| 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 | 43.3 | Very low | 38.5 | Very low | 250 Ų | 250 | 145.5 Ų | 145.5 | 100% | 1.232 | 84% | 0.838 | S | S | * | * | 0 | 111 | 0 | -60.9 | -167.5 | 98.3 | 0 | 0 | 106.6 | |||||
| 2 | S | 37.2 | Very low | 38.2 | Very low | 127 Ų | 127 | 143.8 Ų | 143.8 | 89% | 0.888 | 83% | 0.832 | S | S | * | * | trans | -98.2 | 139.1 | -160.4 | -161.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 3 | T | 44.7 | Very low | 37.7 | Very low | 140 Ų | 140 | 139.5 Ų | 139.5 | 86% | 0.859 | 82% | 0.823 | S | S | * | * | trans | -74 | 149.6 | 174.9 | 44.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 4 | G | 37.2 | Very low | 38 | Very low | 66 Ų | 66 | 141.4 Ų | 141.4 | 68% | 0.68 | 82% | 0.823 | S | S | * | * | trans | -168.9 | 122.5 | 169 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 5 | P | 42.9 | Very low | 37.8 | Very low | 124 Ų | 124 | 138.3 Ų | 138.3 | 81% | 0.805 | 81% | 0.81 | S | S | * | * | trans | -90.9 | 125.1 | 176 | 32.7 | -27.1 | 0 | 0 | 0 | 110.8 | Q7 | P5-Q7 PolarHBondContact O-N 2.96Å; P5-Q7 VanDerWaalsContact O-N 3.11Å | ||
| 6 | F | 38 | Very low | 38.3 | Very low | 215 Ų | 215 | 144.9 Ų | 144.9 | 94% | 0.943 | 82% | 0.817 | S | S | * | * | trans | -79 | 95.3 | 173.1 | -93.9 | -86.2 | 0 | 0 | 0 | 110.7 | G8 | F6-G8 PolarHBondContact O-N 2.9Š| ||
| 7 | Q | 39.5 | Very low | 38.7 | Very low | 187 Ų | 187 | 146.6 Ų | 146.6 | 87% | 0.874 | 81% | 0.813 | S | S | * | * | trans | -82.8 | 95.5 | 165.6 | -157.5 | 169.3 | 7.8 | 0 | 0 | 108.2 | P5 L9 | P5-Q7 PolarHBondContact O-N 2.96Å; P5-Q7 VanDerWaalsContact O-N 3.11Å; Q7-L9 PolarHBondContact O-N 3.34Å | ||
| 8 | G | 34.8 | Very low | 38.6 | Very low | 68 Ų | 68 | 148.8 Ų | 148.8 | 70% | 0.701 | 81% | 0.813 | S | S | * | * | trans | -88.8 | 91.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | F6 V10 | F6-G8 PolarHBondContact O-N 2.9Å; G8-V10 PolarHBondContact O-N 2.89Å; G8-V10 VanDerWaalsContact O-N 3.08Å | ||
| 9 | L | 34.7 | Very low | 38.7 | Very low | 140 Ų | 140 | 147.4 Ų | 147.4 | 73% | 0.733 | 81% | 0.814 | S | S | * | * | trans | -59.6 | 94 | 169.8 | -169.4 | 103.9 | 0 | 0 | 0 | 111.2 | Q7 Q11 | Q7-L9 PolarHBondContact O-N 3.34Å; L9-Q11 HydrophobicContact CD2-CB 3.85Å; L9-Q11 VanDerWaalsContact CD2-OE1 3.31Å; L9-Q11 HydrophobicContact CG-CB 4.28Å; L9-Q11 PolarHBondContact O-N 3.17Å | ||
| 10 | V | 36.3 | Very low | 38.8 | Very low | 127 Ų | 127 | 149.5 Ų | 149.5 | 77% | 0.77 | 82% | 0.815 | S | S | * | * | trans | -84.4 | 75.3 | 167.2 | -175 | 0 | 0 | 0 | 0 | 109 | G8 T12 | G8-V10 PolarHBondContact O-N 2.89Å; G8-V10 VanDerWaalsContact O-N 3.08Å; V10-T12 VanDerWaalsContact C-N 3.34Å; V10-T12 HydrophobicContact CG1-CG2 4.07Å; V10-T12 PolarHBondContact O-N 2.94Å | ||
| 11 | Q | 35.5 | Very low | 38.8 | Very low | 157 Ų | 157 | 150 Ų | 150 | 73% | 0.734 | 82% | 0.816 | S | S | * | * | trans | -66.4 | 90.8 | 162.8 | -171.5 | 170.3 | 12.1 | 0 | 0 | 107.9 | L9 A13 | L9-Q11 HydrophobicContact CD2-CB 3.85Å; L9-Q11 VanDerWaalsContact CD2-OE1 3.31Å; L9-Q11 HydrophobicContact CG-CB 4.28Å; L9-Q11 PolarHBondContact O-N 3.17Å; Q11-A13 PolarHBondContact O-N 3.13Å | ||
| 12 | T | 33.9 | Very low | 38.5 | Very low | 125 Ų | 125 | 146 Ų | 146 | 77% | 0.767 | 80% | 0.798 | S | S | * | * | trans | -73.6 | 97.9 | 171.5 | 32.5 | 0 | 0 | 0 | 0 | 108.8 | V10 M14 | V10-T12 VanDerWaalsContact C-N 3.34Å; V10-T12 HydrophobicContact CG1-CG2 4.07Å; V10-T12 PolarHBondContact O-N 2.94Å; T12-M14 PolarHBondContact O-N 2.94Å | ||
| 13 | A | 32.7 | Very low | 38.3 | Very low | 87 Ų | 87 | 145.9 Ų | 145.9 | 72% | 0.719 | 80% | 0.795 | S | S | * | * | trans | -46.5 | 123.2 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111 | Q11 | Q11-A13 PolarHBondContact O-N 3.13Š| ||
| 14 | M | 41.8 | Very low | 37.8 | Very low | 167 Ų | 167 | 151 Ų | 151 | 82% | 0.823 | 80% | 0.798 | S | S | * | * | trans | -61.4 | 126.5 | 167.5 | -71.2 | -79 | -79 | 0 | 0 | 109 | T12 R16 | T12-M14 PolarHBondContact O-N 2.94Å; M14-R16 PolarHBondContact O-N 3.08Å | ||
| 15 | P | 34.8 | Very low | 37.6 | Very low | 95 Ų | 95 | 153.6 Ų | 153.6 | 62% | 0.617 | 80% | 0.801 | S | S | * | * | trans | -76.9 | 112.9 | 176.7 | 29.7 | -31.8 | 0 | 0 | 0 | 110 | F17 | P15-F17 HydrophobicContact CB-CD2 3.57Å; P15-F17 HydrophobicContact CB-CE2 3.44Å; P15-F17 VanDerWaalsContact CB-CE2 3.44Å; P15-F17 HydrophobicContact CB-CZ 4.44Å; P15-F17 HydrophobicContact CG-CD2 4.01Å; P15-F17 HydrophobicContact CG-CE2 3.96Å; P15-F17 PolarHBondContact O-N 3.27Å | ||
| 16 | R | 45.8 | Very low | 37 | Very low | 244 Ų | 244 | 155.7 Ų | 155.7 | 92% | 0.921 | 81% | 0.806 | S | S | * | * | trans | -68.1 | 76.6 | 167.3 | -71.8 | 177.3 | 166.5 | 142.2 | -4.3 | 109.6 | M14 F18 | M14-R16 PolarHBondContact O-N 3.08Å; R16-F18 PolarHBondContact O-N 3.03Å | ||
| 17 | F | 44.6 | Very low | 36.8 | Very low | 174 Ų | 174 | 149.7 Ų | 149.7 | 76% | 0.763 | 80% | 0.796 | S | S | * | * | trans | -89.3 | 80.5 | 170.5 | -78.4 | -70.8 | 0 | 0 | 0 | 110.1 | P15 | P15-F17 HydrophobicContact CB-CD2 3.57Å; P15-F17 HydrophobicContact CB-CE2 3.44Å; P15-F17 VanDerWaalsContact CB-CE2 3.44Å; P15-F17 HydrophobicContact CB-CZ 4.44Å; P15-F17 HydrophobicContact CG-CD2 4.01Å; P15-F17 HydrophobicContact CG-CE2 3.96Å; P15-F17 PolarHBondContact O-N 3.27Å | ||
| 18 | F | 36.7 | Very low | 36.5 | Very low | 185 Ų | 185 | 145.9 Ų | 145.9 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -170.2 | 79.2 | 153.3 | -98.1 | -70.2 | 0 | 0 | 0 | 108 | R16 | R16-F18 PolarHBondContact O-N 3.03Š| ||
| 19 | C | 40.3 | Very low | 36.3 | Very low | 122 Ų | 122 | 149.9 Ų | 149.9 | 82% | 0.824 | 80% | 0.801 | S | S | * | * | trans | -134.3 | 58.1 | 166 | -81.8 | 0 | 0 | 0 | 0 | 108.6 | L21 | C19-L21 PolarHBondContact O-N 2.92Š| ||
| 20 | F | 41.2 | Very low | 36.3 | Very low | 189 Ų | 189 | 150.1 Ų | 150.1 | 83% | 0.829 | 81% | 0.808 | S | S | * | * | trans | -82.9 | 99.6 | 162.1 | -83.6 | -74.8 | 0 | 0 | 0 | 108.5 | ||||
| 21 | L | 38.2 | Very low | 35.9 | Very low | 160 Ų | 160 | 147.9 Ų | 147.9 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | trans | 3.2 | 116.3 | 144.3 | -63.4 | 158.3 | 0 | 0 | 0 | 116.1 | C19 | C19-L21 PolarHBondContact O-N 2.92Š| ||
| 22 | L | 37.6 | Very low | 35.6 | Very low | 166 Ų | 166 | 145.4 Ų | 145.4 | 87% | 0.869 | 81% | 0.809 | S | S | * | * | trans | -116.5 | 128.1 | 153.4 | -79.3 | 171.8 | 0 | 0 | 0 | 108.7 | ||||
| 23 | P | 32.8 | Very low | 35.3 | Very low | 125 Ų | 125 | 142.9 Ų | 142.9 | 81% | 0.812 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 161.1 | 166.3 | -16.9 | 30.9 | 0 | 0 | 0 | 112.8 | ||
| 24 | R | 34.4 | Very low | 35 | Very low | 247 Ų | 247 | 147.7 Ų | 147.7 | 93% | 0.932 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 151.7 | -163.1 | -171.4 | 179.6 | 170.3 | 99.1 | -1.6 | 112.9 | ||
| 25 | V | 33.9 | Very low | 34.5 | Very low | 121 Ų | 121 | 147.8 Ų | 147.8 | 73% | 0.733 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 148.3 | 176.2 | 169.6 | 0 | 0 | 0 | 0 | 113.9 | ||
| 26 | D | 29.8 | Very low | 34.8 | Very low | 169 Ų | 169 | 148.6 Ų | 148.6 | 90% | 0.904 | 82% | 0.821 | S | S | * | * | trans | -134.7 | 140.7 | 137 | -114 | -38.4 | 0 | 0 | 0 | 111.4 | ||||
| 27 | A | 33.6 | Very low | 33.9 | Very low | 89 Ų | 89 | 141.9 Ų | 141.9 | 74% | 0.736 | 81% | 0.812 | S | S | * | * | trans | -90.9 | 149.9 | -172 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 28 | A | 32.7 | Very low | 33.1 | Very low | 106 Ų | 106 | 139 Ų | 139 | 88% | 0.876 | 81% | 0.814 | S | S | * | * | trans | -140.4 | 118.3 | 156.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 29 | D | 30.5 | Very low | 32.7 | Very low | 153 Ų | 153 | 136 Ų | 136 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -87.2 | 125.7 | 176.5 | -157.5 | -24.1 | 0 | 0 | 0 | 107.6 | ||||
| 30 | V | 34.7 | Very low | 32 | Very low | 145 Ų | 145 | 135.3 Ų | 135.3 | 88% | 0.879 | 81% | 0.812 | S | S | * | * | trans | -144.7 | 122 | 159.2 | -177.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 31 | A | 29 | Very low | 31.1 | Very low | 79 Ų | 79 | 131.9 Ų | 131.9 | 65% | 0.653 | 81% | 0.812 | S | S | * | * | trans | -79.4 | 165.3 | -172.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 32 | A | 27.7 | Very low | 30.5 | Very low | 106 Ų | 106 | 129.3 Ų | 129.3 | 88% | 0.876 | 81% | 0.807 | S | S | * | * | trans | 71 | 129.1 | 141.7 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 33 | G | 27.6 | Very low | 30.1 | Very low | 72 Ų | 72 | 127.1 Ų | 127.1 | 74% | 0.742 | 81% | 0.805 | S | S | * | * | trans | 173.8 | 73.5 | 166.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 34 | Q | 28.4 | Very low | 29.8 | Very low | 187 Ų | 187 | 126.5 Ų | 126.5 | 87% | 0.874 | 80% | 0.804 | S | S | * | * | trans | 25 | 128.4 | 147.1 | -121.8 | 100.2 | -18.3 | 0 | 0 | 122.5 | ||||
| 35 | M | 29.5 | Very low | 29.6 | Very low | 169 Ų | 169 | 121.2 Ų | 121.2 | 83% | 0.833 | 80% | 0.799 | S | S | * | * | trans | -67.1 | 164.1 | 138.7 | -77.8 | -97.6 | -79.5 | 0 | 0 | 110 | ||||
| 36 | P | 41.4 | Very low | 29.3 | Very low | 112 Ų | 112 | 120.9 Ų | 120.9 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | cis | -136.3 | -169.2 | 39.1 | 37.1 | -13.2 | 0 | 0 | 0 | 111.2 | ||||
| 37 | S | 27.2 | Very low | 29.6 | Very low | 104 Ų | 104 | 118.6 Ų | 118.6 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | cis | -173.5 | 158 | 36.4 | 29.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 38 | S | 28.6 | Very low | 29.9 | Very low | 114 Ų | 114 | 119.6 Ų | 119.6 | 80% | 0.797 | 81% | 0.805 | S | S | * | * | trans | -34.5 | 143.9 | 163.7 | 49.6 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 39 | S | 27.1 | Very low | 29.8 | Very low | 120 Ų | 120 | 119 Ų | 119 | 84% | 0.839 | 80% | 0.801 | S | S | * | * | trans | -154.8 | 126.4 | 142.5 | 55.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 40 | S | 25.3 | Very low | 30 | Very low | 109 Ų | 109 | 115.3 Ų | 115.3 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | -78 | 175.5 | 177.1 | 44.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 41 | S | 23.7 | Very low | 30.2 | Very low | 117 Ų | 117 | 114 Ų | 114 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | 80.5 | 136.2 | 170.8 | 75.3 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 42 | S | 25.3 | Very low | 30.9 | Very low | 105 Ų | 105 | 115.1 Ų | 115.1 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | cis | -156.8 | 140.4 | 36 | 47.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 43 | S | 28.6 | Very low | 31.6 | Very low | 120 Ų | 120 | 112.8 Ų | 112.8 | 84% | 0.839 | 77% | 0.766 | S | S | * | * | trans | -58.1 | 132.9 | 159.3 | 48.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 44 | S | 26.5 | Very low | 32.7 | Very low | 113 Ų | 113 | 119.5 Ų | 119.5 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | trans | -141.8 | 99 | 157.3 | 60.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 45 | T | 30.5 | Very low | 33.7 | Very low | 135 Ų | 135 | 118 Ų | 118 | 83% | 0.828 | 77% | 0.773 | S | S | * | * | trans | -65 | 131.7 | 161.2 | 30.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 46 | S | 27.9 | Very low | 34.6 | Very low | 115 Ų | 115 | 111.3 Ų | 111.3 | 80% | 0.804 | 74% | 0.74 | S | S | * | * | trans | 173.7 | 158.9 | 144.6 | -79.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 47 | P | 36 | Very low | 34.8 | Very low | 121 Ų | 121 | 108.8 Ų | 108.8 | 79% | 0.786 | 74% | 0.735 | S | S | * | * | -117.5 | 177 | -66.2 | 24.3 | -3.5 | 0 | 0 | 0 | 110.9 | A49 | P47-A49 PolarHBondContact O-N 2.87Š| |||
| 48 | A | 39.8 | Very low | 35.6 | Very low | 109 Ų | 109 | 111.2 Ų | 111.2 | 90% | 0.901 | 73% | 0.732 | S | S | * | * | trans | -51.5 | 126.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 49 | A | 31.4 | Very low | 36.6 | Very low | 95 Ų | 95 | 109.9 Ų | 109.9 | 79% | 0.785 | 72% | 0.721 | S | S | * | * | trans | -129 | 133.9 | 159.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | P47 | P47-A49 PolarHBondContact O-N 2.87Š| ||
| 50 | G | 34.6 | Very low | 37.6 | Very low | 75 Ų | 75 | 111.3 Ų | 111.3 | 77% | 0.773 | 71% | 0.714 | S | S | * | * | trans | -43.4 | 134.3 | -167.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | L52 | G50-L52 PolarHBondContact O-N 3.49Š| ||
| 51 | S | 37.4 | Very low | 38.5 | Very low | 116 Ų | 116 | 111.4 Ų | 111.4 | 81% | 0.811 | 70% | 0.701 | S | S | * | * | trans | -55.5 | 106 | 179.7 | 51.6 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 52 | L | 44.1 | Very low | 39.8 | Very low | 104 Ų | 104 | 108.2 Ų | 108.2 | 55% | 0.545 | 68% | 0.677 | S | S | . | * | trans | -54.7 | 135.1 | 157.9 | -95.4 | 124.3 | 0 | 0 | 0 | 108.8 | G50 K54 I56 | G50-L52 PolarHBondContact O-N 3.49Å; L52-K54 PolarHBondContact O-N 3.22Å; L52-I56 HydrophobicContact CD2-CB 4.18Å; L52-I56 HydrophobicContact CD2-CG2 3.78Å | ||
| 53 | P | 43.3 | Very low | 41 | Very low | 57 Ų | 57 | 111 Ų | 111 | 37% | 0.37 | 68% | 0.684 | S | S | . | * | trans | -61.4 | 137.3 | 176.9 | 20.7 | -26.9 | 0 | 0 | 0 | 109.8 | N55 I56 W247 | P53-N55 PolarHBondContact O-N 2.89Å; P53-I56 HydrophobicContact CG-CD1 3.94Å; P53-I56 PolarHBondContact O-N 3.41Å; P53-W247 HydrophobicContact CB-CH2 4.35Å; P53-W247 HydrophobicContact CG-CE3 4.37Å; P53-W247 HydrophobicContact CG-CH2 3.4Å; P53-W247 VanDerWaalsContact CG-CH2 3.4Å; P53-W247 HydrophobicContact CG-CZ2 4.18Å; P53-W247 HydrophobicContact CG-CZ3 3.53Å | ||
| 54 | K | 50.3 | Low | 42.2 | Very low | 212 Ų | 212 | 109.1 Ų | 109.1 | 92% | 0.922 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.5 | -11.7 | -178.4 | -73.6 | 173.7 | 176.5 | 172 | 0 | 115 | L52 | L52-K54 PolarHBondContact O-N 3.22Š|
| 55 | N | 49 | Very low | 43.8 | Very low | 157 Ų | 157 | 104.5 Ų | 104.5 | 84% | 0.84 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.8 | -6.8 | 177.8 | -80.6 | -56.1 | 0 | 0 | 0 | 114.5 | P53 | P53-N55 PolarHBondContact O-N 2.89Š|
| 56 | I | 48.9 | Very low | 45.3 | Very low | 27 Ų | 27 | 105.5 Ų | 105.5 | 14% | 0.138 | 63% | 0.627 | C | S | . | * | S | Bend | trans | -100.3 | 96.9 | 167.3 | -80.3 | 79.8 | 0 | 0 | 0 | 105 | L52 P53 K58 W247 | L52-I56 HydrophobicContact CD2-CB 4.18Å; L52-I56 HydrophobicContact CD2-CG2 3.78Å; P53-I56 HydrophobicContact CG-CD1 3.94Å; P53-I56 PolarHBondContact O-N 3.41Å; I56-K58 PolarHBondContact O-N 3.44Å; I56-K58 VanDerWaalsContact O-N 3.13Å; I56-W247 HydrophobicContact CD1-CD2 3.51Å; I56-W247 HydrophobicContact CD1-CE3 4.15Å; I56-W247 HydrophobicContact CD1-CG 4.03Å; I56-W247 HydrophobicContact CD1-CH2 3.78Å; I56-W247 HydrophobicContact CD1-CZ2 3.08Å; I56-W247 HydrophobicContact CD1-CZ3 4.27Å; I56-W247 HydrophobicContact CG1-CD2 4.09Å; I56-W247 HydrophobicContact CG1-CG 4.09Å; I56-W247 HydrophobicContact CG1-CZ2 4.35Å |
| 57 | G | 44.6 | Very low | 46.9 | Very low | 60 Ų | 60 | 105.4 Ų | 105.4 | 62% | 0.619 | 61% | 0.613 | S | S | * | * | trans | -50.3 | 122.2 | 169.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 58 | K | 45.3 | Very low | 48.3 | Very low | 155 Ų | 155 | 100.7 Ų | 100.7 | 67% | 0.674 | 58% | 0.58 | S | S | * | * | trans | -54 | 147.4 | 170.5 | -75.4 | 176.8 | 174.9 | -175.5 | 0 | 108.8 | I56 E60 | I56-K58 PolarHBondContact O-N 3.44Å; I56-K58 VanDerWaalsContact O-N 3.13Å; K58-E60 PolarHBondContact O-N 3.37Å; K58-E60 VanDerWaalsContact O-N 3.14Å | ||
| 59 | P | 48.8 | Very low | 49.4 | Very low | 86 Ų | 86 | 98.3 Ų | 98.3 | 56% | 0.558 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -68.4 | -7.9 | 174.8 | 30.3 | -34.6 | 0 | 0 | 0 | 112.3 | Y240 | P59-Y240 HydrophobicContact CB-CD1 4.38Å; P59-Y240 HydrophobicContact CB-CD2 4.03Å; P59-Y240 HydrophobicContact CB-CE1 4.16Å; P59-Y240 HydrophobicContact CB-CE2 3.83Å; P59-Y240 HydrophobicContact CB-CG 4.3Å; P59-Y240 WeakPolarHBondContact CD-OH 3.43Å; P59-Y240 HydrophobicContact CG-CE1 3.97Å; P59-Y240 HydrophobicContact CG-CE2 3.86Å |
| 60 | E | 48.8 | Very low | 50.9 | Low | 149 Ų | 149 | 99.5 Ų | 99.5 | 70% | 0.696 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -81.5 | 129.3 | 170 | -76.1 | -174.9 | 141.2 | 0 | 0 | 110 | K58 | K58-E60 PolarHBondContact O-N 3.37Å; K58-E60 VanDerWaalsContact O-N 3.14Å |
| 61 | F | 43.1 | Very low | 52.3 | Low | 111 Ų | 111 | 101.7 Ų | 101.7 | 49% | 0.487 | 53% | 0.533 | S | S | . | . | trans | -32.7 | 121 | 175.1 | -57.9 | -68.3 | 0 | 0 | 0 | 110.3 | D63 N172 | F61-D63 PolarHBondContact O-N 3.34Å; F61-N172 WeakPolarHBondContact CD1-ND2 3.2Å; F61-N172 WeakPolarHBondContact CD1-OD1 3.22Å; F61-N172 VanDerWaalsContact CE1-CG 3.46Å; F61-N172 VanDerWaalsContact CE1-ND2 3.26Å; F61-N172 WeakPolarHBondContact CE1-ND2 3.29Å; F61-N172 WeakPolarHBondContact CE1-OD1 3.48Å; F61-N172 VanDerWaalsContact CG-ND2 3.27Å; F61-N172 WeakPolarHBondContact CG-ND2 3.36Å | ||
| 62 | P | 51.3 | Low | 53.4 | Low | 50 Ų | 50 | 98 Ų | 98 | 33% | 0.325 | 50% | 0.504 | S | S | . | . | trans | -55.2 | 118.6 | 163 | 22.1 | -29.9 | 0 | 0 | 0 | 105.6 | T64 Q67 R68 | P62-T64 PolarHBondContact O-N 2.96Å; P62-Q67 HydrophobicContact CB-CB 4.16Å; P62-R68 HydrophobicContact CG-CB 4.27Å; P62-R68 HydrophobicContact CG-CG 4.12Å | ||
| 63 | D | 50.4 | Low | 54 | Low | 165 Ų | 165 | 101.7 Ų | 101.7 | 88% | 0.882 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -58.5 | -10.2 | -169.5 | -63.8 | -46.7 | 0 | 0 | 0 | 112.9 | F61 | F61-D63 PolarHBondContact O-N 3.34Š|
| 64 | T | 55.2 | Low | 54.6 | Low | 80 Ų | 80 | 105.3 Ų | 105.3 | 49% | 0.491 | 53% | 0.532 | S | S | . | . | S | Bend | trans | -113.8 | 112.5 | -179 | -51.4 | 0 | 0 | 0 | 0 | 111.5 | P62 W66 Q67 | P62-T64 PolarHBondContact O-N 2.96Å; T64-W66 HydrophobicContact CG2-CB 4.27Å; T64-W66 PolarHBondContact O-N 2.8Å; T64-Q67 PolarHBondContact O-N 2.87Å |
| 65 | G | 58.8 | Low | 54.4 | Low | 16 Ų | 16 | 105.3 Ų | 105.3 | 17% | 0.165 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -55.7 | -18.8 | -177.9 | 0 | 0 | 0 | 0 | 0 | 116 | R68 I69 | G65-R68 WeakPolarHBondContact O-CB 3.35Å; G65-I69 WeakPolarHBondContact O-CG1 3.39Å; G65-I69 PolarHBondContact O-N 3.05Å |
