| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.6 | Very low | 27.7 | Very low | 253 Ų | 253 | 146.7 Ų | 146.7 | 100% | 1.246 | 83% | 0.832 | S | S | * | * | 0 | 124.8 | 0 | -78.5 | -167.8 | -71.3 | 0 | 0 | 108.3 | |||||
| 2 | G | 31.3 | Very low | 27.8 | Very low | 79 Ų | 79 | 151.8 Ų | 151.8 | 81% | 0.814 | 84% | 0.838 | S | S | * | * | trans | 123.6 | 55.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 3 | C | 25.3 | Very low | 27.8 | Very low | 126 Ų | 126 | 154.7 Ų | 154.7 | 85% | 0.851 | 84% | 0.841 | S | S | * | * | trans | -89.5 | 119.1 | 153.8 | -61.1 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 4 | T | 29.3 | Very low | 27.6 | Very low | 127 Ų | 127 | 149.1 Ų | 149.1 | 78% | 0.779 | 83% | 0.827 | S | S | * | * | trans | -154 | 95.5 | 154.8 | 27.2 | 0 | 0 | 0 | 0 | 109.5 | S6 | T4-S6 VanDerWaalsContact C-N 3.3Å; T4-S6 PolarHBondContact O-N 3.17Å | ||
| 5 | E | 25.8 | Very low | 27.6 | Very low | 176 Ų | 176 | 146.7 Ų | 146.7 | 82% | 0.822 | 82% | 0.822 | S | S | * | * | trans | -56.7 | 91.5 | 158.5 | -58.9 | 171.6 | -166.5 | 0 | 0 | 108.8 | R7 | E5-R7 PolarHBondContact O-N 3.42Š| ||
| 6 | S | 28.8 | Very low | 27.6 | Very low | 110 Ų | 110 | 143.4 Ų | 143.4 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | trans | -79.7 | 85.2 | 168.3 | -66.1 | 0 | 0 | 0 | 0 | 108.6 | T4 G8 | T4-S6 VanDerWaalsContact C-N 3.3Å; T4-S6 PolarHBondContact O-N 3.17Å; S6-G8 PolarHBondContact O-N 3Å | ||
| 7 | R | 25 | Very low | 27.5 | Very low | 230 Ų | 230 | 146.5 Ų | 146.5 | 87% | 0.868 | 82% | 0.817 | S | S | * | * | trans | -51.2 | 126.2 | 150.9 | -73.3 | 179.8 | 173.2 | -173.5 | -2 | 108.3 | E5 | E5-R7 PolarHBondContact O-N 3.42Š| ||
| 8 | G | 24.1 | Very low | 27.4 | Very low | 64 Ų | 64 | 141.7 Ų | 141.7 | 66% | 0.66 | 81% | 0.806 | S | S | * | * | trans | 89.7 | 85.6 | 163.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | S6 | S6-G8 PolarHBondContact O-N 3Š| ||
| 9 | C | 25.4 | Very low | 28 | Very low | 102 Ų | 102 | 141.1 Ų | 141.1 | 69% | 0.689 | 81% | 0.812 | S | S | * | * | trans | -139.6 | 95.6 | 130.7 | -100.9 | 0 | 0 | 0 | 0 | 108.4 | R11 | C9-R11 HydrophobicContact CB-CG 4.35Å; C9-R11 PolarHBondContact O-N 3.18Å | ||
| 10 | V | 25.1 | Very low | 28.4 | Very low | 152 Ų | 152 | 138.5 Ų | 138.5 | 92% | 0.921 | 81% | 0.808 | S | S | * | * | trans | -49.8 | 86.3 | 141.8 | 178.5 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 11 | R | 29.6 | Very low | 28.4 | Very low | 195 Ų | 195 | 138.6 Ų | 138.6 | 74% | 0.736 | 81% | 0.811 | S | S | * | * | trans | -122.7 | 100 | 165.3 | -91.7 | -174.1 | -176.9 | 177.6 | 2.2 | 107.3 | C9 H13 | C9-R11 HydrophobicContact CB-CG 4.35Å; C9-R11 PolarHBondContact O-N 3.18Å; R11-H13 PolarHBondContact O-N 3.32Å | ||
| 12 | K | 29.1 | Very low | 28.2 | Very low | 208 Ų | 208 | 135.4 Ų | 135.4 | 90% | 0.904 | 79% | 0.79 | S | S | * | * | trans | 9.2 | 80.6 | 142.2 | -66.5 | 177.5 | 176.4 | 179.2 | 0 | 112.8 | A14 | K12-A14 VanDerWaalsContact C-N 3.26Å; K12-A14 PolarHBondContact O-N 3.03Å | ||
| 13 | H | 28.4 | Very low | 28 | Very low | 189 Ų | 189 | 138.3 Ų | 138.3 | 88% | 0.875 | 79% | 0.787 | S | S | * | * | trans | -72.4 | 95.1 | 157.4 | -88.9 | -78.4 | 0 | 0 | 0 | 106.9 | R11 C15 | R11-H13 PolarHBondContact O-N 3.32Å; H13-C15 PolarHBondContact O-N 2.95Å | ||
| 14 | A | 24.6 | Very low | 27.9 | Very low | 77 Ų | 77 | 136 Ų | 136 | 64% | 0.636 | 78% | 0.777 | S | S | * | * | trans | -57.2 | 113 | 149.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | K12 S16 | K12-A14 VanDerWaalsContact C-N 3.26Å; K12-A14 PolarHBondContact O-N 3.03Å; A14-S16 PolarHBondContact O-OG 2.93Å | ||
| 15 | C | 27.3 | Very low | 28.3 | Very low | 113 Ų | 113 | 136.4 Ų | 136.4 | 76% | 0.764 | 78% | 0.779 | S | S | * | * | trans | -80.9 | 109.4 | 140.9 | -70.7 | 0 | 0 | 0 | 0 | 104.2 | H13 | H13-C15 PolarHBondContact O-N 2.95Š| ||
| 16 | S | 27.7 | Very low | 28.6 | Very low | 93 Ų | 93 | 132.1 Ų | 132.1 | 65% | 0.65 | 77% | 0.767 | S | S | * | * | 54.1 | 85.3 | 55.9 | -43.7 | 0 | 0 | 0 | 0 | 110.3 | A14 G18 | A14-S16 PolarHBondContact O-OG 2.93Å; S16-G18 PolarHBondContact O-N 2.9Å | |||
| 17 | H | 26.4 | Very low | 28.2 | Very low | 196 Ų | 196 | 136.9 Ų | 136.9 | 91% | 0.907 | 77% | 0.768 | S | S | * | * | trans | 17.3 | 96.4 | 147.1 | -66.1 | -85.8 | 0 | 0 | 0 | 117.6 | ||||
| 18 | G | 25.8 | Very low | 28.2 | Very low | 60 Ų | 60 | 135.9 Ų | 135.9 | 62% | 0.619 | 77% | 0.765 | S | S | * | * | -130.2 | 113.7 | 122 | 0 | 0 | 0 | 0 | 0 | 105.3 | S16 A20 | S16-G18 PolarHBondContact O-N 2.9Å; G18-A20 PolarHBondContact O-N 2.81Å; G18-A20 VanDerWaalsContact O-N 3.17Å | |||
| 19 | S | 39 | Very low | 28.2 | Very low | 131 Ų | 131 | 143.9 Ų | 143.9 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | S | Bend | 42.1 | 53.6 | 87.2 | -64.8 | 0 | 0 | 0 | 0 | 113 | |||
| 20 | A | 35 | Very low | 28.1 | Very low | 89 Ų | 89 | 147 Ų | 147 | 74% | 0.736 | 78% | 0.777 | S | S | * | * | S | Bend | trans | 164.6 | 114.3 | 147.3 | 0 | 0 | 0 | 0 | 0 | 104.8 | G18 F22 | G18-A20 PolarHBondContact O-N 2.81Å; G18-A20 VanDerWaalsContact O-N 3.17Å; A20-F22 PolarHBondContact O-N 3.42Å |
| 21 | T | 28.6 | Very low | 28.1 | Very low | 141 Ų | 141 | 150.8 Ų | 150.8 | 87% | 0.865 | 78% | 0.775 | S | S | * | * | trans | -54.6 | 113.7 | -162.4 | 41.6 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 22 | F | 29.7 | Very low | 28.1 | Very low | 186 Ų | 186 | 147.1 Ų | 147.1 | 82% | 0.816 | 77% | 0.769 | S | S | * | * | trans | 45.9 | 98.1 | 148 | -73.3 | -87.1 | 0 | 0 | 0 | 122.4 | A20 | A20-F22 PolarHBondContact O-N 3.42Š| ||
| 23 | N | 27.6 | Very low | 28 | Very low | 140 Ų | 140 | 148.8 Ų | 148.8 | 75% | 0.749 | 77% | 0.77 | S | S | * | * | 53.2 | 98.7 | 117.2 | -74.6 | -22 | 0 | 0 | 0 | 121.6 | |||||
| 24 | A | 23.9 | Very low | 27.9 | Very low | 78 Ų | 78 | 147.5 Ų | 147.5 | 65% | 0.645 | 76% | 0.762 | S | S | * | * | 64.5 | 96.4 | 110.6 | 0 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 25 | T | 36.5 | Very low | 28.3 | Very low | 134 Ų | 134 | 155.5 Ų | 155.5 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | trans | 64.1 | 163.3 | 135.8 | 21.7 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 26 | P | 32.6 | Very low | 28.2 | Very low | 87 Ų | 87 | 157.5 Ų | 157.5 | 57% | 0.565 | 78% | 0.778 | S | S | * | * | cis | -139 | 92.7 | -9.3 | 31.3 | -8.4 | 0 | 0 | 0 | 108.9 | R28 | P26-R28 VanDerWaalsContact C-N 3.29Å; P26-R28 PolarHBondContact O-N 3.47Å | ||
| 27 | R | 21.5 | Very low | 28.2 | Very low | 209 Ų | 209 | 158.8 Ų | 158.8 | 79% | 0.789 | 78% | 0.784 | S | S | * | * | trans | -105.7 | 69.5 | 164.8 | -70.7 | 179.7 | 99.5 | 146.6 | 1.9 | 106 | R29 | R27-R29 PolarHBondContact O-N 2.99Š| ||
| 28 | R | 23.6 | Very low | 28.3 | Very low | 210 Ų | 210 | 156.1 Ų | 156.1 | 79% | 0.792 | 78% | 0.781 | S | S | * | * | 37.9 | 71.9 | 102.2 | -83.9 | -175.1 | 166.2 | 170.2 | -1.5 | 105.4 | P26 F30 | P26-R28 VanDerWaalsContact C-N 3.29Å; P26-R28 PolarHBondContact O-N 3.47Å; R28-F30 WeakPolarHBondContact O-CD2 3.19Å; R28-F30 PolarHBondContact O-N 3.01Å | |||
| 29 | R | 24.6 | Very low | 28.3 | Very low | 232 Ų | 232 | 161.4 Ų | 161.4 | 88% | 0.875 | 79% | 0.79 | S | S | * | * | trans | -42.9 | 107.2 | 156.9 | -83.3 | 179.9 | 169.6 | 165 | -3.6 | 104.1 | R27 R31 | R27-R29 PolarHBondContact O-N 2.99Å; R29-R31 PolarHBondContact O-N 3.49Å | ||
| 30 | F | 24.4 | Very low | 27.8 | Very low | 168 Ų | 168 | 161 Ų | 161 | 74% | 0.737 | 79% | 0.785 | S | S | * | * | trans | -66.1 | 77.5 | 175.1 | -74.1 | -96.1 | 0 | 0 | 0 | 104.9 | R28 L32 | R28-F30 WeakPolarHBondContact O-CD2 3.19Å; R28-F30 PolarHBondContact O-N 3.01Å; F30-L32 PolarHBondContact O-N 3.42Å; F30-L32 VanDerWaalsContact O-N 3.11Å | ||
| 31 | R | 24.8 | Very low | 27.4 | Very low | 230 Ų | 230 | 162.1 Ų | 162.1 | 87% | 0.868 | 79% | 0.788 | S | S | * | * | trans | -80.5 | 91.6 | 159.1 | -87.3 | -172 | 168.6 | 157.3 | -2.3 | 105.3 | R29 R33 | R29-R31 PolarHBondContact O-N 3.49Å; R31-R33 PolarHBondContact O-N 3.43Å | ||
| 32 | L | 28.6 | Very low | 27.2 | Very low | 119 Ų | 119 | 158.4 Ų | 158.4 | 62% | 0.623 | 78% | 0.777 | S | S | * | * | trans | -15.2 | 120.2 | 147.1 | -79.6 | 152.4 | 0 | 0 | 0 | 109.5 | F30 F34 | F30-L32 PolarHBondContact O-N 3.42Å; F30-L32 VanDerWaalsContact O-N 3.11Å; L32-F34 HydrophobicContact CB-CD2 3.79Å; L32-F34 HydrophobicContact CB-CE2 3.67Å; L32-F34 HydrophobicContact CD1-CE2 4.06Å; L32-F34 HydrophobicContact CG-CE2 4.47Å; L32-F34 PolarHBondContact O-N 3.05Å | ||
| 33 | R | 26.7 | Very low | 26.9 | Very low | 243 Ų | 243 | 159.2 Ų | 159.2 | 92% | 0.917 | 78% | 0.784 | S | S | * | * | trans | -66.8 | 70 | 167 | -66.1 | 179.5 | 176 | 169.1 | -3.1 | 107.9 | R31 R35 | R31-R33 PolarHBondContact O-N 3.43Å; R33-R35 PolarHBondContact O-N 3.11Å | ||
| 34 | F | 26.9 | Very low | 26.9 | Very low | 162 Ų | 162 | 157.3 Ų | 157.3 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | trans | -56.1 | 113.5 | 145.1 | -68.5 | -80.9 | 0 | 0 | 0 | 104.1 | L32 L36 | L32-F34 HydrophobicContact CB-CD2 3.79Å; L32-F34 HydrophobicContact CB-CE2 3.67Å; L32-F34 HydrophobicContact CD1-CE2 4.06Å; L32-F34 HydrophobicContact CG-CE2 4.47Å; L32-F34 PolarHBondContact O-N 3.05Å; F34-L36 PolarHBondContact O-N 2.77Å | ||
| 35 | R | 32.7 | Very low | 27.1 | Very low | 245 Ų | 245 | 163.1 Ų | 163.1 | 93% | 0.925 | 80% | 0.801 | S | S | * | * | trans | -56.9 | 111.2 | 176 | -76.5 | -177.7 | 172.9 | 154.7 | -2.9 | 106.6 | R33 | R33-R35 PolarHBondContact O-N 3.11Š| ||
| 36 | L | 24.9 | Very low | 26.5 | Very low | 154 Ų | 154 | 160.9 Ų | 160.9 | 81% | 0.806 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 132.7 | 175.3 | -80.6 | 149.6 | 0 | 0 | 0 | 107.8 | F34 V38 | F34-L36 PolarHBondContact O-N 2.77Å; L36-V38 PolarHBondContact O-N 3.29Å |
| 37 | P | 28.7 | Very low | 26.3 | Very low | 120 Ų | 120 | 162.1 Ų | 162.1 | 78% | 0.779 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 129.8 | 168.4 | 1 | 4.5 | 0 | 0 | 0 | 108.4 | H39 | P37-H39 PolarHBondContact O-N 3.3Š|
| 38 | V | 28 | Very low | 26.9 | Very low | 141 Ų | 141 | 158.7 Ų | 158.7 | 86% | 0.855 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 131.6 | 178.3 | 179.1 | 0 | 0 | 0 | 0 | 108.2 | L36 C40 | L36-V38 PolarHBondContact O-N 3.29Å; V38-C40 PolarHBondContact O-N 2.74Å |
| 39 | H | 25.7 | Very low | 27 | Very low | 171 Ų | 171 | 154.8 Ų | 154.8 | 79% | 0.792 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 116.7 | 171.7 | -122.8 | -76.1 | 0 | 0 | 0 | 109.4 | P37 S41 | P37-H39 PolarHBondContact O-N 3.3Å; H39-S41 PolarHBondContact O-N 3.18Å |
| 40 | C | 28.7 | Very low | 27.4 | Very low | 121 Ų | 121 | 148.9 Ų | 148.9 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 121.5 | 139.8 | -69.9 | 0 | 0 | 0 | 0 | 105.3 | V38 | V38-C40 PolarHBondContact O-N 2.74Š|
| 41 | S | 26.9 | Very low | 27.5 | Very low | 114 Ų | 114 | 145.2 Ų | 145.2 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 130.1 | 169.7 | 49.6 | 0 | 0 | 0 | 0 | 109 | H39 | H39-S41 PolarHBondContact O-N 3.18Š|
| 42 | G | 23.7 | Very low | 27.9 | Very low | 62 Ų | 62 | 142.2 Ų | 142.2 | 64% | 0.639 | 82% | 0.82 | S | S | * | * | S | Bend | trans | 113 | 110.8 | 163.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 43 | E | 24 | Very low | 28.4 | Very low | 204 Ų | 204 | 142 Ų | 142 | 95% | 0.953 | 83% | 0.826 | S | S | * | * | trans | 79.8 | 128.1 | 147.9 | -63.8 | -179.7 | 138.2 | 0 | 0 | 120.4 | ||||
| 44 | A | 27.8 | Very low | 28.4 | Very low | 99 Ų | 99 | 136.5 Ų | 136.5 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | trans | -74.9 | 138.8 | -174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 45 | Q | 27.7 | Very low | 28.7 | Very low | 200 Ų | 200 | 137.6 Ų | 137.6 | 94% | 0.935 | 83% | 0.832 | S | S | * | * | trans | -133.6 | 139.6 | 154 | -78.8 | -159.3 | -5.6 | 0 | 0 | 111.4 | ||||
