| 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 | 41.4 | Very low | 45.6 | Very low | 247 Ų | 247 | 155.9 Ų | 155.9 | 100% | 1.217 | 85% | 0.852 | S | S | * | * | 0 | 124.5 | 0 | -76.2 | 169.2 | 178.7 | 0 | 0 | 107.1 | |||||
| 2 | Q | 35.2 | Very low | 45.5 | Very low | 188 Ų | 188 | 159.3 Ų | 159.3 | 88% | 0.879 | 85% | 0.853 | S | S | * | * | trans | -98.8 | 127.7 | -160.4 | -169.4 | 165.3 | -3 | 0 | 0 | 108.6 | ||||
| 3 | F | 41.8 | Very low | 45.6 | Very low | 208 Ų | 208 | 157.8 Ų | 157.8 | 91% | 0.912 | 85% | 0.853 | S | S | * | * | trans | -93.4 | 126 | 175.1 | -90.5 | -90 | 0 | 0 | 0 | 109.6 | ||||
| 4 | S | 45.8 | Very low | 45.6 | Very low | 99 Ų | 99 | 154.3 Ų | 154.3 | 69% | 0.692 | 85% | 0.846 | S | S | * | * | trans | -117.6 | 139.3 | 165.8 | -69.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 5 | P | 49.1 | Very low | 45.8 | Very low | 122 Ų | 122 | 151.7 Ų | 151.7 | 79% | 0.792 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 142.7 | 176.9 | 33.6 | -31.2 | 0 | 0 | 0 | 111.7 | ||
| 6 | T | 48.9 | Very low | 45.9 | Very low | 141 Ų | 141 | 148.8 Ų | 148.8 | 87% | 0.865 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -103.8 | 122.6 | 175.5 | -41.9 | 0 | 0 | 0 | 0 | 109.4 | ||
| 7 | N | 52.3 | Low | 45.5 | Very low | 164 Ų | 164 | 151.5 Ų | 151.5 | 88% | 0.877 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 138.8 | 171.5 | -71.7 | -53.3 | 0 | 0 | 0 | 110.4 | ||
| 8 | G | 47.1 | Very low | 45.5 | Very low | 63 Ų | 63 | 148.4 Ų | 148.4 | 65% | 0.649 | 84% | 0.839 | S | S | * | * | trans | 140.1 | 96.3 | 158.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 9 | D | 43.9 | Very low | 45.5 | Very low | 157 Ų | 157 | 149.7 Ų | 149.7 | 84% | 0.84 | 84% | 0.837 | S | S | * | * | 164.5 | 102.5 | 111.1 | -84.3 | -14.4 | 0 | 0 | 0 | 111.4 | |||||
| 10 | F | 45 | Very low | 45.5 | Very low | 199 Ų | 199 | 150.4 Ų | 150.4 | 87% | 0.873 | 84% | 0.839 | S | S | * | * | trans | -89.9 | 112.9 | 161.9 | -82.5 | -89.5 | 0 | 0 | 0 | 107.9 | ||||
| 11 | T | 51.6 | Low | 45.5 | Very low | 127 Ų | 127 | 150.8 Ų | 150.8 | 78% | 0.779 | 84% | 0.838 | S | S | * | * | trans | -96.5 | 114.5 | 173.7 | 45.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 12 | F | 44 | Very low | 45.8 | Very low | 196 Ų | 196 | 144.5 Ų | 144.5 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | trans | -86.8 | 131 | 166.6 | -70.6 | -92.8 | 0 | 0 | 0 | 109.6 | ||||
| 13 | V | 47.3 | Very low | 46.2 | Very low | 141 Ų | 141 | 138.7 Ų | 138.7 | 86% | 0.855 | 81% | 0.809 | S | S | * | * | trans | -97.2 | 113.9 | 173.9 | 178.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 14 | S | 44.9 | Very low | 46.6 | Very low | 108 Ų | 108 | 134.6 Ų | 134.6 | 76% | 0.755 | 80% | 0.801 | S | S | * | * | trans | -86.8 | 122.8 | 172.8 | -174.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 15 | S | 49.1 | Very low | 47 | Very low | 116 Ų | 116 | 137.4 Ų | 137.4 | 81% | 0.811 | 81% | 0.807 | S | S | * | * | trans | -78.4 | 116.6 | 175.7 | 52.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 16 | S | 46.4 | Very low | 46.9 | Very low | 104 Ų | 104 | 136.6 Ų | 136.6 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | -140.6 | 78.2 | 169.2 | 56.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 17 | E | 40.4 | Very low | 47 | Very low | 195 Ų | 195 | 134 Ų | 134 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | -144.1 | 96.4 | 157.2 | -109.5 | 158.1 | 127.1 | 0 | 0 | 106.8 | ||||
| 18 | A | 44.6 | Very low | 47 | Very low | 97 Ų | 97 | 131.2 Ų | 131.2 | 80% | 0.802 | 79% | 0.788 | S | S | * | * | trans | -86.1 | 102.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 19 | E | 45.4 | Very low | 47.1 | Very low | 173 Ų | 173 | 136.5 Ų | 136.5 | 81% | 0.808 | 80% | 0.801 | S | S | * | * | trans | -80.8 | 114.8 | 159.7 | -69 | -164.3 | 133.8 | 0 | 0 | 108.1 | L21 | E19-L21 VanDerWaalsContact C-N 3.34Å; E19-L21 PolarHBondContact O-N 3.39Å | ||
| 20 | D | 46.3 | Very low | 47.2 | Very low | 162 Ų | 162 | 134.2 Ų | 134.2 | 87% | 0.866 | 79% | 0.793 | S | S | * | * | trans | -64.5 | 87.7 | 173.5 | -82.5 | -50.1 | 0 | 0 | 0 | 110.5 | S22 | D20-S22 VanDerWaalsContact C-N 3.32Å; D20-S22 PolarHBondContact O-N 3.22Å | ||
| 21 | L | 44.5 | Very low | 47 | Very low | 160 Ų | 160 | 134.2 Ų | 134.2 | 84% | 0.838 | 79% | 0.793 | S | S | * | * | trans | -73.6 | 87.7 | 164.2 | -96.6 | 109 | 0 | 0 | 0 | 109.7 | E19 G23 | E19-L21 VanDerWaalsContact C-N 3.34Å; E19-L21 PolarHBondContact O-N 3.39Å; L21-G23 PolarHBondContact O-N 3.09Å | ||
| 22 | S | 47.9 | Very low | 46.6 | Very low | 114 Ų | 114 | 135.7 Ų | 135.7 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | trans | -71.6 | 92.4 | 163.9 | -174.2 | 0 | 0 | 0 | 0 | 109.7 | D20 | D20-S22 VanDerWaalsContact C-N 3.32Å; D20-S22 PolarHBondContact O-N 3.22Å | ||
| 23 | G | 45 | Very low | 46.4 | Very low | 66 Ų | 66 | 134.2 Ų | 134.2 | 68% | 0.68 | 80% | 0.796 | S | S | * | * | trans | -89.9 | 108.5 | 169 | 0 | 0 | 0 | 0 | 0 | 110.5 | L21 I25 | L21-G23 PolarHBondContact O-N 3.09Å; G23-I25 PolarHBondContact O-N 3.37Å | ||
| 24 | T | 50 | Low | 46.3 | Very low | 122 Ų | 122 | 136.5 Ų | 136.5 | 75% | 0.748 | 80% | 0.799 | S | S | * | * | trans | -73.7 | 122.1 | 165 | -72.5 | 0 | 0 | 0 | 0 | 108.9 | S26 | T24-S26 PolarHBondContact O-N 2.94Š| ||
| 25 | I | 52.4 | Low | 45.7 | Very low | 158 Ų | 158 | 136 Ų | 136 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | trans | -83.6 | 106 | 167.2 | -68.2 | 172 | 0 | 0 | 0 | 107.1 | G23 A27 | G23-I25 PolarHBondContact O-N 3.37Å; I25-A27 PolarHBondContact O-N 3.32Å | ||
| 26 | S | 47.9 | Very low | 45.6 | Very low | 105 Ų | 105 | 135.7 Ų | 135.7 | 73% | 0.734 | 80% | 0.8 | S | S | * | * | trans | -72.3 | 112.2 | 159.2 | -63.7 | 0 | 0 | 0 | 0 | 107.8 | T24 | T24-S26 PolarHBondContact O-N 2.94Š| ||
| 27 | A | 52 | Low | 45.2 | Very low | 86 Ų | 86 | 139.6 Ų | 139.6 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | trans | -71.3 | 128.9 | 167 | 0 | 0 | 0 | 0 | 0 | 108.4 | I25 | I25-A27 PolarHBondContact O-N 3.32Š| ||
| 28 | P | 50.4 | Low | 45.8 | Very low | 107 Ų | 107 | 134.8 Ų | 134.8 | 70% | 0.695 | 81% | 0.81 | S | S | * | * | trans | -73.8 | 130.1 | 168.6 | 29.8 | -29.3 | 0 | 0 | 0 | 108.7 | V30 | P28-V30 HydrophobicContact CB-CG2 4.16Å; P28-V30 HydrophobicContact CG-CG2 4.29Å; P28-V30 PolarHBondContact O-N 2.76Å; P28-V30 VanDerWaalsContact O-N 3.14Å | ||
| 29 | D | 49.7 | Very low | 45.9 | Very low | 174 Ų | 174 | 133.1 Ų | 133.1 | 93% | 0.93 | 80% | 0.802 | S | S | * | * | trans | -64.8 | 107.9 | 167.1 | -97.3 | -52.1 | 0 | 0 | 0 | 108.7 | ||||
| 30 | V | 47 | Very low | 46.4 | Very low | 108 Ų | 108 | 134 Ų | 134 | 66% | 0.655 | 80% | 0.798 | S | S | * | * | trans | -121.2 | 117.3 | 176.9 | -175.1 | 0 | 0 | 0 | 0 | 110 | P28 L32 | P28-V30 HydrophobicContact CB-CG2 4.16Å; P28-V30 HydrophobicContact CG-CG2 4.29Å; P28-V30 PolarHBondContact O-N 2.76Å; P28-V30 VanDerWaalsContact O-N 3.14Å; V30-L32 PolarHBondContact O-N 2.97Å | ||
| 31 | K | 40 | Very low | 46.9 | Very low | 200 Ų | 200 | 132 Ų | 132 | 87% | 0.87 | 79% | 0.787 | S | S | * | * | trans | -60.1 | 120.3 | -178.9 | -160.2 | 177.2 | -176.1 | -177.5 | 0 | 110.8 | N33 | K31-N33 PolarHBondContact O-N 2.92Š| ||
| 32 | L | 44 | Very low | 47.6 | Very low | 158 Ų | 158 | 128.2 Ų | 128.2 | 83% | 0.827 | 77% | 0.772 | S | S | * | * | trans | -68.6 | 115.6 | 177.5 | -70.3 | 165.5 | 0 | 0 | 0 | 110.9 | V30 | V30-L32 PolarHBondContact O-N 2.97Š| ||
| 33 | N | 39.3 | Very low | 48.1 | Very low | 165 Ų | 165 | 131.5 Ų | 131.5 | 88% | 0.882 | 77% | 0.768 | S | S | * | * | trans | -107.2 | 103.7 | 157.5 | -108 | 6.5 | 0 | 0 | 0 | 107.8 | K31 A35 | K31-N33 PolarHBondContact O-N 2.92Å; N33-A35 PolarHBondContact O-N 3.45Å | ||
| 34 | M | 44.3 | Very low | 48.9 | Very low | 188 Ų | 188 | 130.9 Ų | 130.9 | 93% | 0.926 | 76% | 0.756 | S | S | * | * | trans | -83.3 | 95.5 | -179.5 | -173.7 | 168.6 | 157.7 | 0 | 0 | 108.9 | ||||
| 35 | A | 33.3 | Very low | 49.6 | Very low | 99 Ų | 99 | 127.3 Ų | 127.3 | 82% | 0.818 | 74% | 0.735 | S | S | * | * | trans | -106.7 | 110.9 | 161.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | N33 | N33-A35 PolarHBondContact O-N 3.45Š| ||
| 36 | S | 46.5 | Very low | 50.3 | Low | 108 Ų | 108 | 123.6 Ų | 123.6 | 76% | 0.755 | 72% | 0.72 | S | S | * | * | trans | -77.7 | 111.7 | 175.9 | 157.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 37 | E | 39.4 | Very low | 51.5 | Low | 186 Ų | 186 | 124.1 Ų | 124.1 | 87% | 0.869 | 71% | 0.709 | S | S | * | * | trans | -155.4 | 138.1 | 150.9 | -113.8 | 173.4 | 132.7 | 0 | 0 | 109.4 | G39 | E37-G39 PolarHBondContact O-N 2.92Å; E37-G39 VanDerWaalsContact O-N 3.08Å | ||
| 38 | G | 50.9 | Low | 52.5 | Low | 95 Ų | 95 | 122.8 Ų | 122.8 | 98% | 0.979 | 69% | 0.69 | S | S | * | * | trans | -55.3 | 111.6 | -167.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 39 | G | 47.2 | Very low | 53.4 | Low | 62 Ų | 62 | 127.2 Ų | 127.2 | 64% | 0.639 | 69% | 0.692 | S | S | * | * | trans | -171.6 | 124.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | E37 | E37-G39 PolarHBondContact O-N 2.92Å; E37-G39 VanDerWaalsContact O-N 3.08Å | ||
| 40 | R | 55.7 | Low | 54.7 | Low | 192 Ų | 192 | 126.8 Ų | 126.8 | 73% | 0.725 | 69% | 0.685 | S | S | * | * | trans | -38.2 | 134.5 | -175.2 | -59.9 | 164.2 | -171.8 | 156.4 | 3.4 | 112.3 | P42 | R40-P42 WeakPolarHBondContact O-CD 3.4Å; R40-P42 VanDerWaalsContact O-N 3.09Å | ||
| 41 | D | 56.6 | Low | 55.9 | Low | 119 Ų | 119 | 130 Ų | 130 | 64% | 0.636 | 69% | 0.685 | S | S | * | * | trans | -51.4 | 115.1 | -176.8 | -68.3 | -47.8 | 0 | 0 | 0 | 111.6 | Y43 A44 T45 | D41-Y43 PolarHBondContact O-N 3.19Å; D41-A44 HydrophobicContact CB-CB 4.47Å; D41-A44 PolarHBondContact O-N 2.85Å; D41-T45 PolarHBondContact O-N 2.91Å | ||
| 42 | P | 60.3 | Low | 57 | Low | 80 Ų | 80 | 123.4 Ų | 123.4 | 52% | 0.519 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -64.3 | -15.4 | -175.9 | 23.3 | -32.5 | 0 | 0 | 0 | 113.1 | R40 T45 T46 | R40-P42 WeakPolarHBondContact O-CD 3.4Å; R40-P42 VanDerWaalsContact O-N 3.09Å; P42-T45 WeakPolarHBondContact CA-OG1 3.37Å; P42-T45 PolarHBondContact O-OG1 3.4Å; P42-T46 WeakPolarHBondContact O-CB 3.37Å; P42-T46 PolarHBondContact O-N 3.37Å; P42-T46 PolarHBondContact O-OG1 3.47Å |
| 43 | Y | 57.6 | Low | 58.2 | Low | 183 Ų | 183 | 121.8 Ų | 121.8 | 72% | 0.718 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -72.6 | -42.3 | 174.5 | -61.1 | -78.8 | 0 | 0 | 0 | 112.4 | D41 F47 | D41-Y43 PolarHBondContact O-N 3.19Å; Y43-F47 PolarHBondContact O-N 3.41Å; Y43-F47 VanDerWaalsContact O-N 3.17Å |
| 44 | A | 62.6 | Low | 59.4 | Low | 53 Ų | 53 | 114.9 Ų | 114.9 | 44% | 0.438 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -69.6 | -37.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | D41 F47 L48 | D41-A44 HydrophobicContact CB-CB 4.47Å; D41-A44 PolarHBondContact O-N 2.85Å; A44-F47 PolarHBondContact O-N 3.41Å; A44-L48 VanDerWaalsContact O-CG 3.31Å; A44-L48 WeakPolarHBondContact O-CG 3.42Å; A44-L48 PolarHBondContact O-N 3.19Å |
| 45 | T | 63.9 | Low | 60.5 | Low | 47 Ų | 47 | 115.3 Ų | 115.3 | 29% | 0.288 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -67.6 | -39.1 | 179.2 | 61 | 0 | 0 | 0 | 0 | 112.3 | D41 P42 R49 L57 | D41-T45 PolarHBondContact O-N 2.91Å; P42-T45 WeakPolarHBondContact CA-OG1 3.37Å; P42-T45 PolarHBondContact O-OG1 3.4Å; T45-R49 PolarHBondContact O-N 3.03Å; T45-L57 HydrophobicContact CG2-CD1 4.2Å; T45-L57 HydrophobicContact CG2-CD2 4.42Å |
| 46 | T | 67.4 | Low | 62.2 | Low | 81 Ų | 81 | 116.1 Ų | 116.1 | 50% | 0.497 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -70.9 | -37.8 | 178.9 | -51.7 | 0 | 0 | 0 | 0 | 112 | P42 R49 Q50 | P42-T46 WeakPolarHBondContact O-CB 3.37Å; P42-T46 PolarHBondContact O-N 3.37Å; P42-T46 PolarHBondContact O-OG1 3.47Å; T46-R49 PolarHBondContact O-N 2.86Å; T46-Q50 PolarHBondContact O-N 3.48Å |
| 47 | F | 73.4 | Confident | 63.1 | Low | 115 Ų | 115 | 114.4 Ų | 114.4 | 50% | 0.504 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.6 | -42.4 | 177.6 | -174.6 | -96.8 | 0 | 0 | 0 | 112.7 | Y43 A44 R49 Q50 R51 | Y43-F47 PolarHBondContact O-N 3.41Å; Y43-F47 VanDerWaalsContact O-N 3.17Å; A44-F47 PolarHBondContact O-N 3.41Å; F47-R49 VanDerWaalsContact C-N 3.33Å; F47-R49 PolarHBondContact O-N 3.46Å; F47-Q50 PolarHBondContact O-N 2.89Å; F47-R51 PolarHBondContact O-N 3.35Å |
| 48 | L | 72.7 | Confident | 64.1 | Low | 59 Ų | 59 | 112.6 Ų | 112.6 | 31% | 0.309 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.9 | -36.4 | 178.3 | -70.3 | 170.4 | 0 | 0 | 0 | 112.1 | A44 R51 Y53 L57 | A44-L48 VanDerWaalsContact O-CG 3.31Å; A44-L48 WeakPolarHBondContact O-CG 3.42Å; A44-L48 PolarHBondContact O-N 3.19Å; L48-R51 PolarHBondContact O-N 3.49Å; L48-Y53 CarbonylContact O-C 3.49Å; L48-Y53 WeakPolarHBondContact O-CA 3.32Å; L48-Y53 PolarHBondContact O-N 3.04Å; L48-L57 HydrophobicContact CB-CD1 3.85Å; L48-L57 HydrophobicContact CD1-CD1 3.96Å; L48-L57 HydrophobicContact CD1-CD2 4.22Å; L48-L57 HydrophobicContact CD1-CG 4.17Å |
| 49 | R | 70.3 | Confident | 64.7 | Low | 200 Ų | 200 | 112.8 Ų | 112.8 | 76% | 0.755 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68.5 | -39.3 | 178.3 | -155.1 | 175.2 | -177.9 | -154.1 | 1.6 | 112.6 | T45 T46 F47 R51 G52 | T45-R49 PolarHBondContact O-N 3.03Å; T46-R49 PolarHBondContact O-N 2.86Å; F47-R49 VanDerWaalsContact C-N 3.33Å; F47-R49 PolarHBondContact O-N 3.46Å; R49-R51 VanDerWaalsContact C-N 3.3Å; R49-R51 PolarHBondContact O-N 3.42Å; R49-G52 PolarHBondContact O-N 3.46Å |
| 50 | Q | 76.1 | Confident | 65.1 | Low | 165 Ų | 165 | 118.4 Ų | 118.4 | 77% | 0.771 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65 | -30.5 | 176.1 | -88 | -175.9 | -14.8 | 0 | 0 | 113.6 | T46 F47 G52 | T46-Q50 PolarHBondContact O-N 3.48Å; F47-Q50 PolarHBondContact O-N 2.89Å; Q50-G52 VanDerWaalsContact C-N 3.28Å; Q50-G52 PolarHBondContact O-N 3.35Å |
| 51 | R | 72.3 | Confident | 64.7 | Low | 174 Ų | 174 | 115.5 Ų | 115.5 | 66% | 0.657 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | 5.5 | 179.3 | -76.6 | -117.6 | -180 | 148.4 | -1.6 | 114.1 | F47 L48 R49 Y53 | F47-R51 PolarHBondContact O-N 3.35Å; L48-R51 PolarHBondContact O-N 3.49Å; R49-R51 VanDerWaalsContact C-N 3.3Å; R49-R51 PolarHBondContact O-N 3.42Å; R51-Y53 HydrophobicContact CB-CD2 3.67Å; R51-Y53 HydrophobicContact CB-CE2 4.04Å; R51-Y53 PolarHBondContact O-N 3.34Å |
| 52 | G | 63.8 | Low | 64.3 | Low | 62 Ų | 62 | 114.1 Ų | 114.1 | 64% | 0.639 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 78 | 5.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | R49 Q50 G54 | R49-G52 PolarHBondContact O-N 3.46Å; Q50-G52 VanDerWaalsContact C-N 3.28Å; Q50-G52 PolarHBondContact O-N 3.35Å; G52-G54 PolarHBondContact O-N 3.48Å |
| 53 | Y | 69.6 | Low | 63.7 | Low | 125 Ų | 125 | 116.8 Ų | 116.8 | 49% | 0.49 | 57% | 0.569 | S | S | . | * | G | 310 helix | trans | -86.6 | 23.9 | 172.9 | -61.8 | -68.4 | 0 | 0 | 0 | 112.2 | L48 R51 W55 L56 | L48-Y53 CarbonylContact O-C 3.49Å; L48-Y53 WeakPolarHBondContact O-CA 3.32Å; L48-Y53 PolarHBondContact O-N 3.04Å; R51-Y53 HydrophobicContact CB-CD2 3.67Å; R51-Y53 HydrophobicContact CB-CE2 4.04Å; R51-Y53 PolarHBondContact O-N 3.34Å; Y53-W55 PolarHBondContact O-N 3.25Å; Y53-L56 HydrophobicContact CD1-CD1 4.4Å; Y53-L56 WeakPolarHBondContact O-CB 3.5Å; Y53-L56 PolarHBondContact O-N 2.89Å; Y53-L56 VanDerWaalsContact O-N 3.09Å |
| 54 | G | 64.3 | Low | 63.2 | Low | 19 Ų | 19 | 115.3 Ų | 115.3 | 20% | 0.196 | 57% | 0.573 | C | S | . | * | G | 310 helix | trans | -57.2 | -32.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | G52 L56 L57 E58 | G52-G54 PolarHBondContact O-N 3.48Å; G54-L56 PolarHBondContact O-N 3.09Å; G54-L56 VanDerWaalsContact O-N 3.13Å; G54-L57 PolarHBondContact O-N 2.81Å; G54-E58 PolarHBondContact O-N 3.39Å |
| 55 | W | 66.9 | Low | 62.6 | Low | 198 Ų | 198 | 119.8 Ų | 119.8 | 75% | 0.75 | 59% | 0.585 | S | S | * | * | G | 310 helix | trans | -61.7 | -19.4 | 177.4 | 92.3 | -36.3 | 0 | 0 | 0 | 114.2 | Y53 L57 | Y53-W55 PolarHBondContact O-N 3.25Å; W55-L57 VanDerWaalsContact C-N 3.31Å |
| 56 | L | 68.3 | Low | 62.1 | Low | 116 Ų | 116 | 126.2 Ų | 126.2 | 61% | 0.607 | 61% | 0.612 | S | S | * | * | G | 310 helix | trans | -82.4 | -15.2 | 178.5 | -92.8 | 165.9 | 0 | 0 | 0 | 111.7 | Y53 G54 | Y53-L56 HydrophobicContact CD1-CD1 4.4Å; Y53-L56 WeakPolarHBondContact O-CB 3.5Å; Y53-L56 PolarHBondContact O-N 2.89Å; Y53-L56 VanDerWaalsContact O-N 3.09Å; G54-L56 PolarHBondContact O-N 3.09Å; G54-L56 VanDerWaalsContact O-N 3.13Å |
| 57 | L | 66.2 | Low | 61.3 | Low | 71 Ų | 71 | 126.9 Ų | 126.9 | 37% | 0.372 | 62% | 0.62 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -105.3 | -14.4 | 177.4 | -68.4 | 172.8 | 0 | 0 | 0 | 112.5 | T45 L48 G54 W55 V59 | T45-L57 HydrophobicContact CG2-CD1 4.2Å; T45-L57 HydrophobicContact CG2-CD2 4.42Å; L48-L57 HydrophobicContact CB-CD1 3.85Å; L48-L57 HydrophobicContact CD1-CD1 3.96Å; L48-L57 HydrophobicContact CD1-CD2 4.22Å; L48-L57 HydrophobicContact CD1-CG 4.17Å; G54-L57 PolarHBondContact O-N 2.81Å; W55-L57 VanDerWaalsContact C-N 3.31Å; L57-V59 PolarHBondContact O-N 2.85Å |
