact O-N 2.89Å; A94-R96 VanDerWaalsContact C-N 3.33Å; A94-R96 PolarHBondContact O-N 3.22Å; A94-T97 WeakPolarHBondContact CA-OG1 3.28Å; A94-T97 PolarHBondContact O-N 2.77Å; A94-T97 VanDerWaalsContact O-N 3.12Å; A94-T97 PolarHBondContact O-OG1 2.93Å; A94-T98 PolarHBondContact O-N 3.13Å; A94-T98 PolarHBondContact O-OG1 2.93Å |
| 95 | L | 86.4 | Confident | 82.1 | Confident | 14 Ų | 14 | 31.8 Ų | 31.8 | 7% | 0.073 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.9 | -38.6 | 179.8 | -68.4 | 165.5 | 0 | 0 | 0 | 112.8 | L91 W92 T98 L99 L126 L127 F130 P131 L134 | L91-L95 HydrophobicContact CD1-CD1 4.48Å; L91-L95 HydrophobicContact CG-CD1 4.31Å; L91-L95 WeakPolarHBondContact O-CD1 3.47Å; L91-L95 VanDerWaalsContact O-CG 3.27Å; L91-L95 WeakPolarHBondContact O-CG 3.45Å; L91-L95 PolarHBondContact O-N 3.32Å; W92-L95 PolarHBondContact O-N 3.04Å; L95-T98 WeakPolarHBondContact CA-OG1 3.25Å; L95-T98 PolarHBondContact O-N 2.84Å; L95-T98 PolarHBondContact O-OG1 2.91Å; L95-L99 WeakPolarHBondContact O-CB 3.04Å; L95-L99 PolarHBondContact O-N 3.4Å; L95-L126 HydrophobicContact CD2-CD1 4.35Å; L95-L126 HydrophobicContact CD2-CD2 4.43Å; L95-L126 HydrophobicContact CD2-CG 3.89Å; L95-L127 HydrophobicContact CD2-CD2 4.3Å; L95-F130 HydrophobicContact CD1-CD1 3.55Å; L95-F130 HydrophobicContact CD1-CE1 3.99Å; L95-P131 HydrophobicContact CB-CG 4.1Å; L95-P131 HydrophobicContact CD1-CG 4.31Å; L95-L134 HydrophobicContact CD1-CD1 3.65Å |
| 96 | R | 86 | Confident | 80.4 | Confident | 16 Ų | 16 | 38.6 Ų | 38.6 | 6% | 0.06 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -65.2 | -45.1 | 171.8 | -78.8 | -68.2 | -170.3 | -139.1 | 5.1 | 111.7 | Y57 W92 A93 A94 T98 L99 F100 E311 | Y57-R96 HydrophobicContact CD1-CB 3.5Å; Y57-R96 HydrophobicContact CD1-CG 4.02Å; Y57-R96 HydrophobicContact CD2-CB 4.03Å; Y57-R96 HydrophobicContact CE1-CB 3.57Å; Y57-R96 HydrophobicContact CE1-CG 3.57Å; Y57-R96 HydrophobicContact CE2-CB 4.12Å; Y57-R96 HydrophobicContact CG-CB 3.75Å; W92-R96 HydrophobicContact CZ2-CG 4.34Å; W92-R96 PolarHBondContact O-N 3.06Å; A93-R96 PolarHBondContact O-N 3.42Å; A94-R96 VanDerWaalsContact C-N 3.33Å; A94-R96 PolarHBondContact O-N 3.22Å; R96-T98 VanDerWaalsContact C-N 3.32Å; R96-T98 PolarHBondContact O-N 3.41Å; R96-L99 PolarHBondContact O-N 2.86Å; R96-F100 WeakPolarHBondContact O-CD2 3.38Å; R96-F100 PolarHBondContact O-N 3.35Å; R96-F100 VanDerWaalsContact O-N 3.07Å; R96-E311 IonicContact CZ-OE1 3.18Å; R96-E311 IonicContact CZ-OE2 3.95Å; R96-E311 IonicContact NE-OE1 2.74Å; R96-E311 IonicContact NE-OE2 2.71Å; R96-E311 PolarHBondContact NE-OE2 3.49Å; R96-E311 IonicContact NH2-OE1 2.87Å; R96-E311 PolarHBondContact NH2-OE1 3.41Å; R96-E311 IonicContact NH2-OE2 2.7Å; R96-E311 PolarHBondContact NH2-OE2 3.37Å |
| 97 | T | 85.8 | Confident | 78.6 | Confident | 37 Ų | 37 | 44 Ų | 44 | 23% | 0.227 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.2 | -37.4 | 174.5 | 57.1 | 0 | 0 | 0 | 0 | 112.9 | A58 A93 A94 S101 | A58-T97 HydrophobicContact CB-CG2 4.17Å; A93-T97 WeakPolarHBondContact O-CG2 3.25Å; A93-T97 PolarHBondContact O-N 3.35Å; A93-T97 PolarHBondContact O-OG1 3.18Å; A94-T97 WeakPolarHBondContact CA-OG1 3.28Å; A94-T97 PolarHBondContact O-N 2.77Å; A94-T97 VanDerWaalsContact O-N 3.12Å; A94-T97 PolarHBondContact O-OG1 2.93Å; T97-S101 WeakPolarHBondContact O-CB 3.48Å; T97-S101 PolarHBondContact O-N 3.07Å |
| 98 | T | 82.3 | Confident | 76.6 | Confident | 70 Ų | 70 | 41 Ų | 41 | 43% | 0.429 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -71.4 | -34.8 | 177.5 | 53.7 | 0 | 0 | 0 | 0 | 112.4 | A94 L95 R96 A102 L127 | A94-T98 PolarHBondContact O-N 3.13Å; A94-T98 PolarHBondContact O-OG1 2.93Å; L95-T98 WeakPolarHBondContact CA-OG1 3.25Å; L95-T98 PolarHBondContact O-N 2.84Å; L95-T98 PolarHBondContact O-OG1 2.91Å; R96-T98 VanDerWaalsContact C-N 3.32Å; R96-T98 PolarHBondContact O-N 3.41Å; T98-A102 WeakPolarHBondContact O-CB 3.46Å; T98-A102 PolarHBondContact O-N 3.02Å; T98-L127 VanDerWaalsContact OG1-CD2 3.31Å; T98-L127 WeakPolarHBondContact OG1-CD2 3.39Å |
| 99 | L | 77.9 | Confident | 74.5 | Confident | 7 Ų | 7 | 45 Ų | 45 | 4% | 0.037 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.5 | -52.8 | 173.4 | -171.3 | 165.5 | 0 | 0 | 0 | 111.1 | L95 R96 S101 A102 A103 Y128 W283 | L95-L99 WeakPolarHBondContact O-CB 3.04Å; L95-L99 PolarHBondContact O-N 3.4Å; R96-L99 PolarHBondContact O-N 2.86Å; L99-S101 PolarHBondContact O-N 2.88Å; L99-A102 PolarHBondContact O-N 2.92Å; L99-A103 PolarHBondContact O-N 3.47Å; L99-Y128 HydrophobicContact CD1-CD1 3.97Å; L99-Y128 HydrophobicContact CD1-CE1 3.76Å; L99-Y128 HydrophobicContact CG-CE1 4.36Å; L99-W283 HydrophobicContact CD2-CH2 4.28Å; L99-W283 HydrophobicContact CD2-CZ2 3.93Å |
| 100 | F | 72.8 | Confident | 71.9 | Confident | 8 Ų | 8 | 49.9 Ų | 49.9 | 4% | 0.035 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 178.9 | -82.3 | -92.7 | 0 | 0 | 0 | 112.1 | H53 A54 Y57 R96 A103 F104 W283 | H53-F100 HydrophobicContact CB-CD1 4.46Å; H53-F100 HydrophobicContact CB-CE1 3.95Å; H53-F100 HydrophobicContact CB-CZ 4.13Å; A54-F100 HydrophobicContact CB-CB 4.18Å; Y57-F100 HydrophobicContact CD2-CD2 4.04Å; Y57-F100 HydrophobicContact CD2-CE2 4.16Å; Y57-F100 AromaticContact CE2-CD2 3.75Å; Y57-F100 HydrophobicContact CE2-CD2 3.75Å; Y57-F100 AromaticContact CE2-CE2 3.4Å; Y57-F100 HydrophobicContact CE2-CE2 3.4Å; Y57-F100 HydrophobicContact CE2-CZ 4.08Å; R96-F100 WeakPolarHBondContact O-CD2 3.38Å; R96-F100 PolarHBondContact O-N 3.35Å; R96-F100 VanDerWaalsContact O-N 3.07Å; F100-A103 WeakPolarHBondContact O-CB 3.46Å; F100-A103 PolarHBondContact O-N 2.93Å; F100-F104 WeakPolarHBondContact O-CD2 3.03Å; F100-F104 PolarHBondContact O-N 3.27Å; F100-F104 VanDerWaalsContact O-N 3.07Å; F100-W283 HydrophobicContact CE1-CH2 4.36Å; F100-W283 HydrophobicContact CE1-CZ3 4.24Å; F100-W283 HydrophobicContact CZ-CZ3 4.3Å |
| 101 | S | 74 | Confident | 69.5 | Low | 66 Ų | 66 | 53.8 Ų | 53.8 | 46% | 0.462 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -64.5 | -39.3 | 175.9 | -172.5 | 0 | 0 | 0 | 0 | 112.9 | T97 L99 S105 | T97-S101 WeakPolarHBondContact O-CB 3.48Å; T97-S101 PolarHBondContact O-N 3.07Å; L99-S101 PolarHBondContact O-N 2.88Å; S101-S105 WeakPolarHBondContact O-CB 3.4Å; S101-S105 PolarHBondContact O-N 3.31Å; S101-S105 PolarHBondContact O-OG 3.07Å |
| 102 | A | 69.8 | Low | 67.1 | Low | 52 Ų | 52 | 58.8 Ų | 58.8 | 43% | 0.43 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.1 | -40.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | T98 L99 S105 L106 | T98-A102 WeakPolarHBondContact O-CB 3.46Å; T98-A102 PolarHBondContact O-N 3.02Å; L99-A102 PolarHBondContact O-N 2.92Å; A102-S105 PolarHBondContact O-N 3.37Å; A102-L106 WeakPolarHBondContact O-CB 3.32Å; A102-L106 PolarHBondContact O-N 3.09Å |
| 103 | A | 65.1 | Low | 64.8 | Low | 27 Ų | 27 | 66.1 Ų | 66.1 | 22% | 0.223 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -59.5 | -51.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L99 F100 S105 L106 S107 W283 | L99-A103 PolarHBondContact O-N 3.47Å; F100-A103 WeakPolarHBondContact O-CB 3.46Å; F100-A103 PolarHBondContact O-N 2.93Å; A103-S105 VanDerWaalsContact C-N 3.3Å; A103-S105 PolarHBondContact O-N 3.28Å; A103-L106 PolarHBondContact O-N 2.91Å; A103-L106 VanDerWaalsContact O-N 3.15Å; A103-S107 PolarHBondContact O-N 3.1Å; A103-S107 PolarHBondContact O-OG 3.27Å; A103-W283 HydrophobicContact CB-CH2 4.18Å; A103-W283 HydrophobicContact CB-CZ2 3.78Å |
| 104 | F | 63.8 | Low | 62.6 | Low | 65 Ų | 65 | 75.7 Ų | 75.7 | 29% | 0.285 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -58 | -41.8 | 174.8 | -69.5 | -61 | 0 | 0 | 0 | 112.6 | L47 S50 V51 A54 F100 L106 S107 G108 | L47-F104 HydrophobicContact CD1-CD1 4.28Å; L47-F104 HydrophobicContact CD1-CE1 3.93Å; S50-F104 VanDerWaalsContact CB-CZ 3.48Å; V51-F104 HydrophobicContact CB-CZ 4.46Å; V51-F104 HydrophobicContact CG2-CE1 3.99Å; V51-F104 HydrophobicContact CG2-CZ 3.65Å; A54-F104 HydrophobicContact CB-CE2 4.01Å; F100-F104 WeakPolarHBondContact O-CD2 3.03Å; F100-F104 PolarHBondContact O-N 3.27Å; F100-F104 VanDerWaalsContact O-N 3.07Å; F104-L106 VanDerWaalsContact C-N 3.29Å; F104-L106 PolarHBondContact O-N 2.96Å; F104-S107 PolarHBondContact O-N 3.19Å; F104-G108 PolarHBondContact O-N 2.87Å |
| 105 | S | 56.7 | Low | 60.4 | Low | 60 Ų | 60 | 76.9 Ų | 76.9 | 42% | 0.42 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -66.9 | -31 | 179.4 | -57 | 0 | 0 | 0 | 0 | 112.6 | S101 A102 A103 G108 | S101-S105 WeakPolarHBondContact O-CB 3.4Å; S101-S105 PolarHBondContact O-N 3.31Å; S101-S105 PolarHBondContact O-OG 3.07Å; A102-S105 PolarHBondContact O-N 3.37Å; A103-S105 VanDerWaalsContact C-N 3.3Å; A103-S105 PolarHBondContact O-N 3.28Å; S105-G108 CarbonylContact O-C 3.11Å; S105-G108 PolarHBondContact O-N 2.74Å |
| 106 | L | 51.7 | Low | 58.3 | Low | 142 Ų | 142 | 80.7 Ų | 80.7 | 74% | 0.743 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -77.3 | -37.7 | 178.9 | -159.7 | 70.3 | 0 | 0 | 0 | 111.8 | A102 A103 F104 G108 | A102-L106 WeakPolarHBondContact O-CB 3.32Å; A102-L106 PolarHBondContact O-N 3.09Å; A103-L106 PolarHBondContact O-N 2.91Å; A103-L106 VanDerWaalsContact O-N 3.15Å; F104-L106 VanDerWaalsContact C-N 3.29Å; F104-L106 PolarHBondContact O-N 2.96Å; L106-G108 PolarHBondContact O-N 2.97Å |
| 107 | S | 49.4 | Very low | 56.6 | Low | 115 Ų | 115 | 84.4 Ų | 84.4 | 80% | 0.804 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64 | -23.5 | 166.8 | -53.6 | 0 | 0 | 0 | 0 | 112.7 | A103 F104 | A103-S107 PolarHBondContact O-N 3.1Å; A103-S107 PolarHBondContact O-OG 3.27Å; F104-S107 PolarHBondContact O-N 3.19Å |
| 108 | G | 49.4 | Very low | 54.7 | Low | 42 Ų | 42 | 91.5 Ų | 91.5 | 43% | 0.433 | 54% | 0.539 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | 36.9 | -175.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | F104 S105 L106 | F104-G108 PolarHBondContact O-N 2.87Å; S105-G108 CarbonylContact O-C 3.11Å; S105-G108 PolarHBondContact O-N 2.74Å; L106-G108 PolarHBondContact O-N 2.97Å |
| 109 | S | 46.3 | Very low | 53.3 | Low | 110 Ų | 110 | 93.2 Ų | 93.2 | 77% | 0.769 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.1 | 60.9 | 164.2 | 62.2 | 0 | 0 | 0 | 0 | 117.2 | ||
| 110 | L | 36.4 | Very low | 52.6 | Low | 110 Ų | 110 | 97.1 Ų | 97.1 | 58% | 0.576 | 56% | 0.563 | S | S | * | * | trans | -136.4 | 99.6 | 172.5 | -111.8 | 167.8 | 0 | 0 | 0 | 113.4 | L112 | L110-L112 HydrophobicContact CD2-CB 4.24Å; L110-L112 HydrophobicContact CD2-CD1 4.01Å; L110-L112 HydrophobicContact CD2-CG 4.48Å; L110-L112 PolarHBondContact O-N 3.38Å | ||
| 111 | P | 41.6 | Very low | 52.4 | Low | 105 Ų | 105 | 98.6 Ų | 98.6 | 68% | 0.682 | 57% | 0.569 | S | S | * | * | G | 310 helix | trans | -70.1 | -8.7 | -177.1 | -22 | 34.3 | 0 | 0 | 0 | 116.2 | L113 | P111-L113 VanDerWaalsContact C-N 3.25Å; P111-L113 PolarHBondContact O-N 3.24Å |
| 112 | L | 40.6 | Very low | 52.5 | Low | 159 Ų | 159 | 100.6 Ų | 100.6 | 83% | 0.832 | 57% | 0.57 | S | S | * | * | G | 310 helix | trans | -75.7 | -0.4 | -166 | -83.5 | 164.8 | 0 | 0 | 0 | 115.9 | L110 | L110-L112 HydrophobicContact CD2-CB 4.24Å; L110-L112 HydrophobicContact CD2-CD1 4.01Å; L110-L112 HydrophobicContact CD2-CG 4.48Å; L110-L112 PolarHBondContact O-N 3.38Å |
| 113 | L | 44.3 | Very low | 52.7 | Low | 159 Ų | 159 | 100 Ų | 100 | 83% | 0.832 | 56% | 0.561 | S | S | * | * | G | 310 helix | trans | -118.7 | 15.5 | -176.7 | -104.1 | 158.3 | 0 | 0 | 0 | 114.3 | P111 P115 | P111-L113 VanDerWaalsContact C-N 3.25Å; P111-L113 PolarHBondContact O-N 3.24Å; L113-P115 VanDerWaalsContact O-CD 3.26Å; L113-P115 WeakPolarHBondContact O-CD 3.24Å |
| 114 | R | 44.4 | Very low | 53.1 | Low | 202 Ų | 202 | 101.2 Ų | 101.2 | 76% | 0.762 | 56% | 0.563 | S | S | * | * | trans | -71.5 | 114.8 | 169.2 | 179.3 | 170.9 | -74.8 | 127.4 | -3.1 | 110 | ||||
| 115 | P | 44.5 | Very low | 53.9 | Low | 48 Ų | 48 | 99.2 Ų | 99.2 | 31% | 0.312 | 55% | 0.553 | S | S | . | * | trans | -68 | 156.4 | 179.2 | -17.5 | 32.5 | 0 | 0 | 0 | 111.8 | L113 A117 P123 | L113-P115 VanDerWaalsContact O-CD 3.26Å; L113-P115 WeakPolarHBondContact O-CD 3.24Å; P115-A117 PolarHBondContact O-N 3.31Å; P115-P123 HydrophobicContact CG-CG 4.35Å | ||
| 116 | P | 40.8 | Very low | 55.1 | Low | 95 Ų | 95 | 98.7 Ų | 98.7 | 62% | 0.617 | 55% | 0.545 | S | S | * | . | trans | -55.5 | 137 | 170.9 | -24.3 | 34.5 | 0 | 0 | 0 | 111.4 | H118 L119 | P116-H118 PolarHBondContact O-N 3.37Å; P116-L119 PolarHBondContact O-N 3.34Å | ||
| 117 | A | 51.2 | Low | 56.3 | Low | 93 Ų | 93 | 93.8 Ų | 93.8 | 77% | 0.769 | 52% | 0.519 | S | S | * | . | G | 310 helix | trans | -54.9 | -33.7 | -170 | 0 | 0 | 0 | 0 | 0 | 114.2 | P115 L119 H120 | P115-A117 PolarHBondContact O-N 3.31Å; A117-L119 PolarHBondContact O-N 2.72Å; A117-H120 PolarHBondContact O-N 3.39Å |
| 118 | H | 46.7 | Very low | 57.3 | Low | 186 Ų | 186 | 91.4 Ų | 91.4 | 86% | 0.861 | 49% | 0.493 | S | S | * | . | G | 310 helix | trans | -73.2 | -11.2 | 178.8 | -156.1 | -56.4 | 0 | 0 | 0 | 114 | P116 | P116-H118 PolarHBondContact O-N 3.37Š|
| 119 | L | 51.6 | Low | 58.6 | Low | 107 Ų | 107 | 90 Ų | 90 | 56% | 0.56 | 48% | 0.477 | S | S | * | . | G | 310 helix | trans | -100.2 | -8 | 175 | -103.1 | 72.7 | 0 | 0 | 0 | 113.7 | P116 A117 F121 F122 P123 | P116-L119 PolarHBondContact O-N 3.34Å; A117-L119 PolarHBondContact O-N 2.72Å; L119-F121 PolarHBondContact O-N 3.07Å; L119-F121 VanDerWaalsContact O-N 3.08Å; L119-F122 PolarHBondContact O-N 2.92Å; L119-P123 WeakPolarHBondContact O-CD 3.26Å |
| 120 | H | 62.8 | Low | 60.3 | Low | 89 Ų | 89 | 86.5 Ų | 86.5 | 41% | 0.412 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.5 | -31.9 | -166.4 | -129.5 | -104.3 | 0 | 0 | 0 | 114.7 | A117 F122 P123 H124 | A117-H120 PolarHBondContact O-N 3.39Å; H120-F122 PolarHBondContact O-N 3.45Å; H120-P123 WeakPolarHBondContact O-CD 3.49Å; H120-H124 WeakPolarHBondContact O-CB 3.39Å; H120-H124 PolarHBondContact O-N 3.27Å |
| 121 | F | 70.2 | Confident | 62.7 | Low | 38 Ų | 38 | 81.3 Ų | 81.3 | 17% | 0.167 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -53.9 | -46.6 | 173 | 154.2 | -97.6 | 0 | 0 | 0 | 113.2 | L119 H124 W125 L182 A185 M186 H189 | L119-F121 PolarHBondContact O-N 3.07Å; L119-F121 VanDerWaalsContact O-N 3.08Å; F121-H124 PolarHBondContact O-N 3.15Å; F121-W125 HydrophobicContact CE2-CB 4.04Å; F121-W125 HydrophobicContact CE2-CG 4.48Å; F121-W125 HydrophobicContact CZ-CB 4.22Å; F121-W125 HydrophobicContact CZ-CG 4.4Å; F121-W125 WeakPolarHBondContact O-CB 3.29Å; F121-W125 PolarHBondContact O-N 2.77Å; F121-L182 HydrophobicContact CZ-CD1 3.84Å; F121-A185 HydrophobicContact CD2-CB 4.29Å; F121-A185 HydrophobicContact CE2-CB 3.73Å; F121-M186 HydrophobicContact CD1-CE 4.25Å; F121-M186 HydrophobicContact CD1-SD 4.08Å; F121-M186 HydrophobicContact CD2-CG 4.47Å; F121-M186 HydrophobicContact CD2-SD 4.07Å; F121-M186 HydrophobicContact CE1-CE 3.46Å; F121-M186 VanDerWaalsContact CE1-CE 3.46Å; F121-M186 HydrophobicContact CE1-SD 3.72Å; F121-M186 HydrophobicContact CE2-CB 4.41Å; F121-M186 HydrophobicContact CE2-CE 4.27Å; F121-M186 HydrophobicContact CE2-CG 3.73Å; F121-M186 HydrophobicContact CE2-SD 3.69Å; F121-M186 HydrophobicContact CG-SD 4.26Å; F121-M186 HydrophobicContact CZ-CE 3.48Å; F121-M186 VanDerWaalsContact CZ-CE 3.48Å; F121-M186 HydrophobicContact CZ-CG 3.81Å; F121-M186 HydrophobicContact CZ-SD 3.52Å; F121-M186 VanDerWaalsContact CZ-SD 3.52Å; F121-H189 HydrophobicContact CB-CB 4.45Å |
| 122 | F | 75.1 | Confident | 64.7 | Low | 109 Ų | 109 | 76.3 Ų | 76.3 | 48% | 0.478 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -68.6 | -50.3 | -169.4 | -176.6 | -101.7 | 0 | 0 | 0 | 114 | L119 H120 H124 W125 L126 | L119-F122 PolarHBondContact O-N 2.92Å; H120-F122 PolarHBondContact O-N 3.45Å; F122-H124 VanDerWaalsContact C-N 3.31Å; F122-H124 PolarHBondContact O-N 3.13Å; F122-W125 HydrophobicContact CD2-CE3 4.4Å; F122-W125 HydrophobicContact CE2-CE3 4.25Å; F122-W125 HydrophobicContact CE2-CZ3 4.16Å; F122-W125 PolarHBondContact O-N 2.74Å; F122-L126 HydrophobicContact CE1-CD2 4Å; F122-L126 HydrophobicContact CZ-CD2 4.39Å; F122-L126 WeakPolarHBondContact O-CB 3.11Å; F122-L126 PolarHBondContact O-N 2.96Å |
| 123 | P | 75.1 | Confident | 67 | Low | 39 Ų | 39 | 68.9 Ų | 68.9 | 25% | 0.253 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.7 | -30.7 | 175.2 | 28.8 | -33 | 0 | 0 | 0 | 111.9 | P115 L119 H120 L126 L127 | P115-P123 HydrophobicContact CG-CG 4.35Å; L119-P123 WeakPolarHBondContact O-CD 3.26Å; H120-P123 WeakPolarHBondContact O-CD 3.49Å; P123-L126 PolarHBondContact O-N 2.84Å; P123-L127 VanDerWaalsContact O-CB 3.27Å; P123-L127 WeakPolarHBondContact O-CB 3.37Å; P123-L127 VanDerWaalsContact O-CG 3.25Å; P123-L127 WeakPolarHBondContact O-CG 3.2Å; P123-L127 PolarHBondContact O-N 3.35Å |
| 124 | H | 72.3 | Confident | 69.2 | Low | 53 Ų | 53 | 61.6 Ų | 61.6 | 25% | 0.245 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.4 | -52.9 | 172.7 | 175.9 | 87.1 | 0 | 0 | 0 | 111 | H120 F121 F122 L126 L127 Y128 H189 | H120-H124 WeakPolarHBondContact O-CB 3.39Å; H120-H124 PolarHBondContact O-N 3.27Å; F121-H124 PolarHBondContact O-N 3.15Å; F122-H124 VanDerWaalsContact C-N 3.31Å; F122-H124 PolarHBondContact O-N 3.13Å; H124-L126 VanDerWaalsContact C-N 3.32Å; H124-L126 PolarHBondContact O-N 3.41Å; H124-L127 PolarHBondContact O-N 2.99Å; H124-Y128 AromaticContact ND1-CD2 3.68Å; H124-Y128 WeakPolarHBondContact O-CB 3.43Å; H124-Y128 WeakPolarHBondContact O-CD2 3.49Å; H124-Y128 PolarHBondContact O-N 3.25Å; H124-H189 AromaticContact CD2-CE1 3.84Å |
| 125 | W | 80.9 | Confident | 71.4 | Confident | 23 Ų | 23 | 52.3 Ų | 52.3 | 9% | 0.087 | 28% | 0.276 | C | S | . | . | I | π-helix | trans | -58.5 | -42.5 | 174.9 | 172.8 | 83.9 | 0 | 0 | 0 | 112.2 | F121 F122 C129 F130 L178 L182 A185 | F121-W125 HydrophobicContact CE2-CB 4.04Å; F121-W125 HydrophobicContact CE2-CG 4.48Å; F121-W125 HydrophobicContact CZ-CB 4.22Å; F121-W125 HydrophobicContact CZ-CG 4.4Å; F121-W125 WeakPolarHBondContact O-CB 3.29Å; F121-W125 PolarHBondContact O-N 2.77Å; F122-W125 HydrophobicContact CD2-CE3 4.4Å; F122-W125 HydrophobicContact CE2-CE3 4.25Å; F122-W125 HydrophobicContact CE2-CZ3 4.16Å; F122-W125 PolarHBondContact O-N 2.74Å; W125-C129 HydrophobicContact CG-CB 4.31Å; W125-C129 WeakPolarHBondContact O-CA 3.44Å; W125-C129 WeakPolarHBondContact O-CB 3.39Å; W125-C129 PolarHBondContact O-N 2.86Å; W125-F130 HydrophobicContact CD2-CB 4.43Å; W125-F130 HydrophobicContact CE3-CB 4.37Å; W125-F130 HydrophobicContact CH2-CB 4.18Å; W125-F130 AromaticContact CH2-CD2 3.48Å; W125-F130 HydrophobicContact CH2-CD2 3.48Å; W125-F130 VanDerWaalsContact CH2-CD2 3.48Å; W125-F130 HydrophobicContact CH2-CE2 4.04Å; W125-F130 AromaticContact CH2-CG 3.94Å; W125-F130 HydrophobicContact CH2-CG 3.94Å; W125-F130 HydrophobicContact CZ2-CB 4.24Å; W125-F130 AromaticContact CZ2-CD2 3.76Å; W125-F130 HydrophobicContact CZ2-CD2 3.76Å; W125-F130 HydrophobicContact CZ2-CG 4.32Å; W125-F130 HydrophobicContact CZ3-CB 4.24Å; W125-F130 HydrophobicContact CZ3-CD2 4.19Å; W125-F130 HydrophobicContact CZ3-CG 4.2Å; W125-F130 WeakPolarHBondContact O-CB 3.26Å; W125-F130 PolarHBondContact O-N 3.42Å; W125-L178 HydrophobicContact CH2-CD1 4.32Å; W125-L178 HydrophobicContact CZ2-CD1 3.76Å; W125-L182 HydrophobicContact CD2-CD1 3.97Å; W125-L182 HydrophobicContact CG-CD1 4.25Å; W125-L182 HydrophobicContact CZ2-CD1 3.92Å; W125-A185 HydrophobicContact CB-CB 4.06Å; W125-A185 HydrophobicContact CG-CB 4.24Å |
| 126 | L | 81.3 | Confident | 73.7 | Confident | 49 Ų | 49 | 50.1 Ų | 50.1 | 26% | 0.257 | 26% | 0.262 | S | S | . | . | I | π-helix | trans | -68.7 | -34.9 | -177.1 | -173.4 | 69.2 | 0 | 0 | 0 | 113.1 | L95 F122 P123 H124 F130 | L95-L126 HydrophobicContact CD2-CD1 4.35Å; L95-L126 HydrophobicContact CD2-CD2 4.43Å; L95-L126 HydrophobicContact CD2-CG 3.89Å; F122-L126 HydrophobicContact CE1-CD2 4Å; F122-L126 HydrophobicContact CZ-CD2 4.39Å; F122-L126 WeakPolarHBondContact O-CB 3.11Å; F122-L126 PolarHBondContact O-N 2.96Å; P123-L126 PolarHBondContact O-N 2.84Å; H124-L126 VanDerWaalsContact C-N 3.32Å; H124-L126 PolarHBondContact O-N 3.41Å; L126-F130 HydrophobicContact CD1-CB 4.49Å; L126-F130 HydrophobicContact CD1-CD1 3.61Å; L126-F130 HydrophobicContact CD1-CE1 4.1Å; L126-F130 HydrophobicContact CD1-CG 4.24Å |
| 127 | L | 77.1 | Confident | 76.2 | Confident | 38 Ų | 38 | 46.9 Ų | 46.9 | 20% | 0.199 | 24% | 0.242 | C | C | . | . | I | π-helix | trans | -89.3 | -34.2 | -178.7 | -67.2 | 170.9 | 0 | 0 | 0 | 113.3 | L95 T98 P123 H124 P131 | L95-L127 HydrophobicContact CD2-CD2 4.3Å; T98-L127 VanDerWaalsContact OG1-CD2 3.31Å; T98-L127 WeakPolarHBondContact OG1-CD2 3.39Å; P123-L127 VanDerWaalsContact O-CB 3.27Å; P123-L127 WeakPolarHBondContact O-CB 3.37Å; P123-L127 VanDerWaalsContact O-CG 3.25Å; P123-L127 WeakPolarHBondContact O-CG 3.2Å; P123-L127 PolarHBondContact O-N 3.35Å; H124-L127 PolarHBondContact O-N 2.99Å; L127-P131 WeakPolarHBondContact O-CG 3.25Å |
| 128 | Y | 71.4 | Confident | 78.1 | Confident | 65 Ų | 65 | 42.9 Ų | 42.9 | 26% | 0.255 | 21% | 0.208 | S | C | . | . | I | π-helix | trans | -103.1 | -48.8 | -174.5 | -66.5 | -83.2 | 0 | 0 | 0 | 113.4 | L99 H124 W283 | L99-Y128 HydrophobicContact CD1-CD1 3.97Å; L99-Y128 HydrophobicContact CD1-CE1 3.76Å; L99-Y128 HydrophobicContact CG-CE1 4.36Å; H124-Y128 AromaticContact ND1-CD2 3.68Å; H124-Y128 WeakPolarHBondContact O-CB 3.43Å; H124-Y128 WeakPolarHBondContact O-CD2 3.49Å; H124-Y128 PolarHBondContact O-N 3.25Å; Y128-W283 AromaticContact CE1-CD1 3.64Å; Y128-W283 HydrophobicContact CE1-CG 4.28Å; Y128-W283 PolarHBondContact OH-NE1 2.85Å |
| 129 | C | 75.9 | Confident | 80.3 | Confident | 13 Ų | 13 | 34.2 Ų | 34.2 | 9% | 0.088 | 17% | 0.168 | C | C | . | . | I | π-helix | trans | -84.2 | -48 | -175.7 | -57.2 | 0 | 0 | 0 | 0 | 112.8 | W125 P131 S132 C133 N181 | W125-C129 HydrophobicContact CG-CB 4.31Å; W125-C129 WeakPolarHBondContact O-CA 3.44Å; W125-C129 WeakPolarHBondContact O-CB 3.39Å; W125-C129 PolarHBondContact O-N 2.86Å; C129-P131 VanDerWaalsContact C-CD 3.47Å; C129-S132 WeakPolarHBondContact O-CB 3.25Å; C129-S132 PolarHBondContact O-N 2.89Å; C129-C133 PolarHBondContact O-N 2.95Å; C129-N181 HydrophobicContact CB-CB 4.49Å |
| 130 | F | 82.9 | Confident | 82.3 | Confident | 37 Ų | 37 | 29.3 Ų | 29.3 | 16% | 0.162 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62 | -32 | -172.1 | -175.6 | -117.8 | 0 | 0 | 0 | 115.1 | L91 L95 W125 L126 S132 C133 L134 L178 | L91-F130 HydrophobicContact CD2-CE1 4.02Å; L91-F130 HydrophobicContact CD2-CZ 4.35Å; L91-F130 HydrophobicContact CG-CE1 4.47Å; L95-F130 HydrophobicContact CD1-CD1 3.55Å; L95-F130 HydrophobicContact CD1-CE1 3.99Å; W125-F130 HydrophobicContact CD2-CB 4.43Å; W125-F130 HydrophobicContact CE3-CB 4.37Å; W125-F130 HydrophobicContact CH2-CB 4.18Å; W125-F130 AromaticContact CH2-CD2 3.48Å; W125-F130 HydrophobicContact CH2-CD2 3.48Å; W125-F130 VanDerWaalsContact CH2-CD2 3.48Å; W125-F130 HydrophobicContact CH2-CE2 4.04Å; W125-F130 AromaticContact CH2-CG 3.94Å; W125-F130 HydrophobicContact CH2-CG 3.94Å; W125-F130 HydrophobicContact CZ2-CB 4.24Å; W125-F130 AromaticContact CZ2-CD2 3.76Å; W125-F130 HydrophobicContact CZ2-CD2 3.76Å; W125-F130 HydrophobicContact CZ2-CG 4.32Å; W125-F130 HydrophobicContact CZ3-CB 4.24Å; W125-F130 HydrophobicContact CZ3-CD2 4.19Å; W125-F130 HydrophobicContact CZ3-CG 4.2Å; W125-F130 WeakPolarHBondContact O-CB 3.26Å; W125-F130 PolarHBondContact O-N 3.42Å; L126-F130 HydrophobicContact CD1-CB 4.49Å; L126-F130 HydrophobicContact CD1-CD1 3.61Å; L126-F130 HydrophobicContact CD1-CE1 4.1Å; L126-F130 HydrophobicContact CD1-CG 4.24Å; F130-S132 PolarHBondContact O-N 3.47Å; F130-C133 HydrophobicContact CD2-CB 4.12Å; F130-C133 WeakPolarHBondContact O-CA 3.29Å; F130-C133 WeakPolarHBondContact O-CB 3.17Å; F130-C133 PolarHBondContact O-N 2.98Å; F130-L134 HydrophobicContact CD1-CD1 4.04Å; F130-L134 HydrophobicContact CD1-CG 4.24Å; F130-L134 HydrophobicContact CE1-CD1 3.82Å; F130-L134 HydrophobicContact CE1-CD2 3.91Å; F130-L134 HydrophobicContact CE1-CG 3.95Å; F130-L134 HydrophobicContact CE2-CD2 4.22Å; F130-L134 HydrophobicContact CE2-CG 4.44Å; F130-L134 HydrophobicContact CZ-CD1 4.4Å; F130-L134 HydrophobicContact CZ-CD2 3.65Å; F130-L134 HydrophobicContact CZ-CG 4.06Å; F130-L134 WeakPolarHBondContact O-CG 3.3Å; F130-L134 PolarHBondContact O-N 3.32Å; F130-L178 HydrophobicContact CD2-CD1 3.96Å; F130-L178 HydrophobicContact CE2-CD1 4.05Å |