| 46 | A | 24.6 | Very low | 28.5 | Very low | 88 Ų | 88 | 130.9 Ų | 130.9 | 73% | 0.727 | 83% | 0.829 | S | S | * | * | trans | -87.9 | 157.2 | -155.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 47 | S | 27.9 | Very low | 28.8 | Very low | 112 Ų | 112 | 130.3 Ų | 130.3 | 78% | 0.783 | 83% | 0.825 | S | S | * | * | trans | 38.6 | 119.1 | 138.8 | -53.6 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 48 | C | 34.1 | Very low | 28.8 | Very low | 138 Ų | 138 | 131.3 Ų | 131.3 | 93% | 0.932 | 82% | 0.824 | S | S | * | * | trans | -155.5 | 113.4 | 135.3 | -93.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 49 | S | 25 | Very low | 29.3 | Very low | 128 Ų | 128 | 130.4 Ų | 130.4 | 90% | 0.895 | 82% | 0.821 | S | S | * | * | trans | -83.1 | 138.4 | 170.9 | -55.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 50 | A | 33.1 | Very low | 29.6 | Very low | 107 Ų | 107 | 127.9 Ų | 127.9 | 88% | 0.884 | 82% | 0.818 | S | S | * | * | trans | -155.9 | 117.9 | 153.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 51 | A | 26.1 | Very low | 29.7 | Very low | 92 Ų | 92 | 127.4 Ų | 127.4 | 76% | 0.76 | 82% | 0.816 | S | S | * | * | trans | -88.3 | 163.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 52 | L | 34 | Very low | 29.8 | Very low | 166 Ų | 166 | 132.1 Ų | 132.1 | 87% | 0.869 | 82% | 0.816 | S | S | * | * | trans | 146.7 | 160.3 | 146.3 | -80.8 | 160.9 | 0 | 0 | 0 | 112.3 | ||||
| 53 | P | 38.9 | Very low | 30.1 | Very low | 116 Ų | 116 | 138.6 Ų | 138.6 | 75% | 0.753 | 83% | 0.829 | S | S | * | * | -123.9 | 161.6 | -54.6 | 31.9 | -14.3 | 0 | 0 | 0 | 112.8 | |||||
| 54 | S | 27.6 | Very low | 30.6 | Very low | 126 Ų | 126 | 135.3 Ų | 135.3 | 88% | 0.881 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -91.9 | 119.5 | -174.9 | -163.7 | 0 | 0 | 0 | 0 | 112.1 | ||
| 55 | Q | 32.2 | Very low | 30.4 | Very low | 185 Ų | 185 | 139.4 Ų | 139.4 | 86% | 0.864 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -95.8 | 122.4 | 167.9 | -80.5 | -175.1 | 1.4 | 0 | 0 | 109.8 | ||
| 56 | A | 28.7 | Very low | 30.7 | Very low | 105 Ų | 105 | 135.6 Ų | 135.6 | 87% | 0.868 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -78 | 130.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 57 | I | 31.1 | Very low | 30.9 | Very low | 141 Ų | 141 | 135.4 Ų | 135.4 | 72% | 0.723 | 80% | 0.797 | S | S | * | * | trans | -107 | 124.5 | 178.3 | -60 | 171.3 | 0 | 0 | 0 | 108.7 | ||||
| 58 | D | 28.5 | Very low | 30.9 | Very low | 142 Ų | 142 | 135.9 Ų | 135.9 | 76% | 0.759 | 79% | 0.786 | S | S | * | * | trans | -74.4 | 125 | -177.3 | -161.4 | -5.8 | 0 | 0 | 0 | 111.6 | V60 | D58-V60 PolarHBondContact O-N 3.09Š| ||
| 59 | P | 39 | Very low | 31 | Very low | 122 Ų | 122 | 132.7 Ų | 132.7 | 79% | 0.792 | 76% | 0.759 | S | S | * | * | trans | -87.1 | 8.2 | -166.3 | 31.6 | -35.4 | 0 | 0 | 0 | 117.2 | ||||
| 60 | V | 31.3 | Very low | 31.1 | Very low | 118 Ų | 118 | 130.4 Ų | 130.4 | 72% | 0.715 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -113.3 | 106.3 | -175.7 | -167.3 | 0 | 0 | 0 | 0 | 111.5 | D58 | D58-V60 PolarHBondContact O-N 3.09Š|
| 61 | S | 32.6 | Very low | 31.2 | Very low | 111 Ų | 111 | 127.1 Ų | 127.1 | 78% | 0.776 | 71% | 0.707 | S | S | * | * | S | Bend | trans | 139.2 | 21.5 | 149.3 | -60 | 0 | 0 | 0 | 0 | 117.6 | ||
| 62 | R | 28.7 | Very low | 31.3 | Very low | 213 Ų | 213 | 127.5 Ų | 127.5 | 80% | 0.804 | 69% | 0.694 | S | S | * | * | trans | -120.3 | 76.4 | 162.4 | -64 | -169.5 | -176.7 | -175 | 2.4 | 110.7 | L64 | R62-L64 HydrophobicContact CB-CD2 4.4Å; R62-L64 HydrophobicContact CB-CG 4.26Å; R62-L64 PolarHBondContact O-N 3.33Å | ||
| 63 | Q | 28.4 | Very low | 31.1 | Very low | 197 Ų | 197 | 123 Ų | 123 | 92% | 0.921 | 67% | 0.671 | S | S | * | * | trans | -58.4 | 85.6 | 146.5 | -87.8 | 177.2 | -13.8 | 0 | 0 | 106.2 | Q65 | Q63-Q65 VanDerWaalsContact C-N 3.27Å; Q63-Q65 PolarHBondContact O-N 2.7Å | ||
| 64 | L | 35 | Very low | 31.1 | Very low | 135 Ų | 135 | 121.3 Ų | 121.3 | 71% | 0.707 | 66% | 0.66 | S | S | * | * | trans | -63.6 | 99.3 | 167.3 | -68.1 | 169.7 | 0 | 0 | 0 | 105 | R62 L66 | R62-L64 HydrophobicContact CB-CD2 4.4Å; R62-L64 HydrophobicContact CB-CG 4.26Å; R62-L64 PolarHBondContact O-N 3.33Å; L64-L66 PolarHBondContact O-N 2.92Å | ||
| 65 | Q | 24.9 | Very low | 31.5 | Very low | 186 Ų | 186 | 120.4 Ų | 120.4 | 87% | 0.869 | 64% | 0.642 | S | S | * | * | trans | -58.3 | 106.6 | 171 | -163.9 | 168.9 | 18.5 | 0 | 0 | 105.8 | Q63 | Q63-Q65 VanDerWaalsContact C-N 3.27Å; Q63-Q65 PolarHBondContact O-N 2.7Å | ||
| 66 | L | 33.1 | Very low | 31.7 | Very low | 120 Ų | 120 | 113.5 Ų | 113.5 | 63% | 0.628 | 61% | 0.61 | S | S | * | * | trans | -59.3 | 130.7 | 177.8 | -78.2 | 138.5 | 0 | 0 | 0 | 107.2 | L64 E68 | L64-L66 PolarHBondContact O-N 2.92Å; L66-E68 PolarHBondContact O-N 2.73Å | ||
| 67 | P | 29.4 | Very low | 32.2 | Very low | 84 Ų | 84 | 109.8 Ų | 109.8 | 55% | 0.545 | 58% | 0.578 | S | S | . | * | trans | -58.5 | 140.9 | 176.9 | 22 | -30.5 | 0 | 0 | 0 | 110 | I69 | P67-I69 PolarHBondContact O-N 2.92Š| ||
| 68 | E | 27.7 | Very low | 32.2 | Very low | 121 Ų | 121 | 109.5 Ų | 109.5 | 57% | 0.565 | 58% | 0.578 | S | S | * | * | trans | -66.6 | 112.4 | 175.9 | -171.9 | 169.2 | -158.9 | 0 | 0 | 108.7 | L66 I172 R174 | L66-E68 PolarHBondContact O-N 2.73Å; E68-I172 WeakPolarHBondContact OE1-CG2 3.05Å; E68-R174 IonicContact OE1-NE 3.93Å | ||
| 69 | I | 35.6 | Very low | 32.5 | Very low | 71 Ų | 71 | 109.4 Ų | 109.4 | 36% | 0.364 | 57% | 0.571 | S | S | . | * | trans | -93.9 | 112.8 | 178.3 | -56.7 | 173.5 | 0 | 0 | 0 | 107.5 | P67 I71 | P67-I69 PolarHBondContact O-N 2.92Å; I69-I71 PolarHBondContact O-N 3.17Å | ||
| 70 | V | 28.4 | Very low | 32.5 | Very low | 80 Ų | 80 | 106.7 Ų | 106.7 | 49% | 0.485 | 55% | 0.552 | S | S | . | * | trans | -73.3 | 108 | 169.5 | -179 | 0 | 0 | 0 | 0 | 107.9 | M72 | V70-M72 HydrophobicContact CG1-CG 4.47Å; V70-M72 PolarHBondContact O-N 3.45Å | ||
| 71 | I | 33.4 | Very low | 32.6 | Very low | 38 Ų | 38 | 102.9 Ų | 102.9 | 20% | 0.195 | 53% | 0.533 | C | S | . | . | trans | -80.6 | 106.2 | 175.6 | -56.6 | 176.6 | 0 | 0 | 0 | 107.5 | I69 V173 F219 | I69-I71 PolarHBondContact O-N 3.17Å; I71-V173 HydrophobicContact CD1-CB 3.71Å; I71-V173 HydrophobicContact CD1-CG2 3.67Å; I71-F219 HydrophobicContact CB-CZ 4.17Å; I71-F219 HydrophobicContact CD1-CE2 3.95Å; I71-F219 HydrophobicContact CD1-CZ 3.72Å; I71-F219 HydrophobicContact CG1-CE2 4.07Å; I71-F219 HydrophobicContact CG1-CZ 3.57Å; I71-F219 HydrophobicContact CG2-CE1 4.14Å; I71-F219 HydrophobicContact CG2-CZ 3.68Å | ||
| 72 | M | 29.1 | Very low | 32.5 | Very low | 101 Ų | 101 | 100.6 Ų | 100.6 | 50% | 0.498 | 52% | 0.517 | S | S | . | . | trans | -85.6 | 134.3 | 166.1 | -65.6 | -168 | 175 | 0 | 0 | 108.5 | V70 M76 | V70-M72 HydrophobicContact CG1-CG 4.47Å; V70-M72 PolarHBondContact O-N 3.45Å; M72-M76 HydrophobicContact CB-CB 4.36Å; M72-M76 HydrophobicContact CB-SD 4.31Å; M72-M76 HydrophobicContact CG-SD 4.48Å | ||
| 73 | D | 30.2 | Very low | 32.8 | Very low | 71 Ų | 71 | 94.1 Ų | 94.1 | 38% | 0.38 | 50% | 0.501 | S | S | . | . | trans | -59.8 | 142.6 | 169.6 | -84 | -38.5 | 0 | 0 | 0 | 108.7 | E75 M76 | D73-E75 PolarHBondContact O-N 2.69Å; D73-M76 HydrophobicContact CB-CG 4.4Å; D73-M76 WeakPolarHBondContact O-CB 3.28Å; D73-M76 PolarHBondContact O-N 3.03Å | ||
| 74 | P | 38.6 | Very low | 33 | Very low | 81 Ų | 81 | 87.7 Ų | 87.7 | 53% | 0.526 | 48% | 0.481 | S | S | . | . | G | 310 helix | trans | -58.1 | -18.3 | 179.6 | 22.4 | -32.5 | 0 | 0 | 0 | 113 | S77 V223 | P74-S77 WeakPolarHBondContact O-CB 3.27Å; P74-V223 HydrophobicContact CB-CG1 4.18Å; P74-V223 HydrophobicContact CG-CG1 4.23Å |
| 75 | E | 36.7 | Very low | 32.7 | Very low | 106 Ų | 106 | 85.6 Ų | 85.6 | 50% | 0.495 | 47% | 0.474 | S | S | . | . | G | 310 helix | trans | -79.4 | -14.1 | 175 | -56.6 | -174.9 | 179.6 | 0 | 0 | 113.4 | D73 S77 A161 S165 | D73-E75 PolarHBondContact O-N 2.69Å; E75-S77 PolarHBondContact O-N 2.71Å; E75-A161 HydrophobicContact CB-CB 4.44Å; E75-S165 WeakPolarHBondContact OE2-CB 3.36Å; E75-S165 PolarHBondContact OE2-OG 3.19Å |
| 76 | M | 36.1 | Very low | 33 | Very low | 41 Ų | 41 | 80 Ų | 80 | 20% | 0.202 | 46% | 0.459 | C | S | . | . | G | 310 helix | trans | -83.7 | 16.3 | 173.8 | -66.4 | -173.9 | -164.8 | 0 | 0 | 113.2 | M72 D73 D78 P168 M170 | M72-M76 HydrophobicContact CB-CB 4.36Å; M72-M76 HydrophobicContact CB-SD 4.31Å; M72-M76 HydrophobicContact CG-SD 4.48Å; D73-M76 HydrophobicContact CB-CG 4.4Å; D73-M76 WeakPolarHBondContact O-CB 3.28Å; D73-M76 PolarHBondContact O-N 3.03Å; M76-D78 PolarHBondContact O-N 2.94Å; M76-P168 HydrophobicContact CE-CB 3.48Å; M76-P168 VanDerWaalsContact CE-CB 3.48Å; M76-P168 HydrophobicContact CE-CG 3.69Å; M76-P168 HydrophobicContact CG-CB 3.86Å; M76-P168 HydrophobicContact CG-CG 3.5Å; M76-P168 VanDerWaalsContact CG-CG 3.5Å; M76-P168 HydrophobicContact SD-CB 4.49Å; M76-P168 HydrophobicContact SD-CG 4.28Å; M76-M170 HydrophobicContact CE-CB 4.22Å; M76-M170 HydrophobicContact CE-CG 4.43Å |
| 77 | S | 37.9 | Very low | 32.9 | Very low | 26 Ų | 26 | 77.2 Ų | 77.2 | 18% | 0.182 | 45% | 0.449 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | 21.4 | -170.1 | -173.1 | 0 | 0 | 0 | 0 | 114.9 | P74 E75 F79 V80 A81 | P74-S77 WeakPolarHBondContact O-CB 3.27Å; E75-S77 PolarHBondContact O-N 2.71Å; S77-F79 PolarHBondContact O-N 2.8Å; S77-V80 PolarHBondContact O-N 3.45Å; S77-V80 VanDerWaalsContact OG-CB 3.27Å; S77-V80 WeakPolarHBondContact OG-CB 2.98Å; S77-A81 VanDerWaalsContact O-CB 3.28Å; S77-A81 WeakPolarHBondContact O-CB 3.47Å; S77-A81 PolarHBondContact O-N 3.15Å |
| 78 | D | 32.2 | Very low | 33.1 | Very low | 136 Ų | 136 | 79.2 Ų | 79.2 | 73% | 0.727 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -62.5 | -30.8 | 167.9 | -72.8 | -20.8 | 0 | 0 | 0 | 110.9 | M76 S82 | M76-D78 PolarHBondContact O-N 2.94Å; D78-S82 WeakPolarHBondContact O-CB 3.32Å; D78-S82 PolarHBondContact O-N 3.05Å |
| 79 | F | 34.6 | Very low | 33.3 | Very low | 140 Ų | 140 | 80.2 Ų | 80.2 | 61% | 0.614 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -69.8 | -41.4 | 174.1 | -172.9 | -100.4 | 0 | 0 | 0 | 112.2 | S77 S82 V83 | S77-F79 PolarHBondContact O-N 2.8Å; F79-S82 PolarHBondContact O-N 3.32Å; F79-V83 HydrophobicContact CD1-CG2 4.46Å; F79-V83 HydrophobicContact CE1-CG2 4.15Å; F79-V83 HydrophobicContact CZ-CG2 4.4Å; F79-V83 WeakPolarHBondContact O-CG2 3.33Å; F79-V83 PolarHBondContact O-N 2.92Å |
| 80 | V | 40 | Very low | 33.2 | Very low | 64 Ų | 64 | 84.8 Ų | 84.8 | 39% | 0.388 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -71.6 | -35.4 | 176.6 | -171.1 | 0 | 0 | 0 | 0 | 110.6 | S77 V83 A84 F158 | S77-V80 PolarHBondContact O-N 3.45Å; S77-V80 VanDerWaalsContact OG-CB 3.27Å; S77-V80 WeakPolarHBondContact OG-CB 2.98Å; V80-V83 PolarHBondContact O-N 2.8Å; V80-A84 PolarHBondContact O-N 3.07Å; V80-F158 HydrophobicContact CG1-CD2 4.23Å; V80-F158 HydrophobicContact CG1-CE2 4.3Å; V80-F158 HydrophobicContact CG1-CG 4.49Å |
| 81 | A | 33 | Very low | 33.3 | Very low | 38 Ų | 38 | 88.3 Ų | 88.3 | 31% | 0.314 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.9 | -42 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | S77 V83 A84 T85 | S77-A81 VanDerWaalsContact O-CB 3.28Å; S77-A81 WeakPolarHBondContact O-CB 3.47Å; S77-A81 PolarHBondContact O-N 3.15Å; A81-V83 VanDerWaalsContact C-N 3.33Å; A81-V83 PolarHBondContact O-N 2.95Å; A81-A84 CarbonylContact O-C 3.53Å; A81-A84 WeakPolarHBondContact O-CA 3.28Å; A81-A84 WeakPolarHBondContact O-CB 3.37Å; A81-A84 PolarHBondContact O-N 3.08Å; A81-T85 WeakPolarHBondContact O-CG2 3.47Å; A81-T85 PolarHBondContact O-N 3.33Å; A81-T85 PolarHBondContact O-OG1 3.35Å |