| 58 | E | 60.8 | Low | 60.4 | Low | 148 Ų | 148 | 128 Ų | 128 | 69% | 0.692 | 63% | 0.625 | S | S | * | * | trans | -71.9 | 74.5 | 161.6 | -79.6 | 171.3 | 166.6 | 0 | 0 | 108.1 | G54 E60 | G54-E58 PolarHBondContact O-N 3.39Å; E58-E60 PolarHBondContact O-N 2.95Å | ||
| 59 | V | 62.2 | Low | 59.5 | Low | 100 Ų | 100 | 128.7 Ų | 128.7 | 61% | 0.606 | 63% | 0.633 | S | S | * | * | trans | -71.8 | 109 | 147.1 | -179.3 | 0 | 0 | 0 | 0 | 103.2 | L57 E61 | L57-V59 PolarHBondContact O-N 2.85Å; V59-E61 PolarHBondContact O-N 3.36Å | ||
| 60 | E | 55.5 | Low | 58.6 | Low | 179 Ų | 179 | 125.6 Ų | 125.6 | 84% | 0.836 | 63% | 0.63 | S | S | * | * | trans | -57.7 | 93.1 | 166.2 | -69.6 | 177.3 | 162 | 0 | 0 | 106.1 | E58 D62 | E58-E60 PolarHBondContact O-N 2.95Å; E60-D62 PolarHBondContact O-N 3.1Å | ||
| 61 | E | 47.7 | Very low | 57.4 | Low | 131 Ų | 131 | 121.6 Ų | 121.6 | 61% | 0.612 | 61% | 0.614 | S | S | * | * | trans | -70.2 | 77.5 | 165.2 | -74.2 | 175.4 | 179.2 | 0 | 0 | 105.4 | V59 D63 | V59-E61 PolarHBondContact O-N 3.36Å; E61-D63 PolarHBondContact O-N 3.19Å | ||
| 62 | D | 47.9 | Very low | 56.6 | Low | 90 Ų | 90 | 118.9 Ų | 118.9 | 48% | 0.481 | 61% | 0.609 | S | S | . | * | trans | -73.3 | 70.8 | 168 | -159.2 | 4.2 | 0 | 0 | 0 | 108 | E60 N64 E65 | E60-D62 PolarHBondContact O-N 3.1Å; D62-N64 PolarHBondContact O-N 2.86Å; D62-E65 HydrophobicContact CB-CG 4.1Å; D62-E65 PolarHBondContact O-N 3.15Å | ||
| 63 | D | 47.9 | Very low | 56.2 | Low | 136 Ų | 136 | 122.8 Ų | 122.8 | 73% | 0.727 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | 23 | 178.6 | -78.8 | -26.3 | 0 | 0 | 0 | 112.7 | E61 | E61-D63 PolarHBondContact O-N 3.19Š|
| 64 | N | 46.7 | Very low | 55.6 | Low | 152 Ų | 152 | 121.9 Ų | 121.9 | 81% | 0.813 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.1 | 10.8 | 162.3 | -68.1 | -68.6 | 0 | 0 | 0 | 112.9 | D62 E66 | D62-N64 PolarHBondContact O-N 2.86Å; N64-E66 PolarHBondContact O-N 3.08Å |
| 65 | E | 50.7 | Low | 55 | Low | 147 Ų | 147 | 127.7 Ų | 127.7 | 69% | 0.687 | 64% | 0.64 | S | S | * | * | trans | -82.3 | 50.9 | 162.2 | -70.2 | -174.3 | 154.3 | 0 | 0 | 111 | D62 S67 | D62-E65 HydrophobicContact CB-CG 4.1Å; D62-E65 PolarHBondContact O-N 3.15Å; E65-S67 PolarHBondContact O-N 3.39Å | ||
| 66 | E | 53 | Low | 54.5 | Low | 182 Ų | 182 | 119.6 Ų | 119.6 | 85% | 0.85 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -73.5 | 71 | 164.3 | -164.4 | 169.2 | -158.9 | 0 | 0 | 108.3 | N64 K68 | N64-E66 PolarHBondContact O-N 3.08Å; E66-K68 PolarHBondContact O-N 2.86Å |
| 67 | S | 51 | Low | 54.1 | Low | 95 Ų | 95 | 118.2 Ų | 118.2 | 66% | 0.664 | 60% | 0.604 | S | S | * | * | trans | 35.6 | 82.2 | 168.9 | 54.5 | 0 | 0 | 0 | 0 | 113.7 | E65 P69 | E65-S67 PolarHBondContact O-N 3.39Å; S67-P69 VanDerWaalsContact O-N 3.12Å | ||
| 68 | K | 54.3 | Low | 53.5 | Low | 138 Ų | 138 | 119.9 Ų | 119.9 | 60% | 0.6 | 61% | 0.613 | S | S | * | * | trans | -46.2 | 127.5 | 149.9 | -79.5 | 177.4 | 179.4 | 178.2 | 0 | 106 | E66 L70 E72 | E66-K68 PolarHBondContact O-N 2.86Å; K68-L70 PolarHBondContact O-N 3.48Å; K68-E72 HydrophobicContact CB-CB 4.23Å; K68-E72 HydrophobicContact CB-CG 4.34Å; K68-E72 HydrophobicContact CD-CG 4.19Å; K68-E72 HydrophobicContact CG-CG 4.41Å | ||
| 69 | P | 54.2 | Low | 53.1 | Low | 74 Ų | 74 | 121.1 Ų | 121.1 | 48% | 0.481 | 62% | 0.616 | S | S | . | * | trans | -51.8 | 143.8 | -176.1 | 21.4 | -32 | 0 | 0 | 0 | 108 | S67 L71 E72 E73 | S67-P69 VanDerWaalsContact O-N 3.12Å; P69-L71 CarbonylContact O-C 3.43Å; P69-L71 PolarHBondContact O-N 3.29Å; P69-E72 HydrophobicContact CG-CB 4.03Å; P69-E72 PolarHBondContact O-N 2.93Å; P69-E73 PolarHBondContact O-N 3.12Å | ||
| 70 | L | 51.9 | Low | 52.9 | Low | 135 Ų | 135 | 117.7 Ų | 117.7 | 71% | 0.707 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -53 | -12.5 | -178.9 | -63.2 | 173.6 | 0 | 0 | 0 | 113.7 | K68 L74 | K68-L70 PolarHBondContact O-N 3.48Å; L70-L74 WeakPolarHBondContact O-CB 3.24Å; L70-L74 PolarHBondContact O-N 3.31Å; L70-L74 VanDerWaalsContact O-N 3.17Å |
| 71 | L | 50.9 | Low | 53.1 | Low | 81 Ų | 81 | 110.2 Ų | 110.2 | 42% | 0.424 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -77.8 | -35 | 172.1 | -60.6 | 176.8 | 0 | 0 | 0 | 113.9 | P69 D75 I76 L78 | P69-L71 CarbonylContact O-C 3.43Å; P69-L71 PolarHBondContact O-N 3.29Å; L71-D75 PolarHBondContact O-N 3.06Å; L71-I76 PolarHBondContact O-N 3.23Å; L71-L78 HydrophobicContact CD1-CD1 4.1Å |
| 72 | E | 54.9 | Low | 53.5 | Low | 117 Ų | 117 | 110.4 Ų | 110.4 | 55% | 0.547 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -79.8 | -28.6 | 175.4 | -173.2 | 170.4 | 171.5 | 0 | 0 | 111.3 | K68 P69 | K68-E72 HydrophobicContact CB-CB 4.23Å; K68-E72 HydrophobicContact CB-CG 4.34Å; K68-E72 HydrophobicContact CD-CG 4.19Å; K68-E72 HydrophobicContact CG-CG 4.41Å; P69-E72 HydrophobicContact CG-CB 4.03Å; P69-E72 PolarHBondContact O-N 2.93Å |
| 73 | E | 55.9 | Low | 54 | Low | 145 Ų | 145 | 110.2 Ų | 110.2 | 68% | 0.678 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -77.3 | -27.3 | 171.5 | -144.4 | 173.8 | -152.6 | 0 | 0 | 112.6 | P69 | P69-E73 PolarHBondContact O-N 3.12Å |
| 74 | L | 56.6 | Low | 54.6 | Low | 106 Ų | 106 | 103.8 Ų | 103.8 | 56% | 0.555 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.5 | 3.1 | 175.8 | -164.9 | 61.4 | 0 | 0 | 0 | 113.4 | L70 I76 | L70-L74 WeakPolarHBondContact O-CB 3.24Å; L70-L74 PolarHBondContact O-N 3.31Å; L70-L74 VanDerWaalsContact O-N 3.17Å; L74-I76 VanDerWaalsContact C-N 3.25Å; L74-I76 HydrophobicContact CB-CG1 4.41Å; L74-I76 HydrophobicContact CD2-CD1 3.62Å; L74-I76 HydrophobicContact CD2-CG1 4.35Å; L74-I76 HydrophobicContact CG-CD1 3.84Å; L74-I76 HydrophobicContact CG-CG1 4.08Å; L74-I76 WeakPolarHBondContact O-CG1 3.36Å; L74-I76 PolarHBondContact O-N 2.89Å |
| 75 | D | 52.5 | Low | 55.2 | Low | 141 Ų | 141 | 97.7 Ų | 97.7 | 75% | 0.754 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.8 | 32.1 | -179.8 | -138 | 2.6 | 0 | 0 | 0 | 113.5 | L71 | L71-D75 PolarHBondContact O-N 3.06Š|
| 76 | I | 55.7 | Low | 55.5 | Low | 27 Ų | 27 | 97 Ų | 97 | 14% | 0.138 | 47% | 0.474 | C | S | . | . | trans | -110.8 | 87.6 | 178.1 | -54.4 | -178 | 0 | 0 | 0 | 109.9 | L71 L74 L78 I81 W109 | L71-I76 PolarHBondContact O-N 3.23Å; L74-I76 VanDerWaalsContact C-N 3.25Å; L74-I76 HydrophobicContact CB-CG1 4.41Å; L74-I76 HydrophobicContact CD2-CD1 3.62Å; L74-I76 HydrophobicContact CD2-CG1 4.35Å; L74-I76 HydrophobicContact CG-CD1 3.84Å; L74-I76 HydrophobicContact CG-CG1 4.08Å; L74-I76 WeakPolarHBondContact O-CG1 3.36Å; L74-I76 PolarHBondContact O-N 2.89Å; I76-L78 HydrophobicContact CG2-CD2 4.4Å; I76-L78 PolarHBondContact O-N 3.47Å; I76-I81 HydrophobicContact CG2-CD1 3.81Å; I76-W109 HydrophobicContact CD1-CB 4.13Å; I76-W109 HydrophobicContact CD1-CG 3.89Å | ||
| 77 | D | 60.2 | Low | 55.6 | Low | 87 Ų | 87 | 89 Ų | 89 | 47% | 0.465 | 44% | 0.438 | S | S | . | . | trans | -84.1 | 101.2 | 170.9 | -172 | -9.9 | 0 | 0 | 0 | 111.2 | K79 D80 I81 | D77-K79 PolarHBondContact O-N 3.46Å; D77-K79 WeakPolarHBondContact OD1-CA 3.42Å; D77-K79 WeakPolarHBondContact OD1-CB 3.46Å; D77-K79 PolarHBondContact OD1-N 3.42Å; D77-D80 HydrophobicContact CB-CB 3.75Å; D77-D80 PolarHBondContact O-N 2.95Å; D77-D80 VanDerWaalsContact O-N 3.15Å; D77-D80 PolarHBondContact OD1-N 3.48Å; D77-I81 WeakPolarHBondContact O-CG1 3.31Å; D77-I81 PolarHBondContact O-N 3.44Å | ||
| 78 | L | 54 | Low | 55.7 | Low | 106 Ų | 106 | 84.5 Ų | 84.5 | 56% | 0.555 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -62.1 | -28.2 | 177.1 | -68.4 | 171.1 | 0 | 0 | 0 | 113.4 | L71 I76 I81 Y82 | L71-L78 HydrophobicContact CD1-CD1 4.1Å; I76-L78 HydrophobicContact CG2-CD2 4.4Å; I76-L78 PolarHBondContact O-N 3.47Å; L78-I81 HydrophobicContact CD2-CD1 4.34Å; L78-Y82 VanDerWaalsContact O-CB 3.3Å; L78-Y82 WeakPolarHBondContact O-CB 3.28Å; L78-Y82 PolarHBondContact O-N 3.41Å |
| 79 | K | 51.6 | Low | 55.9 | Low | 174 Ų | 174 | 81.2 Ų | 81.2 | 76% | 0.757 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -72.6 | -38.2 | 174.9 | -75.6 | 176.4 | 179.8 | 169.5 | 0 | 110.5 | D77 Y82 Y83 | D77-K79 PolarHBondContact O-N 3.46Å; D77-K79 WeakPolarHBondContact OD1-CA 3.42Å; D77-K79 WeakPolarHBondContact OD1-CB 3.46Å; D77-K79 PolarHBondContact OD1-N 3.42Å; K79-Y82 PolarHBondContact O-N 2.83Å; K79-Y83 VanDerWaalsContact O-CB 3.3Å; K79-Y83 WeakPolarHBondContact O-CB 3.17Å; K79-Y83 PolarHBondContact O-N 2.85Å |
| 80 | D | 56.8 | Low | 55.9 | Low | 28 Ų | 28 | 82.3 Ų | 82.3 | 15% | 0.15 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -67 | -43.9 | 173.5 | -166.6 | 31.9 | 0 | 0 | 0 | 111.1 | D77 Y82 Y83 K84 | D77-D80 HydrophobicContact CB-CB 3.75Å; D77-D80 PolarHBondContact O-N 2.95Å; D77-D80 VanDerWaalsContact O-N 3.15Å; D77-D80 PolarHBondContact OD1-N 3.48Å; D80-Y82 VanDerWaalsContact C-N 3.33Å; D80-Y82 PolarHBondContact O-N 2.9Å; D80-Y83 CarbonylContact O-C 3.58Å; D80-Y83 WeakPolarHBondContact O-CB 3.41Å; D80-Y83 PolarHBondContact O-N 2.96Å; D80-Y83 VanDerWaalsContact O-N 3.14Å; D80-K84 VanDerWaalsContact CG-CE 3.5Å; D80-K84 WeakPolarHBondContact O-CB 3.19Å; D80-K84 VanDerWaalsContact O-CG 3.22Å; D80-K84 WeakPolarHBondContact O-CG 3.23Å; D80-K84 PolarHBondContact O-N 3.34Å; D80-K84 WeakPolarHBondContact OD2-CE 3.41Å; D80-K84 IonicContact OD2-NZ 2.67Å; D80-K84 PolarHBondContact OD2-NZ 3.09Å |
| 81 | I | 60.8 | Low | 55.8 | Low | 23 Ų | 23 | 76.4 Ų | 76.4 | 12% | 0.118 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -57.7 | -45.5 | 172.6 | -68.2 | 167.8 | 0 | 0 | 0 | 111 | I76 D77 L78 Y83 K84 V85 Y166 | I76-I81 HydrophobicContact CG2-CD1 3.81Å; D77-I81 WeakPolarHBondContact O-CG1 3.31Å; D77-I81 PolarHBondContact O-N 3.44Å; L78-I81 HydrophobicContact CD2-CD1 4.34Å; I81-Y83 VanDerWaalsContact C-N 3.35Å; I81-Y83 PolarHBondContact O-N 2.85Å; I81-K84 PolarHBondContact O-N 2.97Å; I81-V85 HydrophobicContact CG2-CG2 4.42Å; I81-V85 VanDerWaalsContact O-CB 3.27Å; I81-V85 WeakPolarHBondContact O-CB 3.35Å; I81-V85 WeakPolarHBondContact O-CG2 3.37Å; I81-V85 PolarHBondContact O-N 3.42Å; I81-Y166 HydrophobicContact CG2-CE1 4.17Å |
| 82 | Y | 55.8 | Low | 55.4 | Low | 134 Ų | 134 | 77.8 Ų | 77.8 | 53% | 0.525 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 176.6 | 177.5 | -101.3 | 0 | 0 | 0 | 112.1 | L78 K79 D80 V85 R86 | L78-Y82 VanDerWaalsContact O-CB 3.3Å; L78-Y82 WeakPolarHBondContact O-CB 3.28Å; L78-Y82 PolarHBondContact O-N 3.41Å; K79-Y82 PolarHBondContact O-N 2.83Å; D80-Y82 VanDerWaalsContact C-N 3.33Å; D80-Y82 PolarHBondContact O-N 2.9Å; Y82-V85 PolarHBondContact O-N 3.44Å; Y82-R86 WeakPolarHBondContact O-CB 3.48Å; Y82-R86 PolarHBondContact O-N 3.15Å |
| 83 | Y | 57.5 | Low | 54.9 | Low | 87 Ų | 87 | 77.3 Ų | 77.3 | 34% | 0.341 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -65.3 | -44.8 | 175.8 | -173.9 | -92.7 | 0 | 0 | 0 | 111.8 | K79 D80 I81 R86 C87 Y97 | K79-Y83 VanDerWaalsContact O-CB 3.3Å; K79-Y83 WeakPolarHBondContact O-CB 3.17Å; K79-Y83 PolarHBondContact O-N 2.85Å; D80-Y83 CarbonylContact O-C 3.58Å; D80-Y83 WeakPolarHBondContact O-CB 3.41Å; D80-Y83 PolarHBondContact O-N 2.96Å; D80-Y83 VanDerWaalsContact O-N 3.14Å; I81-Y83 VanDerWaalsContact C-N 3.35Å; I81-Y83 PolarHBondContact O-N 2.85Å; Y83-R86 PolarHBondContact O-N 2.66Å; Y83-C87 PolarHBondContact O-N 3.2Å; Y83-C87 PolarHBondContact O-SG 3.32Å; Y83-Y97 HydrophobicContact CD2-CD1 4.47Å; Y83-Y97 HydrophobicContact CD2-CE1 4.04Å; Y83-Y97 AromaticContact CE1-CD1 3.76Å; Y83-Y97 HydrophobicContact CE1-CD1 3.76Å; Y83-Y97 HydrophobicContact CE1-CE1 4.27Å; Y83-Y97 AromaticContact CE2-CD1 3.64Å; Y83-Y97 HydrophobicContact CE2-CD1 3.64Å; Y83-Y97 AromaticContact CE2-CE1 3.32Å; Y83-Y97 HydrophobicContact CE2-CE1 3.32Å; Y83-Y97 AromaticContact CZ-CD1 3.24Å; Y83-Y97 AromaticContact CZ-CE1 3.49Å; Y83-Y97 VanDerWaalsContact CZ-CE1 3.49Å; Y83-Y97 WeakPolarHBondContact OH-CD1 3.26Å |
| 84 | K | 60.9 | Low | 54.1 | Low | 0 Ų | 0 | 75.6 Ų | 75.6 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -58.9 | -47.4 | 173.5 | -72.1 | 170.8 | 178.4 | 165.3 | 0 | 111.1 | D80 I81 R86 C87 V88 V102 N105 D107 Y166 | D80-K84 VanDerWaalsContact CG-CE 3.5Å; D80-K84 WeakPolarHBondContact O-CB 3.19Å; D80-K84 VanDerWaalsContact O-CG 3.22Å; D80-K84 WeakPolarHBondContact O-CG 3.23Å; D80-K84 PolarHBondContact O-N 3.34Å; D80-K84 WeakPolarHBondContact OD2-CE 3.41Å; D80-K84 IonicContact OD2-NZ 2.67Å; D80-K84 PolarHBondContact OD2-NZ 3.09Å; I81-K84 PolarHBondContact O-N 2.97Å; K84-R86 VanDerWaalsContact C-N 3.33Å; K84-R86 PolarHBondContact O-N 2.89Å; K84-C87 WeakPolarHBondContact O-CB 3.42Å; K84-C87 PolarHBondContact O-N 2.88Å; K84-V88 WeakPolarHBondContact O-CB 3.45Å; K84-V88 WeakPolarHBondContact O-CG2 3.06Å; K84-V88 PolarHBondContact O-N 2.95Å; K84-V102 HydrophobicContact CB-CG1 4.48Å; K84-V102 HydrophobicContact CB-CG2 4.41Å; K84-V102 HydrophobicContact CD-CG1 4.41Å; K84-V102 HydrophobicContact CG-CB 4.36Å; K84-V102 HydrophobicContact CG-CG1 4.21Å; K84-V102 HydrophobicContact CG-CG2 3.93Å; K84-N105 PolarHBondContact NZ-O 2.94Å; K84-D107 IonicContact NZ-OD1 3.52Å; K84-D107 IonicContact NZ-OD2 2.7Å; K84-D107 PolarHBondContact NZ-OD2 3.49Å; K84-Y166 HydrophobicContact CD-CE2 4.44Å |
| 85 | V | 60.8 | Low | 53.3 | Low | 24 Ų | 24 | 74.4 Ų | 74.4 | 15% | 0.145 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -56.7 | -44.6 | 173.6 | 154.2 | 0 | 0 | 0 | 0 | 111.7 | I81 Y82 V88 L89 Y166 L169 | I81-V85 HydrophobicContact CG2-CG2 4.42Å; I81-V85 VanDerWaalsContact O-CB 3.27Å; I81-V85 WeakPolarHBondContact O-CB 3.35Å; I81-V85 WeakPolarHBondContact O-CG2 3.37Å; I81-V85 PolarHBondContact O-N 3.42Å; Y82-V85 PolarHBondContact O-N 3.44Å; V85-V88 PolarHBondContact O-N 3.41Å; V85-L89 WeakPolarHBondContact O-CB 3.42Å; V85-L89 PolarHBondContact O-N 2.92Å; V85-Y166 HydrophobicContact CG2-CD1 4Å; V85-Y166 HydrophobicContact CG2-CE1 4.24Å; V85-L169 HydrophobicContact CB-CD1 3.93Å; V85-L169 HydrophobicContact CG1-CD1 3.28Å; V85-L169 HydrophobicContact CG1-CD2 4.26Å; V85-L169 HydrophobicContact CG1-CG 4.4Å; V85-L169 HydrophobicContact CG2-CD1 3.55Å |
| 86 | R | 56.1 | Low | 52.7 | Low | 134 Ų | 134 | 70.9 Ų | 70.9 | 51% | 0.506 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -70.5 | -35.7 | -179.3 | -150.8 | 176 | -168.9 | 173.1 | 4 | 112.3 | Y82 Y83 K84 V88 L89 M90 | Y82-R86 WeakPolarHBondContact O-CB 3.48Å; Y82-R86 PolarHBondContact O-N 3.15Å; Y83-R86 PolarHBondContact O-N 2.66Å; K84-R86 VanDerWaalsContact C-N 3.33Å; K84-R86 PolarHBondContact O-N 2.89Å; R86-V88 VanDerWaalsContact C-N 3.34Å; R86-L89 PolarHBondContact O-N 3.29Å; R86-M90 PolarHBondContact O-N 3.11Å |
| 87 | C | 54.3 | Low | 52.2 | Low | 13 Ų | 13 | 72.7 Ų | 72.7 | 9% | 0.088 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -64.1 | -39.1 | 172 | -68.7 | 0 | 0 | 0 | 0 | 112.1 | Y83 K84 M90 Y97 | Y83-C87 PolarHBondContact O-N 3.2Å; Y83-C87 PolarHBondContact O-SG 3.32Å; K84-C87 WeakPolarHBondContact O-CB 3.42Å; K84-C87 PolarHBondContact O-N 2.88Å; C87-M90 CarbonylContact O-C 3.57Å; C87-M90 VanDerWaalsContact O-O 3.11Å; C87-Y97 VanDerWaalsContact SG-CB 3.54Å; C87-Y97 VanDerWaalsContact SG-CD1 3.5Å |
| 88 | V | 55.1 | Low | 51.7 | Low | 0 Ų | 0 | 73.2 Ų | 73.2 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -74.5 | -34.8 | 179.5 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | K84 V85 R86 M90 Y166 S202 L206 | K84-V88 WeakPolarHBondContact O-CB 3.45Å; K84-V88 WeakPolarHBondContact O-CG2 3.06Å; K84-V88 PolarHBondContact O-N 2.95Å; V85-V88 PolarHBondContact O-N 3.41Å; R86-V88 VanDerWaalsContact C-N 3.34Å; V88-M90 VanDerWaalsContact C-N 3.32Å; V88-Y166 WeakPolarHBondContact CG1-O 2.89Å; V88-S202 WeakPolarHBondContact CG1-OG 3.35Å; V88-S202 WeakPolarHBondContact O-CB 3.44Å; V88-S202 PolarHBondContact O-OG 3.42Å; V88-L206 HydrophobicContact CB-CD1 4.35Å; V88-L206 HydrophobicContact CG2-CD1 3.45Å; V88-L206 VanDerWaalsContact CG2-CD1 3.45Å |
| 89 | L | 57.6 | Low | 51.7 | Low | 69 Ų | 69 | 73.1 Ų | 73.1 | 36% | 0.361 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -69.6 | -29 | 176.9 | -170.1 | 67.6 | 0 | 0 | 0 | 112.1 | V85 R86 L169 P170 W198 | V85-L89 WeakPolarHBondContact O-CB 3.42Å; V85-L89 PolarHBondContact O-N 2.92Å; R86-L89 PolarHBondContact O-N 3.29Å; L89-L169 HydrophobicContact CD1-CD2 3.96Å; L89-P170 HydrophobicContact CD1-CG 4.41Å; L89-W198 VanDerWaalsContact O-CE2 3.29Å; L89-W198 WeakPolarHBondContact O-CZ2 3.5Å; L89-W198 PolarHBondContact O-NE1 3.08Å |
| 90 | M | 54.3 | Low | 51.7 | Low | 97 Ų | 97 | 70.6 Ų | 70.6 | 48% | 0.478 | 36% | 0.364 | S | S | . | . | trans | -125.4 | 92 | 179.3 | -160.2 | 178.8 | -154.9 | 0 | 0 | 111 | R86 C87 V88 M92 L95 | R86-M90 PolarHBondContact O-N 3.11Å; C87-M90 CarbonylContact O-C 3.57Å; C87-M90 VanDerWaalsContact O-O 3.11Å; V88-M90 VanDerWaalsContact C-N 3.32Å; M90-M92 HydrophobicContact CE-CG 4.22Å; M90-M92 HydrophobicContact CG-CB 4.18Å; M90-M92 HydrophobicContact CG-CG 3.91Å; M90-M92 PolarHBondContact O-N 3.01Å; M90-L95 HydrophobicContact SD-CD1 3.77Å | ||