| 131 | P | 85.6 | Confident | 83.7 | Confident | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -57.2 | -36.6 | 171.2 | -27.3 | 37.2 | 0 | 0 | 0 | 113 | L95 L127 C129 C133 L134 Q135 | L95-P131 HydrophobicContact CB-CG 4.1Å; L95-P131 HydrophobicContact CD1-CG 4.31Å; L127-P131 WeakPolarHBondContact O-CG 3.25Å; C129-P131 VanDerWaalsContact C-CD 3.47Å; P131-C133 VanDerWaalsContact C-N 3.33Å; P131-C133 PolarHBondContact O-N 3.46Å; P131-L134 PolarHBondContact O-N 3.47Å; P131-Q135 WeakPolarHBondContact O-CB 3.39Å; P131-Q135 PolarHBondContact O-N 3.22Å |
| 132 | S | 84.3 | Confident | 84.7 | Confident | 1 Ų | 1 | 24.8 Ų | 24.8 | 1% | 0.007 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -66.7 | -35.8 | 175.2 | -60.9 | 0 | 0 | 0 | 0 | 111.8 | C129 F130 Q135 F136 F279 | C129-S132 WeakPolarHBondContact O-CB 3.25Å; C129-S132 PolarHBondContact O-N 2.89Å; F130-S132 PolarHBondContact O-N 3.47Å; S132-Q135 PolarHBondContact O-N 3.49Å; S132-F136 PolarHBondContact O-N 3.45Å; S132-F279 WeakPolarHBondContact OG-CD1 3.39Å |
| 133 | C | 88.6 | Confident | 85.6 | Confident | 2 Ų | 2 | 19.6 Ų | 19.6 | 1% | 0.014 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -65.6 | -39.3 | 174 | -54.8 | 0 | 0 | 0 | 0 | 112.2 | C129 F130 P131 S137 F177 L178 | C129-C133 PolarHBondContact O-N 2.95Å; F130-C133 HydrophobicContact CD2-CB 4.12Å; F130-C133 WeakPolarHBondContact O-CA 3.29Å; F130-C133 WeakPolarHBondContact O-CB 3.17Å; F130-C133 PolarHBondContact O-N 2.98Å; P131-C133 VanDerWaalsContact C-N 3.33Å; P131-C133 PolarHBondContact O-N 3.46Å; C133-S137 VanDerWaalsContact O-CB 3.25Å; C133-S137 WeakPolarHBondContact O-CB 3.45Å; C133-S137 PolarHBondContact O-N 2.84Å; C133-S137 PolarHBondContact O-OG 3.47Å; C133-F177 HydrophobicContact CB-CD1 4.16Å; C133-F177 HydrophobicContact CB-CE1 4.31Å; C133-L178 HydrophobicContact CB-CD1 3.9Å |
| 134 | L | 90.4 | Very high | 86.3 | Confident | 6 Ų | 6 | 18.1 Ų | 18.1 | 3% | 0.031 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -65.5 | -41.2 | 173.7 | -63.8 | 173.2 | 0 | 0 | 0 | 111.4 | L88 L91 W92 L95 F130 P131 S137 T138 | L88-L134 HydrophobicContact CD2-CD2 3.7Å; L91-L134 HydrophobicContact CB-CD1 4.17Å; L91-L134 HydrophobicContact CD2-CD1 4.2Å; L91-L134 HydrophobicContact CD2-CD2 3.98Å; L91-L134 HydrophobicContact CG-CD1 3.83Å; L91-L134 HydrophobicContact CG-CD2 4.48Å; W92-L134 HydrophobicContact CB-CB 4.23Å; W92-L134 HydrophobicContact CB-CD1 4.02Å; L95-L134 HydrophobicContact CD1-CD1 3.65Å; F130-L134 HydrophobicContact CD1-CD1 4.04Å; F130-L134 HydrophobicContact CD1-CG 4.24Å; F130-L134 HydrophobicContact CE1-CD1 3.82Å; F130-L134 HydrophobicContact CE1-CD2 3.91Å; F130-L134 HydrophobicContact CE1-CG 3.95Å; F130-L134 HydrophobicContact CE2-CD2 4.22Å; F130-L134 HydrophobicContact CE2-CG 4.44Å; F130-L134 HydrophobicContact CZ-CD1 4.4Å; F130-L134 HydrophobicContact CZ-CD2 3.65Å; F130-L134 HydrophobicContact CZ-CG 4.06Å; F130-L134 WeakPolarHBondContact O-CG 3.3Å; F130-L134 PolarHBondContact O-N 3.32Å; P131-L134 PolarHBondContact O-N 3.47Å; L134-S137 PolarHBondContact O-N 2.94Å; L134-T138 WeakPolarHBondContact O-CB 3.49Å; L134-T138 PolarHBondContact O-N 2.89Å; L134-T138 PolarHBondContact O-OG1 2.96Å |
| 135 | Q | 90.9 | Very high | 87.1 | Confident | 7 Ų | 7 | 15.9 Ų | 15.9 | 3% | 0.033 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -65 | -44.6 | 178.7 | -163.7 | 175.5 | 15.3 | 0 | 0 | 111.5 | P131 S132 T138 L139 Y257 W310 | P131-Q135 WeakPolarHBondContact O-CB 3.39Å; P131-Q135 PolarHBondContact O-N 3.22Å; S132-Q135 PolarHBondContact O-N 3.49Å; Q135-T138 WeakPolarHBondContact O-CB 3.39Å; Q135-T138 PolarHBondContact O-N 3.47Å; Q135-L139 PolarHBondContact O-N 2.99Å; Q135-Y257 HydrophobicContact CG-CE1 3.66Å; Q135-Y257 WeakPolarHBondContact CG-OH 3.41Å; Q135-Y257 PolarHBondContact NE2-OH 3.37Å; Q135-Y257 VanDerWaalsContact NE2-OH 3.08Å; Q135-W310 PolarHBondContact NE2-O 2.95Å |
| 136 | F | 92.1 | Very high | 87.5 | Confident | 2 Ų | 2 | 15 Ų | 15 | 1% | 0.009 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -63.7 | -46.1 | 172.4 | -177.2 | -102.8 | 0 | 0 | 0 | 112.4 | S132 T138 L139 C140 A173 F177 L211 F212 C215 | S132-F136 PolarHBondContact O-N 3.45Å; F136-T138 PolarHBondContact O-N 3.26Å; F136-L139 WeakPolarHBondContact O-CB 3.43Å; F136-L139 PolarHBondContact O-N 3.49Å; F136-C140 WeakPolarHBondContact CE1-SG 3.4Å; F136-C140 PolarHBondContact O-N 3.02Å; F136-A173 HydrophobicContact CE1-CB 4.28Å; F136-A173 HydrophobicContact CZ-CB 4.32Å; F136-F177 HydrophobicContact CB-CD1 4.11Å; F136-F177 HydrophobicContact CB-CD2 4.04Å; F136-F177 HydrophobicContact CB-CE1 4.08Å; F136-F177 HydrophobicContact CB-CE2 3.98Å; F136-F177 HydrophobicContact CB-CG 4.11Å; F136-F177 HydrophobicContact CB-CZ 4.02Å; F136-F177 HydrophobicContact CD1-CB 3.67Å; F136-F177 HydrophobicContact CD1-CD1 4.35Å; F136-F177 AromaticContact CD1-CD2 3.78Å; F136-F177 HydrophobicContact CD1-CD2 3.78Å; F136-F177 AromaticContact CD1-CG 3.68Å; F136-F177 HydrophobicContact CD1-CG 3.68Å; F136-F177 AromaticContact CD2-CD2 3.93Å; F136-F177 HydrophobicContact CD2-CD2 3.93Å; F136-F177 HydrophobicContact CD2-CE2 4.08Å; F136-F177 HydrophobicContact CE1-CB 3.93Å; F136-F177 HydrophobicContact CE1-CD2 4.23Å; F136-F177 HydrophobicContact CE1-CG 4.29Å; F136-F177 HydrophobicContact CE2-CD2 4.39Å; F136-F177 HydrophobicContact CG-CB 4.36Å; F136-F177 HydrophobicContact CG-CD1 4.37Å; F136-F177 AromaticContact CG-CD2 3.61Å; F136-F177 HydrophobicContact CG-CD2 3.61Å; F136-F177 AromaticContact CG-CE2 3.93Å; F136-F177 HydrophobicContact CG-CE2 3.93Å; F136-F177 AromaticContact CG-CG 3.86Å; F136-F177 HydrophobicContact CG-CG 3.86Å; F136-F177 HydrophobicContact CG-CZ 4.46Å; F136-L211 HydrophobicContact CE2-CB 3.84Å; F136-L211 HydrophobicContact CZ-CB 3.83Å; F136-F212 HydrophobicContact CB-CE1 4.14Å; F136-F212 HydrophobicContact CB-CE2 4.41Å; F136-F212 HydrophobicContact CB-CZ 3.8Å; F136-F212 AromaticContact CD2-CD1 3.88Å; F136-F212 HydrophobicContact CD2-CD1 3.88Å; F136-F212 HydrophobicContact CD2-CD2 4.3Å; F136-F212 AromaticContact CD2-CE1 3.8Å; F136-F212 HydrophobicContact CD2-CE1 3.8Å; F136-F212 HydrophobicContact CD2-CE2 4.24Å; F136-F212 HydrophobicContact CD2-CG 4.12Å; F136-F212 AromaticContact CD2-CZ 3.98Å; F136-F212 HydrophobicContact CD2-CZ 3.98Å; F136-F212 HydrophobicContact CG-CE1 4.49Å; F136-F212 HydrophobicContact CG-CZ 4.39Å; F136-C215 HydrophobicContact CE2-CB 4.06Å |
| 137 | S | 92.8 | Very high | 87.8 | Confident | 27 Ų | 27 | 12.8 Ų | 12.8 | 19% | 0.189 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -60.4 | -33.7 | 177.5 | -60.2 | 0 | 0 | 0 | 0 | 112.3 | C133 L134 C140 L141 | C133-S137 VanDerWaalsContact O-CB 3.25Å; C133-S137 WeakPolarHBondContact O-CB 3.45Å; C133-S137 PolarHBondContact O-N 2.84Å; C133-S137 PolarHBondContact O-OG 3.47Å; L134-S137 PolarHBondContact O-N 2.94Å; S137-C140 PolarHBondContact O-N 3.16Å; S137-L141 WeakPolarHBondContact O-CG 3.5Å; S137-L141 PolarHBondContact O-N 3.41Å |
| 138 | T | 92.5 | Very high | 88.3 | Confident | 10 Ų | 10 | 12.6 Ų | 12.6 | 6% | 0.061 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -65 | -41.5 | 173.7 | -60.6 | 0 | 0 | 0 | 0 | 111.6 | L88 L134 Q135 F136 L141 L142 V318 | L88-T138 WeakPolarHBondContact CB-OG1 3.28Å; L134-T138 WeakPolarHBondContact O-CB 3.49Å; L134-T138 PolarHBondContact O-N 2.89Å; L134-T138 PolarHBondContact O-OG1 2.96Å; Q135-T138 WeakPolarHBondContact O-CB 3.39Å; Q135-T138 PolarHBondContact O-N 3.47Å; F136-T138 PolarHBondContact O-N 3.26Å; T138-L141 PolarHBondContact O-N 3.22Å; T138-L142 PolarHBondContact O-N 2.9Å; T138-V318 HydrophobicContact CG2-CG1 3.95Å |
| 139 | L | 92.6 | Very high | 89 | Confident | 4 Ų | 4 | 9.5 Ų | 9.5 | 2% | 0.021 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -66.3 | -37.6 | 174.8 | -171.7 | 66.2 | 0 | 0 | 0 | 112.2 | Q135 F136 L142 N143 F212 C215 L219 V253 Y257 | Q135-L139 PolarHBondContact O-N 2.99Å; F136-L139 WeakPolarHBondContact O-CB 3.43Å; F136-L139 PolarHBondContact O-N 3.49Å; L139-L142 PolarHBondContact O-N 3.43Å; L139-N143 PolarHBondContact O-N 3.3Å; L139-N143 PolarHBondContact O-ND2 2.87Å; L139-F212 HydrophobicContact CD2-CD1 3.8Å; L139-F212 HydrophobicContact CD2-CE1 4.2Å; L139-C215 HydrophobicContact CD2-CB 3.95Å; L139-C215 HydrophobicContact CG-CB 4.41Å; L139-L219 HydrophobicContact CD1-CD2 3.75Å; L139-V253 HydrophobicContact CD1-CG1 3.4Å; L139-V253 VanDerWaalsContact CD1-CG1 3.4Å; L139-Y257 HydrophobicContact CD1-CD2 3.87Å; L139-Y257 HydrophobicContact CD1-CE2 4.15Å; L139-Y257 HydrophobicContact CD2-CD2 4.08Å; L139-Y257 HydrophobicContact CD2-CG 4.17Å |
| 140 | C | 93.4 | Very high | 89.4 | Confident | 3 Ų | 3 | 9.6 Ų | 9.6 | 2% | 0.02 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -63.9 | -43.6 | 171.7 | -71 | 0 | 0 | 0 | 0 | 112.3 | F136 S137 L142 N143 L144 F170 S174 | F136-C140 WeakPolarHBondContact CE1-SG 3.4Å; F136-C140 PolarHBondContact O-N 3.02Å; S137-C140 PolarHBondContact O-N 3.16Å; C140-L142 VanDerWaalsContact C-N 3.33Å; C140-L142 PolarHBondContact O-N 2.85Å; C140-N143 WeakPolarHBondContact O-CB 3.48Å; C140-N143 PolarHBondContact O-N 3.44Å; C140-L144 WeakPolarHBondContact O-CG 3.26Å; C140-L144 PolarHBondContact O-N 3.27Å; C140-F170 HydrophobicContact CB-CB 4.29Å; C140-F170 HydrophobicContact CB-CD1 4.1Å; C140-S174 PolarHBondContact SG-OG 2.9Å; C140-S174 VanDerWaalsContact SG-OG 3.37Å |
| 141 | L | 92.4 | Very high | 89.3 | Confident | 25 Ų | 25 | 9 Ų | 9 | 13% | 0.131 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -63.5 | -37 | 174.7 | -73.7 | -178.1 | 0 | 0 | 0 | 112.5 | Y81 L84 C85 L88 S137 T138 L144 Y145 | Y81-L141 HydrophobicContact CD1-CD2 4.21Å; L84-L141 HydrophobicContact CB-CD1 3.69Å; C85-L141 HydrophobicContact CB-CD1 4.31Å; L88-L141 HydrophobicContact CD1-CD1 3.6Å; L88-L141 HydrophobicContact CD1-CG 4.41Å; L88-L141 HydrophobicContact CG-CD1 4.34Å; S137-L141 WeakPolarHBondContact O-CG 3.5Å; S137-L141 PolarHBondContact O-N 3.41Å; T138-L141 PolarHBondContact O-N 3.22Å; L141-L144 PolarHBondContact O-N 2.98Å; L141-Y145 WeakPolarHBondContact O-CB 3.5Å; L141-Y145 PolarHBondContact O-N 3.33Å |
| 142 | L | 91.4 | Very high | 89.1 | Confident | 7 Ų | 7 | 13.6 Ų | 13.6 | 4% | 0.037 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -65.5 | -41.8 | 175.3 | -175.4 | 64.1 | 0 | 0 | 0 | 111.6 | T138 L139 C140 Y145 L146 L219 V253 F321 F322 | T138-L142 PolarHBondContact O-N 2.9Å; L139-L142 PolarHBondContact O-N 3.43Å; C140-L142 VanDerWaalsContact C-N 3.33Å; C140-L142 PolarHBondContact O-N 2.85Å; L142-Y145 PolarHBondContact O-N 2.93Å; L142-L146 PolarHBondContact O-N 2.71Å; L142-L146 VanDerWaalsContact O-N 3.12Å; L142-L219 HydrophobicContact CD2-CD1 4.35Å; L142-L219 HydrophobicContact CD2-CD2 3.98Å; L142-L219 HydrophobicContact CG-CD1 4.18Å; L142-V253 HydrophobicContact CD2-CG1 4.06Å; L142-V253 HydrophobicContact CD2-CG2 4.5Å; L142-F321 HydrophobicContact CD1-CD1 4.2Å; L142-F321 HydrophobicContact CD1-CE1 3.94Å; L142-F322 HydrophobicContact CD1-CE2 4.12Å; L142-F322 HydrophobicContact CD1-CZ 4.1Å |
| 143 | N | 93 | Very high | 88.9 | Confident | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -59.4 | -48.8 | 171.7 | -89.8 | -89.6 | 0 | 0 | 0 | 111.9 | L139 C140 Y145 L146 A147 F170 C215 S218 L219 Y222 | L139-N143 PolarHBondContact O-N 3.3Å; L139-N143 PolarHBondContact O-ND2 2.87Å; C140-N143 WeakPolarHBondContact O-CB 3.48Å; C140-N143 PolarHBondContact O-N 3.44Å; N143-Y145 VanDerWaalsContact C-N 3.29Å; N143-Y145 PolarHBondContact O-N 3.4Å; N143-L146 PolarHBondContact O-N 2.99Å; N143-A147 WeakPolarHBondContact O-CB 3.43Å; N143-A147 PolarHBondContact O-N 3.26Å; N143-F170 HydrophobicContact CB-CD1 4.2Å; N143-F170 HydrophobicContact CB-CE1 3.6Å; N143-F170 HydrophobicContact CB-CE2 4.11Å; N143-F170 HydrophobicContact CB-CZ 3.56Å; N143-C215 PolarHBondContact ND2-O 3.38Å; N143-C215 PolarHBondContact ND2-SG 3.12Å; N143-C215 PolarHBondContact OD1-O 3.46Å; N143-S218 WeakPolarHBondContact OD1-CB 3.42Å; N143-S218 PolarHBondContact OD1-OG 2.86Å; N143-L219 WeakPolarHBondContact OD1-CA 3.48Å; N143-L219 PolarHBondContact OD1-N 2.91Å; N143-Y222 HydrophobicContact CB-CD2 4.4Å; N143-Y222 HydrophobicContact CB-CE2 4.17Å; N143-Y222 WeakPolarHBondContact OD1-CD2 3.46Å; N143-Y222 WeakPolarHBondContact OD1-CE2 3.14Å |
| 144 | L | 91.3 | Very high | 88.3 | Confident | 8 Ų | 8 | 22.8 Ų | 22.8 | 4% | 0.042 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -62 | -35.8 | 177.2 | -72.6 | 176.4 | 0 | 0 | 0 | 112.7 | Y81 C140 L141 A147 E148 H167 F170 | Y81-L144 HydrophobicContact CD1-CB 4.23Å; Y81-L144 HydrophobicContact CE1-CB 4.1Å; C140-L144 WeakPolarHBondContact O-CG 3.26Å; C140-L144 PolarHBondContact O-N 3.27Å; L141-L144 PolarHBondContact O-N 2.98Å; L144-A147 PolarHBondContact O-N 3.32Å; L144-E148 WeakPolarHBondContact O-CB 3.17Å; L144-E148 PolarHBondContact O-N 3.39Å; L144-H167 HydrophobicContact CD2-CB 4.39Å; L144-F170 HydrophobicContact CD1-CB 3.92Å; L144-F170 HydrophobicContact CD2-CB 3.98Å; L144-F170 HydrophobicContact CD2-CD2 3.52Å; L144-F170 HydrophobicContact CD2-CE2 4.4Å; L144-F170 HydrophobicContact CD2-CG 4.08Å; L144-F170 HydrophobicContact CG-CB 3.88Å; L144-F170 HydrophobicContact CG-CD2 3.96Å; L144-F170 HydrophobicContact CG-CG 4.09Å |
| 145 | Y | 89.1 | Confident | 86.8 | Confident | 7 Ų | 7 | 28 Ų | 28 | 3% | 0.027 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.5 | -47.7 | 176 | -176.9 | -115 | 0 | 0 | 0 | 112.3 | Y81 L141 L142 N143 A147 E148 V149 M241 F321 F322 | Y81-Y145 HydrophobicContact CD2-CD2 4.45Å; Y81-Y145 HydrophobicContact CG-CD2 4.43Å; L141-Y145 WeakPolarHBondContact O-CB 3.5Å; L141-Y145 PolarHBondContact O-N 3.33Å; L142-Y145 PolarHBondContact O-N 2.93Å; N143-Y145 VanDerWaalsContact C-N 3.29Å; N143-Y145 PolarHBondContact O-N 3.4Å; Y145-A147 VanDerWaalsContact C-N 3.34Å; Y145-E148 PolarHBondContact O-N 2.99Å; Y145-V149 WeakPolarHBondContact O-CG2 3.27Å; Y145-V149 PolarHBondContact O-N 2.98Å; Y145-V149 VanDerWaalsContact O-N 3.08Å; Y145-M241 HydrophobicContact CE1-CE 4.36Å; Y145-M241 HydrophobicContact CE1-SD 3.86Å; Y145-M241 WeakPolarHBondContact OH-CE 3.35Å; Y145-M241 PolarHBondContact OH-SD 2.84Å; Y145-F321 HydrophobicContact CD1-CE1 4.04Å; Y145-F321 HydrophobicContact CD1-CZ 4.45Å; Y145-F321 AromaticContact CE1-CE1 3.83Å; Y145-F321 HydrophobicContact CE1-CE1 3.83Å; Y145-F321 HydrophobicContact CE1-CZ 4.02Å; Y145-F322 AromaticContact CD1-CE1 3.86Å; Y145-F322 HydrophobicContact CD1-CE1 3.86Å; Y145-F322 AromaticContact CD1-CZ 3.92Å; Y145-F322 HydrophobicContact CD1-CZ 3.92Å; Y145-F322 HydrophobicContact CD2-CE1 4.35Å; Y145-F322 AromaticContact CE1-CE1 3.84Å; Y145-F322 HydrophobicContact CE1-CE1 3.84Å; Y145-F322 HydrophobicContact CE1-CZ 4.33Å; Y145-F322 HydrophobicContact CE2-CE1 4.33Å; Y145-F322 HydrophobicContact CG-CE1 4.12Å; Y145-F322 HydrophobicContact CG-CZ 4.12Å |
| 146 | L | 88.8 | Confident | 85.2 | Confident | 4 Ų | 4 | 30 Ų | 30 | 2% | 0.021 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -67.3 | -36 | 175.9 | -61.2 | -165 | 0 | 0 | 0 | 111.8 | L142 N143 V149 I150 L219 Y222 I223 I226 T246 | L142-L146 PolarHBondContact O-N 2.71Å; L142-L146 VanDerWaalsContact O-N 3.12Å; N143-L146 PolarHBondContact O-N 2.99Å; L146-V149 PolarHBondContact O-N 3.45Å; L146-I150 VanDerWaalsContact O-CG1 3.3Å; L146-I150 WeakPolarHBondContact O-CG1 3.39Å; L146-I150 PolarHBondContact O-N 2.97Å; L146-I150 VanDerWaalsContact O-N 3.09Å; L146-L219 HydrophobicContact CD1-CD1 3.71Å; L146-L219 HydrophobicContact CG-CD1 4.45Å; L146-Y222 HydrophobicContact CB-CG 4.46Å; L146-I223 HydrophobicContact CD1-CG1 3.66Å; L146-I226 HydrophobicContact CB-CD1 3.75Å; L146-I226 HydrophobicContact CD1-CD1 4.23Å; L146-I226 HydrophobicContact CD2-CD1 3.82Å; L146-I226 HydrophobicContact CG-CD1 4.13Å; L146-T246 HydrophobicContact CD2-CG2 3.94Å |
| 147 | A | 88.1 | Confident | 83.5 | Confident | 3 Ų | 3 | 36.2 Ų | 36.2 | 3% | 0.025 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.7 | -41.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | N143 L144 Y145 V149 I150 C151 Y222 | N143-A147 WeakPolarHBondContact O-CB 3.43Å; N143-A147 PolarHBondContact O-N 3.26Å; L144-A147 PolarHBondContact O-N 3.32Å; Y145-A147 VanDerWaalsContact C-N 3.34Å; A147-V149 PolarHBondContact O-N 3.03Å; A147-I150 PolarHBondContact O-N 2.76Å; A147-C151 WeakPolarHBondContact O-CB 3.39Å; A147-C151 PolarHBondContact O-N 2.96Å; A147-C151 PolarHBondContact O-SG 3.37Å; A147-Y222 HydrophobicContact CB-CD1 4.47Å; A147-Y222 HydrophobicContact CB-CE1 3.99Å; A147-Y222 HydrophobicContact CB-CE2 4.42Å |
| 148 | E | 86.8 | Confident | 81.8 | Confident | 33 Ų | 33 | 42.7 Ų | 42.7 | 15% | 0.154 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.3 | -42.4 | 176.5 | -160.3 | -147.9 | -152 | 0 | 0 | 111.8 | Y81 L144 Y145 C151 K152 | Y81-E148 HydrophobicContact CE2-CB 4.42Å; Y81-E148 HydrophobicContact CE2-CG 4.17Å; L144-E148 WeakPolarHBondContact O-CB 3.17Å; L144-E148 PolarHBondContact O-N 3.39Å; Y145-E148 PolarHBondContact O-N 2.99Å; E148-C151 PolarHBondContact O-N 2.87Å; E148-K152 HydrophobicContact CG-CD 4.33Å; E148-K152 WeakPolarHBondContact O-CB 3.31Å; E148-K152 WeakPolarHBondContact O-CG 3.47Å; E148-K152 PolarHBondContact O-N 3.4Å; E148-K152 VanDerWaalsContact OE1-CE 3.24Å; E148-K152 WeakPolarHBondContact OE1-CE 3.25Å; E148-K152 IonicContact OE1-NZ 3.71Å; E148-K152 PolarHBondContact OE1-NZ 3.3Å; E148-K152 WeakPolarHBondContact OE2-CE 3.26Å; E148-K152 IonicContact OE2-NZ 2.64Å; E148-K152 PolarHBondContact OE2-NZ 3.31Å |
| 149 | V | 85.5 | Confident | 80.3 | Confident | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57 | -52.5 | 174.1 | 166.2 | 0 | 0 | 0 | 0 | 110.8 | Y145 L146 A147 C151 K152 V153 I226 A232 Y235 L236 | Y145-V149 WeakPolarHBondContact O-CG2 3.27Å; Y145-V149 PolarHBondContact O-N 2.98Å; Y145-V149 VanDerWaalsContact O-N 3.08Å; L146-V149 PolarHBondContact O-N 3.45Å; A147-V149 PolarHBondContact O-N 3.03Å; V149-C151 VanDerWaalsContact C-N 3.35Å; V149-C151 PolarHBondContact O-N 2.76Å; V149-K152 PolarHBondContact O-N 3.47Å; V149-V153 WeakPolarHBondContact O-CB 3.32Å; V149-V153 WeakPolarHBondContact O-CG2 3.42Å; V149-V153 PolarHBondContact O-N 3.37Å; V149-V153 VanDerWaalsContact O-N 3.08Å; V149-I226 HydrophobicContact CB-CD1 4.47Å; V149-I226 HydrophobicContact CG1-CD1 4.14Å; V149-I226 HydrophobicContact CG1-CG1 4.43Å; V149-A232 HydrophobicContact CG1-CB 4.43Å; V149-Y235 HydrophobicContact CB-CD1 4.4Å; V149-Y235 HydrophobicContact CG1-CD1 4.03Å; V149-Y235 HydrophobicContact CG2-CD1 4.09Å; V149-Y235 HydrophobicContact CG2-CE1 4.05Å; V149-L236 HydrophobicContact CG1-CD2 4.11Å; V149-L236 HydrophobicContact CG1-CG 4.22Å; V149-L236 HydrophobicContact CG2-CD2 3.92Å |
| 150 | I | 84.4 | Confident | 79.1 | Confident | 16 Ų | 16 | 47.8 Ų | 47.8 | 8% | 0.082 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.9 | -44 | 179.1 | -62.8 | 163.1 | 0 | 0 | 0 | 110.9 | L146 A147 V153 R154 Y222 K225 I226 M229 | L146-I150 VanDerWaalsContact O-CG1 3.3Å; L146-I150 WeakPolarHBondContact O-CG1 3.39Å; L146-I150 PolarHBondContact O-N 2.97Å; L146-I150 VanDerWaalsContact O-N 3.09Å; A147-I150 PolarHBondContact O-N 2.76Å; I150-V153 PolarHBondContact O-N 3.42Å; I150-R154 WeakPolarHBondContact O-CB 3.27Å; I150-R154 PolarHBondContact O-N 3.5Å; I150-Y222 HydrophobicContact CD1-CD1 3.64Å; I150-Y222 HydrophobicContact CD1-CG 4.27Å; I150-K225 HydrophobicContact CD1-CB 4.01Å; I150-I226 HydrophobicContact CD1-CD1 4.3Å; I150-I226 HydrophobicContact CD1-CG1 3.93Å; I150-I226 HydrophobicContact CG1-CD1 4.08Å; I150-I226 HydrophobicContact CG1-CG1 3.55Å; I150-M229 HydrophobicContact CG2-CE 4.44Å; I150-M229 HydrophobicContact CG2-SD 4.25Å |
| 151 | C | 80.8 | Confident | 78 | Confident | 24 Ų | 24 | 57.1 Ų | 57.1 | 16% | 0.162 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.8 | -43.6 | -179 | -73.3 | 0 | 0 | 0 | 0 | 112.6 | A147 E148 V149 R154 C155 L159 | A147-C151 WeakPolarHBondContact O-CB 3.39Å; A147-C151 PolarHBondContact O-N 2.96Å; A147-C151 PolarHBondContact O-SG 3.37Å; E148-C151 PolarHBondContact O-N 2.87Å; V149-C151 VanDerWaalsContact C-N 3.35Å; V149-C151 PolarHBondContact O-N 2.76Å; C151-R154 PolarHBondContact O-N 2.96Å; C151-C155 PolarHBondContact O-N 3.38Å; C151-L159 HydrophobicContact CB-CD2 4.08Å |
| 152 | K | 82.3 | Confident | 77.1 | Confident | 97 Ų | 97 | 60 Ų | 60 | 42% | 0.422 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 176.2 | -76.3 | 175.3 | 177.5 | 167 | 0 | 112 | E148 V149 R154 Y235 | E148-K152 HydrophobicContact CG-CD 4.33Å; E148-K152 WeakPolarHBondContact O-CB 3.31Å; E148-K152 WeakPolarHBondContact O-CG 3.47Å; E148-K152 PolarHBondContact O-N 3.4Å; E148-K152 VanDerWaalsContact OE1-CE 3.24Å; E148-K152 WeakPolarHBondContact OE1-CE 3.25Å; E148-K152 IonicContact OE1-NZ 3.71Å; E148-K152 PolarHBondContact OE1-NZ 3.3Å; E148-K152 WeakPolarHBondContact OE2-CE 3.26Å; E148-K152 IonicContact OE2-NZ 2.64Å; E148-K152 PolarHBondContact OE2-NZ 3.31Å; V149-K152 PolarHBondContact O-N 3.47Å; K152-R154 VanDerWaalsContact C-N 3.34Å; K152-R154 PolarHBondContact O-N 3.42Å; K152-Y235 HydrophobicContact CD-CE1 4.26Å; K152-Y235 VanDerWaalsContact CD-OH 3.32Å; K152-Y235 WeakPolarHBondContact CD-OH 3.33Å |
| 153 | V | 80.1 | Confident | 76.6 | Confident | 32 Ų | 32 | 63.1 Ų | 63.1 | 19% | 0.194 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -67.2 | -33 | -179.8 | 169.4 | 0 | 0 | 0 | 0 | 112.4 | V149 I150 S231 A232 Y235 | V149-V153 WeakPolarHBondContact O-CB 3.32Å; V149-V153 WeakPolarHBondContact O-CG2 3.42Å; V149-V153 PolarHBondContact O-N 3.37Å; V149-V153 VanDerWaalsContact O-N 3.08Å; I150-V153 PolarHBondContact O-N 3.42Å; V153-S231 WeakPolarHBondContact CG1-OG 3.47Å; V153-A232 HydrophobicContact CG1-CB 4.25Å; V153-A232 HydrophobicContact CG2-CB 4.11Å; V153-Y235 HydrophobicContact CG2-CG 4.17Å |
| 154 | R | 75.1 | Confident | 76.1 | Confident | 163 Ų | 163 | 67.4 Ų | 67.4 | 62% | 0.615 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -85.8 | -16.7 | -174.6 | -156.7 | 169.9 | -170.4 | -166.4 | 0.3 | 114.6 | I150 C151 K152 A156 L159 | I150-R154 WeakPolarHBondContact O-CB 3.27Å; I150-R154 PolarHBondContact O-N 3.5Å; C151-R154 PolarHBondContact O-N 2.96Å; K152-R154 VanDerWaalsContact C-N 3.34Å; K152-R154 PolarHBondContact O-N 3.42Å; R154-A156 PolarHBondContact O-N 2.89Å; R154-L159 HydrophobicContact CB-CD2 4.39Å |
| 155 | C | 60.3 | Low | 75.8 | Confident | 116 Ų | 116 | 72.5 Ų | 72.5 | 78% | 0.784 | 37% | 0.367 | S | S | * | . | trans | 45.2 | 29.3 | 171.4 | -157.4 | 0 | 0 | 0 | 0 | 116.7 | C151 | C151-C155 PolarHBondContact O-N 3.38Š| ||
| 156 | A | 57 | Low | 75.7 | Confident | 48 Ų | 48 | 75.2 Ų | 75.2 | 40% | 0.397 | 38% | 0.382 | S | S | . | . | trans | -94.1 | 122.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | R154 E158 L159 | R154-A156 PolarHBondContact O-N 2.89Å; A156-E158 VanDerWaalsContact C-N 3.32Å; A156-E158 PolarHBondContact O-N 3.38Å; A156-L159 HydrophobicContact CB-CB 4.34Å; A156-L159 WeakPolarHBondContact O-CB 3.45Å; A156-L159 PolarHBondContact O-N 3.26Å | ||
| 157 | T | 55.7 | Low | 75.7 | Confident | 134 Ų | 134 | 76.5 Ų | 76.5 | 82% | 0.822 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -35.4 | -176.6 | 44.1 | 0 | 0 | 0 | 0 | 113.2 | L159 D160 | T157-L159 PolarHBondContact O-N 3.04Å; T157-L159 VanDerWaalsContact O-N 3.14Å; T157-D160 PolarHBondContact O-N 2.92Å |
| 158 | E | 57.5 | Low | 75.8 | Confident | 163 Ų | 163 | 82.3 Ų | 82.3 | 76% | 0.762 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.3 | -17.8 | 173.8 | -58.6 | -171.5 | 136.5 | 0 | 0 | 114 | A156 D160 H162 | A156-E158 VanDerWaalsContact C-N 3.32Å; A156-E158 PolarHBondContact O-N 3.38Å; E158-D160 VanDerWaalsContact C-N 3.29Å; E158-D160 PolarHBondContact O-N 3.05Å; E158-H162 PolarHBondContact O-ND1 3.08Å |
| 159 | L | 60.2 | Low | 76 | Confident | 41 Ų | 41 | 82.6 Ų | 82.6 | 22% | 0.215 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -77.5 | -13.9 | -177 | -159 | 64.5 | 0 | 0 | 0 | 112.3 | C151 R154 A156 T157 H162 K163 | C151-L159 HydrophobicContact CB-CD2 4.08Å; R154-L159 HydrophobicContact CB-CD2 4.39Å; A156-L159 HydrophobicContact CB-CB 4.34Å; A156-L159 WeakPolarHBondContact O-CB 3.45Å; A156-L159 PolarHBondContact O-N 3.26Å; T157-L159 PolarHBondContact O-N 3.04Å; T157-L159 VanDerWaalsContact O-N 3.14Å; L159-H162 HydrophobicContact CD1-CB 4.18Å; L159-H162 CarbonylContact O-C 3.53Å; L159-H162 PolarHBondContact O-N 2.87Å; L159-K163 VanDerWaalsContact O-CB 3.31Å; L159-K163 WeakPolarHBondContact O-CB 3.37Å; L159-K163 PolarHBondContact O-N 3.37Å |