| 82 | S | 29.6 | Very low | 33.3 | Very low | 63 Ų | 63 | 94.4 Ų | 94.4 | 44% | 0.441 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.1 | -35.3 | 175.5 | -179.4 | 0 | 0 | 0 | 0 | 112.7 | D78 F79 A84 T85 A86 | D78-S82 WeakPolarHBondContact O-CB 3.32Å; D78-S82 PolarHBondContact O-N 3.05Å; F79-S82 PolarHBondContact O-N 3.32Å; S82-A84 VanDerWaalsContact C-N 3.31Å; S82-T85 WeakPolarHBondContact CA-OG1 3.49Å; S82-T85 PolarHBondContact O-OG1 2.68Å; S82-A86 WeakPolarHBondContact O-CB 3.36Å; S82-A86 PolarHBondContact O-N 2.8Å |
| 83 | V | 35.5 | Very low | 33.9 | Very low | 78 Ų | 78 | 98.6 Ų | 98.6 | 47% | 0.473 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -70.3 | -30.3 | 172.4 | 174.4 | 0 | 0 | 0 | 0 | 111.3 | F79 V80 A81 | F79-V83 HydrophobicContact CD1-CG2 4.46Å; F79-V83 HydrophobicContact CE1-CG2 4.15Å; F79-V83 HydrophobicContact CZ-CG2 4.4Å; F79-V83 WeakPolarHBondContact O-CG2 3.33Å; F79-V83 PolarHBondContact O-N 2.92Å; V80-V83 PolarHBondContact O-N 2.8Å; A81-V83 VanDerWaalsContact C-N 3.33Å; A81-V83 PolarHBondContact O-N 2.95Å |
| 84 | A | 32.2 | Very low | 34.1 | Very low | 61 Ų | 61 | 104.5 Ų | 104.5 | 50% | 0.504 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -73.8 | -37.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | V80 A81 S82 | V80-A84 PolarHBondContact O-N 3.07Å; A81-A84 CarbonylContact O-C 3.53Å; A81-A84 WeakPolarHBondContact O-CA 3.28Å; A81-A84 WeakPolarHBondContact O-CB 3.37Å; A81-A84 PolarHBondContact O-N 3.08Å; S82-A84 VanDerWaalsContact C-N 3.31Å |
| 85 | T | 29.6 | Very low | 34 | Very low | 92 Ų | 92 | 105.9 Ų | 105.9 | 56% | 0.564 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -88.5 | -26.5 | -177.3 | 59.4 | 0 | 0 | 0 | 0 | 114.3 | A81 S82 C87 D88 | A81-T85 WeakPolarHBondContact O-CG2 3.47Å; A81-T85 PolarHBondContact O-N 3.33Å; A81-T85 PolarHBondContact O-OG1 3.35Å; S82-T85 WeakPolarHBondContact CA-OG1 3.49Å; S82-T85 PolarHBondContact O-OG1 2.68Å; T85-C87 PolarHBondContact O-N 3.19Å; T85-D88 PolarHBondContact O-N 3.05Å; T85-D88 VanDerWaalsContact O-N 3.09Å |
| 86 | A | 30.9 | Very low | 34.1 | Very low | 67 Ų | 67 | 107.7 Ų | 107.7 | 55% | 0.554 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | 6.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | S82 | S82-A86 WeakPolarHBondContact O-CB 3.36Å; S82-A86 PolarHBondContact O-N 2.8Å |
| 87 | C | 31.1 | Very low | 34.1 | Very low | 62 Ų | 62 | 112.8 Ų | 112.8 | 42% | 0.419 | 62% | 0.62 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -134.2 | 26 | 172.3 | -64 | 0 | 0 | 0 | 0 | 111.3 | T85 | T85-C87 PolarHBondContact O-N 3.19Š|
| 88 | D | 33.4 | Very low | 33.7 | Very low | 127 Ų | 127 | 118.9 Ų | 118.9 | 68% | 0.679 | 65% | 0.651 | S | S | * | * | trans | -85.2 | 3.7 | 165.5 | -137.7 | 16.3 | 0 | 0 | 0 | 111.6 | T85 E90 | T85-D88 PolarHBondContact O-N 3.05Å; T85-D88 VanDerWaalsContact O-N 3.09Å; D88-E90 PolarHBondContact O-N 3.43Å | ||
| 89 | D | 31.6 | Very low | 33.5 | Very low | 142 Ų | 142 | 123.5 Ų | 123.5 | 76% | 0.759 | 66% | 0.66 | S | S | * | * | trans | -77.7 | 82 | 157.1 | -61.5 | -44 | 0 | 0 | 0 | 107.6 | D91 | D89-D91 VanDerWaalsContact C-N 3.29Å; D89-D91 PolarHBondContact O-N 2.89Å | ||
| 90 | E | 32.3 | Very low | 33 | Very low | 167 Ų | 167 | 121.7 Ų | 121.7 | 78% | 0.78 | 66% | 0.664 | S | S | * | * | trans | -35.6 | 98.8 | 139 | -60.5 | -101.3 | 105.2 | 0 | 0 | 108.4 | D88 | D88-E90 PolarHBondContact O-N 3.43Š| ||
| 91 | D | 31.3 | Very low | 32.3 | Very low | 153 Ų | 153 | 123.9 Ų | 123.9 | 82% | 0.818 | 68% | 0.682 | S | S | * | * | trans | -162.1 | 137.3 | 150.7 | -95.3 | -35.4 | 0 | 0 | 0 | 112.9 | D89 Q93 | D89-D91 VanDerWaalsContact C-N 3.29Å; D89-D91 PolarHBondContact O-N 2.89Å; D91-Q93 PolarHBondContact O-N 3.41Å | ||
| 92 | E | 33.7 | Very low | 32 | Very low | 167 Ų | 167 | 127.9 Ų | 127.9 | 78% | 0.78 | 70% | 0.702 | S | S | * | * | trans | -50.6 | 119.4 | -179 | -65.1 | 175.8 | 94.3 | 0 | 0 | 112.8 | K94 | E92-K94 VanDerWaalsContact C-N 3.27Å; E92-K94 PolarHBondContact O-N 3.02Å | ||
| 93 | Q | 41.2 | Very low | 31.8 | Very low | 189 Ų | 189 | 131 Ų | 131 | 88% | 0.883 | 72% | 0.718 | S | S | * | * | S | Bend | 58.1 | 15.5 | 123.7 | -134 | 126.6 | 22.4 | 0 | 0 | 119.8 | D91 | D91-Q93 PolarHBondContact O-N 3.41Š| |
| 94 | K | 34.9 | Very low | 31.4 | Very low | 194 Ų | 194 | 134.8 Ų | 134.8 | 84% | 0.843 | 74% | 0.736 | S | S | * | * | trans | -144.1 | 74 | -176.2 | -149.3 | 178.7 | -173.1 | -175.2 | 0 | 113.8 | E92 | E92-K94 VanDerWaalsContact C-N 3.27Å; E92-K94 PolarHBondContact O-N 3.02Å | ||
| 95 | S | 35.3 | Very low | 31 | Very low | 111 Ų | 111 | 135.4 Ų | 135.4 | 78% | 0.776 | 75% | 0.748 | S | S | * | * | trans | 166.3 | 50 | 144.8 | 55.6 | 0 | 0 | 0 | 0 | 114 | D97 | S95-D97 VanDerWaalsContact C-N 3.32Š| ||
| 96 | I | 39.5 | Very low | 30.8 | Very low | 143 Ų | 143 | 136.6 Ų | 136.6 | 73% | 0.733 | 76% | 0.76 | S | S | * | * | trans | -84.1 | -11.5 | 174.3 | -61.3 | 166.1 | 0 | 0 | 0 | 112 | N98 | I96-N98 VanDerWaalsContact C-N 3.32Å; I96-N98 PolarHBondContact O-N 3.27Å | ||
| 97 | D | 35.9 | Very low | 30.6 | Very low | 149 Ų | 149 | 137.7 Ų | 137.7 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | 76.8 | 172.5 | -61 | -33.6 | 0 | 0 | 0 | 110 | S95 | S95-D97 VanDerWaalsContact C-N 3.32Š|
| 98 | N | 30.7 | Very low | 30.5 | Very low | 154 Ų | 154 | 141.3 Ų | 141.3 | 82% | 0.824 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 172.7 | 27.8 | 149.9 | -87.6 | -16.8 | 0 | 0 | 0 | 116 | I96 S100 | I96-N98 VanDerWaalsContact C-N 3.32Å; I96-N98 PolarHBondContact O-N 3.27Å; N98-S100 PolarHBondContact O-N 3.42Å; N98-S100 VanDerWaalsContact O-N 3.14Å |
| 99 | Y | 26.2 | Very low | 30.2 | Very low | 233 Ų | 233 | 146.2 Ų | 146.2 | 91% | 0.914 | 79% | 0.788 | S | S | * | * | trans | -84.3 | 79.9 | 165.6 | -102.5 | -90.4 | 0 | 0 | 0 | 111.4 | ||||
| 100 | S | 25.3 | Very low | 30.4 | Very low | 101 Ų | 101 | 148.5 Ų | 148.5 | 71% | 0.706 | 80% | 0.799 | S | S | * | * | trans | -96 | 104.4 | 160.4 | 63.6 | 0 | 0 | 0 | 0 | 109.2 | N98 T102 | N98-S100 PolarHBondContact O-N 3.42Å; N98-S100 VanDerWaalsContact O-N 3.14Å; S100-T102 PolarHBondContact O-N 2.85Å | ||
| 101 | C | 25.5 | Very low | 30.1 | Very low | 111 Ų | 111 | 144.4 Ų | 144.4 | 75% | 0.75 | 79% | 0.789 | S | S | * | * | trans | -85.4 | 100.8 | 175.8 | -176 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 102 | T | 25.9 | Very low | 29.9 | Very low | 122 Ų | 122 | 141.9 Ų | 141.9 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | -91.1 | 111.5 | 163.6 | 44.4 | 0 | 0 | 0 | 0 | 108.5 | S100 D104 | S100-T102 PolarHBondContact O-N 2.85Å; T102-D104 PolarHBondContact O-N 2.92Å | ||
| 103 | V | 26 | Very low | 29.7 | Very low | 127 Ų | 127 | 141.9 Ų | 141.9 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | trans | -77.1 | 100.5 | 172.2 | 171.2 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 104 | D | 27.1 | Very low | 29 | Very low | 159 Ų | 159 | 140.4 Ų | 140.4 | 85% | 0.85 | 78% | 0.78 | S | S | * | * | trans | -108.1 | 120.7 | 160.3 | -94.4 | -35.1 | 0 | 0 | 0 | 108.8 | T102 | T102-D104 PolarHBondContact O-N 2.92Š| ||
| 105 | G | 22.9 | Very low | 28.8 | Very low | 74 Ų | 74 | 139.2 Ų | 139.2 | 76% | 0.763 | 78% | 0.78 | S | S | * | * | trans | -77.9 | 134.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 106 | S | 25.2 | Very low | 28.4 | Very low | 116 Ų | 116 | 138.4 Ų | 138.4 | 81% | 0.811 | 77% | 0.774 | S | S | * | * | trans | -176.1 | 129.9 | 138.7 | 178.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 107 | S | 26.8 | Very low | 27.9 | Very low | 91 Ų | 91 | 140 Ų | 140 | 64% | 0.636 | 78% | 0.782 | S | S | * | * | trans | 11.1 | 131.8 | 153.9 | -103.4 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 108 | D | 29.2 | Very low | 27.3 | Very low | 137 Ų | 137 | 137.7 Ų | 137.7 | 73% | 0.733 | 78% | 0.778 | S | S | * | * | trans | 59.5 | 83.3 | 132.7 | -53.7 | -41.4 | 0 | 0 | 0 | 117.4 | ||||
| 109 | R | 28.3 | Very low | 27 | Very low | 230 Ų | 230 | 139.8 Ų | 139.8 | 87% | 0.868 | 77% | 0.774 | S | S | * | * | 174.8 | 100.2 | 126.3 | -94.3 | 161.2 | -175.5 | -119.3 | 1.2 | 109.9 | S111 | R109-S111 PolarHBondContact O-N 3.34Š| |||
| 110 | L | 34.8 | Very low | 27.1 | Very low | 191 Ų | 191 | 134.4 Ų | 134.4 | 100% | 1 | 76% | 0.757 | S | S | * | * | trans | -67.9 | 81.3 | 161.6 | -68.3 | 168.6 | 0 | 0 | 0 | 108.5 | ||||
| 111 | S | 26.1 | Very low | 27.2 | Very low | 80 Ų | 80 | 138.4 Ų | 138.4 | 56% | 0.559 | 76% | 0.764 | S | S | * | * | trans | -147.4 | 110.5 | 166.9 | 56 | 0 | 0 | 0 | 0 | 109.7 | R109 | R109-S111 PolarHBondContact O-N 3.34Š| ||
| 112 | S | 26.6 | Very low | 27.5 | Very low | 101 Ų | 101 | 138.7 Ų | 138.7 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | trans | 52.4 | 84 | 163.1 | 69.2 | 0 | 0 | 0 | 0 | 116.7 | Q114 | S112-Q114 PolarHBondContact O-N 3.31Š| ||
| 113 | I | 30.6 | Very low | 27.5 | Very low | 166 Ų | 166 | 140.6 Ų | 140.6 | 85% | 0.851 | 77% | 0.774 | S | S | * | * | trans | -75.3 | 80 | 145.7 | -59.7 | 172.5 | 0 | 0 | 0 | 105.9 | M115 | I113-M115 HydrophobicContact CG2-CG 4.15Å; I113-M115 PolarHBondContact O-N 3.37Å | ||
| 114 | Q | 27.3 | Very low | 27.9 | Very low | 159 Ų | 159 | 139.2 Ų | 139.2 | 74% | 0.743 | 78% | 0.776 | S | S | * | * | trans | -73.3 | 101.9 | 160.3 | -176.4 | 175.6 | 2 | 0 | 0 | 105.4 | S112 S116 | S112-Q114 PolarHBondContact O-N 3.31Å; Q114-S116 PolarHBondContact O-N 3.37Å | ||
| 115 | M | 30.1 | Very low | 28 | Very low | 169 Ų | 169 | 137.3 Ų | 137.3 | 83% | 0.833 | 78% | 0.775 | S | S | * | * | trans | -63.4 | 90.9 | 171.8 | -73.3 | -158.9 | -84.3 | 0 | 0 | 108.4 | I113 I117 | I113-M115 HydrophobicContact CG2-CG 4.15Å; I113-M115 PolarHBondContact O-N 3.37Å; M115-I117 PolarHBondContact O-N 3.43Å | ||
| 116 | S | 26.3 | Very low | 28.4 | Very low | 94 Ų | 94 | 139.4 Ų | 139.4 | 66% | 0.657 | 78% | 0.778 | S | S | * | * | trans | -84 | 103.1 | 168 | 33.7 | 0 | 0 | 0 | 0 | 107.1 | Q114 S118 | Q114-S116 PolarHBondContact O-N 3.37Å; S116-S118 VanDerWaalsContact C-N 3.35Å; S116-S118 PolarHBondContact O-N 2.77Å; S116-S118 VanDerWaalsContact O-N 3.09Å | ||
| 117 | I | 28.5 | Very low | 28.7 | Very low | 177 Ų | 177 | 139 Ų | 139 | 91% | 0.908 | 78% | 0.775 | S | S | * | * | trans | -73.3 | 94.3 | 167.5 | -63.9 | 164.5 | 0 | 0 | 0 | 106.2 | M115 | M115-I117 PolarHBondContact O-N 3.43Š| ||
| 118 | S | 24.2 | Very low | 29 | Very low | 100 Ų | 100 | 139.5 Ų | 139.5 | 70% | 0.699 | 78% | 0.778 | S | S | * | * | trans | -138.7 | 137.5 | 167.8 | 87 | 0 | 0 | 0 | 0 | 105 | S116 | S116-S118 VanDerWaalsContact C-N 3.35Å; S116-S118 PolarHBondContact O-N 2.77Å; S116-S118 VanDerWaalsContact O-N 3.09Å | ||
| 119 | R | 25.3 | Very low | 29.3 | Very low | 198 Ų | 198 | 140 Ų | 140 | 75% | 0.747 | 78% | 0.781 | S | S | * | * | cis | -176.4 | 161.5 | 9.4 | -166.3 | 179.3 | 155.5 | -178.5 | -16.3 | 104.7 | ||||
| 120 | E | 27.1 | Very low | 29.6 | Very low | 119 Ų | 119 | 137.3 Ų | 137.3 | 56% | 0.556 | 78% | 0.783 | S | S | * | * | trans | 67.1 | 110.6 | 155.6 | -81 | 148 | 168.7 | 0 | 0 | 118.3 | ||||
| 121 | E | 28.2 | Very low | 29.4 | Very low | 185 Ų | 185 | 133 Ų | 133 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | 47.8 | 97.7 | 83.7 | -79 | -176.3 | 125.8 | 0 | 0 | 113.8 | |||||
| 122 | S | 32.2 | Very low | 29.9 | Very low | 117 Ų | 117 | 139.1 Ų | 139.1 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -143.5 | 128.7 | 148.9 | 37.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 123 | N | 24.6 | Very low | 30.5 | Very low | 163 Ų | 163 | 140.4 Ų | 140.4 | 87% | 0.872 | 79% | 0.786 | S | S | * | * | trans | -66.9 | 126.7 | -172.5 | -59.4 | -56.7 | 0 | 0 | 0 | 111.9 | ||||
| 124 | A | 34.9 | Very low | 30.8 | Very low | 98 Ų | 98 | 139.7 Ų | 139.7 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | trans | -137.6 | 90.1 | 156.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | S126 | A124-S126 PolarHBondContact O-N 2.81Š| ||