| 91 | P | 49.9 | Very low | 51.4 | Low | 12 Ų | 12 | 71.2 Ų | 71.2 | 8% | 0.078 | 37% | 0.369 | C | S | . | . | trans | -78.2 | 46.9 | -178.8 | 35.2 | -35.3 | 0 | 0 | 0 | 111.3 | P93 W198 Y201 | P91-P93 WeakPolarHBondContact O-CD 3.3Å; P91-W198 HydrophobicContact CG-CZ2 4.16Å; P91-Y201 HydrophobicContact CB-CD1 3.81Å; P91-Y201 HydrophobicContact CB-CE1 3.75Å; P91-Y201 HydrophobicContact CG-CD1 3.66Å; P91-Y201 HydrophobicContact CG-CE1 3.84Å | ||
| 92 | M | 41.8 | Very low | 51.1 | Low | 109 Ų | 109 | 70.5 Ų | 70.5 | 54% | 0.537 | 37% | 0.365 | S | S | . | . | trans | -92.4 | 117.8 | 178.2 | -78.2 | -72.5 | -102 | 0 | 0 | 109.9 | M90 S94 | M90-M92 HydrophobicContact CE-CG 4.22Å; M90-M92 HydrophobicContact CG-CB 4.18Å; M90-M92 HydrophobicContact CG-CG 3.91Å; M90-M92 PolarHBondContact O-N 3.01Å; M92-S94 PolarHBondContact O-N 3.41Å; M92-S94 VanDerWaalsContact O-N 3.09Å | ||
| 93 | P | 45.1 | Very low | 51 | Low | 108 Ų | 108 | 66.9 Ų | 66.9 | 70% | 0.701 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -61.4 | -15.4 | 176.2 | -20.5 | 31.1 | 0 | 0 | 0 | 114.5 | P91 L95 | P91-P93 WeakPolarHBondContact O-CD 3.3Å; P93-L95 PolarHBondContact O-N 2.77Å |
| 94 | S | 38 | Very low | 51 | Low | 108 Ų | 108 | 66.9 Ų | 66.9 | 76% | 0.755 | 36% | 0.357 | S | S | * | . | G | 310 helix | trans | -80.9 | -7.2 | -170.7 | -176 | 0 | 0 | 0 | 0 | 115.1 | M92 | M92-S94 PolarHBondContact O-N 3.41Å; M92-S94 VanDerWaalsContact O-N 3.09Å |
| 95 | L | 41 | Very low | 50.9 | Low | 82 Ų | 82 | 71.2 Ų | 71.2 | 43% | 0.429 | 38% | 0.38 | S | S | . | . | G | 310 helix | trans | -100.3 | 9.6 | -167.5 | -113.7 | 153.7 | 0 | 0 | 0 | 114.6 | M90 P93 Y97 | M90-L95 HydrophobicContact SD-CD1 3.77Å; P93-L95 PolarHBondContact O-N 2.77Å; L95-Y97 HydrophobicContact CB-CD2 3.51Å; L95-Y97 HydrophobicContact CB-CE2 3.55Å; L95-Y97 HydrophobicContact CD1-CE2 4.04Å; L95-Y97 HydrophobicContact CD2-CD2 4.38Å; L95-Y97 HydrophobicContact CD2-CE2 3.58Å; L95-Y97 HydrophobicContact CG-CD2 4.37Å; L95-Y97 HydrophobicContact CG-CE2 3.9Å; L95-Y97 PolarHBondContact O-N 3.14Å; L95-Y97 VanDerWaalsContact O-N 3.1Å |
| 96 | G | 38.8 | Very low | 50.9 | Low | 67 Ų | 67 | 73.1 Ų | 73.1 | 69% | 0.691 | 39% | 0.392 | S | S | * | . | trans | 65.5 | 15.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 97 | Y | 46.5 | Very low | 51.6 | Low | 65 Ų | 65 | 67.9 Ų | 67.9 | 26% | 0.255 | 37% | 0.374 | S | S | . | . | trans | -75.9 | 122.5 | -179.7 | -72.4 | -56.4 | 0 | 0 | 0 | 111 | Y83 C87 L95 R99 | Y83-Y97 HydrophobicContact CD2-CD1 4.47Å; Y83-Y97 HydrophobicContact CD2-CE1 4.04Å; Y83-Y97 AromaticContact CE1-CD1 3.76Å; Y83-Y97 HydrophobicContact CE1-CD1 3.76Å; Y83-Y97 HydrophobicContact CE1-CE1 4.27Å; Y83-Y97 AromaticContact CE2-CD1 3.64Å; Y83-Y97 HydrophobicContact CE2-CD1 3.64Å; Y83-Y97 AromaticContact CE2-CE1 3.32Å; Y83-Y97 HydrophobicContact CE2-CE1 3.32Å; Y83-Y97 AromaticContact CZ-CD1 3.24Å; Y83-Y97 AromaticContact CZ-CE1 3.49Å; Y83-Y97 VanDerWaalsContact CZ-CE1 3.49Å; Y83-Y97 WeakPolarHBondContact OH-CD1 3.26Å; C87-Y97 VanDerWaalsContact SG-CB 3.54Å; C87-Y97 VanDerWaalsContact SG-CD1 3.5Å; L95-Y97 HydrophobicContact CB-CD2 3.51Å; L95-Y97 HydrophobicContact CB-CE2 3.55Å; L95-Y97 HydrophobicContact CD1-CE2 4.04Å; L95-Y97 HydrophobicContact CD2-CD2 4.38Å; L95-Y97 HydrophobicContact CD2-CE2 3.58Å; L95-Y97 HydrophobicContact CG-CD2 4.37Å; L95-Y97 HydrophobicContact CG-CE2 3.9Å; L95-Y97 PolarHBondContact O-N 3.14Å; L95-Y97 VanDerWaalsContact O-N 3.1Å; Y97-R99 VanDerWaalsContact C-N 3.34Å; Y97-R99 PolarHBondContact O-N 2.89Å | ||
| 98 | N | 49.6 | Very low | 52.3 | Low | 98 Ų | 98 | 72.5 Ų | 72.5 | 52% | 0.524 | 39% | 0.393 | S | S | . | . | trans | -67 | 90.2 | 175.5 | -76.9 | -35.2 | 0 | 0 | 0 | 110 | Q100 V101 | N98-Q100 PolarHBondContact O-N 3.5Å; N98-V101 HydrophobicContact CB-CB 4.33Å; N98-V101 HydrophobicContact CB-CG2 3.61Å; N98-V101 PolarHBondContact O-N 3.48Å | ||
| 99 | R | 54 | Low | 53.4 | Low | 103 Ų | 103 | 79.7 Ų | 79.7 | 39% | 0.389 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -54.2 | -22.3 | 172 | -74.4 | 151.5 | 74.6 | 122.4 | -18 | 112.5 | Y97 S205 L206 | Y97-R99 VanDerWaalsContact C-N 3.34Å; Y97-R99 PolarHBondContact O-N 2.89Å; R99-S205 PolarHBondContact NH2-O 3.01Å; R99-L206 HydrophobicContact CB-CD2 4.26Å; R99-L206 HydrophobicContact CG-CD2 3.88Å |
| 100 | Q | 50.8 | Low | 54.4 | Low | 121 Ų | 121 | 76.6 Ų | 76.6 | 57% | 0.565 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -67.5 | -33.2 | 173 | -70.1 | 176.6 | -16.9 | 0 | 0 | 112.7 | N98 V102 R103 D104 | N98-Q100 PolarHBondContact O-N 3.5Å; Q100-V102 VanDerWaalsContact C-N 3.34Å; Q100-V102 PolarHBondContact O-N 2.85Å; Q100-R103 CarbonylContact O-C 3.59Å; Q100-R103 WeakPolarHBondContact O-CA 3.47Å; Q100-R103 VanDerWaalsContact O-CB 3.3Å; Q100-R103 WeakPolarHBondContact O-CB 3.09Å; Q100-R103 PolarHBondContact O-N 3.38Å; Q100-D104 WeakPolarHBondContact O-CB 3.28Å; Q100-D104 PolarHBondContact O-N 2.93Å; Q100-D104 VanDerWaalsContact O-OD2 3.12Å |
| 101 | V | 51.6 | Low | 55.8 | Low | 42 Ų | 42 | 72.1 Ų | 72.1 | 26% | 0.255 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -66.5 | -32.9 | -178.9 | 173.9 | 0 | 0 | 0 | 0 | 112.8 | N98 R103 D104 N105 | N98-V101 HydrophobicContact CB-CB 4.33Å; N98-V101 HydrophobicContact CB-CG2 3.61Å; N98-V101 PolarHBondContact O-N 3.48Å; V101-R103 PolarHBondContact O-N 3.43Å; V101-D104 PolarHBondContact O-N 3.16Å; V101-N105 PolarHBondContact O-N 2.92Å |
| 102 | V | 54 | Low | 57.4 | Low | 8 Ų | 8 | 73.5 Ų | 73.5 | 5% | 0.048 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -66.9 | -30.9 | 172 | -164.7 | 0 | 0 | 0 | 0 | 111.6 | K84 Q100 V163 Y166 | K84-V102 HydrophobicContact CB-CG1 4.48Å; K84-V102 HydrophobicContact CB-CG2 4.41Å; K84-V102 HydrophobicContact CD-CG1 4.41Å; K84-V102 HydrophobicContact CG-CB 4.36Å; K84-V102 HydrophobicContact CG-CG1 4.21Å; K84-V102 HydrophobicContact CG-CG2 3.93Å; Q100-V102 VanDerWaalsContact C-N 3.34Å; Q100-V102 PolarHBondContact O-N 2.85Å; V102-V163 HydrophobicContact CG1-CG2 4.29Å; V102-Y166 HydrophobicContact CG1-CD2 4.48Å |
| 103 | R | 54.1 | Low | 59.4 | Low | 57 Ų | 57 | 70.6 Ų | 70.6 | 22% | 0.215 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -80.4 | -41.5 | 177.7 | -167.7 | 170.4 | 95 | 161.8 | 5.9 | 110.1 | Q100 V101 Q159 E211 | Q100-R103 CarbonylContact O-C 3.59Å; Q100-R103 WeakPolarHBondContact O-CA 3.47Å; Q100-R103 VanDerWaalsContact O-CB 3.3Å; Q100-R103 WeakPolarHBondContact O-CB 3.09Å; Q100-R103 PolarHBondContact O-N 3.38Å; V101-R103 PolarHBondContact O-N 3.43Å; R103-Q159 HydrophobicContact CG-CB 4.32Å; R103-Q159 HydrophobicContact CG-CG 4.11Å; R103-Q159 WeakPolarHBondContact O-CG 3.26Å; R103-Q159 PolarHBondContact O-NE2 3.04Å; R103-E211 IonicContact NH1-OE2 3.09Å; R103-E211 PolarHBondContact NH1-OE2 3.32Å; R103-E211 VanDerWaalsContact NH1-OE2 3.09Å; R103-E211 IonicContact NH2-OE1 3.84Å; R103-E211 IonicContact NH2-OE2 3.97Å |
| 104 | D | 56.8 | Low | 61.4 | Low | 88 Ų | 88 | 66 Ų | 66 | 47% | 0.471 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -82.8 | -26.5 | -165.8 | -61.2 | -22.2 | 0 | 0 | 0 | 112.8 | Q100 V101 P106 | Q100-D104 WeakPolarHBondContact O-CB 3.28Å; Q100-D104 PolarHBondContact O-N 2.93Å; Q100-D104 VanDerWaalsContact O-OD2 3.12Å; V101-D104 PolarHBondContact O-N 3.16Å; D104-P106 WeakPolarHBondContact O-CD 3.2Å |
| 105 | N | 58.4 | Low | 63.8 | Low | 91 Ų | 91 | 60.8 Ų | 60.8 | 49% | 0.487 | 32% | 0.317 | S | S | . | . | S | Bend | trans | -118.9 | 86 | 173.2 | -60.1 | -54.4 | 0 | 0 | 0 | 110.7 | K84 V101 D107 | K84-N105 PolarHBondContact NZ-O 2.94Å; V101-N105 PolarHBondContact O-N 2.92Å; N105-D107 PolarHBondContact O-N 3.41Å; N105-D107 VanDerWaalsContact O-N 3.13Å |
| 106 | P | 61.1 | Low | 66 | Low | 63 Ų | 63 | 60.9 Ų | 60.9 | 41% | 0.409 | 32% | 0.318 | S | S | . | . | trans | -75.5 | 98.8 | -178.3 | 29.5 | -33.4 | 0 | 0 | 0 | 111.4 | D104 Q159 | D104-P106 WeakPolarHBondContact O-CD 3.2Å; P106-Q159 HydrophobicContact CB-CG 4.42Å | ||
| 107 | D | 70.7 | Confident | 68.2 | Low | 24 Ų | 24 | 62.3 Ų | 62.3 | 13% | 0.128 | 31% | 0.309 | C | S | . | . | trans | -75.4 | 126.6 | 170.6 | -46.1 | -44 | 0 | 0 | 0 | 109.4 | K84 N105 P111 Y166 | K84-D107 IonicContact NZ-OD1 3.52Å; K84-D107 IonicContact NZ-OD2 2.7Å; K84-D107 PolarHBondContact NZ-OD2 3.49Å; N105-D107 PolarHBondContact O-N 3.41Å; N105-D107 VanDerWaalsContact O-N 3.13Å; D107-P111 WeakPolarHBondContact O-CD 3.49Å; D107-P111 WeakPolarHBondContact O-CG 3.37Å; D107-Y166 PolarHBondContact OD2-OH 3.4Å | ||
| 108 | F | 69.4 | Low | 70.2 | Confident | 111 Ų | 111 | 59.3 Ų | 59.3 | 49% | 0.487 | 30% | 0.297 | S | S | . | . | S | Bend | trans | -79.3 | -35.4 | 174.2 | 179.5 | -105 | 0 | 0 | 0 | 112.3 | P111 L112 W137 L161 | F108-P111 WeakPolarHBondContact O-CD 3.43Å; F108-L112 HydrophobicContact CD1-CD1 4.16Å; F108-L112 HydrophobicContact CE1-CD1 3.4Å; F108-L112 VanDerWaalsContact CE1-CD1 3.4Å; F108-L112 HydrophobicContact CZ-CD1 3.74Å; F108-L112 VanDerWaalsContact O-CB 3.26Å; F108-L112 WeakPolarHBondContact O-CB 3.48Å; F108-L112 PolarHBondContact O-N 3.2Å; F108-W137 HydrophobicContact CE2-CH2 4.46Å; F108-L161 HydrophobicContact CD2-CD2 3.92Å; F108-L161 HydrophobicContact CE2-CD2 3.82Å |
| 109 | W | 77.8 | Confident | 71.9 | Confident | 150 Ų | 150 | 54.7 Ų | 54.7 | 57% | 0.568 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -74.6 | -37.3 | -171.9 | -72.1 | 103 | 0 | 0 | 0 | 113.9 | I76 L112 A113 | I76-W109 HydrophobicContact CD1-CB 4.13Å; I76-W109 HydrophobicContact CD1-CG 3.89Å; W109-L112 PolarHBondContact O-N 2.84Å; W109-A113 WeakPolarHBondContact O-CB 3.13Å; W109-A113 PolarHBondContact O-N 3.35Å |
| 110 | G | 79.1 | Confident | 73.1 | Confident | 5 Ų | 5 | 54.4 Ų | 54.4 | 5% | 0.052 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.2 | -56 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | L112 A113 V114 | G110-L112 VanDerWaalsContact C-N 3.3Å; G110-L112 PolarHBondContact O-N 3.09Å; G110-A113 PolarHBondContact O-N 3.39Å; G110-V114 WeakPolarHBondContact O-CG2 3.31Å; G110-V114 PolarHBondContact O-N 2.94Å |
| 111 | P | 82.6 | Confident | 74.5 | Confident | 2 Ų | 2 | 51.5 Ų | 51.5 | 1% | 0.013 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.6 | -39.6 | 176.6 | -16.3 | 26.9 | 0 | 0 | 0 | 112.1 | D107 F108 A113 V114 V115 W137 Y166 | D107-P111 WeakPolarHBondContact O-CD 3.49Å; D107-P111 WeakPolarHBondContact O-CG 3.37Å; F108-P111 WeakPolarHBondContact O-CD 3.43Å; P111-A113 PolarHBondContact O-N 3.17Å; P111-V114 PolarHBondContact O-N 3.42Å; P111-V115 WeakPolarHBondContact O-CG2 3.42Å; P111-V115 PolarHBondContact O-N 3.05Å; P111-W137 HydrophobicContact CB-CZ2 3.93Å; P111-Y166 HydrophobicContact CB-CD2 4.47Å; P111-Y166 HydrophobicContact CB-CE2 4.44Å; P111-Y166 VanDerWaalsContact CD-CZ 3.41Å; P111-Y166 WeakPolarHBondContact CD-OH 3.43Å; P111-Y166 HydrophobicContact CG-CD2 3.84Å; P111-Y166 HydrophobicContact CG-CE1 4.25Å; P111-Y166 HydrophobicContact CG-CE2 3.43Å; P111-Y166 VanDerWaalsContact CG-CE2 3.43Å; P111-Y166 HydrophobicContact CG-CG 4.4Å |
| 112 | L | 84.7 | Confident | 75.6 | Confident | 41 Ų | 41 | 50.1 Ų | 50.1 | 22% | 0.215 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.8 | -46.9 | 176.8 | -176.4 | 159.1 | 0 | 0 | 0 | 110.8 | F108 W109 G110 V114 V115 L116 W137 | F108-L112 HydrophobicContact CD1-CD1 4.16Å; F108-L112 HydrophobicContact CE1-CD1 3.4Å; F108-L112 VanDerWaalsContact CE1-CD1 3.4Å; F108-L112 HydrophobicContact CZ-CD1 3.74Å; F108-L112 VanDerWaalsContact O-CB 3.26Å; F108-L112 WeakPolarHBondContact O-CB 3.48Å; F108-L112 PolarHBondContact O-N 3.2Å; W109-L112 PolarHBondContact O-N 2.84Å; G110-L112 VanDerWaalsContact C-N 3.3Å; G110-L112 PolarHBondContact O-N 3.09Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.45Å; L112-V115 PolarHBondContact O-N 3.13Å; L112-L116 HydrophobicContact CD2-CD1 4.38Å; L112-L116 VanDerWaalsContact O-CB 3.3Å; L112-L116 WeakPolarHBondContact O-CB 3.31Å; L112-L116 PolarHBondContact O-N 2.87Å; L112-W137 HydrophobicContact CB-CH2 4.16Å |
| 113 | A | 84.1 | Confident | 75.7 | Confident | 48 Ų | 48 | 55.3 Ų | 55.3 | 40% | 0.397 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.7 | -41.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | W109 G110 P111 L116 L117 | W109-A113 WeakPolarHBondContact O-CB 3.13Å; W109-A113 PolarHBondContact O-N 3.35Å; G110-A113 PolarHBondContact O-N 3.39Å; P111-A113 PolarHBondContact O-N 3.17Å; A113-L116 PolarHBondContact O-N 3.27Å; A113-L117 WeakPolarHBondContact O-CB 3.42Å; A113-L117 VanDerWaalsContact O-CG 3.32Å; A113-L117 WeakPolarHBondContact O-CG 3.19Å; A113-L117 PolarHBondContact O-N 2.86Å |
| 114 | V | 85.7 | Confident | 75.9 | Confident | 11 Ų | 11 | 62.5 Ų | 62.5 | 7% | 0.067 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.4 | -47.4 | 175.9 | 175.2 | 0 | 0 | 0 | 0 | 111.2 | G110 P111 L112 L116 L117 F118 G165 Y166 L168 L169 I172 | G110-V114 WeakPolarHBondContact O-CG2 3.31Å; G110-V114 PolarHBondContact O-N 2.94Å; P111-V114 PolarHBondContact O-N 3.42Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.45Å; V114-L116 VanDerWaalsContact C-N 3.31Å; V114-L116 PolarHBondContact O-N 3.15Å; V114-L117 PolarHBondContact O-N 3.3Å; V114-F118 PolarHBondContact O-N 3.32Å; V114-G165 VanDerWaalsContact CG1-O 3.25Å; V114-G165 WeakPolarHBondContact CG1-O 2.96Å; V114-Y166 HydrophobicContact CG2-CD1 4.26Å; V114-L168 HydrophobicContact CG1-CB 4.2Å; V114-L169 HydrophobicContact CG1-CB 4.32Å; V114-L169 HydrophobicContact CG2-CD1 4.33Å; V114-I172 HydrophobicContact CG1-CD1 3.57Å; V114-I172 VanDerWaalsContact O-CD1 3.22Å; V114-I172 WeakPolarHBondContact O-CD1 3.36Å |
| 115 | V | 88.8 | Confident | 75.9 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.4 | -39.5 | 178.4 | 178.9 | 0 | 0 | 0 | 0 | 110.9 | P111 L112 F118 S119 I133 I134 W137 L168 | P111-V115 WeakPolarHBondContact O-CG2 3.42Å; P111-V115 PolarHBondContact O-N 3.05Å; L112-V115 PolarHBondContact O-N 3.13Å; V115-F118 PolarHBondContact O-N 3.05Å; V115-S119 WeakPolarHBondContact O-CB 3.47Å; V115-S119 PolarHBondContact O-N 2.85Å; V115-I133 HydrophobicContact CG1-CG2 3.88Å; V115-I134 HydrophobicContact CG1-CD1 3.67Å; V115-W137 HydrophobicContact CB-CD2 4.44Å; V115-W137 HydrophobicContact CG1-CB 4.35Å; V115-W137 HydrophobicContact CG1-CD2 4.25Å; V115-W137 HydrophobicContact CG1-CE3 4.31Å; V115-W137 HydrophobicContact CG1-CG 4.27Å; V115-W137 HydrophobicContact CG2-CD2 3.7Å; V115-W137 HydrophobicContact CG2-CE3 4.24Å; V115-W137 HydrophobicContact CG2-CG 3.92Å; V115-W137 HydrophobicContact CG2-CZ2 4.11Å; V115-L168 HydrophobicContact CB-CD1 4.26Å; V115-L168 HydrophobicContact CG1-CD1 4.4Å; V115-L168 HydrophobicContact CG2-CD1 3.57Å |
| 116 | L | 87.1 | Confident | 76.1 | Confident | 83 Ų | 83 | 62.7 Ų | 62.7 | 44% | 0.435 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -66.5 | -41.6 | 177.4 | -167.2 | 154 | 0 | 0 | 0 | 111.4 | L112 A113 V114 S119 M120 | L112-L116 HydrophobicContact CD2-CD1 4.38Å; L112-L116 VanDerWaalsContact O-CB 3.3Å; L112-L116 WeakPolarHBondContact O-CB 3.31Å; L112-L116 PolarHBondContact O-N 2.87Å; A113-L116 PolarHBondContact O-N 3.27Å; V114-L116 VanDerWaalsContact C-N 3.31Å; V114-L116 PolarHBondContact O-N 3.15Å; L116-S119 CarbonylContact O-C 3.56Å; L116-S119 WeakPolarHBondContact O-CB 3.4Å; L116-S119 PolarHBondContact O-N 2.83Å; L116-M120 HydrophobicContact CD2-CG 4.05Å; L116-M120 WeakPolarHBondContact O-CG 3.43Å; L116-M120 PolarHBondContact O-N 3.45Å |
| 117 | L | 86.3 | Confident | 76.5 | Confident | 98 Ų | 98 | 69 Ų | 69 | 51% | 0.513 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 173.3 | -76.7 | 173 | 0 | 0 | 0 | 111.9 | A113 V114 S119 M120 I121 I172 | A113-L117 WeakPolarHBondContact O-CB 3.42Å; A113-L117 VanDerWaalsContact O-CG 3.32Å; A113-L117 WeakPolarHBondContact O-CG 3.19Å; A113-L117 PolarHBondContact O-N 2.86Å; V114-L117 PolarHBondContact O-N 3.3Å; L117-S119 VanDerWaalsContact C-N 3.29Å; L117-S119 PolarHBondContact O-N 3.33Å; L117-M120 PolarHBondContact O-N 3.43Å; L117-I121 WeakPolarHBondContact O-CG1 3.3Å; L117-I121 PolarHBondContact O-N 3.21Å; L117-I172 HydrophobicContact CB-CD1 4.29Å |
| 118 | F | 86.8 | Confident | 76.8 | Confident | 1 Ų | 1 | 76.6 Ų | 76.6 | 0% | 0.004 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -57.7 | -45.2 | 173.4 | 177.2 | -105.1 | 0 | 0 | 0 | 111.3 | V114 V115 M120 I121 S122 I133 L171 I172 T175 F230 | V114-F118 PolarHBondContact O-N 3.32Å; V115-F118 PolarHBondContact O-N 3.05Å; F118-M120 VanDerWaalsContact C-N 3.3Å; F118-M120 PolarHBondContact O-N 2.69Å; F118-I121 PolarHBondContact O-N 3.46Å; F118-I121 VanDerWaalsContact O-N 3.16Å; F118-S122 PolarHBondContact O-N 3.33Å; F118-S122 VanDerWaalsContact O-N 3.09Å; F118-I133 HydrophobicContact CD1-CD1 4.3Å; F118-I133 HydrophobicContact CD1-CG2 4.12Å; F118-I133 HydrophobicContact CE1-CD1 4.2Å; F118-I133 HydrophobicContact CE1-CG2 4.48Å; F118-L171 HydrophobicContact CD2-CB 4.4Å; F118-L171 HydrophobicContact CE2-CB 4.06Å; F118-L171 HydrophobicContact CE2-CD2 4.21Å; F118-L171 HydrophobicContact CZ-CD2 4.38Å; F118-I172 HydrophobicContact CB-CD1 3.85Å; F118-I172 HydrophobicContact CB-CG1 3.67Å; F118-I172 HydrophobicContact CD2-CG1 3.93Å; F118-I172 HydrophobicContact CG-CG1 4.29Å; F118-T175 HydrophobicContact CE2-CG2 4.4Å; F118-F230 HydrophobicContact CE1-CB 4.29Å; F118-F230 HydrophobicContact CE1-CD1 4.24Å; F118-F230 HydrophobicContact CZ-CB 4.32Å |