| 160 | D | 67 | Low | 76.3 | Confident | 80 Ų | 80 | 83.6 Ų | 83.6 | 43% | 0.428 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -70.4 | -38.3 | -176 | -154.8 | 52.8 | 0 | 0 | 0 | 112.8 | T157 E158 H162 K163 V164 | T157-D160 PolarHBondContact O-N 2.92Å; E158-D160 VanDerWaalsContact C-N 3.29Å; E158-D160 PolarHBondContact O-N 3.05Å; D160-H162 VanDerWaalsContact C-N 3.29Å; D160-H162 PolarHBondContact O-N 2.83Å; D160-K163 WeakPolarHBondContact O-CB 3.3Å; D160-K163 PolarHBondContact O-N 2.91Å; D160-K163 WeakPolarHBondContact OD1-CD 3.43Å; D160-K163 IonicContact OD1-NZ 2.76Å; D160-K163 PolarHBondContact OD1-NZ 3.45Å; D160-V164 WeakPolarHBondContact O-CG2 3.39Å; D160-V164 PolarHBondContact O-N 3.16Å |
| 161 | R | 70.3 | Confident | 76.7 | Confident | 198 Ų | 198 | 87.1 Ų | 87.1 | 75% | 0.747 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -60.3 | -41 | 171 | -168 | -179.4 | 76.9 | 153.1 | 1.6 | 111.5 | L165 | R161-L165 WeakPolarHBondContact O-CB 3.49Å; R161-L165 PolarHBondContact O-N 3.24Å |
| 162 | H | 74.5 | Confident | 77.2 | Confident | 87 Ų | 87 | 90.1 Ų | 90.1 | 40% | 0.403 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -70.6 | -35.7 | 178 | -63 | 99.6 | 0 | 0 | 0 | 112.1 | E158 L159 D160 L165 L166 | E158-H162 PolarHBondContact O-ND1 3.08Å; L159-H162 HydrophobicContact CD1-CB 4.18Å; L159-H162 CarbonylContact O-C 3.53Å; L159-H162 PolarHBondContact O-N 2.87Å; D160-H162 VanDerWaalsContact C-N 3.29Å; D160-H162 PolarHBondContact O-N 2.83Å; H162-L165 PolarHBondContact O-N 3.49Å; H162-L166 WeakPolarHBondContact O-CB 3.45Å; H162-L166 WeakPolarHBondContact O-CG 3.09Å; H162-L166 PolarHBondContact O-N 3.46Å |
| 163 | K | 80.8 | Confident | 77.8 | Confident | 72 Ų | 72 | 86.5 Ų | 86.5 | 31% | 0.313 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.5 | -49.4 | 172.3 | 172.8 | -177 | 139 | -136.5 | 0 | 110.5 | L159 D160 L165 L166 H167 | L159-K163 VanDerWaalsContact O-CB 3.31Å; L159-K163 WeakPolarHBondContact O-CB 3.37Å; L159-K163 PolarHBondContact O-N 3.37Å; D160-K163 WeakPolarHBondContact O-CB 3.3Å; D160-K163 PolarHBondContact O-N 2.91Å; D160-K163 WeakPolarHBondContact OD1-CD 3.43Å; D160-K163 IonicContact OD1-NZ 2.76Å; D160-K163 PolarHBondContact OD1-NZ 3.45Å; K163-L165 VanDerWaalsContact C-N 3.33Å; K163-L165 PolarHBondContact O-N 2.84Å; K163-L166 PolarHBondContact O-N 3Å; K163-H167 PolarHBondContact O-N 3.06Å; K163-H167 PolarHBondContact O-ND1 2.97Å |
| 164 | V | 81.7 | Confident | 78.4 | Confident | 89 Ų | 89 | 86 Ų | 86 | 54% | 0.539 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -58.7 | -45.1 | 175.4 | 172.8 | 0 | 0 | 0 | 0 | 111 | D160 L166 H167 F168 | D160-V164 WeakPolarHBondContact O-CG2 3.39Å; D160-V164 PolarHBondContact O-N 3.16Å; V164-L166 PolarHBondContact O-N 2.94Å; V164-H167 PolarHBondContact O-N 3.41Å; V164-F168 WeakPolarHBondContact O-CB 3.32Å; V164-F168 PolarHBondContact O-N 3.43Å |
| 165 | L | 86.6 | Confident | 79.3 | Confident | 115 Ų | 115 | 82.1 Ų | 82.1 | 60% | 0.602 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -60.3 | -41.8 | 176.7 | -177.3 | 62.4 | 0 | 0 | 0 | 112.7 | R161 H162 K163 G169 | R161-L165 WeakPolarHBondContact O-CB 3.49Å; R161-L165 PolarHBondContact O-N 3.24Å; H162-L165 PolarHBondContact O-N 3.49Å; K163-L165 VanDerWaalsContact C-N 3.33Å; K163-L165 PolarHBondContact O-N 2.84Å; L165-G169 PolarHBondContact O-N 3.27Å |
| 166 | L | 87 | Confident | 80.8 | Confident | 65 Ų | 65 | 80.6 Ų | 80.6 | 34% | 0.34 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.9 | -41.4 | 175.1 | -74.1 | 171.4 | 0 | 0 | 0 | 112.3 | H162 K163 V164 G169 F170 | H162-L166 WeakPolarHBondContact O-CB 3.45Å; H162-L166 WeakPolarHBondContact O-CG 3.09Å; H162-L166 PolarHBondContact O-N 3.46Å; K163-L166 PolarHBondContact O-N 3Å; V164-L166 PolarHBondContact O-N 2.94Å; L166-G169 PolarHBondContact O-N 2.83Å; L166-F170 VanDerWaalsContact O-CD2 3.32Å; L166-F170 WeakPolarHBondContact O-CD2 3.4Å; L166-F170 PolarHBondContact O-N 3.31Å |
| 167 | H | 87.1 | Confident | 82.5 | Confident | 31 Ų | 31 | 78.3 Ų | 78.3 | 14% | 0.144 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -63.5 | -46.2 | 177.1 | -73.6 | 63.4 | 0 | 0 | 0 | 111 | Y81 L144 K163 V164 G169 I171 | Y81-H167 AromaticContact CZ-NE2 3.75Å; Y81-H167 PolarHBondContact OH-CD2 3.05Å; Y81-H167 PolarHBondContact OH-NE2 3.32Å; L144-H167 HydrophobicContact CD2-CB 4.39Å; K163-H167 PolarHBondContact O-N 3.06Å; K163-H167 PolarHBondContact O-ND1 2.97Å; V164-H167 PolarHBondContact O-N 3.41Å; H167-G169 VanDerWaalsContact C-N 3.34Å; H167-G169 PolarHBondContact O-N 3.48Å; H167-I171 WeakPolarHBondContact O-CB 3.49Å; H167-I171 WeakPolarHBondContact O-CD1 3.25Å; H167-I171 WeakPolarHBondContact O-CG1 3.31Å; H167-I171 PolarHBondContact O-N 3.21Å |
| 168 | F | 90.1 | Very high | 84.2 | Confident | 125 Ų | 125 | 74.5 Ų | 74.5 | 55% | 0.548 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60.4 | -43 | 173.5 | -170 | -106.6 | 0 | 0 | 0 | 111.7 | V164 I171 M172 | V164-F168 WeakPolarHBondContact O-CB 3.32Å; V164-F168 PolarHBondContact O-N 3.43Å; F168-I171 PolarHBondContact O-N 3.5Å; F168-M172 HydrophobicContact CD1-CG 3.86Å; F168-M172 HydrophobicContact CD2-CG 4.25Å; F168-M172 HydrophobicContact CE1-CG 3.52Å; F168-M172 HydrophobicContact CE1-SD 4.24Å; F168-M172 HydrophobicContact CE2-CG 3.95Å; F168-M172 HydrophobicContact CE2-SD 4.04Å; F168-M172 HydrophobicContact CG-CG 4.22Å; F168-M172 HydrophobicContact CZ-CG 3.57Å; F168-M172 HydrophobicContact CZ-SD 3.7Å; F168-M172 VanDerWaalsContact O-CB 3.31Å; F168-M172 WeakPolarHBondContact O-CB 3.41Å; F168-M172 VanDerWaalsContact O-CG 3.25Å; F168-M172 WeakPolarHBondContact O-CG 3.45Å; F168-M172 PolarHBondContact O-N 3.13Å |
| 169 | G | 91.9 | Very high | 85.8 | Confident | 38 Ų | 38 | 70.3 Ų | 70.3 | 39% | 0.392 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -58.1 | -50.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | L165 L166 H167 M172 A173 | L165-G169 PolarHBondContact O-N 3.27Å; L166-G169 PolarHBondContact O-N 2.83Å; H167-G169 VanDerWaalsContact C-N 3.34Å; H167-G169 PolarHBondContact O-N 3.48Å; G169-M172 PolarHBondContact O-N 2.85Å; G169-A173 WeakPolarHBondContact O-CB 3.13Å; G169-A173 PolarHBondContact O-N 3.06Å |
| 170 | F | 92.6 | Very high | 87.2 | Confident | 22 Ų | 22 | 69.5 Ų | 69.5 | 10% | 0.096 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -70.4 | -31.4 | 178.2 | -77.6 | -72.5 | 0 | 0 | 0 | 113.1 | C140 N143 L144 L166 S174 Y222 | C140-F170 HydrophobicContact CB-CB 4.29Å; C140-F170 HydrophobicContact CB-CD1 4.1Å; N143-F170 HydrophobicContact CB-CD1 4.2Å; N143-F170 HydrophobicContact CB-CE1 3.6Å; N143-F170 HydrophobicContact CB-CE2 4.11Å; N143-F170 HydrophobicContact CB-CZ 3.56Å; L144-F170 HydrophobicContact CD1-CB 3.92Å; L144-F170 HydrophobicContact CD2-CB 3.98Å; L144-F170 HydrophobicContact CD2-CD2 3.52Å; L144-F170 HydrophobicContact CD2-CE2 4.4Å; L144-F170 HydrophobicContact CD2-CG 4.08Å; L144-F170 HydrophobicContact CG-CB 3.88Å; L144-F170 HydrophobicContact CG-CD2 3.96Å; L144-F170 HydrophobicContact CG-CG 4.09Å; L166-F170 VanDerWaalsContact O-CD2 3.32Å; L166-F170 WeakPolarHBondContact O-CD2 3.4Å; L166-F170 PolarHBondContact O-N 3.31Å; F170-S174 WeakPolarHBondContact O-CB 3.35Å; F170-S174 PolarHBondContact O-N 3.16Å; F170-S174 VanDerWaalsContact O-N 3.08Å; F170-S174 PolarHBondContact O-OG 3.44Å; F170-Y222 HydrophobicContact CE2-CE2 4.21Å; F170-Y222 HydrophobicContact CZ-CE2 4.09Å |
| 171 | I | 91.5 | Very high | 88.2 | Confident | 89 Ų | 89 | 65.7 Ų | 65.7 | 46% | 0.456 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -65.9 | -48.5 | 171.5 | -70.4 | 165.8 | 0 | 0 | 0 | 110.2 | H167 F168 A173 S174 L175 | H167-I171 WeakPolarHBondContact O-CB 3.49Å; H167-I171 WeakPolarHBondContact O-CD1 3.25Å; H167-I171 WeakPolarHBondContact O-CG1 3.31Å; H167-I171 PolarHBondContact O-N 3.21Å; F168-I171 PolarHBondContact O-N 3.5Å; I171-A173 PolarHBondContact O-N 3.43Å; I171-S174 WeakPolarHBondContact O-CB 3.32Å; I171-S174 PolarHBondContact O-N 3Å; I171-S174 VanDerWaalsContact O-N 3.11Å; I171-L175 HydrophobicContact CG2-CD1 3.94Å; I171-L175 HydrophobicContact CG2-CG 4.39Å; I171-L175 WeakPolarHBondContact O-CG 3.38Å; I171-L175 PolarHBondContact O-N 3.44Å |
| 172 | M | 92.8 | Very high | 89 | Confident | 88 Ų | 88 | 59 Ų | 59 | 43% | 0.433 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.8 | -37.5 | 178.4 | -72.7 | -59.4 | -64 | 0 | 0 | 112.5 | F168 G169 S174 L175 L176 | F168-M172 HydrophobicContact CD1-CG 3.86Å; F168-M172 HydrophobicContact CD2-CG 4.25Å; F168-M172 HydrophobicContact CE1-CG 3.52Å; F168-M172 HydrophobicContact CE1-SD 4.24Å; F168-M172 HydrophobicContact CE2-CG 3.95Å; F168-M172 HydrophobicContact CE2-SD 4.04Å; F168-M172 HydrophobicContact CG-CG 4.22Å; F168-M172 HydrophobicContact CZ-CG 3.57Å; F168-M172 HydrophobicContact CZ-SD 3.7Å; F168-M172 VanDerWaalsContact O-CB 3.31Å; F168-M172 WeakPolarHBondContact O-CB 3.41Å; F168-M172 VanDerWaalsContact O-CG 3.25Å; F168-M172 WeakPolarHBondContact O-CG 3.45Å; F168-M172 PolarHBondContact O-N 3.13Å; G169-M172 PolarHBondContact O-N 2.85Å; M172-S174 VanDerWaalsContact C-N 3.33Å; M172-L175 PolarHBondContact O-N 3.11Å; M172-L175 HydrophobicContact SD-CD1 4.13Å; M172-L176 VanDerWaalsContact O-CB 3.28Å; M172-L176 WeakPolarHBondContact O-CB 3.35Å; M172-L176 PolarHBondContact O-N 2.65Å |
| 173 | A | 93.6 | Very high | 89.4 | Confident | 21 Ų | 21 | 58.3 Ų | 58.3 | 17% | 0.174 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.9 | -41.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | F136 G169 I171 L176 F177 L211 | F136-A173 HydrophobicContact CE1-CB 4.28Å; F136-A173 HydrophobicContact CZ-CB 4.32Å; G169-A173 WeakPolarHBondContact O-CB 3.13Å; G169-A173 PolarHBondContact O-N 3.06Å; I171-A173 PolarHBondContact O-N 3.43Å; A173-L176 PolarHBondContact O-N 3.01Å; A173-F177 WeakPolarHBondContact O-CB 3.35Å; A173-F177 PolarHBondContact O-N 3.46Å; A173-L211 HydrophobicContact CB-CD2 4.33Å |
| 174 | S | 92.9 | Very high | 89.4 | Confident | 20 Ų | 20 | 55 Ų | 55 | 14% | 0.14 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -69.2 | -37.7 | 178.5 | -52.8 | 0 | 0 | 0 | 0 | 112 | C140 F170 I171 M172 L178 | C140-S174 PolarHBondContact SG-OG 2.9Å; C140-S174 VanDerWaalsContact SG-OG 3.37Å; F170-S174 WeakPolarHBondContact O-CB 3.35Å; F170-S174 PolarHBondContact O-N 3.16Å; F170-S174 VanDerWaalsContact O-N 3.08Å; F170-S174 PolarHBondContact O-OG 3.44Å; I171-S174 WeakPolarHBondContact O-CB 3.32Å; I171-S174 PolarHBondContact O-N 3Å; I171-S174 VanDerWaalsContact O-N 3.11Å; M172-S174 VanDerWaalsContact C-N 3.33Å; S174-L178 WeakPolarHBondContact O-CB 3.2Å; S174-L178 PolarHBondContact O-N 3.27Å |
| 175 | L | 93.7 | Very high | 89.2 | Confident | 83 Ų | 83 | 50.9 Ų | 50.9 | 44% | 0.435 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -67.5 | -41.6 | 172.5 | -70.5 | 172.4 | 0 | 0 | 0 | 112 | I171 M172 L178 V179 | I171-L175 HydrophobicContact CG2-CD1 3.94Å; I171-L175 HydrophobicContact CG2-CG 4.39Å; I171-L175 WeakPolarHBondContact O-CG 3.38Å; I171-L175 PolarHBondContact O-N 3.44Å; M172-L175 PolarHBondContact O-N 3.11Å; M172-L175 HydrophobicContact SD-CD1 4.13Å; L175-L178 PolarHBondContact O-N 2.98Å; L175-V179 WeakPolarHBondContact O-CB 3.44Å; L175-V179 VanDerWaalsContact O-CG2 3.3Å; L175-V179 WeakPolarHBondContact O-CG2 3.31Å; L175-V179 PolarHBondContact O-N 2.91Å |
| 176 | L | 93.4 | Very high | 88.9 | Confident | 83 Ų | 83 | 50.3 Ų | 50.3 | 44% | 0.435 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.5 | -48.1 | 175.3 | 178 | 62.3 | 0 | 0 | 0 | 110.8 | M172 A173 L178 V179 V180 L211 | M172-L176 VanDerWaalsContact O-CB 3.28Å; M172-L176 WeakPolarHBondContact O-CB 3.35Å; M172-L176 PolarHBondContact O-N 2.65Å; A173-L176 PolarHBondContact O-N 3.01Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L178 PolarHBondContact O-N 3.45Å; L176-V179 PolarHBondContact O-N 2.91Å; L176-V180 HydrophobicContact CD1-CG2 3.95Å; L176-V180 HydrophobicContact CG-CG2 4.43Å; L176-V180 WeakPolarHBondContact O-CB 3.14Å; L176-V180 VanDerWaalsContact O-CG2 3.28Å; L176-V180 WeakPolarHBondContact O-CG2 3.29Å; L176-V180 PolarHBondContact O-N 2.74Å; L176-L211 HydrophobicContact CD2-CD1 4.21Å; L176-L211 HydrophobicContact CG-CD1 4.34Å |
| 177 | F | 92.1 | Very high | 88.5 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -58 | -45.6 | 174.8 | -167.1 | -76.4 | 0 | 0 | 0 | 111.3 | C133 F136 A173 N181 N208 L211 F212 F279 | C133-F177 HydrophobicContact CB-CD1 4.16Å; C133-F177 HydrophobicContact CB-CE1 4.31Å; F136-F177 HydrophobicContact CB-CD1 4.11Å; F136-F177 HydrophobicContact CB-CD2 4.04Å; F136-F177 HydrophobicContact CB-CE1 4.08Å; F136-F177 HydrophobicContact CB-CE2 3.98Å; F136-F177 HydrophobicContact CB-CG 4.11Å; F136-F177 HydrophobicContact CB-CZ 4.02Å; F136-F177 HydrophobicContact CD1-CB 3.67Å; F136-F177 HydrophobicContact CD1-CD1 4.35Å; F136-F177 AromaticContact CD1-CD2 3.78Å; F136-F177 HydrophobicContact CD1-CD2 3.78Å; F136-F177 AromaticContact CD1-CG 3.68Å; F136-F177 HydrophobicContact CD1-CG 3.68Å; F136-F177 AromaticContact CD2-CD2 3.93Å; F136-F177 HydrophobicContact CD2-CD2 3.93Å; F136-F177 HydrophobicContact CD2-CE2 4.08Å; F136-F177 HydrophobicContact CE1-CB 3.93Å; F136-F177 HydrophobicContact CE1-CD2 4.23Å; F136-F177 HydrophobicContact CE1-CG 4.29Å; F136-F177 HydrophobicContact CE2-CD2 4.39Å; F136-F177 HydrophobicContact CG-CB 4.36Å; F136-F177 HydrophobicContact CG-CD1 4.37Å; F136-F177 AromaticContact CG-CD2 3.61Å; F136-F177 HydrophobicContact CG-CD2 3.61Å; F136-F177 AromaticContact CG-CE2 3.93Å; F136-F177 HydrophobicContact CG-CE2 3.93Å; F136-F177 AromaticContact CG-CG 3.86Å; F136-F177 HydrophobicContact CG-CG 3.86Å; F136-F177 HydrophobicContact CG-CZ 4.46Å; A173-F177 WeakPolarHBondContact O-CB 3.35Å; A173-F177 PolarHBondContact O-N 3.46Å; F177-N181 WeakPolarHBondContact CD1-ND2 3.49Å; F177-N181 WeakPolarHBondContact CE1-ND2 3.33Å; F177-N181 PolarHBondContact O-N 2.85Å; F177-N181 VanDerWaalsContact O-N 3.14Å; F177-N181 PolarHBondContact O-ND2 3.32Å; F177-N208 HydrophobicContact CD2-CB 4.15Å; F177-N208 HydrophobicContact CE2-CB 3.56Å; F177-N208 HydrophobicContact CZ-CB 4.12Å; F177-L211 HydrophobicContact CB-CD1 4.19Å; F177-L211 HydrophobicContact CD2-CD1 4.17Å; F177-F212 AromaticContact CE2-CD2 3.98Å; F177-F212 HydrophobicContact CE2-CD2 3.98Å; F177-F212 AromaticContact CE2-CE2 3.54Å; F177-F212 HydrophobicContact CE2-CE2 3.54Å; F177-F212 HydrophobicContact CE2-CZ 4.3Å; F177-F212 AromaticContact CZ-CE2 3.7Å; F177-F212 HydrophobicContact CZ-CE2 3.7Å; F177-F212 HydrophobicContact CZ-CZ 4.29Å; F177-F279 HydrophobicContact CZ-CE1 4.14Å; F177-F279 HydrophobicContact CZ-CZ 4.24Å |
| 178 | L | 91.4 | Very high | 87.7 | Confident | 54 Ų | 54 | 51.7 Ų | 51.7 | 28% | 0.283 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60.9 | -47.9 | 178 | -175 | 68.9 | 0 | 0 | 0 | 112 | W125 F130 C133 S174 L175 L176 L182 | W125-L178 HydrophobicContact CH2-CD1 4.32Å; W125-L178 HydrophobicContact CZ2-CD1 3.76Å; F130-L178 HydrophobicContact CD2-CD1 3.96Å; F130-L178 HydrophobicContact CE2-CD1 4.05Å; C133-L178 HydrophobicContact CB-CD1 3.9Å; S174-L178 WeakPolarHBondContact O-CB 3.2Å; S174-L178 PolarHBondContact O-N 3.27Å; L175-L178 PolarHBondContact O-N 2.98Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L178 PolarHBondContact O-N 3.45Å; L178-L182 VanDerWaalsContact O-CB 3.28Å; L178-L182 WeakPolarHBondContact O-CB 3.32Å; L178-L182 PolarHBondContact O-N 2.84Å |
| 179 | V | 91.2 | Very high | 86.7 | Confident | 75 Ų | 75 | 50 Ų | 50 | 46% | 0.455 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65.4 | -45.9 | -180 | 169.4 | 0 | 0 | 0 | 0 | 111.1 | L175 L176 N181 L182 T183 | L175-V179 WeakPolarHBondContact O-CB 3.44Å; L175-V179 VanDerWaalsContact O-CG2 3.3Å; L175-V179 WeakPolarHBondContact O-CG2 3.31Å; L175-V179 PolarHBondContact O-N 2.91Å; L176-V179 PolarHBondContact O-N 2.91Å; V179-N181 VanDerWaalsContact C-N 3.31Å; V179-N181 PolarHBondContact O-N 3.39Å; V179-L182 PolarHBondContact O-N 3.43Å; V179-L182 VanDerWaalsContact O-N 3.14Å; V179-T183 WeakPolarHBondContact O-CB 3.3Å; V179-T183 PolarHBondContact O-N 2.84Å; V179-T183 PolarHBondContact O-OG1 3.38Å |
| 180 | V | 89.5 | Confident | 85.6 | Confident | 24 Ų | 24 | 49.9 Ų | 49.9 | 15% | 0.145 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.6 | -39.5 | 179.6 | 164.7 | 0 | 0 | 0 | 0 | 111.8 | L176 C184 R204 I207 | L176-V180 HydrophobicContact CD1-CG2 3.95Å; L176-V180 HydrophobicContact CG-CG2 4.43Å; L176-V180 WeakPolarHBondContact O-CB 3.14Å; L176-V180 VanDerWaalsContact O-CG2 3.28Å; L176-V180 WeakPolarHBondContact O-CG2 3.29Å; L176-V180 PolarHBondContact O-N 2.74Å; V180-C184 WeakPolarHBondContact O-CB 3.41Å; V180-C184 PolarHBondContact O-N 2.93Å; V180-C184 VanDerWaalsContact O-N 3.15Å; V180-R204 HydrophobicContact CG1-CB 4.08Å; V180-R204 HydrophobicContact CG1-CG 3.73Å; V180-I207 HydrophobicContact CG1-CB 4.48Å; V180-I207 HydrophobicContact CG1-CG2 4.41Å; V180-I207 HydrophobicContact CG2-CD1 4.35Å; V180-I207 HydrophobicContact CG2-CG2 4.23Å |
| 181 | N | 87.5 | Confident | 84.2 | Confident | 1 Ų | 1 | 57.5 Ų | 57.5 | 1% | 0.005 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -73.1 | -37 | 174 | -74 | -75.2 | 0 | 0 | 0 | 113.1 | C129 F177 V179 A185 N208 | C129-N181 HydrophobicContact CB-CB 4.49Å; F177-N181 WeakPolarHBondContact CD1-ND2 3.49Å; F177-N181 WeakPolarHBondContact CE1-ND2 3.33Å; F177-N181 PolarHBondContact O-N 2.85Å; F177-N181 VanDerWaalsContact O-N 3.14Å; F177-N181 PolarHBondContact O-ND2 3.32Å; V179-N181 VanDerWaalsContact C-N 3.31Å; V179-N181 PolarHBondContact O-N 3.39Å; N181-A185 WeakPolarHBondContact O-CB 3.31Å; N181-A185 PolarHBondContact O-N 3.03Å; N181-A185 VanDerWaalsContact O-N 3.07Å; N181-N208 PolarHBondContact ND2-ND2 2.91Å; N181-N208 PolarHBondContact ND2-OD1 3.4Å; N181-N208 PolarHBondContact OD1-ND2 2.91Å |
| 182 | L | 86.3 | Confident | 83.3 | Confident | 58 Ų | 58 | 55.5 Ų | 55.5 | 30% | 0.304 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -64.7 | -49.3 | 175.7 | -174.1 | 73.3 | 0 | 0 | 0 | 111.7 | F121 W125 L178 V179 C184 A185 M186 | F121-L182 HydrophobicContact CZ-CD1 3.84Å; W125-L182 HydrophobicContact CD2-CD1 3.97Å; W125-L182 HydrophobicContact CG-CD1 4.25Å; W125-L182 HydrophobicContact CZ2-CD1 3.92Å; L178-L182 VanDerWaalsContact O-CB 3.28Å; L178-L182 WeakPolarHBondContact O-CB 3.32Å; L178-L182 PolarHBondContact O-N 2.84Å; V179-L182 PolarHBondContact O-N 3.43Å; V179-L182 VanDerWaalsContact O-N 3.14Å; L182-C184 VanDerWaalsContact C-N 3.35Å; L182-C184 PolarHBondContact O-N 2.85Å; L182-A185 PolarHBondContact O-N 3.31Å; L182-M186 WeakPolarHBondContact O-CG 3.5Å; L182-M186 PolarHBondContact O-N 3.29Å |
| 183 | T | 84.8 | Confident | 82.5 | Confident | 71 Ų | 71 | 55.2 Ų | 55.2 | 44% | 0.436 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.8 | -42 | 177.5 | -64.5 | 0 | 0 | 0 | 0 | 111.4 | V179 M186 L187 | V179-T183 WeakPolarHBondContact O-CB 3.3Å; V179-T183 PolarHBondContact O-N 2.84Å; V179-T183 PolarHBondContact O-OG1 3.38Å; T183-M186 PolarHBondContact O-N 3.45Å; T183-L187 HydrophobicContact CG2-CD1 3.8Å; T183-L187 HydrophobicContact CG2-CG 4.45Å; T183-L187 WeakPolarHBondContact O-CB 3.36Å; T183-L187 VanDerWaalsContact O-CG 3.28Å; T183-L187 WeakPolarHBondContact O-CG 3.23Å; T183-L187 PolarHBondContact O-N 3.43Å |
| 184 | C | 79.9 | Confident | 81.6 | Confident | 2 Ų | 2 | 61.4 Ų | 61.4 | 1% | 0.014 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64 | -43 | 174.8 | -175.3 | 0 | 0 | 0 | 0 | 112.5 | V180 L182 M186 L187 V188 T200 R204 | V180-C184 WeakPolarHBondContact O-CB 3.41Å; V180-C184 PolarHBondContact O-N 2.93Å; V180-C184 VanDerWaalsContact O-N 3.15Å; L182-C184 VanDerWaalsContact C-N 3.35Å; L182-C184 PolarHBondContact O-N 2.85Å; C184-M186 VanDerWaalsContact C-N 3.32Å; C184-M186 PolarHBondContact O-N 2.88Å; C184-L187 PolarHBondContact O-N 3.31Å; C184-V188 VanDerWaalsContact O-CG2 3.31Å; C184-V188 WeakPolarHBondContact O-CG2 3.34Å; C184-V188 PolarHBondContact O-N 2.88Å; C184-T200 HydrophobicContact CB-CG2 4.42Å; C184-R204 HydrophobicContact CB-CB 4.38Å; C184-R204 HydrophobicContact CB-CG 4.12Å; C184-R204 PolarHBondContact SG-NH1 2.92Å; C184-R204 VanDerWaalsContact SG-NH1 3.45Å |
| 185 | A | 77.3 | Confident | 80.7 | Confident | 4 Ų | 4 | 65.2 Ų | 65.2 | 3% | 0.033 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -67.3 | -33 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | F121 W125 N181 L182 H189 | F121-A185 HydrophobicContact CD2-CB 4.29Å; F121-A185 HydrophobicContact CE2-CB 3.73Å; W125-A185 HydrophobicContact CB-CB 4.06Å; W125-A185 HydrophobicContact CG-CB 4.24Å; N181-A185 WeakPolarHBondContact O-CB 3.31Å; N181-A185 PolarHBondContact O-N 3.03Å; N181-A185 VanDerWaalsContact O-N 3.07Å; L182-A185 PolarHBondContact O-N 3.31Å; A185-H189 PolarHBondContact O-ND1 2.89Å |
| 186 | M | 80.8 | Confident | 79.9 | Confident | 102 Ų | 102 | 66.4 Ų | 66.4 | 50% | 0.502 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.1 | -46.8 | 169.7 | -72.2 | -73.2 | -165.2 | 0 | 0 | 111.2 | F121 L182 T183 C184 V188 H189 G190 | F121-M186 HydrophobicContact CD1-CE 4.25Å; F121-M186 HydrophobicContact CD1-SD 4.08Å; F121-M186 HydrophobicContact CD2-CG 4.47Å; F121-M186 HydrophobicContact CD2-SD 4.07Å; F121-M186 HydrophobicContact CE1-CE 3.46Å; F121-M186 VanDerWaalsContact CE1-CE 3.46Å; F121-M186 HydrophobicContact CE1-SD 3.72Å; F121-M186 HydrophobicContact CE2-CB 4.41Å; F121-M186 HydrophobicContact CE2-CE 4.27Å; F121-M186 HydrophobicContact CE2-CG 3.73Å; F121-M186 HydrophobicContact CE2-SD 3.69Å; F121-M186 HydrophobicContact CG-SD 4.26Å; F121-M186 HydrophobicContact CZ-CE 3.48Å; F121-M186 VanDerWaalsContact CZ-CE 3.48Å; F121-M186 HydrophobicContact CZ-CG 3.81Å; F121-M186 HydrophobicContact CZ-SD 3.52Å; F121-M186 VanDerWaalsContact CZ-SD 3.52Å; L182-M186 WeakPolarHBondContact O-CG 3.5Å; L182-M186 PolarHBondContact O-N 3.29Å; T183-M186 PolarHBondContact O-N 3.45Å; C184-M186 VanDerWaalsContact C-N 3.32Å; C184-M186 PolarHBondContact O-N 2.88Å; M186-V188 VanDerWaalsContact C-N 3.33Å; M186-V188 PolarHBondContact O-N 3.06Å; M186-H189 CarbonylContact O-C 3.58Å; M186-H189 PolarHBondContact O-N 3.06Å; M186-G190 PolarHBondContact O-N 3.42Å |
| 187 | L | 77.5 | Confident | 79.1 | Confident | 56 Ų | 56 | 64.1 Ų | 64.1 | 29% | 0.293 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -67.7 | -29.2 | -179.2 | -72 | 167.5 | 0 | 0 | 0 | 113.2 | T183 C184 H189 G190 V192 T200 | T183-L187 HydrophobicContact CG2-CD1 3.8Å; T183-L187 HydrophobicContact CG2-CG 4.45Å; T183-L187 WeakPolarHBondContact O-CB 3.36Å; T183-L187 VanDerWaalsContact O-CG 3.28Å; T183-L187 WeakPolarHBondContact O-CG 3.23Å; T183-L187 PolarHBondContact O-N 3.43Å; C184-L187 PolarHBondContact O-N 3.31Å; L187-H189 PolarHBondContact O-N 3.21Å; L187-G190 PolarHBondContact O-N 3.01Å; L187-V192 HydrophobicContact CD2-CG2 4.04Å; L187-T200 HydrophobicContact CB-CG2 4.45Å; L187-T200 HydrophobicContact CD1-CG2 3.63Å |
| 188 | V | 70.6 | Confident | 78.3 | Confident | 70 Ų | 70 | 67.9 Ų | 67.9 | 42% | 0.424 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -65.3 | -25.1 | 170.2 | 167.4 | 0 | 0 | 0 | 0 | 112.5 | C184 M186 L197 | C184-V188 VanDerWaalsContact O-CG2 3.31Å; C184-V188 WeakPolarHBondContact O-CG2 3.34Å; C184-V188 PolarHBondContact O-N 2.88Å; M186-V188 VanDerWaalsContact C-N 3.33Å; M186-V188 PolarHBondContact O-N 3.06Å; V188-L197 HydrophobicContact CG2-CD1 3.89Å |
| 189 | H | 69.6 | Low | 77.7 | Confident | 89 Ų | 89 | 72.9 Ų | 72.9 | 41% | 0.412 | 38% | 0.384 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.3 | 1.1 | 177 | -68.7 | 76.8 | 0 | 0 | 0 | 113.2 | F121 H124 A185 M186 L187 | F121-H189 HydrophobicContact CB-CB 4.45Å; H124-H189 AromaticContact CD2-CE1 3.84Å; A185-H189 PolarHBondContact O-ND1 2.89Å; M186-H189 CarbonylContact O-C 3.58Å; M186-H189 PolarHBondContact O-N 3.06Å; L187-H189 PolarHBondContact O-N 3.21Å |
| 190 | G | 68.1 | Low | 77.2 | Confident | 36 Ų | 36 | 71 Ų | 71 | 37% | 0.371 | 37% | 0.372 | S | S | . | . | S | Bend | trans | -92.1 | 149.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | M186 L187 V192 | M186-G190 PolarHBondContact O-N 3.42Å; L187-G190 PolarHBondContact O-N 3.01Å; G190-V192 PolarHBondContact O-N 3.41Å |
| 191 | D | 63.9 | Low | 76.7 | Confident | 181 Ų | 181 | 70.5 Ų | 70.5 | 97% | 0.968 | 37% | 0.369 | S | S | * | . | trans | -75.9 | 70.3 | 175.9 | -163 | 21.1 | 0 | 0 | 0 | 110.2 | ||||
| 192 | V | 72.7 | Confident | 76.4 | Confident | 47 Ų | 47 | 73.1 Ų | 73.1 | 29% | 0.285 | 38% | 0.381 | S | S | . | . | trans | -111.3 | 132.3 | -170.4 | 175.7 | 0 | 0 | 0 | 0 | 109 | L187 G190 E194 Q196 | L187-V192 HydrophobicContact CD2-CG2 4.04Å; G190-V192 PolarHBondContact O-N 3.41Å; V192-E194 PolarHBondContact O-N 3.4Å; V192-Q196 HydrophobicContact CG1-CB 3.91Å | ||