| 125 | S | 28.4 | Very low | 31.5 | Very low | 119 Ų | 119 | 137.4 Ų | 137.4 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | trans | -56.6 | 117.5 | 157.8 | -67.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 126 | S | 32.6 | Very low | 31.7 | Very low | 118 Ų | 118 | 132.4 Ų | 132.4 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | trans | -173.7 | 118.3 | 139.4 | -80.2 | 0 | 0 | 0 | 0 | 108 | A124 | A124-S126 PolarHBondContact O-N 2.81Š| ||
| 127 | S | 31.6 | Very low | 32.3 | Very low | 108 Ų | 108 | 139.3 Ų | 139.3 | 76% | 0.755 | 80% | 0.796 | S | S | * | * | trans | -60.5 | 166.3 | 168 | 54.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 128 | S | 33 | Very low | 32.6 | Very low | 101 Ų | 101 | 135.8 Ų | 135.8 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | trans | 86.8 | 128.7 | 171.4 | 69 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 129 | D | 34.3 | Very low | 33.3 | Very low | 148 Ų | 148 | 134.3 Ų | 134.3 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | trans | 81 | 55.7 | 154.6 | -51.9 | -20.6 | 0 | 0 | 0 | 118.8 | P131 | D129-P131 WeakPolarHBondContact O-CD 3.38Š| ||
| 130 | L | 34.7 | Very low | 33.7 | Very low | 173 Ų | 173 | 128.5 Ų | 128.5 | 91% | 0.906 | 77% | 0.765 | S | S | * | * | trans | -86.2 | 107.1 | 146.8 | -79.8 | 159.5 | 0 | 0 | 0 | 108.1 | K132 | L130-K132 PolarHBondContact O-N 3.13Š| ||
| 131 | P | 32 | Very low | 34.3 | Very low | 101 Ų | 101 | 128.4 Ų | 128.4 | 66% | 0.656 | 77% | 0.774 | S | S | * | * | trans | -62.1 | 136.2 | 177.5 | 24.7 | -31.4 | 0 | 0 | 0 | 109.4 | D129 V133 | D129-P131 WeakPolarHBondContact O-CD 3.38Å; P131-V133 HydrophobicContact CG-CG2 4.46Å; P131-V133 PolarHBondContact O-N 2.77Å | ||
| 132 | K | 36.1 | Very low | 34.9 | Very low | 208 Ų | 208 | 123.6 Ų | 123.6 | 90% | 0.904 | 76% | 0.761 | S | S | * | * | trans | -52.5 | 93.8 | 158.3 | -97.3 | 173.2 | 168 | 173.9 | 0 | 107.4 | L130 D134 | L130-K132 PolarHBondContact O-N 3.13Å; K132-D134 PolarHBondContact O-N 3.12Å; K132-D134 VanDerWaalsContact O-N 3.13Å | ||
| 133 | V | 39.1 | Very low | 35.6 | Very low | 128 Ų | 128 | 123 Ų | 123 | 78% | 0.776 | 74% | 0.744 | S | S | * | * | trans | -76.2 | 101.7 | 168.5 | 179.1 | 0 | 0 | 0 | 0 | 105.4 | P131 A135 | P131-V133 HydrophobicContact CG-CG2 4.46Å; P131-V133 PolarHBondContact O-N 2.77Å; V133-A135 PolarHBondContact O-N 3.42Å | ||
| 134 | D | 36.6 | Very low | 36.5 | Very low | 151 Ų | 151 | 119.3 Ų | 119.3 | 81% | 0.807 | 72% | 0.721 | S | S | * | * | trans | -46.3 | 125.5 | 173.2 | -101.9 | -51.5 | 0 | 0 | 0 | 110.3 | K132 G136 | K132-D134 PolarHBondContact O-N 3.12Å; K132-D134 VanDerWaalsContact O-N 3.13Å; D134-G136 PolarHBondContact O-N 3.38Å | ||
| 135 | A | 41.6 | Very low | 37 | Very low | 111 Ų | 111 | 118.6 Ų | 118.6 | 92% | 0.917 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -71.7 | 45.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | V133 | V133-A135 PolarHBondContact O-N 3.42Š|
| 136 | G | 34.5 | Very low | 37.8 | Very low | 64 Ų | 64 | 117.1 Ų | 117.1 | 66% | 0.66 | 68% | 0.68 | S | S | * | * | trans | -98.7 | 9.3 | 180 | 0 | 0 | 0 | 0 | 0 | 114.2 | D134 S138 | D134-G136 PolarHBondContact O-N 3.38Å; G136-S138 PolarHBondContact O-N 3.15Å | ||
| 137 | R | 39.1 | Very low | 38.9 | Very low | 239 Ų | 239 | 119.2 Ų | 119.2 | 90% | 0.902 | 67% | 0.67 | S | S | * | * | trans | -73.4 | 97.6 | 173.4 | -108.5 | -174.7 | -178.3 | -159.6 | 1.4 | 109.1 | ||||
| 138 | S | 33.9 | Very low | 39.6 | Very low | 103 Ų | 103 | 117.2 Ų | 117.2 | 72% | 0.72 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 127.7 | 163 | 25.5 | 0 | 0 | 0 | 0 | 108.6 | G136 S140 | G136-S138 PolarHBondContact O-N 3.15Å; S138-S140 PolarHBondContact O-N 2.98Å |
| 139 | P | 39.5 | Very low | 40.3 | Very low | 69 Ų | 69 | 115.5 Ų | 115.5 | 45% | 0.448 | 63% | 0.631 | S | S | . | * | P | Polyproline II helix | trans | -58.5 | 136.6 | 179.8 | 21.6 | -30.8 | 0 | 0 | 0 | 109.4 | F143 E144 | P139-F143 HydrophobicContact CB-CD1 4.29Å; P139-E144 HydrophobicContact CB-CG 4.17Å; P139-E144 HydrophobicContact CG-CG 3.84Å; P139-E144 WeakPolarHBondContact CG-OE1 3.43Å |
| 140 | S | 33.3 | Very low | 41.1 | Very low | 76 Ų | 76 | 114.6 Ų | 114.6 | 53% | 0.531 | 62% | 0.616 | S | S | . | * | P | Polyproline II helix | trans | -53.9 | 139.6 | 174.2 | -61.5 | 0 | 0 | 0 | 0 | 109.3 | S138 S142 F143 | S138-S140 PolarHBondContact O-N 2.98Å; S140-S142 PolarHBondContact O-N 3.44Å; S140-F143 PolarHBondContact O-N 3.44Å |
| 141 | P | 39.8 | Very low | 41.8 | Very low | 116 Ų | 116 | 109.4 Ų | 109.4 | 75% | 0.753 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -57.2 | -22.5 | -176.9 | 20.7 | -32.2 | 0 | 0 | 0 | 113.3 | F145 | P141-F145 WeakPolarHBondContact O-CB 3.26Å; P141-F145 PolarHBondContact O-N 3.37Å |
| 142 | S | 42.1 | Very low | 42.5 | Very low | 84 Ų | 84 | 105.3 Ų | 105.3 | 59% | 0.587 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.8 | -39 | 172.8 | 56.4 | 0 | 0 | 0 | 0 | 113.3 | S140 F145 E146 | S140-S142 PolarHBondContact O-N 3.44Å; S142-F145 PolarHBondContact O-N 2.97Å; S142-E146 VanDerWaalsContact O-CB 3.31Å; S142-E146 WeakPolarHBondContact O-CB 3.32Å; S142-E146 PolarHBondContact O-N 2.79Å |
| 143 | F | 45.7 | Very low | 42.9 | Very low | 104 Ų | 104 | 98 Ų | 98 | 46% | 0.456 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -73 | -43.2 | -176.3 | -175 | -99.3 | 0 | 0 | 0 | 111.8 | P139 S140 F145 E146 R147 | P139-F143 HydrophobicContact CB-CD1 4.29Å; S140-F143 PolarHBondContact O-N 3.44Å; F143-F145 VanDerWaalsContact C-N 3.31Å; F143-F145 PolarHBondContact O-N 2.91Å; F143-E146 PolarHBondContact O-N 2.97Å; F143-R147 VanDerWaalsContact O-CB 3.29Å; F143-R147 WeakPolarHBondContact O-CB 3.08Å; F143-R147 PolarHBondContact O-N 2.91Å |
| 144 | E | 43.5 | Very low | 43.4 | Very low | 86 Ų | 86 | 99.9 Ų | 99.9 | 40% | 0.402 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63 | -39.5 | 173.9 | -75.6 | -61.9 | 152.2 | 0 | 0 | 111.5 | P139 H148 | P139-E144 HydrophobicContact CB-CG 4.17Å; P139-E144 HydrophobicContact CG-CG 3.84Å; P139-E144 WeakPolarHBondContact CG-OE1 3.43Å; E144-H148 WeakPolarHBondContact O-CB 3.34Å; E144-H148 PolarHBondContact O-N 3.21Å |
| 145 | F | 44.9 | Very low | 43.6 | Very low | 84 Ų | 84 | 102.6 Ų | 102.6 | 37% | 0.368 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.4 | -44.2 | 175.6 | -177.4 | -109.8 | 0 | 0 | 0 | 112.2 | P141 S142 F143 H148 I149 | P141-F145 WeakPolarHBondContact O-CB 3.26Å; P141-F145 PolarHBondContact O-N 3.37Å; S142-F145 PolarHBondContact O-N 2.97Å; F143-F145 VanDerWaalsContact C-N 3.31Å; F143-F145 PolarHBondContact O-N 2.91Å; F145-H148 WeakPolarHBondContact O-CB 3.33Å; F145-H148 PolarHBondContact O-N 2.92Å; F145-I149 HydrophobicContact CD1-CD1 3.72Å; F145-I149 HydrophobicContact CD1-CG1 4.5Å; F145-I149 HydrophobicContact CE1-CD1 3.18Å; F145-I149 HydrophobicContact CE1-CG1 4.22Å; F145-I149 HydrophobicContact CE2-CD1 4.07Å; F145-I149 HydrophobicContact CE2-CG1 4.37Å; F145-I149 HydrophobicContact CG-CD1 4.38Å; F145-I149 HydrophobicContact CZ-CD1 3.39Å; F145-I149 HydrophobicContact CZ-CG1 4.17Å; F145-I149 WeakPolarHBondContact O-CG1 3.27Å; F145-I149 PolarHBondContact O-N 3.17Å |
| 146 | E | 46.4 | Very low | 43.5 | Very low | 88 Ų | 88 | 98.2 Ų | 98.2 | 41% | 0.411 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.8 | -43.7 | 177.4 | -173.1 | 172.5 | -171.1 | 0 | 0 | 111.6 | S142 F143 H148 I149 R150 | S142-E146 VanDerWaalsContact O-CB 3.31Å; S142-E146 WeakPolarHBondContact O-CB 3.32Å; S142-E146 PolarHBondContact O-N 2.79Å; F143-E146 PolarHBondContact O-N 2.97Å; E146-H148 VanDerWaalsContact C-N 3.29Å; E146-H148 PolarHBondContact O-N 3.05Å; E146-I149 PolarHBondContact O-N 3.24Å; E146-R150 HydrophobicContact CG-CG 4.48Å; E146-R150 WeakPolarHBondContact O-CB 3.42Å; E146-R150 VanDerWaalsContact O-CG 3.27Å; E146-R150 WeakPolarHBondContact O-CG 3.43Å; E146-R150 PolarHBondContact O-N 2.76Å; E146-R150 IonicContact OE1-CZ 3.32Å; E146-R150 VanDerWaalsContact OE1-CZ 3.32Å; E146-R150 IonicContact OE1-NE 3.34Å; E146-R150 PolarHBondContact OE1-NE 2.81Å; E146-R150 IonicContact OE1-NH2 2.65Å; E146-R150 PolarHBondContact OE1-NH2 3.13Å |
| 147 | R | 54.6 | Low | 43.6 | Very low | 162 Ų | 162 | 99.9 Ų | 99.9 | 61% | 0.611 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -59.2 | -42.5 | 172.4 | -172.7 | -176.1 | -169.3 | -171.2 | 5.6 | 111.4 | F143 R150 S151 | F143-R147 VanDerWaalsContact O-CB 3.29Å; F143-R147 WeakPolarHBondContact O-CB 3.08Å; F143-R147 PolarHBondContact O-N 2.91Å; R147-R150 PolarHBondContact O-N 2.96Å; R147-S151 WeakPolarHBondContact O-CB 3.49Å; R147-S151 PolarHBondContact O-N 3.13Å |
| 148 | H | 48.2 | Very low | 43.8 | Very low | 66 Ų | 66 | 92.8 Ų | 92.8 | 31% | 0.306 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.4 | -50.9 | 177.1 | -172 | 59 | 0 | 0 | 0 | 110.8 | E144 F145 E146 R150 S151 I152 V241 | E144-H148 WeakPolarHBondContact O-CB 3.34Å; E144-H148 PolarHBondContact O-N 3.21Å; F145-H148 WeakPolarHBondContact O-CB 3.33Å; F145-H148 PolarHBondContact O-N 2.92Å; E146-H148 VanDerWaalsContact C-N 3.29Å; E146-H148 PolarHBondContact O-N 3.05Å; H148-R150 PolarHBondContact O-N 3.38Å; H148-S151 WeakPolarHBondContact O-CB 3.42Å; H148-S151 PolarHBondContact O-N 2.99Å; H148-I152 WeakPolarHBondContact CD2-CD1 3.5Å; H148-I152 VanDerWaalsContact NE2-CD1 3.35Å; H148-I152 WeakPolarHBondContact NE2-CD1 3.23Å; H148-I152 WeakPolarHBondContact O-CB 3.17Å; H148-I152 VanDerWaalsContact O-CD1 3.22Å; H148-I152 WeakPolarHBondContact O-CD1 3.28Å; H148-I152 WeakPolarHBondContact O-CG1 3.48Å; H148-I152 PolarHBondContact O-N 2.97Å; H148-V241 WeakPolarHBondContact NE2-CG2 3.33Å |
| 149 | I | 47.7 | Very low | 43.8 | Very low | 65 Ų | 65 | 93 Ų | 93 | 33% | 0.333 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -58.3 | -47.4 | 176.7 | -70.6 | 176.5 | 0 | 0 | 0 | 110.9 | F145 E146 S151 I152 L153 | F145-I149 HydrophobicContact CD1-CD1 3.72Å; F145-I149 HydrophobicContact CD1-CG1 4.5Å; F145-I149 HydrophobicContact CE1-CD1 3.18Å; F145-I149 HydrophobicContact CE1-CG1 4.22Å; F145-I149 HydrophobicContact CE2-CD1 4.07Å; F145-I149 HydrophobicContact CE2-CG1 4.37Å; F145-I149 HydrophobicContact CG-CD1 4.38Å; F145-I149 HydrophobicContact CZ-CD1 3.39Å; F145-I149 HydrophobicContact CZ-CG1 4.17Å; F145-I149 WeakPolarHBondContact O-CG1 3.27Å; F145-I149 PolarHBondContact O-N 3.17Å; E146-I149 PolarHBondContact O-N 3.24Å; I149-S151 PolarHBondContact O-N 3.43Å; I149-I152 WeakPolarHBondContact O-CB 3.42Å; I149-I152 PolarHBondContact O-N 3.27Å; I149-I152 VanDerWaalsContact O-N 3.15Å; I149-L153 HydrophobicContact CG2-CD1 3.71Å; I149-L153 HydrophobicContact CG2-CG 4.11Å; I149-L153 VanDerWaalsContact O-CG 3.31Å; I149-L153 WeakPolarHBondContact O-CG 3.4Å; I149-L153 PolarHBondContact O-N 3.25Å |
| 150 | R | 49.1 | Very low | 43.6 | Very low | 128 Ų | 128 | 96 Ų | 96 | 48% | 0.483 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.8 | -43.9 | 179 | -71.5 | 177.3 | -176.3 | -160.9 | 3.7 | 111.6 | E146 R147 H148 I152 L153 R154 | E146-R150 HydrophobicContact CG-CG 4.48Å; E146-R150 WeakPolarHBondContact O-CB 3.42Å; E146-R150 VanDerWaalsContact O-CG 3.27Å; E146-R150 WeakPolarHBondContact O-CG 3.43Å; E146-R150 PolarHBondContact O-N 2.76Å; E146-R150 IonicContact OE1-CZ 3.32Å; E146-R150 VanDerWaalsContact OE1-CZ 3.32Å; E146-R150 IonicContact OE1-NE 3.34Å; E146-R150 PolarHBondContact OE1-NE 2.81Å; E146-R150 IonicContact OE1-NH2 2.65Å; E146-R150 PolarHBondContact OE1-NH2 3.13Å; R147-R150 PolarHBondContact O-N 2.96Å; H148-R150 PolarHBondContact O-N 3.38Å; R150-I152 VanDerWaalsContact C-N 3.26Å; R150-I152 PolarHBondContact O-N 2.75Å; R150-L153 PolarHBondContact O-N 2.85Å; R150-R154 WeakPolarHBondContact O-CG 3.36Å; R150-R154 PolarHBondContact O-N 3.43Å |