| 66 | W | 61.5 | Low | 54.3 | Low | 155 Ų | 155 | 102.7 Ų | 102.7 | 59% | 0.587 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -73 | -37.5 | 175.5 | -174.5 | -120.7 | 0 | 0 | 0 | 113.8 | T64 R68 I69 K70 | T64-W66 HydrophobicContact CG2-CB 4.27Å; T64-W66 PolarHBondContact O-N 2.8Å; W66-R68 PolarHBondContact O-N 2.94Å; W66-I69 HydrophobicContact CE3-CD1 4.33Å; W66-I69 PolarHBondContact O-N 2.94Å; W66-K70 PolarHBondContact O-N 3.4Å |
| 67 | Q | 62.5 | Low | 54.2 | Low | 113 Ų | 113 | 110.9 Ų | 110.9 | 53% | 0.528 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -65.6 | -31.7 | 176.2 | -73.9 | 179.1 | -11.9 | 0 | 0 | 110.8 | P62 T64 K70 D71 | P62-Q67 HydrophobicContact CB-CB 4.16Å; T64-Q67 PolarHBondContact O-N 2.87Å; Q67-K70 PolarHBondContact O-N 2.81Å; Q67-D71 WeakPolarHBondContact O-CB 3.33Å; Q67-D71 PolarHBondContact O-N 3.46Å |
| 68 | R | 65 | Low | 54.1 | Low | 23 Ų | 23 | 115.8 Ų | 115.8 | 9% | 0.087 | 56% | 0.559 | C | S | . | * | H | α-helix | trans | -71.1 | -31.7 | 178.6 | -141.3 | 176.2 | -171.3 | -155.1 | 1.8 | 114.6 | P62 G65 W66 I72 V169 N172 | P62-R68 HydrophobicContact CG-CB 4.27Å; P62-R68 HydrophobicContact CG-CG 4.12Å; G65-R68 WeakPolarHBondContact O-CB 3.35Å; W66-R68 PolarHBondContact O-N 2.94Å; R68-I72 WeakPolarHBondContact O-CD1 3.4Å; R68-I72 WeakPolarHBondContact O-CG1 3.27Å; R68-V169 HydrophobicContact CB-CG1 3.73Å; R68-V169 WeakPolarHBondContact CD-O 3.24Å; R68-V169 HydrophobicContact CG-CG1 3.51Å; R68-V169 PolarHBondContact NH1-O 2.79Å; R68-N172 VanDerWaalsContact CZ-OD1 3.26Å; R68-N172 PolarHBondContact NH1-ND2 3.13Å; R68-N172 PolarHBondContact NH1-OD1 3.44Å; R68-N172 PolarHBondContact NH2-OD1 2.94Å; R68-N172 VanDerWaalsContact NH2-OD1 3.07Å |
| 69 | I | 63.7 | Low | 53.9 | Low | 58 Ų | 58 | 116.7 Ų | 116.7 | 30% | 0.297 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -72.2 | -37.8 | 172.9 | -67 | 166.9 | 0 | 0 | 0 | 110 | G65 W66 I72 F73 Y170 | G65-I69 WeakPolarHBondContact O-CG1 3.39Å; G65-I69 PolarHBondContact O-N 3.05Å; W66-I69 HydrophobicContact CE3-CD1 4.33Å; W66-I69 PolarHBondContact O-N 2.94Å; I69-I72 PolarHBondContact O-N 3.29Å; I69-F73 PolarHBondContact O-N 3.26Å; I69-Y170 HydrophobicContact CD1-CD2 4.21Å |
| 70 | K | 62.8 | Low | 53.7 | Low | 120 Ų | 120 | 123 Ų | 123 | 52% | 0.522 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66 | -40.6 | 175.3 | -71.7 | -174 | -162.5 | 176.2 | 0 | 112.3 | W66 Q67 I72 F73 D74 | W66-K70 PolarHBondContact O-N 3.4Å; Q67-K70 PolarHBondContact O-N 2.81Å; K70-I72 PolarHBondContact O-N 3.45Å; K70-F73 CarbonylContact O-C 3.53Å; K70-F73 PolarHBondContact O-N 3.21Å; K70-D74 PolarHBondContact O-N 2.91Å |
| 71 | D | 63.3 | Low | 53.4 | Low | 122 Ų | 122 | 119.6 Ų | 119.6 | 65% | 0.652 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -60.1 | -27.6 | 179.2 | -166.5 | 54.6 | 0 | 0 | 0 | 113.2 | Q67 | Q67-D71 WeakPolarHBondContact O-CB 3.33Å; Q67-D71 PolarHBondContact O-N 3.46Å |
| 72 | I | 61.5 | Low | 54.2 | Low | 38 Ų | 38 | 116.6 Ų | 116.6 | 20% | 0.195 | 56% | 0.562 | C | S | . | * | H | α-helix | trans | -79.1 | -28.7 | 175.3 | -64.8 | 162.8 | 0 | 0 | 0 | 112.2 | R68 I69 K70 E84 V169 | R68-I72 WeakPolarHBondContact O-CD1 3.4Å; R68-I72 WeakPolarHBondContact O-CG1 3.27Å; I69-I72 PolarHBondContact O-N 3.29Å; K70-I72 PolarHBondContact O-N 3.45Å; I72-E84 VanDerWaalsContact CD1-OE2 3.22Å; I72-E84 WeakPolarHBondContact CD1-OE2 3.27Å; I72-E84 WeakPolarHBondContact CG1-OE2 3.48Å; I72-V169 HydrophobicContact CD1-CB 4.01Å; I72-V169 HydrophobicContact CD1-CG1 3.62Å; I72-V169 HydrophobicContact CD1-CG2 3.48Å; I72-V169 VanDerWaalsContact CD1-CG2 3.48Å |
| 73 | F | 56.8 | Low | 54.6 | Low | 182 Ų | 182 | 119.8 Ų | 119.8 | 80% | 0.798 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -93.5 | -19.2 | -178 | -126.7 | -89.7 | 0 | 0 | 0 | 112.7 | I69 K70 R75 | I69-F73 PolarHBondContact O-N 3.26Å; K70-F73 CarbonylContact O-C 3.53Å; K70-F73 PolarHBondContact O-N 3.21Å; F73-R75 PolarHBondContact O-N 2.94Å |
| 74 | D | 54.6 | Low | 55.2 | Low | 133 Ų | 133 | 112.9 Ų | 112.9 | 71% | 0.711 | 54% | 0.535 | S | S | * | . | S | Bend | trans | -69.1 | 117.1 | 174 | -145 | 0 | 0 | 0 | 0 | 108.1 | K70 D76 | K70-D74 PolarHBondContact O-N 2.91Å; D74-D76 PolarHBondContact O-N 3.43Å; D74-D76 VanDerWaalsContact O-N 3.12Å |
| 75 | R | 45.7 | Very low | 55.5 | Low | 212 Ų | 212 | 112.2 Ų | 112.2 | 80% | 0.8 | 53% | 0.53 | S | S | * | . | trans | -85 | 96.1 | -169.2 | -177 | 166.4 | 146.3 | 164.9 | -6.2 | 105.7 | F73 E77 | F73-R75 PolarHBondContact O-N 2.94Å; R75-E77 PolarHBondContact O-N 2.9Å | ||
| 76 | D | 48.8 | Very low | 55.7 | Low | 101 Ų | 101 | 114.8 Ų | 114.8 | 54% | 0.54 | 54% | 0.539 | S | S | . | . | trans | -43.4 | 126 | 177.2 | -131.8 | -20.7 | 0 | 0 | 0 | 108.2 | D74 M78 Q79 K243 | D74-D76 PolarHBondContact O-N 3.43Å; D74-D76 VanDerWaalsContact O-N 3.12Å; D76-M78 PolarHBondContact O-N 3.48Å; D76-Q79 PolarHBondContact O-N 3.38Å; D76-K243 IonicContact OD2-NZ 3.68Å | ||
| 77 | E | 46.1 | Very low | 56 | Low | 199 Ų | 199 | 110.8 Ų | 110.8 | 93% | 0.93 | 53% | 0.532 | S | S | * | . | S | Bend | trans | -55.5 | -12.5 | -167.4 | -71.1 | -178.7 | 148.7 | 0 | 0 | 113.3 | R75 | R75-E77 PolarHBondContact O-N 2.9Š|
| 78 | M | 41.5 | Very low | 56.4 | Low | 164 Ų | 164 | 106.5 Ų | 106.5 | 81% | 0.808 | 51% | 0.513 | S | S | * | . | S | Bend | trans | -96.7 | 39.1 | 179.5 | -117 | 157.6 | -179.3 | 0 | 0 | 114.5 | D76 R80 | D76-M78 PolarHBondContact O-N 3.48Å; M78-R80 PolarHBondContact O-N 2.99Å |
| 79 | Q | 41.4 | Very low | 56.6 | Low | 173 Ų | 173 | 110.5 Ų | 110.5 | 81% | 0.808 | 53% | 0.534 | S | S | * | . | trans | 49.2 | 9 | 164.5 | -66.4 | -166.7 | -2.2 | 0 | 0 | 118.6 | D76 P81 | D76-Q79 PolarHBondContact O-N 3.38Å; Q79-P81 VanDerWaalsContact O-CD 3.24Å; Q79-P81 WeakPolarHBondContact O-CD 3.47Å | ||
| 80 | R | 44.3 | Very low | 57 | Low | 218 Ų | 218 | 114.1 Ų | 114.1 | 82% | 0.823 | 55% | 0.548 | S | S | * | . | trans | -88.8 | 109.4 | 175.6 | -80.1 | -169.1 | 177.7 | -176.2 | 2.8 | 108.1 | M78 S82 | M78-R80 PolarHBondContact O-N 2.99Å; R80-S82 PolarHBondContact O-N 3.06Å | ||
| 81 | P | 44.2 | Very low | 57.5 | Low | 78 Ų | 78 | 111.1 Ų | 111.1 | 51% | 0.506 | 54% | 0.541 | S | S | . | . | trans | -59.2 | 129.5 | 172.5 | 25.4 | -32.7 | 0 | 0 | 0 | 108.4 | Q79 E83 M86 | Q79-P81 VanDerWaalsContact O-CD 3.24Å; Q79-P81 WeakPolarHBondContact O-CD 3.47Å; P81-E83 PolarHBondContact O-N 3.06Å; P81-M86 HydrophobicContact CG-CE 3.6Å | ||
| 82 | S | 58.2 | Low | 58 | Low | 49 Ų | 49 | 105.6 Ų | 105.6 | 34% | 0.343 | 51% | 0.513 | S | S | . | . | trans | -45.2 | 131.8 | 178.7 | 176.1 | 0 | 0 | 0 | 0 | 110.5 | R80 E84 V85 M86 | R80-S82 PolarHBondContact O-N 3.06Å; S82-E84 PolarHBondContact O-N 3.32Å; S82-V85 PolarHBondContact O-N 3.31Å; S82-M86 PolarHBondContact O-N 3.36Å; S82-M86 VanDerWaalsContact O-N 3.15Å | ||
| 83 | E | 60.8 | Low | 58.8 | Low | 116 Ų | 116 | 108.3 Ų | 108.3 | 54% | 0.542 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -55.9 | -25.1 | -176.5 | -64.5 | -167.6 | 153.6 | 0 | 0 | 112.4 | P81 T87 | P81-E83 PolarHBondContact O-N 3.06Å; E83-T87 VanDerWaalsContact O-CB 3.3Å; E83-T87 WeakPolarHBondContact O-CB 3.34Å; E83-T87 PolarHBondContact O-N 3.42Å; E83-T87 PolarHBondContact O-OG1 3.31Å |
| 84 | E | 61.8 | Low | 60 | Low | 21 Ų | 21 | 105.3 Ų | 105.3 | 10% | 0.098 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -64.2 | -45.6 | 173.7 | -62.8 | -168.5 | 171.9 | 0 | 0 | 111.8 | I72 S82 T87 V88 T165 R232 R236 | I72-E84 VanDerWaalsContact CD1-OE2 3.22Å; I72-E84 WeakPolarHBondContact CD1-OE2 3.27Å; I72-E84 WeakPolarHBondContact CG1-OE2 3.48Å; S82-E84 PolarHBondContact O-N 3.32Å; E84-T87 PolarHBondContact O-N 3.43Å; E84-V88 VanDerWaalsContact O-CG2 3.25Å; E84-V88 WeakPolarHBondContact O-CG2 3.4Å; E84-V88 PolarHBondContact O-N 3.32Å; E84-T165 HydrophobicContact CB-CG2 4.36Å; E84-R232 VanDerWaalsContact CD-NH2 3.27Å; E84-R232 IonicContact OE1-CZ 3.93Å; E84-R232 IonicContact OE1-NE 3.93Å; E84-R232 IonicContact OE1-NH2 3.85Å; E84-R232 PolarHBondContact OE1-NH2 2.95Å; E84-R236 IonicContact OE1-CZ 3.61Å; E84-R236 IonicContact OE1-NH1 3.64Å; E84-R236 IonicContact OE1-NH2 3.15Å; E84-R236 PolarHBondContact OE1-NH2 2.96Å; E84-R236 VanDerWaalsContact OE1-NH2 3.15Å |
| 85 | V | 61.7 | Low | 61.1 | Low | 65 Ų | 65 | 99.5 Ų | 99.5 | 39% | 0.394 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69.1 | -40.2 | 178.6 | -178.4 | 0 | 0 | 0 | 0 | 110.7 | S82 T87 V88 M89 | S82-V85 PolarHBondContact O-N 3.31Å; V85-T87 VanDerWaalsContact C-N 3.32Å; V85-T87 PolarHBondContact O-N 3Å; V85-V88 PolarHBondContact O-N 3.2Å; V85-M89 WeakPolarHBondContact O-CB 3.44Å; V85-M89 PolarHBondContact O-N 3.16Å |
| 86 | M | 63.4 | Low | 62.8 | Low | 71 Ų | 71 | 90.4 Ų | 90.4 | 35% | 0.35 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.6 | -39.2 | 175.8 | -173.9 | 63.6 | 67.7 | 0 | 0 | 111.6 | P81 S82 M89 K90 | P81-M86 HydrophobicContact CG-CE 3.6Å; S82-M86 PolarHBondContact O-N 3.36Å; S82-M86 VanDerWaalsContact O-N 3.15Å; M86-M89 PolarHBondContact O-N 3.37Å; M86-K90 VanDerWaalsContact O-CG 3.31Å; M86-K90 WeakPolarHBondContact O-CG 3.32Å; M86-K90 PolarHBondContact O-N 3.05Å |
| 87 | T | 67.6 | Low | 64.6 | Low | 70 Ų | 70 | 91.9 Ų | 91.9 | 43% | 0.429 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -67.8 | -43.2 | 176.1 | -58.3 | 0 | 0 | 0 | 0 | 111.2 | E83 E84 V85 M89 K90 C91 | E83-T87 VanDerWaalsContact O-CB 3.3Å; E83-T87 WeakPolarHBondContact O-CB 3.34Å; E83-T87 PolarHBondContact O-N 3.42Å; E83-T87 PolarHBondContact O-OG1 3.31Å; E84-T87 PolarHBondContact O-N 3.43Å; V85-T87 VanDerWaalsContact C-N 3.32Å; V85-T87 PolarHBondContact O-N 3Å; T87-M89 VanDerWaalsContact C-N 3.3Å; T87-M89 PolarHBondContact O-N 2.96Å; T87-K90 PolarHBondContact O-N 3.35Å; T87-C91 PolarHBondContact O-N 3.24Å; T87-C91 PolarHBondContact O-SG 2.83Å; T87-C91 VanDerWaalsContact O-SG 3.33Å |
| 88 | V | 72 | Confident | 66.5 | Low | 24 Ų | 24 | 86.7 Ų | 86.7 | 15% | 0.145 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -59.3 | -42 | 173.2 | 169.8 | 0 | 0 | 0 | 0 | 111.1 | E84 V85 C91 G92 | E84-V88 VanDerWaalsContact O-CG2 3.25Å; E84-V88 WeakPolarHBondContact O-CG2 3.4Å; E84-V88 PolarHBondContact O-N 3.32Å; V85-V88 PolarHBondContact O-N 3.2Å; V88-C91 PolarHBondContact O-N 2.94Å; V88-G92 PolarHBondContact O-N 3.44Å |
| 89 | M | 68.2 | Low | 68.5 | Low | 107 Ų | 107 | 79 Ų | 79 | 53% | 0.527 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.8 | -44.5 | 176.5 | -170.9 | -176 | -66.5 | 0 | 0 | 111.8 | V85 M86 T87 C91 G92 I93 | V85-M89 WeakPolarHBondContact O-CB 3.44Å; V85-M89 PolarHBondContact O-N 3.16Å; M86-M89 PolarHBondContact O-N 3.37Å; T87-M89 VanDerWaalsContact C-N 3.3Å; T87-M89 PolarHBondContact O-N 2.96Å; M89-C91 PolarHBondContact O-N 3.4Å; M89-G92 PolarHBondContact O-N 2.98Å; M89-I93 HydrophobicContact CG-CD1 4.14Å; M89-I93 WeakPolarHBondContact O-CG1 3.37Å; M89-I93 PolarHBondContact O-N 3.3Å |
| 90 | K | 72.6 | Confident | 70.6 | Confident | 134 Ų | 134 | 73 Ų | 73 | 58% | 0.583 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -60.7 | -43 | 175.1 | -73.7 | 171.9 | -179.8 | 176.1 | 0 | 111.8 | M86 T87 I93 L94 | M86-K90 VanDerWaalsContact O-CG 3.31Å; M86-K90 WeakPolarHBondContact O-CG 3.32Å; M86-K90 PolarHBondContact O-N 3.05Å; T87-K90 PolarHBondContact O-N 3.35Å; K90-I93 PolarHBondContact O-N 3.22Å; K90-L94 WeakPolarHBondContact O-CB 3.17Å; K90-L94 PolarHBondContact O-N 2.93Å |
| 91 | C | 72.2 | Confident | 72.6 | Confident | 57 Ų | 57 | 66.6 Ų | 66.6 | 39% | 0.385 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.1 | -40.3 | 174 | -69 | 0 | 0 | 0 | 0 | 112.2 | T87 V88 M89 L94 G95 | T87-C91 PolarHBondContact O-N 3.24Å; T87-C91 PolarHBondContact O-SG 2.83Å; T87-C91 VanDerWaalsContact O-SG 3.33Å; V88-C91 PolarHBondContact O-N 2.94Å; M89-C91 PolarHBondContact O-N 3.4Å; C91-L94 PolarHBondContact O-N 3.13Å; C91-G95 PolarHBondContact O-N 3.01Å |
| 92 | G | 75.7 | Confident | 74.5 | Confident | 5 Ų | 5 | 71 Ų | 71 | 5% | 0.052 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61 | -45.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | V88 M89 G95 A96 | V88-G92 PolarHBondContact O-N 3.44Å; M89-G92 PolarHBondContact O-N 2.98Å; G92-G95 PolarHBondContact O-N 3.02Å; G92-A96 WeakPolarHBondContact O-CB 3.4Å; G92-A96 PolarHBondContact O-N 3.05Å |
| 93 | I | 76.8 | Confident | 75.7 | Confident | 95 Ų | 95 | 69.2 Ų | 69.2 | 49% | 0.487 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64.4 | -43.6 | 177.1 | -65.5 | 163.5 | 0 | 0 | 0 | 110.8 | M89 K90 A96 F97 | M89-I93 HydrophobicContact CG-CD1 4.14Å; M89-I93 WeakPolarHBondContact O-CG1 3.37Å; M89-I93 PolarHBondContact O-N 3.3Å; K90-I93 PolarHBondContact O-N 3.22Å; I93-A96 WeakPolarHBondContact O-CB 3.24Å; I93-A96 PolarHBondContact O-N 3.49Å; I93-F97 HydrophobicContact CG2-CD2 4.39Å; I93-F97 PolarHBondContact O-N 3.24Å |
| 94 | L | 82.1 | Confident | 76.7 | Confident | 119 Ų | 119 | 63.7 Ų | 63.7 | 62% | 0.623 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -62.8 | -44.5 | 177.4 | -171.3 | 64.3 | 0 | 0 | 0 | 111 | K90 C91 A96 F97 T98 | K90-L94 WeakPolarHBondContact O-CB 3.17Å; K90-L94 PolarHBondContact O-N 2.93Å; C91-L94 PolarHBondContact O-N 3.13Å; L94-A96 PolarHBondContact O-N 2.88Å; L94-F97 WeakPolarHBondContact O-CB 3.32Å; L94-F97 PolarHBondContact O-N 3.06Å; L94-T98 PolarHBondContact O-N 2.87Å; L94-T98 PolarHBondContact O-OG1 2.81Å; L94-T98 VanDerWaalsContact O-OG1 3.07Å |
| 95 | G | 78.4 | Confident | 77.6 | Confident | 12 Ų | 12 | 67.3 Ų | 67.3 | 12% | 0.124 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -62.6 | -39.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | C91 G92 F97 T98 G99 V153 | C91-G95 PolarHBondContact O-N 3.01Å; G92-G95 PolarHBondContact O-N 3.02Å; G95-F97 VanDerWaalsContact C-N 3.32Å; G95-F97 PolarHBondContact O-N 3.42Å; G95-T98 PolarHBondContact O-N 2.8Å; G95-G99 PolarHBondContact O-N 3.16Å; G95-V153 WeakPolarHBondContact O-CG1 3.49Å |
| 96 | A | 80.9 | Confident | 78.3 | Confident | 20 Ų | 20 | 67.4 Ų | 67.4 | 17% | 0.165 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62 | -40.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | G92 I93 L94 F100 S150 | G92-A96 WeakPolarHBondContact O-CB 3.4Å; G92-A96 PolarHBondContact O-N 3.05Å; I93-A96 WeakPolarHBondContact O-CB 3.24Å; I93-A96 PolarHBondContact O-N 3.49Å; L94-A96 PolarHBondContact O-N 2.88Å; A96-F100 VanDerWaalsContact O-CB 3.23Å; A96-F100 WeakPolarHBondContact O-CB 3.27Å; A96-F100 PolarHBondContact O-N 3.31Å; A96-S150 PolarHBondContact O-OG 2.87Å |
| 97 | F | 86.3 | Confident | 78.8 | Confident | 133 Ų | 133 | 64.6 Ų | 64.6 | 58% | 0.583 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -65 | -49.4 | 174.4 | -107.4 | -86.3 | 0 | 0 | 0 | 111.6 | I93 L94 G95 G99 F100 L101 | I93-F97 HydrophobicContact CG2-CD2 4.39Å; I93-F97 PolarHBondContact O-N 3.24Å; L94-F97 WeakPolarHBondContact O-CB 3.32Å; L94-F97 PolarHBondContact O-N 3.06Å; G95-F97 VanDerWaalsContact C-N 3.32Å; G95-F97 PolarHBondContact O-N 3.42Å; F97-G99 VanDerWaalsContact C-N 3.32Å; F97-G99 PolarHBondContact O-N 2.79Å; F97-F100 WeakPolarHBondContact O-CB 3.26Å; F97-F100 PolarHBondContact O-N 2.81Å; F97-L101 HydrophobicContact CD1-CD1 4.04Å; F97-L101 WeakPolarHBondContact O-CD1 3.3Å; F97-L101 PolarHBondContact O-N 2.8Å |
| 98 | T | 86.4 | Confident | 78.9 | Confident | 90 Ų | 90 | 62.5 Ų | 62.5 | 55% | 0.552 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -59.7 | -43.2 | 177.5 | -54 | 0 | 0 | 0 | 0 | 111.5 | L94 G95 F100 L101 Y102 | L94-T98 PolarHBondContact O-N 2.87Å; L94-T98 PolarHBondContact O-OG1 2.81Å; L94-T98 VanDerWaalsContact O-OG1 3.07Å; G95-T98 PolarHBondContact O-N 2.8Å; T98-F100 PolarHBondContact O-N 2.83Å; T98-L101 PolarHBondContact O-N 3.01Å; T98-Y102 VanDerWaalsContact O-CB 3.25Å; T98-Y102 WeakPolarHBondContact O-CB 3.48Å; T98-Y102 PolarHBondContact O-N 2.83Å |
| 99 | G | 83.9 | Confident | 78.8 | Confident | 3 Ų | 3 | 70.1 Ų | 70.1 | 3% | 0.031 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -66.2 | -35 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | G95 F97 G103 | G95-G99 PolarHBondContact O-N 3.16Å; F97-G99 VanDerWaalsContact C-N 3.32Å; F97-G99 PolarHBondContact O-N 2.79Å; G99-G103 PolarHBondContact O-N 2.8Å |
| 100 | F | 85 | Confident | 79.1 | Confident | 46 Ų | 46 | 69.2 Ų | 69.2 | 20% | 0.202 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -67.8 | -45.3 | 175.1 | -177.1 | -102.4 | 0 | 0 | 0 | 111.8 | A96 F97 T98 G104 F142 L143 G146 | A96-F100 VanDerWaalsContact O-CB 3.23Å; A96-F100 WeakPolarHBondContact O-CB 3.27Å; A96-F100 PolarHBondContact O-N 3.31Å; F97-F100 WeakPolarHBondContact O-CB 3.26Å; F97-F100 PolarHBondContact O-N 2.81Å; T98-F100 PolarHBondContact O-N 2.83Å; F100-G104 WeakPolarHBondContact O-CA 3.5Å; F100-G104 PolarHBondContact O-N 2.89Å; F100-F142 HydrophobicContact CD1-CE1 4.18Å; F100-F142 HydrophobicContact CD1-CZ 4.02Å; F100-F142 HydrophobicContact CE1-CD1 4.2Å; F100-F142 AromaticContact CE1-CE1 3.2Å; F100-F142 HydrophobicContact CE1-CE1 3.2Å; F100-F142 AromaticContact CE1-CZ 3.48Å; F100-F142 HydrophobicContact CE1-CZ 3.48Å; F100-F142 VanDerWaalsContact CE1-CZ 3.48Å; F100-F142 AromaticContact CZ-CD1 3.99Å; F100-F142 HydrophobicContact CZ-CD1 3.99Å; F100-F142 AromaticContact CZ-CE1 3.43Å; F100-F142 HydrophobicContact CZ-CE1 3.43Å; F100-F142 VanDerWaalsContact CZ-CE1 3.43Å; F100-F142 HydrophobicContact CZ-CZ 4.05Å; F100-L143 HydrophobicContact CZ-CD1 4.15Å; F100-G146 VanDerWaalsContact CD2-C 3.44Å |
| 101 | L | 85.7 | Confident | 78.9 | Confident | 83 Ų | 83 | 64.2 Ų | 64.2 | 44% | 0.435 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.4 | -47.5 | 175.4 | -89.1 | 79.4 | 0 | 0 | 0 | 111.1 | F97 T98 G103 G104 L105 | F97-L101 HydrophobicContact CD1-CD1 4.04Å; F97-L101 WeakPolarHBondContact O-CD1 3.3Å; F97-L101 PolarHBondContact O-N 2.8Å; T98-L101 PolarHBondContact O-N 3.01Å; L101-G103 PolarHBondContact O-N 3.33Å; L101-G104 PolarHBondContact O-N 2.82Å; L101-L105 HydrophobicContact CB-CD1 4.42Å; L101-L105 WeakPolarHBondContact O-CB 2.94Å; L101-L105 WeakPolarHBondContact O-CD1 3.17Å; L101-L105 WeakPolarHBondContact O-CG 3.27Å; L101-L105 PolarHBondContact O-N 3.28Å |