| 119 | S | 85.3 | Confident | 77.4 | Confident | 2 Ų | 2 | 72.9 Ų | 72.9 | 1% | 0.014 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63.6 | -34.7 | 177 | -172.8 | 0 | 0 | 0 | 0 | 113.2 | V115 L116 L117 S122 V130 | V115-S119 WeakPolarHBondContact O-CB 3.47Å; V115-S119 PolarHBondContact O-N 2.85Å; L116-S119 CarbonylContact O-C 3.56Å; L116-S119 WeakPolarHBondContact O-CB 3.4Å; L116-S119 PolarHBondContact O-N 2.83Å; L117-S119 VanDerWaalsContact C-N 3.29Å; L117-S119 PolarHBondContact O-N 3.33Å; S119-S122 WeakPolarHBondContact O-CB 3.22Å; S119-S122 PolarHBondContact O-N 2.85Å; S119-V130 VanDerWaalsContact OG-CA 3.26Å; S119-V130 WeakPolarHBondContact OG-CA 3.42Å; S119-V130 VanDerWaalsContact OG-CB 3.29Å; S119-V130 WeakPolarHBondContact OG-CB 3.06Å; S119-V130 VanDerWaalsContact OG-CG1 3.24Å; S119-V130 WeakPolarHBondContact OG-CG1 3.22Å; S119-V130 WeakPolarHBondContact OG-CG2 3.38Å |
| 120 | M | 80.3 | Confident | 77.7 | Confident | 96 Ų | 96 | 68 Ų | 68 | 47% | 0.473 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -70.7 | -34.9 | 173.5 | -77.9 | -68 | 163.6 | 0 | 0 | 111.5 | L116 L117 F118 S122 I123 | L116-M120 HydrophobicContact CD2-CG 4.05Å; L116-M120 WeakPolarHBondContact O-CG 3.43Å; L116-M120 PolarHBondContact O-N 3.45Å; L117-M120 PolarHBondContact O-N 3.43Å; F118-M120 VanDerWaalsContact C-N 3.3Å; F118-M120 PolarHBondContact O-N 2.69Å; M120-S122 PolarHBondContact O-N 3.25Å; M120-I123 HydrophobicContact CB-CD1 4.31Å; M120-I123 WeakPolarHBondContact O-CB 3.36Å; M120-I123 WeakPolarHBondContact O-CD1 3.45Å; M120-I123 WeakPolarHBondContact O-CG1 3.39Å; M120-I123 PolarHBondContact O-N 3.23Å; M120-I123 HydrophobicContact SD-CD1 3.59Å; M120-I123 VanDerWaalsContact SD-CD1 3.59Å; M120-I123 HydrophobicContact SD-CG1 4.33Å |
| 121 | I | 79.3 | Confident | 78.1 | Confident | 61 Ų | 61 | 71.3 Ų | 71.3 | 31% | 0.313 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -70.5 | -24.7 | 176 | -69.2 | 158.8 | 0 | 0 | 0 | 111.6 | L117 F118 I123 I172 Y234 | L117-I121 WeakPolarHBondContact O-CG1 3.3Å; L117-I121 PolarHBondContact O-N 3.21Å; F118-I121 PolarHBondContact O-N 3.46Å; F118-I121 VanDerWaalsContact O-N 3.16Å; I121-I123 PolarHBondContact O-N 2.84Å; I121-I172 HydrophobicContact CD1-CB 4.44Å; I121-I172 HydrophobicContact CD1-CG2 3.62Å; I121-Y234 HydrophobicContact CG2-CE2 4.3Å |
| 122 | S | 75.4 | Confident | 78.4 | Confident | 13 Ų | 13 | 77.4 Ų | 77.4 | 9% | 0.091 | 38% | 0.382 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.7 | 7.1 | 172.6 | -155.3 | 0 | 0 | 0 | 0 | 114.2 | F118 S119 M120 Y124 | F118-S122 PolarHBondContact O-N 3.33Å; F118-S122 VanDerWaalsContact O-N 3.09Å; S119-S122 WeakPolarHBondContact O-CB 3.22Å; S119-S122 PolarHBondContact O-N 2.85Å; M120-S122 PolarHBondContact O-N 3.25Å; S122-Y124 PolarHBondContact O-N 3.45Å |
| 123 | I | 57.1 | Low | 78.6 | Confident | 116 Ų | 116 | 75.4 Ų | 75.4 | 60% | 0.595 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.5 | -2.6 | -168.9 | -97.5 | 171.6 | 0 | 0 | 0 | 117.4 | M120 I121 G125 | M120-I123 HydrophobicContact CB-CD1 4.31Å; M120-I123 WeakPolarHBondContact O-CB 3.36Å; M120-I123 WeakPolarHBondContact O-CD1 3.45Å; M120-I123 WeakPolarHBondContact O-CG1 3.39Å; M120-I123 PolarHBondContact O-N 3.23Å; M120-I123 HydrophobicContact SD-CD1 3.59Å; M120-I123 VanDerWaalsContact SD-CD1 3.59Å; M120-I123 HydrophobicContact SD-CG1 4.33Å; I121-I123 PolarHBondContact O-N 2.84Å; I123-G125 PolarHBondContact O-N 3.34Å; I123-G125 VanDerWaalsContact O-N 3.13Å |
| 124 | Y | 58 | Low | 78.9 | Confident | 209 Ų | 209 | 75.5 Ų | 75.5 | 82% | 0.82 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | 8.2 | 175.3 | -80 | -79.5 | 0 | 0 | 0 | 115.5 | S122 | S122-Y124 PolarHBondContact O-N 3.45Š|
| 125 | G | 55.2 | Low | 79.1 | Confident | 33 Ų | 33 | 78.3 Ų | 78.3 | 34% | 0.34 | 38% | 0.382 | S | S | . | . | S | Bend | trans | -176.9 | 103.3 | 167.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | I123 V129 | I123-G125 PolarHBondContact O-N 3.34Å; I123-G125 VanDerWaalsContact O-N 3.13Å; G125-V129 WeakPolarHBondContact O-CG2 3.21Å |
| 126 | Q | 62.8 | Low | 79.3 | Confident | 150 Ų | 150 | 79.5 Ų | 79.5 | 70% | 0.701 | 39% | 0.388 | S | S | * | . | trans | 76.8 | 131.8 | 154.9 | -51.3 | 172.8 | -2.8 | 0 | 0 | 117.8 | R128 V129 | Q126-R128 HydrophobicContact CB-CB 4.24Å; Q126-R128 PolarHBondContact O-N 3.07Å; Q126-V129 PolarHBondContact O-N 3.49Å | ||
| 127 | F | 69.8 | Low | 79.5 | Confident | 195 Ų | 195 | 75.7 Ų | 75.7 | 86% | 0.855 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -50.9 | -22.2 | 168.6 | -69.6 | -72.4 | 0 | 0 | 0 | 113.9 | V129 V130 S131 | F127-V129 VanDerWaalsContact C-N 3.33Å; F127-V129 PolarHBondContact O-N 3.41Å; F127-V130 PolarHBondContact O-N 2.89Å; F127-S131 PolarHBondContact O-N 2.95Å |
| 128 | R | 76.9 | Confident | 79.8 | Confident | 183 Ų | 183 | 74.8 Ų | 74.8 | 69% | 0.691 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -61 | -39.4 | 175.8 | -161 | 178.7 | -128.6 | -149.7 | 1.4 | 112.2 | Q126 S131 W132 | Q126-R128 HydrophobicContact CB-CB 4.24Å; Q126-R128 PolarHBondContact O-N 3.07Å; R128-S131 PolarHBondContact O-N 3.06Å; R128-W132 VanDerWaalsContact O-CD1 3.24Å; R128-W132 PolarHBondContact O-N 3.02Å |
| 129 | V | 82.8 | Confident | 80.2 | Confident | 33 Ų | 33 | 81.1 Ų | 81.1 | 20% | 0.2 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -69.8 | -37.1 | -177.8 | -179.7 | 0 | 0 | 0 | 0 | 111 | G125 Q126 F127 S131 W132 I133 | G125-V129 WeakPolarHBondContact O-CG2 3.21Å; Q126-V129 PolarHBondContact O-N 3.49Å; F127-V129 VanDerWaalsContact C-N 3.33Å; F127-V129 PolarHBondContact O-N 3.41Å; V129-S131 PolarHBondContact O-N 3.29Å; V129-W132 WeakPolarHBondContact O-CB 3.27Å; V129-W132 PolarHBondContact O-N 3.02Å; V129-W132 VanDerWaalsContact O-N 3.15Å; V129-I133 HydrophobicContact CG1-CD1 3.94Å; V129-I133 HydrophobicContact CG1-CG1 4.3Å; V129-I133 WeakPolarHBondContact O-CG1 3.22Å; V129-I133 PolarHBondContact O-N 3.07Å |
| 130 | V | 84.6 | Confident | 80.5 | Confident | 49 Ų | 49 | 81.5 Ų | 81.5 | 30% | 0.297 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -57.4 | -48.4 | 175.6 | 176.7 | 0 | 0 | 0 | 0 | 111.5 | S119 F127 W132 I133 I134 | S119-V130 VanDerWaalsContact OG-CA 3.26Å; S119-V130 WeakPolarHBondContact OG-CA 3.42Å; S119-V130 VanDerWaalsContact OG-CB 3.29Å; S119-V130 WeakPolarHBondContact OG-CB 3.06Å; S119-V130 VanDerWaalsContact OG-CG1 3.24Å; S119-V130 WeakPolarHBondContact OG-CG1 3.22Å; S119-V130 WeakPolarHBondContact OG-CG2 3.38Å; F127-V130 PolarHBondContact O-N 2.89Å; V130-W132 VanDerWaalsContact C-N 3.3Å; V130-W132 PolarHBondContact O-N 2.6Å; V130-I133 PolarHBondContact O-N 2.82Å; V130-I134 WeakPolarHBondContact O-CG1 3.44Å; V130-I134 PolarHBondContact O-N 3.17Å; V130-I134 VanDerWaalsContact O-N 3.12Å |
| 131 | S | 86.8 | Confident | 81 | Confident | 73 Ų | 73 | 76.9 Ų | 76.9 | 51% | 0.51 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.9 | -40.1 | 177.4 | -175.7 | 0 | 0 | 0 | 0 | 111.9 | F127 R128 V129 T135 | F127-S131 PolarHBondContact O-N 2.95Å; R128-S131 PolarHBondContact O-N 3.06Å; V129-S131 PolarHBondContact O-N 3.29Å; S131-T135 WeakPolarHBondContact O-CB 3.45Å; S131-T135 PolarHBondContact O-N 3.46Å; S131-T135 PolarHBondContact O-OG1 2.92Å |
| 132 | W | 88.3 | Confident | 81.6 | Confident | 130 Ų | 130 | 77 Ų | 77 | 49% | 0.492 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.9 | -45.3 | 175.4 | -85.5 | 108.7 | 0 | 0 | 0 | 113 | R128 V129 V130 I134 T135 I136 L233 | R128-W132 VanDerWaalsContact O-CD1 3.24Å; R128-W132 PolarHBondContact O-N 3.02Å; V129-W132 WeakPolarHBondContact O-CB 3.27Å; V129-W132 PolarHBondContact O-N 3.02Å; V129-W132 VanDerWaalsContact O-N 3.15Å; V130-W132 VanDerWaalsContact C-N 3.3Å; V130-W132 PolarHBondContact O-N 2.6Å; W132-I134 VanDerWaalsContact C-N 3.33Å; W132-I134 PolarHBondContact O-N 2.6Å; W132-T135 PolarHBondContact O-N 3.44Å; W132-I136 HydrophobicContact CE3-CD1 3.88Å; W132-I136 HydrophobicContact CE3-CG1 4.39Å; W132-I136 WeakPolarHBondContact O-CB 3.07Å; W132-I136 WeakPolarHBondContact O-CD1 3.35Å; W132-I136 WeakPolarHBondContact O-CG1 2.9Å; W132-I136 PolarHBondContact O-N 3.05Å; W132-L233 HydrophobicContact CB-CD2 4.36Å |
| 133 | I | 89.7 | Confident | 82.4 | Confident | 0 Ų | 0 | 79.4 Ų | 79.4 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -57.3 | -48.2 | 178.1 | -69.1 | 167.3 | 0 | 0 | 0 | 110.3 | V115 F118 V129 V130 I136 W137 F230 L233 | V115-I133 HydrophobicContact CG1-CG2 3.88Å; F118-I133 HydrophobicContact CD1-CD1 4.3Å; F118-I133 HydrophobicContact CD1-CG2 4.12Å; F118-I133 HydrophobicContact CE1-CD1 4.2Å; F118-I133 HydrophobicContact CE1-CG2 4.48Å; V129-I133 HydrophobicContact CG1-CD1 3.94Å; V129-I133 HydrophobicContact CG1-CG1 4.3Å; V129-I133 WeakPolarHBondContact O-CG1 3.22Å; V129-I133 PolarHBondContact O-N 3.07Å; V130-I133 PolarHBondContact O-N 2.82Å; I133-I136 PolarHBondContact O-N 3.22Å; I133-W137 VanDerWaalsContact O-CB 3.28Å; I133-W137 WeakPolarHBondContact O-CB 3.48Å; I133-W137 PolarHBondContact O-N 3.42Å; I133-F230 HydrophobicContact CG2-CD1 4.34Å; I133-F230 HydrophobicContact CG2-CE1 4.04Å; I133-L233 HydrophobicContact CG1-CB 4.49Å; I133-L233 HydrophobicContact CG1-CD1 3.9Å |
| 134 | I | 89.4 | Confident | 84 | Confident | 49 Ų | 49 | 74 Ų | 74 | 25% | 0.251 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -65 | -44.3 | 179 | -64.1 | -68.7 | 0 | 0 | 0 | 111.3 | V115 V130 W132 I136 W137 I138 | V115-I134 HydrophobicContact CG1-CD1 3.67Å; V130-I134 WeakPolarHBondContact O-CG1 3.44Å; V130-I134 PolarHBondContact O-N 3.17Å; V130-I134 VanDerWaalsContact O-N 3.12Å; W132-I134 VanDerWaalsContact C-N 3.33Å; W132-I134 PolarHBondContact O-N 2.6Å; I134-I136 VanDerWaalsContact C-N 3.34Å; I134-I136 PolarHBondContact O-N 3.19Å; I134-W137 HydrophobicContact CD1-CE3 4.46Å; I134-W137 PolarHBondContact O-N 3.25Å; I134-I138 HydrophobicContact CG2-CD1 3.93Å; I134-I138 WeakPolarHBondContact O-CG1 3.32Å; I134-I138 PolarHBondContact O-N 2.88Å |
| 135 | T | 91.4 | Very high | 85.5 | Confident | 70 Ų | 70 | 66 Ų | 66 | 43% | 0.429 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60.9 | -44.6 | 179.8 | -59.2 | 0 | 0 | 0 | 0 | 111.3 | S131 W132 I138 F139 | S131-T135 WeakPolarHBondContact O-CB 3.45Å; S131-T135 PolarHBondContact O-N 3.46Å; S131-T135 PolarHBondContact O-OG1 2.92Å; W132-T135 PolarHBondContact O-N 3.44Å; T135-I138 PolarHBondContact O-N 3.32Å; T135-F139 VanDerWaalsContact O-CB 3.25Å; T135-F139 WeakPolarHBondContact O-CB 3.01Å; T135-F139 PolarHBondContact O-N 3.18Å |
| 136 | I | 91.6 | Very high | 87.2 | Confident | 26 Ų | 26 | 69 Ų | 69 | 13% | 0.133 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -71.1 | -35 | 179 | -74 | 155.2 | 0 | 0 | 0 | 111.5 | W132 I133 I134 G140 L226 Y229 F230 L233 | W132-I136 HydrophobicContact CE3-CD1 3.88Å; W132-I136 HydrophobicContact CE3-CG1 4.39Å; W132-I136 WeakPolarHBondContact O-CB 3.07Å; W132-I136 WeakPolarHBondContact O-CD1 3.35Å; W132-I136 WeakPolarHBondContact O-CG1 2.9Å; W132-I136 PolarHBondContact O-N 3.05Å; I133-I136 PolarHBondContact O-N 3.22Å; I134-I136 VanDerWaalsContact C-N 3.34Å; I134-I136 PolarHBondContact O-N 3.19Å; I136-G140 WeakPolarHBondContact O-CA 3.17Å; I136-G140 PolarHBondContact O-N 3.21Å; I136-L226 HydrophobicContact CG2-CD1 4.39Å; I136-Y229 HydrophobicContact CD1-CD1 3.6Å; I136-Y229 HydrophobicContact CD1-CE1 3.07Å; I136-Y229 HydrophobicContact CG1-CE1 4.26Å; I136-Y229 HydrophobicContact CG2-CD1 4.24Å; I136-F230 HydrophobicContact CG2-CE1 4.31Å; I136-F230 HydrophobicContact CG2-CZ 4.33Å; I136-L233 HydrophobicContact CD1-CD1 3.72Å |
| 137 | W | 92.3 | Very high | 88.5 | Confident | 3 Ų | 3 | 64.5 Ų | 64.5 | 1% | 0.011 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.1 | -48 | 173.1 | 174.6 | 56.9 | 0 | 0 | 0 | 111.7 | F108 P111 L112 V115 I133 I134 S141 L161 F230 | F108-W137 HydrophobicContact CE2-CH2 4.46Å; P111-W137 HydrophobicContact CB-CZ2 3.93Å; L112-W137 HydrophobicContact CB-CH2 4.16Å; V115-W137 HydrophobicContact CB-CD2 4.44Å; V115-W137 HydrophobicContact CG1-CB 4.35Å; V115-W137 HydrophobicContact CG1-CD2 4.25Å; V115-W137 HydrophobicContact CG1-CE3 4.31Å; V115-W137 HydrophobicContact CG1-CG 4.27Å; V115-W137 HydrophobicContact CG2-CD2 3.7Å; V115-W137 HydrophobicContact CG2-CE3 4.24Å; V115-W137 HydrophobicContact CG2-CG 3.92Å; V115-W137 HydrophobicContact CG2-CZ2 4.11Å; I133-W137 VanDerWaalsContact O-CB 3.28Å; I133-W137 WeakPolarHBondContact O-CB 3.48Å; I133-W137 PolarHBondContact O-N 3.42Å; I134-W137 HydrophobicContact CD1-CE3 4.46Å; I134-W137 PolarHBondContact O-N 3.25Å; W137-S141 WeakPolarHBondContact O-CB 3.14Å; W137-S141 PolarHBondContact O-N 2.87Å; W137-S141 PolarHBondContact O-OG 3.32Å; W137-L161 HydrophobicContact CD2-CD1 3.97Å; W137-L161 HydrophobicContact CE3-CD1 4.36Å; W137-L161 HydrophobicContact CH2-CD1 4.04Å; W137-L161 HydrophobicContact CH2-CD2 4.14Å; W137-L161 HydrophobicContact CH2-CG 4Å; W137-L161 HydrophobicContact CZ2-CD1 3.6Å; W137-L161 HydrophobicContact CZ2-CD2 4.16Å; W137-L161 HydrophobicContact CZ2-CG 3.52Å; W137-L161 HydrophobicContact CZ3-CD1 4.39Å; W137-L161 PolarHBondContact NE1-O 2.99Å; W137-F230 HydrophobicContact CB-CE1 4.32Å; W137-F230 HydrophobicContact CB-CZ 3.91Å |
| 138 | I | 92.3 | Very high | 89.2 | Confident | 78 Ų | 78 | 55.5 Ų | 55.5 | 40% | 0.4 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -66.9 | -53.3 | 177.6 | -65.5 | 173.7 | 0 | 0 | 0 | 110.9 | I134 T135 S141 L142 Y157 | I134-I138 HydrophobicContact CG2-CD1 3.93Å; I134-I138 WeakPolarHBondContact O-CG1 3.32Å; I134-I138 PolarHBondContact O-N 2.88Å; T135-I138 PolarHBondContact O-N 3.32Å; I138-S141 PolarHBondContact O-OG 3.49Å; I138-L142 WeakPolarHBondContact O-CB 3.34Å; I138-L142 PolarHBondContact O-N 3.24Å; I138-Y157 PolarHBondContact O-OH 3.39Å |
| 139 | F | 94 | Very high | 89.7 | Confident | 134 Ų | 134 | 53.5 Ų | 53.5 | 59% | 0.588 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -73.2 | -36.2 | -174.2 | -169.3 | -96.1 | 0 | 0 | 0 | 113 | T135 L142 T143 | T135-F139 VanDerWaalsContact O-CB 3.25Å; T135-F139 WeakPolarHBondContact O-CB 3.01Å; T135-F139 PolarHBondContact O-N 3.18Å; F139-L142 HydrophobicContact CD2-CD2 4.5Å; F139-L142 WeakPolarHBondContact O-CB 3.48Å; F139-L142 PolarHBondContact O-N 3.4Å; F139-T143 PolarHBondContact O-N 3.24Å; F139-T143 PolarHBondContact O-OG1 3.3Å |
| 140 | G | 92.1 | Very high | 89.8 | Confident | 10 Ų | 10 | 57.7 Ų | 57.7 | 10% | 0.103 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -70.1 | -39.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | I136 L142 T143 I144 | I136-G140 WeakPolarHBondContact O-CA 3.17Å; I136-G140 PolarHBondContact O-N 3.21Å; G140-L142 VanDerWaalsContact C-N 3.33Å; G140-T143 WeakPolarHBondContact O-CB 3.1Å; G140-T143 PolarHBondContact O-N 3.36Å; G140-I144 WeakPolarHBondContact O-CG1 3.32Å; G140-I144 PolarHBondContact O-N 3.13Å |
| 141 | S | 90.5 | Very high | 89.7 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.5 | -36.3 | 170.8 | 65.7 | 0 | 0 | 0 | 0 | 112.2 | W137 I138 T143 I144 F145 Y157 V160 L161 | W137-S141 WeakPolarHBondContact O-CB 3.14Å; W137-S141 PolarHBondContact O-N 2.87Å; W137-S141 PolarHBondContact O-OG 3.32Å; I138-S141 PolarHBondContact O-OG 3.49Å; S141-T143 VanDerWaalsContact C-N 3.34Å; S141-T143 PolarHBondContact O-N 2.67Å; S141-I144 PolarHBondContact O-N 2.84Å; S141-F145 VanDerWaalsContact O-CB 3.28Å; S141-F145 WeakPolarHBondContact O-CB 3.45Å; S141-F145 PolarHBondContact O-N 2.7Å; S141-Y157 PolarHBondContact OG-OH 2.89Å; S141-V160 WeakPolarHBondContact O-CG1 3.11Å; S141-L161 WeakPolarHBondContact OG-CD1 3.42Å |
| 142 | L | 92.9 | Very high | 89.2 | Confident | 62 Ų | 62 | 56.6 Ų | 56.6 | 33% | 0.325 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.5 | -42.8 | 173.3 | 179.2 | 66.9 | 0 | 0 | 0 | 111.2 | I138 F139 G140 I144 F145 L146 Y157 | I138-L142 WeakPolarHBondContact O-CB 3.34Å; I138-L142 PolarHBondContact O-N 3.24Å; F139-L142 HydrophobicContact CD2-CD2 4.5Å; F139-L142 WeakPolarHBondContact O-CB 3.48Å; F139-L142 PolarHBondContact O-N 3.4Å; G140-L142 VanDerWaalsContact C-N 3.33Å; L142-I144 PolarHBondContact O-N 2.89Å; L142-F145 HydrophobicContact CD1-CD1 4.19Å; L142-F145 WeakPolarHBondContact O-CB 3.43Å; L142-F145 PolarHBondContact O-N 3.43Å; L142-L146 HydrophobicContact CG-CD1 4.45Å; L142-L146 WeakPolarHBondContact O-CG 3.37Å; L142-L146 PolarHBondContact O-N 3.38Å; L142-Y157 HydrophobicContact CB-CE2 3.92Å; L142-Y157 HydrophobicContact CD1-CD2 4.34Å; L142-Y157 HydrophobicContact CD1-CE2 4.17Å |
| 143 | T | 92.3 | Very high | 88.6 | Confident | 65 Ų | 65 | 50.4 Ų | 50.4 | 40% | 0.399 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -61.8 | -45.1 | 177.1 | -58.8 | 0 | 0 | 0 | 0 | 111.1 | F139 G140 S141 F145 L146 L147 | F139-T143 PolarHBondContact O-N 3.24Å; F139-T143 PolarHBondContact O-OG1 3.3Å; G140-T143 WeakPolarHBondContact O-CB 3.1Å; G140-T143 PolarHBondContact O-N 3.36Å; S141-T143 VanDerWaalsContact C-N 3.34Å; S141-T143 PolarHBondContact O-N 2.67Å; T143-F145 VanDerWaalsContact C-N 3.34Å; T143-L146 PolarHBondContact O-N 3.06Å; T143-L147 WeakPolarHBondContact O-CB 3.42Å; T143-L147 PolarHBondContact O-N 2.87Å |