| 151 | S | 51.3 | Low | 43.9 | Very low | 65 Ų | 65 | 94.7 Ų | 94.7 | 46% | 0.455 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.5 | -38.6 | 174.3 | 175.9 | 0 | 0 | 0 | 0 | 112 | R147 H148 I149 R155 | R147-S151 WeakPolarHBondContact O-CB 3.49Å; R147-S151 PolarHBondContact O-N 3.13Å; H148-S151 WeakPolarHBondContact O-CB 3.42Å; H148-S151 PolarHBondContact O-N 2.99Å; I149-S151 PolarHBondContact O-N 3.43Å; S151-R155 WeakPolarHBondContact O-CG 3.42Å |
| 152 | I | 45.8 | Very low | 43.4 | Very low | 15 Ų | 15 | 91.9 Ų | 91.9 | 8% | 0.077 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -66 | -53.1 | 176.1 | -72.7 | 161 | 0 | 0 | 0 | 110.5 | H148 I149 R150 R154 R155 F156 L237 V241 | H148-I152 WeakPolarHBondContact CD2-CD1 3.5Å; H148-I152 VanDerWaalsContact NE2-CD1 3.35Å; H148-I152 WeakPolarHBondContact NE2-CD1 3.23Å; H148-I152 WeakPolarHBondContact O-CB 3.17Å; H148-I152 VanDerWaalsContact O-CD1 3.22Å; H148-I152 WeakPolarHBondContact O-CD1 3.28Å; H148-I152 WeakPolarHBondContact O-CG1 3.48Å; H148-I152 PolarHBondContact O-N 2.97Å; I149-I152 WeakPolarHBondContact O-CB 3.42Å; I149-I152 PolarHBondContact O-N 3.27Å; I149-I152 VanDerWaalsContact O-N 3.15Å; R150-I152 VanDerWaalsContact C-N 3.26Å; R150-I152 PolarHBondContact O-N 2.75Å; I152-R154 VanDerWaalsContact C-N 3.28Å; I152-R154 PolarHBondContact O-N 2.93Å; I152-R155 WeakPolarHBondContact O-CB 3.3Å; I152-R155 PolarHBondContact O-N 2.81Å; I152-F156 HydrophobicContact CG2-CD2 4.4Å; I152-F156 HydrophobicContact CG2-CE2 3.76Å; I152-F156 WeakPolarHBondContact O-CD2 3.41Å; I152-F156 WeakPolarHBondContact O-CE2 3.25Å; I152-L237 HydrophobicContact CB-CD1 3.88Å; I152-L237 HydrophobicContact CD1-CD1 3.36Å; I152-L237 HydrophobicContact CD1-CG 4.48Å; I152-L237 HydrophobicContact CG1-CD1 3.32Å; I152-L237 HydrophobicContact CG2-CD1 3.27Å; I152-L237 HydrophobicContact CG2-CD2 3.44Å; I152-L237 VanDerWaalsContact CG2-CD2 3.44Å; I152-L237 HydrophobicContact CG2-CG 3.96Å; I152-V241 HydrophobicContact CD1-CG2 3.7Å |
| 153 | L | 45.4 | Very low | 43 | Very low | 53 Ų | 53 | 100 Ų | 100 | 28% | 0.277 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.5 | -35.8 | -177.2 | -66.2 | 173.5 | 0 | 0 | 0 | 111.8 | I149 R150 R155 F156 F158 | I149-L153 HydrophobicContact CG2-CD1 3.71Å; I149-L153 HydrophobicContact CG2-CG 4.11Å; I149-L153 VanDerWaalsContact O-CG 3.31Å; I149-L153 WeakPolarHBondContact O-CG 3.4Å; I149-L153 PolarHBondContact O-N 3.25Å; R150-L153 PolarHBondContact O-N 2.85Å; L153-R155 PolarHBondContact O-N 3.09Å; L153-R155 VanDerWaalsContact O-N 3.13Å; L153-F156 PolarHBondContact O-N 3.41Å; L153-F158 HydrophobicContact CB-CE2 4.36Å; L153-F158 HydrophobicContact CB-CZ 4.49Å; L153-F158 HydrophobicContact CD2-CZ 4.04Å |
| 154 | R | 49.2 | Very low | 42.6 | Very low | 169 Ų | 169 | 102.8 Ų | 102.8 | 64% | 0.638 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.9 | -25.4 | 172.3 | -80.9 | -174.8 | -175.8 | 175.6 | 0.1 | 114 | R150 I152 F156 | R150-R154 WeakPolarHBondContact O-CG 3.36Å; R150-R154 PolarHBondContact O-N 3.43Å; I152-R154 VanDerWaalsContact C-N 3.28Å; I152-R154 PolarHBondContact O-N 2.93Å; R154-F156 VanDerWaalsContact C-N 3.27Å |
| 155 | R | 40.3 | Very low | 42.3 | Very low | 208 Ų | 208 | 101 Ų | 101 | 79% | 0.785 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.1 | -6.4 | 179.7 | -61.4 | 174.8 | 112 | -178.3 | 6.9 | 113 | S151 I152 L153 | S151-R155 WeakPolarHBondContact O-CG 3.42Å; I152-R155 WeakPolarHBondContact O-CB 3.3Å; I152-R155 PolarHBondContact O-N 2.81Å; L153-R155 PolarHBondContact O-N 3.09Å; L153-R155 VanDerWaalsContact O-N 3.13Å |
| 156 | F | 38.7 | Very low | 41.7 | Very low | 18 Ų | 18 | 102.1 Ų | 102.1 | 8% | 0.079 | 52% | 0.517 | C | S | . | . | S | Bend | trans | -105.8 | 118.1 | 179.4 | -66.2 | -82.5 | 0 | 0 | 0 | 109.7 | I152 L153 R154 F158 P233 W234 L237 | I152-F156 HydrophobicContact CG2-CD2 4.4Å; I152-F156 HydrophobicContact CG2-CE2 3.76Å; I152-F156 WeakPolarHBondContact O-CD2 3.41Å; I152-F156 WeakPolarHBondContact O-CE2 3.25Å; L153-F156 PolarHBondContact O-N 3.41Å; R154-F156 VanDerWaalsContact C-N 3.27Å; F156-F158 WeakPolarHBondContact O-CD2 3.39Å; F156-F158 PolarHBondContact O-N 3.09Å; F156-P233 HydrophobicContact CE1-CB 3.73Å; F156-P233 HydrophobicContact CE1-CG 4.47Å; F156-P233 HydrophobicContact CZ-CB 4.28Å; F156-W234 HydrophobicContact CD1-CZ2 4.18Å; F156-W234 AromaticContact CD1-NE1 3.59Å; F156-W234 HydrophobicContact CD2-CZ2 4.08Å; F156-W234 AromaticContact CE1-CD1 3.38Å; F156-W234 HydrophobicContact CE1-CD2 4.18Å; F156-W234 AromaticContact CE1-CE2 3.44Å; F156-W234 VanDerWaalsContact CE1-CE2 3.44Å; F156-W234 HydrophobicContact CE1-CG 4.16Å; F156-W234 AromaticContact CE1-CZ2 3.9Å; F156-W234 HydrophobicContact CE1-CZ2 3.9Å; F156-W234 AromaticContact CE1-NE1 2.99Å; F156-W234 HydrophobicContact CE2-CH2 4.26Å; F156-W234 AromaticContact CE2-CZ2 3.83Å; F156-W234 HydrophobicContact CE2-CZ2 3.83Å; F156-W234 HydrophobicContact CG-CZ2 4.26Å; F156-W234 AromaticContact CZ-CD1 3.79Å; F156-W234 AromaticContact CZ-CD2 3.9Å; F156-W234 HydrophobicContact CZ-CD2 3.9Å; F156-W234 AromaticContact CZ-CE2 3.44Å; F156-W234 VanDerWaalsContact CZ-CE2 3.44Å; F156-W234 HydrophobicContact CZ-CG 4.13Å; F156-W234 HydrophobicContact CZ-CH2 4.41Å; F156-W234 AromaticContact CZ-CZ2 3.73Å; F156-W234 HydrophobicContact CZ-CZ2 3.73Å; F156-W234 AromaticContact CZ-NE1 3.5Å; F156-L237 HydrophobicContact CE2-CD2 4.46Å |
| 157 | P | 37.2 | Very low | 41.1 | Very low | 99 Ų | 99 | 109.6 Ų | 109.6 | 64% | 0.643 | 54% | 0.541 | S | S | * | . | trans | -70.9 | 99.9 | 173.1 | 28.7 | -31.4 | 0 | 0 | 0 | 109.1 | ||||
| 158 | F | 44.3 | Very low | 40.5 | Very low | 91 Ų | 91 | 104.9 Ų | 104.9 | 40% | 0.399 | 53% | 0.532 | S | S | . | . | trans | -65.6 | 130 | 167.8 | -65.3 | -80.1 | 0 | 0 | 0 | 108.8 | V80 L153 F156 V160 | V80-F158 HydrophobicContact CG1-CD2 4.23Å; V80-F158 HydrophobicContact CG1-CE2 4.3Å; V80-F158 HydrophobicContact CG1-CG 4.49Å; L153-F158 HydrophobicContact CB-CE2 4.36Å; L153-F158 HydrophobicContact CB-CZ 4.49Å; L153-F158 HydrophobicContact CD2-CZ 4.04Å; F156-F158 WeakPolarHBondContact O-CD2 3.39Å; F156-F158 PolarHBondContact O-N 3.09Å; F158-V160 PolarHBondContact O-N 2.9Å | ||
| 159 | P | 33.6 | Very low | 39.7 | Very low | 108 Ų | 108 | 110.2 Ų | 110.2 | 70% | 0.701 | 55% | 0.554 | S | S | * | * | trans | -63.7 | 112.8 | 176.2 | 24 | -30.6 | 0 | 0 | 0 | 108.9 | A161 | P159-A161 PolarHBondContact O-N 3.26Š| ||
| 160 | V | 33.8 | Very low | 38.9 | Very low | 131 Ų | 131 | 112.9 Ų | 112.9 | 79% | 0.794 | 57% | 0.566 | S | S | * | * | trans | -64 | 114.1 | 172.5 | -177.1 | 0 | 0 | 0 | 0 | 107.3 | F158 G162 | F158-V160 PolarHBondContact O-N 2.9Å; V160-G162 PolarHBondContact O-N 3.09Å | ||
| 161 | A | 39.5 | Very low | 37.9 | Very low | 48 Ų | 48 | 114.4 Ų | 114.4 | 40% | 0.397 | 58% | 0.576 | S | S | . | * | trans | -62 | 119.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | E75 P159 | E75-A161 HydrophobicContact CB-CB 4.44Å; P159-A161 PolarHBondContact O-N 3.26Å | ||
| 162 | G | 29.3 | Very low | 36.9 | Very low | 57 Ų | 57 | 115.2 Ų | 115.2 | 59% | 0.588 | 58% | 0.575 | S | S | * | * | trans | -68.3 | 147.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | V160 N164 S165 | V160-G162 PolarHBondContact O-N 3.09Å; G162-N164 PolarHBondContact O-N 3.47Å; G162-S165 PolarHBondContact O-N 3.22Å | ||
| 163 | R | 35.4 | Very low | 36.2 | Very low | 254 Ų | 254 | 117.3 Ų | 117.3 | 96% | 0.958 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.8 | -1.9 | -173.6 | -77.8 | -175.5 | 171.7 | -170.5 | -1.8 | 118.1 | ||
| 164 | N | 36.8 | Very low | 35.5 | Very low | 163 Ų | 163 | 124.3 Ų | 124.3 | 87% | 0.872 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.7 | 16 | -174.4 | -64.8 | -32.8 | 0 | 0 | 0 | 114.4 | G162 | G162-N164 PolarHBondContact O-N 3.47Š|
| 165 | S | 36.3 | Very low | 34.5 | Very low | 48 Ų | 48 | 120.4 Ų | 120.4 | 34% | 0.336 | 61% | 0.609 | S | S | . | * | S | Bend | trans | -80 | 142.6 | 172.8 | 143.4 | 0 | 0 | 0 | 0 | 112 | E75 G162 | E75-S165 WeakPolarHBondContact OE2-CB 3.36Å; E75-S165 PolarHBondContact OE2-OG 3.19Å; G162-S165 PolarHBondContact O-N 3.22Å |
| 166 | P | 32.1 | Very low | 34 | Very low | 109 Ų | 109 | 113.8 Ų | 113.8 | 71% | 0.708 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 138.9 | 176.1 | -18.1 | 30.9 | 0 | 0 | 0 | 112.7 | ||
| 167 | R | 35.7 | Very low | 33.4 | Very low | 244 Ų | 244 | 117.7 Ų | 117.7 | 92% | 0.921 | 62% | 0.619 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 123.2 | -179.7 | -73.3 | -176 | 177.2 | -155.7 | -1.3 | 112.1 | ||
| 168 | P | 42 | Very low | 33 | Very low | 64 Ų | 64 | 119.6 Ų | 119.6 | 42% | 0.416 | 61% | 0.613 | S | S | . | * | P | Polyproline II helix | trans | -80.7 | 140.2 | -164.8 | 30.8 | -35.7 | 0 | 0 | 0 | 112.9 | M76 | M76-P168 HydrophobicContact CE-CB 3.48Å; M76-P168 VanDerWaalsContact CE-CB 3.48Å; M76-P168 HydrophobicContact CE-CG 3.69Å; M76-P168 HydrophobicContact CG-CB 3.86Å; M76-P168 HydrophobicContact CG-CG 3.5Å; M76-P168 VanDerWaalsContact CG-CG 3.5Å; M76-P168 HydrophobicContact SD-CB 4.49Å; M76-P168 HydrophobicContact SD-CG 4.28Å |
| 169 | K | 30.1 | Very low | 32.1 | Very low | 178 Ų | 178 | 125.6 Ų | 125.6 | 77% | 0.774 | 63% | 0.633 | S | S | * | * | trans | -96.9 | 103.8 | -179.2 | -77.3 | -177.6 | 179.1 | 175.8 | 0 | 109.9 | K171 | K169-K171 PolarHBondContact O-N 3.4Š| ||
| 170 | M | 30.6 | Very low | 32.1 | Very low | 120 Ų | 120 | 130.1 Ų | 130.1 | 59% | 0.591 | 64% | 0.636 | S | S | * | * | trans | -58 | 122.9 | 175.7 | -149.7 | 164.7 | 84.2 | 0 | 0 | 110.9 | M76 | M76-M170 HydrophobicContact CE-CB 4.22Å; M76-M170 HydrophobicContact CE-CG 4.43Å | ||
| 171 | K | 29 | Very low | 31.8 | Very low | 160 Ų | 160 | 129.5 Ų | 129.5 | 70% | 0.696 | 63% | 0.629 | S | S | * | * | trans | -119.1 | 110.1 | 172.2 | -77.2 | -174.8 | 179.7 | 175.5 | 0 | 110 | K169 V173 | K169-K171 PolarHBondContact O-N 3.4Å; K171-V173 PolarHBondContact O-N 3.4Å | ||
| 172 | I | 30.8 | Very low | 31.5 | Very low | 83 Ų | 83 | 132.9 Ų | 132.9 | 43% | 0.426 | 64% | 0.64 | S | S | . | * | trans | -76.1 | 109.9 | 171.7 | -57.9 | 169.7 | 0 | 0 | 0 | 107.7 | E68 R174 | E68-I172 WeakPolarHBondContact OE1-CG2 3.05Å; I172-R174 HydrophobicContact CG2-CG 4.1Å | ||
| 173 | V | 30.5 | Very low | 31.4 | Very low | 58 Ų | 58 | 136 Ų | 136 | 35% | 0.352 | 64% | 0.643 | S | S | . | * | trans | -97.8 | 100.4 | 174.3 | 179.4 | 0 | 0 | 0 | 0 | 108.1 | I71 K171 S175 L176 | I71-V173 HydrophobicContact CD1-CB 3.71Å; I71-V173 HydrophobicContact CD1-CG2 3.67Å; K171-V173 PolarHBondContact O-N 3.4Å; V173-S175 PolarHBondContact O-N 2.92Å; V173-L176 HydrophobicContact CG1-CD2 4.34Å | ||
| 174 | R | 29.6 | Very low | 31.4 | Very low | 200 Ų | 200 | 130.7 Ų | 130.7 | 76% | 0.755 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -68.9 | -13.2 | -175.9 | -70.4 | -171.6 | 172.9 | 114.3 | -0.7 | 114.8 | E68 I172 | E68-R174 IonicContact OE1-NE 3.93Å; I172-R174 HydrophobicContact CG2-CG 4.1Å |
| 175 | S | 28.5 | Very low | 31.4 | Very low | 87 Ų | 87 | 131.3 Ų | 131.3 | 61% | 0.608 | 63% | 0.628 | S | S | * | * | trans | -160.9 | 117.9 | 177.8 | 58.9 | 0 | 0 | 0 | 0 | 111 | V173 S177 | V173-S175 PolarHBondContact O-N 2.92Å; S175-S177 PolarHBondContact O-N 2.96Å | ||
| 176 | L | 30.8 | Very low | 31.1 | Very low | 69 Ų | 69 | 134.8 Ų | 134.8 | 36% | 0.361 | 64% | 0.643 | S | S | . | * | trans | -78.7 | 93.2 | 162.4 | -71.2 | 169.1 | 0 | 0 | 0 | 107.7 | V173 W178 F219 | V173-L176 HydrophobicContact CG1-CD2 4.34Å; L176-W178 PolarHBondContact O-N 2.87Å; L176-F219 HydrophobicContact CD1-CD2 4.34Å; L176-F219 HydrophobicContact CD1-CE2 4.25Å | ||