| 193 | P | 76.9 | Confident | 76.3 | Confident | 82 Ų | 82 | 73.6 Ų | 73.6 | 53% | 0.532 | 39% | 0.386 | S | S | . | . | trans | -60.4 | 138.7 | -177.1 | 24.6 | -35.1 | 0 | 0 | 0 | 112.3 | N195 Q196 L197 | P193-N195 PolarHBondContact O-N 3.3Å; P193-N195 PolarHBondContact O-OD1 2.88Å; P193-Q196 HydrophobicContact CG-CB 4.44Å; P193-Q196 HydrophobicContact CG-CG 4.09Å; P193-Q196 PolarHBondContact O-N 2.91Å; P193-L197 PolarHBondContact O-N 3.44Å | ||
| 194 | E | 73.8 | Confident | 76.4 | Confident | 151 Ų | 151 | 70.9 Ų | 70.9 | 71% | 0.706 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -52.4 | -34.5 | -168.8 | -61 | 179.2 | -175.9 | 0 | 0 | 114.3 | V192 L197 K198 | V192-E194 PolarHBondContact O-N 3.4Å; E194-L197 WeakPolarHBondContact O-CB 3.22Å; E194-L197 PolarHBondContact O-N 2.87Å; E194-K198 WeakPolarHBondContact O-CG 3.22Å; E194-K198 PolarHBondContact O-N 3.36Å |
| 195 | N | 74.1 | Confident | 76.6 | Confident | 100 Ų | 100 | 70.8 Ų | 70.8 | 54% | 0.535 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.2 | -43 | 178.6 | 60.5 | -7.1 | 0 | 0 | 0 | 112.2 | P193 L197 K198 W199 | P193-N195 PolarHBondContact O-N 3.3Å; P193-N195 PolarHBondContact O-OD1 2.88Å; N195-L197 VanDerWaalsContact C-N 3.32Å; N195-K198 PolarHBondContact O-N 3.31Å; N195-W199 PolarHBondContact O-N 2.83Å; N195-W199 VanDerWaalsContact O-N 3.16Å |
| 196 | Q | 76.7 | Confident | 77.1 | Confident | 109 Ų | 109 | 74.1 Ų | 74.1 | 51% | 0.509 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -67.9 | -34 | 174.3 | -65.1 | -66.4 | -7.1 | 0 | 0 | 111.3 | V192 P193 T200 | V192-Q196 HydrophobicContact CG1-CB 3.91Å; P193-Q196 HydrophobicContact CG-CB 4.44Å; P193-Q196 HydrophobicContact CG-CG 4.09Å; P193-Q196 PolarHBondContact O-N 2.91Å; Q196-T200 VanDerWaalsContact O-CB 3.31Å; Q196-T200 WeakPolarHBondContact O-CB 3.22Å; Q196-T200 PolarHBondContact O-N 3.49Å; Q196-T200 PolarHBondContact O-OG1 3.39Å |
| 197 | L | 76.4 | Confident | 77.5 | Confident | 34 Ų | 34 | 72 Ų | 72 | 18% | 0.178 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -65.6 | -46 | 175.1 | -172.6 | 63 | 0 | 0 | 0 | 111.7 | V188 P193 E194 N195 W199 T200 V201 | V188-L197 HydrophobicContact CG2-CD1 3.89Å; P193-L197 PolarHBondContact O-N 3.44Å; E194-L197 WeakPolarHBondContact O-CB 3.22Å; E194-L197 PolarHBondContact O-N 2.87Å; N195-L197 VanDerWaalsContact C-N 3.32Å; L197-W199 PolarHBondContact O-N 3.43Å; L197-T200 WeakPolarHBondContact O-CB 3.18Å; L197-T200 PolarHBondContact O-N 2.99Å; L197-V201 WeakPolarHBondContact O-CG2 3.38Å; L197-V201 PolarHBondContact O-N 3.08Å |
| 198 | K | 75.1 | Confident | 78.1 | Confident | 79 Ų | 79 | 69.3 Ų | 69.3 | 34% | 0.343 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -57.1 | -50 | 174.6 | -72.9 | -169.5 | -177.4 | -162.7 | 0 | 111.7 | E194 N195 T200 V201 F202 D273 L275 | E194-K198 WeakPolarHBondContact O-CG 3.22Å; E194-K198 PolarHBondContact O-N 3.36Å; N195-K198 PolarHBondContact O-N 3.31Å; K198-T200 VanDerWaalsContact C-N 3.33Å; K198-T200 PolarHBondContact O-N 3.39Å; K198-V201 PolarHBondContact O-N 3.14Å; K198-F202 WeakPolarHBondContact O-CB 3.31Å; K198-F202 PolarHBondContact O-N 3.04Å; K198-D273 PolarHBondContact NZ-O 3.3Å; K198-L275 HydrophobicContact CG-CG 4.37Å |
| 199 | W | 78.6 | Confident | 79.1 | Confident | 160 Ų | 160 | 66.1 Ų | 66.1 | 61% | 0.606 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -61.4 | -38.8 | 176.4 | -78.7 | 112.3 | 0 | 0 | 0 | 112.8 | N195 L197 F202 V203 | N195-W199 PolarHBondContact O-N 2.83Å; N195-W199 VanDerWaalsContact O-N 3.16Å; L197-W199 PolarHBondContact O-N 3.43Å; W199-F202 HydrophobicContact CE3-CD1 4.35Å; W199-F202 HydrophobicContact CZ3-CD1 4.38Å; W199-F202 PolarHBondContact O-N 3.47Å; W199-V203 WeakPolarHBondContact O-CB 3.39Å; W199-V203 VanDerWaalsContact O-CG2 3.3Å; W199-V203 WeakPolarHBondContact O-CG2 3.27Å; W199-V203 PolarHBondContact O-N 3.39Å |
| 200 | T | 80.8 | Confident | 80.1 | Confident | 35 Ų | 35 | 64 Ų | 64 | 22% | 0.215 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.6 | -46.2 | 175.4 | -62.8 | 0 | 0 | 0 | 0 | 111.8 | C184 L187 Q196 L197 K198 V203 R204 | C184-T200 HydrophobicContact CB-CG2 4.42Å; L187-T200 HydrophobicContact CB-CG2 4.45Å; L187-T200 HydrophobicContact CD1-CG2 3.63Å; Q196-T200 VanDerWaalsContact O-CB 3.31Å; Q196-T200 WeakPolarHBondContact O-CB 3.22Å; Q196-T200 PolarHBondContact O-N 3.49Å; Q196-T200 PolarHBondContact O-OG1 3.39Å; L197-T200 WeakPolarHBondContact O-CB 3.18Å; L197-T200 PolarHBondContact O-N 2.99Å; K198-T200 VanDerWaalsContact C-N 3.33Å; K198-T200 PolarHBondContact O-N 3.39Å; T200-V203 PolarHBondContact O-N 3.25Å; T200-R204 VanDerWaalsContact O-CB 3.32Å; T200-R204 WeakPolarHBondContact O-CB 3.13Å; T200-R204 PolarHBondContact O-N 2.87Å |
| 201 | V | 78.6 | Confident | 81.3 | Confident | 14 Ų | 14 | 63.4 Ų | 63.4 | 9% | 0.085 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -65.7 | -40.2 | 179.8 | 170 | 0 | 0 | 0 | 0 | 111.5 | L197 K198 A205 | L197-V201 WeakPolarHBondContact O-CG2 3.38Å; L197-V201 PolarHBondContact O-N 3.08Å; K198-V201 PolarHBondContact O-N 3.14Å; V201-A205 PolarHBondContact O-N 3.45Å; V201-A205 VanDerWaalsContact O-N 3.13Å |
| 202 | F | 82 | Confident | 82.7 | Confident | 56 Ų | 56 | 55 Ų | 55 | 25% | 0.246 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.7 | -51.4 | 173.3 | 177.9 | -84.5 | 0 | 0 | 0 | 111.8 | K198 W199 R204 A205 L206 V268 | K198-F202 WeakPolarHBondContact O-CB 3.31Å; K198-F202 PolarHBondContact O-N 3.04Å; W199-F202 HydrophobicContact CE3-CD1 4.35Å; W199-F202 HydrophobicContact CZ3-CD1 4.38Å; W199-F202 PolarHBondContact O-N 3.47Å; F202-R204 PolarHBondContact O-N 2.99Å; F202-A205 WeakPolarHBondContact O-CB 3.3Å; F202-A205 PolarHBondContact O-N 2.92Å; F202-A205 VanDerWaalsContact O-N 3.16Å; F202-L206 HydrophobicContact CE1-CD2 4.26Å; F202-L206 PolarHBondContact O-N 2.93Å; F202-V268 HydrophobicContact CD2-CG1 3.42Å; F202-V268 VanDerWaalsContact CD2-CG1 3.42Å; F202-V268 HydrophobicContact CE2-CG1 3.5Å; F202-V268 VanDerWaalsContact CE2-CG1 3.5Å; F202-V268 WeakPolarHBondContact CE2-O 3.38Å; F202-V268 HydrophobicContact CG-CG1 4.2Å; F202-V268 HydrophobicContact CZ-CG1 4.33Å |
| 203 | V | 84.5 | Confident | 83.6 | Confident | 68 Ų | 68 | 54.9 Ų | 54.9 | 41% | 0.412 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64.6 | -39.6 | -179.3 | 169.8 | 0 | 0 | 0 | 0 | 111.5 | W199 T200 A205 L206 I207 | W199-V203 WeakPolarHBondContact O-CB 3.39Å; W199-V203 VanDerWaalsContact O-CG2 3.3Å; W199-V203 WeakPolarHBondContact O-CG2 3.27Å; W199-V203 PolarHBondContact O-N 3.39Å; T200-V203 PolarHBondContact O-N 3.25Å; V203-A205 VanDerWaalsContact C-N 3.32Å; V203-A205 PolarHBondContact O-N 3.38Å; V203-L206 PolarHBondContact O-N 3.29Å; V203-I207 HydrophobicContact CG1-CD1 3.67Å; V203-I207 HydrophobicContact CG1-CG1 4.39Å; V203-I207 WeakPolarHBondContact O-CB 3.4Å; V203-I207 VanDerWaalsContact O-CG1 3.29Å; V203-I207 WeakPolarHBondContact O-CG1 3.5Å; V203-I207 PolarHBondContact O-N 2.97Å |
| 204 | R | 86.8 | Confident | 84.5 | Confident | 13 Ų | 13 | 56.2 Ų | 56.2 | 5% | 0.049 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -55 | -48.2 | 171.6 | 179.5 | -155.4 | 62.5 | -167.8 | 4.6 | 111.2 | V180 C184 T200 F202 N208 S277 | V180-R204 HydrophobicContact CG1-CB 4.08Å; V180-R204 HydrophobicContact CG1-CG 3.73Å; C184-R204 HydrophobicContact CB-CB 4.38Å; C184-R204 HydrophobicContact CB-CG 4.12Å; C184-R204 PolarHBondContact SG-NH1 2.92Å; C184-R204 VanDerWaalsContact SG-NH1 3.45Å; T200-R204 VanDerWaalsContact O-CB 3.32Å; T200-R204 WeakPolarHBondContact O-CB 3.13Å; T200-R204 PolarHBondContact O-N 2.87Å; F202-R204 PolarHBondContact O-N 2.99Å; R204-N208 WeakPolarHBondContact O-CB 3.23Å; R204-N208 PolarHBondContact O-N 3.45Å; R204-N208 PolarHBondContact O-ND2 3.01Å; R204-S277 PolarHBondContact NH1-OG 3.1Å; R204-S277 PolarHBondContact NH2-OG 3.34Å |
| 205 | A | 83.1 | Confident | 85.4 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.2 | -55.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | V201 F202 V203 I207 N208 D209 V268 P278 | V201-A205 PolarHBondContact O-N 3.45Å; V201-A205 VanDerWaalsContact O-N 3.13Å; F202-A205 WeakPolarHBondContact O-CB 3.3Å; F202-A205 PolarHBondContact O-N 2.92Å; F202-A205 VanDerWaalsContact O-N 3.16Å; V203-A205 VanDerWaalsContact C-N 3.32Å; V203-A205 PolarHBondContact O-N 3.38Å; A205-I207 VanDerWaalsContact C-N 3.28Å; A205-I207 PolarHBondContact O-N 3.2Å; A205-N208 PolarHBondContact O-N 3.34Å; A205-D209 WeakPolarHBondContact O-CB 3.16Å; A205-D209 PolarHBondContact O-N 3.5Å; A205-D209 VanDerWaalsContact O-OD2 3.09Å; A205-V268 HydrophobicContact CB-CG1 4.36Å; A205-V268 HydrophobicContact CB-CG2 3.91Å; A205-P278 HydrophobicContact CB-CB 4.38Å; A205-P278 HydrophobicContact CB-CG 3.31Å |
| 206 | L | 87.9 | Confident | 86.4 | Confident | 75 Ų | 75 | 44.7 Ų | 44.7 | 39% | 0.393 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -53.9 | -42.8 | -179.5 | -175.5 | 64.5 | 0 | 0 | 0 | 112.3 | F202 V203 S210 | F202-L206 HydrophobicContact CE1-CD2 4.26Å; F202-L206 PolarHBondContact O-N 2.93Å; V203-L206 PolarHBondContact O-N 3.29Å; L206-S210 WeakPolarHBondContact O-CB 3.37Å; L206-S210 PolarHBondContact O-N 2.84Å; L206-S210 VanDerWaalsContact O-N 3.11Å; L206-S210 PolarHBondContact O-OG 3.02Å |
| 207 | I | 90.4 | Very high | 87.2 | Confident | 57 Ų | 57 | 44.2 Ų | 44.2 | 29% | 0.292 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -66.1 | -51 | 175.7 | -67.4 | 166.9 | 0 | 0 | 0 | 111.2 | V180 V203 A205 S210 L211 | V180-I207 HydrophobicContact CG1-CB 4.48Å; V180-I207 HydrophobicContact CG1-CG2 4.41Å; V180-I207 HydrophobicContact CG2-CD1 4.35Å; V180-I207 HydrophobicContact CG2-CG2 4.23Å; V203-I207 HydrophobicContact CG1-CD1 3.67Å; V203-I207 HydrophobicContact CG1-CG1 4.39Å; V203-I207 WeakPolarHBondContact O-CB 3.4Å; V203-I207 VanDerWaalsContact O-CG1 3.29Å; V203-I207 WeakPolarHBondContact O-CG1 3.5Å; V203-I207 PolarHBondContact O-N 2.97Å; A205-I207 VanDerWaalsContact C-N 3.28Å; A205-I207 PolarHBondContact O-N 3.2Å; I207-S210 PolarHBondContact O-N 2.88Å; I207-L211 HydrophobicContact CG2-CD1 3.9Å; I207-L211 HydrophobicContact CG2-CG 4.45Å; I207-L211 WeakPolarHBondContact O-CB 3.41Å; I207-L211 VanDerWaalsContact O-CG 3.29Å; I207-L211 WeakPolarHBondContact O-CG 3.37Å; I207-L211 PolarHBondContact O-N 2.78Å |
| 208 | N | 90.5 | Very high | 88 | Confident | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.7 | -46.5 | -176.1 | -73.2 | -7.6 | 0 | 0 | 0 | 112.3 | F177 N181 R204 A205 L211 F212 F279 | F177-N208 HydrophobicContact CD2-CB 4.15Å; F177-N208 HydrophobicContact CE2-CB 3.56Å; F177-N208 HydrophobicContact CZ-CB 4.12Å; N181-N208 PolarHBondContact ND2-ND2 2.91Å; N181-N208 PolarHBondContact ND2-OD1 3.4Å; N181-N208 PolarHBondContact OD1-ND2 2.91Å; R204-N208 WeakPolarHBondContact O-CB 3.23Å; R204-N208 PolarHBondContact O-N 3.45Å; R204-N208 PolarHBondContact O-ND2 3.01Å; A205-N208 PolarHBondContact O-N 3.34Å; N208-L211 WeakPolarHBondContact O-CB 3.36Å; N208-L211 PolarHBondContact O-N 3.47Å; N208-F212 WeakPolarHBondContact O-CD2 3.37Å; N208-F212 PolarHBondContact O-N 3Å; N208-F279 HydrophobicContact CB-CE2 3.7Å; N208-F279 HydrophobicContact CB-CZ 3.54Å; N208-F279 WeakPolarHBondContact ND2-CE2 3.43Å; N208-F279 VanDerWaalsContact ND2-CZ 3.32Å; N208-F279 WeakPolarHBondContact ND2-CZ 3.47Å |
| 209 | D | 90.1 | Very high | 88.8 | Confident | 3 Ų | 3 | 40 Ų | 40 | 2% | 0.016 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -70.4 | -36.6 | -178.7 | -63.7 | -49.5 | 0 | 0 | 0 | 111 | A205 L211 F212 I213 A261 N264 | A205-D209 WeakPolarHBondContact O-CB 3.16Å; A205-D209 PolarHBondContact O-N 3.5Å; A205-D209 VanDerWaalsContact O-OD2 3.09Å; D209-L211 VanDerWaalsContact C-N 3.35Å; D209-L211 PolarHBondContact O-N 3.28Å; D209-F212 PolarHBondContact O-N 3.05Å; D209-I213 WeakPolarHBondContact O-CG1 3Å; D209-I213 PolarHBondContact O-N 3.31Å; D209-A261 HydrophobicContact CB-CB 4.08Å; D209-N264 PolarHBondContact OD1-ND2 3.47Å; D209-N264 VanDerWaalsContact OD2-CB 3.3Å; D209-N264 WeakPolarHBondContact OD2-CB 3.42Å |
| 210 | S | 91.5 | Very high | 89.6 | Confident | 45 Ų | 45 | 35.2 Ų | 35.2 | 32% | 0.315 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -61.5 | -41.1 | 170.4 | -63.3 | 0 | 0 | 0 | 0 | 112.2 | L206 I207 I213 L214 | L206-S210 WeakPolarHBondContact O-CB 3.37Å; L206-S210 PolarHBondContact O-N 2.84Å; L206-S210 VanDerWaalsContact O-N 3.11Å; L206-S210 PolarHBondContact O-OG 3.02Å; I207-S210 PolarHBondContact O-N 2.88Å; S210-I213 PolarHBondContact O-N 3.14Å; S210-L214 WeakPolarHBondContact O-CB 3.27Å; S210-L214 VanDerWaalsContact O-CG 3.31Å; S210-L214 WeakPolarHBondContact O-CG 3.28Å; S210-L214 PolarHBondContact O-N 3.35Å |
| 211 | L | 92.9 | Very high | 90.2 | Very high | 23 Ų | 23 | 36.2 Ų | 36.2 | 12% | 0.12 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.5 | -40.8 | 175.3 | -75 | 171 | 0 | 0 | 0 | 111.6 | F136 A173 L176 F177 I207 N208 D209 C215 | F136-L211 HydrophobicContact CE2-CB 3.84Å; F136-L211 HydrophobicContact CZ-CB 3.83Å; A173-L211 HydrophobicContact CB-CD2 4.33Å; L176-L211 HydrophobicContact CD2-CD1 4.21Å; L176-L211 HydrophobicContact CG-CD1 4.34Å; F177-L211 HydrophobicContact CB-CD1 4.19Å; F177-L211 HydrophobicContact CD2-CD1 4.17Å; I207-L211 HydrophobicContact CG2-CD1 3.9Å; I207-L211 HydrophobicContact CG2-CG 4.45Å; I207-L211 WeakPolarHBondContact O-CB 3.41Å; I207-L211 VanDerWaalsContact O-CG 3.29Å; I207-L211 WeakPolarHBondContact O-CG 3.37Å; I207-L211 PolarHBondContact O-N 2.78Å; N208-L211 WeakPolarHBondContact O-CB 3.36Å; N208-L211 PolarHBondContact O-N 3.47Å; D209-L211 VanDerWaalsContact C-N 3.35Å; D209-L211 PolarHBondContact O-N 3.28Å; L211-C215 WeakPolarHBondContact O-CB 3.38Å; L211-C215 PolarHBondContact O-N 3.22Å |
| 212 | F | 92.4 | Very high | 90.7 | Very high | 4 Ų | 4 | 36.7 Ų | 36.7 | 2% | 0.018 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.7 | -45.8 | 172.6 | -87.6 | -69.9 | 0 | 0 | 0 | 112.2 | F136 L139 F177 N208 D209 C215 A216 Y257 A261 | F136-F212 HydrophobicContact CB-CE1 4.14Å; F136-F212 HydrophobicContact CB-CE2 4.41Å; F136-F212 HydrophobicContact CB-CZ 3.8Å; F136-F212 AromaticContact CD2-CD1 3.88Å; F136-F212 HydrophobicContact CD2-CD1 3.88Å; F136-F212 HydrophobicContact CD2-CD2 4.3Å; F136-F212 AromaticContact CD2-CE1 3.8Å; F136-F212 HydrophobicContact CD2-CE1 3.8Å; F136-F212 HydrophobicContact CD2-CE2 4.24Å; F136-F212 HydrophobicContact CD2-CG 4.12Å; F136-F212 AromaticContact CD2-CZ 3.98Å; F136-F212 HydrophobicContact CD2-CZ 3.98Å; F136-F212 HydrophobicContact CG-CE1 4.49Å; F136-F212 HydrophobicContact CG-CZ 4.39Å; L139-F212 HydrophobicContact CD2-CD1 3.8Å; L139-F212 HydrophobicContact CD2-CE1 4.2Å; F177-F212 AromaticContact CE2-CD2 3.98Å; F177-F212 HydrophobicContact CE2-CD2 3.98Å; F177-F212 AromaticContact CE2-CE2 3.54Å; F177-F212 HydrophobicContact CE2-CE2 3.54Å; F177-F212 HydrophobicContact CE2-CZ 4.3Å; F177-F212 AromaticContact CZ-CE2 3.7Å; F177-F212 HydrophobicContact CZ-CE2 3.7Å; F177-F212 HydrophobicContact CZ-CZ 4.29Å; N208-F212 WeakPolarHBondContact O-CD2 3.37Å; N208-F212 PolarHBondContact O-N 3Å; D209-F212 PolarHBondContact O-N 3.05Å; F212-C215 PolarHBondContact O-N 3.07Å; F212-A216 WeakPolarHBondContact O-CB 3.33Å; F212-A216 PolarHBondContact O-N 2.93Å; F212-Y257 AromaticContact CD1-CD1 3.78Å; F212-Y257 HydrophobicContact CD1-CD1 3.78Å; F212-Y257 HydrophobicContact CD1-CG 4.17Å; F212-Y257 AromaticContact CE1-CD1 3.51Å; F212-Y257 HydrophobicContact CE1-CD1 3.51Å; F212-Y257 AromaticContact CE1-CE1 3.86Å; F212-Y257 HydrophobicContact CE1-CE1 3.86Å; F212-Y257 HydrophobicContact CE1-CG 4.25Å; F212-Y257 HydrophobicContact CZ-CD1 4.39Å; F212-A261 HydrophobicContact CB-CB 4Å |
| 213 | I | 93.5 | Very high | 91.2 | Very high | 44 Ų | 44 | 34.6 Ų | 34.6 | 23% | 0.226 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63 | -45.6 | 179.1 | -68.6 | 164.5 | 0 | 0 | 0 | 111.1 | D209 S210 C215 A216 I217 A261 L265 | D209-I213 WeakPolarHBondContact O-CG1 3Å; D209-I213 PolarHBondContact O-N 3.31Å; S210-I213 PolarHBondContact O-N 3.14Å; I213-C215 VanDerWaalsContact C-N 3.34Å; I213-C215 PolarHBondContact O-N 2.79Å; I213-A216 PolarHBondContact O-N 2.94Å; I213-I217 HydrophobicContact CG2-CD1 3.87Å; I213-I217 WeakPolarHBondContact O-CG1 3.48Å; I213-I217 PolarHBondContact O-N 3.13Å; I213-A261 HydrophobicContact CD1-CB 4.19Å; I213-A261 HydrophobicContact CG1-CB 3.86Å; I213-L265 HydrophobicContact CD1-CD1 4.49Å |
| 214 | L | 93.9 | Very high | 91.5 | Very high | 111 Ų | 111 | 34.4 Ų | 34.4 | 58% | 0.581 | 20% | 0.195 | S | C | * | . | H | α-helix | trans | -60.7 | -42.1 | 175.5 | -71.5 | 169.5 | 0 | 0 | 0 | 112.1 | S210 A216 I217 S218 | S210-L214 WeakPolarHBondContact O-CB 3.27Å; S210-L214 VanDerWaalsContact O-CG 3.31Å; S210-L214 WeakPolarHBondContact O-CG 3.28Å; S210-L214 PolarHBondContact O-N 3.35Å; L214-A216 VanDerWaalsContact C-N 3.31Å; L214-A216 PolarHBondContact O-N 3.41Å; L214-I217 PolarHBondContact O-N 3.06Å; L214-S218 PolarHBondContact O-N 3.34Å; L214-S218 PolarHBondContact O-OG 2.89Å |
| 215 | C | 93.9 | Very high | 91.6 | Very high | 5 Ų | 5 | 39.1 Ų | 39.1 | 3% | 0.034 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -70.4 | -26.2 | 179.1 | -158.9 | 0 | 0 | 0 | 0 | 112.8 | F136 L139 N143 L211 F212 I213 S218 L219 | F136-C215 HydrophobicContact CE2-CB 4.06Å; L139-C215 HydrophobicContact CD2-CB 3.95Å; L139-C215 HydrophobicContact CG-CB 4.41Å; N143-C215 PolarHBondContact ND2-O 3.38Å; N143-C215 PolarHBondContact ND2-SG 3.12Å; N143-C215 PolarHBondContact OD1-O 3.46Å; L211-C215 WeakPolarHBondContact O-CB 3.38Å; L211-C215 PolarHBondContact O-N 3.22Å; F212-C215 PolarHBondContact O-N 3.07Å; I213-C215 VanDerWaalsContact C-N 3.34Å; I213-C215 PolarHBondContact O-N 2.79Å; C215-S218 WeakPolarHBondContact CA-OG 3.43Å; C215-S218 PolarHBondContact O-OG 2.94Å; C215-L219 WeakPolarHBondContact O-CB 3.29Å; C215-L219 PolarHBondContact O-N 3.14Å |
| 216 | A | 94.2 | Very high | 91.8 | Very high | 3 Ų | 3 | 39.2 Ų | 39.2 | 3% | 0.025 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -74.5 | -42.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F212 I213 L214 S218 L219 V220 I254 S258 | F212-A216 WeakPolarHBondContact O-CB 3.33Å; F212-A216 PolarHBondContact O-N 2.93Å; I213-A216 PolarHBondContact O-N 2.94Å; L214-A216 VanDerWaalsContact C-N 3.31Å; L214-A216 PolarHBondContact O-N 3.41Å; A216-S218 VanDerWaalsContact C-N 3.34Å; A216-S218 PolarHBondContact O-N 3.36Å; A216-L219 WeakPolarHBondContact O-CB 3.19Å; A216-L219 PolarHBondContact O-N 3.39Å; A216-L219 VanDerWaalsContact O-N 3.11Å; A216-V220 WeakPolarHBondContact O-CG2 3.13Å; A216-V220 PolarHBondContact O-N 3.3Å; A216-I254 HydrophobicContact CB-CG2 4.48Å; A216-S258 WeakPolarHBondContact CB-OG 3.39Å |
| 217 | I | 93.9 | Very high | 91.7 | Very high | 99 Ų | 99 | 39 Ų | 39 | 51% | 0.508 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -62.5 | -40.1 | 176.5 | -68.2 | 164.1 | 0 | 0 | 0 | 111.3 | I213 L214 S221 | I213-I217 HydrophobicContact CG2-CD1 3.87Å; I213-I217 WeakPolarHBondContact O-CG1 3.48Å; I213-I217 PolarHBondContact O-N 3.13Å; L214-I217 PolarHBondContact O-N 3.06Å; I217-S221 WeakPolarHBondContact O-CB 3.47Å; I217-S221 PolarHBondContact O-N 2.91Å; I217-S221 PolarHBondContact O-OG 3.3Å |
| 218 | S | 93.4 | Very high | 91.6 | Very high | 24 Ų | 24 | 44.8 Ų | 44.8 | 17% | 0.168 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.5 | -38.9 | 172.5 | 60.2 | 0 | 0 | 0 | 0 | 111.9 | N143 L214 C215 A216 S221 Y222 | N143-S218 WeakPolarHBondContact OD1-CB 3.42Å; N143-S218 PolarHBondContact OD1-OG 2.86Å; L214-S218 PolarHBondContact O-N 3.34Å; L214-S218 PolarHBondContact O-OG 2.89Å; C215-S218 WeakPolarHBondContact CA-OG 3.43Å; C215-S218 PolarHBondContact O-OG 2.94Å; A216-S218 VanDerWaalsContact C-N 3.34Å; A216-S218 PolarHBondContact O-N 3.36Å; S218-S221 CarbonylContact O-C 3.5Å; S218-S221 WeakPolarHBondContact O-CA 3.43Å; S218-S221 WeakPolarHBondContact O-CB 3.31Å; S218-S221 PolarHBondContact O-N 3.47Å; S218-S221 VanDerWaalsContact O-N 3.13Å; S218-Y222 WeakPolarHBondContact O-CD2 3.35Å; S218-Y222 PolarHBondContact O-N 3Å |
| 219 | L | 92.9 | Very high | 91.3 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.9 | -44.5 | 179.8 | -169.1 | 56.7 | 0 | 0 | 0 | 111.8 | L139 L142 N143 L146 C215 A216 S221 Y222 I223 V253 I254 | L139-L219 HydrophobicContact CD1-CD2 3.75Å; L142-L219 HydrophobicContact CD2-CD1 4.35Å; L142-L219 HydrophobicContact CD2-CD2 3.98Å; L142-L219 HydrophobicContact CG-CD1 4.18Å; N143-L219 WeakPolarHBondContact OD1-CA 3.48Å; N143-L219 PolarHBondContact OD1-N 2.91Å; L146-L219 HydrophobicContact CD1-CD1 3.71Å; L146-L219 HydrophobicContact CG-CD1 4.45Å; C215-L219 WeakPolarHBondContact O-CB 3.29Å; C215-L219 PolarHBondContact O-N 3.14Å; A216-L219 WeakPolarHBondContact O-CB 3.19Å; A216-L219 PolarHBondContact O-N 3.39Å; A216-L219 VanDerWaalsContact O-N 3.11Å; L219-S221 VanDerWaalsContact C-N 3.28Å; L219-S221 PolarHBondContact O-N 3.24Å; L219-Y222 PolarHBondContact O-N 3.22Å; L219-I223 HydrophobicContact CD1-CD1 4.44Å; L219-I223 HydrophobicContact CG-CD1 4.11Å; L219-I223 VanDerWaalsContact O-CG1 3.31Å; L219-I223 WeakPolarHBondContact O-CG1 3.3Å; L219-I223 PolarHBondContact O-N 3.45Å; L219-V253 HydrophobicContact CD2-CG1 3.71Å; L219-I254 HydrophobicContact CB-CD1 4.22Å; L219-I254 HydrophobicContact CB-CG1 4.15Å; L219-I254 HydrophobicContact CD2-CD1 4.3Å; L219-I254 HydrophobicContact CD2-CG1 3.86Å; L219-I254 HydrophobicContact CG-CD1 4.01Å; L219-I254 HydrophobicContact CG-CG1 4.05Å |
| 220 | V | 95.1 | Very high | 90.9 | Very high | 61 Ų | 61 | 51.7 Ų | 51.7 | 37% | 0.37 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -53.2 | -48.7 | 168.7 | 173 | 0 | 0 | 0 | 0 | 110 | A216 Y222 I223 C224 I254 | A216-V220 WeakPolarHBondContact O-CG2 3.13Å; A216-V220 PolarHBondContact O-N 3.3Å; V220-Y222 VanDerWaalsContact C-N 3.31Å; V220-Y222 PolarHBondContact O-N 2.96Å; V220-I223 PolarHBondContact O-N 3.11Å; V220-C224 VanDerWaalsContact O-CB 3.3Å; V220-C224 WeakPolarHBondContact O-CB 3.39Å; V220-C224 PolarHBondContact O-N 3.46Å; V220-C224 PolarHBondContact O-SG 3.44Å; V220-C224 VanDerWaalsContact O-SG 3.36Å; V220-I254 HydrophobicContact CB-CD1 4.41Å; V220-I254 HydrophobicContact CG2-CD1 3.58Å; V220-I254 HydrophobicContact CG2-CG1 4.21Å; V220-I254 HydrophobicContact CG2-CG2 3.93Å |
| 221 | S | 91.9 | Very high | 90.4 | Very high | 55 Ų | 55 | 53 Ų | 53 | 39% | 0.385 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.7 | -32.3 | -177.4 | -60.9 | 0 | 0 | 0 | 0 | 113.6 | I217 S218 L219 K225 | I217-S221 WeakPolarHBondContact O-CB 3.47Å; I217-S221 PolarHBondContact O-N 2.91Å; I217-S221 PolarHBondContact O-OG 3.3Å; S218-S221 CarbonylContact O-C 3.5Å; S218-S221 WeakPolarHBondContact O-CA 3.43Å; S218-S221 WeakPolarHBondContact O-CB 3.31Å; S218-S221 PolarHBondContact O-N 3.47Å; S218-S221 VanDerWaalsContact O-N 3.13Å; L219-S221 VanDerWaalsContact C-N 3.28Å; L219-S221 PolarHBondContact O-N 3.24Å; S221-K225 WeakPolarHBondContact O-CG 3.24Å; S221-K225 PolarHBondContact O-N 2.98Å |
| 222 | Y | 90.8 | Very high | 89.6 | Confident | 24 Ų | 24 | 51.9 Ų | 51.9 | 9% | 0.094 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -76.6 | -43.8 | 174.3 | -65.2 | -51 | 0 | 0 | 0 | 112.1 | N143 L146 A147 I150 F170 S218 L219 V220 C224 K225 I226 | N143-Y222 HydrophobicContact CB-CD2 4.4Å; N143-Y222 HydrophobicContact CB-CE2 4.17Å; N143-Y222 WeakPolarHBondContact OD1-CD2 3.46Å; N143-Y222 WeakPolarHBondContact OD1-CE2 3.14Å; L146-Y222 HydrophobicContact CB-CG 4.46Å; A147-Y222 HydrophobicContact CB-CD1 4.47Å; A147-Y222 HydrophobicContact CB-CE1 3.99Å; A147-Y222 HydrophobicContact CB-CE2 4.42Å; I150-Y222 HydrophobicContact CD1-CD1 3.64Å; I150-Y222 HydrophobicContact CD1-CG 4.27Å; F170-Y222 HydrophobicContact CE2-CE2 4.21Å; F170-Y222 HydrophobicContact CZ-CE2 4.09Å; S218-Y222 WeakPolarHBondContact O-CD2 3.35Å; S218-Y222 PolarHBondContact O-N 3Å; L219-Y222 PolarHBondContact O-N 3.22Å; V220-Y222 VanDerWaalsContact C-N 3.31Å; V220-Y222 PolarHBondContact O-N 2.96Å; Y222-C224 PolarHBondContact O-N 3.3Å; Y222-K225 PolarHBondContact O-N 3.02Å; Y222-K225 VanDerWaalsContact O-N 3.1Å; Y222-I226 WeakPolarHBondContact O-CB 3.41Å; Y222-I226 PolarHBondContact O-N 3.15Å |