| 102 | Y | 85.8 | Confident | 78.5 | Confident | 172 Ų | 172 | 68.8 Ų | 68.8 | 68% | 0.675 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -61.3 | -41.9 | -179.7 | -176.4 | -99.5 | 0 | 0 | 0 | 112.4 | T98 P106 | T98-Y102 VanDerWaalsContact O-CB 3.25Å; T98-Y102 WeakPolarHBondContact O-CB 3.48Å; T98-Y102 PolarHBondContact O-N 2.83Å; Y102-P106 WeakPolarHBondContact O-CD 3.31Å; Y102-P106 WeakPolarHBondContact O-CG 3.27Å |
| 103 | G | 82.9 | Confident | 78.1 | Confident | 10 Ų | 10 | 74.2 Ų | 74.2 | 10% | 0.103 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -77.7 | -28.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | G99 L101 | G99-G103 PolarHBondContact O-N 2.8Å; L101-G103 PolarHBondContact O-N 3.33Å |
| 104 | G | 81.9 | Confident | 77.7 | Confident | 0 Ų | 0 | 77 Ų | 77 | 0% | 0 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -83.8 | -42.8 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | F100 L101 A107 A108 F142 | F100-G104 WeakPolarHBondContact O-CA 3.5Å; F100-G104 PolarHBondContact O-N 2.89Å; L101-G104 PolarHBondContact O-N 2.82Å; G104-A107 PolarHBondContact O-N 3.49Å; G104-A108 PolarHBondContact O-N 3.36Å; G104-F142 VanDerWaalsContact C-CE2 3.49Å; G104-F142 VanDerWaalsContact CA-CE2 3.46Å; G104-F142 VanDerWaalsContact O-CD2 3.31Å; G104-F142 WeakPolarHBondContact O-CD2 3.5Å |
| 105 | L | 79.2 | Confident | 76.9 | Confident | 97 Ų | 97 | 73.5 Ų | 73.5 | 51% | 0.508 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -54.6 | -50 | -177.4 | -81.9 | 158.7 | 0 | 0 | 0 | 114.7 | L101 A107 A108 R109 | L101-L105 HydrophobicContact CB-CD1 4.42Å; L101-L105 WeakPolarHBondContact O-CB 2.94Å; L101-L105 WeakPolarHBondContact O-CD1 3.17Å; L101-L105 WeakPolarHBondContact O-CG 3.27Å; L101-L105 PolarHBondContact O-N 3.28Å; L105-A107 VanDerWaalsContact C-N 3.34Å; L105-A107 PolarHBondContact O-N 2.89Å; L105-A108 PolarHBondContact O-N 3.26Å; L105-R109 PolarHBondContact O-N 2.93Å |
| 106 | P | 77.5 | Confident | 76.4 | Confident | 67 Ų | 67 | 76.8 Ų | 76.8 | 44% | 0.435 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -67.8 | -35 | 178.1 | 25.3 | -32.8 | 0 | 0 | 0 | 112.2 | Y102 R109 L110 | Y102-P106 WeakPolarHBondContact O-CD 3.31Å; Y102-P106 WeakPolarHBondContact O-CG 3.27Å; P106-R109 PolarHBondContact O-N 3.25Å; P106-L110 PolarHBondContact O-N 2.65Å |
| 107 | A | 73.9 | Confident | 75.8 | Confident | 13 Ų | 13 | 82.8 Ų | 82.8 | 11% | 0.107 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -67.2 | -38.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G104 L105 R109 L110 A111 Y145 | G104-A107 PolarHBondContact O-N 3.49Å; L105-A107 VanDerWaalsContact C-N 3.34Å; L105-A107 PolarHBondContact O-N 2.89Å; A107-R109 VanDerWaalsContact C-N 3.35Å; A107-L110 PolarHBondContact O-N 3.07Å; A107-A111 WeakPolarHBondContact O-CB 3.48Å; A107-A111 PolarHBondContact O-N 3.08Å; A107-Y145 HydrophobicContact CB-CD2 3.92Å; A107-Y145 HydrophobicContact CB-CG 3.89Å |
| 108 | A | 68.8 | Low | 74.9 | Confident | 26 Ų | 26 | 81.9 Ų | 81.9 | 22% | 0.215 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.2 | -39.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | G104 L105 R112 F142 | G104-A108 PolarHBondContact O-N 3.36Å; L105-A108 PolarHBondContact O-N 3.26Å; A108-R112 VanDerWaalsContact O-CB 3.32Å; A108-R112 WeakPolarHBondContact O-CB 3.33Å; A108-R112 PolarHBondContact O-N 3.39Å; A108-F142 HydrophobicContact CB-CB 4.32Å; A108-F142 HydrophobicContact CB-CD2 4.22Å |
| 109 | R | 71.6 | Confident | 73.7 | Confident | 183 Ų | 183 | 78.7 Ų | 78.7 | 69% | 0.691 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -67 | -45.5 | 176.9 | -70.8 | -173.2 | 177.6 | 178.3 | 0.2 | 112 | L105 P106 A107 R112 Q113 | L105-R109 PolarHBondContact O-N 2.93Å; P106-R109 PolarHBondContact O-N 3.25Å; A107-R109 VanDerWaalsContact C-N 3.35Å; R109-R112 PolarHBondContact O-N 3.42Å; R109-Q113 WeakPolarHBondContact O-CG 3.23Å; R109-Q113 PolarHBondContact O-N 2.94Å |
| 110 | L | 72.4 | Confident | 72.5 | Confident | 88 Ų | 88 | 86.6 Ų | 86.6 | 46% | 0.461 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 177.1 | -82.4 | 157.1 | 0 | 0 | 0 | 112.4 | P106 A107 Q113 R114 | P106-L110 PolarHBondContact O-N 2.65Å; A107-L110 PolarHBondContact O-N 3.07Å; L110-Q113 PolarHBondContact O-N 3.2Å; L110-R114 WeakPolarHBondContact O-CG 3.17Å; L110-R114 PolarHBondContact O-N 3.27Å |
| 111 | A | 69.7 | Low | 71.1 | Confident | 29 Ų | 29 | 88.7 Ų | 88.7 | 24% | 0.24 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -64.7 | -41.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A107 Y115 | A107-A111 WeakPolarHBondContact O-CB 3.48Å; A107-A111 PolarHBondContact O-N 3.08Å; A111-Y115 WeakPolarHBondContact O-CB 3.47Å; A111-Y115 PolarHBondContact O-N 2.86Å |
| 112 | R | 62.9 | Low | 69.8 | Low | 153 Ų | 153 | 90.3 Ų | 90.3 | 58% | 0.577 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.8 | -43.3 | 176.8 | -170.7 | -177.6 | -179 | -166.8 | 1 | 112.2 | A108 R109 Y115 I116 | A108-R112 VanDerWaalsContact O-CB 3.32Å; A108-R112 WeakPolarHBondContact O-CB 3.33Å; A108-R112 PolarHBondContact O-N 3.39Å; R109-R112 PolarHBondContact O-N 3.42Å; R112-Y115 PolarHBondContact O-N 2.86Å; R112-I116 HydrophobicContact CG-CD1 4.23Å; R112-I116 VanDerWaalsContact O-CG1 3.31Å; R112-I116 WeakPolarHBondContact O-CG1 3.35Å; R112-I116 PolarHBondContact O-N 2.89Å; R112-I116 VanDerWaalsContact O-N 3.07Å |
| 113 | Q | 68.2 | Low | 68.2 | Low | 120 Ų | 120 | 90.7 Ų | 90.7 | 56% | 0.561 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.2 | -43.7 | 177.7 | -76.1 | 177.2 | -30.6 | 0 | 0 | 112.2 | R109 L110 Y115 I116 Q117 | R109-Q113 WeakPolarHBondContact O-CG 3.23Å; R109-Q113 PolarHBondContact O-N 2.94Å; L110-Q113 PolarHBondContact O-N 3.2Å; Q113-Y115 VanDerWaalsContact C-N 3.33Å; Q113-Y115 PolarHBondContact O-N 3.04Å; Q113-I116 PolarHBondContact O-N 3.41Å; Q113-Q117 WeakPolarHBondContact O-CG 3.48Å; Q113-Q117 PolarHBondContact O-N 3.49Å; Q113-Q117 VanDerWaalsContact O-N 3.14Å |
| 114 | R | 68 | Low | 66.9 | Low | 153 Ų | 153 | 94.2 Ų | 94.2 | 58% | 0.577 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -64.4 | -38.6 | 175.4 | -72.9 | 179 | -174.8 | 176.6 | 1.3 | 112.1 | L110 Q117 I118 | L110-R114 WeakPolarHBondContact O-CG 3.17Å; L110-R114 PolarHBondContact O-N 3.27Å; R114-Q117 PolarHBondContact O-N 3.02Å; R114-I118 WeakPolarHBondContact O-CB 3.42Å; R114-I118 WeakPolarHBondContact O-CD1 3.21Å; R114-I118 VanDerWaalsContact O-CG1 3.27Å; R114-I118 WeakPolarHBondContact O-CG1 3.42Å; R114-I118 PolarHBondContact O-N 3.24Å |
| 115 | Y | 64.9 | Low | 65.8 | Low | 46 Ų | 46 | 102.3 Ų | 102.3 | 18% | 0.18 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -60.9 | -45.3 | 175.8 | -170.9 | -96.6 | 0 | 0 | 0 | 111.4 | A111 R112 Q113 Q117 I118 S119 S133 A134 A137 | A111-Y115 WeakPolarHBondContact O-CB 3.47Å; A111-Y115 PolarHBondContact O-N 2.86Å; R112-Y115 PolarHBondContact O-N 2.86Å; Q113-Y115 VanDerWaalsContact C-N 3.33Å; Q113-Y115 PolarHBondContact O-N 3.04Å; Y115-Q117 VanDerWaalsContact C-N 3.35Å; Y115-Q117 PolarHBondContact O-N 3.08Å; Y115-I118 PolarHBondContact O-N 3.28Å; Y115-S119 WeakPolarHBondContact O-CB 3.41Å; Y115-S119 PolarHBondContact O-N 3.34Å; Y115-S119 PolarHBondContact O-OG 3.21Å; Y115-S133 WeakPolarHBondContact OH-CB 3.45Å; Y115-S133 PolarHBondContact OH-OG 2.75Å; Y115-A134 HydrophobicContact CD1-CB 3.38Å; Y115-A134 HydrophobicContact CE1-CB 3.47Å; Y115-A134 VanDerWaalsContact CE1-CB 3.47Å; Y115-A134 HydrophobicContact CG-CB 4.23Å; Y115-A137 HydrophobicContact CD2-CB 4.24Å |
| 116 | I | 68.3 | Low | 65 | Low | 81 Ų | 81 | 100 Ų | 100 | 42% | 0.415 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.2 | -40.6 | 178.7 | -66.3 | 163.1 | 0 | 0 | 0 | 111.8 | R112 Q113 S119 Q120 | R112-I116 HydrophobicContact CG-CD1 4.23Å; R112-I116 VanDerWaalsContact O-CG1 3.31Å; R112-I116 WeakPolarHBondContact O-CG1 3.35Å; R112-I116 PolarHBondContact O-N 2.89Å; R112-I116 VanDerWaalsContact O-N 3.07Å; Q113-I116 PolarHBondContact O-N 3.41Å; I116-S119 WeakPolarHBondContact CA-OG 3.27Å; I116-S119 PolarHBondContact O-OG 3.14Å; I116-Q120 WeakPolarHBondContact O-CG 3.18Å; I116-Q120 PolarHBondContact O-N 2.92Å; I116-Q120 VanDerWaalsContact O-N 3.13Å |
| 117 | Q | 69.2 | Low | 64.2 | Low | 146 Ų | 146 | 107.6 Ų | 107.6 | 68% | 0.682 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66.7 | -39.7 | 178.3 | -72.8 | 178.1 | -9.8 | 0 | 0 | 112.7 | Q113 R114 Y115 | Q113-Q117 WeakPolarHBondContact O-CG 3.48Å; Q113-Q117 PolarHBondContact O-N 3.49Å; Q113-Q117 VanDerWaalsContact O-N 3.14Å; R114-Q117 PolarHBondContact O-N 3.02Å; Y115-Q117 VanDerWaalsContact C-N 3.35Å; Y115-Q117 PolarHBondContact O-N 3.08Å |
| 118 | I | 66.2 | Low | 64 | Low | 114 Ų | 114 | 111.8 Ų | 111.8 | 59% | 0.585 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -77.6 | -38 | 179.8 | -63.8 | 165 | 0 | 0 | 0 | 110.5 | R114 Y115 Q120 A121 | R114-I118 WeakPolarHBondContact O-CB 3.42Å; R114-I118 WeakPolarHBondContact O-CD1 3.21Å; R114-I118 VanDerWaalsContact O-CG1 3.27Å; R114-I118 WeakPolarHBondContact O-CG1 3.42Å; R114-I118 PolarHBondContact O-N 3.24Å; Y115-I118 PolarHBondContact O-N 3.28Å; I118-Q120 VanDerWaalsContact C-N 3.31Å; I118-Q120 PolarHBondContact O-N 3.45Å; I118-A121 WeakPolarHBondContact O-CB 3.35Å; I118-A121 PolarHBondContact O-N 2.79Å; I118-A121 VanDerWaalsContact O-N 3.12Å |
| 119 | S | 61 | Low | 64 | Low | 23 Ų | 23 | 116.8 Ų | 116.8 | 16% | 0.161 | 56% | 0.556 | C | S | . | * | H | α-helix | trans | -71.9 | -22.4 | -179.5 | 70.5 | 0 | 0 | 0 | 0 | 113.2 | Y115 I116 A121 E122 Y124 | Y115-S119 WeakPolarHBondContact O-CB 3.41Å; Y115-S119 PolarHBondContact O-N 3.34Å; Y115-S119 PolarHBondContact O-OG 3.21Å; I116-S119 WeakPolarHBondContact CA-OG 3.27Å; I116-S119 PolarHBondContact O-OG 3.14Å; S119-A121 PolarHBondContact O-N 2.98Å; S119-E122 PolarHBondContact O-N 3.5Å; S119-E122 VanDerWaalsContact O-O 3.09Å; S119-Y124 WeakPolarHBondContact O-CE2 3.31Å |
| 120 | Q | 58.4 | Low | 63.8 | Low | 168 Ų | 168 | 109.2 Ų | 109.2 | 79% | 0.785 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.1 | -14.7 | 171.3 | -82.6 | -170.1 | -6.3 | 0 | 0 | 112.8 | I116 I118 | I116-Q120 WeakPolarHBondContact O-CG 3.18Å; I116-Q120 PolarHBondContact O-N 2.92Å; I116-Q120 VanDerWaalsContact O-N 3.13Å; I118-Q120 VanDerWaalsContact C-N 3.31Å; I118-Q120 PolarHBondContact O-N 3.45Å |
| 121 | A | 56.8 | Low | 63.6 | Low | 91 Ų | 91 | 109.1 Ų | 109.1 | 75% | 0.752 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.5 | -8.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114 | I118 S119 | I118-A121 WeakPolarHBondContact O-CB 3.35Å; I118-A121 PolarHBondContact O-N 2.79Å; I118-A121 VanDerWaalsContact O-N 3.12Å; S119-A121 PolarHBondContact O-N 2.98Å |
| 122 | E | 57.9 | Low | 63.6 | Low | 117 Ų | 117 | 117.2 Ų | 117.2 | 55% | 0.547 | 56% | 0.56 | S | S | . | * | S | Bend | trans | -113.4 | 121.2 | 177.8 | -78 | -179 | 169.8 | 0 | 0 | 110.4 | S119 Y124 | S119-E122 PolarHBondContact O-N 3.5Å; S119-E122 VanDerWaalsContact O-O 3.09Å; E122-Y124 HydrophobicContact CB-CD2 4.44Å; E122-Y124 HydrophobicContact CB-CE2 3.72Å; E122-Y124 WeakPolarHBondContact O-CD2 3.25Å; E122-Y124 VanDerWaalsContact O-CE2 3.29Å; E122-Y124 WeakPolarHBondContact O-CE2 3.43Å; E122-Y124 PolarHBondContact O-N 3.37Å; E122-Y124 VanDerWaalsContact O-N 3.13Å; E122-Y124 PolarHBondContact OE2-OH 2.9Å |
| 123 | M | 51.9 | Low | 64 | Low | 180 Ų | 180 | 111.9 Ų | 111.9 | 89% | 0.887 | 55% | 0.547 | S | S | * | . | trans | -72.6 | 102.3 | 174.6 | -76.6 | -143.9 | -72.7 | 0 | 0 | 110.5 | ||||
| 124 | Y | 55.3 | Low | 64.1 | Low | 83 Ų | 83 | 107 Ų | 107 | 33% | 0.325 | 53% | 0.527 | S | S | . | . | trans | -84.4 | 132.5 | 175.2 | -62.8 | -83.1 | 0 | 0 | 0 | 111.7 | S119 E122 S126 A130 | S119-Y124 WeakPolarHBondContact O-CE2 3.31Å; E122-Y124 HydrophobicContact CB-CD2 4.44Å; E122-Y124 HydrophobicContact CB-CE2 3.72Å; E122-Y124 WeakPolarHBondContact O-CD2 3.25Å; E122-Y124 VanDerWaalsContact O-CE2 3.29Å; E122-Y124 WeakPolarHBondContact O-CE2 3.43Å; E122-Y124 PolarHBondContact O-N 3.37Å; E122-Y124 VanDerWaalsContact O-N 3.13Å; E122-Y124 PolarHBondContact OE2-OH 2.9Å; Y124-S126 PolarHBondContact O-N 2.85Å; Y124-A130 HydrophobicContact CD2-CB 4.46Å; Y124-A130 HydrophobicContact CG-CB 4.32Å | ||
| 125 | M | 59.3 | Low | 64.3 | Low | 171 Ų | 171 | 104.9 Ų | 104.9 | 84% | 0.842 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -71.2 | -11.8 | 179.5 | -67.2 | -70.7 | 101 | 0 | 0 | 114 | ||
| 126 | S | 62.3 | Low | 64.9 | Low | 49 Ų | 49 | 106.7 Ų | 106.7 | 34% | 0.343 | 54% | 0.536 | S | S | . | . | trans | -149.9 | 134.4 | -179.6 | 174.8 | 0 | 0 | 0 | 0 | 113.1 | Y124 V128 | Y124-S126 PolarHBondContact O-N 2.85Å; S126-V128 PolarHBondContact O-N 3.5Å; S126-V128 PolarHBondContact OG-N 3.23Å | ||
| 127 | R | 61.8 | Low | 65.1 | Low | 226 Ų | 226 | 104.6 Ų | 104.6 | 85% | 0.853 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.8 | -29.8 | 175.5 | -75.8 | -168.1 | -168.7 | -104.2 | 3.5 | 113 | V131 | R127-V131 WeakPolarHBondContact O-CG2 3.43Å; R127-V131 PolarHBondContact O-N 3.04Å |
| 128 | V | 68.5 | Low | 65.3 | Low | 100 Ų | 100 | 98.3 Ų | 98.3 | 61% | 0.606 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -75.7 | -37.6 | -172.9 | -175.8 | 0 | 0 | 0 | 0 | 111.2 | S126 V131 R132 | S126-V128 PolarHBondContact O-N 3.5Å; S126-V128 PolarHBondContact OG-N 3.23Å; V128-V131 PolarHBondContact O-N 3.44Å; V128-R132 PolarHBondContact O-N 2.85Å; V128-R132 VanDerWaalsContact O-N 3.14Å |
| 129 | E | 68.6 | Low | 65.9 | Low | 131 Ų | 131 | 97.5 Ų | 97.5 | 61% | 0.612 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -70.3 | -37 | 176.9 | -73.4 | -172.2 | 145.3 | 0 | 0 | 112.4 | V131 R132 S133 | E129-V131 VanDerWaalsContact C-N 3.29Å; E129-V131 PolarHBondContact O-N 3.48Å; E129-R132 PolarHBondContact O-N 2.84Å; E129-S133 WeakPolarHBondContact O-CB 3.02Å; E129-S133 PolarHBondContact O-N 3.48Å; E129-S133 PolarHBondContact O-OG 2.76Å |
| 130 | A | 68 | Low | 66.8 | Low | 25 Ų | 25 | 104 Ų | 104 | 21% | 0.207 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -62.2 | -35.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y124 S133 A134 | Y124-A130 HydrophobicContact CD2-CB 4.46Å; Y124-A130 HydrophobicContact CG-CB 4.32Å; A130-S133 WeakPolarHBondContact CA-OG 3.49Å; A130-S133 PolarHBondContact O-OG 3.18Å; A130-A134 WeakPolarHBondContact O-CB 3.41Å; A130-A134 PolarHBondContact O-N 3.31Å |
| 131 | V | 67.4 | Low | 67.6 | Low | 86 Ų | 86 | 96.6 Ų | 96.6 | 52% | 0.521 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -73.2 | -42 | 176.7 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | R127 V128 E129 A134 H135 | R127-V131 WeakPolarHBondContact O-CG2 3.43Å; R127-V131 PolarHBondContact O-N 3.04Å; V128-V131 PolarHBondContact O-N 3.44Å; E129-V131 VanDerWaalsContact C-N 3.29Å; E129-V131 PolarHBondContact O-N 3.48Å; V131-A134 PolarHBondContact O-N 2.96Å; V131-H135 PolarHBondContact O-CD2 2.92Å; V131-H135 PolarHBondContact O-N 3.26Å; V131-H135 VanDerWaalsContact O-N 3.07Å |
| 132 | R | 71.1 | Confident | 68.7 | Low | 199 Ų | 199 | 94.7 Ų | 94.7 | 75% | 0.751 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.7 | -40.5 | -179.6 | -123.2 | 174.8 | -172 | 158.1 | 2.4 | 112.6 | V128 E129 H135 N136 | V128-R132 PolarHBondContact O-N 2.85Å; V128-R132 VanDerWaalsContact O-N 3.14Å; E129-R132 PolarHBondContact O-N 2.84Å; R132-H135 PolarHBondContact O-N 3.01Å; R132-N136 WeakPolarHBondContact O-CB 3.37Å; R132-N136 PolarHBondContact O-N 3.32Å |
| 133 | S | 70.3 | Confident | 70 | Confident | 41 Ų | 41 | 93.9 Ų | 93.9 | 29% | 0.287 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -68.5 | -41.3 | 176.6 | 46.7 | 0 | 0 | 0 | 0 | 112.3 | Y115 E129 A130 H135 N136 A137 | Y115-S133 WeakPolarHBondContact OH-CB 3.45Å; Y115-S133 PolarHBondContact OH-OG 2.75Å; E129-S133 WeakPolarHBondContact O-CB 3.02Å; E129-S133 PolarHBondContact O-N 3.48Å; E129-S133 PolarHBondContact O-OG 2.76Å; A130-S133 WeakPolarHBondContact CA-OG 3.49Å; A130-S133 PolarHBondContact O-OG 3.18Å; S133-H135 VanDerWaalsContact C-N 3.34Å; S133-H135 PolarHBondContact O-N 3.32Å; S133-N136 PolarHBondContact O-N 3.12Å; S133-A137 WeakPolarHBondContact O-CB 3.38Å; S133-A137 PolarHBondContact O-N 3.12Å |
| 134 | A | 69.8 | Low | 71.4 | Confident | 18 Ų | 18 | 94.9 Ų | 94.9 | 15% | 0.149 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -58.7 | -43.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y115 A130 V131 A138 | Y115-A134 HydrophobicContact CD1-CB 3.38Å; Y115-A134 HydrophobicContact CE1-CB 3.47Å; Y115-A134 VanDerWaalsContact CE1-CB 3.47Å; Y115-A134 HydrophobicContact CG-CB 4.23Å; A130-A134 WeakPolarHBondContact O-CB 3.41Å; A130-A134 PolarHBondContact O-N 3.31Å; V131-A134 PolarHBondContact O-N 2.96Å; A134-A138 VanDerWaalsContact O-CB 3.31Å; A134-A138 WeakPolarHBondContact O-CB 3.43Å; A134-A138 PolarHBondContact O-N 3.42Å |
| 135 | H | 73 | Confident | 72.5 | Confident | 108 Ų | 108 | 96.9 Ų | 96.9 | 50% | 0.5 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.9 | -42.9 | 177.6 | -90.4 | -75.3 | 0 | 0 | 0 | 112.4 | V131 R132 S133 A137 A138 I139 | V131-H135 PolarHBondContact O-CD2 2.92Å; V131-H135 PolarHBondContact O-N 3.26Å; V131-H135 VanDerWaalsContact O-N 3.07Å; R132-H135 PolarHBondContact O-N 3.01Å; S133-H135 VanDerWaalsContact C-N 3.34Å; S133-H135 PolarHBondContact O-N 3.32Å; H135-A137 VanDerWaalsContact C-N 3.33Å; H135-A137 PolarHBondContact O-N 2.9Å; H135-A138 PolarHBondContact O-N 3.41Å; H135-I139 WeakPolarHBondContact O-CB 3.42Å; H135-I139 WeakPolarHBondContact O-CD1 3.18Å; H135-I139 WeakPolarHBondContact O-CG1 3.37Å; H135-I139 PolarHBondContact O-N 2.9Å |
| 136 | N | 76.7 | Confident | 73.7 | Confident | 84 Ų | 84 | 88.7 Ų | 88.7 | 45% | 0.449 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.8 | -39.3 | 177.9 | -163.6 | -7 | 0 | 0 | 0 | 111.3 | R132 S133 R140 | R132-N136 WeakPolarHBondContact O-CB 3.37Å; R132-N136 PolarHBondContact O-N 3.32Å; S133-N136 PolarHBondContact O-N 3.12Å; N136-R140 VanDerWaalsContact CG-NH2 3.32Å; N136-R140 PolarHBondContact ND2-NH2 3.04Å; N136-R140 WeakPolarHBondContact O-CB 3.48Å; N136-R140 PolarHBondContact O-N 3.08Å; N136-R140 VanDerWaalsContact O-N 3.09Å; N136-R140 PolarHBondContact OD1-NH2 2.99Å |