| 177 | S | 25.3 | Very low | 31 | Very low | 100 Ų | 100 | 137.5 Ų | 137.5 | 70% | 0.699 | 65% | 0.652 | S | S | * | * | trans | -71.8 | 99.9 | 164.9 | 62.7 | 0 | 0 | 0 | 0 | 107.7 | S175 R179 | S175-S177 PolarHBondContact O-N 2.96Å; S177-R179 VanDerWaalsContact C-N 3.31Å; S177-R179 PolarHBondContact O-N 3.44Å | ||
| 178 | W | 29.9 | Very low | 30.6 | Very low | 139 Ų | 139 | 134.5 Ų | 134.5 | 53% | 0.527 | 65% | 0.648 | S | S | . | * | trans | -67.6 | 97.7 | 162 | -61.7 | 85.7 | 0 | 0 | 0 | 106.3 | L176 R180 N218 M222 | L176-W178 PolarHBondContact O-N 2.87Å; W178-R180 VanDerWaalsContact C-N 3.31Å; W178-R180 PolarHBondContact O-N 3.5Å; W178-N218 HydrophobicContact CH2-CB 4.42Å; W178-M222 HydrophobicContact CH2-CE 4.15Å; W178-M222 HydrophobicContact CH2-SD 4.34Å | ||
| 179 | R | 23.9 | Very low | 30.4 | Very low | 218 Ų | 218 | 136.2 Ų | 136.2 | 82% | 0.823 | 66% | 0.659 | S | S | * | * | trans | -59.9 | 106.8 | 158.2 | -80.7 | -171.1 | 177 | -155.3 | -0.2 | 105.1 | S177 D181 | S177-R179 VanDerWaalsContact C-N 3.31Å; S177-R179 PolarHBondContact O-N 3.44Å; R179-D181 VanDerWaalsContact C-N 3.29Å; R179-D181 PolarHBondContact O-N 3.27Å | ||
| 180 | R | 33.8 | Very low | 30.4 | Very low | 202 Ų | 202 | 135.8 Ų | 135.8 | 76% | 0.762 | 67% | 0.665 | S | S | * | * | trans | -59.6 | 109.6 | 150.8 | -68.2 | -173.6 | -163.6 | 138.3 | 3.1 | 103.1 | W178 N182 | W178-R180 VanDerWaalsContact C-N 3.31Å; W178-R180 PolarHBondContact O-N 3.5Å; R180-N182 PolarHBondContact O-N 2.84Å | ||
| 181 | D | 28.7 | Very low | 30.3 | Very low | 119 Ų | 119 | 134.8 Ų | 134.8 | 64% | 0.636 | 67% | 0.666 | S | S | * | * | trans | -61.9 | 79.8 | 161.8 | -85.2 | -19.5 | 0 | 0 | 0 | 106.4 | R179 D183 | R179-D181 VanDerWaalsContact C-N 3.29Å; R179-D181 PolarHBondContact O-N 3.27Å; D181-D183 PolarHBondContact O-N 3.23Å | ||
| 182 | N | 32 | Very low | 30.1 | Very low | 118 Ų | 118 | 134.6 Ų | 134.6 | 63% | 0.631 | 67% | 0.672 | S | S | * | * | trans | -72.6 | 0.9 | 164.1 | -78.7 | -23.8 | 0 | 0 | 0 | 110.4 | R180 M184 H185 | R180-N182 PolarHBondContact O-N 2.84Å; N182-M184 PolarHBondContact O-N 3.46Å; N182-M184 VanDerWaalsContact O-N 3.09Å; N182-H185 PolarHBondContact O-N 2.84Å | ||
| 183 | D | 26.7 | Very low | 30 | Very low | 124 Ų | 124 | 135.3 Ų | 135.3 | 66% | 0.663 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | 19.8 | 173.5 | -106.6 | -14.9 | 0 | 0 | 0 | 114.4 | D181 H185 | D181-D183 PolarHBondContact O-N 3.23Å; D183-H185 VanDerWaalsContact C-N 3.33Å |
| 184 | M | 35.9 | Very low | 29.8 | Very low | 142 Ų | 142 | 138 Ų | 138 | 70% | 0.7 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | 2.5 | 163.8 | -68.2 | -66.9 | 108.9 | 0 | 0 | 113.2 | N182 | N182-M184 PolarHBondContact O-N 3.46Å; N182-M184 VanDerWaalsContact O-N 3.09Å |
| 185 | H | 36.5 | Very low | 29.6 | Very low | 175 Ų | 175 | 134.1 Ų | 134.1 | 81% | 0.81 | 71% | 0.714 | S | S | * | * | trans | -119.9 | 53 | 175.1 | -69.7 | -63.9 | 0 | 0 | 0 | 112.5 | N182 D183 | N182-H185 PolarHBondContact O-N 2.84Å; D183-H185 VanDerWaalsContact C-N 3.33Å | ||
| 186 | N | 31 | Very low | 29.5 | Very low | 122 Ų | 122 | 138.2 Ų | 138.2 | 65% | 0.652 | 73% | 0.729 | S | S | * | * | trans | -137.4 | 76.1 | 161.7 | -148 | 2.2 | 0 | 0 | 0 | 111.3 | ||||
| 187 | N | 30.3 | Very low | 29.5 | Very low | 166 Ų | 166 | 140.7 Ų | 140.7 | 89% | 0.888 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -162.3 | 67.9 | 148.6 | -82.9 | -33.8 | 0 | 0 | 0 | 107 | ||
| 188 | Q | 26.2 | Very low | 29.5 | Very low | 180 Ų | 180 | 140.3 Ų | 140.3 | 84% | 0.841 | 74% | 0.744 | S | S | * | * | trans | 32.3 | 166 | 144.3 | -105 | -162.3 | 0.5 | 0 | 0 | 123.2 | ||||
| 189 | P | 39 | Very low | 29.5 | Very low | 100 Ų | 100 | 139.7 Ų | 139.7 | 65% | 0.649 | 76% | 0.758 | S | S | * | * | -114 | 162 | -116.2 | 40.3 | -26.9 | 0 | 0 | 0 | 114.5 | |||||
| 190 | L | 29.1 | Very low | 29.6 | Very low | 170 Ų | 170 | 134.3 Ų | 134.3 | 89% | 0.89 | 75% | 0.749 | S | S | * | * | trans | -138.2 | 87.3 | 158.7 | -92.7 | 153.1 | 0 | 0 | 0 | 108.7 | ||||
| 191 | T | 28.1 | Very low | 29.4 | Very low | 99 Ų | 99 | 129.8 Ų | 129.8 | 61% | 0.607 | 75% | 0.746 | S | S | * | * | trans | 4.1 | 126.4 | 140.3 | 44.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 192 | D | 26.1 | Very low | 29.2 | Very low | 155 Ų | 155 | 130.8 Ų | 130.8 | 83% | 0.829 | 75% | 0.75 | S | S | * | * | 64.5 | 81.7 | 124.9 | -48.6 | -22.9 | 0 | 0 | 0 | 119.1 | |||||
| 193 | A | 27.6 | Very low | 29.1 | Very low | 99 Ų | 99 | 130.2 Ų | 130.2 | 82% | 0.818 | 75% | 0.754 | S | S | * | * | trans | -142.6 | 108.4 | 135.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 194 | S | 26.6 | Very low | 29.4 | Very low | 114 Ų | 114 | 131 Ų | 131 | 80% | 0.797 | 75% | 0.754 | S | S | * | * | trans | -24.4 | 128.7 | 174.8 | 59.9 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 195 | C | 25.4 | Very low | 29.3 | Very low | 118 Ų | 118 | 132 Ų | 132 | 80% | 0.797 | 76% | 0.757 | S | S | * | * | trans | -161.7 | 109.8 | 133.8 | -94.2 | 0 | 0 | 0 | 0 | 106.5 | V197 | C195-V197 PolarHBondContact O-N 3.42Š| ||
| 196 | D | 27.2 | Very low | 29.3 | Very low | 173 Ų | 173 | 126.3 Ų | 126.3 | 93% | 0.925 | 73% | 0.732 | S | S | * | * | trans | -40.6 | 102.4 | 166.1 | -83 | -54.2 | 0 | 0 | 0 | 111.2 | ||||
| 197 | V | 29.7 | Very low | 29.6 | Very low | 122 Ų | 122 | 124.9 Ų | 124.9 | 74% | 0.739 | 73% | 0.725 | S | S | * | * | trans | -138.5 | 91.2 | 162.2 | -172.7 | 0 | 0 | 0 | 0 | 106.6 | C195 | C195-V197 PolarHBondContact O-N 3.42Š| ||
| 198 | S | 25.6 | Very low | 30 | Very low | 92 Ų | 92 | 121.9 Ų | 121.9 | 64% | 0.643 | 71% | 0.714 | S | S | * | * | trans | -38.5 | 120.3 | 170.2 | 51.8 | 0 | 0 | 0 | 0 | 111.8 | T200 | S198-T200 PolarHBondContact O-N 2.88Š| ||
| 199 | P | 29.7 | Very low | 30.7 | Very low | 125 Ų | 125 | 117.2 Ų | 117.2 | 81% | 0.812 | 70% | 0.697 | S | S | * | * | trans | -86.6 | 67.4 | 176.5 | 35.7 | -32.4 | 0 | 0 | 0 | 109.2 | P201 | P199-P201 WeakPolarHBondContact O-CD 3.33Š| ||
| 200 | T | 26.3 | Very low | 30.9 | Very low | 105 Ų | 105 | 115.4 Ų | 115.4 | 64% | 0.644 | 69% | 0.685 | S | S | * | * | trans | -96.1 | 95.6 | 156.9 | 45.2 | 0 | 0 | 0 | 0 | 106.4 | S198 I202 | S198-T200 PolarHBondContact O-N 2.88Å; T200-I202 PolarHBondContact O-N 3.18Å | ||
| 201 | P | 30.1 | Very low | 31.6 | Very low | 107 Ų | 107 | 110.7 Ų | 110.7 | 70% | 0.695 | 66% | 0.66 | S | S | * | * | trans | -57.4 | 113.2 | 164.3 | 25.3 | -30.4 | 0 | 0 | 0 | 105.1 | P199 C203 | P199-P201 WeakPolarHBondContact O-CD 3.33Å; P201-C203 PolarHBondContact O-N 2.79Å | ||
| 202 | I | 24.8 | Very low | 32.2 | Very low | 140 Ų | 140 | 111.8 Ų | 111.8 | 72% | 0.718 | 66% | 0.658 | S | S | * | * | trans | -59.3 | 92.6 | 171.2 | -56.4 | 167.2 | 0 | 0 | 0 | 103.7 | T200 Q204 | T200-I202 PolarHBondContact O-N 3.18Å; I202-Q204 HydrophobicContact CG2-CG 3.65Å; I202-Q204 PolarHBondContact O-N 3.47Å | ||
| 203 | C | 29.1 | Very low | 33.1 | Very low | 106 Ų | 106 | 105.8 Ų | 105.8 | 72% | 0.716 | 63% | 0.63 | S | S | * | * | trans | -61.3 | 82.7 | 156.8 | -73 | 0 | 0 | 0 | 0 | 103.2 | P201 Q205 | P201-C203 PolarHBondContact O-N 2.79Å; C203-Q205 PolarHBondContact O-N 2.89Å | ||
| 204 | Q | 33.6 | Very low | 34 | Very low | 142 Ų | 142 | 103.6 Ų | 103.6 | 66% | 0.664 | 60% | 0.603 | S | S | * | * | trans | -53.6 | 106.8 | 167.1 | -76.3 | -175.4 | -15.3 | 0 | 0 | 102.8 | I202 L206 | I202-Q204 HydrophobicContact CG2-CG 3.65Å; I202-Q204 PolarHBondContact O-N 3.47Å; Q204-L206 PolarHBondContact O-N 2.83Å | ||
| 205 | Q | 32.3 | Very low | 34.8 | Very low | 161 Ų | 161 | 100.6 Ų | 100.6 | 75% | 0.752 | 58% | 0.576 | S | S | * | * | trans | -59.3 | 89.5 | 178.3 | -175.2 | 170.4 | -7.3 | 0 | 0 | 105 | C203 D207 | C203-Q205 PolarHBondContact O-N 2.89Å; Q205-D207 PolarHBondContact O-N 2.77Å | ||
| 206 | L | 38 | Very low | 35.7 | Very low | 57 Ų | 57 | 97.1 Ų | 97.1 | 30% | 0.298 | 56% | 0.556 | S | S | . | * | trans | -60.2 | 131.7 | 175.3 | -79.9 | 121.3 | 0 | 0 | 0 | 105.1 | Q204 T210 | Q204-L206 PolarHBondContact O-N 2.83Å; L206-T210 HydrophobicContact CD2-CG2 3.42Å; L206-T210 VanDerWaalsContact CD2-CG2 3.42Å | ||
| 207 | D | 37.5 | Very low | 36.4 | Very low | 92 Ų | 92 | 90.7 Ų | 90.7 | 49% | 0.492 | 52% | 0.521 | S | S | . | . | trans | -44.3 | 132.2 | 168.4 | -179 | -19.3 | 0 | 0 | 0 | 107.9 | Q205 V209 T210 L211 | Q205-D207 PolarHBondContact O-N 2.77Å; D207-V209 CarbonylContact O-C 3.57Å; D207-V209 PolarHBondContact O-N 3.39Å; D207-V209 PolarHBondContact OD1-N 3.27Å; D207-V209 VanDerWaalsContact OD1-N 3.13Å; D207-T210 WeakPolarHBondContact O-CA 3.29Å; D207-T210 WeakPolarHBondContact O-CB 3.18Å; D207-T210 PolarHBondContact O-N 3.44Å; D207-L211 PolarHBondContact O-N 3.09Å | ||
| 208 | P | 39 | Very low | 37 | Very low | 103 Ų | 103 | 87.7 Ų | 87.7 | 67% | 0.669 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -42.4 | -34.3 | 176.4 | -30.9 | 32.5 | 0 | 0 | 0 | 113.8 | L211 H212 | P208-L211 PolarHBondContact O-N 3.42Å; P208-H212 WeakPolarHBondContact O-CB 3.21Å; P208-H212 PolarHBondContact O-N 3.05Å |
| 209 | V | 38.9 | Very low | 37.5 | Very low | 81 Ų | 81 | 85.6 Ų | 85.6 | 49% | 0.491 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.6 | -43.3 | 175.8 | -176.9 | 0 | 0 | 0 | 0 | 112 | D207 H212 A213 | D207-V209 CarbonylContact O-C 3.57Å; D207-V209 PolarHBondContact O-N 3.39Å; D207-V209 PolarHBondContact OD1-N 3.27Å; D207-V209 VanDerWaalsContact OD1-N 3.13Å; V209-H212 PolarHBondContact O-N 3.2Å; V209-A213 WeakPolarHBondContact O-CB 3.46Å; V209-A213 PolarHBondContact O-N 3.32Å |
| 210 | T | 43.9 | Very low | 37.7 | Very low | 63 Ų | 63 | 83.3 Ų | 83.3 | 39% | 0.387 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -71.6 | -36.1 | 178.3 | -42.5 | 0 | 0 | 0 | 0 | 111.1 | L206 D207 Q214 | L206-T210 HydrophobicContact CD2-CG2 3.42Å; L206-T210 VanDerWaalsContact CD2-CG2 3.42Å; D207-T210 WeakPolarHBondContact O-CA 3.29Å; D207-T210 WeakPolarHBondContact O-CB 3.18Å; D207-T210 PolarHBondContact O-N 3.44Å; T210-Q214 VanDerWaalsContact O-CB 3.28Å; T210-Q214 WeakPolarHBondContact O-CB 3.34Å; T210-Q214 PolarHBondContact O-N 2.78Å |
| 211 | L | 43.6 | Very low | 38.2 | Very low | 71 Ų | 71 | 80.4 Ų | 80.4 | 37% | 0.372 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.2 | -43.9 | 173.8 | -164.6 | 99.3 | 0 | 0 | 0 | 111 | D207 P208 Q214 H215 | D207-L211 PolarHBondContact O-N 3.09Å; P208-L211 PolarHBondContact O-N 3.42Å; L211-Q214 WeakPolarHBondContact O-CB 3.43Å; L211-Q214 PolarHBondContact O-N 2.98Å; L211-H215 PolarHBondContact O-CD2 3.1Å; L211-H215 VanDerWaalsContact O-CD2 3.24Å; L211-H215 PolarHBondContact O-N 2.86Å |
| 212 | H | 41.4 | Very low | 38.1 | Very low | 121 Ų | 121 | 78.8 Ų | 78.8 | 56% | 0.56 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -65.3 | -43.3 | 178 | -160.1 | 75.4 | 0 | 0 | 0 | 111.5 | P208 V209 Q214 H215 A216 | P208-H212 WeakPolarHBondContact O-CB 3.21Å; P208-H212 PolarHBondContact O-N 3.05Å; V209-H212 PolarHBondContact O-N 3.2Å; H212-Q214 VanDerWaalsContact C-N 3.33Å; H212-Q214 PolarHBondContact O-N 2.88Å; H212-H215 PolarHBondContact O-N 3.04Å; H212-A216 WeakPolarHBondContact O-CB 3.34Å; H212-A216 PolarHBondContact O-N 3.26Å |
| 213 | A | 45 | Very low | 38.5 | Very low | 30 Ų | 30 | 75 Ų | 75 | 25% | 0.248 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.9 | -43.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | V209 H215 A216 L217 | V209-A213 WeakPolarHBondContact O-CB 3.46Å; V209-A213 PolarHBondContact O-N 3.32Å; A213-H215 PolarHBondContact O-N 3.22Å; A213-A216 PolarHBondContact O-N 3.47Å; A213-L217 WeakPolarHBondContact O-CB 3.3Å; A213-L217 VanDerWaalsContact O-CD1 3.31Å; A213-L217 WeakPolarHBondContact O-CD1 3.4Å; A213-L217 WeakPolarHBondContact O-CG 3.39Å; A213-L217 PolarHBondContact O-N 3.42Å |