| 144 | I | 90.1 | Very high | 88.1 | Confident | 3 Ų | 3 | 57.8 Ų | 57.8 | 2% | 0.015 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.8 | -38.9 | 177.1 | -67.7 | 161.5 | 0 | 0 | 0 | 110.9 | G140 S141 L142 L147 A148 V160 I164 L207 L219 P222 I223 L226 | G140-I144 WeakPolarHBondContact O-CG1 3.32Å; G140-I144 PolarHBondContact O-N 3.13Å; S141-I144 PolarHBondContact O-N 2.84Å; L142-I144 PolarHBondContact O-N 2.89Å; I144-L147 PolarHBondContact O-N 3.3Å; I144-A148 WeakPolarHBondContact O-CB 3.4Å; I144-A148 PolarHBondContact O-N 3.24Å; I144-V160 HydrophobicContact CB-CG1 4.13Å; I144-V160 HydrophobicContact CG2-CG1 3.86Å; I144-I164 HydrophobicContact CB-CD1 4.23Å; I144-I164 HydrophobicContact CD1-CD1 3.52Å; I144-I164 HydrophobicContact CD1-CG1 4.44Å; I144-I164 HydrophobicContact CG1-CD1 4.47Å; I144-I164 HydrophobicContact CG2-CD1 4.36Å; I144-L207 HydrophobicContact CG2-CD1 4.09Å; I144-L219 HydrophobicContact CG2-CD2 3.95Å; I144-P222 HydrophobicContact CG1-CB 4.47Å; I144-I223 HydrophobicContact CD1-CG1 4.01Å; I144-I223 HydrophobicContact CG1-CG1 4.4Å; I144-I223 HydrophobicContact CG2-CG1 4.17Å; I144-L226 HydrophobicContact CD1-CB 4.45Å; I144-L226 HydrophobicContact CD1-CD1 4.28Å; I144-L226 HydrophobicContact CD1-CD2 4.12Å |
| 145 | F | 90.4 | Very high | 87.6 | Confident | 41 Ų | 41 | 56.1 Ų | 56.1 | 18% | 0.18 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.3 | -48 | 175.2 | 165.1 | -100.3 | 0 | 0 | 0 | 112.1 | S141 L142 T143 L147 A148 R149 V155 Y157 V160 | S141-F145 VanDerWaalsContact O-CB 3.28Å; S141-F145 WeakPolarHBondContact O-CB 3.45Å; S141-F145 PolarHBondContact O-N 2.7Å; L142-F145 HydrophobicContact CD1-CD1 4.19Å; L142-F145 WeakPolarHBondContact O-CB 3.43Å; L142-F145 PolarHBondContact O-N 3.43Å; T143-F145 VanDerWaalsContact C-N 3.34Å; F145-L147 VanDerWaalsContact C-N 3.28Å; F145-L147 PolarHBondContact O-N 3.43Å; F145-A148 WeakPolarHBondContact O-CB 3.25Å; F145-A148 PolarHBondContact O-N 2.89Å; F145-R149 WeakPolarHBondContact O-CB 3.34Å; F145-R149 PolarHBondContact O-N 2.97Å; F145-V155 VanDerWaalsContact CE2-O 3.28Å; F145-V155 WeakPolarHBondContact CE2-O 3.14Å; F145-Y157 HydrophobicContact CB-CD2 3.93Å; F145-Y157 HydrophobicContact CD1-CD2 4.22Å; F145-Y157 AromaticContact CG-CD2 3.96Å; F145-Y157 HydrophobicContact CG-CD2 3.96Å; F145-V160 HydrophobicContact CB-CB 4.22Å; F145-V160 HydrophobicContact CB-CG1 4.18Å; F145-V160 HydrophobicContact CB-CG2 4.12Å; F145-V160 HydrophobicContact CD2-CG2 4.2Å |
| 146 | L | 90.5 | Very high | 87.2 | Confident | 96 Ų | 96 | 55.8 Ų | 55.8 | 50% | 0.503 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.4 | -41.9 | 176.4 | -70.8 | 177.6 | 0 | 0 | 0 | 111 | L142 T143 R149 V150 | L142-L146 HydrophobicContact CG-CD1 4.45Å; L142-L146 WeakPolarHBondContact O-CG 3.37Å; L142-L146 PolarHBondContact O-N 3.38Å; T143-L146 PolarHBondContact O-N 3.06Å; L146-R149 PolarHBondContact O-N 2.92Å; L146-V150 VanDerWaalsContact O-CG2 3.29Å; L146-V150 WeakPolarHBondContact O-CG2 3.37Å; L146-V150 PolarHBondContact O-N 2.82Å |
| 147 | L | 89.1 | Confident | 87 | Confident | 55 Ų | 55 | 57.8 Ų | 57.8 | 29% | 0.288 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.8 | -44.4 | 177.1 | -168.4 | 66.9 | 0 | 0 | 0 | 111.6 | T143 I144 F145 R149 V150 L151 P222 | T143-L147 WeakPolarHBondContact O-CB 3.42Å; T143-L147 PolarHBondContact O-N 2.87Å; I144-L147 PolarHBondContact O-N 3.3Å; F145-L147 VanDerWaalsContact C-N 3.28Å; F145-L147 PolarHBondContact O-N 3.43Å; L147-R149 VanDerWaalsContact C-N 3.27Å; L147-R149 PolarHBondContact O-N 2.91Å; L147-V150 PolarHBondContact O-N 2.84Å; L147-L151 HydrophobicContact CD1-CD1 4.05Å; L147-L151 HydrophobicContact CG-CD1 4.2Å; L147-L151 WeakPolarHBondContact O-CB 3.45Å; L147-L151 VanDerWaalsContact O-CD1 3.27Å; L147-L151 WeakPolarHBondContact O-CD1 2.95Å; L147-L151 PolarHBondContact O-N 2.73Å; L147-P222 HydrophobicContact CD2-CG 3.5Å; L147-P222 VanDerWaalsContact CD2-CG 3.5Å |
| 148 | A | 85.5 | Confident | 86.5 | Confident | 5 Ų | 5 | 58.8 Ų | 58.8 | 4% | 0.041 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -58.2 | -41.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | I144 F145 L151 G152 G153 V155 L219 | I144-A148 WeakPolarHBondContact O-CB 3.4Å; I144-A148 PolarHBondContact O-N 3.24Å; F145-A148 WeakPolarHBondContact O-CB 3.25Å; F145-A148 PolarHBondContact O-N 2.89Å; A148-L151 PolarHBondContact O-N 2.73Å; A148-G152 PolarHBondContact O-N 3.18Å; A148-G153 WeakPolarHBondContact O-CA 3.39Å; A148-G153 PolarHBondContact O-N 3.35Å; A148-V155 HydrophobicContact CB-CG2 3.64Å; A148-L219 HydrophobicContact CB-CD1 3.83Å |
| 149 | R | 86.5 | Confident | 86 | Confident | 142 Ų | 142 | 56.3 Ų | 56.3 | 54% | 0.536 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -67.5 | -42.6 | 179 | -165.7 | 64.6 | 175.7 | 142.5 | -0.7 | 112.5 | F145 L146 L147 L151 G152 G153 | F145-R149 WeakPolarHBondContact O-CB 3.34Å; F145-R149 PolarHBondContact O-N 2.97Å; L146-R149 PolarHBondContact O-N 2.92Å; L147-R149 VanDerWaalsContact C-N 3.27Å; L147-R149 PolarHBondContact O-N 2.91Å; R149-L151 PolarHBondContact O-N 3.31Å; R149-G152 PolarHBondContact O-N 3.45Å; R149-G153 WeakPolarHBondContact CD-O 3.39Å; R149-G153 PolarHBondContact NH1-O 2.76Å; R149-G153 VanDerWaalsContact NH1-O 3.08Å |
| 150 | V | 86.8 | Confident | 85.6 | Confident | 120 Ų | 120 | 50 Ų | 50 | 73% | 0.727 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -63.3 | -33.3 | 175.1 | 169.1 | 0 | 0 | 0 | 0 | 111.5 | L146 L147 G152 | L146-V150 VanDerWaalsContact O-CG2 3.29Å; L146-V150 WeakPolarHBondContact O-CG2 3.37Å; L146-V150 PolarHBondContact O-N 2.82Å; L147-V150 PolarHBondContact O-N 2.84Å; V150-G152 PolarHBondContact O-N 3.17Å |
| 151 | L | 82.4 | Confident | 85.4 | Confident | 43 Ų | 43 | 50 Ų | 50 | 23% | 0.225 | 28% | 0.275 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -0.6 | 174.6 | -92.9 | 59.9 | 0 | 0 | 0 | 113.4 | L147 A148 R149 L218 L219 | L147-L151 HydrophobicContact CD1-CD1 4.05Å; L147-L151 HydrophobicContact CG-CD1 4.2Å; L147-L151 WeakPolarHBondContact O-CB 3.45Å; L147-L151 VanDerWaalsContact O-CD1 3.27Å; L147-L151 WeakPolarHBondContact O-CD1 2.95Å; L147-L151 PolarHBondContact O-N 2.73Å; A148-L151 PolarHBondContact O-N 2.73Å; R149-L151 PolarHBondContact O-N 3.31Å; L151-L218 HydrophobicContact CD1-CD2 4.48Å; L151-L218 HydrophobicContact CD2-CB 4.18Å; L151-L219 HydrophobicContact CD2-CB 4.27Å; L151-L219 HydrophobicContact CD2-CD1 4.37Å |
| 152 | G | 76.1 | Confident | 85.1 | Confident | 56 Ų | 56 | 50.2 Ų | 50.2 | 58% | 0.577 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 88.4 | 18.5 | -180 | 0 | 0 | 0 | 0 | 0 | 113.8 | A148 R149 V150 | A148-G152 PolarHBondContact O-N 3.18Å; R149-G152 PolarHBondContact O-N 3.45Å; V150-G152 PolarHBondContact O-N 3.17Å |
| 153 | G | 75.9 | Confident | 84.7 | Confident | 1 Ų | 1 | 47.5 Ų | 47.5 | 1% | 0.01 | 26% | 0.264 | C | S | . | . | trans | -77.7 | 138.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | A148 R149 V155 | A148-G153 WeakPolarHBondContact O-CA 3.39Å; A148-G153 PolarHBondContact O-N 3.35Å; R149-G153 WeakPolarHBondContact CD-O 3.39Å; R149-G153 PolarHBondContact NH1-O 2.76Å; R149-G153 VanDerWaalsContact NH1-O 3.08Å; G153-V155 VanDerWaalsContact C-N 3.33Å; G153-V155 PolarHBondContact O-N 3.42Å | ||
| 154 | E | 78.5 | Confident | 84.5 | Confident | 154 Ų | 154 | 44.4 Ų | 44.4 | 72% | 0.72 | 25% | 0.245 | S | C | * | . | trans | -96.7 | 60.2 | 170 | -61.6 | -169.1 | 153.1 | 0 | 0 | 109.7 | ||||
| 155 | V | 77.7 | Confident | 84.4 | Confident | 14 Ų | 14 | 44.3 Ų | 44.3 | 9% | 0.085 | 24% | 0.244 | C | C | . | . | trans | -109.5 | 140.4 | 174.1 | -65.6 | 0 | 0 | 0 | 0 | 109.6 | F145 A148 G153 V160 | F145-V155 VanDerWaalsContact CE2-O 3.28Å; F145-V155 WeakPolarHBondContact CE2-O 3.14Å; A148-V155 HydrophobicContact CB-CG2 3.64Å; G153-V155 VanDerWaalsContact C-N 3.33Å; G153-V155 PolarHBondContact O-N 3.42Å; V155-V160 HydrophobicContact CB-CG2 4.32Å; V155-V160 HydrophobicContact CG2-CG2 3.94Å | ||
| 156 | S | 84.7 | Confident | 84.1 | Confident | 64 Ų | 64 | 42.5 Ų | 42.5 | 45% | 0.448 | 24% | 0.236 | S | C | . | . | trans | -85 | 151.9 | 173.6 | 172 | 0 | 0 | 0 | 0 | 110.8 | G158 Q159 V160 | S156-G158 VanDerWaalsContact C-N 3.3Å; S156-G158 PolarHBondContact O-N 3.36Å; S156-Q159 WeakPolarHBondContact O-CB 3.29Å; S156-Q159 PolarHBondContact O-N 2.91Å; S156-Q159 VanDerWaalsContact O-N 3.13Å; S156-V160 PolarHBondContact O-N 3.26Å | ||
| 157 | Y | 85.8 | Confident | 83.8 | Confident | 67 Ų | 67 | 38 Ų | 38 | 26% | 0.263 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -59.8 | -40.1 | 179.5 | 175.6 | -116.2 | 0 | 0 | 0 | 112.3 | I138 S141 L142 F145 Q159 V160 L161 | I138-Y157 PolarHBondContact O-OH 3.39Å; S141-Y157 PolarHBondContact OG-OH 2.89Å; L142-Y157 HydrophobicContact CB-CE2 3.92Å; L142-Y157 HydrophobicContact CD1-CD2 4.34Å; L142-Y157 HydrophobicContact CD1-CE2 4.17Å; F145-Y157 HydrophobicContact CB-CD2 3.93Å; F145-Y157 HydrophobicContact CD1-CD2 4.22Å; F145-Y157 AromaticContact CG-CD2 3.96Å; F145-Y157 HydrophobicContact CG-CD2 3.96Å; Y157-Q159 PolarHBondContact O-N 3.29Å; Y157-V160 PolarHBondContact O-N 3.41Å; Y157-V160 VanDerWaalsContact O-N 3.17Å; Y157-L161 HydrophobicContact CE1-CD2 4.29Å; Y157-L161 VanDerWaalsContact O-CB 3.3Å; Y157-L161 WeakPolarHBondContact O-CB 3.24Å; Y157-L161 PolarHBondContact O-N 3.31Å |
| 158 | G | 83.3 | Confident | 83.7 | Confident | 24 Ų | 24 | 35.3 Ų | 35.3 | 25% | 0.247 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.8 | -33.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S156 G162 | S156-G158 VanDerWaalsContact C-N 3.3Å; S156-G158 PolarHBondContact O-N 3.36Å; G158-G162 PolarHBondContact O-N 3.22Å |
| 159 | Q | 80.9 | Confident | 83.6 | Confident | 26 Ų | 26 | 36.3 Ų | 36.3 | 12% | 0.121 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -68.3 | -45.7 | 176.2 | -56.2 | 175.3 | -29.1 | 0 | 0 | 110.8 | R103 P106 S156 Y157 G162 V163 | R103-Q159 HydrophobicContact CG-CB 4.32Å; R103-Q159 HydrophobicContact CG-CG 4.11Å; R103-Q159 WeakPolarHBondContact O-CG 3.26Å; R103-Q159 PolarHBondContact O-NE2 3.04Å; P106-Q159 HydrophobicContact CB-CG 4.42Å; S156-Q159 WeakPolarHBondContact O-CB 3.29Å; S156-Q159 PolarHBondContact O-N 2.91Å; S156-Q159 VanDerWaalsContact O-N 3.13Å; Y157-Q159 PolarHBondContact O-N 3.29Å; Q159-G162 PolarHBondContact O-N 2.82Å; Q159-V163 WeakPolarHBondContact O-CB 3.45Å; Q159-V163 WeakPolarHBondContact O-CG2 3.37Å; Q159-V163 PolarHBondContact O-N 3.23Å |
| 160 | V | 85.9 | Confident | 83.5 | Confident | 1 Ų | 1 | 29.9 Ų | 29.9 | 1% | 0.006 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64 | -48 | 178.5 | -179.9 | 0 | 0 | 0 | 0 | 110.8 | S141 I144 F145 V155 S156 Y157 G162 I164 L207 | S141-V160 WeakPolarHBondContact O-CG1 3.11Å; I144-V160 HydrophobicContact CB-CG1 4.13Å; I144-V160 HydrophobicContact CG2-CG1 3.86Å; F145-V160 HydrophobicContact CB-CB 4.22Å; F145-V160 HydrophobicContact CB-CG1 4.18Å; F145-V160 HydrophobicContact CB-CG2 4.12Å; F145-V160 HydrophobicContact CD2-CG2 4.2Å; V155-V160 HydrophobicContact CB-CG2 4.32Å; V155-V160 HydrophobicContact CG2-CG2 3.94Å; S156-V160 PolarHBondContact O-N 3.26Å; Y157-V160 PolarHBondContact O-N 3.41Å; Y157-V160 VanDerWaalsContact O-N 3.17Å; V160-G162 VanDerWaalsContact C-N 3.33Å; V160-G162 PolarHBondContact O-N 2.95Å; V160-I164 HydrophobicContact CG1-CD1 3.61Å; V160-I164 HydrophobicContact CG1-CG1 4.48Å; V160-I164 WeakPolarHBondContact O-CB 3.36Å; V160-I164 WeakPolarHBondContact O-CD1 2.89Å; V160-I164 WeakPolarHBondContact O-CG1 3.3Å; V160-I164 PolarHBondContact O-N 3.41Å; V160-L207 HydrophobicContact CB-CD2 4.4Å; V160-L207 HydrophobicContact CG1-CD1 4.37Å; V160-L207 HydrophobicContact CG2-CD2 4.07Å |
| 161 | L | 88.4 | Confident | 83.4 | Confident | 10 Ų | 10 | 24.4 Ų | 24.4 | 5% | 0.052 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -58.3 | -46 | 177.2 | -174.8 | 73.1 | 0 | 0 | 0 | 111.5 | F108 W137 S141 Y157 G165 | F108-L161 HydrophobicContact CD2-CD2 3.92Å; F108-L161 HydrophobicContact CE2-CD2 3.82Å; W137-L161 HydrophobicContact CD2-CD1 3.97Å; W137-L161 HydrophobicContact CE3-CD1 4.36Å; W137-L161 HydrophobicContact CH2-CD1 4.04Å; W137-L161 HydrophobicContact CH2-CD2 4.14Å; W137-L161 HydrophobicContact CH2-CG 4Å; W137-L161 HydrophobicContact CZ2-CD1 3.6Å; W137-L161 HydrophobicContact CZ2-CD2 4.16Å; W137-L161 HydrophobicContact CZ2-CG 3.52Å; W137-L161 HydrophobicContact CZ3-CD1 4.39Å; W137-L161 PolarHBondContact NE1-O 2.99Å; S141-L161 WeakPolarHBondContact OG-CD1 3.42Å; Y157-L161 HydrophobicContact CE1-CD2 4.29Å; Y157-L161 VanDerWaalsContact O-CB 3.3Å; Y157-L161 WeakPolarHBondContact O-CB 3.24Å; Y157-L161 PolarHBondContact O-N 3.31Å; L161-G165 PolarHBondContact O-N 3.19Å |
| 162 | G | 84.3 | Confident | 83.6 | Confident | 6 Ų | 6 | 23.5 Ų | 23.5 | 6% | 0.062 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -67.9 | -49.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | G158 Q159 V160 I164 G165 Y166 | G158-G162 PolarHBondContact O-N 3.22Å; Q159-G162 PolarHBondContact O-N 2.82Å; V160-G162 VanDerWaalsContact C-N 3.33Å; V160-G162 PolarHBondContact O-N 2.95Å; G162-I164 VanDerWaalsContact C-N 3.3Å; G162-I164 PolarHBondContact O-N 3.42Å; G162-G165 PolarHBondContact O-N 3.28Å; G162-G165 VanDerWaalsContact O-N 3.16Å; G162-Y166 WeakPolarHBondContact O-CD2 3.39Å; G162-Y166 PolarHBondContact O-N 3Å |
| 163 | V | 83.1 | Confident | 84 | Confident | 5 Ų | 5 | 24.6 Ų | 24.6 | 3% | 0.03 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -58.8 | -43.4 | 178 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | V102 Q159 S167 L206 L207 | V102-V163 HydrophobicContact CG1-CG2 4.29Å; Q159-V163 WeakPolarHBondContact O-CB 3.45Å; Q159-V163 WeakPolarHBondContact O-CG2 3.37Å; Q159-V163 PolarHBondContact O-N 3.23Å; V163-S167 WeakPolarHBondContact O-CB 3.11Å; V163-S167 PolarHBondContact O-N 3.47Å; V163-S167 VanDerWaalsContact O-N 3.13Å; V163-S167 PolarHBondContact O-OG 3.17Å; V163-L206 HydrophobicContact CG1-CB 3.52Å; V163-L206 HydrophobicContact CG1-CD1 4.07Å; V163-L206 HydrophobicContact CG1-CG 4.45Å; V163-L206 HydrophobicContact CG2-CB 4.3Å; V163-L207 HydrophobicContact CB-CD2 3.97Å; V163-L207 HydrophobicContact CB-CG 4.18Å; V163-L207 HydrophobicContact CG1-CD1 4.37Å; V163-L207 HydrophobicContact CG1-CD2 4.07Å; V163-L207 HydrophobicContact CG1-CG 3.74Å; V163-L207 HydrophobicContact CG2-CD2 4.2Å |
| 164 | I | 88.7 | Confident | 84.4 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.6 | -43.3 | 178 | -70.5 | 168 | 0 | 0 | 0 | 111.1 | I144 V160 G162 S167 L207 L226 Y227 | I144-I164 HydrophobicContact CB-CD1 4.23Å; I144-I164 HydrophobicContact CD1-CD1 3.52Å; I144-I164 HydrophobicContact CD1-CG1 4.44Å; I144-I164 HydrophobicContact CG1-CD1 4.47Å; I144-I164 HydrophobicContact CG2-CD1 4.36Å; V160-I164 HydrophobicContact CG1-CD1 3.61Å; V160-I164 HydrophobicContact CG1-CG1 4.48Å; V160-I164 WeakPolarHBondContact O-CB 3.36Å; V160-I164 WeakPolarHBondContact O-CD1 2.89Å; V160-I164 WeakPolarHBondContact O-CG1 3.3Å; V160-I164 PolarHBondContact O-N 3.41Å; G162-I164 VanDerWaalsContact C-N 3.3Å; G162-I164 PolarHBondContact O-N 3.42Å; I164-S167 PolarHBondContact O-OG 3Å; I164-S167 VanDerWaalsContact O-OG 3.06Å; I164-L207 HydrophobicContact CG1-CD1 4.23Å; I164-L226 HydrophobicContact CD1-CD2 4.49Å; I164-L226 HydrophobicContact CG2-CD2 3.43Å; I164-L226 VanDerWaalsContact CG2-CD2 3.43Å; I164-Y227 VanDerWaalsContact CA-OH 3.32Å; I164-Y227 WeakPolarHBondContact CA-OH 3.4Å; I164-Y227 PolarHBondContact O-OH 3.01Å |
| 165 | G | 87.7 | Confident | 84.6 | Confident | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -67.6 | -45.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | V114 L161 G162 S167 L168 | V114-G165 VanDerWaalsContact CG1-O 3.25Å; V114-G165 WeakPolarHBondContact CG1-O 2.96Å; L161-G165 PolarHBondContact O-N 3.19Å; G162-G165 PolarHBondContact O-N 3.28Å; G162-G165 VanDerWaalsContact O-N 3.16Å; G165-S167 VanDerWaalsContact C-N 3.29Å; G165-S167 PolarHBondContact O-N 2.98Å; G165-L168 WeakPolarHBondContact O-CB 3.36Å; G165-L168 PolarHBondContact O-N 2.72Å |
| 166 | Y | 83.8 | Confident | 84.7 | Confident | 4 Ų | 4 | 21.2 Ų | 21.2 | 2% | 0.016 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.7 | -36.9 | 178.1 | -75.1 | -59.8 | 0 | 0 | 0 | 112.7 | I81 K84 V85 V88 V102 D107 P111 V114 G162 L168 L169 | I81-Y166 HydrophobicContact CG2-CE1 4.17Å; K84-Y166 HydrophobicContact CD-CE2 4.44Å; V85-Y166 HydrophobicContact CG2-CD1 4Å; V85-Y166 HydrophobicContact CG2-CE1 4.24Å; V88-Y166 WeakPolarHBondContact CG1-O 2.89Å; V102-Y166 HydrophobicContact CG1-CD2 4.48Å; D107-Y166 PolarHBondContact OD2-OH 3.4Å; P111-Y166 HydrophobicContact CB-CD2 4.47Å; P111-Y166 HydrophobicContact CB-CE2 4.44Å; P111-Y166 VanDerWaalsContact CD-CZ 3.41Å; P111-Y166 WeakPolarHBondContact CD-OH 3.43Å; P111-Y166 HydrophobicContact CG-CD2 3.84Å; P111-Y166 HydrophobicContact CG-CE1 4.25Å; P111-Y166 HydrophobicContact CG-CE2 3.43Å; P111-Y166 VanDerWaalsContact CG-CE2 3.43Å; P111-Y166 HydrophobicContact CG-CG 4.4Å; V114-Y166 HydrophobicContact CG2-CD1 4.26Å; G162-Y166 WeakPolarHBondContact O-CD2 3.39Å; G162-Y166 PolarHBondContact O-N 3Å; Y166-L168 PolarHBondContact O-N 3.49Å; Y166-L169 VanDerWaalsContact O-CB 3.22Å; Y166-L169 WeakPolarHBondContact O-CB 3.42Å; Y166-L169 PolarHBondContact O-N 2.93Å; Y166-L169 VanDerWaalsContact O-N 3.08Å |