| 137 | A | 73.3 | Confident | 74.7 | Confident | 37 Ų | 37 | 95.6 Ų | 95.6 | 31% | 0.306 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -66.1 | -41.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y115 S133 H135 R140 G141 | Y115-A137 HydrophobicContact CD2-CB 4.24Å; S133-A137 WeakPolarHBondContact O-CB 3.38Å; S133-A137 PolarHBondContact O-N 3.12Å; H135-A137 VanDerWaalsContact C-N 3.33Å; H135-A137 PolarHBondContact O-N 2.9Å; A137-R140 PolarHBondContact O-N 3.29Å; A137-G141 PolarHBondContact O-N 3.49Å |
| 138 | A | 73.4 | Confident | 75.7 | Confident | 14 Ų | 14 | 92.4 Ų | 92.4 | 12% | 0.116 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -65.2 | -42.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A134 H135 G141 F142 | A134-A138 VanDerWaalsContact O-CB 3.31Å; A134-A138 WeakPolarHBondContact O-CB 3.43Å; A134-A138 PolarHBondContact O-N 3.42Å; H135-A138 PolarHBondContact O-N 3.41Å; A138-G141 PolarHBondContact O-N 3.45Å; A138-F142 WeakPolarHBondContact O-CB 3.36Å; A138-F142 PolarHBondContact O-N 3.06Å |
| 139 | I | 79.2 | Confident | 76.4 | Confident | 97 Ų | 97 | 94.2 Ų | 94.2 | 50% | 0.497 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.9 | -41.9 | 177.8 | -68.7 | 163.9 | 0 | 0 | 0 | 110.6 | H135 G141 F142 L143 | H135-I139 WeakPolarHBondContact O-CB 3.42Å; H135-I139 WeakPolarHBondContact O-CD1 3.18Å; H135-I139 WeakPolarHBondContact O-CG1 3.37Å; H135-I139 PolarHBondContact O-N 2.9Å; I139-G141 VanDerWaalsContact C-N 3.33Å; I139-G141 PolarHBondContact O-N 3.5Å; I139-F142 WeakPolarHBondContact O-CB 3.49Å; I139-F142 PolarHBondContact O-N 2.88Å; I139-L143 PolarHBondContact O-N 2.92Å |
| 140 | R | 78.7 | Confident | 77.1 | Confident | 159 Ų | 159 | 88.9 Ų | 88.9 | 60% | 0.6 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -66.2 | -36.3 | 178.2 | -138 | 176.5 | -62.4 | 172.2 | 0.7 | 112 | N136 A137 R144 | N136-R140 VanDerWaalsContact CG-NH2 3.32Å; N136-R140 PolarHBondContact ND2-NH2 3.04Å; N136-R140 WeakPolarHBondContact O-CB 3.48Å; N136-R140 PolarHBondContact O-N 3.08Å; N136-R140 VanDerWaalsContact O-N 3.09Å; N136-R140 PolarHBondContact OD1-NH2 2.99Å; A137-R140 PolarHBondContact O-N 3.29Å; R140-R144 WeakPolarHBondContact O-CB 3.25Å; R140-R144 PolarHBondContact O-N 2.67Å |
| 141 | G | 76.3 | Confident | 77.9 | Confident | 12 Ų | 12 | 94.1 Ų | 94.1 | 12% | 0.124 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -65.1 | -47.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A137 A138 I139 L143 R144 Y145 | A137-G141 PolarHBondContact O-N 3.49Å; A138-G141 PolarHBondContact O-N 3.45Å; I139-G141 VanDerWaalsContact C-N 3.33Å; I139-G141 PolarHBondContact O-N 3.5Å; G141-L143 PolarHBondContact O-N 2.88Å; G141-R144 PolarHBondContact O-N 3.1Å; G141-Y145 VanDerWaalsContact O-CD2 3.26Å; G141-Y145 WeakPolarHBondContact O-CD2 3.45Å; G141-Y145 PolarHBondContact O-N 3.47Å; G141-Y145 VanDerWaalsContact O-N 3.1Å |
| 142 | F | 80.8 | Confident | 78.7 | Confident | 52 Ų | 52 | 96 Ų | 96 | 23% | 0.228 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -56.3 | -48.5 | 178.3 | 179.6 | -100.3 | 0 | 0 | 0 | 112.3 | F100 G104 A108 A138 I139 G146 | F100-F142 HydrophobicContact CD1-CE1 4.18Å; F100-F142 HydrophobicContact CD1-CZ 4.02Å; F100-F142 HydrophobicContact CE1-CD1 4.2Å; F100-F142 AromaticContact CE1-CE1 3.2Å; F100-F142 HydrophobicContact CE1-CE1 3.2Å; F100-F142 AromaticContact CE1-CZ 3.48Å; F100-F142 HydrophobicContact CE1-CZ 3.48Å; F100-F142 VanDerWaalsContact CE1-CZ 3.48Å; F100-F142 AromaticContact CZ-CD1 3.99Å; F100-F142 HydrophobicContact CZ-CD1 3.99Å; F100-F142 AromaticContact CZ-CE1 3.43Å; F100-F142 HydrophobicContact CZ-CE1 3.43Å; F100-F142 VanDerWaalsContact CZ-CE1 3.43Å; F100-F142 HydrophobicContact CZ-CZ 4.05Å; G104-F142 VanDerWaalsContact C-CE2 3.49Å; G104-F142 VanDerWaalsContact CA-CE2 3.46Å; G104-F142 VanDerWaalsContact O-CD2 3.31Å; G104-F142 WeakPolarHBondContact O-CD2 3.5Å; A108-F142 HydrophobicContact CB-CB 4.32Å; A108-F142 HydrophobicContact CB-CD2 4.22Å; A138-F142 WeakPolarHBondContact O-CB 3.36Å; A138-F142 PolarHBondContact O-N 3.06Å; I139-F142 WeakPolarHBondContact O-CB 3.49Å; I139-F142 PolarHBondContact O-N 2.88Å; F142-G146 WeakPolarHBondContact O-CA 3.48Å; F142-G146 PolarHBondContact O-N 3.32Å |
| 143 | L | 83.8 | Confident | 79.2 | Confident | 99 Ų | 99 | 88.3 Ų | 88.3 | 52% | 0.518 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.4 | -45.8 | 179.7 | -117.9 | 71.4 | 0 | 0 | 0 | 112.4 | F100 I139 G141 Y145 W147 | F100-L143 HydrophobicContact CZ-CD1 4.15Å; I139-L143 PolarHBondContact O-N 2.92Å; G141-L143 PolarHBondContact O-N 2.88Å; L143-Y145 PolarHBondContact O-N 2.97Å; L143-W147 WeakPolarHBondContact O-CB 3.44Å; L143-W147 PolarHBondContact O-N 3.41Å |
| 144 | R | 81.3 | Confident | 79.7 | Confident | 202 Ų | 202 | 88 Ų | 88 | 76% | 0.762 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -68.7 | -39.2 | -173.6 | -161 | 172.5 | -165.3 | 138.7 | 1.7 | 112.4 | R140 G141 | R140-R144 WeakPolarHBondContact O-CB 3.25Å; R140-R144 PolarHBondContact O-N 2.67Å; G141-R144 PolarHBondContact O-N 3.1Å |
| 145 | Y | 78.8 | Confident | 80.4 | Confident | 124 Ų | 124 | 90.8 Ų | 90.8 | 49% | 0.486 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -82.3 | -38.8 | 177.7 | -72.4 | -79.5 | 0 | 0 | 0 | 112.1 | A107 G141 L143 R148 W149 | A107-Y145 HydrophobicContact CB-CD2 3.92Å; A107-Y145 HydrophobicContact CB-CG 3.89Å; G141-Y145 VanDerWaalsContact O-CD2 3.26Å; G141-Y145 WeakPolarHBondContact O-CD2 3.45Å; G141-Y145 PolarHBondContact O-N 3.47Å; G141-Y145 VanDerWaalsContact O-N 3.1Å; L143-Y145 PolarHBondContact O-N 2.97Å; Y145-R148 PolarHBondContact O-N 3.46Å; Y145-W149 PolarHBondContact O-N 2.82Å |
| 146 | G | 83.6 | Confident | 80.8 | Confident | 0 Ų | 0 | 88.8 Ų | 88.8 | 0% | 0 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -61.5 | -44.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F100 F142 R148 W149 S150 | F100-G146 VanDerWaalsContact CD2-C 3.44Å; F142-G146 WeakPolarHBondContact O-CA 3.48Å; F142-G146 PolarHBondContact O-N 3.32Å; G146-R148 PolarHBondContact O-N 3.38Å; G146-W149 PolarHBondContact O-N 3.29Å; G146-S150 WeakPolarHBondContact O-CB 3.26Å; G146-S150 PolarHBondContact O-N 3.1Å |
| 147 | W | 84 | Confident | 81 | Confident | 194 Ų | 194 | 86.7 Ų | 86.7 | 74% | 0.735 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -60.5 | -44.5 | 177.7 | -176.7 | -98.7 | 0 | 0 | 0 | 112.1 | L143 W149 S150 W151 | L143-W147 WeakPolarHBondContact O-CB 3.44Å; L143-W147 PolarHBondContact O-N 3.41Å; W147-W149 VanDerWaalsContact C-N 3.28Å; W147-W149 PolarHBondContact O-N 2.92Å; W147-S150 PolarHBondContact O-N 3.39Å; W147-W151 PolarHBondContact O-N 3.5Å |
| 148 | R | 83.6 | Confident | 81.3 | Confident | 158 Ų | 158 | 87.7 Ų | 87.7 | 60% | 0.596 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -73 | -19.2 | -175 | -149.8 | 155.2 | 75.4 | 108.3 | -2.1 | 113.9 | Y145 G146 W151 | Y145-R148 PolarHBondContact O-N 3.46Å; G146-R148 PolarHBondContact O-N 3.38Å; R148-W151 VanDerWaalsContact C-CD1 3.49Å; R148-W151 PolarHBondContact O-NE1 2.92Å |
| 149 | W | 81.9 | Confident | 81.7 | Confident | 139 Ų | 139 | 89.8 Ų | 89.8 | 53% | 0.527 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -94.1 | -36.3 | 172 | -89.4 | 77.8 | 0 | 0 | 0 | 112.5 | Y145 G146 W147 W151 R152 V153 | Y145-W149 PolarHBondContact O-N 2.82Å; G146-W149 PolarHBondContact O-N 3.29Å; W147-W149 VanDerWaalsContact C-N 3.28Å; W147-W149 PolarHBondContact O-N 2.92Å; W149-W151 PolarHBondContact O-N 3.15Å; W149-R152 PolarHBondContact O-N 3.43Å; W149-V153 WeakPolarHBondContact O-CG2 3.38Å; W149-V153 PolarHBondContact O-N 2.65Å; W149-V153 VanDerWaalsContact O-N 3.13Å |
| 150 | S | 84.5 | Confident | 81.4 | Confident | 19 Ų | 19 | 87.2 Ų | 87.2 | 13% | 0.133 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -60 | -43.1 | -178.3 | -176.9 | 0 | 0 | 0 | 0 | 112.7 | A96 G146 W147 R152 V153 S154 | A96-S150 PolarHBondContact O-OG 2.87Å; G146-S150 WeakPolarHBondContact O-CB 3.26Å; G146-S150 PolarHBondContact O-N 3.1Å; W147-S150 PolarHBondContact O-N 3.39Å; S150-R152 VanDerWaalsContact C-N 3.3Å; S150-R152 PolarHBondContact O-N 3.41Å; S150-V153 PolarHBondContact O-N 3.27Å; S150-S154 VanDerWaalsContact O-CB 3.23Å; S150-S154 WeakPolarHBondContact O-CB 3.34Å; S150-S154 PolarHBondContact O-N 3.46Å |
| 151 | W | 84.2 | Confident | 81.2 | Confident | 135 Ų | 135 | 80.3 Ų | 80.3 | 51% | 0.511 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.4 | -34.9 | 178.5 | 77.8 | -85 | 0 | 0 | 0 | 112.9 | W147 R148 W149 V155 | W147-W151 PolarHBondContact O-N 3.5Å; R148-W151 VanDerWaalsContact C-CD1 3.49Å; R148-W151 PolarHBondContact O-NE1 2.92Å; W149-W151 PolarHBondContact O-N 3.15Å; W151-V155 HydrophobicContact CE3-CG2 4.49Å; W151-V155 VanDerWaalsContact O-CG2 3.27Å; W151-V155 WeakPolarHBondContact O-CG2 3.46Å; W151-V155 PolarHBondContact O-N 2.84Å |
| 152 | R | 83.9 | Confident | 81 | Confident | 124 Ų | 124 | 83 Ų | 83 | 47% | 0.468 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -68.2 | -46.3 | 177.3 | -64.1 | -168.2 | 173.8 | -164.5 | -2 | 111.3 | W149 S150 S154 V155 I156 | W149-R152 PolarHBondContact O-N 3.43Å; S150-R152 VanDerWaalsContact C-N 3.3Å; S150-R152 PolarHBondContact O-N 3.41Å; R152-S154 VanDerWaalsContact C-N 3.35Å; R152-V155 PolarHBondContact O-N 3.3Å; R152-I156 WeakPolarHBondContact O-CD1 3.49Å; R152-I156 VanDerWaalsContact O-CG1 3.24Å; R152-I156 WeakPolarHBondContact O-CG1 3.24Å; R152-I156 PolarHBondContact O-N 3.12Å |
| 153 | V | 81.9 | Confident | 80.5 | Confident | 39 Ų | 39 | 81.8 Ų | 81.8 | 24% | 0.236 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.7 | -42.6 | 178.2 | 178.3 | 0 | 0 | 0 | 0 | 110.4 | G95 W149 S150 V155 I156 V157 | G95-V153 WeakPolarHBondContact O-CG1 3.49Å; W149-V153 WeakPolarHBondContact O-CG2 3.38Å; W149-V153 PolarHBondContact O-N 2.65Å; W149-V153 VanDerWaalsContact O-N 3.13Å; S150-V153 PolarHBondContact O-N 3.27Å; V153-V155 PolarHBondContact O-N 3.43Å; V153-I156 PolarHBondContact O-N 3.27Å; V153-V157 HydrophobicContact CG1-CG2 4.08Å; V153-V157 WeakPolarHBondContact O-CB 3.5Å; V153-V157 VanDerWaalsContact O-CG2 3.29Å; V153-V157 WeakPolarHBondContact O-CG2 3.33Å; V153-V157 PolarHBondContact O-N 2.95Å |
| 154 | S | 81.9 | Confident | 79.5 | Confident | 34 Ų | 34 | 78.1 Ų | 78.1 | 24% | 0.238 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -59.3 | -47.5 | 177.6 | -177.2 | 0 | 0 | 0 | 0 | 112.1 | S150 R152 I156 V157 T158 | S150-S154 VanDerWaalsContact O-CB 3.23Å; S150-S154 WeakPolarHBondContact O-CB 3.34Å; S150-S154 PolarHBondContact O-N 3.46Å; R152-S154 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 3.36Å; S154-V157 PolarHBondContact O-N 3.13Å; S154-T158 VanDerWaalsContact O-CB 3.24Å; S154-T158 WeakPolarHBondContact O-CB 3.46Å; S154-T158 PolarHBondContact O-N 3.36Å; S154-T158 PolarHBondContact O-OG1 3.22Å |
| 155 | V | 83.9 | Confident | 78.8 | Confident | 76 Ų | 76 | 70.3 Ų | 70.3 | 46% | 0.461 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.4 | -44.8 | 176.9 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | W151 R152 V153 L159 | W151-V155 HydrophobicContact CE3-CG2 4.49Å; W151-V155 VanDerWaalsContact O-CG2 3.27Å; W151-V155 WeakPolarHBondContact O-CG2 3.46Å; W151-V155 PolarHBondContact O-N 2.84Å; R152-V155 PolarHBondContact O-N 3.3Å; V153-V155 PolarHBondContact O-N 3.43Å; V155-L159 WeakPolarHBondContact O-CB 3.41Å; V155-L159 PolarHBondContact O-N 3.02Å |
| 156 | I | 81.4 | Confident | 78.1 | Confident | 67 Ų | 67 | 65.6 Ų | 65.6 | 34% | 0.344 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.6 | -46.6 | 179.5 | -68.7 | 166.3 | 0 | 0 | 0 | 111.1 | R152 V153 S154 L159 F160 | R152-I156 WeakPolarHBondContact O-CD1 3.49Å; R152-I156 VanDerWaalsContact O-CG1 3.24Å; R152-I156 WeakPolarHBondContact O-CG1 3.24Å; R152-I156 PolarHBondContact O-N 3.12Å; V153-I156 PolarHBondContact O-N 3.27Å; S154-I156 PolarHBondContact O-N 3.36Å; I156-L159 PolarHBondContact O-N 3.38Å; I156-F160 VanDerWaalsContact O-CB 3.3Å; I156-F160 WeakPolarHBondContact O-CB 3.3Å; I156-F160 PolarHBondContact O-N 2.8Å |
| 157 | V | 80.4 | Confident | 77.2 | Confident | 40 Ų | 40 | 67.7 Ų | 67.7 | 24% | 0.242 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -66.1 | -43.2 | -179.5 | 168 | 0 | 0 | 0 | 0 | 111.4 | V153 S154 F160 S161 | V153-V157 HydrophobicContact CG1-CG2 4.08Å; V153-V157 WeakPolarHBondContact O-CB 3.5Å; V153-V157 VanDerWaalsContact O-CG2 3.29Å; V153-V157 WeakPolarHBondContact O-CG2 3.33Å; V153-V157 PolarHBondContact O-N 2.95Å; S154-V157 PolarHBondContact O-N 3.13Å; V157-F160 PolarHBondContact O-N 3.07Å; V157-S161 VanDerWaalsContact O-CB 3.27Å; V157-S161 WeakPolarHBondContact O-CB 3.37Å; V157-S161 PolarHBondContact O-N 3.08Å; V157-S161 PolarHBondContact O-OG 3.08Å |
| 158 | T | 80.8 | Confident | 76.2 | Confident | 57 Ų | 57 | 59.9 Ų | 59.9 | 35% | 0.35 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 178.1 | -56 | 0 | 0 | 0 | 0 | 110.6 | S154 S161 S162 | S154-T158 VanDerWaalsContact O-CB 3.24Å; S154-T158 WeakPolarHBondContact O-CB 3.46Å; S154-T158 PolarHBondContact O-N 3.36Å; S154-T158 PolarHBondContact O-OG1 3.22Å; T158-S161 PolarHBondContact O-N 3.02Å; T158-S162 VanDerWaalsContact O-CB 3.29Å; T158-S162 WeakPolarHBondContact O-CB 3.37Å; T158-S162 PolarHBondContact O-N 3.4Å |
| 159 | L | 80.3 | Confident | 75.1 | Confident | 58 Ų | 58 | 52.7 Ų | 52.7 | 30% | 0.304 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -64.9 | -46.3 | 177.8 | -171.4 | 65.2 | 0 | 0 | 0 | 111.3 | V155 I156 S161 S162 V163 T186 L189 | V155-L159 WeakPolarHBondContact O-CB 3.41Å; V155-L159 PolarHBondContact O-N 3.02Å; I156-L159 PolarHBondContact O-N 3.38Å; L159-S161 VanDerWaalsContact C-N 3.35Å; L159-S161 PolarHBondContact O-N 3.47Å; L159-S162 PolarHBondContact O-N 3.19Å; L159-V163 WeakPolarHBondContact O-CB 3.11Å; L159-V163 VanDerWaalsContact O-CG2 3.23Å; L159-V163 WeakPolarHBondContact O-CG2 3.27Å; L159-V163 PolarHBondContact O-N 2.85Å; L159-T186 HydrophobicContact CB-CG2 4.1Å; L159-T186 HydrophobicContact CD2-CG2 3.9Å; L159-T186 HydrophobicContact CG-CG2 4.01Å; L159-L189 HydrophobicContact CD2-CD2 4.19Å |
| 160 | F | 73.8 | Confident | 74 | Confident | 44 Ų | 44 | 52.9 Ų | 52.9 | 19% | 0.193 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -59.3 | -45.6 | 175.6 | 179.1 | -101.1 | 0 | 0 | 0 | 112 | I156 V157 V163 S164 Y179 A182 T186 V213 | I156-F160 VanDerWaalsContact O-CB 3.3Å; I156-F160 WeakPolarHBondContact O-CB 3.3Å; I156-F160 PolarHBondContact O-N 2.8Å; V157-F160 PolarHBondContact O-N 3.07Å; F160-V163 PolarHBondContact O-N 3.49Å; F160-S164 VanDerWaalsContact O-CB 3.24Å; F160-S164 WeakPolarHBondContact O-CB 3.23Å; F160-S164 PolarHBondContact O-N 3.39Å; F160-S164 PolarHBondContact O-OG 3.42Å; F160-Y179 HydrophobicContact CE1-CD1 4.36Å; F160-Y179 AromaticContact CZ-CD1 3.89Å; F160-Y179 HydrophobicContact CZ-CD1 3.89Å; F160-A182 HydrophobicContact CD2-CB 4.2Å; F160-A182 HydrophobicContact CE2-CB 3.98Å; F160-T186 WeakPolarHBondContact CA-OG1 3.07Å; F160-T186 HydrophobicContact CB-CG2 4.16Å; F160-V213 HydrophobicContact CE1-CG1 4.18Å; F160-V213 HydrophobicContact CZ-CG1 3.84Å |
| 161 | S | 74.1 | Confident | 72.7 | Confident | 14 Ų | 14 | 57.7 Ų | 57.7 | 10% | 0.098 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65 | -45.1 | -179.4 | -58 | 0 | 0 | 0 | 0 | 110.7 | V157 T158 L159 V163 S164 T165 | V157-S161 VanDerWaalsContact O-CB 3.27Å; V157-S161 WeakPolarHBondContact O-CB 3.37Å; V157-S161 PolarHBondContact O-N 3.08Å; V157-S161 PolarHBondContact O-OG 3.08Å; T158-S161 PolarHBondContact O-N 3.02Å; L159-S161 VanDerWaalsContact C-N 3.35Å; L159-S161 PolarHBondContact O-N 3.47Å; S161-V163 PolarHBondContact O-N 3.11Å; S161-S164 WeakPolarHBondContact CA-OG 3.44Å; S161-S164 PolarHBondContact O-N 2.87Å; S161-S164 PolarHBondContact O-OG 2.93Å; S161-T165 PolarHBondContact O-N 2.8Å; S161-T165 PolarHBondContact O-OG1 3.37Å; S161-T165 VanDerWaalsContact O-OG1 3.04Å |
| 162 | S | 73.1 | Confident | 71.4 | Confident | 67 Ų | 67 | 54.8 Ų | 54.8 | 47% | 0.469 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -59.1 | -47.4 | 175.1 | 178.2 | 0 | 0 | 0 | 0 | 112.5 | T158 L159 T165 G166 | T158-S162 VanDerWaalsContact O-CB 3.29Å; T158-S162 WeakPolarHBondContact O-CB 3.37Å; T158-S162 PolarHBondContact O-N 3.4Å; L159-S162 PolarHBondContact O-N 3.19Å; S162-T165 PolarHBondContact O-N 2.81Å; S162-G166 PolarHBondContact O-N 3.29Å |
| 163 | V | 69.1 | Low | 69.9 | Low | 27 Ų | 27 | 56.5 Ų | 56.5 | 16% | 0.164 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.3 | -39.8 | 178.3 | 176.2 | 0 | 0 | 0 | 0 | 111.2 | L159 F160 S161 G166 L167 A182 V185 | L159-V163 WeakPolarHBondContact O-CB 3.11Å; L159-V163 VanDerWaalsContact O-CG2 3.23Å; L159-V163 WeakPolarHBondContact O-CG2 3.27Å; L159-V163 PolarHBondContact O-N 2.85Å; F160-V163 PolarHBondContact O-N 3.49Å; S161-V163 PolarHBondContact O-N 3.11Å; V163-G166 PolarHBondContact O-N 2.95Å; V163-L167 HydrophobicContact CG1-CD1 4.06Å; V163-L167 WeakPolarHBondContact O-CB 3.49Å; V163-L167 PolarHBondContact O-N 3.45Å; V163-A182 HydrophobicContact CB-CB 4.34Å; V163-A182 HydrophobicContact CG1-CB 3.78Å; V163-V185 HydrophobicContact CG1-CB 4.3Å; V163-V185 HydrophobicContact CG1-CG1 4.24Å; V163-V185 HydrophobicContact CG2-CG1 4.43Å |
| 164 | S | 63.3 | Low | 68.6 | Low | 23 Ų | 23 | 60 Ų | 60 | 16% | 0.161 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.6 | -43 | 178.2 | 74.4 | 0 | 0 | 0 | 0 | 112.2 | F160 S161 L167 A168 | F160-S164 VanDerWaalsContact O-CB 3.24Å; F160-S164 WeakPolarHBondContact O-CB 3.23Å; F160-S164 PolarHBondContact O-N 3.39Å; F160-S164 PolarHBondContact O-OG 3.42Å; S161-S164 WeakPolarHBondContact CA-OG 3.44Å; S161-S164 PolarHBondContact O-N 2.87Å; S161-S164 PolarHBondContact O-OG 2.93Å; S164-L167 PolarHBondContact O-N 2.88Å; S164-A168 VanDerWaalsContact O-CB 3.27Å; S164-A168 WeakPolarHBondContact O-CB 3.23Å; S164-A168 PolarHBondContact O-N 3.35Å |