| 223 | I | 91.5 | Very high | 89.1 | Confident | 12 Ų | 12 | 53.9 Ų | 53.9 | 6% | 0.062 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.8 | -47.5 | 176.4 | -65.7 | 164.1 | 0 | 0 | 0 | 110.2 | L146 L219 V220 K225 I226 T227 V247 I254 | L146-I223 HydrophobicContact CD1-CG1 3.66Å; L219-I223 HydrophobicContact CD1-CD1 4.44Å; L219-I223 HydrophobicContact CG-CD1 4.11Å; L219-I223 VanDerWaalsContact O-CG1 3.31Å; L219-I223 WeakPolarHBondContact O-CG1 3.3Å; L219-I223 PolarHBondContact O-N 3.45Å; V220-I223 PolarHBondContact O-N 3.11Å; I223-K225 PolarHBondContact O-N 3.28Å; I223-I226 PolarHBondContact O-N 3Å; I223-T227 HydrophobicContact CG2-CG2 4.43Å; I223-T227 PolarHBondContact O-N 2.92Å; I223-T227 PolarHBondContact O-OG1 2.94Å; I223-T227 VanDerWaalsContact O-OG1 3.12Å; I223-V247 HydrophobicContact CG2-CB 4.5Å; I223-V247 HydrophobicContact CG2-CG2 3.93Å; I223-I254 HydrophobicContact CD1-CD1 3.68Å |
| 224 | C | 90 | Very high | 88.5 | Confident | 64 Ų | 64 | 55.9 Ų | 55.9 | 43% | 0.432 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -66.2 | -14.1 | 176.7 | -70.7 | 0 | 0 | 0 | 0 | 114.8 | V220 Y222 K228 | V220-C224 VanDerWaalsContact O-CB 3.3Å; V220-C224 WeakPolarHBondContact O-CB 3.39Å; V220-C224 PolarHBondContact O-N 3.46Å; V220-C224 PolarHBondContact O-SG 3.44Å; V220-C224 VanDerWaalsContact O-SG 3.36Å; Y222-C224 PolarHBondContact O-N 3.3Å; C224-K228 WeakPolarHBondContact O-CD 3.35Å; C224-K228 WeakPolarHBondContact O-CG 3.49Å |
| 225 | K | 89.4 | Confident | 87.9 | Confident | 112 Ų | 112 | 53.6 Ų | 53.6 | 49% | 0.487 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -89.6 | -42.8 | 169.5 | -80.5 | 173.3 | 179.3 | 170.7 | 0 | 111.3 | I150 S221 Y222 I223 K228 M229 | I150-K225 HydrophobicContact CD1-CB 4.01Å; S221-K225 WeakPolarHBondContact O-CG 3.24Å; S221-K225 PolarHBondContact O-N 2.98Å; Y222-K225 PolarHBondContact O-N 3.02Å; Y222-K225 VanDerWaalsContact O-N 3.1Å; I223-K225 PolarHBondContact O-N 3.28Å; K225-K228 PolarHBondContact O-N 3.22Å; K225-M229 WeakPolarHBondContact O-CG 3.45Å; K225-M229 PolarHBondContact O-N 3.3Å |
| 226 | I | 87.4 | Confident | 87.2 | Confident | 2 Ų | 2 | 53.3 Ų | 53.3 | 1% | 0.01 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.2 | -46.4 | 177.1 | -79.4 | 173.4 | 0 | 0 | 0 | 111.2 | L146 V149 I150 Y222 I223 K228 M229 L236 L243 | L146-I226 HydrophobicContact CB-CD1 3.75Å; L146-I226 HydrophobicContact CD1-CD1 4.23Å; L146-I226 HydrophobicContact CD2-CD1 3.82Å; L146-I226 HydrophobicContact CG-CD1 4.13Å; V149-I226 HydrophobicContact CB-CD1 4.47Å; V149-I226 HydrophobicContact CG1-CD1 4.14Å; V149-I226 HydrophobicContact CG1-CG1 4.43Å; I150-I226 HydrophobicContact CD1-CD1 4.3Å; I150-I226 HydrophobicContact CD1-CG1 3.93Å; I150-I226 HydrophobicContact CG1-CD1 4.08Å; I150-I226 HydrophobicContact CG1-CG1 3.55Å; Y222-I226 WeakPolarHBondContact O-CB 3.41Å; Y222-I226 PolarHBondContact O-N 3.15Å; I223-I226 PolarHBondContact O-N 3Å; I226-K228 PolarHBondContact O-N 3.35Å; I226-M229 PolarHBondContact O-N 2.78Å; I226-L236 HydrophobicContact CG2-CD1 3.74Å; I226-L243 HydrophobicContact CG2-CD2 3.34Å |
| 227 | T | 87.1 | Confident | 86.5 | Confident | 70 Ų | 70 | 58.7 Ų | 58.7 | 43% | 0.429 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -20 | 178.5 | 53.7 | 0 | 0 | 0 | 0 | 114 | I223 V247 | I223-T227 HydrophobicContact CG2-CG2 4.43Å; I223-T227 PolarHBondContact O-N 2.92Å; I223-T227 PolarHBondContact O-OG1 2.94Å; I223-T227 VanDerWaalsContact O-OG1 3.12Å; T227-V247 HydrophobicContact CG2-CG2 3.5Å; T227-V247 VanDerWaalsContact CG2-CG2 3.5Å |
| 228 | K | 87.6 | Confident | 85.7 | Confident | 179 Ų | 179 | 58.2 Ų | 58.2 | 78% | 0.778 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89 | -9.7 | 174.8 | -68.4 | -178 | -178.3 | -175.5 | 0 | 113.6 | C224 K225 I226 | C224-K228 WeakPolarHBondContact O-CD 3.35Å; C224-K228 WeakPolarHBondContact O-CG 3.49Å; K225-K228 PolarHBondContact O-N 3.22Å; I226-K228 PolarHBondContact O-N 3.35Å |
| 229 | M | 84.4 | Confident | 84.7 | Confident | 48 Ų | 48 | 61.2 Ų | 61.2 | 24% | 0.236 | 34% | 0.336 | C | S | . | . | trans | -109.2 | 99.2 | -176.8 | -70.6 | -179.9 | -178 | 0 | 0 | 110.4 | I150 K225 I226 S231 A232 N233 | I150-M229 HydrophobicContact CG2-CE 4.44Å; I150-M229 HydrophobicContact CG2-SD 4.25Å; K225-M229 WeakPolarHBondContact O-CG 3.45Å; K225-M229 PolarHBondContact O-N 3.3Å; I226-M229 PolarHBondContact O-N 2.78Å; M229-S231 PolarHBondContact O-N 3Å; M229-A232 HydrophobicContact CB-CB 3.77Å; M229-A232 WeakPolarHBondContact O-CA 3.45Å; M229-A232 VanDerWaalsContact O-CB 3.32Å; M229-A232 WeakPolarHBondContact O-CB 3.2Å; M229-A232 PolarHBondContact O-N 3.39Å; M229-N233 PolarHBondContact O-N 3.26Å | ||
| 230 | S | 80.7 | Confident | 83.7 | Confident | 100 Ų | 100 | 62.7 Ų | 62.7 | 70% | 0.699 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -55.2 | -36.6 | 178.4 | -173.1 | 0 | 0 | 0 | 0 | 112.8 | A232 N233 V234 | S230-A232 VanDerWaalsContact C-N 3.28Å; S230-A232 PolarHBondContact O-N 2.81Å; S230-N233 VanDerWaalsContact O-CB 3.28Å; S230-N233 WeakPolarHBondContact O-CB 3.48Å; S230-N233 PolarHBondContact O-N 2.9Å; S230-N233 VanDerWaalsContact O-N 3.15Å; S230-V234 PolarHBondContact O-N 3.33Å |
| 231 | S | 80.5 | Confident | 82.8 | Confident | 73 Ų | 73 | 60.5 Ų | 60.5 | 51% | 0.51 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -66.7 | -23.7 | 173.5 | 45.3 | 0 | 0 | 0 | 0 | 114.2 | V153 M229 Y235 | V153-S231 WeakPolarHBondContact CG1-OG 3.47Å; M229-S231 PolarHBondContact O-N 3Å; S231-Y235 PolarHBondContact O-N 3.35Å |
| 232 | A | 78.1 | Confident | 82.4 | Confident | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -77.1 | -28.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | V149 V153 M229 S230 Y235 L236 | V149-A232 HydrophobicContact CG1-CB 4.43Å; V153-A232 HydrophobicContact CG1-CB 4.25Å; V153-A232 HydrophobicContact CG2-CB 4.11Å; M229-A232 HydrophobicContact CB-CB 3.77Å; M229-A232 WeakPolarHBondContact O-CA 3.45Å; M229-A232 VanDerWaalsContact O-CB 3.32Å; M229-A232 WeakPolarHBondContact O-CB 3.2Å; M229-A232 PolarHBondContact O-N 3.39Å; S230-A232 VanDerWaalsContact C-N 3.28Å; S230-A232 PolarHBondContact O-N 2.81Å; A232-Y235 PolarHBondContact O-N 2.85Å; A232-L236 WeakPolarHBondContact O-CG 3.38Å; A232-L236 PolarHBondContact O-N 2.92Å; A232-L236 VanDerWaalsContact O-N 3.1Å |
| 233 | N | 81.6 | Confident | 82.1 | Confident | 46 Ų | 46 | 61.1 Ų | 61.1 | 25% | 0.246 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -58.1 | -55.6 | 169.2 | -175.2 | 46.5 | 0 | 0 | 0 | 110.2 | M229 S230 Y235 L236 E237 L243 | M229-N233 PolarHBondContact O-N 3.26Å; S230-N233 VanDerWaalsContact O-CB 3.28Å; S230-N233 WeakPolarHBondContact O-CB 3.48Å; S230-N233 PolarHBondContact O-N 2.9Å; S230-N233 VanDerWaalsContact O-N 3.15Å; N233-Y235 VanDerWaalsContact C-N 3.25Å; N233-Y235 PolarHBondContact O-N 2.76Å; N233-L236 PolarHBondContact O-N 3.25Å; N233-E237 VanDerWaalsContact O-CB 3.32Å; N233-E237 WeakPolarHBondContact O-CB 3.28Å; N233-E237 PolarHBondContact O-N 3.32Å; N233-L243 HydrophobicContact CB-CD1 3.56Å; N233-L243 HydrophobicContact CB-CG 4.01Å; N233-L243 VanDerWaalsContact OD1-CD1 3.29Å; N233-L243 WeakPolarHBondContact OD1-CD1 3.28Å; N233-L243 WeakPolarHBondContact OD1-CG 3.29Å |
| 234 | V | 81.2 | Confident | 81.8 | Confident | 86 Ų | 86 | 64.8 Ų | 64.8 | 52% | 0.521 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -60.5 | -33.8 | -177.8 | -175.7 | 0 | 0 | 0 | 0 | 111.9 | S230 S238 | S230-V234 PolarHBondContact O-N 3.33Å; V234-S238 VanDerWaalsContact O-CB 3.28Å; V234-S238 WeakPolarHBondContact O-CB 3.33Å; V234-S238 PolarHBondContact O-N 3.29Å; V234-S238 PolarHBondContact O-OG 2.96Å |
| 235 | Y | 80.3 | Confident | 81.7 | Confident | 62 Ų | 62 | 63.9 Ų | 63.9 | 24% | 0.243 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -71 | -34.6 | 174.9 | -171.4 | -99.9 | 0 | 0 | 0 | 113.9 | V149 K152 V153 S231 A232 N233 S238 K239 | V149-Y235 HydrophobicContact CB-CD1 4.4Å; V149-Y235 HydrophobicContact CG1-CD1 4.03Å; V149-Y235 HydrophobicContact CG2-CD1 4.09Å; V149-Y235 HydrophobicContact CG2-CE1 4.05Å; K152-Y235 HydrophobicContact CD-CE1 4.26Å; K152-Y235 VanDerWaalsContact CD-OH 3.32Å; K152-Y235 WeakPolarHBondContact CD-OH 3.33Å; V153-Y235 HydrophobicContact CG2-CG 4.17Å; S231-Y235 PolarHBondContact O-N 3.35Å; A232-Y235 PolarHBondContact O-N 2.85Å; N233-Y235 VanDerWaalsContact C-N 3.25Å; N233-Y235 PolarHBondContact O-N 2.76Å; Y235-S238 PolarHBondContact O-OG 3.02Å; Y235-K239 HydrophobicContact CE1-CD 4.16Å; Y235-K239 VanDerWaalsContact OH-CE 3.25Å; Y235-K239 WeakPolarHBondContact OH-CE 3.31Å |
| 236 | L | 78.4 | Confident | 81.6 | Confident | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -73.5 | -43 | 174.4 | -69.1 | 170.3 | 0 | 0 | 0 | 111 | V149 I226 A232 N233 K239 G240 M241 L243 T246 | V149-L236 HydrophobicContact CG1-CD2 4.11Å; V149-L236 HydrophobicContact CG1-CG 4.22Å; V149-L236 HydrophobicContact CG2-CD2 3.92Å; I226-L236 HydrophobicContact CG2-CD1 3.74Å; A232-L236 WeakPolarHBondContact O-CG 3.38Å; A232-L236 PolarHBondContact O-N 2.92Å; A232-L236 VanDerWaalsContact O-N 3.1Å; N233-L236 PolarHBondContact O-N 3.25Å; L236-K239 CarbonylContact O-C 3.58Å; L236-K239 WeakPolarHBondContact O-CA 3.39Å; L236-K239 WeakPolarHBondContact O-CB 3.47Å; L236-K239 PolarHBondContact O-N 3.38Å; L236-K239 VanDerWaalsContact O-N 3.1Å; L236-G240 PolarHBondContact O-N 2.97Å; L236-M241 CarbonylContact C-O 3.3Å; L236-M241 HydrophobicContact CB-CE 4.3Å; L236-M241 HydrophobicContact CD2-CE 3.49Å; L236-M241 VanDerWaalsContact CD2-CE 3.49Å; L236-M241 HydrophobicContact CD2-SD 4.24Å; L236-M241 PolarHBondContact O-N 3.24Å; L236-M241 VanDerWaalsContact O-O 3.06Å; L236-L243 HydrophobicContact CD1-CD2 3.83Å; L236-L243 HydrophobicContact CD1-CG 4.49Å; L236-T246 HydrophobicContact CD1-CG2 4.45Å |
| 237 | E | 80.8 | Confident | 81.8 | Confident | 115 Ų | 115 | 60.9 Ų | 60.9 | 54% | 0.537 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -64.9 | -41.8 | -179.6 | -174.3 | 165.8 | -152.1 | 0 | 0 | 112.2 | N233 K239 G240 M241 | N233-E237 VanDerWaalsContact O-CB 3.32Å; N233-E237 WeakPolarHBondContact O-CB 3.28Å; N233-E237 PolarHBondContact O-N 3.32Å; E237-K239 PolarHBondContact O-N 2.93Å; E237-G240 WeakPolarHBondContact O-CA 3.43Å; E237-G240 PolarHBondContact O-N 3.45Å; E237-M241 WeakPolarHBondContact CA-O 3.22Å; E237-M241 PolarHBondContact N-O 2.92Å |
| 238 | S | 76.4 | Confident | 82 | Confident | 89 Ų | 89 | 61.4 Ų | 61.4 | 62% | 0.622 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.6 | -18.4 | 172.8 | 54.7 | 0 | 0 | 0 | 0 | 114.2 | V234 Y235 | V234-S238 VanDerWaalsContact O-CB 3.28Å; V234-S238 WeakPolarHBondContact O-CB 3.33Å; V234-S238 PolarHBondContact O-N 3.29Å; V234-S238 PolarHBondContact O-OG 2.96Å; Y235-S238 PolarHBondContact O-OG 3.02Å |
| 239 | K | 73.1 | Confident | 82.2 | Confident | 88 Ų | 88 | 53.7 Ų | 53.7 | 38% | 0.383 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.9 | -2.2 | 165.9 | -79.3 | -171.4 | 172.7 | -175.3 | 0 | 113.8 | Y235 L236 E237 M241 | Y235-K239 HydrophobicContact CE1-CD 4.16Å; Y235-K239 VanDerWaalsContact OH-CE 3.25Å; Y235-K239 WeakPolarHBondContact OH-CE 3.31Å; L236-K239 CarbonylContact O-C 3.58Å; L236-K239 WeakPolarHBondContact O-CA 3.39Å; L236-K239 WeakPolarHBondContact O-CB 3.47Å; L236-K239 PolarHBondContact O-N 3.38Å; L236-K239 VanDerWaalsContact O-N 3.1Å; E237-K239 PolarHBondContact O-N 2.93Å; K239-M241 HydrophobicContact CB-CE 3.51Å; K239-M241 HydrophobicContact CD-CE 3.78Å; K239-M241 HydrophobicContact CG-CE 4.32Å |
| 240 | G | 70.6 | Confident | 82.6 | Confident | 30 Ų | 30 | 51.6 Ų | 51.6 | 31% | 0.309 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81.1 | 20.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | L236 E237 | L236-G240 PolarHBondContact O-N 2.97Å; E237-G240 WeakPolarHBondContact O-CA 3.43Å; E237-G240 PolarHBondContact O-N 3.45Å |
| 241 | M | 78 | Confident | 83.1 | Confident | 15 Ų | 15 | 49.2 Ų | 49.2 | 7% | 0.074 | 29% | 0.292 | C | S | . | . | trans | -109.9 | 138.3 | 167.7 | -52.9 | 156.8 | -73.2 | 0 | 0 | 109.6 | Y145 L236 E237 K239 F321 | Y145-M241 HydrophobicContact CE1-CE 4.36Å; Y145-M241 HydrophobicContact CE1-SD 3.86Å; Y145-M241 WeakPolarHBondContact OH-CE 3.35Å; Y145-M241 PolarHBondContact OH-SD 2.84Å; L236-M241 CarbonylContact C-O 3.3Å; L236-M241 HydrophobicContact CB-CE 4.3Å; L236-M241 HydrophobicContact CD2-CE 3.49Å; L236-M241 VanDerWaalsContact CD2-CE 3.49Å; L236-M241 HydrophobicContact CD2-SD 4.24Å; L236-M241 PolarHBondContact O-N 3.24Å; L236-M241 VanDerWaalsContact O-O 3.06Å; E237-M241 WeakPolarHBondContact CA-O 3.22Å; E237-M241 PolarHBondContact N-O 2.92Å; K239-M241 HydrophobicContact CB-CE 3.51Å; K239-M241 HydrophobicContact CD-CE 3.78Å; K239-M241 HydrophobicContact CG-CE 4.32Å; M241-F321 HydrophobicContact CG-CE2 4.41Å; M241-F321 HydrophobicContact SD-CE1 4.28Å; M241-F321 HydrophobicContact SD-CE2 4.08Å; M241-F321 HydrophobicContact SD-CZ 3.69Å | ||
| 242 | S | 83.1 | Confident | 83.8 | Confident | 54 Ų | 54 | 48 Ų | 48 | 38% | 0.378 | 28% | 0.281 | S | S | . | . | trans | -83.2 | 151.2 | 171.2 | 68 | 0 | 0 | 0 | 0 | 112.1 | C244 Q245 T246 | S242-C244 VanDerWaalsContact C-N 3.26Å; S242-C244 PolarHBondContact O-N 3.47Å; S242-Q245 PolarHBondContact O-N 3.41Å; S242-Q245 WeakPolarHBondContact OG-CB 3.33Å; S242-Q245 PolarHBondContact OG-N 2.99Å; S242-T246 PolarHBondContact O-N 3.34Å; S242-T246 PolarHBondContact O-OG1 3.26Å | ||
| 243 | L | 84.3 | Confident | 84.5 | Confident | 39 Ų | 39 | 48 Ų | 48 | 20% | 0.204 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -55.2 | -43.9 | 168.2 | -99.5 | -174.4 | 0 | 0 | 0 | 111.5 | I226 N233 L236 Q245 T246 V247 | I226-L243 HydrophobicContact CG2-CD2 3.34Å; N233-L243 HydrophobicContact CB-CD1 3.56Å; N233-L243 HydrophobicContact CB-CG 4.01Å; N233-L243 VanDerWaalsContact OD1-CD1 3.29Å; N233-L243 WeakPolarHBondContact OD1-CD1 3.28Å; N233-L243 WeakPolarHBondContact OD1-CG 3.29Å; L236-L243 HydrophobicContact CD1-CD2 3.83Å; L236-L243 HydrophobicContact CD1-CG 4.49Å; L243-Q245 PolarHBondContact O-N 3.03Å; L243-T246 WeakPolarHBondContact O-CB 3.39Å; L243-T246 PolarHBondContact O-N 2.71Å; L243-T246 VanDerWaalsContact O-N 3.14Å; L243-V247 WeakPolarHBondContact O-CG2 3.43Å; L243-V247 PolarHBondContact O-N 2.91Å |
| 244 | C | 84.4 | Confident | 85.1 | Confident | 89 Ų | 89 | 46.9 Ų | 46.9 | 60% | 0.601 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -58.1 | -49.6 | -179.7 | -174 | 0 | 0 | 0 | 0 | 111.6 | S242 T246 V247 V248 | S242-C244 VanDerWaalsContact C-N 3.26Å; S242-C244 PolarHBondContact O-N 3.47Å; C244-T246 VanDerWaalsContact C-N 3.32Å; C244-T246 PolarHBondContact O-N 2.89Å; C244-V247 PolarHBondContact O-N 3.39Å; C244-V248 WeakPolarHBondContact O-CB 3.47Å; C244-V248 VanDerWaalsContact O-CG2 3.3Å; C244-V248 WeakPolarHBondContact O-CG2 3.26Å; C244-V248 PolarHBondContact O-N 3.41Å |
| 245 | Q | 87.3 | Confident | 85.7 | Confident | 44 Ų | 44 | 48.5 Ų | 48.5 | 21% | 0.206 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -59.6 | -40.2 | 174.8 | -179.2 | -173.1 | 4.4 | 0 | 0 | 112.4 | S242 L243 V248 V249 F321 | S242-Q245 PolarHBondContact O-N 3.41Å; S242-Q245 WeakPolarHBondContact OG-CB 3.33Å; S242-Q245 PolarHBondContact OG-N 2.99Å; L243-Q245 PolarHBondContact O-N 3.03Å; Q245-V248 PolarHBondContact O-N 2.71Å; Q245-V249 WeakPolarHBondContact O-CB 3.44Å; Q245-V249 WeakPolarHBondContact O-CG2 3.37Å; Q245-V249 PolarHBondContact O-N 3.12Å; Q245-F321 HydrophobicContact CG-CD2 4.3Å |
| 246 | T | 88.6 | Confident | 86.2 | Confident | 5 Ų | 5 | 46.9 Ų | 46.9 | 3% | 0.031 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.6 | -43.6 | 177 | -50.6 | 0 | 0 | 0 | 0 | 111.6 | L146 L236 S242 L243 C244 G250 F321 | L146-T246 HydrophobicContact CD2-CG2 3.94Å; L236-T246 HydrophobicContact CD1-CG2 4.45Å; S242-T246 PolarHBondContact O-N 3.34Å; S242-T246 PolarHBondContact O-OG1 3.26Å; L243-T246 WeakPolarHBondContact O-CB 3.39Å; L243-T246 PolarHBondContact O-N 2.71Å; L243-T246 VanDerWaalsContact O-N 3.14Å; C244-T246 VanDerWaalsContact C-N 3.32Å; C244-T246 PolarHBondContact O-N 2.89Å; T246-G250 PolarHBondContact O-N 3.28Å; T246-F321 HydrophobicContact CG2-CE2 4.06Å; T246-F321 HydrophobicContact CG2-CZ 4.12Å |
| 247 | V | 91.6 | Very high | 86.8 | Confident | 46 Ų | 46 | 47.3 Ų | 47.3 | 28% | 0.279 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -67.5 | -46.5 | 176.3 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | I223 T227 L243 C244 G250 S251 | I223-V247 HydrophobicContact CG2-CB 4.5Å; I223-V247 HydrophobicContact CG2-CG2 3.93Å; T227-V247 HydrophobicContact CG2-CG2 3.5Å; T227-V247 VanDerWaalsContact CG2-CG2 3.5Å; L243-V247 WeakPolarHBondContact O-CG2 3.43Å; L243-V247 PolarHBondContact O-N 2.91Å; C244-V247 PolarHBondContact O-N 3.39Å; V247-G250 PolarHBondContact O-N 3.03Å; V247-S251 VanDerWaalsContact O-CB 3.31Å; V247-S251 WeakPolarHBondContact O-CB 3.08Å; V247-S251 PolarHBondContact O-N 2.97Å; V247-S251 PolarHBondContact O-OG 3.37Å; V247-S251 VanDerWaalsContact O-OG 3.05Å |
| 248 | V | 91.8 | Very high | 87.3 | Confident | 81 Ų | 81 | 43.3 Ų | 43.3 | 49% | 0.491 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -64.7 | -50.3 | -178 | 169.3 | 0 | 0 | 0 | 0 | 111.2 | C244 Q245 G250 S251 V252 | C244-V248 WeakPolarHBondContact O-CB 3.47Å; C244-V248 VanDerWaalsContact O-CG2 3.3Å; C244-V248 WeakPolarHBondContact O-CG2 3.26Å; C244-V248 PolarHBondContact O-N 3.41Å; Q245-V248 PolarHBondContact O-N 2.71Å; V248-G250 PolarHBondContact O-N 2.92Å; V248-S251 PolarHBondContact O-N 3.31Å; V248-V252 WeakPolarHBondContact O-CB 3.43Å; V248-V252 WeakPolarHBondContact O-CG2 3.48Å; V248-V252 PolarHBondContact O-N 3.04Å |
| 249 | V | 91.7 | Very high | 88.1 | Confident | 17 Ų | 17 | 41.5 Ų | 41.5 | 10% | 0.103 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.3 | -44.3 | 177.1 | 172.1 | 0 | 0 | 0 | 0 | 110.4 | Q245 S251 V252 V253 F321 | Q245-V249 WeakPolarHBondContact O-CB 3.44Å; Q245-V249 WeakPolarHBondContact O-CG2 3.37Å; Q245-V249 PolarHBondContact O-N 3.12Å; V249-S251 PolarHBondContact O-N 3.34Å; V249-V252 PolarHBondContact O-N 2.97Å; V249-V253 HydrophobicContact CG1-CG2 4.2Å; V249-V253 VanDerWaalsContact O-CB 3.28Å; V249-V253 WeakPolarHBondContact O-CB 3.43Å; V249-V253 VanDerWaalsContact O-CG2 3.27Å; V249-V253 WeakPolarHBondContact O-CG2 3.16Å; V249-V253 PolarHBondContact O-N 2.71Å; V249-F321 HydrophobicContact CB-CB 4.41Å; V249-F321 HydrophobicContact CB-CD2 4.42Å; V249-F321 HydrophobicContact CG1-CB 3.97Å; V249-F321 HydrophobicContact CG1-CG 4.34Å; V249-F321 HydrophobicContact CG2-CB 4.2Å; V249-F321 HydrophobicContact CG2-CD2 4.49Å |
| 250 | G | 91.4 | Very high | 88.7 | Confident | 4 Ų | 4 | 37.7 Ų | 37.7 | 4% | 0.041 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.2 | -48.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | T246 V247 V248 V253 I254 | T246-G250 PolarHBondContact O-N 3.28Å; V247-G250 PolarHBondContact O-N 3.03Å; V248-G250 PolarHBondContact O-N 2.92Å; G250-V253 WeakPolarHBondContact O-CB 3.48Å; G250-V253 PolarHBondContact O-N 2.98Å; G250-I254 WeakPolarHBondContact O-CB 3.35Å; G250-I254 VanDerWaalsContact O-CD1 3.29Å; G250-I254 WeakPolarHBondContact O-CD1 3.47Å; G250-I254 WeakPolarHBondContact O-CG1 3.46Å; G250-I254 PolarHBondContact O-N 2.85Å |
| 251 | S | 92.9 | Very high | 89.6 | Confident | 51 Ų | 51 | 36.3 Ų | 36.3 | 36% | 0.357 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -64.2 | -42.3 | 177.8 | -68.6 | 0 | 0 | 0 | 0 | 112.9 | V247 V248 V249 I254 L255 | V247-S251 VanDerWaalsContact O-CB 3.31Å; V247-S251 WeakPolarHBondContact O-CB 3.08Å; V247-S251 PolarHBondContact O-N 2.97Å; V247-S251 PolarHBondContact O-OG 3.37Å; V247-S251 VanDerWaalsContact O-OG 3.05Å; V248-S251 PolarHBondContact O-N 3.31Å; V249-S251 PolarHBondContact O-N 3.34Å; S251-I254 PolarHBondContact O-N 3.44Å; S251-L255 WeakPolarHBondContact O-CB 3.25Å; S251-L255 VanDerWaalsContact O-CG 3.25Å; S251-L255 WeakPolarHBondContact O-CG 3.46Å; S251-L255 PolarHBondContact O-N 3.12Å |
| 252 | V | 94.1 | Very high | 90.1 | Very high | 47 Ų | 47 | 38.7 Ų | 38.7 | 29% | 0.285 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.1 | -46.5 | 175.2 | 167.3 | 0 | 0 | 0 | 0 | 110.7 | V248 V249 L256 V313 | V248-V252 WeakPolarHBondContact O-CB 3.43Å; V248-V252 WeakPolarHBondContact O-CG2 3.48Å; V248-V252 PolarHBondContact O-N 3.04Å; V249-V252 PolarHBondContact O-N 2.97Å; V252-L256 HydrophobicContact CG1-CD1 3.67Å; V252-L256 WeakPolarHBondContact O-CB 3.44Å; V252-L256 WeakPolarHBondContact O-CD1 3.28Å; V252-L256 VanDerWaalsContact O-CG 3.26Å; V252-L256 WeakPolarHBondContact O-CG 3.34Å; V252-L256 PolarHBondContact O-N 3.18Å; V252-L256 VanDerWaalsContact O-N 3.07Å; V252-V313 HydrophobicContact CG1-CG1 3.81Å |
| 253 | V | 92.8 | Very high | 90.2 | Very high | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.006 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -57.6 | -51.6 | 174.3 | 160.8 | 0 | 0 | 0 | 0 | 111.1 | L139 L142 L219 V249 G250 L256 Y257 V318 | L139-V253 HydrophobicContact CD1-CG1 3.4Å; L139-V253 VanDerWaalsContact CD1-CG1 3.4Å; L142-V253 HydrophobicContact CD2-CG1 4.06Å; L142-V253 HydrophobicContact CD2-CG2 4.5Å; L219-V253 HydrophobicContact CD2-CG1 3.71Å; V249-V253 HydrophobicContact CG1-CG2 4.2Å; V249-V253 VanDerWaalsContact O-CB 3.28Å; V249-V253 WeakPolarHBondContact O-CB 3.43Å; V249-V253 VanDerWaalsContact O-CG2 3.27Å; V249-V253 WeakPolarHBondContact O-CG2 3.16Å; V249-V253 PolarHBondContact O-N 2.71Å; G250-V253 WeakPolarHBondContact O-CB 3.48Å; G250-V253 PolarHBondContact O-N 2.98Å; V253-L256 PolarHBondContact O-N 2.89Å; V253-Y257 HydrophobicContact CG1-CD2 3.73Å; V253-Y257 HydrophobicContact CG1-CE2 3.87Å; V253-Y257 WeakPolarHBondContact O-CD2 3.29Å; V253-Y257 PolarHBondContact O-N 3.34Å; V253-V318 HydrophobicContact CG2-CG2 3.95Å |
| 254 | I | 93.6 | Very high | 90.2 | Very high | 21 Ų | 21 | 41.2 Ų | 41.2 | 11% | 0.108 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58 | -52.2 | 179.6 | -73 | 157.1 | 0 | 0 | 0 | 111.1 | A216 L219 V220 I223 G250 S251 L256 Y257 S258 | A216-I254 HydrophobicContact CB-CG2 4.48Å; L219-I254 HydrophobicContact CB-CD1 4.22Å; L219-I254 HydrophobicContact CB-CG1 4.15Å; L219-I254 HydrophobicContact CD2-CD1 4.3Å; L219-I254 HydrophobicContact CD2-CG1 3.86Å; L219-I254 HydrophobicContact CG-CD1 4.01Å; L219-I254 HydrophobicContact CG-CG1 4.05Å; V220-I254 HydrophobicContact CB-CD1 4.41Å; V220-I254 HydrophobicContact CG2-CD1 3.58Å; V220-I254 HydrophobicContact CG2-CG1 4.21Å; V220-I254 HydrophobicContact CG2-CG2 3.93Å; I223-I254 HydrophobicContact CD1-CD1 3.68Å; G250-I254 WeakPolarHBondContact O-CB 3.35Å; G250-I254 VanDerWaalsContact O-CD1 3.29Å; G250-I254 WeakPolarHBondContact O-CD1 3.47Å; G250-I254 WeakPolarHBondContact O-CG1 3.46Å; G250-I254 PolarHBondContact O-N 2.85Å; S251-I254 PolarHBondContact O-N 3.44Å; I254-L256 VanDerWaalsContact C-N 3.34Å; I254-L256 PolarHBondContact O-N 3.2Å; I254-Y257 PolarHBondContact O-N 3.27Å; I254-S258 VanDerWaalsContact O-CB 3.25Å; I254-S258 WeakPolarHBondContact O-CB 3.45Å; I254-S258 PolarHBondContact O-N 3.22Å; I254-S258 PolarHBondContact O-OG 3.21Å |
| 255 | L | 93.6 | Very high | 90.1 | Very high | 120 Ų | 120 | 39.5 Ų | 39.5 | 63% | 0.628 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -63.6 | -38.6 | -176 | -70.5 | 169.4 | 0 | 0 | 0 | 112.2 | S251 S259 | S251-L255 WeakPolarHBondContact O-CB 3.25Å; S251-L255 VanDerWaalsContact O-CG 3.25Å; S251-L255 WeakPolarHBondContact O-CG 3.46Å; S251-L255 PolarHBondContact O-N 3.12Å; L255-S259 WeakPolarHBondContact O-CB 3.5Å; L255-S259 PolarHBondContact O-N 2.94Å; L255-S259 PolarHBondContact O-OG 3.06Å |
| 256 | L | 92.7 | Very high | 89.9 | Confident | 28 Ų | 28 | 41 Ų | 41 | 15% | 0.147 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -76.3 | -39.5 | -178.8 | -66.2 | 170.1 | 0 | 0 | 0 | 112.5 | V252 V253 I254 S259 R260 V313 P314 | V252-L256 HydrophobicContact CG1-CD1 3.67Å; V252-L256 WeakPolarHBondContact O-CB 3.44Å; V252-L256 WeakPolarHBondContact O-CD1 3.28Å; V252-L256 VanDerWaalsContact O-CG 3.26Å; V252-L256 WeakPolarHBondContact O-CG 3.34Å; V252-L256 PolarHBondContact O-N 3.18Å; V252-L256 VanDerWaalsContact O-N 3.07Å; V253-L256 PolarHBondContact O-N 2.89Å; I254-L256 VanDerWaalsContact C-N 3.34Å; I254-L256 PolarHBondContact O-N 3.2Å; L256-S259 WeakPolarHBondContact CA-OG 3.36Å; L256-S259 PolarHBondContact O-OG 3.25Å; L256-S259 VanDerWaalsContact O-OG 3.13Å; L256-R260 WeakPolarHBondContact O-CB 3.44Å; L256-R260 PolarHBondContact O-N 2.91Å; L256-R260 VanDerWaalsContact O-N 3.15Å; L256-V313 HydrophobicContact CD1-CB 3.82Å; L256-V313 HydrophobicContact CD1-CG1 3.57Å; L256-P314 HydrophobicContact CB-CG 3.88Å; L256-P314 HydrophobicContact CD1-CG 3.78Å; L256-P314 HydrophobicContact CG-CG 4.48Å |