| 167 | S | 85.3 | Confident | 84.6 | Confident | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 13% | 0.125 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76 | 4.1 | -179.3 | 48.3 | 0 | 0 | 0 | 0 | 114.2 | V163 I164 G165 L169 P170 A199 A203 Y227 | V163-S167 WeakPolarHBondContact O-CB 3.11Å; V163-S167 PolarHBondContact O-N 3.47Å; V163-S167 VanDerWaalsContact O-N 3.13Å; V163-S167 PolarHBondContact O-OG 3.17Å; I164-S167 PolarHBondContact O-OG 3Å; I164-S167 VanDerWaalsContact O-OG 3.06Å; G165-S167 VanDerWaalsContact C-N 3.29Å; G165-S167 PolarHBondContact O-N 2.98Å; S167-L169 VanDerWaalsContact C-N 3.28Å; S167-P170 VanDerWaalsContact O-CD 3.31Å; S167-P170 WeakPolarHBondContact O-CD 3.29Å; S167-A199 WeakPolarHBondContact O-CB 3.18Å; S167-A203 WeakPolarHBondContact OG-CB 3.3Å; S167-Y227 PolarHBondContact OG-OH 3.13Å |
| 168 | L | 86.3 | Confident | 84.3 | Confident | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 12% | 0.115 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -14.7 | 162.5 | -67.3 | 170.4 | 0 | 0 | 0 | 113.2 | V114 V115 G165 Y166 L171 I172 Y227 F230 | V114-L168 HydrophobicContact CG1-CB 4.2Å; V115-L168 HydrophobicContact CB-CD1 4.26Å; V115-L168 HydrophobicContact CG1-CD1 4.4Å; V115-L168 HydrophobicContact CG2-CD1 3.57Å; G165-L168 WeakPolarHBondContact O-CB 3.36Å; G165-L168 PolarHBondContact O-N 2.72Å; Y166-L168 PolarHBondContact O-N 3.49Å; L168-L171 WeakPolarHBondContact O-CA 3.47Å; L168-L171 VanDerWaalsContact O-CB 3.31Å; L168-L171 WeakPolarHBondContact O-CB 3.3Å; L168-L171 PolarHBondContact O-N 2.91Å; L168-I172 PolarHBondContact O-N 3.35Å; L168-Y227 HydrophobicContact CD2-CD1 4.04Å; L168-Y227 HydrophobicContact CD2-CE1 3.79Å; L168-Y227 HydrophobicContact CG-CE1 4.3Å; L168-F230 HydrophobicContact CD1-CZ 4.44Å; L168-F230 HydrophobicContact CD2-CB 4.2Å; L168-F230 HydrophobicContact CD2-CD1 4.37Å; L168-F230 HydrophobicContact CD2-CD2 3.59Å; L168-F230 HydrophobicContact CD2-CE2 3.93Å; L168-F230 HydrophobicContact CD2-CG 3.82Å; L168-F230 HydrophobicContact CD2-CZ 4.48Å |
| 169 | L | 84 | Confident | 84.1 | Confident | 26 Ų | 26 | 24 Ų | 24 | 14% | 0.136 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -60.3 | -40.1 | -175.9 | -156.1 | 148.6 | 0 | 0 | 0 | 114.5 | V85 L89 V114 Y166 S167 L171 I172 V173 | V85-L169 HydrophobicContact CB-CD1 3.93Å; V85-L169 HydrophobicContact CG1-CD1 3.28Å; V85-L169 HydrophobicContact CG1-CD2 4.26Å; V85-L169 HydrophobicContact CG1-CG 4.4Å; V85-L169 HydrophobicContact CG2-CD1 3.55Å; L89-L169 HydrophobicContact CD1-CD2 3.96Å; V114-L169 HydrophobicContact CG1-CB 4.32Å; V114-L169 HydrophobicContact CG2-CD1 4.33Å; Y166-L169 VanDerWaalsContact O-CB 3.22Å; Y166-L169 WeakPolarHBondContact O-CB 3.42Å; Y166-L169 PolarHBondContact O-N 2.93Å; Y166-L169 VanDerWaalsContact O-N 3.08Å; S167-L169 VanDerWaalsContact C-N 3.28Å; L169-L171 VanDerWaalsContact C-N 3.26Å; L169-L171 PolarHBondContact O-N 3.16Å; L169-I172 WeakPolarHBondContact O-CB 3.41Å; L169-I172 PolarHBondContact O-N 3.44Å; L169-I172 VanDerWaalsContact O-N 3.11Å; L169-V173 HydrophobicContact CD2-CG2 4.13Å; L169-V173 WeakPolarHBondContact O-CG2 3.3Å; L169-V173 PolarHBondContact O-N 3.45Å |
| 170 | P | 83.7 | Confident | 84.2 | Confident | 6 Ų | 6 | 28.7 Ų | 28.7 | 4% | 0.039 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -57.1 | -37.9 | 170.2 | -23.1 | 34 | 0 | 0 | 0 | 112.9 | L89 S167 V173 I174 W198 A199 | L89-P170 HydrophobicContact CD1-CG 4.41Å; S167-P170 VanDerWaalsContact O-CD 3.31Å; S167-P170 WeakPolarHBondContact O-CD 3.29Å; P170-V173 PolarHBondContact O-N 3.45Å; P170-I174 WeakPolarHBondContact O-CB 3.35Å; P170-I174 WeakPolarHBondContact O-CG1 3.2Å; P170-I174 PolarHBondContact O-N 3.04Å; P170-I174 VanDerWaalsContact O-N 3.08Å; P170-W198 HydrophobicContact CB-CG 4.34Å; P170-A199 HydrophobicContact CB-CB 4.35Å; P170-A199 HydrophobicContact CG-CB 4.4Å |
| 171 | L | 85.8 | Confident | 83.8 | Confident | 5 Ų | 5 | 31.1 Ų | 31.1 | 3% | 0.026 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65.5 | -43 | 174.3 | -86.7 | 72.1 | 0 | 0 | 0 | 110.9 | F118 L168 L169 V173 I174 T175 A199 Y227 F230 | F118-L171 HydrophobicContact CD2-CB 4.4Å; F118-L171 HydrophobicContact CE2-CB 4.06Å; F118-L171 HydrophobicContact CE2-CD2 4.21Å; F118-L171 HydrophobicContact CZ-CD2 4.38Å; L168-L171 WeakPolarHBondContact O-CA 3.47Å; L168-L171 VanDerWaalsContact O-CB 3.31Å; L168-L171 WeakPolarHBondContact O-CB 3.3Å; L168-L171 PolarHBondContact O-N 2.91Å; L169-L171 VanDerWaalsContact C-N 3.26Å; L169-L171 PolarHBondContact O-N 3.16Å; L171-V173 PolarHBondContact O-N 3.02Å; L171-I174 PolarHBondContact O-N 3.2Å; L171-I174 VanDerWaalsContact O-N 3.15Å; L171-T175 WeakPolarHBondContact O-CG2 3.34Å; L171-T175 PolarHBondContact O-N 2.91Å; L171-T175 PolarHBondContact O-OG1 3.28Å; L171-A199 HydrophobicContact CD1-CB 3.11Å; L171-Y227 HydrophobicContact CD1-CD1 4.37Å; L171-F230 HydrophobicContact CD2-CB 4.36Å |
| 172 | I | 86.3 | Confident | 82.7 | Confident | 25 Ų | 25 | 32.9 Ų | 32.9 | 13% | 0.128 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.3 | -34.1 | 177.3 | -69.2 | 172.2 | 0 | 0 | 0 | 112.5 | V114 L117 F118 I121 L168 L169 T175 P176 | V114-I172 HydrophobicContact CG1-CD1 3.57Å; V114-I172 VanDerWaalsContact O-CD1 3.22Å; V114-I172 WeakPolarHBondContact O-CD1 3.36Å; L117-I172 HydrophobicContact CB-CD1 4.29Å; F118-I172 HydrophobicContact CB-CD1 3.85Å; F118-I172 HydrophobicContact CB-CG1 3.67Å; F118-I172 HydrophobicContact CD2-CG1 3.93Å; F118-I172 HydrophobicContact CG-CG1 4.29Å; I121-I172 HydrophobicContact CD1-CB 4.44Å; I121-I172 HydrophobicContact CD1-CG2 3.62Å; L168-I172 PolarHBondContact O-N 3.35Å; L169-I172 WeakPolarHBondContact O-CB 3.41Å; L169-I172 PolarHBondContact O-N 3.44Å; L169-I172 VanDerWaalsContact O-N 3.11Å; I172-T175 PolarHBondContact O-OG1 2.89Å; I172-P176 WeakPolarHBondContact O-CD 3.19Å; I172-P176 WeakPolarHBondContact O-CG 3.42Å |
| 173 | V | 84.3 | Confident | 82.1 | Confident | 79 Ų | 79 | 36.1 Ų | 36.1 | 48% | 0.479 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -77.5 | -38.5 | 177.2 | 175.3 | 0 | 0 | 0 | 0 | 111.1 | L169 P170 L171 P176 | L169-V173 HydrophobicContact CD2-CG2 4.13Å; L169-V173 WeakPolarHBondContact O-CG2 3.3Å; L169-V173 PolarHBondContact O-N 3.45Å; P170-V173 PolarHBondContact O-N 3.45Å; L171-V173 PolarHBondContact O-N 3.02Å; V173-P176 WeakPolarHBondContact O-CD 3.36Å; V173-P176 WeakPolarHBondContact O-CG 3.24Å |
| 174 | I | 84.1 | Confident | 82.2 | Confident | 30 Ų | 30 | 42.9 Ų | 42.9 | 15% | 0.154 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -73 | -38.6 | -177.9 | -69.8 | -70.4 | 0 | 0 | 0 | 111.3 | P170 L171 L177 L178 | P170-I174 WeakPolarHBondContact O-CB 3.35Å; P170-I174 WeakPolarHBondContact O-CG1 3.2Å; P170-I174 PolarHBondContact O-N 3.04Å; P170-I174 VanDerWaalsContact O-N 3.08Å; L171-I174 PolarHBondContact O-N 3.2Å; L171-I174 VanDerWaalsContact O-N 3.15Å; I174-L177 HydrophobicContact CD1-CD2 4.37Å; I174-L177 WeakPolarHBondContact O-CA 3.04Å; I174-L177 VanDerWaalsContact O-CB 3.32Å; I174-L177 WeakPolarHBondContact O-CB 3.28Å; I174-L177 PolarHBondContact O-N 3.49Å; I174-L177 VanDerWaalsContact O-N 3.12Å; I174-L178 HydrophobicContact CB-CD1 4.49Å; I174-L178 HydrophobicContact CG2-CD1 3.31Å; I174-L178 WeakPolarHBondContact O-CD1 3.46Å; I174-L178 PolarHBondContact O-N 3.33Å |
| 175 | T | 82.3 | Confident | 81.9 | Confident | 4 Ų | 4 | 51 Ų | 51 | 3% | 0.025 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -57.9 | -47 | -178.2 | 41 | 0 | 0 | 0 | 0 | 115.9 | F118 L171 I172 L177 L178 L179 Y234 | F118-T175 HydrophobicContact CE2-CG2 4.4Å; L171-T175 WeakPolarHBondContact O-CG2 3.34Å; L171-T175 PolarHBondContact O-N 2.91Å; L171-T175 PolarHBondContact O-OG1 3.28Å; I172-T175 PolarHBondContact O-OG1 2.89Å; T175-L177 VanDerWaalsContact C-N 3.32Å; T175-L178 WeakPolarHBondContact O-CB 3.35Å; T175-L178 PolarHBondContact O-N 3.48Å; T175-L179 PolarHBondContact O-N 3.44Å; T175-Y234 HydrophobicContact CG2-CD1 3.79Å; T175-Y234 HydrophobicContact CG2-CD2 3.71Å; T175-Y234 HydrophobicContact CG2-CE1 3.57Å; T175-Y234 HydrophobicContact CG2-CE2 3.48Å; T175-Y234 VanDerWaalsContact CG2-CE2 3.48Å; T175-Y234 HydrophobicContact CG2-CG 3.86Å; T175-Y234 VanDerWaalsContact CG2-CZ 3.4Å; T175-Y234 PolarHBondContact O-OH 2.9Å |
| 176 | P | 81.1 | Confident | 81.8 | Confident | 64 Ų | 64 | 56.3 Ų | 56.3 | 42% | 0.416 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -69.4 | -30.5 | 173.6 | 27.6 | -34.9 | 0 | 0 | 0 | 112.2 | I172 V173 L178 L179 V180 | I172-P176 WeakPolarHBondContact O-CD 3.19Å; I172-P176 WeakPolarHBondContact O-CG 3.42Å; V173-P176 WeakPolarHBondContact O-CD 3.36Å; V173-P176 WeakPolarHBondContact O-CG 3.24Å; P176-L178 VanDerWaalsContact C-N 3.31Å; P176-L178 PolarHBondContact O-N 3.12Å; P176-L179 WeakPolarHBondContact O-CB 3.36Å; P176-L179 PolarHBondContact O-N 3.4Å; P176-V180 PolarHBondContact O-N 3.15Å |
| 177 | L | 81.6 | Confident | 81.9 | Confident | 81 Ų | 81 | 59.5 Ų | 59.5 | 42% | 0.424 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64 | -38.2 | 174.6 | -176.1 | 65.9 | 0 | 0 | 0 | 111.4 | I174 T175 L179 V180 I181 | I174-L177 HydrophobicContact CD1-CD2 4.37Å; I174-L177 WeakPolarHBondContact O-CA 3.04Å; I174-L177 VanDerWaalsContact O-CB 3.32Å; I174-L177 WeakPolarHBondContact O-CB 3.28Å; I174-L177 PolarHBondContact O-N 3.49Å; I174-L177 VanDerWaalsContact O-N 3.12Å; T175-L177 VanDerWaalsContact C-N 3.32Å; L177-L179 VanDerWaalsContact C-N 3.27Å; L177-L179 PolarHBondContact O-N 3.43Å; L177-V180 PolarHBondContact O-N 3.29Å; L177-I181 HydrophobicContact CD1-CD1 3.71Å; L177-I181 HydrophobicContact CD1-CG1 4.38Å; L177-I181 HydrophobicContact CD2-CD1 4.27Å; L177-I181 HydrophobicContact CG-CD1 3.67Å; L177-I181 WeakPolarHBondContact O-CG1 3.15Å; L177-I181 PolarHBondContact O-N 3.13Å |
| 178 | L | 80.5 | Confident | 81.9 | Confident | 10 Ų | 10 | 60.2 Ų | 60.2 | 5% | 0.052 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.4 | -34.5 | 173.5 | -94.6 | 66.5 | 0 | 0 | 0 | 112.8 | I174 T175 P176 V180 I181 G182 A191 K192 Y234 | I174-L178 HydrophobicContact CB-CD1 4.49Å; I174-L178 HydrophobicContact CG2-CD1 3.31Å; I174-L178 WeakPolarHBondContact O-CD1 3.46Å; I174-L178 PolarHBondContact O-N 3.33Å; T175-L178 WeakPolarHBondContact O-CB 3.35Å; T175-L178 PolarHBondContact O-N 3.48Å; P176-L178 VanDerWaalsContact C-N 3.31Å; P176-L178 PolarHBondContact O-N 3.12Å; L178-V180 VanDerWaalsContact C-N 3.27Å; L178-V180 PolarHBondContact O-N 3.45Å; L178-I181 PolarHBondContact O-N 3.45Å; L178-G182 VanDerWaalsContact O-CA 3.24Å; L178-G182 WeakPolarHBondContact O-CA 2.98Å; L178-G182 PolarHBondContact O-N 3.47Å; L178-A191 HydrophobicContact CD1-CB 3.78Å; L178-K192 HydrophobicContact CD2-CD 4.08Å; L178-K192 VanDerWaalsContact CD2-CE 3.45Å; L178-K192 HydrophobicContact CD2-CG 3.43Å; L178-K192 VanDerWaalsContact CD2-CG 3.43Å; L178-K192 HydrophobicContact CG-CG 4.43Å; L178-Y234 HydrophobicContact CD2-CE1 4.48Å |
| 179 | L | 78.9 | Confident | 81.8 | Confident | 121 Ų | 121 | 63.6 Ų | 63.6 | 63% | 0.634 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -63.7 | -37.5 | 177.1 | -174.4 | 66.1 | 0 | 0 | 0 | 110.9 | T175 P176 L177 | T175-L179 PolarHBondContact O-N 3.44Å; P176-L179 WeakPolarHBondContact O-CB 3.36Å; P176-L179 PolarHBondContact O-N 3.4Å; L177-L179 VanDerWaalsContact C-N 3.27Å; L177-L179 PolarHBondContact O-N 3.43Å |
| 180 | V | 81.7 | Confident | 82 | Confident | 125 Ų | 125 | 67.9 Ų | 67.9 | 76% | 0.758 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -74.1 | -38.1 | 178.2 | -179.3 | 0 | 0 | 0 | 0 | 111.8 | P176 L177 L178 | P176-V180 PolarHBondContact O-N 3.15Å; L177-V180 PolarHBondContact O-N 3.29Å; L178-V180 VanDerWaalsContact C-N 3.27Å; L178-V180 PolarHBondContact O-N 3.45Å |
| 181 | I | 77.5 | Confident | 82.1 | Confident | 53 Ų | 53 | 68.6 Ų | 68.6 | 27% | 0.272 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -93.7 | 1.3 | -175.3 | -55.5 | 172.2 | 0 | 0 | 0 | 112.1 | L177 L178 G183 F184 V187 | L177-I181 HydrophobicContact CD1-CD1 3.71Å; L177-I181 HydrophobicContact CD1-CG1 4.38Å; L177-I181 HydrophobicContact CD2-CD1 4.27Å; L177-I181 HydrophobicContact CG-CD1 3.67Å; L177-I181 WeakPolarHBondContact O-CG1 3.15Å; L177-I181 PolarHBondContact O-N 3.13Å; L178-I181 PolarHBondContact O-N 3.45Å; I181-G183 PolarHBondContact O-N 3.25Å; I181-F184 PolarHBondContact O-N 3.3Å; I181-F184 VanDerWaalsContact O-N 3.09Å; I181-V187 HydrophobicContact CG2-CB 4.1Å; I181-V187 HydrophobicContact CG2-CG1 3.56Å |
| 182 | G | 65.6 | Low | 82.2 | Confident | 46 Ų | 46 | 71.1 Ų | 71.1 | 47% | 0.474 | 42% | 0.415 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | -11.4 | -170.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | L178 F184 | L178-G182 VanDerWaalsContact O-CA 3.24Å; L178-G182 WeakPolarHBondContact O-CA 2.98Å; L178-G182 PolarHBondContact O-N 3.47Å; G182-F184 VanDerWaalsContact C-N 3.26Å; G182-F184 PolarHBondContact O-N 3.17Å |
| 183 | G | 72.8 | Confident | 82.3 | Confident | 75 Ų | 75 | 75.2 Ų | 75.2 | 77% | 0.773 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.8 | -15.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | I181 | I181-G183 PolarHBondContact O-N 3.25Š|
| 184 | F | 83.8 | Confident | 82.5 | Confident | 146 Ų | 146 | 77.1 Ų | 77.1 | 64% | 0.64 | 44% | 0.438 | S | S | * | . | trans | -119.3 | 104.2 | -179.9 | -60.5 | -79.5 | 0 | 0 | 0 | 111.5 | I181 G182 V186 V187 S188 | I181-F184 PolarHBondContact O-N 3.3Å; I181-F184 VanDerWaalsContact O-N 3.09Å; G182-F184 VanDerWaalsContact C-N 3.26Å; G182-F184 PolarHBondContact O-N 3.17Å; F184-V186 PolarHBondContact O-N 2.89Å; F184-V187 HydrophobicContact CB-CB 3.92Å; F184-V187 HydrophobicContact CB-CG2 3.8Å; F184-V187 HydrophobicContact CG-CG2 4.49Å; F184-V187 PolarHBondContact O-N 2.95Å; F184-S188 WeakPolarHBondContact O-CB 3.47Å; F184-S188 PolarHBondContact O-N 3.2Å | ||
| 185 | E | 82.8 | Confident | 82.6 | Confident | 170 Ų | 170 | 75.7 Ų | 75.7 | 79% | 0.794 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -58.1 | -42 | -175.5 | -65.2 | -173.4 | 163.3 | 0 | 0 | 113.5 | T189 | E185-T189 WeakPolarHBondContact O-CB 3.18Å; E185-T189 PolarHBondContact O-N 2.95Å; E185-T189 PolarHBondContact O-OG1 2.87Å |
| 186 | V | 86.3 | Confident | 82.9 | Confident | 112 Ų | 112 | 75.8 Ų | 75.8 | 68% | 0.679 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -65.7 | -44 | 179.5 | 179.5 | 0 | 0 | 0 | 0 | 111.1 | F184 T189 L190 | F184-V186 PolarHBondContact O-N 2.89Å; V186-T189 PolarHBondContact O-N 3.27Å; V186-L190 PolarHBondContact O-N 3.13Å |
| 187 | V | 85.6 | Confident | 83.2 | Confident | 72 Ų | 72 | 79 Ų | 79 | 44% | 0.436 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -69.6 | -42.4 | -178.5 | -176.4 | 0 | 0 | 0 | 0 | 110.6 | I181 F184 T189 L190 A191 | I181-V187 HydrophobicContact CG2-CB 4.1Å; I181-V187 HydrophobicContact CG2-CG1 3.56Å; F184-V187 HydrophobicContact CB-CB 3.92Å; F184-V187 HydrophobicContact CB-CG2 3.8Å; F184-V187 HydrophobicContact CG-CG2 4.49Å; F184-V187 PolarHBondContact O-N 2.95Å; V187-T189 VanDerWaalsContact C-N 3.32Å; V187-T189 PolarHBondContact O-N 2.85Å; V187-L190 PolarHBondContact O-N 3.09Å; V187-A191 WeakPolarHBondContact O-CB 3.02Å; V187-A191 PolarHBondContact O-N 3.21Å |
| 188 | S | 84.5 | Confident | 83.5 | Confident | 15 Ų | 15 | 79 Ų | 79 | 11% | 0.105 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -59.1 | -44 | 174 | -177.4 | 0 | 0 | 0 | 0 | 111.1 | F184 A191 K192 | F184-S188 WeakPolarHBondContact O-CB 3.47Å; F184-S188 PolarHBondContact O-N 3.2Å; S188-A191 PolarHBondContact O-N 3.49Å; S188-K192 VanDerWaalsContact O-CG 3.28Å; S188-K192 WeakPolarHBondContact O-CG 3.11Å; S188-K192 PolarHBondContact O-N 3.06Å |
| 189 | T | 84.9 | Confident | 83.8 | Confident | 71 Ų | 71 | 78.5 Ų | 78.5 | 44% | 0.436 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.9 | -42.8 | 178.1 | -56 | 0 | 0 | 0 | 0 | 112.3 | E185 V186 V187 A191 K192 L193 | E185-T189 WeakPolarHBondContact O-CB 3.18Å; E185-T189 PolarHBondContact O-N 2.95Å; E185-T189 PolarHBondContact O-OG1 2.87Å; V186-T189 PolarHBondContact O-N 3.27Å; V187-T189 VanDerWaalsContact C-N 3.32Å; V187-T189 PolarHBondContact O-N 2.85Å; T189-A191 VanDerWaalsContact C-N 3.35Å; T189-A191 PolarHBondContact O-N 3.26Å; T189-K192 WeakPolarHBondContact O-CB 3.45Å; T189-K192 PolarHBondContact O-N 3.38Å; T189-L193 HydrophobicContact CG2-CD1 4.43Å; T189-L193 WeakPolarHBondContact O-CG 3.26Å; T189-L193 PolarHBondContact O-N 3.25Å |
| 190 | L | 88.6 | Confident | 84.1 | Confident | 116 Ų | 116 | 73 Ų | 73 | 61% | 0.607 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -61.4 | -43.8 | 174.8 | -113.5 | 73.5 | 0 | 0 | 0 | 111.8 | V186 V187 K192 L193 F194 | V186-L190 PolarHBondContact O-N 3.13Å; V187-L190 PolarHBondContact O-N 3.09Å; L190-K192 VanDerWaalsContact C-N 3.35Å; L190-K192 PolarHBondContact O-N 2.82Å; L190-L193 PolarHBondContact O-N 3.34Å; L190-F194 VanDerWaalsContact O-CB 3.31Å; L190-F194 WeakPolarHBondContact O-CB 3.48Å; L190-F194 PolarHBondContact O-N 2.74Å |