| 165 | T | 65.7 | Low | 67.4 | Low | 38 Ų | 38 | 60.7 Ų | 60.7 | 23% | 0.233 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -66.7 | -45 | 175.6 | -56.9 | 0 | 0 | 0 | 0 | 110.4 | E84 S161 S162 L167 A168 V169 | E84-T165 HydrophobicContact CB-CG2 4.36Å; S161-T165 PolarHBondContact O-N 2.8Å; S161-T165 PolarHBondContact O-OG1 3.37Å; S161-T165 VanDerWaalsContact O-OG1 3.04Å; S162-T165 PolarHBondContact O-N 2.81Å; T165-L167 PolarHBondContact O-N 3.48Å; T165-A168 PolarHBondContact O-N 3.02Å; T165-V169 HydrophobicContact CG2-CG2 4.49Å; T165-V169 WeakPolarHBondContact O-CB 3.46Å; T165-V169 WeakPolarHBondContact O-CG2 3.22Å; T165-V169 PolarHBondContact O-N 3.43Å |
| 166 | G | 64.5 | Low | 66.3 | Low | 25 Ų | 25 | 59.6 Ų | 59.6 | 26% | 0.258 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.6 | -42 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | S162 V163 Y170 | S162-G166 PolarHBondContact O-N 3.29Å; V163-G166 PolarHBondContact O-N 2.95Å; G166-Y170 VanDerWaalsContact O-CB 3.3Å; G166-Y170 WeakPolarHBondContact O-CB 3.1Å; G166-Y170 PolarHBondContact O-N 3.45Å |
| 167 | L | 65.4 | Low | 65.5 | Low | 43 Ų | 43 | 58.8 Ų | 58.8 | 23% | 0.225 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -74 | -39 | 177.9 | -105.9 | 74.5 | 0 | 0 | 0 | 113.4 | V163 S164 T165 V169 Y170 R171 N178 A181 | V163-L167 HydrophobicContact CG1-CD1 4.06Å; V163-L167 WeakPolarHBondContact O-CB 3.49Å; V163-L167 PolarHBondContact O-N 3.45Å; S164-L167 PolarHBondContact O-N 2.88Å; T165-L167 PolarHBondContact O-N 3.48Å; L167-V169 PolarHBondContact O-N 3.23Å; L167-Y170 PolarHBondContact O-N 3.37Å; L167-R171 PolarHBondContact O-N 2.93Å; L167-N178 HydrophobicContact CB-CB 4.43Å; L167-A181 HydrophobicContact CD2-CB 3.47Å; L167-A181 VanDerWaalsContact CD2-CB 3.47Å |
| 168 | A | 61.8 | Low | 65.2 | Low | 31 Ų | 31 | 57.2 Ų | 57.2 | 26% | 0.256 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -59.8 | -41.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | S164 T165 N172 | S164-A168 VanDerWaalsContact O-CB 3.27Å; S164-A168 WeakPolarHBondContact O-CB 3.23Å; S164-A168 PolarHBondContact O-N 3.35Å; T165-A168 PolarHBondContact O-N 3.02Å; A168-N172 PolarHBondContact O-N 2.83Å |
| 169 | V | 61.5 | Low | 64.9 | Low | 6 Ų | 6 | 57.5 Ų | 57.5 | 4% | 0.036 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -69.2 | -42.2 | 175.8 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | R68 I72 T165 L167 | R68-V169 HydrophobicContact CB-CG1 3.73Å; R68-V169 WeakPolarHBondContact CD-O 3.24Å; R68-V169 HydrophobicContact CG-CG1 3.51Å; R68-V169 PolarHBondContact NH1-O 2.79Å; I72-V169 HydrophobicContact CD1-CB 4.01Å; I72-V169 HydrophobicContact CD1-CG1 3.62Å; I72-V169 HydrophobicContact CD1-CG2 3.48Å; I72-V169 VanDerWaalsContact CD1-CG2 3.48Å; T165-V169 HydrophobicContact CG2-CG2 4.49Å; T165-V169 WeakPolarHBondContact O-CB 3.46Å; T165-V169 WeakPolarHBondContact O-CG2 3.22Å; T165-V169 PolarHBondContact O-N 3.43Å; L167-V169 PolarHBondContact O-N 3.23Å |
| 170 | Y | 58.9 | Low | 64.9 | Low | 143 Ų | 143 | 56.5 Ų | 56.5 | 56% | 0.561 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -67.3 | -40.4 | -178.2 | -175.1 | -102.9 | 0 | 0 | 0 | 113.1 | I69 G166 L167 | I69-Y170 HydrophobicContact CD1-CD2 4.21Å; G166-Y170 VanDerWaalsContact O-CB 3.3Å; G166-Y170 WeakPolarHBondContact O-CB 3.1Å; G166-Y170 PolarHBondContact O-N 3.45Å; L167-Y170 PolarHBondContact O-N 3.37Å |
| 171 | R | 56.8 | Low | 65.1 | Low | 121 Ų | 121 | 55.8 Ų | 55.8 | 46% | 0.457 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -102.2 | -10 | -167.9 | -155.8 | 142.4 | 72.2 | 160.1 | 5.4 | 115.4 | L167 K173 S177 N178 | L167-R171 PolarHBondContact O-N 2.93Å; R171-K173 WeakPolarHBondContact O-CB 3.48Å; R171-K173 PolarHBondContact O-N 2.84Å; R171-S177 PolarHBondContact NH2-OG 2.84Å; R171-N178 PolarHBondContact NE-OD1 2.95Å; R171-N178 PolarHBondContact NH2-OD1 3.21Å |
| 172 | N | 55.9 | Low | 65.2 | Low | 74 Ų | 74 | 55.1 Ų | 55.1 | 40% | 0.396 | 30% | 0.302 | S | S | . | . | trans | 53.1 | 13.9 | 175.7 | -110.5 | -16.5 | 0 | 0 | 0 | 115.4 | F61 R68 A168 | F61-N172 WeakPolarHBondContact CD1-ND2 3.2Å; F61-N172 WeakPolarHBondContact CD1-OD1 3.22Å; F61-N172 VanDerWaalsContact CE1-CG 3.46Å; F61-N172 VanDerWaalsContact CE1-ND2 3.26Å; F61-N172 WeakPolarHBondContact CE1-ND2 3.29Å; F61-N172 WeakPolarHBondContact CE1-OD1 3.48Å; F61-N172 VanDerWaalsContact CG-ND2 3.27Å; F61-N172 WeakPolarHBondContact CG-ND2 3.36Å; R68-N172 VanDerWaalsContact CZ-OD1 3.26Å; R68-N172 PolarHBondContact NH1-ND2 3.13Å; R68-N172 PolarHBondContact NH1-OD1 3.44Å; R68-N172 PolarHBondContact NH2-OD1 2.94Å; R68-N172 VanDerWaalsContact NH2-OD1 3.07Å; A168-N172 PolarHBondContact O-N 2.83Å | ||
| 173 | K | 53.6 | Low | 65.6 | Low | 159 Ų | 159 | 52.2 Ų | 52.2 | 69% | 0.691 | 28% | 0.282 | S | S | * | . | trans | -135.3 | 94.7 | -173.4 | -126.4 | 148.8 | 174.6 | 174.7 | 0 | 106 | R171 A175 N178 | R171-K173 WeakPolarHBondContact O-CB 3.48Å; R171-K173 PolarHBondContact O-N 2.84Å; K173-A175 VanDerWaalsContact C-N 3.34Å; K173-A175 PolarHBondContact O-N 2.95Å; K173-N178 PolarHBondContact O-ND2 3.31Å | ||
| 174 | D | 53.5 | Low | 66.4 | Low | 114 Ų | 114 | 51.5 Ų | 51.5 | 61% | 0.61 | 28% | 0.279 | S | S | * | . | trans | -76.6 | 87.4 | -178.5 | -57.1 | -39.4 | 0 | 0 | 0 | 108.7 | ||||
| 175 | A | 57.5 | Low | 67.3 | Low | 48 Ų | 48 | 54 Ų | 54 | 40% | 0.397 | 29% | 0.293 | S | S | . | . | S | Bend | trans | -123.7 | 157.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | K173 S177 N178 | K173-A175 VanDerWaalsContact C-N 3.34Å; K173-A175 PolarHBondContact O-N 2.95Å; A175-S177 PolarHBondContact O-N 3.33Å; A175-N178 PolarHBondContact O-N 2.84Å |
| 176 | V | 60.4 | Low | 68.2 | Low | 53 Ų | 53 | 52.4 Ų | 52.4 | 32% | 0.321 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -39.9 | -30.4 | 169.7 | -158.9 | 0 | 0 | 0 | 0 | 112 | N178 Y179 V180 I218 | V176-N178 VanDerWaalsContact C-N 3.28Å; V176-N178 PolarHBondContact O-N 3.14Å; V176-Y179 PolarHBondContact O-N 2.92Å; V176-Y179 VanDerWaalsContact O-N 3.08Å; V176-V180 HydrophobicContact CG1-CG2 4.48Å; V176-V180 WeakPolarHBondContact O-CG2 3.39Å; V176-V180 PolarHBondContact O-N 3.31Å; V176-I218 HydrophobicContact CG2-CD1 3.76Å |
| 177 | S | 65.6 | Low | 69.1 | Low | 49 Ų | 49 | 53.2 Ų | 53.2 | 34% | 0.343 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -52.8 | -34 | 172.8 | 76.3 | 0 | 0 | 0 | 0 | 115.5 | R171 A175 A181 | R171-S177 PolarHBondContact NH2-OG 2.84Å; A175-S177 PolarHBondContact O-N 3.33Å; S177-A181 VanDerWaalsContact O-CB 3.23Å; S177-A181 WeakPolarHBondContact O-CB 3.46Å; S177-A181 PolarHBondContact O-N 3.36Å |
| 178 | N | 74.8 | Confident | 70 | Confident | 7 Ų | 7 | 51.3 Ų | 51.3 | 4% | 0.037 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -74.4 | -35.2 | 177.8 | -64.5 | -20.8 | 0 | 0 | 0 | 110.9 | L167 R171 K173 A175 V176 A182 | L167-N178 HydrophobicContact CB-CB 4.43Å; R171-N178 PolarHBondContact NE-OD1 2.95Å; R171-N178 PolarHBondContact NH2-OD1 3.21Å; K173-N178 PolarHBondContact O-ND2 3.31Å; A175-N178 PolarHBondContact O-N 2.84Å; V176-N178 VanDerWaalsContact C-N 3.28Å; V176-N178 PolarHBondContact O-N 3.14Å; N178-A182 WeakPolarHBondContact O-CB 3.18Å; N178-A182 PolarHBondContact O-N 3.47Å |
| 179 | Y | 73.9 | Confident | 71.1 | Confident | 63 Ų | 63 | 54.5 Ų | 54.5 | 25% | 0.247 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -70.4 | -37.9 | 173.2 | -68.7 | -71.7 | 0 | 0 | 0 | 111.8 | F160 V176 G183 V217 | F160-Y179 HydrophobicContact CE1-CD1 4.36Å; F160-Y179 AromaticContact CZ-CD1 3.89Å; F160-Y179 HydrophobicContact CZ-CD1 3.89Å; V176-Y179 PolarHBondContact O-N 2.92Å; V176-Y179 VanDerWaalsContact O-N 3.08Å; Y179-G183 PolarHBondContact O-N 2.88Å; Y179-V217 HydrophobicContact CE2-CG1 4.45Å |
| 180 | V | 78.9 | Confident | 72 | Confident | 37 Ų | 37 | 59.3 Ų | 59.3 | 22% | 0.224 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.4 | -48.8 | 172.9 | 173.8 | 0 | 0 | 0 | 0 | 111 | V176 G183 A184 A207 I211 | V176-V180 HydrophobicContact CG1-CG2 4.48Å; V176-V180 WeakPolarHBondContact O-CG2 3.39Å; V176-V180 PolarHBondContact O-N 3.31Å; V180-G183 PolarHBondContact O-N 2.88Å; V180-A184 WeakPolarHBondContact O-CB 3.48Å; V180-A184 PolarHBondContact O-N 2.85Å; V180-A207 HydrophobicContact CG1-CB 3.8Å; V180-I211 HydrophobicContact CG2-CB 4.5Å; V180-I211 HydrophobicContact CG2-CG1 3.59Å |
| 181 | A | 77.9 | Confident | 73.1 | Confident | 30 Ų | 30 | 56.8 Ų | 56.8 | 25% | 0.248 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.5 | -41.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L167 S177 G183 A184 V185 | L167-A181 HydrophobicContact CD2-CB 3.47Å; L167-A181 VanDerWaalsContact CD2-CB 3.47Å; S177-A181 VanDerWaalsContact O-CB 3.23Å; S177-A181 WeakPolarHBondContact O-CB 3.46Å; S177-A181 PolarHBondContact O-N 3.36Å; A181-G183 PolarHBondContact O-N 3.18Å; A181-A184 PolarHBondContact O-N 3.45Å; A181-V185 WeakPolarHBondContact O-CB 3.45Å; A181-V185 VanDerWaalsContact O-CG2 3.25Å; A181-V185 WeakPolarHBondContact O-CG2 3.43Å; A181-V185 PolarHBondContact O-N 3.17Å |
| 182 | A | 77.9 | Confident | 74.2 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.7 | -40.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | F160 V163 N178 T186 | F160-A182 HydrophobicContact CD2-CB 4.2Å; F160-A182 HydrophobicContact CE2-CB 3.98Å; V163-A182 HydrophobicContact CB-CB 4.34Å; V163-A182 HydrophobicContact CG1-CB 3.78Å; N178-A182 WeakPolarHBondContact O-CB 3.18Å; N178-A182 PolarHBondContact O-N 3.47Å; A182-T186 WeakPolarHBondContact O-CB 3.36Å; A182-T186 PolarHBondContact O-N 2.78Å; A182-T186 PolarHBondContact O-OG1 3.41Å |
| 183 | G | 81.2 | Confident | 75.3 | Confident | 5 Ų | 5 | 58.4 Ų | 58.4 | 5% | 0.052 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -63.3 | -45.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y179 V180 A181 V185 T186 V187 G206 | Y179-G183 PolarHBondContact O-N 2.88Å; V180-G183 PolarHBondContact O-N 2.88Å; A181-G183 PolarHBondContact O-N 3.18Å; G183-V185 PolarHBondContact O-N 2.75Å; G183-T186 PolarHBondContact O-N 2.86Å; G183-V187 WeakPolarHBondContact O-CB 3.39Å; G183-V187 VanDerWaalsContact O-CG2 3.3Å; G183-V187 WeakPolarHBondContact O-CG2 3.33Å; G183-V187 PolarHBondContact O-N 3.45Å; G183-G206 VanDerWaalsContact C-C 3.47Å; G183-G206 CarbonylContact C-O 3.47Å; G183-G206 WeakPolarHBondContact O-CA 3.45Å |
| 184 | A | 84.7 | Confident | 76.5 | Confident | 13 Ų | 13 | 57.2 Ų | 57.2 | 11% | 0.107 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.8 | -46.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | V180 A181 G188 A207 | V180-A184 WeakPolarHBondContact O-CB 3.48Å; V180-A184 PolarHBondContact O-N 2.85Å; A181-A184 PolarHBondContact O-N 3.45Å; A184-G188 WeakPolarHBondContact O-CA 3.47Å; A184-G188 PolarHBondContact O-N 3.03Å; A184-A207 HydrophobicContact CB-CB 4.11Å |
| 185 | V | 83.1 | Confident | 78.2 | Confident | 75 Ų | 75 | 53.4 Ų | 53.4 | 46% | 0.455 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -67.5 | -47.3 | 179.2 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | V163 A181 G183 L189 | V163-V185 HydrophobicContact CG1-CB 4.3Å; V163-V185 HydrophobicContact CG1-CG1 4.24Å; V163-V185 HydrophobicContact CG2-CG1 4.43Å; A181-V185 WeakPolarHBondContact O-CB 3.45Å; A181-V185 VanDerWaalsContact O-CG2 3.25Å; A181-V185 WeakPolarHBondContact O-CG2 3.43Å; A181-V185 PolarHBondContact O-N 3.17Å; G183-V185 PolarHBondContact O-N 2.75Å; V185-L189 WeakPolarHBondContact O-CB 3.41Å; V185-L189 PolarHBondContact O-N 2.84Å |
| 186 | T | 83.8 | Confident | 79.5 | Confident | 5 Ų | 5 | 58.3 Ų | 58.3 | 3% | 0.031 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.2 | -47.9 | -176.8 | -56.1 | 0 | 0 | 0 | 0 | 111.5 | L159 F160 A182 G183 F190 | L159-T186 HydrophobicContact CB-CG2 4.1Å; L159-T186 HydrophobicContact CD2-CG2 3.9Å; L159-T186 HydrophobicContact CG-CG2 4.01Å; F160-T186 WeakPolarHBondContact CA-OG1 3.07Å; F160-T186 HydrophobicContact CB-CG2 4.16Å; A182-T186 WeakPolarHBondContact O-CB 3.36Å; A182-T186 PolarHBondContact O-N 2.78Å; A182-T186 PolarHBondContact O-OG1 3.41Å; G183-T186 PolarHBondContact O-N 2.86Å; T186-F190 WeakPolarHBondContact O-CB 3.27Å; T186-F190 PolarHBondContact O-N 3.04Å |
| 187 | V | 84.6 | Confident | 80.7 | Confident | 42 Ų | 42 | 66.8 Ų | 66.8 | 26% | 0.255 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -75.6 | -36.7 | -178.1 | -177.7 | 0 | 0 | 0 | 0 | 111 | G183 F190 R191 G202 | G183-V187 WeakPolarHBondContact O-CB 3.39Å; G183-V187 VanDerWaalsContact O-CG2 3.3Å; G183-V187 WeakPolarHBondContact O-CG2 3.33Å; G183-V187 PolarHBondContact O-N 3.45Å; V187-F190 PolarHBondContact O-N 3.45Å; V187-R191 PolarHBondContact O-N 3.16Å; V187-R191 VanDerWaalsContact O-N 3.1Å; V187-G202 WeakPolarHBondContact CB-O 3.33Å; V187-G202 WeakPolarHBondContact CG1-O 3.45Å |
| 188 | G | 84.6 | Confident | 81.7 | Confident | 3 Ų | 3 | 65 Ų | 65 | 3% | 0.031 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -59.5 | -47.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A184 R191 L192 | A184-G188 WeakPolarHBondContact O-CA 3.47Å; A184-G188 PolarHBondContact O-N 3.03Å; G188-R191 PolarHBondContact O-N 3.44Å; G188-L192 PolarHBondContact O-N 3.39Å; G188-L192 VanDerWaalsContact O-N 3.08Å |
| 189 | L | 84 | Confident | 82.3 | Confident | 97 Ų | 97 | 67.7 Ų | 67.7 | 51% | 0.508 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -66.4 | -40.6 | 179.4 | -161.9 | 80.9 | 0 | 0 | 0 | 111.8 | L159 V185 R191 L192 | L159-L189 HydrophobicContact CD2-CD2 4.19Å; V185-L189 WeakPolarHBondContact O-CB 3.41Å; V185-L189 PolarHBondContact O-N 2.84Å; L189-R191 VanDerWaalsContact C-N 3.26Å; L189-R191 PolarHBondContact O-N 3.41Å; L189-L192 HydrophobicContact CB-CD1 4.48Å; L189-L192 HydrophobicContact CD1-CD1 3.42Å; L189-L192 VanDerWaalsContact CD1-CD1 3.42Å; L189-L192 HydrophobicContact CG-CD1 4.12Å; L189-L192 WeakPolarHBondContact O-CB 3.19Å; L189-L192 PolarHBondContact O-N 3.12Å |
| 190 | F | 81 | Confident | 83.1 | Confident | 108 Ų | 108 | 69 Ų | 69 | 47% | 0.474 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63.4 | -33.3 | 176.6 | -174.4 | -100.4 | 0 | 0 | 0 | 112.6 | T186 V187 | T186-F190 WeakPolarHBondContact O-CB 3.27Å; T186-F190 PolarHBondContact O-N 3.04Å; V187-F190 PolarHBondContact O-N 3.45Å |
| 191 | R | 80.8 | Confident | 83.6 | Confident | 89 Ų | 89 | 69.4 Ų | 69.4 | 34% | 0.336 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -90.6 | -1.4 | 179.1 | -102.8 | -179.2 | 161.4 | -179 | -2.8 | 115 | V187 G188 L189 N193 L194 G198 I205 | V187-R191 PolarHBondContact O-N 3.16Å; V187-R191 VanDerWaalsContact O-N 3.1Å; G188-R191 PolarHBondContact O-N 3.44Å; L189-R191 VanDerWaalsContact C-N 3.26Å; L189-R191 PolarHBondContact O-N 3.41Å; R191-N193 PolarHBondContact O-N 3Å; R191-L194 HydrophobicContact CG-CD1 4.39Å; R191-L194 PolarHBondContact O-N 3.29Å; R191-L194 VanDerWaalsContact O-N 3.08Å; R191-G198 WeakPolarHBondContact CB-O 3.28Å; R191-I205 VanDerWaalsContact NH1-CD1 3.3Å |
| 192 | L | 80.9 | Confident | 84 | Confident | 71 Ų | 71 | 68 Ų | 68 | 37% | 0.372 | 36% | 0.36 | S | S | . | . | G | 310 helix | trans | -57.7 | -32 | 173.6 | -88.3 | 170.8 | 0 | 0 | 0 | 113 | G188 L189 L194 G195 L199 | G188-L192 PolarHBondContact O-N 3.39Å; G188-L192 VanDerWaalsContact O-N 3.08Å; L189-L192 HydrophobicContact CB-CD1 4.48Å; L189-L192 HydrophobicContact CD1-CD1 3.42Å; L189-L192 VanDerWaalsContact CD1-CD1 3.42Å; L189-L192 HydrophobicContact CG-CD1 4.12Å; L189-L192 WeakPolarHBondContact O-CB 3.19Å; L189-L192 PolarHBondContact O-N 3.12Å; L192-L194 PolarHBondContact O-N 3.06Å; L192-G195 PolarHBondContact O-N 3.5Å; L192-L199 HydrophobicContact CD1-CD1 4.09Å; L192-L199 HydrophobicContact CD2-CB 3.75Å; L192-L199 HydrophobicContact CD2-CD1 3.28Å; L192-L199 HydrophobicContact CD2-CG 4.12Å; L192-L199 HydrophobicContact CG-CB 4.19Å; L192-L199 HydrophobicContact CG-CD1 3.65Å; L192-L199 HydrophobicContact CG-CG 4.46Å |
| 193 | N | 77.6 | Confident | 84.5 | Confident | 158 Ų | 158 | 70.1 Ų | 70.1 | 85% | 0.845 | 38% | 0.375 | S | S | * | . | G | 310 helix | trans | -67.8 | -4 | -179.9 | -151.3 | 10.7 | 0 | 0 | 0 | 113.1 | R191 | R191-N193 PolarHBondContact O-N 3Š|
| 194 | L | 80.2 | Confident | 84.9 | Confident | 134 Ų | 134 | 74.4 Ų | 74.4 | 70% | 0.702 | 40% | 0.4 | S | S | * | . | G | 310 helix | trans | -107.3 | 8.9 | 172.1 | -67.6 | 90.5 | 0 | 0 | 0 | 112.9 | R191 L192 | R191-L194 HydrophobicContact CG-CD1 4.39Å; R191-L194 PolarHBondContact O-N 3.29Å; R191-L194 VanDerWaalsContact O-N 3.08Å; L192-L194 PolarHBondContact O-N 3.06Å |
| 195 | G | 88.5 | Confident | 85.1 | Confident | 35 Ų | 35 | 77.5 Ų | 77.5 | 36% | 0.361 | 41% | 0.414 | S | S | . | . | trans | 99.5 | 176.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115 | L192 R197 G198 L199 | L192-G195 PolarHBondContact O-N 3.5Å; G195-R197 VanDerWaalsContact C-N 3.32Å; G195-R197 PolarHBondContact O-N 2.88Å; G195-G198 WeakPolarHBondContact O-CA 3.28Å; G195-G198 PolarHBondContact O-N 2.88Å; G195-L199 PolarHBondContact O-N 3.37Å | ||
| 196 | L | 85.3 | Confident | 85.3 | Confident | 150 Ų | 150 | 74 Ų | 74 | 79% | 0.785 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -59.3 | -37 | -177.3 | -86.5 | 102.5 | 0 | 0 | 0 | 113.6 | G198 L199 V200 | L196-G198 VanDerWaalsContact C-N 3.26Å; L196-G198 PolarHBondContact O-N 2.96Å; L196-L199 PolarHBondContact O-N 2.93Å; L196-V200 PolarHBondContact O-N 2.89Å; L196-V200 VanDerWaalsContact O-N 3.16Å |
| 197 | R | 84.6 | Confident | 85.4 | Confident | 232 Ų | 232 | 75 Ų | 75 | 88% | 0.875 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -64.8 | -33.6 | 175.7 | -70.7 | -176.7 | 169.9 | 179.3 | -2.9 | 111.9 | G195 A201 | G195-R197 VanDerWaalsContact C-N 3.32Å; G195-R197 PolarHBondContact O-N 2.88Å; R197-A201 WeakPolarHBondContact O-CB 3.31Å; R197-A201 PolarHBondContact O-N 3.08Å; R197-A201 VanDerWaalsContact O-N 3.16Å |