| 214 | Q | 45.7 | Very low | 38.4 | Very low | 52 Ų | 52 | 71.8 Ų | 71.8 | 24% | 0.243 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -63.8 | -39.9 | 176.6 | -171.8 | 178.1 | 11 | 0 | 0 | 112.1 | T210 L211 H212 N218 | T210-Q214 VanDerWaalsContact O-CB 3.28Å; T210-Q214 WeakPolarHBondContact O-CB 3.34Å; T210-Q214 PolarHBondContact O-N 2.78Å; L211-Q214 WeakPolarHBondContact O-CB 3.43Å; L211-Q214 PolarHBondContact O-N 2.98Å; H212-Q214 VanDerWaalsContact C-N 3.33Å; H212-Q214 PolarHBondContact O-N 2.88Å; Q214-N218 VanDerWaalsContact O-CB 3.23Å; Q214-N218 WeakPolarHBondContact O-CB 3.18Å; Q214-N218 VanDerWaalsContact O-CG 3.25Å; Q214-N218 PolarHBondContact O-N 3.22Å; Q214-N218 PolarHBondContact O-ND2 2.91Å |
| 215 | H | 43 | Very low | 38.2 | Very low | 51 Ų | 51 | 69.9 Ų | 69.9 | 24% | 0.236 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -65.9 | -47.7 | 174.8 | -86.7 | -75.2 | 0 | 0 | 0 | 111.9 | L211 H212 A213 L217 N218 F219 | L211-H215 PolarHBondContact O-CD2 3.1Å; L211-H215 VanDerWaalsContact O-CD2 3.24Å; L211-H215 PolarHBondContact O-N 2.86Å; H212-H215 PolarHBondContact O-N 3.04Å; A213-H215 PolarHBondContact O-N 3.22Å; H215-L217 VanDerWaalsContact C-N 3.29Å; H215-L217 PolarHBondContact O-N 3.25Å; H215-N218 PolarHBondContact O-N 3.03Å; H215-F219 WeakPolarHBondContact O-CB 3.41Å; H215-F219 PolarHBondContact O-N 3.15Å |
| 216 | A | 44.9 | Very low | 38.1 | Very low | 45 Ų | 45 | 69.7 Ų | 69.7 | 37% | 0.372 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -60.1 | -40.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | H212 A213 F219 M220 | H212-A216 WeakPolarHBondContact O-CB 3.34Å; H212-A216 PolarHBondContact O-N 3.26Å; A213-A216 PolarHBondContact O-N 3.47Å; A216-F219 PolarHBondContact O-N 2.73Å; A216-M220 HydrophobicContact CB-CE 4.5Å; A216-M220 WeakPolarHBondContact O-CG 3.31Å; A216-M220 PolarHBondContact O-N 3.45Å |
| 217 | L | 42.5 | Very low | 37.4 | Very low | 38 Ų | 38 | 70.7 Ų | 70.7 | 20% | 0.199 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -73.1 | -41.6 | 178.4 | -71.9 | 165.3 | 0 | 0 | 0 | 112.7 | A213 H215 F219 M220 V221 W234 F249 | A213-L217 WeakPolarHBondContact O-CB 3.3Å; A213-L217 VanDerWaalsContact O-CD1 3.31Å; A213-L217 WeakPolarHBondContact O-CD1 3.4Å; A213-L217 WeakPolarHBondContact O-CG 3.39Å; A213-L217 PolarHBondContact O-N 3.42Å; H215-L217 VanDerWaalsContact C-N 3.29Å; H215-L217 PolarHBondContact O-N 3.25Å; L217-F219 PolarHBondContact O-N 2.94Å; L217-M220 HydrophobicContact CD2-CE 3.97Å; L217-M220 HydrophobicContact CG-CE 4.49Å; L217-M220 PolarHBondContact O-N 3.32Å; L217-V221 WeakPolarHBondContact O-CB 3.27Å; L217-V221 VanDerWaalsContact O-CG2 3.27Å; L217-V221 WeakPolarHBondContact O-CG2 3.1Å; L217-V221 PolarHBondContact O-N 2.96Å; L217-W234 HydrophobicContact CD2-CZ3 3.91Å; L217-F249 HydrophobicContact CD1-CE1 4.44Å; L217-F249 HydrophobicContact CD1-CE2 4.4Å; L217-F249 HydrophobicContact CD1-CZ 3.65Å; L217-F249 HydrophobicContact CD2-CZ 4.1Å; L217-F249 HydrophobicContact CG-CZ 4.39Å |
| 218 | N | 42.6 | Very low | 36.9 | Very low | 59 Ų | 59 | 71.9 Ų | 71.9 | 32% | 0.316 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.8 | -36.5 | 172.7 | -80.3 | -22.1 | 0 | 0 | 0 | 111 | W178 Q214 H215 M222 | W178-N218 HydrophobicContact CH2-CB 4.42Å; Q214-N218 VanDerWaalsContact O-CB 3.23Å; Q214-N218 WeakPolarHBondContact O-CB 3.18Å; Q214-N218 VanDerWaalsContact O-CG 3.25Å; Q214-N218 PolarHBondContact O-N 3.22Å; Q214-N218 PolarHBondContact O-ND2 2.91Å; H215-N218 PolarHBondContact O-N 3.03Å; N218-M222 WeakPolarHBondContact O-CB 3.34Å; N218-M222 VanDerWaalsContact O-CG 3.3Å; N218-M222 WeakPolarHBondContact O-CG 3.4Å; N218-M222 PolarHBondContact O-N 3.28Å |
| 219 | F | 36.4 | Very low | 36.3 | Very low | 48 Ų | 48 | 77.7 Ų | 77.7 | 21% | 0.211 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -67.4 | -45.4 | 175 | -150.4 | -89.9 | 0 | 0 | 0 | 111.3 | I71 L176 H215 A216 L217 V221 M222 V223 | I71-F219 HydrophobicContact CB-CZ 4.17Å; I71-F219 HydrophobicContact CD1-CE2 3.95Å; I71-F219 HydrophobicContact CD1-CZ 3.72Å; I71-F219 HydrophobicContact CG1-CE2 4.07Å; I71-F219 HydrophobicContact CG1-CZ 3.57Å; I71-F219 HydrophobicContact CG2-CE1 4.14Å; I71-F219 HydrophobicContact CG2-CZ 3.68Å; L176-F219 HydrophobicContact CD1-CD2 4.34Å; L176-F219 HydrophobicContact CD1-CE2 4.25Å; H215-F219 WeakPolarHBondContact O-CB 3.41Å; H215-F219 PolarHBondContact O-N 3.15Å; A216-F219 PolarHBondContact O-N 2.73Å; L217-F219 PolarHBondContact O-N 2.94Å; F219-V221 PolarHBondContact O-N 2.99Å; F219-M222 PolarHBondContact O-N 3.23Å; F219-V223 HydrophobicContact CD1-CG2 3.89Å; F219-V223 HydrophobicContact CE1-CG2 3.8Å; F219-V223 WeakPolarHBondContact O-CG2 3.34Å; F219-V223 PolarHBondContact O-N 2.99Å |
| 220 | M | 33.2 | Very low | 36.1 | Very low | 78 Ų | 78 | 77.1 Ų | 77.1 | 38% | 0.384 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65.8 | -34.5 | 174.8 | -78.4 | -173.1 | -80.1 | 0 | 0 | 113.1 | A216 L217 G224 W234 | A216-M220 HydrophobicContact CB-CE 4.5Å; A216-M220 WeakPolarHBondContact O-CG 3.31Å; A216-M220 PolarHBondContact O-N 3.45Å; L217-M220 HydrophobicContact CD2-CE 3.97Å; L217-M220 HydrophobicContact CG-CE 4.49Å; L217-M220 PolarHBondContact O-N 3.32Å; M220-G224 VanDerWaalsContact O-CA 3.31Å; M220-G224 WeakPolarHBondContact O-CA 3.44Å; M220-G224 PolarHBondContact O-N 3.43Å; M220-W234 HydrophobicContact SD-CH2 4.4Å |
| 221 | V | 36.3 | Very low | 35.7 | Very low | 44 Ų | 44 | 77.3 Ų | 77.3 | 27% | 0.267 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -69.8 | -37.1 | 172.5 | 172.5 | 0 | 0 | 0 | 0 | 110.3 | L217 F219 R225 F253 | L217-V221 WeakPolarHBondContact O-CB 3.27Å; L217-V221 VanDerWaalsContact O-CG2 3.27Å; L217-V221 WeakPolarHBondContact O-CG2 3.1Å; L217-V221 PolarHBondContact O-N 2.96Å; F219-V221 PolarHBondContact O-N 2.99Å; V221-R225 WeakPolarHBondContact O-CG 3.41Å; V221-R225 PolarHBondContact O-N 3.34Å; V221-F253 HydrophobicContact CG2-CE2 4.42Å; V221-F253 HydrophobicContact CG2-CZ 4.39Å |
| 222 | M | 28.6 | Very low | 35.1 | Very low | 72 Ų | 72 | 81.1 Ų | 81.1 | 36% | 0.355 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -70.6 | -36.5 | 175.6 | -76 | -147.6 | -57.3 | 0 | 0 | 113.3 | W178 N218 F219 R225 | W178-M222 HydrophobicContact CH2-CE 4.15Å; W178-M222 HydrophobicContact CH2-SD 4.34Å; N218-M222 WeakPolarHBondContact O-CB 3.34Å; N218-M222 VanDerWaalsContact O-CG 3.3Å; N218-M222 WeakPolarHBondContact O-CG 3.4Å; N218-M222 PolarHBondContact O-N 3.28Å; F219-M222 PolarHBondContact O-N 3.23Å; M222-R225 WeakPolarHBondContact O-CB 3.39Å |
| 223 | V | 32.1 | Very low | 34.9 | Very low | 61 Ų | 61 | 78.1 Ų | 78.1 | 37% | 0.37 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -75.3 | -39.5 | 174.1 | 176.3 | 0 | 0 | 0 | 0 | 110.5 | P74 F219 R225 L226 | P74-V223 HydrophobicContact CB-CG1 4.18Å; P74-V223 HydrophobicContact CG-CG1 4.23Å; F219-V223 HydrophobicContact CD1-CG2 3.89Å; F219-V223 HydrophobicContact CE1-CG2 3.8Å; F219-V223 WeakPolarHBondContact O-CG2 3.34Å; F219-V223 PolarHBondContact O-N 2.99Å; V223-R225 PolarHBondContact O-N 3.3Å; V223-L226 PolarHBondContact O-N 3.25Å |
| 224 | G | 27.3 | Very low | 34.7 | Very low | 38 Ų | 38 | 79.6 Ų | 79.6 | 39% | 0.392 | 41% | 0.409 | S | S | . | . | G | 310 helix | trans | -70.2 | -4.1 | 174 | 0 | 0 | 0 | 0 | 0 | 114.8 | M220 L226 C227 | M220-G224 VanDerWaalsContact O-CA 3.31Å; M220-G224 WeakPolarHBondContact O-CA 3.44Å; M220-G224 PolarHBondContact O-N 3.43Å; G224-L226 PolarHBondContact O-N 2.85Å; G224-C227 PolarHBondContact O-N 3.47Å |
| 225 | R | 29.6 | Very low | 34.4 | Very low | 102 Ų | 102 | 78.8 Ų | 78.8 | 39% | 0.385 | 41% | 0.412 | S | S | . | . | G | 310 helix | trans | -59.2 | -6.6 | 166.8 | -82.8 | 171.1 | -173.2 | -166.6 | 1.7 | 113.3 | V221 M222 V223 | V221-R225 WeakPolarHBondContact O-CG 3.41Å; V221-R225 PolarHBondContact O-N 3.34Å; M222-R225 WeakPolarHBondContact O-CB 3.39Å; V223-R225 PolarHBondContact O-N 3.3Å |
| 226 | L | 29.8 | Very low | 34.1 | Very low | 158 Ų | 158 | 83.4 Ų | 83.4 | 83% | 0.827 | 43% | 0.431 | S | S | * | . | G | 310 helix | trans | -93.9 | -7.9 | 170.3 | -91.9 | 140.1 | 0 | 0 | 0 | 115.1 | V223 G224 | V223-L226 PolarHBondContact O-N 3.25Å; G224-L226 PolarHBondContact O-N 2.85Å |
| 227 | C | 24.8 | Very low | 34 | Very low | 77 Ų | 77 | 82.3 Ų | 82.3 | 52% | 0.52 | 42% | 0.419 | S | S | . | . | trans | -138.4 | 81.2 | 178 | -74.5 | 0 | 0 | 0 | 0 | 111.9 | G224 Y229 E230 | G224-C227 PolarHBondContact O-N 3.47Å; C227-Y229 PolarHBondContact O-N 3.32Å; C227-E230 PolarHBondContact O-N 2.84Å | ||
| 228 | F | 26.4 | Very low | 33.8 | Very low | 117 Ų | 117 | 80.7 Ų | 80.7 | 51% | 0.513 | 41% | 0.411 | S | S | . | . | G | 310 helix | trans | -54.1 | -16 | 170.7 | -94.9 | -97 | 0 | 0 | 0 | 114.9 | E230 V260 | F228-E230 VanDerWaalsContact C-N 3.3Å; F228-E230 PolarHBondContact O-N 2.98Å; F228-V260 HydrophobicContact CE1-CG1 3.96Å; F228-V260 HydrophobicContact CE2-CG1 4.02Å; F228-V260 HydrophobicContact CZ-CG1 3.21Å |
| 229 | Y | 27.3 | Very low | 33.5 | Very low | 226 Ų | 226 | 85.6 Ų | 85.6 | 89% | 0.886 | 43% | 0.425 | S | S | * | . | G | 310 helix | trans | -78.2 | -8.3 | -178.5 | -73.7 | -76.8 | 0 | 0 | 0 | 114.7 | C227 | C227-Y229 PolarHBondContact O-N 3.32Š|
| 230 | E | 33.4 | Very low | 33.5 | Very low | 68 Ų | 68 | 86.3 Ų | 86.3 | 32% | 0.318 | 44% | 0.44 | S | S | . | . | G | 310 helix | trans | -102.7 | 11.3 | 176.8 | -75.8 | -147.5 | 141.9 | 0 | 0 | 114.9 | C227 F228 L232 P233 | C227-E230 PolarHBondContact O-N 2.84Å; F228-E230 VanDerWaalsContact C-N 3.3Å; F228-E230 PolarHBondContact O-N 2.98Å; E230-L232 PolarHBondContact O-N 2.9Å; E230-P233 WeakPolarHBondContact O-CD 3.4Å |
| 231 | V | 35.1 | Very low | 33.7 | Very low | 67 Ų | 67 | 84.3 Ų | 84.3 | 41% | 0.406 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -72.3 | -28.8 | -180 | -174.6 | 0 | 0 | 0 | 0 | 112.9 | W234 A235 F253 | V231-W234 PolarHBondContact O-N 2.87Å; V231-A235 PolarHBondContact O-N 3.47Å; V231-F253 HydrophobicContact CG1-CE1 4.04Å; V231-F253 HydrophobicContact CG1-CZ 4.41Å |
| 232 | L | 31.9 | Very low | 33.8 | Very low | 152 Ų | 152 | 87.3 Ų | 87.3 | 80% | 0.796 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -66.8 | -42.5 | -174.5 | -104.8 | 98.3 | 0 | 0 | 0 | 115 | E230 W234 A235 | E230-L232 PolarHBondContact O-N 2.9Å; L232-W234 PolarHBondContact O-N 3.42Å; L232-A235 PolarHBondContact O-N 3.38Å |
| 233 | P | 36.4 | Very low | 34.3 | Very low | 57 Ų | 57 | 94.3 Ų | 94.3 | 37% | 0.37 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.6 | -25.8 | 175.2 | -17.8 | 27.9 | 0 | 0 | 0 | 112.8 | F156 E230 K236 L237 | F156-P233 HydrophobicContact CE1-CB 3.73Å; F156-P233 HydrophobicContact CE1-CG 4.47Å; F156-P233 HydrophobicContact CZ-CB 4.28Å; E230-P233 WeakPolarHBondContact O-CD 3.4Å; P233-K236 WeakPolarHBondContact O-CB 3.39Å; P233-K236 PolarHBondContact O-N 2.85Å; P233-K236 VanDerWaalsContact O-N 3.15Å; P233-L237 PolarHBondContact O-N 3.46Å |