| 191 | A | 86.1 | Confident | 84.3 | Confident | 21 Ų | 21 | 72.7 Ų | 72.7 | 17% | 0.174 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -63.2 | -40.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L178 V187 S188 T189 F194 G195 | L178-A191 HydrophobicContact CD1-CB 3.78Å; V187-A191 WeakPolarHBondContact O-CB 3.02Å; V187-A191 PolarHBondContact O-N 3.21Å; S188-A191 PolarHBondContact O-N 3.49Å; T189-A191 VanDerWaalsContact C-N 3.35Å; T189-A191 PolarHBondContact O-N 3.26Å; A191-F194 PolarHBondContact O-N 2.66Å; A191-G195 PolarHBondContact O-N 3.13Å |
| 192 | K | 86.5 | Confident | 84.5 | Confident | 57 Ų | 57 | 70.1 Ų | 70.1 | 25% | 0.248 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -58 | -52.8 | 172.6 | -73.4 | 174.7 | -169.3 | 179.4 | 0 | 111.9 | L178 S188 T189 L190 F194 G195 V196 L231 | L178-K192 HydrophobicContact CD2-CD 4.08Å; L178-K192 VanDerWaalsContact CD2-CE 3.45Å; L178-K192 HydrophobicContact CD2-CG 3.43Å; L178-K192 VanDerWaalsContact CD2-CG 3.43Å; L178-K192 HydrophobicContact CG-CG 4.43Å; S188-K192 VanDerWaalsContact O-CG 3.28Å; S188-K192 WeakPolarHBondContact O-CG 3.11Å; S188-K192 PolarHBondContact O-N 3.06Å; T189-K192 WeakPolarHBondContact O-CB 3.45Å; T189-K192 PolarHBondContact O-N 3.38Å; L190-K192 VanDerWaalsContact C-N 3.35Å; L190-K192 PolarHBondContact O-N 2.82Å; K192-F194 VanDerWaalsContact C-N 3.32Å; K192-F194 PolarHBondContact O-N 3.17Å; K192-G195 PolarHBondContact O-N 3.37Å; K192-V196 WeakPolarHBondContact O-CG2 3.39Å; K192-V196 PolarHBondContact O-N 2.87Å; K192-L231 HydrophobicContact CB-CD1 4.4Å; K192-L231 HydrophobicContact CB-CD2 3.9Å; K192-L231 HydrophobicContact CG-CD1 4.2Å; K192-L231 HydrophobicContact CG-CD2 4.38Å |
| 193 | L | 88.3 | Confident | 85.4 | Confident | 112 Ų | 112 | 68 Ų | 68 | 59% | 0.586 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -62 | -42.9 | -178.9 | -70.5 | 175.3 | 0 | 0 | 0 | 111.3 | T189 L190 V196 F197 | T189-L193 HydrophobicContact CG2-CD1 4.43Å; T189-L193 WeakPolarHBondContact O-CG 3.26Å; T189-L193 PolarHBondContact O-N 3.25Å; L190-L193 PolarHBondContact O-N 3.34Å; L193-V196 PolarHBondContact O-N 2.99Å; L193-F197 VanDerWaalsContact O-CB 3.26Å; L193-F197 WeakPolarHBondContact O-CB 3.42Å; L193-F197 PolarHBondContact O-N 3.3Å |
| 194 | F | 88.3 | Confident | 85.8 | Confident | 118 Ų | 118 | 64.8 Ų | 64.8 | 52% | 0.518 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61.8 | -45.3 | 176 | -175.7 | -99.4 | 0 | 0 | 0 | 111.6 | L190 A191 K192 F197 W198 | L190-F194 VanDerWaalsContact O-CB 3.31Å; L190-F194 WeakPolarHBondContact O-CB 3.48Å; L190-F194 PolarHBondContact O-N 2.74Å; A191-F194 PolarHBondContact O-N 2.66Å; K192-F194 VanDerWaalsContact C-N 3.32Å; K192-F194 PolarHBondContact O-N 3.17Å; F194-F197 PolarHBondContact O-N 3.23Å; F194-W198 HydrophobicContact CE1-CE3 4.04Å; F194-W198 HydrophobicContact CE2-CE3 4.26Å; F194-W198 AromaticContact CZ-CE3 3.57Å; F194-W198 HydrophobicContact CZ-CE3 3.57Å; F194-W198 AromaticContact CZ-CZ3 3.9Å; F194-W198 HydrophobicContact CZ-CZ3 3.9Å; F194-W198 VanDerWaalsContact O-CB 3.23Å; F194-W198 WeakPolarHBondContact O-CB 3.2Å; F194-W198 PolarHBondContact O-N 3.29Å |
| 195 | G | 86.1 | Confident | 85.5 | Confident | 1 Ų | 1 | 58.5 Ų | 58.5 | 1% | 0.01 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.1 | -46 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113 | A191 K192 W198 A199 | A191-G195 PolarHBondContact O-N 3.13Å; K192-G195 PolarHBondContact O-N 3.37Å; G195-W198 PolarHBondContact O-N 2.74Å; G195-A199 WeakPolarHBondContact O-CB 3.28Å; G195-A199 PolarHBondContact O-N 3.27Å |
| 196 | V | 88.5 | Confident | 85.1 | Confident | 6 Ų | 6 | 51.3 Ų | 51.3 | 4% | 0.036 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64 | -45.9 | 176.4 | 170.5 | 0 | 0 | 0 | 0 | 111.3 | K192 L193 W198 A199 A200 F224 I228 L231 | K192-V196 WeakPolarHBondContact O-CG2 3.39Å; K192-V196 PolarHBondContact O-N 2.87Å; L193-V196 PolarHBondContact O-N 2.99Å; V196-W198 VanDerWaalsContact C-N 3.31Å; V196-W198 PolarHBondContact O-N 2.84Å; V196-A199 PolarHBondContact O-N 2.89Å; V196-A200 WeakPolarHBondContact O-CB 3.35Å; V196-A200 PolarHBondContact O-N 3.47Å; V196-F224 HydrophobicContact CG1-CE2 4.13Å; V196-I228 HydrophobicContact CG1-CG1 3.96Å; V196-L231 HydrophobicContact CG2-CB 3.73Å; V196-L231 HydrophobicContact CG2-CD1 4.43Å; V196-L231 HydrophobicContact CG2-CD2 3.5Å; V196-L231 HydrophobicContact CG2-CG 4.06Å |
| 197 | F | 88.1 | Confident | 84.5 | Confident | 130 Ų | 130 | 46.7 Ų | 46.7 | 57% | 0.57 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -61.9 | -42.2 | 178.5 | -173 | -94.2 | 0 | 0 | 0 | 111.2 | L193 F194 Y201 | L193-F197 VanDerWaalsContact O-CB 3.26Å; L193-F197 WeakPolarHBondContact O-CB 3.42Å; L193-F197 PolarHBondContact O-N 3.3Å; F194-F197 PolarHBondContact O-N 3.23Å; F197-Y201 WeakPolarHBondContact O-CB 3.39Å; F197-Y201 PolarHBondContact O-N 2.85Å |
| 198 | W | 87.1 | Confident | 83.8 | Confident | 82 Ų | 82 | 43.9 Ų | 43.9 | 31% | 0.311 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -63.7 | -47.4 | 178 | -170 | -80.2 | 0 | 0 | 0 | 112.3 | L89 P91 P170 F194 G195 V196 Y201 S202 | L89-W198 VanDerWaalsContact O-CE2 3.29Å; L89-W198 WeakPolarHBondContact O-CZ2 3.5Å; L89-W198 PolarHBondContact O-NE1 3.08Å; P91-W198 HydrophobicContact CG-CZ2 4.16Å; P170-W198 HydrophobicContact CB-CG 4.34Å; F194-W198 HydrophobicContact CE1-CE3 4.04Å; F194-W198 HydrophobicContact CE2-CE3 4.26Å; F194-W198 AromaticContact CZ-CE3 3.57Å; F194-W198 HydrophobicContact CZ-CE3 3.57Å; F194-W198 AromaticContact CZ-CZ3 3.9Å; F194-W198 HydrophobicContact CZ-CZ3 3.9Å; F194-W198 VanDerWaalsContact O-CB 3.23Å; F194-W198 WeakPolarHBondContact O-CB 3.2Å; F194-W198 PolarHBondContact O-N 3.29Å; G195-W198 PolarHBondContact O-N 2.74Å; V196-W198 VanDerWaalsContact C-N 3.31Å; V196-W198 PolarHBondContact O-N 2.84Å; W198-Y201 PolarHBondContact O-N 2.97Å; W198-S202 VanDerWaalsContact O-CB 3.28Å; W198-S202 WeakPolarHBondContact O-CB 3.28Å; W198-S202 PolarHBondContact O-N 3.45Å |
| 199 | A | 86.8 | Confident | 82.9 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.6 | -48.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | S167 P170 L171 G195 V196 Y201 S202 A203 Y227 | S167-A199 WeakPolarHBondContact O-CB 3.18Å; P170-A199 HydrophobicContact CB-CB 4.35Å; P170-A199 HydrophobicContact CG-CB 4.4Å; L171-A199 HydrophobicContact CD1-CB 3.11Å; G195-A199 WeakPolarHBondContact O-CB 3.28Å; G195-A199 PolarHBondContact O-N 3.27Å; V196-A199 PolarHBondContact O-N 2.89Å; A199-Y201 VanDerWaalsContact C-N 3.33Å; A199-Y201 PolarHBondContact O-N 3.43Å; A199-S202 WeakPolarHBondContact O-CB 3.1Å; A199-S202 PolarHBondContact O-N 3.27Å; A199-A203 WeakPolarHBondContact O-CB 3.08Å; A199-A203 PolarHBondContact O-N 2.73Å; A199-Y227 HydrophobicContact CB-CD1 3.8Å; A199-Y227 HydrophobicContact CB-CE1 4.08Å; A199-Y227 HydrophobicContact CB-CG 4.31Å |
| 200 | A | 87 | Confident | 81.5 | Confident | 6 Ų | 6 | 46.7 Ų | 46.7 | 5% | 0.05 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.8 | -39.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | V196 A204 F224 Y227 | V196-A200 WeakPolarHBondContact O-CB 3.35Å; V196-A200 PolarHBondContact O-N 3.47Å; A200-A204 WeakPolarHBondContact O-CB 3.41Å; A200-A204 PolarHBondContact O-N 2.88Å; A200-F224 HydrophobicContact CB-CB 4.48Å; A200-F224 HydrophobicContact CB-CD2 3.69Å; A200-Y227 HydrophobicContact CB-CD2 3.78Å; A200-Y227 HydrophobicContact CB-CG 4.3Å |
| 201 | Y | 84.3 | Confident | 79.9 | Confident | 117 Ų | 117 | 46.6 Ų | 46.6 | 46% | 0.459 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64.1 | -43.8 | 175 | -179.7 | -101.6 | 0 | 0 | 0 | 111.5 | P91 F197 W198 A199 S205 | P91-Y201 HydrophobicContact CB-CD1 3.81Å; P91-Y201 HydrophobicContact CB-CE1 3.75Å; P91-Y201 HydrophobicContact CG-CD1 3.66Å; P91-Y201 HydrophobicContact CG-CE1 3.84Å; F197-Y201 WeakPolarHBondContact O-CB 3.39Å; F197-Y201 PolarHBondContact O-N 2.85Å; W198-Y201 PolarHBondContact O-N 2.97Å; A199-Y201 VanDerWaalsContact C-N 3.33Å; A199-Y201 PolarHBondContact O-N 3.43Å; Y201-S205 WeakPolarHBondContact O-CB 3.25Å; Y201-S205 PolarHBondContact O-N 3.08Å; Y201-S205 PolarHBondContact O-OG 3.44Å |
| 202 | S | 83.3 | Confident | 78.4 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.9 | -53.2 | 175.2 | -176.1 | 0 | 0 | 0 | 0 | 111.6 | V88 W198 A199 A204 S205 L206 | V88-S202 WeakPolarHBondContact CG1-OG 3.35Å; V88-S202 WeakPolarHBondContact O-CB 3.44Å; V88-S202 PolarHBondContact O-OG 3.42Å; W198-S202 VanDerWaalsContact O-CB 3.28Å; W198-S202 WeakPolarHBondContact O-CB 3.28Å; W198-S202 PolarHBondContact O-N 3.45Å; A199-S202 WeakPolarHBondContact O-CB 3.1Å; A199-S202 PolarHBondContact O-N 3.27Å; S202-A204 PolarHBondContact O-N 2.78Å; S202-S205 PolarHBondContact O-N 3.33Å; S202-S205 PolarHBondContact O-OG 3.31Å; S202-L206 WeakPolarHBondContact O-CG 3.32Å; S202-L206 PolarHBondContact O-N 2.98Å |
| 203 | A | 83.8 | Confident | 76.9 | Confident | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.8 | -48.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | S167 A199 S205 L206 L207 I223 Y227 | S167-A203 WeakPolarHBondContact OG-CB 3.3Å; A199-A203 WeakPolarHBondContact O-CB 3.08Å; A199-A203 PolarHBondContact O-N 2.73Å; A203-S205 VanDerWaalsContact C-N 3.33Å; A203-S205 PolarHBondContact O-N 2.87Å; A203-L206 PolarHBondContact O-N 3.4Å; A203-L207 WeakPolarHBondContact O-CB 3.12Å; A203-L207 PolarHBondContact O-N 2.94Å; A203-I223 HydrophobicContact CB-CG2 3.79Å; A203-Y227 HydrophobicContact CB-CE2 3.52Å; A203-Y227 WeakPolarHBondContact CB-OH 3.48Å |
| 204 | A | 81.9 | Confident | 75.5 | Confident | 9 Ų | 9 | 52 Ų | 52 | 7% | 0.074 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.9 | -42.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | A200 S202 L206 V208 I220 I223 | A200-A204 WeakPolarHBondContact O-CB 3.41Å; A200-A204 PolarHBondContact O-N 2.88Å; S202-A204 PolarHBondContact O-N 2.78Å; A204-L206 VanDerWaalsContact C-N 3.31Å; A204-L206 PolarHBondContact O-N 3.37Å; A204-V208 WeakPolarHBondContact O-CA 3.39Å; A204-V208 WeakPolarHBondContact O-CB 3.41Å; A204-V208 VanDerWaalsContact O-CG2 3.29Å; A204-V208 WeakPolarHBondContact O-CG2 3.27Å; A204-V208 PolarHBondContact O-N 3.28Å; A204-I220 HydrophobicContact CB-CG1 4.03Å; A204-I223 HydrophobicContact CB-CD1 4.45Å |
| 205 | S | 76.6 | Confident | 74.4 | Confident | 14 Ų | 14 | 52.5 Ų | 52.5 | 10% | 0.098 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.4 | -33.6 | -178.9 | 81.2 | 0 | 0 | 0 | 0 | 112.3 | R99 Y201 S202 A203 | R99-S205 PolarHBondContact NH2-O 3.01Å; Y201-S205 WeakPolarHBondContact O-CB 3.25Å; Y201-S205 PolarHBondContact O-N 3.08Å; Y201-S205 PolarHBondContact O-OG 3.44Å; S202-S205 PolarHBondContact O-N 3.33Å; S202-S205 PolarHBondContact O-OG 3.31Å; A203-S205 VanDerWaalsContact C-N 3.33Å; A203-S205 PolarHBondContact O-N 2.87Å |
| 206 | L | 74.6 | Confident | 73.5 | Confident | 18 Ų | 18 | 55.3 Ų | 55.3 | 9% | 0.094 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -79.3 | -37.9 | 179.7 | -70.2 | 171.9 | 0 | 0 | 0 | 112.5 | V88 R99 V163 S202 A203 A204 | V88-L206 HydrophobicContact CB-CD1 4.35Å; V88-L206 HydrophobicContact CG2-CD1 3.45Å; V88-L206 VanDerWaalsContact CG2-CD1 3.45Å; R99-L206 HydrophobicContact CB-CD2 4.26Å; R99-L206 HydrophobicContact CG-CD2 3.88Å; V163-L206 HydrophobicContact CG1-CB 3.52Å; V163-L206 HydrophobicContact CG1-CD1 4.07Å; V163-L206 HydrophobicContact CG1-CG 4.45Å; V163-L206 HydrophobicContact CG2-CB 4.3Å; S202-L206 WeakPolarHBondContact O-CG 3.32Å; S202-L206 PolarHBondContact O-N 2.98Å; A203-L206 PolarHBondContact O-N 3.4Å; A204-L206 VanDerWaalsContact C-N 3.31Å; A204-L206 PolarHBondContact O-N 3.37Å |
| 207 | L | 74.3 | Confident | 72.8 | Confident | 16 Ų | 16 | 59.1 Ų | 59.1 | 8% | 0.084 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -79.1 | -38.2 | 176.6 | -71.8 | 177.1 | 0 | 0 | 0 | 113.2 | I144 V160 V163 I164 A203 G209 I223 | I144-L207 HydrophobicContact CG2-CD1 4.09Å; V160-L207 HydrophobicContact CB-CD2 4.4Å; V160-L207 HydrophobicContact CG1-CD1 4.37Å; V160-L207 HydrophobicContact CG2-CD2 4.07Å; V163-L207 HydrophobicContact CB-CD2 3.97Å; V163-L207 HydrophobicContact CB-CG 4.18Å; V163-L207 HydrophobicContact CG1-CD1 4.37Å; V163-L207 HydrophobicContact CG1-CD2 4.07Å; V163-L207 HydrophobicContact CG1-CG 3.74Å; V163-L207 HydrophobicContact CG2-CD2 4.2Å; I164-L207 HydrophobicContact CG1-CD1 4.23Å; A203-L207 WeakPolarHBondContact O-CB 3.12Å; A203-L207 PolarHBondContact O-N 2.94Å; L207-G209 PolarHBondContact O-N 2.88Å; L207-I223 HydrophobicContact CB-CD1 4.39Å; L207-I223 HydrophobicContact CD1-CD1 3.78Å; L207-I223 HydrophobicContact CD1-CG1 4.44Å |
| 208 | V | 70.9 | Confident | 72.4 | Confident | 12 Ų | 12 | 57.8 Ų | 57.8 | 7% | 0.073 | 29% | 0.293 | C | S | . | . | S | Bend | trans | -95 | 75 | -176.2 | -170.7 | 0 | 0 | 0 | 0 | 109.1 | A204 F212 K216 L219 I220 | A204-V208 WeakPolarHBondContact O-CA 3.39Å; A204-V208 WeakPolarHBondContact O-CB 3.41Å; A204-V208 VanDerWaalsContact O-CG2 3.29Å; A204-V208 WeakPolarHBondContact O-CG2 3.27Å; A204-V208 PolarHBondContact O-N 3.28Å; V208-F212 HydrophobicContact CG1-CB 4.31Å; V208-K216 HydrophobicContact CG1-CB 3.89Å; V208-K216 HydrophobicContact CG1-CD 3.66Å; V208-K216 HydrophobicContact CG1-CG 3.56Å; V208-L219 HydrophobicContact CG2-CB 4.48Å; V208-L219 HydrophobicContact CG2-CD2 4.28Å; V208-I220 HydrophobicContact CG2-CG1 4.35Å |
| 209 | G | 64.4 | Low | 72.2 | Confident | 24 Ų | 24 | 54.1 Ų | 54.1 | 25% | 0.247 | 28% | 0.279 | C | S | . | . | trans | -63.5 | -178.4 | 168.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | L207 E211 | L207-G209 PolarHBondContact O-N 2.88Å; G209-E211 PolarHBondContact O-N 3.24Å | ||
| 210 | D | 55.8 | Low | 72 | Confident | 122 Ų | 122 | 57.6 Ų | 57.6 | 65% | 0.652 | 30% | 0.297 | S | S | * | . | G | 310 helix | trans | -63.4 | -7.5 | -177 | -98.6 | -33.5 | 0 | 0 | 0 | 115.1 | F212 K213 | D210-F212 VanDerWaalsContact C-N 3.3Å; D210-F212 PolarHBondContact O-N 2.83Å; D210-K213 WeakPolarHBondContact OD1-CE 3.44Å; D210-K213 IonicContact OD1-NZ 3.42Å; D210-K213 PolarHBondContact OD1-NZ 3.36Å |
| 211 | E | 55.7 | Low | 72.1 | Confident | 114 Ų | 114 | 65.1 Ų | 65.1 | 53% | 0.533 | 33% | 0.325 | S | S | . | . | G | 310 helix | trans | -70.7 | -16.3 | -175.6 | -61.9 | 177.5 | 153.4 | 0 | 0 | 113.8 | R103 G209 | R103-E211 IonicContact NH1-OE2 3.09Å; R103-E211 PolarHBondContact NH1-OE2 3.32Å; R103-E211 VanDerWaalsContact NH1-OE2 3.09Å; R103-E211 IonicContact NH2-OE1 3.84Å; R103-E211 IonicContact NH2-OE2 3.97Å; G209-E211 PolarHBondContact O-N 3.24Å |
| 212 | F | 55 | Low | 72.3 | Confident | 21 Ų | 21 | 60.9 Ų | 60.9 | 9% | 0.092 | 31% | 0.312 | C | S | . | . | G | 310 helix | trans | -121.7 | 24.7 | -168.9 | -57.9 | -77.6 | 0 | 0 | 0 | 116.7 | V208 D210 T214 K215 K216 | V208-F212 HydrophobicContact CG1-CB 4.31Å; D210-F212 VanDerWaalsContact C-N 3.3Å; D210-F212 PolarHBondContact O-N 2.83Å; F212-T214 PolarHBondContact O-N 3Å; F212-K215 PolarHBondContact O-N 3.39Å; F212-K216 HydrophobicContact CB-CG 4.2Å; F212-K216 WeakPolarHBondContact O-CG 3.41Å; F212-K216 PolarHBondContact O-N 3.43Å; F212-K216 VanDerWaalsContact O-N 3.13Å |
| 213 | K | 55.1 | Low | 72.6 | Confident | 147 Ų | 147 | 60.9 Ų | 60.9 | 64% | 0.639 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -45.2 | -30 | -169.5 | -72.7 | 179.3 | -177.8 | 177.8 | 0 | 116.7 | D210 | D210-K213 WeakPolarHBondContact OD1-CE 3.44Å; D210-K213 IonicContact OD1-NZ 3.42Å; D210-K213 PolarHBondContact OD1-NZ 3.36Å |
| 214 | T | 58.6 | Low | 72.8 | Confident | 135 Ų | 135 | 65 Ų | 65 | 83% | 0.828 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | -14.3 | -179.3 | 27.6 | 0 | 0 | 0 | 0 | 115.9 | F212 | F212-T214 PolarHBondContact O-N 3Š|
| 215 | K | 64 | Low | 73.2 | Confident | 129 Ų | 129 | 68.7 Ų | 68.7 | 56% | 0.561 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.1 | 5.7 | -175.5 | -60.9 | -88.5 | -174.8 | 168.1 | 0 | 113.8 | F212 L218 | F212-K215 PolarHBondContact O-N 3.39Å; K215-L218 PolarHBondContact O-N 2.87Å |
| 216 | K | 67.6 | Low | 73.9 | Confident | 59 Ų | 59 | 68.7 Ų | 68.7 | 26% | 0.257 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -43.2 | -47.3 | 178.3 | -56.7 | -162.6 | 163 | 174.3 | 0 | 115.7 | V208 F212 L218 L219 I220 | V208-K216 HydrophobicContact CG1-CB 3.89Å; V208-K216 HydrophobicContact CG1-CD 3.66Å; V208-K216 HydrophobicContact CG1-CG 3.56Å; F212-K216 HydrophobicContact CB-CG 4.2Å; F212-K216 WeakPolarHBondContact O-CG 3.41Å; F212-K216 PolarHBondContact O-N 3.43Å; F212-K216 VanDerWaalsContact O-N 3.13Å; K216-L218 PolarHBondContact O-N 3.28Å; K216-L219 PolarHBondContact O-N 3.5Å; K216-I220 HydrophobicContact CB-CD1 4.32Å; K216-I220 WeakPolarHBondContact O-CG1 3.35Å; K216-I220 PolarHBondContact O-N 2.91Å |
| 217 | P | 73.9 | Confident | 74.6 | Confident | 87 Ų | 87 | 67.8 Ų | 67.8 | 57% | 0.565 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -65.9 | -24.6 | -173.1 | 24.5 | -34.4 | 0 | 0 | 0 | 113.9 | L219 Y221 | P217-L219 VanDerWaalsContact C-N 3.28Å; P217-L219 PolarHBondContact O-N 3.43Å; P217-Y221 PolarHBondContact O-N 3.08Å |