| 198 | G | 87.3 | Confident | 85.6 | Confident | 11 Ų | 11 | 75.7 Ų | 75.7 | 11% | 0.113 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -64.5 | -40.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112 | R191 G195 L196 G202 | R191-G198 WeakPolarHBondContact CB-O 3.28Å; G195-G198 WeakPolarHBondContact O-CA 3.28Å; G195-G198 PolarHBondContact O-N 2.88Å; L196-G198 VanDerWaalsContact C-N 3.26Å; L196-G198 PolarHBondContact O-N 2.96Å; G198-G202 WeakPolarHBondContact O-CA 3.33Å; G198-G202 PolarHBondContact O-N 2.98Å |
| 199 | L | 88.1 | Confident | 85.6 | Confident | 64 Ų | 64 | 80.4 Ų | 80.4 | 34% | 0.335 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.6 | -47 | 176.1 | 171.2 | 144.3 | 0 | 0 | 0 | 112.3 | L192 G195 L196 G202 S203 | L192-L199 HydrophobicContact CD1-CD1 4.09Å; L192-L199 HydrophobicContact CD2-CB 3.75Å; L192-L199 HydrophobicContact CD2-CD1 3.28Å; L192-L199 HydrophobicContact CD2-CG 4.12Å; L192-L199 HydrophobicContact CG-CB 4.19Å; L192-L199 HydrophobicContact CG-CD1 3.65Å; L192-L199 HydrophobicContact CG-CG 4.46Å; G195-L199 PolarHBondContact O-N 3.37Å; L196-L199 PolarHBondContact O-N 2.93Å; L199-G202 PolarHBondContact O-N 3.21Å; L199-S203 VanDerWaalsContact O-CB 3.27Å; L199-S203 WeakPolarHBondContact O-CB 3.46Å; L199-S203 PolarHBondContact O-N 2.74Å |
| 200 | V | 89.4 | Confident | 85.5 | Confident | 91 Ų | 91 | 75.9 Ų | 75.9 | 55% | 0.552 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -64.9 | -47.8 | -177.9 | 178.6 | 0 | 0 | 0 | 0 | 110.4 | L196 G202 S203 V204 | L196-V200 PolarHBondContact O-N 2.89Å; L196-V200 VanDerWaalsContact O-N 3.16Å; V200-G202 VanDerWaalsContact C-N 3.33Å; V200-G202 PolarHBondContact O-N 2.99Å; V200-S203 PolarHBondContact O-N 3.32Å; V200-V204 VanDerWaalsContact O-CG2 3.27Å; V200-V204 WeakPolarHBondContact O-CG2 3.45Å; V200-V204 PolarHBondContact O-N 3.15Å |
| 201 | A | 90.3 | Very high | 85.7 | Confident | 45 Ų | 45 | 75.3 Ų | 75.3 | 37% | 0.372 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -63.7 | -39.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R197 I205 | R197-A201 WeakPolarHBondContact O-CB 3.31Å; R197-A201 PolarHBondContact O-N 3.08Å; R197-A201 VanDerWaalsContact O-N 3.16Å; A201-I205 WeakPolarHBondContact O-CB 3.2Å; A201-I205 VanDerWaalsContact O-CD1 3.31Å; A201-I205 WeakPolarHBondContact O-CD1 3.41Å; A201-I205 WeakPolarHBondContact O-CG1 3.41Å; A201-I205 PolarHBondContact O-N 3.18Å |
| 202 | G | 87 | Confident | 85.9 | Confident | 0 Ų | 0 | 74.6 Ų | 74.6 | 0% | 0 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -64.5 | -40.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | V187 G198 L199 V200 G206 | V187-G202 WeakPolarHBondContact CB-O 3.33Å; V187-G202 WeakPolarHBondContact CG1-O 3.45Å; G198-G202 WeakPolarHBondContact O-CA 3.33Å; G198-G202 PolarHBondContact O-N 2.98Å; L199-G202 PolarHBondContact O-N 3.21Å; V200-G202 VanDerWaalsContact C-N 3.33Å; V200-G202 PolarHBondContact O-N 2.99Å; G202-G206 WeakPolarHBondContact O-CA 3.42Å; G202-G206 PolarHBondContact O-N 2.9Å |
| 203 | S | 87.4 | Confident | 85.8 | Confident | 44 Ų | 44 | 74.1 Ų | 74.1 | 31% | 0.308 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.8 | -45.8 | 177.2 | -179.4 | 0 | 0 | 0 | 0 | 111.7 | L199 V200 G206 A207 | L199-S203 VanDerWaalsContact O-CB 3.27Å; L199-S203 WeakPolarHBondContact O-CB 3.46Å; L199-S203 PolarHBondContact O-N 2.74Å; V200-S203 PolarHBondContact O-N 3.32Å; S203-G206 PolarHBondContact O-N 3.25Å; S203-A207 WeakPolarHBondContact O-CB 3.3Å; S203-A207 PolarHBondContact O-N 3.12Å |
| 204 | V | 90.1 | Very high | 85.6 | Confident | 96 Ų | 96 | 66.6 Ų | 66.6 | 58% | 0.582 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -62.3 | -46.6 | 177.8 | 175.5 | 0 | 0 | 0 | 0 | 111 | V200 A207 A208 | V200-V204 VanDerWaalsContact O-CG2 3.27Å; V200-V204 WeakPolarHBondContact O-CG2 3.45Å; V200-V204 PolarHBondContact O-N 3.15Å; V204-A207 PolarHBondContact O-N 3.47Å; V204-A208 WeakPolarHBondContact O-CB 3.4Å; V204-A208 PolarHBondContact O-N 3.01Å |
| 205 | I | 89.3 | Confident | 85.7 | Confident | 77 Ų | 77 | 62.9 Ų | 62.9 | 40% | 0.395 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.5 | -41.8 | 177.2 | -67.8 | 163.4 | 0 | 0 | 0 | 110.6 | R191 A201 A207 A208 L209 | R191-I205 VanDerWaalsContact NH1-CD1 3.3Å; A201-I205 WeakPolarHBondContact O-CB 3.2Å; A201-I205 VanDerWaalsContact O-CD1 3.31Å; A201-I205 WeakPolarHBondContact O-CD1 3.41Å; A201-I205 WeakPolarHBondContact O-CG1 3.41Å; A201-I205 PolarHBondContact O-N 3.18Å; I205-A207 VanDerWaalsContact C-N 3.35Å; I205-A207 PolarHBondContact O-N 2.85Å; I205-A208 PolarHBondContact O-N 3.27Å; I205-L209 HydrophobicContact CG2-CD1 3.89Å; I205-L209 HydrophobicContact CG2-CG 4.35Å; I205-L209 WeakPolarHBondContact O-CB 3.3Å; I205-L209 WeakPolarHBondContact O-CG 3.27Å; I205-L209 PolarHBondContact O-N 2.77Å |
| 206 | G | 85.9 | Confident | 85.3 | Confident | 1 Ų | 1 | 67.6 Ų | 67.6 | 1% | 0.01 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.3 | -39.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | G183 G202 S203 G210 | G183-G206 VanDerWaalsContact C-C 3.47Å; G183-G206 CarbonylContact C-O 3.47Å; G183-G206 WeakPolarHBondContact O-CA 3.45Å; G202-G206 WeakPolarHBondContact O-CA 3.42Å; G202-G206 PolarHBondContact O-N 2.9Å; S203-G206 PolarHBondContact O-N 3.25Å; G206-G210 PolarHBondContact O-N 3.24Å |
| 207 | A | 87.3 | Confident | 84.7 | Confident | 26 Ų | 26 | 62.3 Ų | 62.3 | 22% | 0.215 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -64 | -47.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | V180 A184 S203 V204 I205 L209 G210 I211 | V180-A207 HydrophobicContact CG1-CB 3.8Å; A184-A207 HydrophobicContact CB-CB 4.11Å; S203-A207 WeakPolarHBondContact O-CB 3.3Å; S203-A207 PolarHBondContact O-N 3.12Å; V204-A207 PolarHBondContact O-N 3.47Å; I205-A207 VanDerWaalsContact C-N 3.35Å; I205-A207 PolarHBondContact O-N 2.85Å; A207-L209 VanDerWaalsContact C-N 3.33Å; A207-L209 PolarHBondContact O-N 3.31Å; A207-G210 PolarHBondContact O-N 2.87Å; A207-G210 VanDerWaalsContact O-N 3.12Å; A207-I211 PolarHBondContact O-N 3.4Å |
| 208 | A | 88.5 | Confident | 84.3 | Confident | 58 Ų | 58 | 54.9 Ų | 54.9 | 48% | 0.479 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.2 | -40.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V204 I205 P212 | V204-A208 WeakPolarHBondContact O-CB 3.4Å; V204-A208 PolarHBondContact O-N 3.01Å; I205-A208 PolarHBondContact O-N 3.27Å; A208-P212 WeakPolarHBondContact O-CD 3.3Å |
| 209 | L | 84.9 | Confident | 83.8 | Confident | 102 Ų | 102 | 55.8 Ų | 55.8 | 53% | 0.534 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -74.5 | -24.2 | 175.4 | -68.1 | 176 | 0 | 0 | 0 | 113.1 | I205 A207 I211 P212 V213 | I205-L209 HydrophobicContact CG2-CD1 3.89Å; I205-L209 HydrophobicContact CG2-CG 4.35Å; I205-L209 WeakPolarHBondContact O-CB 3.3Å; I205-L209 WeakPolarHBondContact O-CG 3.27Å; I205-L209 PolarHBondContact O-N 2.77Å; A207-L209 VanDerWaalsContact C-N 3.33Å; A207-L209 PolarHBondContact O-N 3.31Å; L209-I211 VanDerWaalsContact C-N 3.3Å; L209-I211 PolarHBondContact O-N 3.24Å; L209-P212 VanDerWaalsContact O-CD 3.27Å; L209-P212 WeakPolarHBondContact O-CD 3.24Å; L209-P212 WeakPolarHBondContact O-CG 3.48Å; L209-V213 VanDerWaalsContact O-CG2 3.28Å; L209-V213 WeakPolarHBondContact O-CG2 3.47Å; L209-V213 PolarHBondContact O-N 3.48Å |
| 210 | G | 81.8 | Confident | 83.1 | Confident | 2 Ų | 2 | 57.3 Ų | 57.3 | 2% | 0.021 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -68.3 | -26.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | G206 A207 G214 | G206-G210 PolarHBondContact O-N 3.24Å; A207-G210 PolarHBondContact O-N 2.87Å; A207-G210 VanDerWaalsContact O-N 3.12Å; G210-G214 PolarHBondContact O-N 3.46Å |
| 211 | I | 83.6 | Confident | 82.2 | Confident | 96 Ų | 96 | 55.6 Ų | 55.6 | 49% | 0.492 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64 | -57.8 | 177.4 | -58.5 | 171.7 | 0 | 0 | 0 | 112 | V180 A207 L209 V213 G214 A215 | V180-I211 HydrophobicContact CG2-CB 4.5Å; V180-I211 HydrophobicContact CG2-CG1 3.59Å; A207-I211 PolarHBondContact O-N 3.4Å; L209-I211 VanDerWaalsContact C-N 3.3Å; L209-I211 PolarHBondContact O-N 3.24Å; I211-V213 VanDerWaalsContact C-N 3.27Å; I211-V213 PolarHBondContact O-N 2.96Å; I211-G214 PolarHBondContact O-N 3.01Å; I211-A215 WeakPolarHBondContact O-CB 3.25Å; I211-A215 PolarHBondContact O-N 2.93Å |
| 212 | P | 85.5 | Confident | 81.3 | Confident | 73 Ų | 73 | 57.7 Ų | 57.7 | 47% | 0.474 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.8 | -31.4 | 179.6 | 25.5 | -34.4 | 0 | 0 | 0 | 112.1 | A208 L209 A215 M216 | A208-P212 WeakPolarHBondContact O-CD 3.3Å; L209-P212 VanDerWaalsContact O-CD 3.27Å; L209-P212 WeakPolarHBondContact O-CD 3.24Å; L209-P212 WeakPolarHBondContact O-CG 3.48Å; P212-A215 PolarHBondContact O-N 3.33Å; P212-M216 WeakPolarHBondContact O-CB 3.37Å; P212-M216 PolarHBondContact O-N 2.71Å |
| 213 | V | 78.5 | Confident | 80.5 | Confident | 62 Ų | 62 | 65 Ų | 65 | 38% | 0.376 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 173.4 | 172.2 | 0 | 0 | 0 | 0 | 110.8 | F160 L209 I211 A215 M216 V217 | F160-V213 HydrophobicContact CE1-CG1 4.18Å; F160-V213 HydrophobicContact CZ-CG1 3.84Å; L209-V213 VanDerWaalsContact O-CG2 3.28Å; L209-V213 WeakPolarHBondContact O-CG2 3.47Å; L209-V213 PolarHBondContact O-N 3.48Å; I211-V213 VanDerWaalsContact C-N 3.27Å; I211-V213 PolarHBondContact O-N 2.96Å; V213-A215 VanDerWaalsContact C-N 3.34Å; V213-A215 PolarHBondContact O-N 3.43Å; V213-M216 PolarHBondContact O-N 2.99Å; V213-V217 VanDerWaalsContact O-CG2 3.31Å; V213-V217 WeakPolarHBondContact O-CG2 3.24Å; V213-V217 PolarHBondContact O-N 3.43Å |
| 214 | G | 75.2 | Confident | 79.6 | Confident | 0 Ų | 0 | 67.9 Ų | 67.9 | 0% | 0 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61.7 | -41.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G210 I211 V217 I218 | G210-G214 PolarHBondContact O-N 3.46Å; I211-G214 PolarHBondContact O-N 3.01Å; G214-V217 PolarHBondContact O-N 3.2Å; G214-I218 VanDerWaalsContact O-CG1 3.28Å; G214-I218 WeakPolarHBondContact O-CG1 3.27Å; G214-I218 PolarHBondContact O-N 3.31Å |
| 215 | A | 80.6 | Confident | 77.8 | Confident | 56 Ų | 56 | 66.5 Ų | 66.5 | 46% | 0.463 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -64.2 | -41 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | I211 P212 V213 I218 G219 | I211-A215 WeakPolarHBondContact O-CB 3.25Å; I211-A215 PolarHBondContact O-N 2.93Å; P212-A215 PolarHBondContact O-N 3.33Å; V213-A215 VanDerWaalsContact C-N 3.34Å; V213-A215 PolarHBondContact O-N 3.43Å; A215-I218 PolarHBondContact O-N 3.07Å; A215-G219 PolarHBondContact O-N 2.88Å |
| 216 | M | 80.4 | Confident | 76.1 | Confident | 133 Ų | 133 | 68.2 Ų | 68.2 | 66% | 0.655 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -66.9 | -39.6 | 177.8 | -176.8 | 144.6 | 161.9 | 0 | 0 | 111.8 | P212 V213 G219 L220 | P212-M216 WeakPolarHBondContact O-CB 3.37Å; P212-M216 PolarHBondContact O-N 2.71Å; V213-M216 PolarHBondContact O-N 2.99Å; M216-G219 PolarHBondContact O-N 3.19Å; M216-L220 HydrophobicContact CE-CD1 4.37Å; M216-L220 HydrophobicContact CG-CD1 3.91Å; M216-L220 WeakPolarHBondContact O-CB 3.5Å; M216-L220 WeakPolarHBondContact O-CD1 3.49Å; M216-L220 PolarHBondContact O-N 3.13Å |
| 217 | V | 74.1 | Confident | 74.6 | Confident | 39 Ų | 39 | 71.5 Ų | 71.5 | 24% | 0.236 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.1 | -44.9 | 173.9 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | Y179 V213 G214 G219 L220 Q221 | Y179-V217 HydrophobicContact CE2-CG1 4.45Å; V213-V217 VanDerWaalsContact O-CG2 3.31Å; V213-V217 WeakPolarHBondContact O-CG2 3.24Å; V213-V217 PolarHBondContact O-N 3.43Å; G214-V217 PolarHBondContact O-N 3.2Å; V217-G219 VanDerWaalsContact C-N 3.33Å; V217-G219 PolarHBondContact O-N 3.33Å; V217-L220 PolarHBondContact O-N 2.82Å; V217-Q221 VanDerWaalsContact CG1-NE2 3.28Å; V217-Q221 WeakPolarHBondContact O-CB 3.41Å; V217-Q221 WeakPolarHBondContact O-CG 3.38Å; V217-Q221 PolarHBondContact O-N 3.48Å |
| 218 | I | 75.1 | Confident | 73 | Confident | 76 Ų | 76 | 75.3 Ų | 75.3 | 39% | 0.39 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -61.9 | -43.3 | 175.4 | -68 | 166 | 0 | 0 | 0 | 110.5 | V176 G214 A215 Q221 S222 | V176-I218 HydrophobicContact CG2-CD1 3.76Å; G214-I218 VanDerWaalsContact O-CG1 3.28Å; G214-I218 WeakPolarHBondContact O-CG1 3.27Å; G214-I218 PolarHBondContact O-N 3.31Å; A215-I218 PolarHBondContact O-N 3.07Å; I218-Q221 WeakPolarHBondContact O-CB 3.4Å; I218-Q221 PolarHBondContact O-N 3.03Å; I218-S222 PolarHBondContact O-N 2.72Å; I218-S222 PolarHBondContact O-OG 3.19Å; I218-S222 VanDerWaalsContact O-OG 3.12Å |
| 219 | G | 77.6 | Confident | 71.3 | Confident | 31 Ų | 31 | 79.7 Ų | 79.7 | 32% | 0.32 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -62.5 | -44 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | A215 M216 V217 Q221 S222 L223 | A215-G219 PolarHBondContact O-N 2.88Å; M216-G219 PolarHBondContact O-N 3.19Å; V217-G219 VanDerWaalsContact C-N 3.33Å; V217-G219 PolarHBondContact O-N 3.33Å; G219-Q221 VanDerWaalsContact C-N 3.31Å; G219-Q221 PolarHBondContact O-N 2.81Å; G219-S222 PolarHBondContact O-N 2.87Å; G219-L223 WeakPolarHBondContact O-CG 3.41Å; G219-L223 PolarHBondContact O-N 3.41Å |
| 220 | L | 73.1 | Confident | 70 | Confident | 96 Ų | 96 | 78.2 Ų | 78.2 | 50% | 0.503 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62 | -38.8 | 173.9 | -93.5 | 143.1 | 0 | 0 | 0 | 111.9 | M216 V217 L223 T224 | M216-L220 HydrophobicContact CE-CD1 4.37Å; M216-L220 HydrophobicContact CG-CD1 3.91Å; M216-L220 WeakPolarHBondContact O-CB 3.5Å; M216-L220 WeakPolarHBondContact O-CD1 3.49Å; M216-L220 PolarHBondContact O-N 3.13Å; V217-L220 PolarHBondContact O-N 2.82Å; L220-L223 PolarHBondContact O-N 2.88Å; L220-T224 WeakPolarHBondContact O-CB 3.49Å; L220-T224 PolarHBondContact O-N 3.37Å; L220-T224 PolarHBondContact O-OG1 3.49Å |
| 221 | Q | 70 | Confident | 69 | Low | 55 Ų | 55 | 84.2 Ų | 84.2 | 26% | 0.257 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -67.9 | -37.7 | 175.1 | -71.5 | 171.7 | 9.9 | 0 | 0 | 112.2 | V217 I218 G219 L223 T224 F228 | V217-Q221 VanDerWaalsContact CG1-NE2 3.28Å; V217-Q221 WeakPolarHBondContact O-CB 3.41Å; V217-Q221 WeakPolarHBondContact O-CG 3.38Å; V217-Q221 PolarHBondContact O-N 3.48Å; I218-Q221 WeakPolarHBondContact O-CB 3.4Å; I218-Q221 PolarHBondContact O-N 3.03Å; G219-Q221 VanDerWaalsContact C-N 3.31Å; G219-Q221 PolarHBondContact O-N 2.81Å; Q221-L223 VanDerWaalsContact C-N 3.33Å; Q221-T224 PolarHBondContact O-N 3.31Å; Q221-F228 HydrophobicContact CG-CB 4.32Å |
| 222 | S | 71.7 | Confident | 67.9 | Low | 89 Ų | 89 | 82.3 Ų | 82.3 | 62% | 0.622 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -64.8 | -36.9 | 173.8 | -62.9 | 0 | 0 | 0 | 0 | 112.3 | I218 G219 | I218-S222 PolarHBondContact O-N 2.72Å; I218-S222 PolarHBondContact O-OG 3.19Å; I218-S222 VanDerWaalsContact O-OG 3.12Å; G219-S222 PolarHBondContact O-N 2.87Å |
| 223 | L | 69.9 | Low | 66.6 | Low | 154 Ų | 154 | 83.4 Ų | 83.4 | 81% | 0.806 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -74.9 | -28.6 | 178 | -70.2 | 172.2 | 0 | 0 | 0 | 113.5 | G219 L220 Q221 G225 | G219-L223 WeakPolarHBondContact O-CG 3.41Å; G219-L223 PolarHBondContact O-N 3.41Å; L220-L223 PolarHBondContact O-N 2.88Å; Q221-L223 VanDerWaalsContact C-N 3.33Å; L223-G225 PolarHBondContact O-N 3.48Å |
| 224 | T | 67.5 | Low | 65.9 | Low | 103 Ų | 103 | 86.5 Ų | 86.5 | 63% | 0.632 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.3 | -3.6 | -178.9 | -50.3 | 0 | 0 | 0 | 0 | 112.1 | L220 Q221 E226 | L220-T224 WeakPolarHBondContact O-CB 3.49Å; L220-T224 PolarHBondContact O-N 3.37Å; L220-T224 PolarHBondContact O-OG1 3.49Å; Q221-T224 PolarHBondContact O-N 3.31Å; T224-E226 PolarHBondContact O-N 2.91Å |
| 225 | G | 54.2 | Low | 65.3 | Low | 68 Ų | 68 | 88.5 Ų | 88.5 | 70% | 0.701 | 46% | 0.459 | S | S | * | . | S | Bend | trans | 72.7 | -21.5 | 170.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | L223 | L223-G225 PolarHBondContact O-N 3.48Š|
| 226 | E | 51.9 | Low | 64.4 | Low | 112 Ų | 112 | 90.9 Ų | 90.9 | 52% | 0.523 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -110.4 | 108.9 | 172.3 | -74.7 | -167.7 | 135.3 | 0 | 0 | 110.3 | T224 F228 | T224-E226 PolarHBondContact O-N 2.91Å; E226-F228 PolarHBondContact O-N 2.92Å |
| 227 | T | 54.8 | Low | 63.8 | Low | 70 Ų | 70 | 92.4 Ų | 92.4 | 43% | 0.429 | 45% | 0.454 | S | S | . | . | trans | -61.3 | 124.8 | 175.5 | 60.7 | 0 | 0 | 0 | 0 | 109.7 | R229 E230 R231 | T227-R229 PolarHBondContact O-N 3.37Å; T227-E230 WeakPolarHBondContact O-CB 3.19Å; T227-E230 PolarHBondContact O-N 2.86Å; T227-R231 PolarHBondContact O-N 2.91Å | ||
| 228 | F | 53.1 | Low | 63.8 | Low | 107 Ų | 107 | 95.8 Ų | 95.8 | 47% | 0.469 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -53.3 | -25.3 | 178 | -153.8 | -94.8 | 0 | 0 | 0 | 112 | Q221 E226 R232 | Q221-F228 HydrophobicContact CG-CB 4.32Å; E226-F228 PolarHBondContact O-N 2.92Å; F228-R232 WeakPolarHBondContact O-CB 3.47Å; F228-R232 PolarHBondContact O-N 3.41Å |
| 229 | R | 54 | Low | 63.5 | Low | 149 Ų | 149 | 96.3 Ų | 96.3 | 56% | 0.562 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -68.3 | -28.6 | 175.6 | -150.7 | -177 | 72.5 | 91 | -0.5 | 114.1 | T227 R233 | T227-R229 PolarHBondContact O-N 3.37Å; R229-R233 VanDerWaalsContact CZ-NH2 3.28Å; R229-R233 PolarHBondContact O-NE 2.66Å; R229-R233 PolarHBondContact O-NH2 3.04Å |
| 230 | E | 58.3 | Low | 62.9 | Low | 71 Ų | 71 | 98.2 Ų | 98.2 | 33% | 0.332 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -83.2 | -47.2 | 174.2 | -155 | 70.3 | -162.5 | 0 | 0 | 109.4 | T227 R232 R233 R234 | T227-E230 WeakPolarHBondContact O-CB 3.19Å; T227-E230 PolarHBondContact O-N 2.86Å; E230-R232 PolarHBondContact O-N 3.25Å; E230-R233 PolarHBondContact O-N 2.92Å; E230-R233 VanDerWaalsContact O-N 3.13Å; E230-R233 IonicContact OE2-CZ 2.79Å; E230-R233 IonicContact OE2-NH1 3.16Å; E230-R233 IonicContact OE2-NH2 3.97Å; E230-R233 PolarHBondContact OE2-NH2 3.47Å; E230-R234 WeakPolarHBondContact O-CG 3.44Å; E230-R234 PolarHBondContact O-N 3.35Å |