| 257 | Y | 90.9 | Very high | 89.4 | Confident | 9 Ų | 9 | 42.8 Ų | 42.8 | 4% | 0.035 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -70.7 | -41.4 | 173.9 | -74 | -60.9 | 0 | 0 | 0 | 112.7 | Q135 L139 F212 V253 I254 A261 P314 | Q135-Y257 HydrophobicContact CG-CE1 3.66Å; Q135-Y257 WeakPolarHBondContact CG-OH 3.41Å; Q135-Y257 PolarHBondContact NE2-OH 3.37Å; Q135-Y257 VanDerWaalsContact NE2-OH 3.08Å; L139-Y257 HydrophobicContact CD1-CD2 3.87Å; L139-Y257 HydrophobicContact CD1-CE2 4.15Å; L139-Y257 HydrophobicContact CD2-CD2 4.08Å; L139-Y257 HydrophobicContact CD2-CG 4.17Å; F212-Y257 AromaticContact CD1-CD1 3.78Å; F212-Y257 HydrophobicContact CD1-CD1 3.78Å; F212-Y257 HydrophobicContact CD1-CG 4.17Å; F212-Y257 AromaticContact CE1-CD1 3.51Å; F212-Y257 HydrophobicContact CE1-CD1 3.51Å; F212-Y257 AromaticContact CE1-CE1 3.86Å; F212-Y257 HydrophobicContact CE1-CE1 3.86Å; F212-Y257 HydrophobicContact CE1-CG 4.25Å; F212-Y257 HydrophobicContact CZ-CD1 4.39Å; V253-Y257 HydrophobicContact CG1-CD2 3.73Å; V253-Y257 HydrophobicContact CG1-CE2 3.87Å; V253-Y257 WeakPolarHBondContact O-CD2 3.29Å; V253-Y257 PolarHBondContact O-N 3.34Å; I254-Y257 PolarHBondContact O-N 3.27Å; Y257-A261 WeakPolarHBondContact O-CB 3.06Å; Y257-A261 PolarHBondContact O-N 3.06Å; Y257-P314 HydrophobicContact CE2-CB 3.92Å; Y257-P314 WeakPolarHBondContact OH-CB 3.48Å |
| 258 | S | 91.4 | Very high | 88.6 | Confident | 31 Ų | 31 | 41.4 Ų | 41.4 | 22% | 0.217 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -67.8 | -39.9 | 176.2 | -65.4 | 0 | 0 | 0 | 0 | 112.3 | A216 I254 A261 C262 | A216-S258 WeakPolarHBondContact CB-OG 3.39Å; I254-S258 VanDerWaalsContact O-CB 3.25Å; I254-S258 WeakPolarHBondContact O-CB 3.45Å; I254-S258 PolarHBondContact O-N 3.22Å; I254-S258 PolarHBondContact O-OG 3.21Å; S258-A261 PolarHBondContact O-N 3.1Å; S258-C262 VanDerWaalsContact O-CB 3.26Å; S258-C262 WeakPolarHBondContact O-CB 3.41Å; S258-C262 PolarHBondContact O-N 3.47Å; S258-C262 PolarHBondContact O-SG 2.98Å |
| 259 | S | 91.4 | Very high | 87.7 | Confident | 51 Ų | 51 | 41.1 Ų | 41.1 | 36% | 0.357 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.2 | -41.6 | 176.1 | 56.1 | 0 | 0 | 0 | 0 | 112.5 | L255 L256 Y263 W310 | L255-S259 WeakPolarHBondContact O-CB 3.5Å; L255-S259 PolarHBondContact O-N 2.94Å; L255-S259 PolarHBondContact O-OG 3.06Å; L256-S259 WeakPolarHBondContact CA-OG 3.36Å; L256-S259 PolarHBondContact O-OG 3.25Å; L256-S259 VanDerWaalsContact O-OG 3.13Å; S259-Y263 VanDerWaalsContact O-CB 3.26Å; S259-Y263 WeakPolarHBondContact O-CB 3.4Å; S259-Y263 PolarHBondContact O-N 2.96Å; S259-W310 PolarHBondContact OG-NE1 3.35Å |
| 260 | R | 87.4 | Confident | 86.9 | Confident | 8 Ų | 8 | 46.4 Ų | 46.4 | 3% | 0.03 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.8 | -50.5 | 173 | -177.4 | 179.5 | 174.4 | -176.9 | -3 | 112 | L256 C262 Y263 N264 Y281 W310 E311 | L256-R260 WeakPolarHBondContact O-CB 3.44Å; L256-R260 PolarHBondContact O-N 2.91Å; L256-R260 VanDerWaalsContact O-N 3.15Å; R260-C262 PolarHBondContact O-N 3.37Å; R260-Y263 PolarHBondContact O-N 3.42Å; R260-N264 WeakPolarHBondContact O-CB 3.49Å; R260-N264 PolarHBondContact O-N 2.88Å; R260-Y281 PolarHBondContact NE-OH 2.9Å; R260-Y281 PolarHBondContact NH1-OH 2.94Å; R260-Y281 PolarHBondContact NH2-OH 2.96Å; R260-W310 HydrophobicContact CB-CD2 3.82Å; R260-W310 HydrophobicContact CB-CE3 4.31Å; R260-W310 HydrophobicContact CB-CG 3.97Å; R260-W310 HydrophobicContact CB-CZ2 4.43Å; R260-W310 HydrophobicContact CG-CD2 3.97Å; R260-W310 HydrophobicContact CG-CE3 3.98Å; R260-W310 HydrophobicContact CG-CG 4.32Å; R260-W310 HydrophobicContact CG-CZ3 4.47Å; R260-E311 IonicContact NH1-OE1 3.75Å |
| 261 | A | 88.7 | Confident | 85.5 | Confident | 2 Ų | 2 | 48.6 Ų | 48.6 | 2% | 0.017 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.4 | -39.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | D209 F212 I213 Y257 S258 L265 | D209-A261 HydrophobicContact CB-CB 4.08Å; F212-A261 HydrophobicContact CB-CB 4Å; I213-A261 HydrophobicContact CD1-CB 4.19Å; I213-A261 HydrophobicContact CG1-CB 3.86Å; Y257-A261 WeakPolarHBondContact O-CB 3.06Å; Y257-A261 PolarHBondContact O-N 3.06Å; S258-A261 PolarHBondContact O-N 3.1Å; A261-L265 VanDerWaalsContact O-CB 3.25Å; A261-L265 WeakPolarHBondContact O-CB 3.4Å; A261-L265 PolarHBondContact O-N 2.68Å |
| 262 | C | 87.5 | Confident | 83.8 | Confident | 65 Ų | 65 | 52.7 Ų | 52.7 | 44% | 0.439 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -68.9 | -40.1 | 174.6 | -70.3 | 0 | 0 | 0 | 0 | 112.5 | S258 R260 L265 V266 | S258-C262 VanDerWaalsContact O-CB 3.26Å; S258-C262 WeakPolarHBondContact O-CB 3.41Å; S258-C262 PolarHBondContact O-N 3.47Å; S258-C262 PolarHBondContact O-SG 2.98Å; R260-C262 PolarHBondContact O-N 3.37Å; C262-L265 PolarHBondContact O-N 3.31Å; C262-V266 WeakPolarHBondContact O-CB 3.33Å; C262-V266 VanDerWaalsContact O-CG2 3.28Å; C262-V266 WeakPolarHBondContact O-CG2 3.19Å; C262-V266 PolarHBondContact O-N 2.98Å |
| 263 | Y | 86.8 | Confident | 81.7 | Confident | 133 Ų | 133 | 57 Ų | 57 | 52% | 0.522 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.8 | -51.1 | 173.8 | 175.1 | -91.5 | 0 | 0 | 0 | 111.1 | S259 R260 L265 V266 V267 W310 | S259-Y263 VanDerWaalsContact O-CB 3.26Å; S259-Y263 WeakPolarHBondContact O-CB 3.4Å; S259-Y263 PolarHBondContact O-N 2.96Å; R260-Y263 PolarHBondContact O-N 3.42Å; Y263-L265 VanDerWaalsContact C-N 3.35Å; Y263-L265 PolarHBondContact O-N 2.82Å; Y263-V266 PolarHBondContact O-N 3.11Å; Y263-V267 HydrophobicContact CD1-CG2 4.23Å; Y263-V267 HydrophobicContact CE1-CG2 3.8Å; Y263-V267 HydrophobicContact CE2-CG2 4.18Å; Y263-V267 WeakPolarHBondContact O-CG2 3.28Å; Y263-V267 PolarHBondContact O-N 3.08Å; Y263-W310 AromaticContact CD1-CH2 3.49Å; Y263-W310 HydrophobicContact CD1-CH2 3.49Å; Y263-W310 VanDerWaalsContact CD1-CH2 3.49Å; Y263-W310 HydrophobicContact CD1-CZ2 4.49Å; Y263-W310 HydrophobicContact CD1-CZ3 4.03Å; Y263-W310 HydrophobicContact CD2-CH2 4.19Å; Y263-W310 HydrophobicContact CE1-CH2 4.07Å; Y263-W310 HydrophobicContact CE1-CZ3 4.39Å; Y263-W310 AromaticContact CG-CH2 3.56Å; Y263-W310 HydrophobicContact CG-CH2 3.56Å; Y263-W310 HydrophobicContact CG-CZ2 4.19Å |
| 264 | N | 83.3 | Confident | 79.7 | Confident | 13 Ų | 13 | 61 Ų | 61 | 7% | 0.07 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -54.1 | -50.2 | 175.7 | -79.2 | 4 | 0 | 0 | 0 | 111.4 | D209 R260 V266 V267 V268 P278 | D209-N264 PolarHBondContact OD1-ND2 3.47Å; D209-N264 VanDerWaalsContact OD2-CB 3.3Å; D209-N264 WeakPolarHBondContact OD2-CB 3.42Å; R260-N264 WeakPolarHBondContact O-CB 3.49Å; R260-N264 PolarHBondContact O-N 2.88Å; N264-V266 PolarHBondContact O-N 3.15Å; N264-V267 PolarHBondContact O-N 2.89Å; N264-V268 VanDerWaalsContact O-CB 3.29Å; N264-V268 WeakPolarHBondContact O-CB 3.3Å; N264-V268 WeakPolarHBondContact O-CG2 3.37Å; N264-V268 PolarHBondContact O-N 3.31Å; N264-P278 PolarHBondContact ND2-O 3.25Å |
| 265 | L | 82.3 | Confident | 77.4 | Confident | 53 Ų | 53 | 64.8 Ų | 64.8 | 28% | 0.277 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | -179.9 | -169.8 | 155.6 | 0 | 0 | 0 | 111.5 | I213 A261 C262 Y263 V268 T269 | I213-L265 HydrophobicContact CD1-CD1 4.49Å; A261-L265 VanDerWaalsContact O-CB 3.25Å; A261-L265 WeakPolarHBondContact O-CB 3.4Å; A261-L265 PolarHBondContact O-N 2.68Å; C262-L265 PolarHBondContact O-N 3.31Å; Y263-L265 VanDerWaalsContact C-N 3.35Å; Y263-L265 PolarHBondContact O-N 2.82Å; L265-V268 PolarHBondContact O-N 3.03Å; L265-T269 HydrophobicContact CD2-CG2 3.93Å; L265-T269 WeakPolarHBondContact O-CB 3.37Å; L265-T269 WeakPolarHBondContact O-CG2 3.33Å; L265-T269 PolarHBondContact O-N 2.95Å; L265-T269 PolarHBondContact O-OG1 3.43Å; L265-T269 VanDerWaalsContact O-OG1 3.06Å |
| 266 | V | 83.1 | Confident | 75.1 | Confident | 75 Ų | 75 | 63.9 Ų | 63.9 | 46% | 0.455 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -59.5 | -50.7 | 175.4 | 168.2 | 0 | 0 | 0 | 0 | 111 | C262 Y263 N264 V268 T269 I270 | C262-V266 WeakPolarHBondContact O-CB 3.33Å; C262-V266 VanDerWaalsContact O-CG2 3.28Å; C262-V266 WeakPolarHBondContact O-CG2 3.19Å; C262-V266 PolarHBondContact O-N 2.98Å; Y263-V266 PolarHBondContact O-N 3.11Å; N264-V266 PolarHBondContact O-N 3.15Å; V266-V268 VanDerWaalsContact C-N 3.35Å; V266-V268 PolarHBondContact O-N 3Å; V266-T269 PolarHBondContact O-N 3.28Å; V266-T269 PolarHBondContact O-OG1 2.94Å; V266-I270 HydrophobicContact CG1-CD1 3.71Å; V266-I270 WeakPolarHBondContact O-CG1 3.23Å; V266-I270 PolarHBondContact O-N 3.07Å |
| 267 | V | 79 | Confident | 72.7 | Confident | 43 Ų | 43 | 63.8 Ų | 63.8 | 26% | 0.261 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -57.8 | -46.2 | 176.6 | 172.3 | 0 | 0 | 0 | 0 | 111.2 | Y263 N264 T269 I270 S271 | Y263-V267 HydrophobicContact CD1-CG2 4.23Å; Y263-V267 HydrophobicContact CE1-CG2 3.8Å; Y263-V267 HydrophobicContact CE2-CG2 4.18Å; Y263-V267 WeakPolarHBondContact O-CG2 3.28Å; Y263-V267 PolarHBondContact O-N 3.08Å; N264-V267 PolarHBondContact O-N 2.89Å; V267-T269 VanDerWaalsContact C-N 3.34Å; V267-T269 PolarHBondContact O-N 3.2Å; V267-I270 PolarHBondContact O-N 3.25Å; V267-S271 VanDerWaalsContact O-CB 3.26Å; V267-S271 WeakPolarHBondContact O-CB 3.45Å; V267-S271 PolarHBondContact O-N 3.35Å; V267-S271 PolarHBondContact O-OG 2.85Å |
| 268 | V | 75.1 | Confident | 70.3 | Confident | 17 Ų | 17 | 64.4 Ų | 64.4 | 10% | 0.103 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.5 | -32.9 | 179.5 | 168.6 | 0 | 0 | 0 | 0 | 112.7 | F202 A205 N264 L265 V266 P278 | F202-V268 HydrophobicContact CD2-CG1 3.42Å; F202-V268 VanDerWaalsContact CD2-CG1 3.42Å; F202-V268 HydrophobicContact CE2-CG1 3.5Å; F202-V268 VanDerWaalsContact CE2-CG1 3.5Å; F202-V268 WeakPolarHBondContact CE2-O 3.38Å; F202-V268 HydrophobicContact CG-CG1 4.2Å; F202-V268 HydrophobicContact CZ-CG1 4.33Å; A205-V268 HydrophobicContact CB-CG1 4.36Å; A205-V268 HydrophobicContact CB-CG2 3.91Å; N264-V268 VanDerWaalsContact O-CB 3.29Å; N264-V268 WeakPolarHBondContact O-CB 3.3Å; N264-V268 WeakPolarHBondContact O-CG2 3.37Å; N264-V268 PolarHBondContact O-N 3.31Å; L265-V268 PolarHBondContact O-N 3.03Å; V266-V268 VanDerWaalsContact C-N 3.35Å; V266-V268 PolarHBondContact O-N 3Å; V268-P278 HydrophobicContact CG2-CB 3.76Å; V268-P278 HydrophobicContact CG2-CG 3.6Å |
| 269 | T | 73.1 | Confident | 67.8 | Low | 74 Ų | 74 | 63.8 Ų | 63.8 | 45% | 0.454 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -77.6 | -28.3 | 176.1 | 55.2 | 0 | 0 | 0 | 0 | 114 | L265 V266 V267 | L265-T269 HydrophobicContact CD2-CG2 3.93Å; L265-T269 WeakPolarHBondContact O-CB 3.37Å; L265-T269 WeakPolarHBondContact O-CG2 3.33Å; L265-T269 PolarHBondContact O-N 2.95Å; L265-T269 PolarHBondContact O-OG1 3.43Å; L265-T269 VanDerWaalsContact O-OG1 3.06Å; V266-T269 PolarHBondContact O-N 3.28Å; V266-T269 PolarHBondContact O-OG1 2.94Å; V267-T269 VanDerWaalsContact C-N 3.34Å; V267-T269 PolarHBondContact O-N 3.2Å |
| 270 | I | 73.9 | Confident | 65.6 | Low | 128 Ų | 128 | 63.5 Ų | 63.5 | 66% | 0.656 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -90.5 | -45 | -178.7 | -66.1 | 173.3 | 0 | 0 | 0 | 111.1 | V266 V267 Q272 | V266-I270 HydrophobicContact CG1-CD1 3.71Å; V266-I270 WeakPolarHBondContact O-CG1 3.23Å; V266-I270 PolarHBondContact O-N 3.07Å; V267-I270 PolarHBondContact O-N 3.25Å; I270-Q272 PolarHBondContact O-N 2.98Å |
| 271 | S | 62.8 | Low | 63.7 | Low | 51 Ų | 51 | 64.8 Ų | 64.8 | 36% | 0.357 | 35% | 0.347 | S | S | . | . | trans | -93.8 | 60.8 | -170.6 | -58.1 | 0 | 0 | 0 | 0 | 112.4 | V267 D273 T274 | V267-S271 VanDerWaalsContact O-CB 3.26Å; V267-S271 WeakPolarHBondContact O-CB 3.45Å; V267-S271 PolarHBondContact O-N 3.35Å; V267-S271 PolarHBondContact O-OG 2.85Å; S271-D273 PolarHBondContact O-N 2.94Å; S271-T274 WeakPolarHBondContact CB-OG1 3.49Å | ||
| 272 | Q | 57.3 | Low | 61.5 | Low | 137 Ų | 137 | 65.9 Ų | 65.9 | 64% | 0.64 | 36% | 0.359 | S | S | * | . | S | Bend | trans | -63.6 | -24.8 | -178.8 | -64.1 | -167.8 | -47.7 | 0 | 0 | 113.8 | I270 | I270-Q272 PolarHBondContact O-N 2.98Š|
| 273 | D | 48.9 | Very low | 59.4 | Low | 136 Ų | 136 | 65.2 Ų | 65.2 | 73% | 0.727 | 35% | 0.347 | S | S | * | . | S | Bend | trans | -94.8 | -33.6 | -171.9 | -69.2 | -58.2 | 0 | 0 | 0 | 115.1 | K198 S271 | K198-D273 PolarHBondContact NZ-O 3.3Å; S271-D273 PolarHBondContact O-N 2.94Å |
| 274 | T | 50.5 | Low | 57.2 | Low | 86 Ų | 86 | 61.7 Ų | 61.7 | 53% | 0.528 | 34% | 0.337 | S | S | . | . | S | Bend | trans | -81.8 | 129.1 | -175.1 | 54.1 | 0 | 0 | 0 | 0 | 111.9 | S271 E276 | S271-T274 WeakPolarHBondContact CB-OG1 3.49Å; T274-E276 PolarHBondContact O-N 2.87Å |
| 275 | L | 46 | Very low | 55.3 | Low | 101 Ų | 101 | 63.5 Ų | 63.5 | 53% | 0.529 | 35% | 0.347 | S | S | . | . | trans | -76.7 | 31.1 | -176 | -136.8 | 174.1 | 0 | 0 | 0 | 113.7 | K198 S277 | K198-L275 HydrophobicContact CG-CG 4.37Å; L275-S277 PolarHBondContact O-N 3.2Å | ||
| 276 | E | 45.1 | Very low | 53.4 | Low | 100 Ų | 100 | 62.4 Ų | 62.4 | 47% | 0.467 | 34% | 0.341 | S | S | . | . | trans | -77.6 | 95.2 | 177.3 | -60.8 | -147.3 | 153.4 | 0 | 0 | 109.9 | T274 P278 N285 | T274-E276 PolarHBondContact O-N 2.87Å; E276-P278 VanDerWaalsContact O-CD 3.27Å; E276-P278 WeakPolarHBondContact O-CD 3.29Å; E276-P278 VanDerWaalsContact O-N 3.16Å; E276-N285 VanDerWaalsContact CD-ND2 3.31Å; E276-N285 WeakPolarHBondContact CG-ND2 3.44Å; E276-N285 PolarHBondContact OE1-ND2 3.01Å | ||
| 277 | S | 41.8 | Very low | 51.5 | Low | 27 Ų | 27 | 61.9 Ų | 61.9 | 19% | 0.189 | 34% | 0.341 | C | S | . | . | trans | -52.3 | 116.4 | 174.6 | 168.1 | 0 | 0 | 0 | 0 | 110.4 | R204 L275 F279 N280 | R204-S277 PolarHBondContact NH1-OG 3.1Å; R204-S277 PolarHBondContact NH2-OG 3.34Å; L275-S277 PolarHBondContact O-N 3.2Å; S277-F279 PolarHBondContact O-N 3.1Å; S277-N280 WeakPolarHBondContact O-CA 3.32Å; S277-N280 WeakPolarHBondContact O-CB 3.34Å; S277-N280 PolarHBondContact O-N 3.49Å | ||
| 278 | P | 41.2 | Very low | 49.7 | Very low | 21 Ų | 21 | 65.4 Ų | 65.4 | 14% | 0.136 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.1 | 7.3 | -172.6 | 28.6 | -38.7 | 0 | 0 | 0 | 115.4 | A205 N264 V268 E276 | A205-P278 HydrophobicContact CB-CB 4.38Å; A205-P278 HydrophobicContact CB-CG 3.31Å; N264-P278 PolarHBondContact ND2-O 3.25Å; V268-P278 HydrophobicContact CG2-CB 3.76Å; V268-P278 HydrophobicContact CG2-CG 3.6Å; E276-P278 VanDerWaalsContact O-CD 3.27Å; E276-P278 WeakPolarHBondContact O-CD 3.29Å; E276-P278 VanDerWaalsContact O-N 3.16Å |
| 279 | F | 39.2 | Very low | 48 | Very low | 18 Ų | 18 | 69.4 Ų | 69.4 | 8% | 0.079 | 37% | 0.374 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103.5 | -9 | 164.6 | -83.7 | -88.6 | 0 | 0 | 0 | 112.5 | S132 F177 N208 S277 | S132-F279 WeakPolarHBondContact OG-CD1 3.39Å; F177-F279 HydrophobicContact CZ-CE1 4.14Å; F177-F279 HydrophobicContact CZ-CZ 4.24Å; N208-F279 HydrophobicContact CB-CE2 3.7Å; N208-F279 HydrophobicContact CB-CZ 3.54Å; N208-F279 WeakPolarHBondContact ND2-CE2 3.43Å; N208-F279 VanDerWaalsContact ND2-CZ 3.32Å; N208-F279 WeakPolarHBondContact ND2-CZ 3.47Å; S277-F279 PolarHBondContact O-N 3.1Å |
| 280 | N | 45.7 | Very low | 46.7 | Very low | 45 Ų | 45 | 68.7 Ų | 68.7 | 24% | 0.241 | 38% | 0.376 | C | S | . | . | S | Bend | trans | -86.5 | 120.8 | 173 | -155.8 | -21 | 0 | 0 | 0 | 108 | S277 G282 W283 D284 | S277-N280 WeakPolarHBondContact O-CA 3.32Å; S277-N280 WeakPolarHBondContact O-CB 3.34Å; S277-N280 PolarHBondContact O-N 3.49Å; N280-G282 PolarHBondContact O-N 3.43Å; N280-W283 PolarHBondContact OD1-N 3.03Å; N280-W283 VanDerWaalsContact OD1-N 3.08Å; N280-D284 WeakPolarHBondContact ND2-CB 3.33Å; N280-D284 VanDerWaalsContact ND2-CG 3.29Å; N280-D284 PolarHBondContact ND2-OD2 3.31Å; N280-D284 PolarHBondContact OD1-N 3.15Å |
| 281 | Y | 47.5 | Very low | 45.3 | Very low | 35 Ų | 35 | 70.2 Ų | 70.2 | 14% | 0.137 | 38% | 0.38 | C | S | . | . | trans | -78.9 | 46.8 | -176.9 | -94.9 | -75.9 | 0 | 0 | 0 | 110.6 | R260 W283 F303 L307 W310 E311 | R260-Y281 PolarHBondContact NE-OH 2.9Å; R260-Y281 PolarHBondContact NH1-OH 2.94Å; R260-Y281 PolarHBondContact NH2-OH 2.96Å; Y281-W283 PolarHBondContact O-N 3.1Å; Y281-F303 HydrophobicContact CD1-CE2 4.09Å; Y281-F303 HydrophobicContact CG-CE2 4.4Å; Y281-F303 WeakPolarHBondContact O-CE2 3.28Å; Y281-F303 WeakPolarHBondContact O-CZ 3.46Å; Y281-L307 HydrophobicContact CD1-CD2 3.53Å; Y281-L307 HydrophobicContact CD1-CG 4.32Å; Y281-L307 HydrophobicContact CD2-CD2 4.17Å; Y281-L307 HydrophobicContact CE1-CD2 3.66Å; Y281-L307 HydrophobicContact CE2-CD2 4.27Å; Y281-L307 HydrophobicContact CG-CD2 3.78Å; Y281-W310 HydrophobicContact CE1-CE3 4.32Å; Y281-E311 HydrophobicContact CE2-CG 4.48Å; Y281-E311 VanDerWaalsContact CE2-OE1 3.29Å; Y281-E311 WeakPolarHBondContact CE2-OE1 3.05Å; Y281-E311 WeakPolarHBondContact OH-CG 3.43Å; Y281-E311 PolarHBondContact OH-OE1 2.86Å | ||
| 282 | G | 41.9 | Very low | 44.5 | Very low | 26 Ų | 26 | 72.8 Ų | 72.8 | 27% | 0.268 | 39% | 0.393 | S | S | . | . | S | Bend | trans | 52.9 | 11.8 | -163.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | N280 N285 L286 | N280-G282 PolarHBondContact O-N 3.43Å; G282-N285 CarbonylContact O-C 3.5Å; G282-N285 PolarHBondContact O-N 3.23Å; G282-L286 WeakPolarHBondContact O-CB 3.28Å; G282-L286 VanDerWaalsContact O-CG 3.28Å; G282-L286 WeakPolarHBondContact O-CG 3.32Å; G282-L286 PolarHBondContact O-N 3.36Å |
| 283 | W | 43.8 | Very low | 43.8 | Very low | 50 Ų | 50 | 74.9 Ų | 74.9 | 19% | 0.189 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -70.9 | -45.5 | -161.6 | 179.3 | -86 | 0 | 0 | 0 | 111.8 | L99 F100 A103 Y128 N280 Y281 N285 L286 S287 F303 | L99-W283 HydrophobicContact CD2-CH2 4.28Å; L99-W283 HydrophobicContact CD2-CZ2 3.93Å; F100-W283 HydrophobicContact CE1-CH2 4.36Å; F100-W283 HydrophobicContact CE1-CZ3 4.24Å; F100-W283 HydrophobicContact CZ-CZ3 4.3Å; A103-W283 HydrophobicContact CB-CH2 4.18Å; A103-W283 HydrophobicContact CB-CZ2 3.78Å; Y128-W283 AromaticContact CE1-CD1 3.64Å; Y128-W283 HydrophobicContact CE1-CG 4.28Å; Y128-W283 PolarHBondContact OH-NE1 2.85Å; N280-W283 PolarHBondContact OD1-N 3.03Å; N280-W283 VanDerWaalsContact OD1-N 3.08Å; Y281-W283 PolarHBondContact O-N 3.1Å; W283-N285 VanDerWaalsContact C-N 3.31Å; W283-L286 PolarHBondContact O-N 3.39Å; W283-S287 PolarHBondContact O-N 3.2Å; W283-F303 HydrophobicContact CE3-CE1 4.36Å; W283-F303 HydrophobicContact CE3-CZ 4.45Å |
| 284 | D | 39.9 | Very low | 43.6 | Very low | 59 Ų | 59 | 75.2 Ų | 75.2 | 32% | 0.316 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -68.1 | -35.9 | 175.5 | -57.3 | -25.2 | 0 | 0 | 0 | 110.5 | N280 L286 S287 D288 | N280-D284 WeakPolarHBondContact ND2-CB 3.33Å; N280-D284 VanDerWaalsContact ND2-CG 3.29Å; N280-D284 PolarHBondContact ND2-OD2 3.31Å; N280-D284 PolarHBondContact OD1-N 3.15Å; D284-L286 VanDerWaalsContact C-N 3.35Å; D284-L286 PolarHBondContact O-N 2.84Å; D284-S287 WeakPolarHBondContact O-CB 3.42Å; D284-S287 PolarHBondContact O-N 3.09Å; D284-S287 VanDerWaalsContact O-N 3.15Å; D284-D288 PolarHBondContact O-N 3.41Å |
| 285 | N | 42.7 | Very low | 43.7 | Very low | 52 Ų | 52 | 73.3 Ų | 73.3 | 28% | 0.278 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -67.6 | -31 | 173.5 | -76 | -8.1 | 0 | 0 | 0 | 113.1 | E276 G282 W283 K289 | E276-N285 VanDerWaalsContact CD-ND2 3.31Å; E276-N285 WeakPolarHBondContact CG-ND2 3.44Å; E276-N285 PolarHBondContact OE1-ND2 3.01Å; G282-N285 CarbonylContact O-C 3.5Å; G282-N285 PolarHBondContact O-N 3.23Å; W283-N285 VanDerWaalsContact C-N 3.31Å; N285-K289 WeakPolarHBondContact O-CB 3.44Å; N285-K289 WeakPolarHBondContact O-CD 3.44Å; N285-K289 WeakPolarHBondContact O-CG 3.3Å; N285-K289 PolarHBondContact O-N 3.39Å |
| 286 | L | 43.9 | Very low | 44.3 | Very low | 30 Ų | 30 | 70.9 Ų | 70.9 | 16% | 0.157 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -74.5 | -29.9 | 172 | -76.4 | 167.2 | 0 | 0 | 0 | 110.8 | G282 W283 D284 A290 I295 F303 | G282-L286 WeakPolarHBondContact O-CB 3.28Å; G282-L286 VanDerWaalsContact O-CG 3.28Å; G282-L286 WeakPolarHBondContact O-CG 3.32Å; G282-L286 PolarHBondContact O-N 3.36Å; W283-L286 PolarHBondContact O-N 3.39Å; D284-L286 VanDerWaalsContact C-N 3.35Å; D284-L286 PolarHBondContact O-N 2.84Å; L286-A290 WeakPolarHBondContact O-CB 3.42Å; L286-A290 PolarHBondContact O-N 3.34Å; L286-I295 HydrophobicContact CD2-CD1 3.82Å; L286-I295 HydrophobicContact CD2-CG1 4.39Å; L286-I295 HydrophobicContact CD2-CG2 4.04Å; L286-F303 HydrophobicContact CD1-CD1 3.76Å; L286-F303 HydrophobicContact CD1-CE1 3.81Å; L286-F303 HydrophobicContact CD1-CG 4.18Å; L286-F303 HydrophobicContact CD1-CZ 4.29Å |
| 287 | S | 42.9 | Very low | 45.2 | Very low | 63 Ų | 63 | 66.7 Ų | 66.7 | 44% | 0.441 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -71.2 | -41.4 | 173 | -164.6 | 0 | 0 | 0 | 0 | 112.1 | W283 D284 H291 | W283-S287 PolarHBondContact O-N 3.2Å; D284-S287 WeakPolarHBondContact O-CB 3.42Å; D284-S287 PolarHBondContact O-N 3.09Å; D284-S287 VanDerWaalsContact O-N 3.15Å; S287-H291 PolarHBondContact O-CD2 2.82Å |
| 288 | D | 41.3 | Very low | 46.4 | Very low | 117 Ų | 117 | 71.3 Ų | 71.3 | 63% | 0.626 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -71.1 | -45.8 | 174.7 | -98.2 | -3 | 0 | 0 | 0 | 111.5 | D284 A290 H291 V292 | D284-D288 PolarHBondContact O-N 3.41Å; D288-A290 VanDerWaalsContact C-N 3.29Å; D288-A290 PolarHBondContact O-N 3.27Å; D288-H291 WeakPolarHBondContact O-CB 3.41Å; D288-H291 PolarHBondContact O-N 3.08Å; D288-V292 PolarHBondContact O-N 2.92Å |
| 289 | K | 39.8 | Very low | 47.8 | Very low | 101 Ų | 101 | 75.3 Ų | 75.3 | 44% | 0.439 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -67.5 | -26.3 | 177.2 | -67.5 | 168.8 | -173.2 | 176 | 0 | 112.8 | N285 H291 V292 I295 | N285-K289 WeakPolarHBondContact O-CB 3.44Å; N285-K289 WeakPolarHBondContact O-CD 3.44Å; N285-K289 WeakPolarHBondContact O-CG 3.3Å; N285-K289 PolarHBondContact O-N 3.39Å; K289-H291 PolarHBondContact O-N 3.4Å; K289-V292 CarbonylContact O-C 3.47Å; K289-V292 VanDerWaalsContact O-C 3.3Å; K289-V292 PolarHBondContact O-N 2.93Å; K289-I295 HydrophobicContact CB-CD1 3.88Å; K289-I295 HydrophobicContact CB-CG1 3.79Å |
| 290 | A | 44 | Very low | 49.4 | Very low | 59 Ų | 59 | 75.5 Ų | 75.5 | 49% | 0.488 | 40% | 0.402 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.9 | -11.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | L286 D288 I295 | L286-A290 WeakPolarHBondContact O-CB 3.42Å; L286-A290 PolarHBondContact O-N 3.34Å; D288-A290 VanDerWaalsContact C-N 3.29Å; D288-A290 PolarHBondContact O-N 3.27Å; A290-I295 HydrophobicContact CB-CD1 4.09Å |
| 291 | H | 45.8 | Very low | 50.9 | Low | 161 Ų | 161 | 76.3 Ų | 76.3 | 75% | 0.745 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.9 | -5.8 | 169.8 | -68.1 | -43.5 | 0 | 0 | 0 | 113.6 | S287 D288 K289 | S287-H291 PolarHBondContact O-CD2 2.82Å; D288-H291 WeakPolarHBondContact O-CB 3.41Å; D288-H291 PolarHBondContact O-N 3.08Å; K289-H291 PolarHBondContact O-N 3.4Å |
| 292 | V | 44.9 | Very low | 52.5 | Low | 104 Ų | 104 | 78.9 Ų | 78.9 | 63% | 0.63 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -138.6 | 78.3 | -177.8 | -169.4 | 0 | 0 | 0 | 0 | 110.7 | D288 K289 | D288-V292 PolarHBondContact O-N 2.92Å; K289-V292 CarbonylContact O-C 3.47Å; K289-V292 VanDerWaalsContact O-C 3.3Å; K289-V292 PolarHBondContact O-N 2.93Å |
| 293 | E | 43.2 | Very low | 54.1 | Low | 181 Ų | 181 | 78.8 Ų | 78.8 | 85% | 0.846 | 42% | 0.417 | S | S | * | . | S | Bend | trans | 52.4 | 123.8 | 161.9 | -60.3 | -175.7 | 139.7 | 0 | 0 | 119.4 | I295 | E293-I295 PolarHBondContact O-N 3.42Š|
| 294 | D | 45.2 | Very low | 55.8 | Low | 144 Ų | 144 | 76.6 Ų | 76.6 | 77% | 0.77 | 41% | 0.41 | S | S | * | . | trans | 47 | 62.6 | 161.1 | -70.9 | 1.8 | 0 | 0 | 0 | 118.3 | S296 | D294-S296 PolarHBondContact O-N 2.85Š| ||
| 295 | I | 52 | Low | 57.8 | Low | 45 Ų | 45 | 78.9 Ų | 78.9 | 23% | 0.231 | 42% | 0.42 | C | S | . | . | trans | -59.9 | 120.2 | 151.1 | -63.3 | 163.4 | 0 | 0 | 0 | 107.9 | L286 K289 A290 E293 G297 | L286-I295 HydrophobicContact CD2-CD1 3.82Å; L286-I295 HydrophobicContact CD2-CG1 4.39Å; L286-I295 HydrophobicContact CD2-CG2 4.04Å; K289-I295 HydrophobicContact CB-CD1 3.88Å; K289-I295 HydrophobicContact CB-CG1 3.79Å; A290-I295 HydrophobicContact CB-CD1 4.09Å; E293-I295 PolarHBondContact O-N 3.42Å; I295-G297 PolarHBondContact O-N 3.01Å | ||
| 296 | S | 58.3 | Low | 59.8 | Low | 51 Ų | 51 | 78.6 Ų | 78.6 | 36% | 0.357 | 42% | 0.42 | S | S | . | . | trans | -67.3 | 137.9 | 177.3 | 78.4 | 0 | 0 | 0 | 0 | 110.6 | D294 E298 E299 Y300 | D294-S296 PolarHBondContact O-N 2.85Å; S296-E298 PolarHBondContact O-N 3.03Å; S296-E298 VanDerWaalsContact O-N 3.15Å; S296-E299 WeakPolarHBondContact CB-OE1 3.4Å; S296-E299 PolarHBondContact N-OE1 3.32Å; S296-E299 WeakPolarHBondContact O-CB 3.49Å; S296-E299 PolarHBondContact O-N 2.8Å; S296-E299 VanDerWaalsContact O-N 3.08Å; S296-E299 WeakPolarHBondContact OG-CG 3.44Å; S296-E299 PolarHBondContact OG-OE1 3.27Å; S296-Y300 PolarHBondContact O-N 3.47Å | ||