| 218 | L | 80.8 | Confident | 75.4 | Confident | 101 Ų | 101 | 70.9 Ų | 70.9 | 53% | 0.529 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -66 | -31 | 179.7 | -113.2 | 69.1 | 0 | 0 | 0 | 112.8 | L151 K215 K216 P222 | L151-L218 HydrophobicContact CD1-CD2 4.48Å; L151-L218 HydrophobicContact CD2-CB 4.18Å; K215-L218 PolarHBondContact O-N 2.87Å; K216-L218 PolarHBondContact O-N 3.28Å; L218-P222 WeakPolarHBondContact O-CD 3.28Å |
| 219 | L | 81.9 | Confident | 76.2 | Confident | 6 Ų | 6 | 75.2 Ų | 75.2 | 3% | 0.031 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -91.7 | -32.3 | -178.7 | -152.9 | 163 | 0 | 0 | 0 | 111.1 | I144 A148 L151 V208 K216 P217 Y221 P222 I223 | I144-L219 HydrophobicContact CG2-CD2 3.95Å; A148-L219 HydrophobicContact CB-CD1 3.83Å; L151-L219 HydrophobicContact CD2-CB 4.27Å; L151-L219 HydrophobicContact CD2-CD1 4.37Å; V208-L219 HydrophobicContact CG2-CB 4.48Å; V208-L219 HydrophobicContact CG2-CD2 4.28Å; K216-L219 PolarHBondContact O-N 3.5Å; P217-L219 VanDerWaalsContact C-N 3.28Å; P217-L219 PolarHBondContact O-N 3.43Å; L219-Y221 VanDerWaalsContact C-N 3.3Å; L219-Y221 PolarHBondContact O-N 2.87Å; L219-P222 WeakPolarHBondContact O-CD 3.41Å; L219-P222 VanDerWaalsContact O-CG 3.28Å; L219-P222 WeakPolarHBondContact O-CG 3.45Å; L219-I223 HydrophobicContact CD2-CD1 3.29Å; L219-I223 HydrophobicContact CD2-CG1 3.94Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.44Å; L219-I223 PolarHBondContact O-N 3.19Å |
| 220 | I | 83.6 | Confident | 77.4 | Confident | 72 Ų | 72 | 74 Ų | 74 | 37% | 0.369 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.2 | -36.9 | 176.5 | -65.4 | 169.4 | 0 | 0 | 0 | 111.5 | A204 V208 K216 I223 F224 | A204-I220 HydrophobicContact CB-CG1 4.03Å; V208-I220 HydrophobicContact CG2-CG1 4.35Å; K216-I220 HydrophobicContact CB-CD1 4.32Å; K216-I220 WeakPolarHBondContact O-CG1 3.35Å; K216-I220 PolarHBondContact O-N 2.91Å; I220-I223 PolarHBondContact O-N 2.99Å; I220-F224 WeakPolarHBondContact O-CB 3.5Å; I220-F224 PolarHBondContact O-N 3.36Å |
| 221 | Y | 88.1 | Confident | 78.9 | Confident | 165 Ų | 165 | 69.6 Ų | 69.6 | 65% | 0.647 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -57.1 | -56.5 | -179.7 | 179.6 | -98.8 | 0 | 0 | 0 | 113.9 | P217 L219 I223 F224 L225 | P217-Y221 PolarHBondContact O-N 3.08Å; L219-Y221 VanDerWaalsContact C-N 3.3Å; L219-Y221 PolarHBondContact O-N 2.87Å; Y221-I223 VanDerWaalsContact C-N 3.31Å; Y221-I223 PolarHBondContact O-N 3.17Å; Y221-F224 PolarHBondContact O-N 3.33Å; Y221-L225 HydrophobicContact CE1-CD1 4.25Å; Y221-L225 PolarHBondContact O-N 2.91Å |
| 222 | P | 89.4 | Confident | 80.3 | Confident | 28 Ų | 28 | 66.4 Ų | 66.4 | 18% | 0.182 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -66.3 | -31 | 178.1 | 24.3 | -33.7 | 0 | 0 | 0 | 113.2 | I144 L147 L218 L219 L225 L226 | I144-P222 HydrophobicContact CG1-CB 4.47Å; L147-P222 HydrophobicContact CD2-CG 3.5Å; L147-P222 VanDerWaalsContact CD2-CG 3.5Å; L218-P222 WeakPolarHBondContact O-CD 3.28Å; L219-P222 WeakPolarHBondContact O-CD 3.41Å; L219-P222 VanDerWaalsContact O-CG 3.28Å; L219-P222 WeakPolarHBondContact O-CG 3.45Å; P222-L225 PolarHBondContact O-N 3.01Å; P222-L226 WeakPolarHBondContact O-CB 3.47Å; P222-L226 PolarHBondContact O-N 3.32Å |
| 223 | I | 89.1 | Confident | 81.7 | Confident | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -60.3 | -51 | 172.3 | -68.5 | 173.8 | 0 | 0 | 0 | 109.8 | I144 A203 A204 L207 L219 I220 Y221 L225 L226 Y227 | I144-I223 HydrophobicContact CD1-CG1 4.01Å; I144-I223 HydrophobicContact CG1-CG1 4.4Å; I144-I223 HydrophobicContact CG2-CG1 4.17Å; A203-I223 HydrophobicContact CB-CG2 3.79Å; A204-I223 HydrophobicContact CB-CD1 4.45Å; L207-I223 HydrophobicContact CB-CD1 4.39Å; L207-I223 HydrophobicContact CD1-CD1 3.78Å; L207-I223 HydrophobicContact CD1-CG1 4.44Å; L219-I223 HydrophobicContact CD2-CD1 3.29Å; L219-I223 HydrophobicContact CD2-CG1 3.94Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.44Å; L219-I223 PolarHBondContact O-N 3.19Å; I220-I223 PolarHBondContact O-N 2.99Å; Y221-I223 VanDerWaalsContact C-N 3.31Å; Y221-I223 PolarHBondContact O-N 3.17Å; I223-L225 VanDerWaalsContact C-N 3.33Å; I223-L225 PolarHBondContact O-N 3.02Å; I223-L226 WeakPolarHBondContact O-CB 3.34Å; I223-L226 PolarHBondContact O-N 2.74Å; I223-Y227 HydrophobicContact CG2-CD2 4.03Å; I223-Y227 HydrophobicContact CG2-CE2 3.66Å; I223-Y227 WeakPolarHBondContact O-CD2 3.46Å; I223-Y227 PolarHBondContact O-N 3.05Å |
| 224 | F | 88.6 | Confident | 82.8 | Confident | 86 Ų | 86 | 62.3 Ų | 62.3 | 38% | 0.377 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -60.5 | -43 | -179.7 | -175.6 | -108.5 | 0 | 0 | 0 | 112 | V196 A200 I220 Y221 L226 Y227 I228 | V196-F224 HydrophobicContact CG1-CE2 4.13Å; A200-F224 HydrophobicContact CB-CB 4.48Å; A200-F224 HydrophobicContact CB-CD2 3.69Å; I220-F224 WeakPolarHBondContact O-CB 3.5Å; I220-F224 PolarHBondContact O-N 3.36Å; Y221-F224 PolarHBondContact O-N 3.33Å; F224-L226 VanDerWaalsContact C-N 3.31Å; F224-L226 PolarHBondContact O-N 3.46Å; F224-Y227 PolarHBondContact O-N 3.41Å; F224-I228 HydrophobicContact CD1-CD1 3.6Å; F224-I228 HydrophobicContact CD1-CG1 4.47Å; F224-I228 HydrophobicContact CE1-CD1 3.27Å; F224-I228 HydrophobicContact CE1-CG1 4.21Å; F224-I228 HydrophobicContact CG-CD1 4.44Å; F224-I228 HydrophobicContact CZ-CD1 3.83Å; F224-I228 HydrophobicContact CZ-CG1 4.38Å; F224-I228 WeakPolarHBondContact O-CG1 3.49Å; F224-I228 PolarHBondContact O-N 3.09Å; F224-I228 VanDerWaalsContact O-N 3.07Å |
| 225 | L | 89.5 | Confident | 83.7 | Confident | 86 Ų | 86 | 58.4 Ų | 58.4 | 45% | 0.45 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.9 | -39.9 | 177 | -166.3 | 153.3 | 0 | 0 | 0 | 111.8 | Y221 P222 I223 I228 Y229 | Y221-L225 HydrophobicContact CE1-CD1 4.25Å; Y221-L225 PolarHBondContact O-N 2.91Å; P222-L225 PolarHBondContact O-N 3.01Å; I223-L225 VanDerWaalsContact C-N 3.33Å; I223-L225 PolarHBondContact O-N 3.02Å; L225-I228 PolarHBondContact O-N 3.27Å; L225-Y229 PolarHBondContact O-N 3.14Å |
| 226 | L | 91.3 | Very high | 83.7 | Confident | 14 Ų | 14 | 55.6 Ų | 55.6 | 7% | 0.073 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 176.5 | -169.4 | 103.9 | 0 | 0 | 0 | 112.1 | I136 I144 I164 P222 I223 F224 Y229 F230 | I136-L226 HydrophobicContact CG2-CD1 4.39Å; I144-L226 HydrophobicContact CD1-CB 4.45Å; I144-L226 HydrophobicContact CD1-CD1 4.28Å; I144-L226 HydrophobicContact CD1-CD2 4.12Å; I164-L226 HydrophobicContact CD1-CD2 4.49Å; I164-L226 HydrophobicContact CG2-CD2 3.43Å; I164-L226 VanDerWaalsContact CG2-CD2 3.43Å; P222-L226 WeakPolarHBondContact O-CB 3.47Å; P222-L226 PolarHBondContact O-N 3.32Å; I223-L226 WeakPolarHBondContact O-CB 3.34Å; I223-L226 PolarHBondContact O-N 2.74Å; F224-L226 VanDerWaalsContact C-N 3.31Å; F224-L226 PolarHBondContact O-N 3.46Å; L226-Y229 WeakPolarHBondContact O-CB 3.38Å; L226-Y229 PolarHBondContact O-N 3.4Å; L226-F230 HydrophobicContact CD2-CD2 4.19Å; L226-F230 HydrophobicContact CD2-CE2 3.48Å; L226-F230 VanDerWaalsContact CD2-CE2 3.48Å; L226-F230 HydrophobicContact CD2-CZ 4.39Å; L226-F230 HydrophobicContact CG-CD2 4.18Å; L226-F230 HydrophobicContact CG-CE2 3.73Å; L226-F230 VanDerWaalsContact O-CD2 3.24Å; L226-F230 WeakPolarHBondContact O-CD2 3.29Å; L226-F230 PolarHBondContact O-N 3.3Å |
| 227 | Y | 89.8 | Confident | 82.8 | Confident | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -69.7 | -33.4 | 177.6 | -71.4 | -76.4 | 0 | 0 | 0 | 113.5 | I164 S167 L168 L171 A199 A200 A203 I223 F224 Y229 F230 L231 | I164-Y227 VanDerWaalsContact CA-OH 3.32Å; I164-Y227 WeakPolarHBondContact CA-OH 3.4Å; I164-Y227 PolarHBondContact O-OH 3.01Å; S167-Y227 PolarHBondContact OG-OH 3.13Å; L168-Y227 HydrophobicContact CD2-CD1 4.04Å; L168-Y227 HydrophobicContact CD2-CE1 3.79Å; L168-Y227 HydrophobicContact CG-CE1 4.3Å; L171-Y227 HydrophobicContact CD1-CD1 4.37Å; A199-Y227 HydrophobicContact CB-CD1 3.8Å; A199-Y227 HydrophobicContact CB-CE1 4.08Å; A199-Y227 HydrophobicContact CB-CG 4.31Å; A200-Y227 HydrophobicContact CB-CD2 3.78Å; A200-Y227 HydrophobicContact CB-CG 4.3Å; A203-Y227 HydrophobicContact CB-CE2 3.52Å; A203-Y227 WeakPolarHBondContact CB-OH 3.48Å; I223-Y227 HydrophobicContact CG2-CD2 4.03Å; I223-Y227 HydrophobicContact CG2-CE2 3.66Å; I223-Y227 WeakPolarHBondContact O-CD2 3.46Å; I223-Y227 PolarHBondContact O-N 3.05Å; F224-Y227 PolarHBondContact O-N 3.41Å; Y227-Y229 VanDerWaalsContact C-N 3.27Å; Y227-Y229 PolarHBondContact O-N 3.24Å; Y227-F230 HydrophobicContact CD1-CD2 4.37Å; Y227-F230 PolarHBondContact O-N 2.91Å; Y227-L231 PolarHBondContact O-N 3.23Å |
| 228 | I | 89.9 | Confident | 83.2 | Confident | 80 Ų | 80 | 59.4 Ų | 59.4 | 41% | 0.41 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.9 | -43.4 | 169.5 | -70 | 169.4 | 0 | 0 | 0 | 109.9 | V196 F224 L225 L231 S232 | V196-I228 HydrophobicContact CG1-CG1 3.96Å; F224-I228 HydrophobicContact CD1-CD1 3.6Å; F224-I228 HydrophobicContact CD1-CG1 4.47Å; F224-I228 HydrophobicContact CE1-CD1 3.27Å; F224-I228 HydrophobicContact CE1-CG1 4.21Å; F224-I228 HydrophobicContact CG-CD1 4.44Å; F224-I228 HydrophobicContact CZ-CD1 3.83Å; F224-I228 HydrophobicContact CZ-CG1 4.38Å; F224-I228 WeakPolarHBondContact O-CG1 3.49Å; F224-I228 PolarHBondContact O-N 3.09Å; F224-I228 VanDerWaalsContact O-N 3.07Å; L225-I228 PolarHBondContact O-N 3.27Å; I228-L231 PolarHBondContact O-N 3.5Å; I228-S232 PolarHBondContact O-N 3.17Å |
| 229 | Y | 89.1 | Confident | 83.4 | Confident | 103 Ų | 103 | 57.2 Ų | 57.2 | 40% | 0.404 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 179.7 | -159.6 | -79 | 0 | 0 | 0 | 112.1 | I136 L225 L226 Y227 L231 S232 L233 | I136-Y229 HydrophobicContact CD1-CD1 3.6Å; I136-Y229 HydrophobicContact CD1-CE1 3.07Å; I136-Y229 HydrophobicContact CG1-CE1 4.26Å; I136-Y229 HydrophobicContact CG2-CD1 4.24Å; L225-Y229 PolarHBondContact O-N 3.14Å; L226-Y229 WeakPolarHBondContact O-CB 3.38Å; L226-Y229 PolarHBondContact O-N 3.4Å; Y227-Y229 VanDerWaalsContact C-N 3.27Å; Y227-Y229 PolarHBondContact O-N 3.24Å; Y229-L231 VanDerWaalsContact C-N 3.32Å; Y229-L231 PolarHBondContact O-N 3.41Å; Y229-S232 WeakPolarHBondContact O-CB 3.49Å; Y229-S232 PolarHBondContact O-N 3.02Å; Y229-L233 HydrophobicContact CD1-CD1 3.71Å; Y229-L233 HydrophobicContact CD1-CG 3.87Å; Y229-L233 HydrophobicContact CE1-CD1 3.61Å; Y229-L233 HydrophobicContact CE1-CD2 4.05Å; Y229-L233 HydrophobicContact CE1-CG 3.6Å; Y229-L233 PolarHBondContact O-N 3.45Å |
| 230 | F | 88.8 | Confident | 83.5 | Confident | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -59.9 | -41.6 | 172.9 | -76.3 | -58.6 | 0 | 0 | 0 | 112.5 | F118 I133 I136 W137 L168 L171 L226 Y227 Y234 | F118-F230 HydrophobicContact CE1-CB 4.29Å; F118-F230 HydrophobicContact CE1-CD1 4.24Å; F118-F230 HydrophobicContact CZ-CB 4.32Å; I133-F230 HydrophobicContact CG2-CD1 4.34Å; I133-F230 HydrophobicContact CG2-CE1 4.04Å; I136-F230 HydrophobicContact CG2-CE1 4.31Å; I136-F230 HydrophobicContact CG2-CZ 4.33Å; W137-F230 HydrophobicContact CB-CE1 4.32Å; W137-F230 HydrophobicContact CB-CZ 3.91Å; L168-F230 HydrophobicContact CD1-CZ 4.44Å; L168-F230 HydrophobicContact CD2-CB 4.2Å; L168-F230 HydrophobicContact CD2-CD1 4.37Å; L168-F230 HydrophobicContact CD2-CD2 3.59Å; L168-F230 HydrophobicContact CD2-CE2 3.93Å; L168-F230 HydrophobicContact CD2-CG 3.82Å; L168-F230 HydrophobicContact CD2-CZ 4.48Å; L171-F230 HydrophobicContact CD2-CB 4.36Å; L226-F230 HydrophobicContact CD2-CD2 4.19Å; L226-F230 HydrophobicContact CD2-CE2 3.48Å; L226-F230 VanDerWaalsContact CD2-CE2 3.48Å; L226-F230 HydrophobicContact CD2-CZ 4.39Å; L226-F230 HydrophobicContact CG-CD2 4.18Å; L226-F230 HydrophobicContact CG-CE2 3.73Å; L226-F230 VanDerWaalsContact O-CD2 3.24Å; L226-F230 WeakPolarHBondContact O-CD2 3.29Å; L226-F230 PolarHBondContact O-N 3.3Å; Y227-F230 HydrophobicContact CD1-CD2 4.37Å; Y227-F230 PolarHBondContact O-N 2.91Å; F230-Y234 PolarHBondContact O-N 3.3Å |
| 231 | L | 86.7 | Confident | 83.4 | Confident | 29 Ų | 29 | 59.4 Ų | 59.4 | 15% | 0.152 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 173.8 | -178 | 70.6 | 0 | 0 | 0 | 111.5 | K192 V196 Y227 I228 Y229 L233 Y234 T235 | K192-L231 HydrophobicContact CB-CD1 4.4Å; K192-L231 HydrophobicContact CB-CD2 3.9Å; K192-L231 HydrophobicContact CG-CD1 4.2Å; K192-L231 HydrophobicContact CG-CD2 4.38Å; V196-L231 HydrophobicContact CG2-CB 3.73Å; V196-L231 HydrophobicContact CG2-CD1 4.43Å; V196-L231 HydrophobicContact CG2-CD2 3.5Å; V196-L231 HydrophobicContact CG2-CG 4.06Å; Y227-L231 PolarHBondContact O-N 3.23Å; I228-L231 PolarHBondContact O-N 3.5Å; Y229-L231 VanDerWaalsContact C-N 3.32Å; Y229-L231 PolarHBondContact O-N 3.41Å; L231-L233 VanDerWaalsContact C-N 3.34Å; L231-L233 PolarHBondContact O-N 3.45Å; L231-Y234 HydrophobicContact CD1-CD1 4.33Å; L231-Y234 WeakPolarHBondContact O-CB 3.31Å; L231-Y234 PolarHBondContact O-N 3.41Å; L231-Y234 VanDerWaalsContact O-N 3.17Å; L231-T235 PolarHBondContact O-N 3.19Å; L231-T235 PolarHBondContact O-OG1 3.01Å |
| 232 | S | 86 | Confident | 83.2 | Confident | 47 Ų | 47 | 52.8 Ų | 52.8 | 33% | 0.329 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -58.4 | -47 | 178.3 | -160.3 | 0 | 0 | 0 | 0 | 111.2 | I228 Y229 Y234 T235 G236 V237 | I228-S232 PolarHBondContact O-N 3.17Å; Y229-S232 WeakPolarHBondContact O-CB 3.49Å; Y229-S232 PolarHBondContact O-N 3.02Å; S232-Y234 VanDerWaalsContact C-N 3.32Å; S232-Y234 PolarHBondContact O-N 3.38Å; S232-T235 WeakPolarHBondContact CA-OG1 3.46Å; S232-T235 CarbonylContact O-C 3.42Å; S232-T235 PolarHBondContact O-N 3.42Å; S232-T235 VanDerWaalsContact O-N 3.09Å; S232-T235 PolarHBondContact O-OG1 3.07Å; S232-G236 PolarHBondContact O-N 3.47Å; S232-V237 PolarHBondContact OG-O 3.2Å |
| 233 | L | 83.3 | Confident | 82.7 | Confident | 28 Ų | 28 | 54.4 Ų | 54.4 | 15% | 0.147 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.4 | -41.4 | 175.4 | -79.9 | 174.2 | 0 | 0 | 0 | 112.3 | W132 I133 I136 Y229 L231 T235 G236 | W132-L233 HydrophobicContact CB-CD2 4.36Å; I133-L233 HydrophobicContact CG1-CB 4.49Å; I133-L233 HydrophobicContact CG1-CD1 3.9Å; I136-L233 HydrophobicContact CD1-CD1 3.72Å; Y229-L233 HydrophobicContact CD1-CD1 3.71Å; Y229-L233 HydrophobicContact CD1-CG 3.87Å; Y229-L233 HydrophobicContact CE1-CD1 3.61Å; Y229-L233 HydrophobicContact CE1-CD2 4.05Å; Y229-L233 HydrophobicContact CE1-CG 3.6Å; Y229-L233 PolarHBondContact O-N 3.45Å; L231-L233 VanDerWaalsContact C-N 3.34Å; L231-L233 PolarHBondContact O-N 3.45Å; L233-T235 VanDerWaalsContact C-N 3.31Å; L233-T235 PolarHBondContact O-N 3.35Å; L233-G236 PolarHBondContact O-N 2.9Å |
| 234 | Y | 79.9 | Confident | 82.3 | Confident | 54 Ų | 54 | 58.3 Ų | 58.3 | 21% | 0.212 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -62.9 | -39 | 174.8 | 168 | -99.1 | 0 | 0 | 0 | 112 | I121 T175 L178 F230 L231 S232 G236 | I121-Y234 HydrophobicContact CG2-CE2 4.3Å; T175-Y234 HydrophobicContact CG2-CD1 3.79Å; T175-Y234 HydrophobicContact CG2-CD2 3.71Å; T175-Y234 HydrophobicContact CG2-CE1 3.57Å; T175-Y234 HydrophobicContact CG2-CE2 3.48Å; T175-Y234 VanDerWaalsContact CG2-CE2 3.48Å; T175-Y234 HydrophobicContact CG2-CG 3.86Å; T175-Y234 VanDerWaalsContact CG2-CZ 3.4Å; T175-Y234 PolarHBondContact O-OH 2.9Å; L178-Y234 HydrophobicContact CD2-CE1 4.48Å; F230-Y234 PolarHBondContact O-N 3.3Å; L231-Y234 HydrophobicContact CD1-CD1 4.33Å; L231-Y234 WeakPolarHBondContact O-CB 3.31Å; L231-Y234 PolarHBondContact O-N 3.41Å; L231-Y234 VanDerWaalsContact O-N 3.17Å; S232-Y234 VanDerWaalsContact C-N 3.32Å; S232-Y234 PolarHBondContact O-N 3.38Å; Y234-G236 VanDerWaalsContact C-N 3.26Å; Y234-G236 PolarHBondContact O-N 3.47Å |
| 235 | T | 75.8 | Confident | 81.8 | Confident | 53 Ų | 53 | 56.2 Ų | 56.2 | 33% | 0.325 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -76.8 | -9.5 | 178.2 | 54.2 | 0 | 0 | 0 | 0 | 114.2 | L231 S232 L233 V237 | L231-T235 PolarHBondContact O-N 3.19Å; L231-T235 PolarHBondContact O-OG1 3.01Å; S232-T235 WeakPolarHBondContact CA-OG1 3.46Å; S232-T235 CarbonylContact O-C 3.42Å; S232-T235 PolarHBondContact O-N 3.42Å; S232-T235 VanDerWaalsContact O-N 3.09Å; S232-T235 PolarHBondContact O-OG1 3.07Å; L233-T235 VanDerWaalsContact C-N 3.31Å; L233-T235 PolarHBondContact O-N 3.35Å; T235-V237 VanDerWaalsContact C-N 3.32Å; T235-V237 PolarHBondContact O-N 3.49Å |
| 236 | G | 64.6 | Low | 81.2 | Confident | 70 Ų | 70 | 53.7 Ų | 53.7 | 72% | 0.722 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70 | 22.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | S232 L233 Y234 | S232-G236 PolarHBondContact O-N 3.47Å; L233-G236 PolarHBondContact O-N 2.9Å; Y234-G236 VanDerWaalsContact C-N 3.26Å; Y234-G236 PolarHBondContact O-N 3.47Å |
| 237 | V | 48.8 | Very low | 80.2 | Confident | 166 Ų | 166 | 57.3 Ų | 57.3 | 100% | 1.006 | 34% | 0.337 | S | S | * | . | trans | -105.5 | 0 | 179.3 | -158.3 | 0 | 0 | 0 | 0 | 110.6 | S232 T235 | S232-V237 PolarHBondContact OG-O 3.2Å; T235-V237 VanDerWaalsContact C-N 3.32Å; T235-V237 PolarHBondContact O-N 3.49Å |
Retrieved 237 of 237 residues in 522.5 ms
(Link to these results)