| 231 | R | 59.3 | Low | 63.2 | Low | 128 Ų | 128 | 99.7 Ų | 99.7 | 48% | 0.483 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -58.7 | -46.2 | 177.7 | -170.3 | 175.4 | 178.2 | 152 | 5.8 | 112.6 | T227 R233 R234 E235 | T227-R231 PolarHBondContact O-N 2.91Å; R231-R233 VanDerWaalsContact C-N 3.29Å; R231-R233 PolarHBondContact O-N 3.41Å; R231-R234 PolarHBondContact O-N 3.37Å; R231-R234 VanDerWaalsContact O-N 3.14Å; R231-E235 HydrophobicContact CG-CG 4.28Å; R231-E235 VanDerWaalsContact CG-OE1 3.27Å; R231-E235 WeakPolarHBondContact CG-OE1 3.23Å; R231-E235 IonicContact CZ-OE1 3.91Å; R231-E235 IonicContact NE-OE1 2.93Å; R231-E235 PolarHBondContact NE-OE1 2.71Å; R231-E235 WeakPolarHBondContact O-CB 3.27Å; R231-E235 WeakPolarHBondContact O-CG 3.48Å; R231-E235 PolarHBondContact O-N 3.02Å |
| 232 | R | 60.4 | Low | 63.5 | Low | 57 Ų | 57 | 102.2 Ų | 102.2 | 22% | 0.215 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -64.2 | -31.7 | 176.9 | -158.8 | 81.4 | -166.5 | 130.5 | 4.1 | 113 | E84 F228 E230 E235 R236 | E84-R232 VanDerWaalsContact CD-NH2 3.27Å; E84-R232 IonicContact OE1-CZ 3.93Å; E84-R232 IonicContact OE1-NE 3.93Å; E84-R232 IonicContact OE1-NH2 3.85Å; E84-R232 PolarHBondContact OE1-NH2 2.95Å; F228-R232 WeakPolarHBondContact O-CB 3.47Å; F228-R232 PolarHBondContact O-N 3.41Å; E230-R232 PolarHBondContact O-N 3.25Å; R232-E235 IonicContact NH1-OE2 2.65Å; R232-E235 PolarHBondContact NH1-OE2 3.11Å; R232-E235 VanDerWaalsContact NH1-OE2 3.16Å; R232-R236 WeakPolarHBondContact O-CG 3.39Å; R232-R236 PolarHBondContact O-N 3.08Å |
| 233 | R | 58.8 | Low | 63.7 | Low | 96 Ų | 96 | 103.4 Ų | 103.4 | 36% | 0.362 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -75.5 | -32.6 | 175.1 | -93.7 | -176.3 | -72 | 144.8 | 12.2 | 111.8 | R229 E230 R231 R237 | R229-R233 VanDerWaalsContact CZ-NH2 3.28Å; R229-R233 PolarHBondContact O-NE 2.66Å; R229-R233 PolarHBondContact O-NH2 3.04Å; E230-R233 PolarHBondContact O-N 2.92Å; E230-R233 VanDerWaalsContact O-N 3.13Å; E230-R233 IonicContact OE2-CZ 2.79Å; E230-R233 IonicContact OE2-NH1 3.16Å; E230-R233 IonicContact OE2-NH2 3.97Å; E230-R233 PolarHBondContact OE2-NH2 3.47Å; R231-R233 VanDerWaalsContact C-N 3.29Å; R231-R233 PolarHBondContact O-N 3.41Å; R233-R237 VanDerWaalsContact O-CG 3.23Å; R233-R237 WeakPolarHBondContact O-CG 3.38Å; R233-R237 PolarHBondContact O-N 2.85Å |
| 234 | R | 63.6 | Low | 64.1 | Low | 126 Ų | 126 | 99.5 Ų | 99.5 | 48% | 0.475 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -73.3 | -52 | 175.4 | -70.2 | 178.4 | -173.4 | 178.3 | 1.3 | 111.7 | E230 R231 R236 R237 E238 | E230-R234 WeakPolarHBondContact O-CG 3.44Å; E230-R234 PolarHBondContact O-N 3.35Å; R231-R234 PolarHBondContact O-N 3.37Å; R231-R234 VanDerWaalsContact O-N 3.14Å; R234-R236 VanDerWaalsContact C-N 3.25Å; R234-R236 PolarHBondContact O-N 3.39Å; R234-R237 WeakPolarHBondContact O-CA 3.32Å; R234-R237 WeakPolarHBondContact O-CB 3.31Å; R234-R237 PolarHBondContact O-N 3.4Å; R234-E238 WeakPolarHBondContact O-CG 3.29Å; R234-E238 PolarHBondContact O-N 3.39Å |
| 235 | E | 63.8 | Low | 64.9 | Low | 43 Ų | 43 | 97.1 Ų | 97.1 | 20% | 0.201 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -55 | -40 | 178.3 | -71.7 | 170.4 | 178 | 0 | 0 | 111.9 | R231 R232 L239 | R231-E235 HydrophobicContact CG-CG 4.28Å; R231-E235 VanDerWaalsContact CG-OE1 3.27Å; R231-E235 WeakPolarHBondContact CG-OE1 3.23Å; R231-E235 IonicContact CZ-OE1 3.91Å; R231-E235 IonicContact NE-OE1 2.93Å; R231-E235 PolarHBondContact NE-OE1 2.71Å; R231-E235 WeakPolarHBondContact O-CB 3.27Å; R231-E235 WeakPolarHBondContact O-CG 3.48Å; R231-E235 PolarHBondContact O-N 3.02Å; R232-E235 IonicContact NH1-OE2 2.65Å; R232-E235 PolarHBondContact NH1-OE2 3.11Å; R232-E235 VanDerWaalsContact NH1-OE2 3.16Å; E235-L239 WeakPolarHBondContact O-CB 3.37Å; E235-L239 VanDerWaalsContact O-CG 3.3Å; E235-L239 WeakPolarHBondContact O-CG 3.3Å; E235-L239 PolarHBondContact O-N 3.5Å |
| 236 | R | 59.9 | Low | 66.1 | Low | 106 Ų | 106 | 99.4 Ų | 99.4 | 40% | 0.4 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -72.5 | -31.3 | 175.9 | -71 | -172.9 | -157.3 | -106.6 | -0.9 | 113.7 | E84 R232 R234 Y240 | E84-R236 IonicContact OE1-CZ 3.61Å; E84-R236 IonicContact OE1-NH1 3.64Å; E84-R236 IonicContact OE1-NH2 3.15Å; E84-R236 PolarHBondContact OE1-NH2 2.96Å; E84-R236 VanDerWaalsContact OE1-NH2 3.15Å; R232-R236 WeakPolarHBondContact O-CG 3.39Å; R232-R236 PolarHBondContact O-N 3.08Å; R234-R236 VanDerWaalsContact C-N 3.25Å; R234-R236 PolarHBondContact O-N 3.39Å; R236-Y240 WeakPolarHBondContact O-CB 3.39Å; R236-Y240 PolarHBondContact O-N 2.87Å; R236-Y240 VanDerWaalsContact O-N 3.1Å |
| 237 | R | 68.6 | Low | 67.2 | Low | 164 Ų | 164 | 98 Ų | 98 | 62% | 0.619 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -68.8 | -45.6 | 173.7 | -77.5 | 172.5 | -167.9 | -105.4 | 1.8 | 110.3 | R233 R234 L239 Y240 E241 | R233-R237 VanDerWaalsContact O-CG 3.23Å; R233-R237 WeakPolarHBondContact O-CG 3.38Å; R233-R237 PolarHBondContact O-N 2.85Å; R234-R237 WeakPolarHBondContact O-CA 3.32Å; R234-R237 WeakPolarHBondContact O-CB 3.31Å; R234-R237 PolarHBondContact O-N 3.4Å; R237-L239 VanDerWaalsContact C-N 3.35Å; R237-L239 PolarHBondContact O-N 2.91Å; R237-Y240 PolarHBondContact O-N 3.48Å; R237-Y240 VanDerWaalsContact O-N 3.12Å; R237-E241 WeakPolarHBondContact O-CB 3.41Å; R237-E241 WeakPolarHBondContact O-CG 3.2Å; R237-E241 PolarHBondContact O-N 3.38Å |
| 238 | E | 74.2 | Confident | 68.6 | Low | 110 Ų | 110 | 97.5 Ų | 97.5 | 51% | 0.514 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -59.3 | -45.7 | 177.4 | -69.4 | 167.2 | -164 | 0 | 0 | 111.1 | R234 Y240 E241 L242 | R234-E238 WeakPolarHBondContact O-CG 3.29Å; R234-E238 PolarHBondContact O-N 3.39Å; E238-Y240 VanDerWaalsContact C-N 3.33Å; E238-Y240 PolarHBondContact O-N 3.39Å; E238-E241 PolarHBondContact O-N 3.21Å; E238-L242 VanDerWaalsContact O-CG 3.3Å; E238-L242 WeakPolarHBondContact O-CG 3.24Å; E238-L242 PolarHBondContact O-N 3.43Å |
| 239 | L | 68.4 | Low | 70.2 | Confident | 87 Ų | 87 | 94.6 Ų | 94.6 | 46% | 0.455 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.6 | -37.5 | 175 | -75.8 | 166.5 | 0 | 0 | 0 | 113.1 | E235 R237 K243 | E235-L239 WeakPolarHBondContact O-CB 3.37Å; E235-L239 VanDerWaalsContact O-CG 3.3Å; E235-L239 WeakPolarHBondContact O-CG 3.3Å; E235-L239 PolarHBondContact O-N 3.5Å; R237-L239 VanDerWaalsContact C-N 3.35Å; R237-L239 PolarHBondContact O-N 2.91Å; L239-K243 PolarHBondContact O-N 3.27Å; L239-K243 VanDerWaalsContact O-N 3.08Å |
| 240 | Y | 66.4 | Low | 71.5 | Confident | 72 Ų | 72 | 94.3 Ų | 94.3 | 28% | 0.282 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -70.7 | -41.7 | 178.3 | -179.2 | -105.5 | 0 | 0 | 0 | 111.9 | P59 R236 R237 E238 L242 K243 L244 | P59-Y240 HydrophobicContact CB-CD1 4.38Å; P59-Y240 HydrophobicContact CB-CD2 4.03Å; P59-Y240 HydrophobicContact CB-CE1 4.16Å; P59-Y240 HydrophobicContact CB-CE2 3.83Å; P59-Y240 HydrophobicContact CB-CG 4.3Å; P59-Y240 WeakPolarHBondContact CD-OH 3.43Å; P59-Y240 HydrophobicContact CG-CE1 3.97Å; P59-Y240 HydrophobicContact CG-CE2 3.86Å; R236-Y240 WeakPolarHBondContact O-CB 3.39Å; R236-Y240 PolarHBondContact O-N 2.87Å; R236-Y240 VanDerWaalsContact O-N 3.1Å; R237-Y240 PolarHBondContact O-N 3.48Å; R237-Y240 VanDerWaalsContact O-N 3.12Å; E238-Y240 VanDerWaalsContact C-N 3.33Å; E238-Y240 PolarHBondContact O-N 3.39Å; Y240-L242 VanDerWaalsContact C-N 3.31Å; Y240-L242 PolarHBondContact O-N 3.07Å; Y240-K243 PolarHBondContact O-N 2.91Å; Y240-L244 HydrophobicContact CD1-CD1 3.69Å; Y240-L244 HydrophobicContact CD1-CG 4.24Å; Y240-L244 HydrophobicContact CE1-CD1 3.17Å; Y240-L244 HydrophobicContact CE1-CD2 4.47Å; Y240-L244 HydrophobicContact CE1-CG 3.81Å; Y240-L244 HydrophobicContact CE2-CG 4.34Å; Y240-L244 WeakPolarHBondContact O-CB 3.45Å; Y240-L244 WeakPolarHBondContact O-CG 3.25Å; Y240-L244 PolarHBondContact O-N 3.39Å |
| 241 | E | 77.9 | Confident | 72.6 | Confident | 126 Ų | 126 | 95.8 Ų | 95.8 | 59% | 0.589 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -61.4 | -40.1 | 175 | -74.6 | 176.3 | -172.6 | 0 | 0 | 111.3 | R237 E238 L244 A245 | R237-E241 WeakPolarHBondContact O-CB 3.41Å; R237-E241 WeakPolarHBondContact O-CG 3.2Å; R237-E241 PolarHBondContact O-N 3.38Å; E238-E241 PolarHBondContact O-N 3.21Å; E241-L244 PolarHBondContact O-N 3.39Å; E241-A245 WeakPolarHBondContact O-CB 3.4Å; E241-A245 PolarHBondContact O-N 2.99Å |
| 242 | L | 76.1 | Confident | 73.9 | Confident | 109 Ų | 109 | 96.3 Ų | 96.3 | 57% | 0.571 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -63.5 | -46.1 | 173.5 | -70.5 | 173.2 | 0 | 0 | 0 | 112.4 | E238 Y240 L244 A245 E246 | E238-L242 VanDerWaalsContact O-CG 3.3Å; E238-L242 WeakPolarHBondContact O-CG 3.24Å; E238-L242 PolarHBondContact O-N 3.43Å; Y240-L242 VanDerWaalsContact C-N 3.31Å; Y240-L242 PolarHBondContact O-N 3.07Å; L242-L244 VanDerWaalsContact C-N 3.32Å; L242-L244 PolarHBondContact O-N 3.35Å; L242-A245 WeakPolarHBondContact O-CB 3.23Å; L242-A245 PolarHBondContact O-N 3.47Å; L242-E246 WeakPolarHBondContact O-CG 3.48Å; L242-E246 PolarHBondContact O-N 3.39Å |
| 243 | K | 77.2 | Confident | 75 | Confident | 113 Ų | 113 | 98.6 Ų | 98.6 | 49% | 0.491 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -63.4 | -38.2 | 177 | -74.9 | -167.6 | 176.4 | -167.1 | 0 | 112 | D76 L239 Y240 W247 | D76-K243 IonicContact OD2-NZ 3.68Å; L239-K243 PolarHBondContact O-N 3.27Å; L239-K243 VanDerWaalsContact O-N 3.08Å; Y240-K243 PolarHBondContact O-N 2.91Å; K243-W247 WeakPolarHBondContact O-CB 3.1Å; K243-W247 PolarHBondContact O-N 2.87Å |
| 244 | L | 77.8 | Confident | 76.3 | Confident | 73 Ų | 73 | 97.7 Ų | 97.7 | 38% | 0.382 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 173.8 | -81.9 | 177.5 | 0 | 0 | 0 | 111.8 | Y240 E241 L242 W247 S248 | Y240-L244 HydrophobicContact CD1-CD1 3.69Å; Y240-L244 HydrophobicContact CD1-CG 4.24Å; Y240-L244 HydrophobicContact CE1-CD1 3.17Å; Y240-L244 HydrophobicContact CE1-CD2 4.47Å; Y240-L244 HydrophobicContact CE1-CG 3.81Å; Y240-L244 HydrophobicContact CE2-CG 4.34Å; Y240-L244 WeakPolarHBondContact O-CB 3.45Å; Y240-L244 WeakPolarHBondContact O-CG 3.25Å; Y240-L244 PolarHBondContact O-N 3.39Å; E241-L244 PolarHBondContact O-N 3.39Å; L242-L244 VanDerWaalsContact C-N 3.32Å; L242-L244 PolarHBondContact O-N 3.35Å; L244-W247 PolarHBondContact O-N 3.43Å; L244-S248 WeakPolarHBondContact O-CB 3.44Å; L244-S248 PolarHBondContact O-N 2.89Å; L244-S248 PolarHBondContact O-OG 2.92Å |
| 245 | A | 83.4 | Confident | 77.5 | Confident | 53 Ų | 53 | 97.1 Ų | 97.1 | 44% | 0.438 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.6 | -47.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111 | E241 L242 W247 S248 A249 | E241-A245 WeakPolarHBondContact O-CB 3.4Å; E241-A245 PolarHBondContact O-N 2.99Å; L242-A245 WeakPolarHBondContact O-CB 3.23Å; L242-A245 PolarHBondContact O-N 3.47Å; A245-W247 VanDerWaalsContact C-N 3.3Å; A245-W247 PolarHBondContact O-N 3.38Å; A245-S248 PolarHBondContact O-N 3.5Å; A245-S248 PolarHBondContact O-OG 3.32Å; A245-A249 PolarHBondContact O-N 3.29Å |
| 246 | E | 79.9 | Confident | 78.7 | Confident | 116 Ų | 116 | 101.5 Ų | 101.5 | 54% | 0.542 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.3 | -40.5 | 175.8 | -72.5 | -179.7 | -178.6 | 0 | 0 | 112.3 | L242 A249 R250 | L242-E246 WeakPolarHBondContact O-CG 3.48Å; L242-E246 PolarHBondContact O-N 3.39Å; E246-A249 PolarHBondContact O-N 2.95Å; E246-R250 WeakPolarHBondContact O-CG 3.4Å; E246-R250 PolarHBondContact O-N 3.44Å; E246-R250 VanDerWaalsContact O-N 3.08Å |
| 247 | W | 75.6 | Confident | 79.9 | Confident | 81 Ų | 81 | 101.5 Ų | 101.5 | 31% | 0.307 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.6 | -43.7 | 176.8 | -98 | 83.4 | 0 | 0 | 0 | 113.1 | P53 I56 K243 L244 A245 A249 R250 L251 | P53-W247 HydrophobicContact CB-CH2 4.35Å; P53-W247 HydrophobicContact CG-CE3 4.37Å; P53-W247 HydrophobicContact CG-CH2 3.4Å; P53-W247 VanDerWaalsContact CG-CH2 3.4Å; P53-W247 HydrophobicContact CG-CZ2 4.18Å; P53-W247 HydrophobicContact CG-CZ3 3.53Å; I56-W247 HydrophobicContact CD1-CD2 3.51Å; I56-W247 HydrophobicContact CD1-CE3 4.15Å; I56-W247 HydrophobicContact CD1-CG 4.03Å; I56-W247 HydrophobicContact CD1-CH2 3.78Å; I56-W247 HydrophobicContact CD1-CZ2 3.08Å; I56-W247 HydrophobicContact CD1-CZ3 4.27Å; I56-W247 HydrophobicContact CG1-CD2 4.09Å; I56-W247 HydrophobicContact CG1-CG 4.09Å; I56-W247 HydrophobicContact CG1-CZ2 4.35Å; K243-W247 WeakPolarHBondContact O-CB 3.1Å; K243-W247 PolarHBondContact O-N 2.87Å; L244-W247 PolarHBondContact O-N 3.43Å; A245-W247 VanDerWaalsContact C-N 3.3Å; A245-W247 PolarHBondContact O-N 3.38Å; W247-A249 PolarHBondContact O-N 3.4Å; W247-R250 PolarHBondContact O-N 3.02Å; W247-R250 VanDerWaalsContact O-N 3.13Å; W247-L251 HydrophobicContact CE3-CD1 3.58Å; W247-L251 HydrophobicContact CZ3-CD1 4.05Å; W247-L251 VanDerWaalsContact O-CD1 3.25Å; W247-L251 WeakPolarHBondContact O-CD1 3.48Å; W247-L251 PolarHBondContact O-N 3.18Å |
| 248 | S | 83.9 | Confident | 80.7 | Confident | 61 Ų | 61 | 98.3 Ų | 98.3 | 43% | 0.427 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60 | -38.8 | 177 | 73.5 | 0 | 0 | 0 | 0 | 111.3 | L244 A245 L251 Q252 | L244-S248 WeakPolarHBondContact O-CB 3.44Å; L244-S248 PolarHBondContact O-N 2.89Å; L244-S248 PolarHBondContact O-OG 2.92Å; A245-S248 PolarHBondContact O-N 3.5Å; A245-S248 PolarHBondContact O-OG 3.32Å; S248-L251 PolarHBondContact O-N 2.83Å; S248-Q252 WeakPolarHBondContact O-CG 3.13Å; S248-Q252 PolarHBondContact O-N 3.2Å; S248-Q252 VanDerWaalsContact O-N 3.08Å |
| 249 | A | 86.3 | Confident | 81.4 | Confident | 46 Ų | 46 | 97.5 Ų | 97.5 | 38% | 0.38 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.5 | -40.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | A245 E246 W247 Q252 L253 | A245-A249 PolarHBondContact O-N 3.29Å; E246-A249 PolarHBondContact O-N 2.95Å; W247-A249 PolarHBondContact O-N 3.4Å; A249-Q252 PolarHBondContact O-N 3.5Å; A249-L253 PolarHBondContact O-N 2.86Å |
| 250 | R | 81.1 | Confident | 82 | Confident | 143 Ų | 143 | 96 Ų | 96 | 54% | 0.54 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66 | -37.6 | 176 | -72.9 | 177.1 | 179.2 | -169.4 | 1.4 | 112.7 | E246 W247 T254 | E246-R250 WeakPolarHBondContact O-CG 3.4Å; E246-R250 PolarHBondContact O-N 3.44Å; E246-R250 VanDerWaalsContact O-N 3.08Å; W247-R250 PolarHBondContact O-N 3.02Å; W247-R250 VanDerWaalsContact O-N 3.13Å; R250-T254 PolarHBondContact O-N 2.93Å; R250-T254 PolarHBondContact O-OG1 3.36Å |
| 251 | L | 82.4 | Confident | 82.7 | Confident | 101 Ų | 101 | 97.6 Ų | 97.6 | 53% | 0.529 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.2 | -45.4 | 175.1 | -95.1 | 88.2 | 0 | 0 | 0 | 111.1 | W247 S248 L253 T254 D255 | W247-L251 HydrophobicContact CE3-CD1 3.58Å; W247-L251 HydrophobicContact CZ3-CD1 4.05Å; W247-L251 VanDerWaalsContact O-CD1 3.25Å; W247-L251 WeakPolarHBondContact O-CD1 3.48Å; W247-L251 PolarHBondContact O-N 3.18Å; S248-L251 PolarHBondContact O-N 2.83Å; L251-L253 VanDerWaalsContact C-N 3.32Å; L251-L253 PolarHBondContact O-N 3.21Å; L251-T254 PolarHBondContact O-N 3.47Å; L251-T254 VanDerWaalsContact O-N 3.11Å; L251-D255 WeakPolarHBondContact O-CB 3.39Å; L251-D255 PolarHBondContact O-N 3.32Å |
| 252 | Q | 86.6 | Confident | 82.9 | Confident | 140 Ų | 140 | 96.8 Ų | 96.8 | 65% | 0.654 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58 | -44.4 | 178.8 | -74.8 | 177.6 | -5.3 | 0 | 0 | 112.3 | S248 A249 T254 D255 E256 | S248-Q252 WeakPolarHBondContact O-CG 3.13Å; S248-Q252 PolarHBondContact O-N 3.2Å; S248-Q252 VanDerWaalsContact O-N 3.08Å; A249-Q252 PolarHBondContact O-N 3.5Å; Q252-T254 PolarHBondContact O-N 3.06Å; Q252-D255 PolarHBondContact O-N 3.5Å; Q252-E256 WeakPolarHBondContact O-CB 3.26Å; Q252-E256 PolarHBondContact O-N 3.1Å |
| 253 | L | 83.9 | Confident | 82.9 | Confident | 104 Ų | 104 | 96.6 Ų | 96.6 | 55% | 0.545 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.7 | -43.1 | 175.3 | -67.9 | 177.1 | 0 | 0 | 0 | 111.8 | A249 L251 D255 E256 L257 | A249-L253 PolarHBondContact O-N 2.86Å; L251-L253 VanDerWaalsContact C-N 3.32Å; L251-L253 PolarHBondContact O-N 3.21Å; L253-D255 VanDerWaalsContact C-N 3.32Å; L253-D255 PolarHBondContact O-N 2.94Å; L253-E256 PolarHBondContact O-N 3.37Å; L253-L257 WeakPolarHBondContact O-CB 3.34Å; L253-L257 WeakPolarHBondContact O-CD1 3.48Å; L253-L257 PolarHBondContact O-N 2.88Å |
| 254 | T | 85.9 | Confident | 82.5 | Confident | 78 Ų | 78 | 95.4 Ų | 95.4 | 48% | 0.479 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.2 | -38.5 | 179.8 | -51.3 | 0 | 0 | 0 | 0 | 111.5 | R250 L251 Q252 L257 I258 | R250-T254 PolarHBondContact O-N 2.93Å; R250-T254 PolarHBondContact O-OG1 3.36Å; L251-T254 PolarHBondContact O-N 3.47Å; L251-T254 VanDerWaalsContact O-N 3.11Å; Q252-T254 PolarHBondContact O-N 3.06Å; T254-L257 WeakPolarHBondContact O-CB 3.4Å; T254-L257 PolarHBondContact O-N 3.48Å; T254-I258 HydrophobicContact CG2-CD1 4.03Å; T254-I258 VanDerWaalsContact O-CG1 3.26Å; T254-I258 WeakPolarHBondContact O-CG1 3.13Å; T254-I258 PolarHBondContact O-N 3.05Å |
| 255 | D | 87.7 | Confident | 82 | Confident | 114 Ų | 114 | 95.4 Ų | 95.4 | 61% | 0.61 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.3 | -40.8 | 178.9 | -142.5 | 28.2 | 0 | 0 | 0 | 111.1 | L251 Q252 L253 L257 I258 D259 | L251-D255 WeakPolarHBondContact O-CB 3.39Å; L251-D255 PolarHBondContact O-N 3.32Å; Q252-D255 PolarHBondContact O-N 3.5Å; L253-D255 VanDerWaalsContact C-N 3.32Å; L253-D255 PolarHBondContact O-N 2.94Å; D255-L257 PolarHBondContact O-N 2.95Å; D255-I258 PolarHBondContact O-N 2.87Å; D255-D259 WeakPolarHBondContact O-CB 3.42Å; D255-D259 PolarHBondContact O-N 3.26Å |
| 256 | E | 88.8 | Confident | 81.3 | Confident | 135 Ų | 135 | 98 Ų | 98 | 63% | 0.631 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.2 | -40.1 | 172.6 | -174.5 | -179.5 | 177 | 0 | 0 | 112.2 | Q252 L253 D259 S260 | Q252-E256 WeakPolarHBondContact O-CB 3.26Å; Q252-E256 PolarHBondContact O-N 3.1Å; L253-E256 PolarHBondContact O-N 3.37Å; E256-D259 PolarHBondContact O-N 3.35Å; E256-S260 WeakPolarHBondContact O-CB 3.31Å; E256-S260 PolarHBondContact O-N 3.46Å; E256-S260 PolarHBondContact O-OG 3.04Å |