| 297 | G | 63.5 | Low | 61.7 | Low | 12 Ų | 12 | 77.5 Ų | 77.5 | 12% | 0.124 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -61.5 | -27.2 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | I295 Y300 I301 | I295-G297 PolarHBondContact O-N 3.01Å; G297-Y300 PolarHBondContact O-N 3.41Å; G297-I301 VanDerWaalsContact O-CG1 3.3Å; G297-I301 WeakPolarHBondContact O-CG1 3.31Å; G297-I301 PolarHBondContact O-N 3.34Å |
| 298 | E | 67.9 | Low | 63.8 | Low | 124 Ų | 124 | 78.2 Ų | 78.2 | 58% | 0.579 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -63.3 | -42 | 174.4 | -58.6 | -55.2 | 144.6 | 0 | 0 | 112.1 | S296 Y300 I301 V302 | S296-E298 PolarHBondContact O-N 3.03Å; S296-E298 VanDerWaalsContact O-N 3.15Å; E298-Y300 VanDerWaalsContact C-N 3.29Å; E298-Y300 PolarHBondContact O-N 2.88Å; E298-I301 PolarHBondContact O-N 3.4Å; E298-V302 WeakPolarHBondContact O-CB 3.4Å; E298-V302 WeakPolarHBondContact O-CG2 3.32Å; E298-V302 PolarHBondContact O-N 3.45Å |
| 299 | E | 71.2 | Confident | 66.1 | Low | 105 Ų | 105 | 76.5 Ų | 76.5 | 49% | 0.491 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -59.4 | -41.5 | 174.3 | -74.7 | 162.7 | -104 | 0 | 0 | 111.3 | S296 F303 | S296-E299 WeakPolarHBondContact CB-OE1 3.4Å; S296-E299 PolarHBondContact N-OE1 3.32Å; S296-E299 WeakPolarHBondContact O-CB 3.49Å; S296-E299 PolarHBondContact O-N 2.8Å; S296-E299 VanDerWaalsContact O-N 3.08Å; S296-E299 WeakPolarHBondContact OG-CG 3.44Å; S296-E299 PolarHBondContact OG-OE1 3.27Å; E299-F303 WeakPolarHBondContact O-CB 3.12Å; E299-F303 PolarHBondContact O-N 3.2Å |
| 300 | Y | 71.8 | Confident | 68.4 | Low | 22 Ų | 22 | 73.5 Ų | 73.5 | 9% | 0.086 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -70.3 | -33.7 | 178.7 | -162.6 | -95.7 | 0 | 0 | 0 | 112.9 | Q46 L49 S50 S296 G297 E298 F303 G304 | Q46-Y300 HydrophobicContact CB-CD1 4.19Å; Q46-Y300 HydrophobicContact CB-CE1 4.12Å; Q46-Y300 HydrophobicContact CG-CD1 3.86Å; Q46-Y300 HydrophobicContact CG-CD2 4.19Å; Q46-Y300 HydrophobicContact CG-CE1 3.57Å; Q46-Y300 HydrophobicContact CG-CE2 3.92Å; Q46-Y300 HydrophobicContact CG-CG 4.17Å; L49-Y300 HydrophobicContact CB-CE1 4.14Å; L49-Y300 HydrophobicContact CD2-CD1 3.81Å; L49-Y300 HydrophobicContact CD2-CE1 3.86Å; L49-Y300 WeakPolarHBondContact CD2-O 3.32Å; L49-Y300 HydrophobicContact CG-CE1 4.27Å; S50-Y300 PolarHBondContact OG-OH 2.86Å; S296-Y300 PolarHBondContact O-N 3.47Å; G297-Y300 PolarHBondContact O-N 3.41Å; E298-Y300 VanDerWaalsContact C-N 3.29Å; E298-Y300 PolarHBondContact O-N 2.88Å; Y300-F303 HydrophobicContact CD2-CD1 4.28Å; Y300-F303 HydrophobicContact CE2-CD1 4.11Å; Y300-F303 HydrophobicContact CE2-CE1 4.49Å; Y300-G304 PolarHBondContact O-N 2.89Å |
| 301 | I | 77.3 | Confident | 70.5 | Confident | 61 Ų | 61 | 70.7 Ų | 70.7 | 31% | 0.313 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -68.4 | -49.3 | 173.7 | -69.3 | 163.5 | 0 | 0 | 0 | 110.6 | V45 G297 E298 F303 G304 M305 | V45-I301 HydrophobicContact CG1-CD1 4.47Å; V45-I301 HydrophobicContact CG1-CG1 4.49Å; G297-I301 VanDerWaalsContact O-CG1 3.3Å; G297-I301 WeakPolarHBondContact O-CG1 3.31Å; G297-I301 PolarHBondContact O-N 3.34Å; E298-I301 PolarHBondContact O-N 3.4Å; I301-F303 VanDerWaalsContact C-N 3.27Å; I301-F303 PolarHBondContact O-N 3.42Å; I301-G304 PolarHBondContact O-N 2.7Å; I301-M305 WeakPolarHBondContact O-CG 3.32Å; I301-M305 PolarHBondContact O-N 3.27Å |
| 302 | V | 80.4 | Confident | 72.5 | Confident | 90 Ų | 90 | 63 Ų | 63 | 55% | 0.545 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -56.9 | -44.4 | 174.9 | 169.8 | 0 | 0 | 0 | 0 | 110.2 | E298 M305 V306 | E298-V302 WeakPolarHBondContact O-CB 3.4Å; E298-V302 WeakPolarHBondContact O-CG2 3.32Å; E298-V302 PolarHBondContact O-N 3.45Å; V302-M305 PolarHBondContact O-N 3.1Å; V302-V306 HydrophobicContact CG1-CG2 4.44Å; V302-V306 WeakPolarHBondContact O-CG2 3.45Å; V302-V306 PolarHBondContact O-N 2.96Å |
| 303 | F | 75.5 | Confident | 74.7 | Confident | 24 Ų | 24 | 60.1 Ų | 60.1 | 11% | 0.105 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -57.8 | -50 | 176.4 | 173.5 | -120.2 | 0 | 0 | 0 | 113.1 | Y281 W283 L286 E299 Y300 I301 M305 V306 L307 | Y281-F303 HydrophobicContact CD1-CE2 4.09Å; Y281-F303 HydrophobicContact CG-CE2 4.4Å; Y281-F303 WeakPolarHBondContact O-CE2 3.28Å; Y281-F303 WeakPolarHBondContact O-CZ 3.46Å; W283-F303 HydrophobicContact CE3-CE1 4.36Å; W283-F303 HydrophobicContact CE3-CZ 4.45Å; L286-F303 HydrophobicContact CD1-CD1 3.76Å; L286-F303 HydrophobicContact CD1-CE1 3.81Å; L286-F303 HydrophobicContact CD1-CG 4.18Å; L286-F303 HydrophobicContact CD1-CZ 4.29Å; E299-F303 WeakPolarHBondContact O-CB 3.12Å; E299-F303 PolarHBondContact O-N 3.2Å; Y300-F303 HydrophobicContact CD2-CD1 4.28Å; Y300-F303 HydrophobicContact CE2-CD1 4.11Å; Y300-F303 HydrophobicContact CE2-CE1 4.49Å; I301-F303 VanDerWaalsContact C-N 3.27Å; I301-F303 PolarHBondContact O-N 3.42Å; F303-M305 VanDerWaalsContact C-N 3.32Å; F303-M305 PolarHBondContact O-N 3.04Å; F303-V306 PolarHBondContact O-N 3.11Å; F303-L307 HydrophobicContact CD1-CD1 4.37Å; F303-L307 HydrophobicContact CD2-CG 4.47Å; F303-L307 HydrophobicContact CE1-CD1 3.66Å; F303-L307 HydrophobicContact CE1-CG 4.44Å; F303-L307 HydrophobicContact CE2-CD1 3.93Å; F303-L307 HydrophobicContact CE2-CD2 4.36Å; F303-L307 HydrophobicContact CE2-CG 3.83Å; F303-L307 HydrophobicContact CZ-CD1 3.4Å; F303-L307 HydrophobicContact CZ-CD2 4.37Å; F303-L307 HydrophobicContact CZ-CG 3.85Å; F303-L307 PolarHBondContact O-N 3.47Å |
| 304 | G | 79.3 | Confident | 76.9 | Confident | 4 Ų | 4 | 51.5 Ų | 51.5 | 4% | 0.041 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.1 | -35.3 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | H53 Y300 I301 L307 F308 | H53-G304 PolarHBondContact NE2-O 3.28Å; Y300-G304 PolarHBondContact O-N 2.89Å; I301-G304 PolarHBondContact O-N 2.7Å; G304-L307 PolarHBondContact O-N 2.7Å; G304-F308 WeakPolarHBondContact O-CB 3.49Å; G304-F308 PolarHBondContact O-N 3.39Å |
| 305 | M | 83.2 | Confident | 79 | Confident | 107 Ų | 107 | 45 Ų | 45 | 53% | 0.527 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -67.2 | -38.3 | 174.2 | -70.4 | -62.3 | -65.7 | 0 | 0 | 112.3 | I301 V302 F303 F308 L309 | I301-M305 WeakPolarHBondContact O-CG 3.32Å; I301-M305 PolarHBondContact O-N 3.27Å; V302-M305 PolarHBondContact O-N 3.1Å; F303-M305 VanDerWaalsContact C-N 3.32Å; F303-M305 PolarHBondContact O-N 3.04Å; M305-F308 PolarHBondContact O-N 3.34Å; M305-L309 WeakPolarHBondContact O-CB 3.3Å; M305-L309 VanDerWaalsContact O-CG 3.3Å; M305-L309 WeakPolarHBondContact O-CG 3.25Å; M305-L309 PolarHBondContact O-N 3.08Å |
| 306 | V | 84.6 | Confident | 80.8 | Confident | 45 Ų | 45 | 46 Ų | 46 | 27% | 0.273 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -66.5 | -43.2 | 174.6 | 169.7 | 0 | 0 | 0 | 0 | 111.4 | V302 F303 L309 W310 | V302-V306 HydrophobicContact CG1-CG2 4.44Å; V302-V306 WeakPolarHBondContact O-CG2 3.45Å; V302-V306 PolarHBondContact O-N 2.96Å; F303-V306 PolarHBondContact O-N 3.11Å; V306-L309 PolarHBondContact O-N 3.42Å; V306-W310 HydrophobicContact CG1-CD2 4.02Å; V306-W310 HydrophobicContact CG1-CE3 3.33Å; V306-W310 HydrophobicContact CG1-CH2 4.05Å; V306-W310 HydrophobicContact CG1-CZ3 3.36Å; V306-W310 PolarHBondContact O-N 3.26Å |
| 307 | L | 83.2 | Confident | 82.3 | Confident | 8 Ų | 8 | 44.2 Ų | 44.2 | 4% | 0.042 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.3 | -44.4 | 171 | -80.8 | 178.5 | 0 | 0 | 0 | 112.1 | Y281 F303 G304 E311 | Y281-L307 HydrophobicContact CD1-CD2 3.53Å; Y281-L307 HydrophobicContact CD1-CG 4.32Å; Y281-L307 HydrophobicContact CD2-CD2 4.17Å; Y281-L307 HydrophobicContact CE1-CD2 3.66Å; Y281-L307 HydrophobicContact CE2-CD2 4.27Å; Y281-L307 HydrophobicContact CG-CD2 3.78Å; F303-L307 HydrophobicContact CD1-CD1 4.37Å; F303-L307 HydrophobicContact CD2-CG 4.47Å; F303-L307 HydrophobicContact CE1-CD1 3.66Å; F303-L307 HydrophobicContact CE1-CG 4.44Å; F303-L307 HydrophobicContact CE2-CD1 3.93Å; F303-L307 HydrophobicContact CE2-CD2 4.36Å; F303-L307 HydrophobicContact CE2-CG 3.83Å; F303-L307 HydrophobicContact CZ-CD1 3.4Å; F303-L307 HydrophobicContact CZ-CD2 4.37Å; F303-L307 HydrophobicContact CZ-CG 3.85Å; F303-L307 PolarHBondContact O-N 3.47Å; G304-L307 PolarHBondContact O-N 2.7Å; L307-E311 HydrophobicContact CD2-CG 4.39Å; L307-E311 VanDerWaalsContact O-CB 3.24Å; L307-E311 WeakPolarHBondContact O-CB 3.19Å; L307-E311 PolarHBondContact O-N 2.71Å |
| 308 | F | 86.7 | Confident | 83.6 | Confident | 77 Ų | 77 | 43.9 Ų | 43.9 | 34% | 0.338 | 22% | 0.22 | S | C | . | . | I | π-helix | trans | -60.4 | -47.9 | 177.3 | -176.3 | -97.6 | 0 | 0 | 0 | 111.6 | L56 G304 M305 H312 V313 | L56-F308 HydrophobicContact CD1-CD2 4.05Å; L56-F308 HydrophobicContact CD1-CE2 4.03Å; G304-F308 WeakPolarHBondContact O-CB 3.49Å; G304-F308 PolarHBondContact O-N 3.39Å; M305-F308 PolarHBondContact O-N 3.34Å; F308-H312 HydrophobicContact CD2-CB 3.77Å; F308-H312 AromaticContact CD2-CG 3.98Å; F308-H312 HydrophobicContact CE2-CB 4.03Å; F308-H312 HydrophobicContact CG-CB 4.36Å; F308-H312 WeakPolarHBondContact O-CB 3.4Å; F308-H312 PolarHBondContact O-N 2.99Å; F308-H312 VanDerWaalsContact O-N 3.1Å; F308-V313 HydrophobicContact CD1-CG2 4.15Å; F308-V313 HydrophobicContact CE1-CG2 3.81Å; F308-V313 HydrophobicContact CZ-CG2 4.36Å; F308-V313 PolarHBondContact O-N 3.42Å; F308-V313 VanDerWaalsContact O-N 3.09Å |
| 309 | L | 89.6 | Confident | 84.6 | Confident | 82 Ų | 82 | 38 Ų | 38 | 43% | 0.429 | 19% | 0.192 | S | C | . | . | I | π-helix | trans | -67.4 | -44.6 | -178.6 | -71.3 | 169.8 | 0 | 0 | 0 | 113.3 | M305 V306 P314 | M305-L309 WeakPolarHBondContact O-CB 3.3Å; M305-L309 VanDerWaalsContact O-CG 3.3Å; M305-L309 WeakPolarHBondContact O-CG 3.25Å; M305-L309 PolarHBondContact O-N 3.08Å; V306-L309 PolarHBondContact O-N 3.42Å; L309-P314 WeakPolarHBondContact O-CD 3.24Å |
| 310 | W | 88.7 | Confident | 85.3 | Confident | 37 Ų | 37 | 36.4 Ų | 36.4 | 14% | 0.14 | 19% | 0.187 | C | C | . | . | I | π-helix | trans | -89.8 | -15.3 | -175.5 | -73.4 | -23.4 | 0 | 0 | 0 | 115.5 | Q135 S259 R260 Y263 Y281 V306 | Q135-W310 PolarHBondContact NE2-O 2.95Å; S259-W310 PolarHBondContact OG-NE1 3.35Å; R260-W310 HydrophobicContact CB-CD2 3.82Å; R260-W310 HydrophobicContact CB-CE3 4.31Å; R260-W310 HydrophobicContact CB-CG 3.97Å; R260-W310 HydrophobicContact CB-CZ2 4.43Å; R260-W310 HydrophobicContact CG-CD2 3.97Å; R260-W310 HydrophobicContact CG-CE3 3.98Å; R260-W310 HydrophobicContact CG-CG 4.32Å; R260-W310 HydrophobicContact CG-CZ3 4.47Å; Y263-W310 AromaticContact CD1-CH2 3.49Å; Y263-W310 HydrophobicContact CD1-CH2 3.49Å; Y263-W310 VanDerWaalsContact CD1-CH2 3.49Å; Y263-W310 HydrophobicContact CD1-CZ2 4.49Å; Y263-W310 HydrophobicContact CD1-CZ3 4.03Å; Y263-W310 HydrophobicContact CD2-CH2 4.19Å; Y263-W310 HydrophobicContact CE1-CH2 4.07Å; Y263-W310 HydrophobicContact CE1-CZ3 4.39Å; Y263-W310 AromaticContact CG-CH2 3.56Å; Y263-W310 HydrophobicContact CG-CH2 3.56Å; Y263-W310 HydrophobicContact CG-CZ2 4.19Å; Y281-W310 HydrophobicContact CE1-CE3 4.32Å; V306-W310 HydrophobicContact CG1-CD2 4.02Å; V306-W310 HydrophobicContact CG1-CE3 3.33Å; V306-W310 HydrophobicContact CG1-CH2 4.05Å; V306-W310 HydrophobicContact CG1-CZ3 3.36Å; V306-W310 PolarHBondContact O-N 3.26Å |
| 311 | E | 88.2 | Confident | 85.9 | Confident | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 18% | 0.184 | C | C | . | . | I | π-helix | trans | -116.9 | -50.8 | -179.4 | -59.7 | -140.1 | 142.3 | 0 | 0 | 113 | Y57 W92 R96 R260 Y281 L307 A315 | Y57-E311 PolarHBondContact OH-OE2 3.43Å; W92-E311 HydrophobicContact CH2-CB 3.92Å; W92-E311 HydrophobicContact CZ2-CB 3.81Å; W92-E311 HydrophobicContact CZ2-CG 4.36Å; R96-E311 IonicContact CZ-OE1 3.18Å; R96-E311 IonicContact CZ-OE2 3.95Å; R96-E311 IonicContact NE-OE1 2.74Å; R96-E311 IonicContact NE-OE2 2.71Å; R96-E311 PolarHBondContact NE-OE2 3.49Å; R96-E311 IonicContact NH2-OE1 2.87Å; R96-E311 PolarHBondContact NH2-OE1 3.41Å; R96-E311 IonicContact NH2-OE2 2.7Å; R96-E311 PolarHBondContact NH2-OE2 3.37Å; R260-E311 IonicContact NH1-OE1 3.75Å; Y281-E311 HydrophobicContact CE2-CG 4.48Å; Y281-E311 VanDerWaalsContact CE2-OE1 3.29Å; Y281-E311 WeakPolarHBondContact CE2-OE1 3.05Å; Y281-E311 WeakPolarHBondContact OH-CG 3.43Å; Y281-E311 PolarHBondContact OH-OE1 2.86Å; L307-E311 HydrophobicContact CD2-CG 4.39Å; L307-E311 VanDerWaalsContact O-CB 3.24Å; L307-E311 WeakPolarHBondContact O-CB 3.19Å; L307-E311 PolarHBondContact O-N 2.71Å; E311-A315 VanDerWaalsContact O-CB 3.27Å; E311-A315 WeakPolarHBondContact O-CB 3.21Å; E311-A315 PolarHBondContact O-N 2.73Å |
| 312 | H | 87.9 | Confident | 86 | Confident | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -73.3 | -49.5 | -175.4 | -69.8 | 78.5 | 0 | 0 | 0 | 112.4 | H53 L56 Y57 F308 A315 W316 | H53-H312 AromaticContact CD2-CE1 3.59Å; L56-H312 WeakPolarHBondContact CB-NE2 3.04Å; Y57-H312 AromaticContact CD1-NE2 3.74Å; Y57-H312 AromaticContact CD2-NE2 3.99Å; Y57-H312 AromaticContact CE1-CE1 3.54Å; Y57-H312 AromaticContact CE1-NE2 3.58Å; Y57-H312 AromaticContact CE2-CE1 3.63Å; Y57-H312 AromaticContact CE2-NE2 3.82Å; Y57-H312 AromaticContact CG-NE2 3.93Å; Y57-H312 AromaticContact CZ-CE1 3.22Å; Y57-H312 AromaticContact CZ-NE2 3.62Å; Y57-H312 PolarHBondContact OH-CE1 3.39Å; F308-H312 HydrophobicContact CD2-CB 3.77Å; F308-H312 AromaticContact CD2-CG 3.98Å; F308-H312 HydrophobicContact CE2-CB 4.03Å; F308-H312 HydrophobicContact CG-CB 4.36Å; F308-H312 WeakPolarHBondContact O-CB 3.4Å; F308-H312 PolarHBondContact O-N 2.99Å; F308-H312 VanDerWaalsContact O-N 3.1Å; H312-A315 PolarHBondContact O-N 3.24Å; H312-W316 WeakPolarHBondContact O-CB 3.39Å; H312-W316 PolarHBondContact O-N 2.94Å |
| 313 | V | 91.4 | Very high | 85.8 | Confident | 43 Ų | 43 | 34.8 Ų | 34.8 | 26% | 0.261 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -60.4 | -45.3 | -176.4 | -179.9 | 0 | 0 | 0 | 0 | 112.2 | V252 L256 F308 S317 | V252-V313 HydrophobicContact CG1-CG1 3.81Å; L256-V313 HydrophobicContact CD1-CB 3.82Å; L256-V313 HydrophobicContact CD1-CG1 3.57Å; F308-V313 HydrophobicContact CD1-CG2 4.15Å; F308-V313 HydrophobicContact CE1-CG2 3.81Å; F308-V313 HydrophobicContact CZ-CG2 4.36Å; F308-V313 PolarHBondContact O-N 3.42Å; F308-V313 VanDerWaalsContact O-N 3.09Å; V313-S317 VanDerWaalsContact O-CB 3.26Å; V313-S317 WeakPolarHBondContact O-CB 3.17Å; V313-S317 PolarHBondContact O-N 3.43Å; V313-S317 PolarHBondContact O-OG 3Å |
| 314 | P | 88.8 | Confident | 84.8 | Confident | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.8 | -47.9 | 175 | -23.4 | 35.9 | 0 | 0 | 0 | 112.2 | L256 Y257 L309 S317 V318 | L256-P314 HydrophobicContact CB-CG 3.88Å; L256-P314 HydrophobicContact CD1-CG 3.78Å; L256-P314 HydrophobicContact CG-CG 4.48Å; Y257-P314 HydrophobicContact CE2-CB 3.92Å; Y257-P314 WeakPolarHBondContact OH-CB 3.48Å; L309-P314 WeakPolarHBondContact O-CD 3.24Å; P314-S317 PolarHBondContact O-N 2.89Å; P314-S317 PolarHBondContact O-OG 3.22Å; P314-V318 WeakPolarHBondContact O-CG2 3.39Å; P314-V318 PolarHBondContact O-N 2.91Å |
| 315 | A | 89.8 | Confident | 83.5 | Confident | 8 Ų | 8 | 41.5 Ų | 41.5 | 7% | 0.066 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.1 | -45.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L60 W92 E311 H312 V318 V319 | L60-A315 HydrophobicContact CD2-CB 3.8Å; W92-A315 HydrophobicContact CE3-CB 4.2Å; W92-A315 HydrophobicContact CH2-CB 3.91Å; W92-A315 HydrophobicContact CZ3-CB 3.58Å; E311-A315 VanDerWaalsContact O-CB 3.27Å; E311-A315 WeakPolarHBondContact O-CB 3.21Å; E311-A315 PolarHBondContact O-N 2.73Å; H312-A315 PolarHBondContact O-N 3.24Å; A315-V318 PolarHBondContact O-N 3.45Å; A315-V319 WeakPolarHBondContact O-CG2 3.37Å; A315-V319 PolarHBondContact O-N 3.47Å |
| 316 | W | 90.4 | Very high | 81.5 | Confident | 64 Ų | 64 | 44.7 Ų | 44.7 | 24% | 0.242 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.4 | -40.9 | 173.9 | -83.2 | 99.6 | 0 | 0 | 0 | 112 | A59 L60 F63 H312 V318 V319 L320 | A59-W316 HydrophobicContact CB-CH2 4.35Å; A59-W316 HydrophobicContact CB-CZ2 4.09Å; L60-W316 HydrophobicContact CB-CH2 4.48Å; L60-W316 HydrophobicContact CB-CZ2 3.79Å; L60-W316 HydrophobicContact CD1-CD2 3.69Å; L60-W316 HydrophobicContact CD1-CE3 4.04Å; L60-W316 HydrophobicContact CD1-CG 3.99Å; L60-W316 HydrophobicContact CD1-CZ2 4.2Å; L60-W316 HydrophobicContact CD1-CZ3 4.43Å; F63-W316 HydrophobicContact CB-CH2 4.3Å; F63-W316 HydrophobicContact CB-CZ3 4.37Å; F63-W316 HydrophobicContact CD1-CE3 4.28Å; F63-W316 HydrophobicContact CD1-CH2 4.35Å; F63-W316 AromaticContact CD1-CZ3 3.6Å; F63-W316 HydrophobicContact CD1-CZ3 3.6Å; F63-W316 HydrophobicContact CE1-CZ3 4.15Å; F63-W316 HydrophobicContact CG-CZ3 4.17Å; H312-W316 WeakPolarHBondContact O-CB 3.39Å; H312-W316 PolarHBondContact O-N 2.94Å; W316-V318 VanDerWaalsContact C-N 3.33Å; W316-V318 PolarHBondContact O-N 3.25Å; W316-V319 PolarHBondContact O-N 2.85Å; W316-L320 HydrophobicContact CE3-CD1 4.48Å; W316-L320 VanDerWaalsContact O-CB 3.22Å; W316-L320 WeakPolarHBondContact O-CB 3.5Å; W316-L320 WeakPolarHBondContact O-CD1 3.33Å; W316-L320 WeakPolarHBondContact O-CG 3.25Å; W316-L320 PolarHBondContact O-N 3.26Å |
| 317 | S | 90.1 | Very high | 79.4 | Confident | 15 Ų | 15 | 48.7 Ų | 48.7 | 11% | 0.105 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.4 | -40.1 | 178.1 | 76.5 | 0 | 0 | 0 | 0 | 112.4 | V313 P314 F321 | V313-S317 VanDerWaalsContact O-CB 3.26Å; V313-S317 WeakPolarHBondContact O-CB 3.17Å; V313-S317 PolarHBondContact O-N 3.43Å; V313-S317 PolarHBondContact O-OG 3Å; P314-S317 PolarHBondContact O-N 2.89Å; P314-S317 PolarHBondContact O-OG 3.22Å; S317-F321 VanDerWaalsContact O-CB 3.3Å; S317-F321 WeakPolarHBondContact O-CB 3.45Å; S317-F321 PolarHBondContact O-N 2.9Å |
| 318 | V | 89 | Confident | 77.1 | Confident | 5 Ų | 5 | 54 Ų | 54 | 3% | 0.03 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -71.1 | -44.4 | 178.5 | 170.6 | 0 | 0 | 0 | 0 | 111.5 | C85 T138 V253 P314 A315 W316 L320 F321 F322 | C85-V318 WeakPolarHBondContact SG-CG1 3.36Å; T138-V318 HydrophobicContact CG2-CG1 3.95Å; V253-V318 HydrophobicContact CG2-CG2 3.95Å; P314-V318 WeakPolarHBondContact O-CG2 3.39Å; P314-V318 PolarHBondContact O-N 2.91Å; A315-V318 PolarHBondContact O-N 3.45Å; W316-V318 VanDerWaalsContact C-N 3.33Å; W316-V318 PolarHBondContact O-N 3.25Å; V318-L320 VanDerWaalsContact C-N 3.29Å; V318-L320 PolarHBondContact O-N 3.1Å; V318-F321 PolarHBondContact O-N 2.9Å; V318-F322 HydrophobicContact CG1-CD2 3.9Å; V318-F322 HydrophobicContact CG1-CE2 4.13Å; V318-F322 WeakPolarHBondContact O-CD2 3.47Å; V318-F322 PolarHBondContact O-N 3.19Å |
| 319 | V | 89.1 | Confident | 74.9 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -70.6 | -25.6 | 177.6 | 177.5 | 0 | 0 | 0 | 0 | 111.8 | L60 F63 A64 Q67 L86 C89 A315 W316 R323 | L60-V319 HydrophobicContact CD1-CB 4.09Å; L60-V319 HydrophobicContact CD1-CG1 4.33Å; L60-V319 HydrophobicContact CD1-CG2 4.02Å; F63-V319 HydrophobicContact CD1-CG1 3.58Å; F63-V319 HydrophobicContact CE1-CG1 3.86Å; A64-V319 HydrophobicContact CB-CG1 4.28Å; Q67-V319 PolarHBondContact NE2-O 2.92Å; L86-V319 HydrophobicContact CD2-CB 4.47Å; L86-V319 HydrophobicContact CD2-CG1 4.06Å; L86-V319 HydrophobicContact CD2-CG2 4.31Å; C89-V319 HydrophobicContact CB-CG2 3.61Å; A315-V319 WeakPolarHBondContact O-CG2 3.37Å; A315-V319 PolarHBondContact O-N 3.47Å; W316-V319 PolarHBondContact O-N 2.85Å; V319-R323 PolarHBondContact O-N 3.43Å |
| 320 | L | 86.4 | Confident | 72.5 | Confident | 72 Ų | 72 | 59.4 Ų | 59.4 | 38% | 0.377 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -79.7 | -28.8 | 170.1 | -72.6 | 168.5 | 0 | 0 | 0 | 113.2 | F63 W316 V318 R323 | F63-L320 HydrophobicContact CE1-CD2 3.78Å; F63-L320 HydrophobicContact CE1-CG 4.37Å; F63-L320 HydrophobicContact CZ-CD2 3.99Å; W316-L320 HydrophobicContact CE3-CD1 4.48Å; W316-L320 VanDerWaalsContact O-CB 3.22Å; W316-L320 WeakPolarHBondContact O-CB 3.5Å; W316-L320 WeakPolarHBondContact O-CD1 3.33Å; W316-L320 WeakPolarHBondContact O-CG 3.25Å; W316-L320 PolarHBondContact O-N 3.26Å; V318-L320 VanDerWaalsContact C-N 3.29Å; V318-L320 PolarHBondContact O-N 3.1Å; L320-R323 WeakPolarHBondContact O-CB 3.46Å |
| 321 | F | 85.2 | Confident | 70.4 | Confident | 6 Ų | 6 | 63.6 Ų | 63.6 | 3% | 0.026 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -70.2 | -45.9 | 173.1 | 176.6 | -106.1 | 0 | 0 | 0 | 112.2 | L142 Y145 M241 Q245 T246 V249 S317 V318 R323 | L142-F321 HydrophobicContact CD1-CD1 4.2Å; L142-F321 HydrophobicContact CD1-CE1 3.94Å; Y145-F321 HydrophobicContact CD1-CE1 4.04Å; Y145-F321 HydrophobicContact CD1-CZ 4.45Å; Y145-F321 AromaticContact CE1-CE1 3.83Å; Y145-F321 HydrophobicContact CE1-CE1 3.83Å; Y145-F321 HydrophobicContact CE1-CZ 4.02Å; M241-F321 HydrophobicContact CG-CE2 4.41Å; M241-F321 HydrophobicContact SD-CE1 4.28Å; M241-F321 HydrophobicContact SD-CE2 4.08Å; M241-F321 HydrophobicContact SD-CZ 3.69Å; Q245-F321 HydrophobicContact CG-CD2 4.3Å; T246-F321 HydrophobicContact CG2-CE2 4.06Å; T246-F321 HydrophobicContact CG2-CZ 4.12Å; V249-F321 HydrophobicContact CB-CB 4.41Å; V249-F321 HydrophobicContact CB-CD2 4.42Å; V249-F321 HydrophobicContact CG1-CB 3.97Å; V249-F321 HydrophobicContact CG1-CG 4.34Å; V249-F321 HydrophobicContact CG2-CB 4.2Å; V249-F321 HydrophobicContact CG2-CD2 4.49Å; S317-F321 VanDerWaalsContact O-CB 3.3Å; S317-F321 WeakPolarHBondContact O-CB 3.45Å; S317-F321 PolarHBondContact O-N 2.9Å; V318-F321 PolarHBondContact O-N 2.9Å; F321-R323 PolarHBondContact O-N 2.94Å |
| 322 | F | 78.6 | Confident | 67.8 | Low | 3 Ų | 3 | 67 Ų | 67 | 1% | 0.013 | 34% | 0.342 | C | S | . | . | S | Bend | trans | -80.6 | 4.6 | 175.5 | -73.6 | -61.5 | 0 | 0 | 0 | 114.1 | Q67 Q82 C85 L86 L142 Y145 V318 A324 | Q67-F322 PolarHBondContact OE1-O 2.98Å; Q82-F322 HydrophobicContact CB-CD1 3.89Å; Q82-F322 HydrophobicContact CB-CE1 4.3Å; Q82-F322 HydrophobicContact CG-CB 4.1Å; Q82-F322 HydrophobicContact CG-CD1 3.76Å; Q82-F322 HydrophobicContact CG-CG 4.24Å; Q82-F322 PolarHBondContact NE2-O 3.06Å; C85-F322 HydrophobicContact CB-CD2 4.02Å; C85-F322 HydrophobicContact CB-CE2 3.89Å; C85-F322 HydrophobicContact CB-CZ 4.47Å; C85-F322 WeakPolarHBondContact SG-CD2 3.3Å; C85-F322 WeakPolarHBondContact SG-CE2 3.44Å; L86-F322 HydrophobicContact CD2-CB 4.19Å; L86-F322 HydrophobicContact CG-CB 4.26Å; L142-F322 HydrophobicContact CD1-CE2 4.12Å; L142-F322 HydrophobicContact CD1-CZ 4.1Å; Y145-F322 AromaticContact CD1-CE1 3.86Å; Y145-F322 HydrophobicContact CD1-CE1 3.86Å; Y145-F322 AromaticContact CD1-CZ 3.92Å; Y145-F322 HydrophobicContact CD1-CZ 3.92Å; Y145-F322 HydrophobicContact CD2-CE1 4.35Å; Y145-F322 AromaticContact CE1-CE1 3.84Å; Y145-F322 HydrophobicContact CE1-CE1 3.84Å; Y145-F322 HydrophobicContact CE1-CZ 4.33Å; Y145-F322 HydrophobicContact CE2-CE1 4.33Å; Y145-F322 HydrophobicContact CG-CE1 4.12Å; Y145-F322 HydrophobicContact CG-CZ 4.12Å; V318-F322 HydrophobicContact CG1-CD2 3.9Å; V318-F322 HydrophobicContact CG1-CE2 4.13Å; V318-F322 WeakPolarHBondContact O-CD2 3.47Å; V318-F322 PolarHBondContact O-N 3.19Å; F322-A324 PolarHBondContact O-N 3.37Å |
| 323 | R | 76.6 | Confident | 65.6 | Low | 130 Ų | 130 | 71.9 Ų | 71.9 | 49% | 0.491 | 37% | 0.374 | S | S | . | . | trans | -57.9 | 122.8 | 173.6 | -175.2 | -175.3 | -180 | 166.4 | -1.9 | 110.2 | F63 Q67 V319 L320 F321 Q325 | F63-R323 HydrophobicContact CZ-CG 4.25Å; Q67-R323 VanDerWaalsContact OE1-CA 3.28Å; V319-R323 PolarHBondContact O-N 3.43Å; L320-R323 WeakPolarHBondContact O-CB 3.46Å; F321-R323 PolarHBondContact O-N 2.94Å; R323-Q325 PolarHBondContact O-N 3.48Å | ||
| 324 | A | 54.3 | Low | 63.2 | Low | 56 Ų | 56 | 75.4 Ų | 75.4 | 46% | 0.463 | 41% | 0.408 | S | S | . | . | trans | -64 | 84.9 | 166.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | F322 | F322-A324 PolarHBondContact O-N 3.37Š| ||
| 325 | Q | 52 | Low | 61.1 | Low | 112 Ų | 112 | 77.5 Ų | 77.5 | 52% | 0.523 | 43% | 0.43 | S | S | . | . | trans | -57.5 | 146.2 | 151.8 | -72.2 | 178.9 | -92.4 | 0 | 0 | 107.8 | R323 L327 | R323-Q325 PolarHBondContact O-N 3.48Å; Q325-L327 PolarHBondContact O-N 2.9Å | ||
| 326 | R | 42.1 | Very low | 58.7 | Low | 174 Ų | 174 | 85.6 Ų | 85.6 | 66% | 0.657 | 47% | 0.468 | S | S | * | . | trans | -65.5 | 114.5 | -165.2 | -70.4 | -175.7 | 177.8 | -164.6 | 3.8 | 110.9 | N328 Q329 | R326-N328 HydrophobicContact CB-CB 4.49Å; R326-N328 PolarHBondContact O-N 2.64Å; R326-Q329 HydrophobicContact CB-CB 4.07Å; R326-Q329 HydrophobicContact CB-CG 4.04Å; R326-Q329 PolarHBondContact O-N 3.36Å | ||