| 257 | L | 86.1 | Confident | 80.6 | Confident | 106 Ų | 106 | 96.6 Ų | 96.6 | 56% | 0.555 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.8 | -39.7 | 173.1 | -89 | 138.4 | 0 | 0 | 0 | 112 | L253 T254 D255 S260 L261 | L253-L257 WeakPolarHBondContact O-CB 3.34Å; L253-L257 WeakPolarHBondContact O-CD1 3.48Å; L253-L257 PolarHBondContact O-N 2.88Å; T254-L257 WeakPolarHBondContact O-CB 3.4Å; T254-L257 PolarHBondContact O-N 3.48Å; D255-L257 PolarHBondContact O-N 2.95Å; L257-S260 WeakPolarHBondContact CA-OG 3.38Å; L257-S260 PolarHBondContact O-OG 3.41Å; L257-L261 WeakPolarHBondContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CD1 3.32Å; L257-L261 PolarHBondContact O-N 3.46Å |
| 258 | I | 86 | Confident | 80.1 | Confident | 96 Ų | 96 | 98.1 Ų | 98.1 | 49% | 0.492 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.6 | -42.8 | 176.8 | -71.1 | 165.8 | 0 | 0 | 0 | 110.9 | T254 D255 L261 N262 | T254-I258 HydrophobicContact CG2-CD1 4.03Å; T254-I258 VanDerWaalsContact O-CG1 3.26Å; T254-I258 WeakPolarHBondContact O-CG1 3.13Å; T254-I258 PolarHBondContact O-N 3.05Å; D255-I258 PolarHBondContact O-N 2.87Å; I258-L261 WeakPolarHBondContact O-CB 3.36Å; I258-L261 PolarHBondContact O-N 3.09Å; I258-N262 WeakPolarHBondContact O-CB 3.48Å; I258-N262 PolarHBondContact O-N 3.14Å |
| 259 | D | 87.4 | Confident | 79.4 | Confident | 93 Ų | 93 | 100.3 Ų | 100.3 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.2 | -43 | 179.3 | -165.9 | 46.5 | 0 | 0 | 0 | 111.4 | D255 E256 L261 N262 I263 | D255-D259 WeakPolarHBondContact O-CB 3.42Å; D255-D259 PolarHBondContact O-N 3.26Å; E256-D259 PolarHBondContact O-N 3.35Å; D259-L261 VanDerWaalsContact C-N 3.34Å; D259-L261 PolarHBondContact O-N 2.95Å; D259-N262 PolarHBondContact O-N 3.33Å; D259-I263 WeakPolarHBondContact O-CB 3.4Å; D259-I263 WeakPolarHBondContact O-CD1 3.47Å; D259-I263 VanDerWaalsContact O-CG1 3.24Å; D259-I263 WeakPolarHBondContact O-CG1 3.32Å; D259-I263 PolarHBondContact O-N 3.49Å |
| 260 | S | 82.3 | Confident | 78.7 | Confident | 55 Ų | 55 | 100.5 Ų | 100.5 | 39% | 0.385 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.9 | -36.2 | 173.4 | 58.2 | 0 | 0 | 0 | 0 | 113.3 | E256 L257 S264 | E256-S260 WeakPolarHBondContact O-CB 3.31Å; E256-S260 PolarHBondContact O-N 3.46Å; E256-S260 PolarHBondContact O-OG 3.04Å; L257-S260 WeakPolarHBondContact CA-OG 3.38Å; L257-S260 PolarHBondContact O-OG 3.41Å; S260-S264 WeakPolarHBondContact O-CB 3.45Å; S260-S264 PolarHBondContact O-N 3.07Å; S260-S264 PolarHBondContact O-OG 3.36Å |
| 261 | L | 80.9 | Confident | 78.5 | Confident | 106 Ų | 106 | 97.8 Ų | 97.8 | 56% | 0.555 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.8 | -44.2 | 170.6 | -91.4 | 157.6 | 0 | 0 | 0 | 111.3 | L257 I258 D259 I263 S264 V265 | L257-L261 WeakPolarHBondContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CD1 3.32Å; L257-L261 PolarHBondContact O-N 3.46Å; I258-L261 WeakPolarHBondContact O-CB 3.36Å; I258-L261 PolarHBondContact O-N 3.09Å; D259-L261 VanDerWaalsContact C-N 3.34Å; D259-L261 PolarHBondContact O-N 2.95Å; L261-I263 VanDerWaalsContact C-N 3.35Å; L261-I263 PolarHBondContact O-N 2.97Å; L261-S264 PolarHBondContact O-N 3.36Å; L261-V265 VanDerWaalsContact O-CB 3.27Å; L261-V265 WeakPolarHBondContact O-CB 3.27Å; L261-V265 WeakPolarHBondContact O-CG2 3.5Å; L261-V265 PolarHBondContact O-N 3.03Å |
| 262 | N | 81.4 | Confident | 78.4 | Confident | 109 Ų | 109 | 98.2 Ų | 98.2 | 58% | 0.583 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -66.5 | -34 | 178.2 | -174.1 | 61.1 | 0 | 0 | 0 | 112.8 | I258 D259 V265 | I258-N262 WeakPolarHBondContact O-CB 3.48Å; I258-N262 PolarHBondContact O-N 3.14Å; D259-N262 PolarHBondContact O-N 3.33Å; N262-V265 CarbonylContact O-C 3.27Å; N262-V265 VanDerWaalsContact O-C 3.27Å |
| 263 | I | 75.9 | Confident | 78.1 | Confident | 106 Ų | 106 | 95.9 Ų | 95.9 | 54% | 0.544 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.9 | -38.8 | 173.6 | -68.6 | 162.7 | 0 | 0 | 0 | 111 | D259 L261 | D259-I263 WeakPolarHBondContact O-CB 3.4Å; D259-I263 WeakPolarHBondContact O-CD1 3.47Å; D259-I263 VanDerWaalsContact O-CG1 3.24Å; D259-I263 WeakPolarHBondContact O-CG1 3.32Å; D259-I263 PolarHBondContact O-N 3.49Å; L261-I263 VanDerWaalsContact C-N 3.35Å; L261-I263 PolarHBondContact O-N 2.97Å |
| 264 | S | 69.3 | Low | 78 | Confident | 88 Ų | 88 | 96 Ų | 96 | 62% | 0.615 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -71.9 | -35.9 | 176.5 | -58.6 | 0 | 0 | 0 | 0 | 111.9 | S260 L261 Q266 | S260-S264 WeakPolarHBondContact O-CB 3.45Å; S260-S264 PolarHBondContact O-N 3.07Å; S260-S264 PolarHBondContact O-OG 3.36Å; L261-S264 PolarHBondContact O-N 3.36Å; S264-Q266 PolarHBondContact O-N 3.32Å; S264-Q266 VanDerWaalsContact O-N 3.12Å |
| 265 | V | 66.3 | Low | 77.8 | Confident | 72 Ų | 72 | 98.6 Ų | 98.6 | 44% | 0.436 | 52% | 0.519 | S | S | . | . | S | Bend | trans | -86.1 | 63.4 | 171.8 | -175.9 | 0 | 0 | 0 | 0 | 107.7 | L261 N262 T270 | L261-V265 VanDerWaalsContact O-CB 3.27Å; L261-V265 WeakPolarHBondContact O-CB 3.27Å; L261-V265 WeakPolarHBondContact O-CG2 3.5Å; L261-V265 PolarHBondContact O-N 3.03Å; N262-V265 CarbonylContact O-C 3.27Å; N262-V265 VanDerWaalsContact O-C 3.27Å; V265-T270 HydrophobicContact CG1-CG2 3.38Å |
| 266 | Q | 70 | Confident | 77.6 | Confident | 109 Ų | 109 | 99.2 Ų | 99.2 | 51% | 0.509 | 52% | 0.516 | S | S | . | . | trans | -58.6 | 137.2 | 168.2 | -98.4 | -175.7 | 16.1 | 0 | 0 | 108.9 | S264 E268 E269 T270 | S264-Q266 PolarHBondContact O-N 3.32Å; S264-Q266 VanDerWaalsContact O-N 3.12Å; Q266-E268 HydrophobicContact CB-CB 4.4Å; Q266-E268 PolarHBondContact O-N 2.88Å; Q266-E269 HydrophobicContact CB-CG 4.26Å; Q266-E269 PolarHBondContact O-N 3.04Å; Q266-T270 PolarHBondContact O-N 2.94Å | ||
| 267 | P | 64.1 | Low | 77.3 | Confident | 85 Ų | 85 | 97 Ų | 97 | 55% | 0.552 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -56.6 | -27.8 | 176.1 | 23 | -33 | 0 | 0 | 0 | 111.6 | T270 N271 | P267-T270 WeakPolarHBondContact CA-OG1 3.44Å; P267-T270 PolarHBondContact O-N 2.95Å; P267-T270 PolarHBondContact O-OG1 3.31Å; P267-N271 WeakPolarHBondContact O-CB 3.38Å; P267-N271 PolarHBondContact O-N 3.27Å; P267-N271 PolarHBondContact O-ND2 3.12Å |
| 268 | E | 65.6 | Low | 77.1 | Confident | 114 Ų | 114 | 98.7 Ų | 98.7 | 53% | 0.533 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 173.2 | -70 | -66.5 | 148.8 | 0 | 0 | 113.5 | Q266 K272 | Q266-E268 HydrophobicContact CB-CB 4.4Å; Q266-E268 PolarHBondContact O-N 2.88Å; E268-K272 VanDerWaalsContact O-CD 3.31Å; E268-K272 WeakPolarHBondContact O-CD 3.43Å; E268-K272 WeakPolarHBondContact O-CG 3.31Å; E268-K272 PolarHBondContact O-N 3.26Å |
| 269 | E | 69.8 | Low | 77 | Confident | 107 Ų | 107 | 100 Ų | 100 | 50% | 0.5 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -71.1 | -42.3 | 176.9 | -64 | -96.6 | 126.2 | 0 | 0 | 110.1 | Q266 N271 K272 D273 | Q266-E269 HydrophobicContact CB-CG 4.26Å; Q266-E269 PolarHBondContact O-N 3.04Å; E269-N271 PolarHBondContact O-N 3.42Å; E269-K272 PolarHBondContact O-N 3.41Å; E269-D273 PolarHBondContact O-N 3.45Å |
| 270 | T | 71.7 | Confident | 76.5 | Confident | 50 Ų | 50 | 101 Ų | 101 | 31% | 0.307 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.8 | -36.3 | 179 | 58.6 | 0 | 0 | 0 | 0 | 113.5 | V265 Q266 P267 D273 L274 | V265-T270 HydrophobicContact CG1-CG2 3.38Å; Q266-T270 PolarHBondContact O-N 2.94Å; P267-T270 WeakPolarHBondContact CA-OG1 3.44Å; P267-T270 PolarHBondContact O-N 2.95Å; P267-T270 PolarHBondContact O-OG1 3.31Å; T270-D273 PolarHBondContact O-N 2.95Å; T270-L274 WeakPolarHBondContact O-CB 3.44Å; T270-L274 VanDerWaalsContact O-CG 3.27Å; T270-L274 WeakPolarHBondContact O-CG 3.38Å; T270-L274 PolarHBondContact O-N 3.02Å |
| 271 | N | 77.1 | Confident | 76.2 | Confident | 86 Ų | 86 | 105 Ų | 105 | 46% | 0.46 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.7 | -41.7 | 175.7 | -79.1 | -57.2 | 0 | 0 | 0 | 110.6 | P267 E269 D273 L274 E275 | P267-N271 WeakPolarHBondContact O-CB 3.38Å; P267-N271 PolarHBondContact O-N 3.27Å; P267-N271 PolarHBondContact O-ND2 3.12Å; E269-N271 PolarHBondContact O-N 3.42Å; N271-D273 VanDerWaalsContact C-N 3.34Å; N271-D273 PolarHBondContact O-N 3.37Å; N271-L274 PolarHBondContact O-N 3.16Å; N271-E275 WeakPolarHBondContact O-CG 3.2Å; N271-E275 PolarHBondContact O-N 3.13Å |
| 272 | K | 79 | Confident | 76 | Confident | 110 Ų | 110 | 104.1 Ų | 104.1 | 48% | 0.478 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.7 | -40.6 | 174.2 | -71 | 166.5 | -168.4 | 165.7 | 0 | 112.3 | E268 E269 K276 | E268-K272 VanDerWaalsContact O-CD 3.31Å; E268-K272 WeakPolarHBondContact O-CD 3.43Å; E268-K272 WeakPolarHBondContact O-CG 3.31Å; E268-K272 PolarHBondContact O-N 3.26Å; E269-K272 PolarHBondContact O-N 3.41Å; K272-K276 VanDerWaalsContact O-CB 3.32Å; K272-K276 WeakPolarHBondContact O-CB 3.43Å; K272-K276 PolarHBondContact O-N 3.42Å |
| 273 | D | 81.5 | Confident | 75.8 | Confident | 91 Ų | 91 | 103.8 Ų | 103.8 | 49% | 0.487 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.3 | -38.5 | 176.9 | -76 | -24.6 | 0 | 0 | 0 | 112 | E269 T270 N271 K276 I277 | E269-D273 PolarHBondContact O-N 3.45Å; T270-D273 PolarHBondContact O-N 2.95Å; N271-D273 VanDerWaalsContact C-N 3.34Å; N271-D273 PolarHBondContact O-N 3.37Å; D273-K276 PolarHBondContact O-N 2.79Å; D273-I277 WeakPolarHBondContact O-CB 3.13Å; D273-I277 WeakPolarHBondContact O-CD1 3.2Å; D273-I277 WeakPolarHBondContact O-CG1 3.34Å; D273-I277 PolarHBondContact O-N 2.62Å |
| 274 | L | 80.4 | Confident | 75.5 | Confident | 107 Ų | 107 | 104.2 Ų | 104.2 | 56% | 0.56 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.9 | -46 | 174 | -78.5 | 168.9 | 0 | 0 | 0 | 111.9 | T270 N271 K276 I277 E278 | T270-L274 WeakPolarHBondContact O-CB 3.44Å; T270-L274 VanDerWaalsContact O-CG 3.27Å; T270-L274 WeakPolarHBondContact O-CG 3.38Å; T270-L274 PolarHBondContact O-N 3.02Å; N271-L274 PolarHBondContact O-N 3.16Å; L274-K276 VanDerWaalsContact C-N 3.29Å; L274-K276 PolarHBondContact O-N 2.97Å; L274-I277 PolarHBondContact O-N 3.34Å; L274-E278 PolarHBondContact O-N 3.32Å |
| 275 | E | 83.3 | Confident | 74.9 | Confident | 132 Ų | 132 | 110.8 Ų | 110.8 | 62% | 0.617 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -58.9 | -42.7 | 174.8 | -74.9 | 179.4 | 173.3 | 0 | 0 | 111.2 | N271 I277 E278 E279 | N271-E275 WeakPolarHBondContact O-CG 3.2Å; N271-E275 PolarHBondContact O-N 3.13Å; E275-I277 PolarHBondContact O-N 3.07Å; E275-E278 PolarHBondContact O-N 3.01Å; E275-E279 WeakPolarHBondContact O-CB 3.38Å; E275-E279 PolarHBondContact O-N 3.47Å |
| 276 | K | 81.9 | Confident | 74.4 | Confident | 126 Ų | 126 | 114.6 Ų | 114.6 | 55% | 0.548 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -67.5 | -35.4 | 177.8 | -165.5 | 174.2 | -174 | 177.3 | 0 | 112.8 | K272 D273 L274 L280 | K272-K276 VanDerWaalsContact O-CB 3.32Å; K272-K276 WeakPolarHBondContact O-CB 3.43Å; K272-K276 PolarHBondContact O-N 3.42Å; D273-K276 PolarHBondContact O-N 2.79Å; L274-K276 VanDerWaalsContact C-N 3.29Å; L274-K276 PolarHBondContact O-N 2.97Å; K276-L280 WeakPolarHBondContact O-CB 3.45Å; K276-L280 VanDerWaalsContact O-CG 3.24Å; K276-L280 WeakPolarHBondContact O-CG 3.29Å; K276-L280 PolarHBondContact O-N 3.13Å |
| 277 | I | 82.9 | Confident | 73.3 | Confident | 90 Ų | 90 | 115.6 Ų | 115.6 | 46% | 0.462 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -67.5 | -40.4 | 173.7 | -70.5 | 162.3 | 0 | 0 | 0 | 110.3 | D273 L274 E275 L280 L281 | D273-I277 WeakPolarHBondContact O-CB 3.13Å; D273-I277 WeakPolarHBondContact O-CD1 3.2Å; D273-I277 WeakPolarHBondContact O-CG1 3.34Å; D273-I277 PolarHBondContact O-N 2.62Å; L274-I277 PolarHBondContact O-N 3.34Å; E275-I277 PolarHBondContact O-N 3.07Å; I277-L280 PolarHBondContact O-N 2.71Å; I277-L281 HydrophobicContact CG2-CD1 3.74Å; I277-L281 HydrophobicContact CG2-CG 4.39Å; I277-L281 WeakPolarHBondContact O-CB 3.09Å; I277-L281 VanDerWaalsContact O-CG 3.27Å; I277-L281 WeakPolarHBondContact O-CG 3.48Å; I277-L281 PolarHBondContact O-N 3.24Å |
| 278 | E | 82.4 | Confident | 72.4 | Confident | 140 Ų | 140 | 118.3 Ų | 118.3 | 65% | 0.654 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -67 | -38.1 | 176.3 | -167.2 | 170 | -172.9 | 0 | 0 | 111.9 | L274 E275 L281 S282 | L274-E278 PolarHBondContact O-N 3.32Å; E275-E278 PolarHBondContact O-N 3.01Å; E278-L281 PolarHBondContact O-N 3.34Å; E278-S282 WeakPolarHBondContact O-CB 3.34Å; E278-S282 PolarHBondContact O-N 3.42Å; E278-S282 PolarHBondContact O-OG 3.19Å |
| 279 | E | 83.5 | Confident | 71.6 | Confident | 124 Ų | 124 | 122.9 Ų | 122.9 | 58% | 0.579 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -62.2 | -45.4 | 171.1 | -168.4 | -176.4 | -175.2 | 0 | 0 | 111.5 | E275 L281 S282 L283 | E275-E279 WeakPolarHBondContact O-CB 3.38Å; E275-E279 PolarHBondContact O-N 3.47Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 3.4Å; E279-S282 WeakPolarHBondContact CA-OG 3.38Å; E279-S282 PolarHBondContact O-N 3.02Å; E279-S282 PolarHBondContact O-OG 3.44Å; E279-L283 HydrophobicContact CG-CD1 4.5Å; E279-L283 WeakPolarHBondContact O-CD1 3.42Å; E279-L283 PolarHBondContact O-N 3.01Å |
| 280 | L | 77.9 | Confident | 70.5 | Confident | 115 Ų | 115 | 124.5 Ų | 124.5 | 60% | 0.602 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -67.1 | -31.8 | 177 | -72.8 | 173.9 | 0 | 0 | 0 | 113.3 | K276 I277 | K276-L280 WeakPolarHBondContact O-CB 3.45Å; K276-L280 VanDerWaalsContact O-CG 3.24Å; K276-L280 WeakPolarHBondContact O-CG 3.29Å; K276-L280 PolarHBondContact O-N 3.13Å; I277-L280 PolarHBondContact O-N 2.71Å |
| 281 | L | 75.8 | Confident | 69.3 | Low | 137 Ų | 137 | 126.9 Ų | 126.9 | 72% | 0.717 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -77.5 | -29.5 | 176.2 | -77.4 | 166.5 | 0 | 0 | 0 | 112.8 | I277 E278 E279 | I277-L281 HydrophobicContact CG2-CD1 3.74Å; I277-L281 HydrophobicContact CG2-CG 4.39Å; I277-L281 WeakPolarHBondContact O-CB 3.09Å; I277-L281 VanDerWaalsContact O-CG 3.27Å; I277-L281 WeakPolarHBondContact O-CG 3.48Å; I277-L281 PolarHBondContact O-N 3.24Å; E278-L281 PolarHBondContact O-N 3.34Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 3.4Å |
| 282 | S | 76 | Confident | 67.6 | Low | 88 Ų | 88 | 128.1 Ų | 128.1 | 62% | 0.615 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -82.1 | -17 | 175.8 | 59.3 | 0 | 0 | 0 | 0 | 113.2 | E278 E279 | E278-S282 WeakPolarHBondContact O-CB 3.34Å; E278-S282 PolarHBondContact O-N 3.42Å; E278-S282 PolarHBondContact O-OG 3.19Å; E279-S282 WeakPolarHBondContact CA-OG 3.38Å; E279-S282 PolarHBondContact O-N 3.02Å; E279-S282 PolarHBondContact O-OG 3.44Å |
| 283 | L | 78 | Confident | 66 | Low | 102 Ų | 102 | 128 Ų | 128 | 53% | 0.534 | 67% | 0.674 | S | S | . | * | S | Bend | trans | -61.4 | 131 | 165.6 | -108.1 | 78.7 | 0 | 0 | 0 | 110 | E279 R285 | E279-L283 HydrophobicContact CG-CD1 4.5Å; E279-L283 WeakPolarHBondContact O-CD1 3.42Å; E279-L283 PolarHBondContact O-N 3.01Å; L283-R285 PolarHBondContact O-N 2.66Å |
| 284 | P | 68.5 | Low | 64.3 | Low | 115 Ų | 115 | 132.8 Ų | 132.8 | 75% | 0.747 | 69% | 0.693 | S | S | * | * | trans | -58.6 | 126.5 | 177 | 22.6 | -30.6 | 0 | 0 | 0 | 109.4 | N286 | P284-N286 PolarHBondContact O-N 3.14Š| ||
| 285 | R | 57.8 | Low | 62.5 | Low | 226 Ų | 226 | 133 Ų | 133 | 85% | 0.853 | 70% | 0.704 | S | S | * | * | trans | -48.9 | 109.5 | 174.5 | -171.4 | 168.1 | -177.1 | 169 | -0.3 | 108.2 | L283 N287 | L283-R285 PolarHBondContact O-N 2.66Å; R285-N287 PolarHBondContact O-N 3.32Å | ||
| 286 | N | 55.7 | Low | 60.3 | Low | 153 Ų | 153 | 139.8 Ų | 139.8 | 82% | 0.818 | 74% | 0.736 | S | S | * | * | trans | -61.1 | 108 | 179.3 | -168.8 | 11.5 | 0 | 0 | 0 | 107.5 | P284 D288 | P284-N286 PolarHBondContact O-N 3.14Å; N286-D288 PolarHBondContact O-N 3.31Å; N286-D288 VanDerWaalsContact O-N 3.13Å | ||
| 287 | N | 47.5 | Very low | 59.2 | Low | 130 Ų | 130 | 140.5 Ų | 140.5 | 70% | 0.695 | 75% | 0.745 | S | S | * | * | trans | -60.1 | 115.5 | 177.7 | -76.2 | -23.5 | 0 | 0 | 0 | 108.7 | R285 K289 | R285-N287 PolarHBondContact O-N 3.32Å; N287-K289 PolarHBondContact O-N 3.35Å; N287-K289 VanDerWaalsContact O-N 3.08Å | ||
| 288 | D | 43.6 | Very low | 58 | Low | 142 Ų | 142 | 143.2 Ų | 143.2 | 76% | 0.759 | 76% | 0.76 | S | S | * | * | trans | 21.9 | 82.9 | 131.6 | -47.8 | -23.6 | 0 | 0 | 0 | 114.4 | N286 N290 | N286-D288 PolarHBondContact O-N 3.31Å; N286-D288 VanDerWaalsContact O-N 3.13Å; D288-N290 PolarHBondContact O-N 3.3Å | ||
| 289 | K | 50.3 | Low | 56.6 | Low | 210 Ų | 210 | 143.3 Ų | 143.3 | 91% | 0.913 | 77% | 0.766 | S | S | * | * | trans | -67.7 | 91.9 | 145.1 | -83.5 | -176.4 | 179.3 | 172.9 | 0 | 106.6 | N287 | N287-K289 PolarHBondContact O-N 3.35Å; N287-K289 VanDerWaalsContact O-N 3.08Å | ||
| 290 | N | 46.5 | Very low | 55 | Low | 141 Ų | 141 | 144.5 Ų | 144.5 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | trans | -139.4 | 110.3 | 152.4 | -122.2 | 7.7 | 0 | 0 | 0 | 111.5 | D288 | D288-N290 PolarHBondContact O-N 3.3Š| ||
| 291 | S | 46.7 | Very low | 53.6 | Low | 100 Ų | 100 | 146.3 Ų | 146.3 | 70% | 0.699 | 79% | 0.788 | S | S | * | * | trans | 53.1 | 102.7 | 138.1 | 58.1 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 292 | S | 40.1 | Very low | 52.1 | Low | 111 Ų | 111 | 146.9 Ų | 146.9 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | 175.6 | 102.8 | 120.3 | 56.8 | 0 | 0 | 0 | 0 | 110 | |||||
| 293 | S | 45.6 | Very low | 50.4 | Low | 109 Ų | 109 | 151.1 Ų | 151.1 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | 91 | 106.1 | 95.1 | -58.6 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 294 | Q | 46.8 | Very low | 48.3 | Very low | 190 Ų | 190 | 154.9 Ų | 154.9 | 89% | 0.888 | 83% | 0.826 | S | S | * | * | 50.8 | 105.9 | 126.4 | -165.4 | 176.3 | -0.2 | 0 | 0 | 119.3 | |||||
| 295 | S | 42.7 | Very low | 46.6 | Very low | 113 Ų | 113 | 158.3 Ų | 158.3 | 79% | 0.79 | 83% | 0.832 | S | S | * | * | trans | 179.2 | 127.8 | 137.6 | 46.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 296 | Q | 36.5 | Very low | 45.6 | Very low | 274 Ų | 274 | 152.1 Ų | 152.1 | 100% | 1.28 | 83% | 0.831 | S | S | * | * | trans | 86.6 | 0 | 167.4 | -65.8 | -167.2 | -24.7 | 0 | 0 | 118.6 |
Retrieved 296 of 296 residues in 334.3 ms
(Link to these results)