| 327 | L | 38.9 | Very low | 56.1 | Low | 129 Ų | 129 | 90.6 Ų | 90.6 | 68% | 0.675 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.2 | -27.2 | 154.9 | -174 | 66.1 | 0 | 0 | 0 | 111.3 | Q325 L331 | Q325-L327 PolarHBondContact O-N 2.9Å; L327-L331 HydrophobicContact CD1-CD1 4.47Å; L327-L331 WeakPolarHBondContact O-CD1 3.31Å |
| 328 | N | 36.5 | Very low | 53.7 | Low | 119 Ų | 119 | 96.4 Ų | 96.4 | 64% | 0.636 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.8 | 29.7 | 177.8 | -121.2 | -64.3 | 0 | 0 | 0 | 115 | R326 | R326-N328 HydrophobicContact CB-CB 4.49Å; R326-N328 PolarHBondContact O-N 2.64Å |
| 329 | Q | 40.4 | Very low | 51.2 | Low | 135 Ų | 135 | 100.6 Ų | 100.6 | 63% | 0.631 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121 | -18.2 | 165.7 | -89.3 | 178.1 | -65 | 0 | 0 | 114.3 | R326 | R326-Q329 HydrophobicContact CB-CB 4.07Å; R326-Q329 HydrophobicContact CB-CG 4.04Å; R326-Q329 PolarHBondContact O-N 3.36Å |
| 330 | N | 39.1 | Very low | 49.1 | Very low | 139 Ų | 139 | 109.2 Ų | 109.2 | 74% | 0.743 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -105.6 | 4.7 | 173.2 | -67.6 | -20.2 | 0 | 0 | 0 | 113.3 | ||
| 331 | L | 44.5 | Very low | 46.7 | Very low | 124 Ų | 124 | 110.8 Ų | 110.8 | 65% | 0.649 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -119 | 20.1 | -179.6 | -86.8 | 84.6 | 0 | 0 | 0 | 113.4 | L327 | L327-L331 HydrophobicContact CD1-CD1 4.47Å; L327-L331 WeakPolarHBondContact O-CD1 3.31Å |
| 332 | A | 33.7 | Very low | 44.9 | Very low | 72 Ų | 72 | 122.2 Ų | 122.2 | 60% | 0.595 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -133.3 | 100.9 | -179 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 333 | P | 39.9 | Very low | 42.8 | Very low | 103 Ų | 103 | 127.1 Ų | 127.1 | 67% | 0.669 | 69% | 0.693 | S | S | * | * | cis | -112.4 | 154.9 | -20.8 | 22.6 | -3.1 | 0 | 0 | 0 | 112.3 | G335 | P333-G335 PolarHBondContact O-N 3.24Š| ||
| 334 | A | 42.2 | Very low | 41.2 | Very low | 118 Ų | 118 | 127.1 Ų | 127.1 | 98% | 0.975 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -75.6 | 57.5 | 163.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 335 | G | 44.3 | Very low | 41.1 | Very low | 44 Ų | 44 | 133.4 Ų | 133.4 | 45% | 0.454 | 73% | 0.725 | S | S | . | * | S | Bend | trans | -170.1 | 119.2 | -174.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | P333 | P333-G335 PolarHBondContact O-N 3.24Š|
| 336 | M | 39.5 | Very low | 41 | Very low | 178 Ų | 178 | 132.4 Ų | 132.4 | 88% | 0.877 | 74% | 0.736 | S | S | * | * | trans | 63.7 | 59.9 | 171.4 | -157.7 | 175.2 | 68.8 | 0 | 0 | 117.1 | N338 | M336-N338 HydrophobicContact CG-CB 4.32Å; M336-N338 PolarHBondContact O-N 3.39Å | ||
| 337 | I | 35.3 | Very low | 41.7 | Very low | 169 Ų | 169 | 131.5 Ų | 131.5 | 87% | 0.867 | 73% | 0.734 | S | S | * | * | trans | -88.3 | 78.8 | 144.4 | 43.9 | 169.6 | 0 | 0 | 0 | 109.5 | S339 | I337-S339 PolarHBondContact O-N 2.9Š| ||
| 338 | N | 39.6 | Very low | 42.4 | Very low | 136 Ų | 136 | 131.7 Ų | 131.7 | 73% | 0.727 | 73% | 0.73 | S | S | * | * | trans | -88 | 90.9 | 171.7 | 179.2 | 21.9 | 0 | 0 | 0 | 110.4 | M336 | M336-N338 HydrophobicContact CG-CB 4.32Å; M336-N338 PolarHBondContact O-N 3.39Å | ||
| 339 | S | 36.8 | Very low | 43.3 | Very low | 94 Ų | 94 | 134.9 Ų | 134.9 | 66% | 0.657 | 74% | 0.738 | S | S | * | * | trans | -158.7 | 118.1 | 164.3 | 59.7 | 0 | 0 | 0 | 0 | 110.5 | I337 S341 | I337-S339 PolarHBondContact O-N 2.9Å; S339-S341 PolarHBondContact O-N 3.02Å | ||
| 340 | H | 45 | Very low | 44.1 | Very low | 180 Ų | 180 | 134 Ų | 134 | 83% | 0.833 | 74% | 0.738 | S | S | * | * | trans | -54.7 | 125.6 | 177.9 | -65.9 | -108.4 | 0 | 0 | 0 | 111.6 | ||||
| 341 | S | 36.3 | Very low | 44.8 | Very low | 105 Ų | 105 | 132.1 Ų | 132.1 | 73% | 0.734 | 73% | 0.727 | S | S | * | * | trans | -149.9 | 123.5 | 165.2 | -77.3 | 0 | 0 | 0 | 0 | 108.4 | S339 S343 | S339-S341 PolarHBondContact O-N 3.02Å; S341-S343 PolarHBondContact O-N 3.14Å | ||
| 342 | Y | 46.9 | Very low | 45.6 | Very low | 246 Ų | 246 | 132.1 Ų | 132.1 | 97% | 0.965 | 74% | 0.735 | S | S | * | * | trans | -69.5 | 104.3 | -165.7 | -81.2 | -107 | 0 | 0 | 0 | 112.2 | ||||
| 343 | S | 34.5 | Very low | 46.6 | Very low | 106 Ų | 106 | 137.2 Ų | 137.2 | 74% | 0.741 | 74% | 0.739 | S | S | * | * | trans | -103.5 | 111.1 | 162.5 | -173.6 | 0 | 0 | 0 | 0 | 109.2 | S341 R345 | S341-S343 PolarHBondContact O-N 3.14Å; S343-R345 PolarHBondContact O-N 3.36Å | ||
| 344 | S | 42.8 | Very low | 47.4 | Very low | 130 Ų | 130 | 138.6 Ų | 138.6 | 91% | 0.909 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -79.2 | 48 | -169.7 | -170.9 | 0 | 0 | 0 | 0 | 113.6 | ||
| 345 | R | 52.2 | Low | 47.8 | Very low | 188 Ų | 188 | 143 Ų | 143 | 71% | 0.709 | 72% | 0.724 | S | S | * | * | trans | -156 | 45.5 | 177.1 | -137.8 | 177.7 | -167.2 | 104.2 | 1.5 | 114.5 | S343 Y347 | S343-R345 PolarHBondContact O-N 3.36Å; R345-Y347 HydrophobicContact CG-CE2 4.16Å; R345-Y347 VanDerWaalsContact O-CD2 3.3Å; R345-Y347 WeakPolarHBondContact O-CD2 3.44Å; R345-Y347 PolarHBondContact O-N 2.77Å | ||
| 346 | A | 51.3 | Low | 48.4 | Very low | 91 Ų | 91 | 146.8 Ų | 146.8 | 75% | 0.752 | 73% | 0.733 | S | S | * | * | trans | -60.4 | 124.7 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 347 | Y | 55.7 | Low | 48.9 | Very low | 155 Ų | 155 | 141.2 Ų | 141.2 | 61% | 0.608 | 71% | 0.712 | S | S | * | * | trans | -80.4 | 154.9 | 177.6 | -78.3 | -101 | 0 | 0 | 0 | 110 | R345 F349 D350 | R345-Y347 HydrophobicContact CG-CE2 4.16Å; R345-Y347 VanDerWaalsContact O-CD2 3.3Å; R345-Y347 WeakPolarHBondContact O-CD2 3.44Å; R345-Y347 PolarHBondContact O-N 2.77Å; Y347-F349 PolarHBondContact O-N 3.44Å; Y347-D350 PolarHBondContact N-OD2 3.24Å; Y347-D350 PolarHBondContact O-N 3.33Å | ||
| 348 | F | 54.4 | Low | 49.6 | Very low | 134 Ų | 134 | 140.6 Ų | 140.6 | 59% | 0.588 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.3 | -25 | -168.1 | -173 | -95.6 | 0 | 0 | 0 | 114.6 | ||
| 349 | F | 55.2 | Low | 50.2 | Low | 185 Ų | 185 | 141.1 Ų | 141.1 | 81% | 0.811 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -9 | -175.9 | -59.3 | -79.2 | 0 | 0 | 0 | 114.8 | Y347 N351 | Y347-F349 PolarHBondContact O-N 3.44Å; F349-N351 VanDerWaalsContact C-N 3.35Å; F349-N351 PolarHBondContact O-N 2.94Å |
| 350 | D | 56.1 | Low | 50.7 | Low | 118 Ų | 118 | 143.5 Ų | 143.5 | 63% | 0.631 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -80.9 | -7.6 | -173 | -71 | -44.3 | 0 | 0 | 0 | 114.6 | Y347 P352 | Y347-D350 PolarHBondContact N-OD2 3.24Å; Y347-D350 PolarHBondContact O-N 3.33Å; D350-P352 VanDerWaalsContact O-CD 3.3Å; D350-P352 WeakPolarHBondContact O-CD 3.16Å |
| 351 | N | 55.5 | Low | 50.8 | Low | 98 Ų | 98 | 141.9 Ų | 141.9 | 52% | 0.524 | 72% | 0.715 | S | S | . | * | trans | -112.3 | 91.8 | -178.7 | -172.7 | 5.3 | 0 | 0 | 0 | 112.3 | F349 R353 R354 | F349-N351 VanDerWaalsContact C-N 3.35Å; F349-N351 PolarHBondContact O-N 2.94Å; N351-R353 PolarHBondContact O-N 3.02Å; N351-R353 VanDerWaalsContact O-N 3.11Å; N351-R353 PolarHBondContact OD1-N 3.06Å; N351-R354 PolarHBondContact O-N 3.07Å | ||
| 352 | P | 60.2 | Low | 51 | Low | 124 Ų | 124 | 142.5 Ų | 142.5 | 81% | 0.805 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69 | -7 | -177.2 | 28.4 | -35.9 | 0 | 0 | 0 | 114.6 | D350 | D350-P352 VanDerWaalsContact O-CD 3.3Å; D350-P352 WeakPolarHBondContact O-CD 3.16Å |
| 353 | R | 55.3 | Low | 50.9 | Low | 179 Ų | 179 | 142.7 Ų | 142.7 | 68% | 0.675 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.8 | 11.1 | 176.7 | -70.8 | -157.7 | 169.2 | 96.3 | 0.4 | 114.6 | N351 Y355 D356 | N351-R353 PolarHBondContact O-N 3.02Å; N351-R353 VanDerWaalsContact O-N 3.11Å; N351-R353 PolarHBondContact OD1-N 3.06Å; R353-Y355 PolarHBondContact O-N 3.28Å; R353-D356 HydrophobicContact CB-CB 4.41Å; R353-D356 WeakPolarHBondContact CD-OD2 3.31Å; R353-D356 VanDerWaalsContact CG-OD2 3.31Å; R353-D356 WeakPolarHBondContact CG-OD2 3.44Å; R353-D356 IonicContact NE-OD2 3.93Å; R353-D356 PolarHBondContact O-N 3.41Å |
| 354 | R | 55.7 | Low | 50.9 | Low | 132 Ų | 132 | 146 Ų | 146 | 50% | 0.498 | 72% | 0.724 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -63.3 | -15.2 | -178.1 | -166.7 | 169 | -171.8 | 153.8 | 9 | 114.5 | N351 | N351-R354 PolarHBondContact O-N 3.07Š|
| 355 | Y | 51.7 | Low | 50.5 | Low | 212 Ų | 212 | 143.4 Ų | 143.4 | 83% | 0.831 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.6 | 1.1 | 175.2 | -63.9 | -77.2 | 0 | 0 | 0 | 113.9 | R353 S357 | R353-Y355 PolarHBondContact O-N 3.28Å; Y355-S357 VanDerWaalsContact C-N 3.31Å |
| 356 | D | 55.9 | Low | 49.6 | Very low | 122 Ų | 122 | 139.5 Ų | 139.5 | 65% | 0.652 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -89.2 | 10.6 | 176.3 | -70.7 | -24.3 | 0 | 0 | 0 | 112.7 | R353 | R353-D356 HydrophobicContact CB-CB 4.41Å; R353-D356 WeakPolarHBondContact CD-OD2 3.31Å; R353-D356 VanDerWaalsContact CG-OD2 3.31Å; R353-D356 WeakPolarHBondContact CG-OD2 3.44Å; R353-D356 IonicContact NE-OD2 3.93Å; R353-D356 PolarHBondContact O-N 3.41Å |
| 357 | S | 51.1 | Low | 48.7 | Very low | 62 Ų | 62 | 140 Ų | 140 | 43% | 0.434 | 72% | 0.717 | S | S | . | * | trans | -130.5 | 102.7 | -175.2 | 59.1 | 0 | 0 | 0 | 0 | 112.5 | Y355 D359 | Y355-S357 VanDerWaalsContact C-N 3.31Å; S357-D359 PolarHBondContact O-N 3.27Å | ||
| 358 | D | 49 | Very low | 47.7 | Very low | 155 Ų | 155 | 142.2 Ų | 142.2 | 83% | 0.829 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | 12.5 | 177.6 | -67.2 | -55.4 | 0 | 0 | 0 | 114.6 | D360 | D358-D360 VanDerWaalsContact C-N 3.35Å; D358-D360 PolarHBondContact O-N 3Å |
| 359 | D | 53.4 | Low | 46.7 | Very low | 148 Ų | 148 | 143.2 Ų | 143.2 | 79% | 0.791 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | -14.5 | -173.9 | -84.3 | -57.5 | 0 | 0 | 0 | 114.7 | S357 L361 | S357-D359 PolarHBondContact O-N 3.27Å; D359-L361 PolarHBondContact O-N 3.11Å |
| 360 | D | 46.4 | Very low | 45.5 | Very low | 144 Ų | 144 | 137.7 Ų | 137.7 | 77% | 0.77 | 73% | 0.726 | S | S | * | * | trans | -81.3 | 44.9 | -179.7 | -88.7 | -27.4 | 0 | 0 | 0 | 113.1 | D358 | D358-D360 VanDerWaalsContact C-N 3.35Å; D358-D360 PolarHBondContact O-N 3Å | ||
| 361 | L | 47.8 | Very low | 44.3 | Very low | 146 Ų | 146 | 138.4 Ų | 138.4 | 76% | 0.764 | 74% | 0.741 | S | S | * | * | trans | -108.1 | 111.2 | 170 | -93.4 | 170.2 | 0 | 0 | 0 | 111.4 | D359 R363 | D359-L361 PolarHBondContact O-N 3.11Å; L361-R363 PolarHBondContact O-N 3.43Å | ||
| 362 | P | 39.5 | Very low | 43.2 | Very low | 118 Ų | 118 | 141.8 Ų | 141.8 | 77% | 0.766 | 76% | 0.758 | S | S | * | * | trans | -68.4 | 117.4 | -179 | 27.1 | -33.4 | 0 | 0 | 0 | 111.1 | L364 | P362-L364 PolarHBondContact O-N 3.15Å; P362-L364 VanDerWaalsContact O-N 3.15Å | ||
| 363 | R | 44.1 | Very low | 42.6 | Very low | 250 Ų | 250 | 141.4 Ų | 141.4 | 94% | 0.943 | 76% | 0.755 | S | S | * | * | trans | -53.8 | 115.7 | -179.7 | -74.5 | -179.6 | 171.1 | 142 | 0.1 | 112.5 | L361 | L361-R363 PolarHBondContact O-N 3.43Š| ||
| 364 | L | 35 | Very low | 41.3 | Very low | 175 Ų | 175 | 140.4 Ų | 140.4 | 92% | 0.916 | 76% | 0.763 | S | S | * | * | trans | -139.7 | 116.8 | 162.6 | -142.2 | 87.4 | 0 | 0 | 0 | 111.1 | P362 | P362-L364 PolarHBondContact O-N 3.15Å; P362-L364 VanDerWaalsContact O-N 3.15Å | ||
| 365 | G | 34.6 | Very low | 40.3 | Very low | 75 Ų | 75 | 137.6 Ų | 137.6 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | 100.4 | 120.7 | 158.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 366 | S | 32.8 | Very low | 39.3 | Very low | 107 Ų | 107 | 135.8 Ų | 135.8 | 75% | 0.748 | 76% | 0.763 | S | S | * | * | trans | 67.8 | 96.1 | 140.4 | -169 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 367 | S | 33.6 | Very low | 37.9 | Very low | 100 Ų | 100 | 134.2 Ų | 134.2 | 70% | 0.699 | 76% | 0.762 | S | S | * | * | 80 | 123.9 | 118.4 | -51 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 368 | R | 34.2 | Very low | 37 | Very low | 203 Ų | 203 | 139.5 Ų | 139.5 | 77% | 0.766 | 78% | 0.784 | S | S | * | * | trans | 74.8 | 142.9 | 139.9 | -70.3 | 178.3 | 101.6 | 114.9 | 11.9 | 120.6 | ||||
| 369 | E | 32.9 | Very low | 36 | Very low | 155 Ų | 155 | 135.3 Ų | 135.3 | 72% | 0.724 | 78% | 0.777 | S | S | * | * | trans | 44.2 | 120.8 | 144 | -65.3 | 139.2 | -172.2 | 0 | 0 | 118.2 | ||||
| 370 | G | 31.1 | Very low | 34.8 | Very low | 69 Ų | 69 | 139 Ų | 139 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | cis | 155.7 | -178 | 1.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 371 | S | 31 | Very low | 34 | Very low | 133 Ų | 133 | 142.1 Ų | 142.1 | 93% | 0.93 | 78% | 0.783 | S | S | * | * | trans | 84.9 | 156.9 | 170.5 | -43.7 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 372 | L | 32.1 | Very low | 33.3 | Very low | 169 Ų | 169 | 138.9 Ų | 138.9 | 89% | 0.885 | 79% | 0.785 | S | S | * | * | trans | -88.3 | 170.3 | -169 | -83.4 | 163.1 | 0 | 0 | 0 | 113.6 | ||||
| 373 | P | 46.9 | Very low | 33.1 | Very low | 116 Ų | 116 | 139.1 Ų | 139.1 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | trans | -87 | 167.3 | -164.9 | 36 | -38.3 | 0 | 0 | 0 | 114.7 | ||||
| 374 | N | 29.3 | Very low | 32.4 | Very low | 158 Ų | 158 | 135.5 Ų | 135.5 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | trans | -143.8 | 171.9 | 158.3 | -159.4 | 8.3 | 0 | 0 | 0 | 111.9 | ||||
| 375 | S | 33.3 | Very low | 32.2 | Very low | 72 Ų | 72 | 133.1 Ų | 133.1 | 50% | 0.503 | 77% | 0.773 | S | S | . | * | trans | -122.1 | 172.2 | -168.6 | 62.7 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 376 | Q | 30.8 | Very low | 32 | Very low | 174 Ų | 174 | 133.5 Ų | 133.5 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | trans | 72.7 | 161.9 | 169.3 | -54.2 | 157 | 59.7 | 0 | 0 | 116.1 | ||||
| 377 | S | 26.7 | Very low | 31.9 | Very low | 90 Ų | 90 | 135 Ų | 135 | 63% | 0.629 | 79% | 0.786 | S | S | * | * | cis | -168.5 | 152.1 | -42.7 | 61.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 378 | L | 32.7 | Very low | 31.7 | Very low | 172 Ų | 172 | 133.2 Ų | 133.2 | 90% | 0.901 | 78% | 0.783 | S | S | * | * | trans | 62.3 | 157.8 | 156.6 | -72.5 | 156.4 | 0 | 0 | 0 | 120.8 | ||||
| 379 | G | 28 | Very low | 31.6 | Very low | 67 Ų | 67 | 129 Ų | 129 | 69% | 0.691 | 79% | 0.785 | S | S | * | * | trans | 105.7 | 109.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 380 | W | 28.9 | Very low | 31.5 | Very low | 225 Ų | 225 | 127 Ų | 127 | 85% | 0.852 | 79% | 0.788 | S | S | * | * | 73.5 | 106.1 | 50.5 | -81.2 | 75.3 | 0 | 0 | 0 | 116.8 | |||||
| 381 | Y | 29.3 | Very low | 31.5 | Very low | 210 Ų | 210 | 128.4 Ų | 128.4 | 82% | 0.824 | 79% | 0.787 | S | S | * | * | trans | 62.1 | 139.3 | 157.1 | -92.2 | -105 | 0 | 0 | 0 | 120.9 | ||||
| 382 | G | 32.2 | Very low | 31.6 | Very low | 78 Ų | 78 | 132.4 Ų | 132.4 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | 176.1 | 89.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 383 | T | 35 | Very low | 31.5 | Very low | 123 Ų | 123 | 130.6 Ų | 130.6 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | trans | -105.6 | 121.4 | -179.4 | -53.7 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 384 | M | 30.9 | Very low | 30.7 | Very low | 175 Ų | 175 | 131.8 Ų | 131.8 | 86% | 0.862 | 78% | 0.784 | S | S | * | * | trans | -148.9 | 106.4 | 160.6 | -85.9 | -155.5 | 165.9 | 0 | 0 | 109.6 | ||||
| 385 | T | 31.2 | Very low | 30.9 | Very low | 125 Ų | 125 | 130.4 Ų | 130.4 | 77% | 0.767 | 78% | 0.781 | S | S | * | * | 69.4 | 111.4 | 88.9 | 59.3 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 386 | G | 30 | Very low | 31.6 | Very low | 83 Ų | 83 | 132.3 Ų | 132.3 | 86% | 0.856 | 79% | 0.792 | S | S | * | * | trans | -146.2 | 136.2 | 159.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 387 | C | 29.9 | Very low | 31.4 | Very low | 138 Ų | 138 | 131.9 Ų | 131.9 | 93% | 0.932 | 79% | 0.79 | S | S | * | * | trans | -142.4 | 152.2 | -166.6 | -169.2 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 388 | G | 30.4 | Very low | 31.5 | Very low | 62 Ų | 62 | 133.9 Ų | 133.9 | 64% | 0.639 | 79% | 0.793 | S | S | * | * | trans | 145.6 | 95.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 389 | S | 31.7 | Very low | 31.4 | Very low | 115 Ų | 115 | 133.1 Ų | 133.1 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | 66.5 | 125 | 78.8 | -56.4 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 390 | S | 30.8 | Very low | 31.7 | Very low | 113 Ų | 113 | 133 Ų | 133 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | cis | -150.5 | 165.7 | 30.5 | -61 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 391 | S | 30.7 | Very low | 32.2 | Very low | 98 Ų | 98 | 128.8 Ų | 128.8 | 69% | 0.685 | 79% | 0.79 | S | S | * | * | trans | -65.1 | 169.5 | 157.7 | 50.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 392 | Y | 32.1 | Very low | 32.3 | Very low | 217 Ų | 217 | 126.8 Ų | 126.8 | 85% | 0.851 | 79% | 0.79 | S | S | * | * | cis | -162.6 | 177 | 48.3 | 25.9 | -111.3 | 0 | 0 | 0 | 114.3 | ||||
| 393 | T | 31.2 | Very low | 32.2 | Very low | 132 Ų | 132 | 129.4 Ų | 129.4 | 81% | 0.81 | 79% | 0.791 | S | S | * | * | trans | -84 | 155.7 | -164.1 | 50.9 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 394 | V | 30.1 | Very low | 32.1 | Very low | 140 Ų | 140 | 130.7 Ų | 130.7 | 85% | 0.848 | 79% | 0.793 | S | S | * | * | -165.2 | 150.4 | 128.8 | 146.5 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 395 | T | 32.3 | Very low | 32.1 | Very low | 129 Ų | 129 | 129.1 Ų | 129.1 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | -136.6 | 176.8 | -179.4 | 42.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 396 | P | 48.1 | Very low | 32.2 | Very low | 113 Ų | 113 | 127.4 Ų | 127.4 | 73% | 0.734 | 79% | 0.792 | S | S | * | * | cis | -111.6 | -149.3 | 1.1 | 35.9 | -15.4 | 0 | 0 | 0 | 111.1 | ||||
| 397 | H | 27.8 | Very low | 33.3 | Very low | 164 Ų | 164 | 128.7 Ų | 128.7 | 76% | 0.759 | 79% | 0.785 | S | S | * | * | cis | -156 | -171.2 | 10.2 | 47.7 | -128.3 | 0 | 0 | 0 | 109.1 | ||||
| 398 | L | 29.3 | Very low | 33.3 | Very low | 132 Ų | 132 | 128.9 Ų | 128.9 | 69% | 0.691 | 78% | 0.776 | S | S | * | * | cis | -158.5 | 142.2 | 10.7 | -174.7 | 64.6 | 0 | 0 | 0 | 110.7 | ||||
| 399 | N | 30.7 | Very low | 33.3 | Very low | 157 Ų | 157 | 132 Ų | 132 | 84% | 0.84 | 78% | 0.777 | S | S | * | * | trans | 59.7 | 158.1 | 176.8 | -60.2 | -14 | 0 | 0 | 0 | 115.3 | ||||
| 400 | G | 34 | Very low | 33.3 | Very low | 65 Ų | 65 | 134.7 Ų | 134.7 | 67% | 0.67 | 78% | 0.775 | S | S | * | * | cis | -155.8 | 173.5 | -4.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 401 | P | 38.7 | Very low | 33.2 | Very low | 136 Ų | 136 | 134.7 Ų | 134.7 | 88% | 0.883 | 77% | 0.771 | S | S | * | * | trans | -84 | 162.1 | -147.6 | 31.1 | -37.3 | 0 | 0 | 0 | 118.7 | ||||
| 402 | M | 31.2 | Very low | 33.1 | Very low | 168 Ų | 168 | 135.8 Ų | 135.8 | 83% | 0.828 | 78% | 0.777 | S | S | * | * | trans | -74.9 | 164.3 | 174.4 | -49.7 | 158.2 | 81.5 | 0 | 0 | 112.3 | ||||
| 403 | T | 30.8 | Very low | 32.8 | Very low | 133 Ų | 133 | 131 Ų | 131 | 82% | 0.816 | 78% | 0.775 | S | S | * | * | -179.3 | 161.2 | 107.2 | 32.8 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 404 | D | 32.1 | Very low | 32.8 | Very low | 150 Ų | 150 | 131.8 Ų | 131.8 | 80% | 0.802 | 77% | 0.774 | S | S | * | * | trans | -71.3 | 149.8 | 178.4 | -45.1 | -99.2 | 0 | 0 | 0 | 114 | ||||
| 405 | T | 31.9 | Very low | 32.8 | Very low | 142 Ų | 142 | 131.8 Ų | 131.8 | 87% | 0.871 | 77% | 0.769 | S | S | * | * | trans | -145.8 | 128.5 | 160.7 | -37.4 | 0 | 0 | 0 | 0 | 114 | ||||
| 406 | A | 32 | Very low | 32.8 | Very low | 88 Ų | 88 | 133.4 Ų | 133.4 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -151.4 | 159.4 | 150.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 407 | P | 53.1 | Low | 32 | Very low | 110 Ų | 110 | 134 Ų | 134 | 71% | 0.714 | 77% | 0.769 | S | S | * | * | cis | -132.5 | -164 | -10 | 25.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 408 | L | 31.2 | Very low | 32.2 | Very low | 143 Ų | 143 | 134 Ų | 134 | 75% | 0.749 | 77% | 0.774 | S | S | * | * | trans | 91.9 | 119.6 | 154.5 | -51 | -179.1 | 0 | 0 | 0 | 121.7 | ||||
| 409 | L | 30.8 | Very low | 32.3 | Very low | 126 Ų | 126 | 133.3 Ų | 133.3 | 66% | 0.66 | 77% | 0.772 | S | S | * | * | 40.2 | 122.3 | 129.6 | -54.4 | 169.4 | 0 | 0 | 0 | 119.3 | |||||
| 410 | F | 29.9 | Very low | 32.4 | Very low | 172 Ų | 172 | 133.5 Ų | 133.5 | 75% | 0.754 | 77% | 0.767 | S | S | * | * | 177.4 | 157.5 | 70.4 | -100.8 | -63.5 | 0 | 0 | 0 | 113.7 | |||||
| 411 | T | 29.1 | Very low | 32.4 | Very low | 114 Ų | 114 | 138.3 Ų | 138.3 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | trans | 52.8 | 119.8 | 148.5 | 56.7 | 0 | 0 | 0 | 0 | 125 | ||||
| 412 | C | 29.3 | Very low | 32.1 | Very low | 121 Ų | 121 | 136.6 Ų | 136.6 | 82% | 0.818 | 76% | 0.763 | S | S | * | * | 52.4 | 103.3 | 124.4 | -56 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 413 | S | 26 | Very low | 32.2 | Very low | 116 Ų | 116 | 136.4 Ų | 136.4 | 81% | 0.811 | 77% | 0.765 | S | S | * | * | -178 | 128.6 | 112.5 | 35.1 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 414 | N | 30.1 | Very low | 32.4 | Very low | 148 Ų | 148 | 140.6 Ų | 140.6 | 79% | 0.791 | 77% | 0.767 | S | S | * | * | 70.7 | 90.7 | 65.6 | -171.6 | 9.7 | 0 | 0 | 0 | 114 | |||||
| 415 | L | 31 | Very low | 32.6 | Very low | 141 Ų | 141 | 138.8 Ų | 138.8 | 74% | 0.738 | 76% | 0.761 | S | S | * | * | trans | -177.2 | 116.7 | 140.5 | -104.3 | 161.8 | 0 | 0 | 0 | 112.9 | L417 | L415-L417 HydrophobicContact CD2-CB 4.37Š| ||
| 416 | D | 32.3 | Very low | 32.9 | Very low | 163 Ų | 163 | 138.2 Ų | 138.2 | 87% | 0.872 | 76% | 0.757 | S | S | * | * | trans | -151.7 | 94.8 | 153 | -98.1 | -36.9 | 0 | 0 | 0 | 103.5 | ||||
| 417 | L | 30.1 | Very low | 33.9 | Very low | 124 Ų | 124 | 138.9 Ų | 138.9 | 65% | 0.649 | 76% | 0.755 | S | S | * | * | 60.7 | 70.2 | 50.5 | -157.5 | 81.2 | 0 | 0 | 0 | 113.3 | L415 | L415-L417 HydrophobicContact CD2-CB 4.37Š| |||
| 418 | N | 32.2 | Very low | 33 | Very low | 164 Ų | 164 | 142.6 Ų | 142.6 | 88% | 0.877 | 76% | 0.763 | S | S | * | * | trans | -125.1 | 113.1 | 157.7 | -131.1 | -24.7 | 0 | 0 | 0 | 109.3 | ||||
| 419 | N | 32.6 | Very low | 33.1 | Very low | 119 Ų | 119 | 146.6 Ų | 146.6 | 64% | 0.636 | 79% | 0.785 | S | S | * | * | trans | -83.4 | 152.9 | 175 | -73.9 | -61 | 0 | 0 | 0 | 109.7 | ||||
| 420 | H | 32.5 | Very low | 33.2 | Very low | 161 Ų | 161 | 147.7 Ų | 147.7 | 75% | 0.745 | 79% | 0.791 | S | S | * | * | -177.3 | 132.4 | 111.4 | -95.8 | -68.5 | 0 | 0 | 0 | 112.9 | |||||
| 421 | H | 33.1 | Very low | 33.4 | Very low | 165 Ų | 165 | 146.4 Ų | 146.4 | 76% | 0.764 | 79% | 0.793 | S | S | * | * | trans | 53.7 | 104.5 | 159.1 | -61.1 | -62.1 | 0 | 0 | 0 | 121.9 | ||||
| 422 | S | 32.6 | Very low | 33.7 | Very low | 101 Ų | 101 | 148.2 Ų | 148.2 | 71% | 0.706 | 80% | 0.798 | S | S | * | * | trans | -55.2 | 162 | 148.7 | 56 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 423 | L | 33.2 | Very low | 33.9 | Very low | 164 Ų | 164 | 149.8 Ų | 149.8 | 86% | 0.859 | 80% | 0.797 | S | S | * | * | -151.4 | 173.2 | 120.6 | -111.6 | 170.7 | 0 | 0 | 0 | 112 | |||||
| 424 | Y | 35.3 | Very low | 34.4 | Very low | 221 Ų | 221 | 151.9 Ų | 151.9 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | -85.6 | 171.3 | -158.5 | -113.8 | -109.6 | 0 | 0 | 0 | 115.9 | ||||
| 425 | V | 36.7 | Very low | 34.7 | Very low | 112 Ų | 112 | 152.1 Ų | 152.1 | 68% | 0.679 | 80% | 0.796 | S | S | * | * | trans | -124 | 155 | 179.2 | 166.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 426 | T | 37.8 | Very low | 35 | Very low | 129 Ų | 129 | 152.9 Ų | 152.9 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | 67.7 | 159.9 | 167.7 | 35.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 427 | P | 53.1 | Low | 35.2 | Very low | 103 Ų | 103 | 152.2 Ų | 152.2 | 67% | 0.669 | 80% | 0.795 | S | S | * | * | cis | -133.2 | -176.8 | -16.4 | 36 | -17.8 | 0 | 0 | 0 | 114.6 | ||||
| 428 | Q | 34 | Very low | 35.6 | Very low | 188 Ų | 188 | 154.5 Ų | 154.5 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | trans | 69.2 | 145.8 | 168.2 | -64.9 | 173 | -21.2 | 0 | 0 | 115.6 | ||||
| 429 | N | 34 | Very low | 35.9 | Very low | 227 Ų | 227 | 153.6 Ų | 153.6 | 100% | 1.214 | 80% | 0.801 | S | S | * | * | cis | -132 | 0 | 5.7 | 170 | 94 | 0 | 0 | 0 | 111.2 |
Retrieved 429 of 429 residues in 533.2 ms
(Link to these results)