| 234 | W | 41.2 | Very low | 34.5 | Very low | 61 Ų | 61 | 99.6 Ų | 99.6 | 23% | 0.231 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -76.6 | -26.7 | -179.4 | -70.1 | 74.8 | 0 | 0 | 0 | 113.6 | F156 L217 M220 V231 L232 K236 L237 A238 | F156-W234 HydrophobicContact CD1-CZ2 4.18Å; F156-W234 AromaticContact CD1-NE1 3.59Å; F156-W234 HydrophobicContact CD2-CZ2 4.08Å; F156-W234 AromaticContact CE1-CD1 3.38Å; F156-W234 HydrophobicContact CE1-CD2 4.18Å; F156-W234 AromaticContact CE1-CE2 3.44Å; F156-W234 VanDerWaalsContact CE1-CE2 3.44Å; F156-W234 HydrophobicContact CE1-CG 4.16Å; F156-W234 AromaticContact CE1-CZ2 3.9Å; F156-W234 HydrophobicContact CE1-CZ2 3.9Å; F156-W234 AromaticContact CE1-NE1 2.99Å; F156-W234 HydrophobicContact CE2-CH2 4.26Å; F156-W234 AromaticContact CE2-CZ2 3.83Å; F156-W234 HydrophobicContact CE2-CZ2 3.83Å; F156-W234 HydrophobicContact CG-CZ2 4.26Å; F156-W234 AromaticContact CZ-CD1 3.79Å; F156-W234 AromaticContact CZ-CD2 3.9Å; F156-W234 HydrophobicContact CZ-CD2 3.9Å; F156-W234 AromaticContact CZ-CE2 3.44Å; F156-W234 VanDerWaalsContact CZ-CE2 3.44Å; F156-W234 HydrophobicContact CZ-CG 4.13Å; F156-W234 HydrophobicContact CZ-CH2 4.41Å; F156-W234 AromaticContact CZ-CZ2 3.73Å; F156-W234 HydrophobicContact CZ-CZ2 3.73Å; F156-W234 AromaticContact CZ-NE1 3.5Å; L217-W234 HydrophobicContact CD2-CZ3 3.91Å; M220-W234 HydrophobicContact SD-CH2 4.4Å; V231-W234 PolarHBondContact O-N 2.87Å; L232-W234 PolarHBondContact O-N 3.42Å; W234-K236 PolarHBondContact O-N 2.84Å; W234-L237 HydrophobicContact CD2-CD2 4.07Å; W234-L237 HydrophobicContact CE3-CB 4.47Å; W234-L237 HydrophobicContact CE3-CD2 3.23Å; W234-L237 HydrophobicContact CE3-CG 4.4Å; W234-L237 HydrophobicContact CH2-CD2 3.95Å; W234-L237 HydrophobicContact CZ3-CD2 3.15Å; W234-L237 CarbonylContact O-C 3.6Å; W234-L237 WeakPolarHBondContact O-CB 3.42Å; W234-L237 PolarHBondContact O-N 3.33Å; W234-L237 VanDerWaalsContact O-N 3.09Å; W234-A238 WeakPolarHBondContact O-CB 3.34Å; W234-A238 PolarHBondContact O-N 3.35Å |
| 235 | A | 39.4 | Very low | 35 | Very low | 35 Ų | 35 | 100 Ų | 100 | 29% | 0.289 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.4 | -24.4 | 168.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V231 L232 R239 | V231-A235 PolarHBondContact O-N 3.47Å; L232-A235 PolarHBondContact O-N 3.38Å; A235-R239 PolarHBondContact O-NE 2.85Å; A235-R239 VanDerWaalsContact O-NE 3.1Å |
| 236 | K | 37.8 | Very low | 35.2 | Very low | 148 Ų | 148 | 95.7 Ų | 95.7 | 64% | 0.643 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -78.2 | -39.7 | 168.5 | -66.1 | 179.8 | 178.9 | 174.4 | 0 | 110.7 | P233 W234 R239 A240 | P233-K236 WeakPolarHBondContact O-CB 3.39Å; P233-K236 PolarHBondContact O-N 2.85Å; P233-K236 VanDerWaalsContact O-N 3.15Å; W234-K236 PolarHBondContact O-N 2.84Å; K236-R239 WeakPolarHBondContact O-CB 3.48Å; K236-R239 PolarHBondContact O-N 3.27Å; K236-A240 PolarHBondContact O-N 3.43Å |
| 237 | L | 42.2 | Very low | 35.7 | Very low | 22 Ų | 22 | 97.3 Ų | 97.3 | 12% | 0.115 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -61 | -50.3 | 176.3 | -176.8 | 63.2 | 0 | 0 | 0 | 112.8 | I152 F156 P233 W234 R239 A240 V241 | I152-L237 HydrophobicContact CB-CD1 3.88Å; I152-L237 HydrophobicContact CD1-CD1 3.36Å; I152-L237 HydrophobicContact CD1-CG 4.48Å; I152-L237 HydrophobicContact CG1-CD1 3.32Å; I152-L237 HydrophobicContact CG2-CD1 3.27Å; I152-L237 HydrophobicContact CG2-CD2 3.44Å; I152-L237 VanDerWaalsContact CG2-CD2 3.44Å; I152-L237 HydrophobicContact CG2-CG 3.96Å; F156-L237 HydrophobicContact CE2-CD2 4.46Å; P233-L237 PolarHBondContact O-N 3.46Å; W234-L237 HydrophobicContact CD2-CD2 4.07Å; W234-L237 HydrophobicContact CE3-CB 4.47Å; W234-L237 HydrophobicContact CE3-CD2 3.23Å; W234-L237 HydrophobicContact CE3-CG 4.4Å; W234-L237 HydrophobicContact CH2-CD2 3.95Å; W234-L237 HydrophobicContact CZ3-CD2 3.15Å; W234-L237 CarbonylContact O-C 3.6Å; W234-L237 WeakPolarHBondContact O-CB 3.42Å; W234-L237 PolarHBondContact O-N 3.33Å; W234-L237 VanDerWaalsContact O-N 3.09Å; L237-R239 PolarHBondContact O-N 2.85Å; L237-A240 CarbonylContact O-C 3.59Å; L237-A240 WeakPolarHBondContact O-CA 3.31Å; L237-A240 WeakPolarHBondContact O-CB 3.34Å; L237-A240 PolarHBondContact O-N 3.47Å; L237-V241 HydrophobicContact CD1-CG2 3.72Å; L237-V241 HydrophobicContact CG-CG2 3.95Å; L237-V241 WeakPolarHBondContact O-CG2 3.42Å; L237-V241 PolarHBondContact O-N 2.84Å |
| 238 | A | 39.2 | Very low | 36.3 | Very low | 4 Ų | 4 | 98 Ų | 98 | 3% | 0.033 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -57.4 | -35.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | W234 A246 F249 | W234-A238 WeakPolarHBondContact O-CB 3.34Å; W234-A238 PolarHBondContact O-N 3.35Å; A238-A246 HydrophobicContact CB-CB 4.37Å; A238-A246 WeakPolarHBondContact O-CB 3.37Å; A238-F249 HydrophobicContact CB-CB 4.26Å; A238-F249 HydrophobicContact CB-CD2 3.5Å; A238-F249 HydrophobicContact CB-CE2 4.04Å; A238-F249 HydrophobicContact CB-CG 4.07Å |
| 239 | R | 35.7 | Very low | 36.8 | Very low | 162 Ų | 162 | 94.5 Ų | 94.5 | 61% | 0.611 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -67.5 | -32.8 | 171.8 | -85.5 | -174.7 | -90.6 | 173.8 | -13.2 | 113.4 | A235 K236 L237 | A235-R239 PolarHBondContact O-NE 2.85Å; A235-R239 VanDerWaalsContact O-NE 3.1Å; K236-R239 WeakPolarHBondContact O-CB 3.48Å; K236-R239 PolarHBondContact O-N 3.27Å; L237-R239 PolarHBondContact O-N 2.85Å |
| 240 | A | 35.7 | Very low | 37.2 | Very low | 64 Ų | 64 | 89.6 Ų | 89.6 | 53% | 0.529 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -77.2 | -42.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | K236 L237 N242 | K236-A240 PolarHBondContact O-N 3.43Å; L237-A240 CarbonylContact O-C 3.59Å; L237-A240 WeakPolarHBondContact O-CA 3.31Å; L237-A240 WeakPolarHBondContact O-CB 3.34Å; L237-A240 PolarHBondContact O-N 3.47Å; A240-N242 PolarHBondContact O-N 3.15Å |
| 241 | V | 38.7 | Very low | 37.6 | Very low | 35 Ų | 35 | 91.3 Ų | 91.3 | 21% | 0.212 | 43% | 0.434 | C | S | . | . | S | Bend | trans | -83.9 | 47.5 | -175.7 | -166.1 | 0 | 0 | 0 | 0 | 111.5 | H148 I152 L237 V245 | H148-V241 WeakPolarHBondContact NE2-CG2 3.33Å; I152-V241 HydrophobicContact CD1-CG2 3.7Å; L237-V241 HydrophobicContact CD1-CG2 3.72Å; L237-V241 HydrophobicContact CG-CG2 3.95Å; L237-V241 WeakPolarHBondContact O-CG2 3.42Å; L237-V241 PolarHBondContact O-N 2.84Å; V241-V245 WeakPolarHBondContact O-CB 3.44Å; V241-V245 WeakPolarHBondContact O-CG2 3.21Å |
| 242 | N | 37.8 | Very low | 37.7 | Very low | 107 Ų | 107 | 91.1 Ų | 91.1 | 57% | 0.572 | 43% | 0.43 | S | S | * | . | trans | 77.2 | 133.2 | 175.3 | -156.8 | -29.6 | 0 | 0 | 0 | 115.4 | A240 K244 V245 A246 | A240-N242 PolarHBondContact O-N 3.15Å; N242-K244 PolarHBondContact O-N 2.88Å; N242-K244 VanDerWaalsContact O-N 3.09Å; N242-V245 PolarHBondContact O-N 3.02Å; N242-V245 VanDerWaalsContact O-N 3.09Å; N242-A246 PolarHBondContact O-N 3.33Å; N242-A246 VanDerWaalsContact O-N 3.09Å | ||
| 243 | R | 38.2 | Very low | 37.9 | Very low | 219 Ų | 219 | 86.8 Ų | 86.8 | 83% | 0.826 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -57.4 | -27.2 | -178.2 | -78.1 | -178.4 | 178.8 | 174 | 0.1 | 113.8 | R247 | R243-R247 PolarHBondContact O-N 3.34Å |
| 244 | K | 37.1 | Very low | 37.7 | Very low | 173 Ų | 173 | 88.6 Ų | 88.6 | 75% | 0.752 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -66.8 | -46.7 | 176.6 | -81.5 | -176.3 | 178.3 | 178.7 | 0 | 111.6 | N242 A246 R247 F248 | N242-K244 PolarHBondContact O-N 2.88Å; N242-K244 VanDerWaalsContact O-N 3.09Å; K244-A246 VanDerWaalsContact C-N 3.33Å; K244-R247 PolarHBondContact O-N 3.13Å; K244-F248 PolarHBondContact O-N 2.97Å; K244-F248 VanDerWaalsContact O-N 3.12Å |
| 245 | V | 37.5 | Very low | 37.3 | Very low | 47 Ų | 47 | 89.7 Ų | 89.7 | 29% | 0.285 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -65.3 | -41.5 | 176.5 | -177.7 | 0 | 0 | 0 | 0 | 109.4 | V241 N242 R247 F248 F249 | V241-V245 WeakPolarHBondContact O-CB 3.44Å; V241-V245 WeakPolarHBondContact O-CG2 3.21Å; N242-V245 PolarHBondContact O-N 3.02Å; N242-V245 VanDerWaalsContact O-N 3.09Å; V245-R247 PolarHBondContact O-N 3.38Å; V245-F248 WeakPolarHBondContact O-CB 3.35Å; V245-F248 PolarHBondContact O-N 3.34Å; V245-F248 VanDerWaalsContact O-N 3.15Å; V245-F249 HydrophobicContact CG1-CD2 3.69Å; V245-F249 HydrophobicContact CG1-CE2 3.38Å; V245-F249 HydrophobicContact CG1-CZ 4.47Å; V245-F249 WeakPolarHBondContact O-CD2 3.34Å; V245-F249 PolarHBondContact O-N 3.17Å |
| 246 | A | 34.6 | Very low | 37 | Very low | 10 Ų | 10 | 89.8 Ų | 89.8 | 8% | 0.083 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -56.6 | -48 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | A238 N242 K244 F248 F249 Y250 | A238-A246 HydrophobicContact CB-CB 4.37Å; A238-A246 WeakPolarHBondContact O-CB 3.37Å; N242-A246 PolarHBondContact O-N 3.33Å; N242-A246 VanDerWaalsContact O-N 3.09Å; K244-A246 VanDerWaalsContact C-N 3.33Å; A246-F248 VanDerWaalsContact C-N 3.27Å; A246-F248 PolarHBondContact O-N 2.84Å; A246-F249 WeakPolarHBondContact O-CB 3.41Å; A246-F249 PolarHBondContact O-N 2.65Å; A246-Y250 VanDerWaalsContact O-CD2 3.29Å; A246-Y250 WeakPolarHBondContact O-CD2 3.22Å; A246-Y250 PolarHBondContact O-N 3.34Å |
| 247 | R | 38.6 | Very low | 36.6 | Very low | 192 Ų | 192 | 86.8 Ų | 86.8 | 73% | 0.725 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -61.5 | -38.4 | 176.8 | -85.5 | -173 | -173.1 | 170.2 | 2.6 | 111.8 | R243 K244 V245 Y250 N251 | R243-R247 PolarHBondContact O-N 3.34Å; K244-R247 PolarHBondContact O-N 3.13Å; V245-R247 PolarHBondContact O-N 3.38Å; R247-Y250 PolarHBondContact O-N 2.97Å; R247-N251 WeakPolarHBondContact O-CB 3.31Å; R247-N251 PolarHBondContact O-N 2.52Å |
| 248 | F | 38.2 | Very low | 36 | Very low | 92 Ų | 92 | 89.3 Ų | 89.3 | 40% | 0.404 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -63.4 | -46.5 | 176.2 | -137 | -86.4 | 0 | 0 | 0 | 110.6 | K244 V245 A246 Y250 N251 D252 | K244-F248 PolarHBondContact O-N 2.97Å; K244-F248 VanDerWaalsContact O-N 3.12Å; V245-F248 WeakPolarHBondContact O-CB 3.35Å; V245-F248 PolarHBondContact O-N 3.34Å; V245-F248 VanDerWaalsContact O-N 3.15Å; A246-F248 VanDerWaalsContact C-N 3.27Å; A246-F248 PolarHBondContact O-N 2.84Å; F248-Y250 PolarHBondContact O-N 3.36Å; F248-N251 PolarHBondContact O-N 2.98Å; F248-D252 VanDerWaalsContact CD1-OD2 3.26Å; F248-D252 WeakPolarHBondContact CD1-OD2 3.38Å; F248-D252 WeakPolarHBondContact CE1-OD2 3.31Å; F248-D252 WeakPolarHBondContact O-CB 3.09Å; F248-D252 PolarHBondContact O-N 3.28Å |
| 249 | F | 37.1 | Very low | 35.7 | Very low | 43 Ų | 43 | 93.7 Ų | 93.7 | 19% | 0.189 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -56.6 | -47.6 | 172.7 | -81.2 | -68.4 | 0 | 0 | 0 | 112.5 | L217 A238 V245 A246 N251 F253 | L217-F249 HydrophobicContact CD1-CE1 4.44Å; L217-F249 HydrophobicContact CD1-CE2 4.4Å; L217-F249 HydrophobicContact CD1-CZ 3.65Å; L217-F249 HydrophobicContact CD2-CZ 4.1Å; L217-F249 HydrophobicContact CG-CZ 4.39Å; A238-F249 HydrophobicContact CB-CB 4.26Å; A238-F249 HydrophobicContact CB-CD2 3.5Å; A238-F249 HydrophobicContact CB-CE2 4.04Å; A238-F249 HydrophobicContact CB-CG 4.07Å; V245-F249 HydrophobicContact CG1-CD2 3.69Å; V245-F249 HydrophobicContact CG1-CE2 3.38Å; V245-F249 HydrophobicContact CG1-CZ 4.47Å; V245-F249 WeakPolarHBondContact O-CD2 3.34Å; V245-F249 PolarHBondContact O-N 3.17Å; A246-F249 WeakPolarHBondContact O-CB 3.41Å; A246-F249 PolarHBondContact O-N 2.65Å; F249-N251 PolarHBondContact O-N 3.03Å; F249-F253 HydrophobicContact CD1-CD2 4.17Å; F249-F253 HydrophobicContact CD1-CE2 4.14Å; F249-F253 WeakPolarHBondContact O-CA 3.29Å; F249-F253 WeakPolarHBondContact O-CB 3.34Å; F249-F253 PolarHBondContact O-N 2.98Å |
| 250 | Y | 36.7 | Very low | 35.4 | Very low | 124 Ų | 124 | 87.1 Ų | 87.1 | 49% | 0.486 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.7 | -35.6 | 180 | -86.4 | -76.9 | 0 | 0 | 0 | 113.2 | A246 R247 F248 N254 | A246-Y250 VanDerWaalsContact O-CD2 3.29Å; A246-Y250 WeakPolarHBondContact O-CD2 3.22Å; A246-Y250 PolarHBondContact O-N 3.34Å; R247-Y250 PolarHBondContact O-N 2.97Å; F248-Y250 PolarHBondContact O-N 3.36Å; Y250-N254 WeakPolarHBondContact O-CB 3.32Å; Y250-N254 PolarHBondContact O-N 3.27Å; Y250-N254 PolarHBondContact O-ND2 3.37Å |
| 251 | N | 40.1 | Very low | 35 | Very low | 103 Ų | 103 | 88.4 Ų | 88.4 | 55% | 0.551 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -75.4 | -44.7 | 178.3 | -74.4 | -20 | 0 | 0 | 0 | 111.6 | R247 F248 F249 N254 C255 | R247-N251 WeakPolarHBondContact O-CB 3.31Å; R247-N251 PolarHBondContact O-N 2.52Å; F248-N251 PolarHBondContact O-N 2.98Å; F249-N251 PolarHBondContact O-N 3.03Å; N251-N254 PolarHBondContact O-N 2.78Å; N251-C255 PolarHBondContact O-N 3.39Å; N251-C255 PolarHBondContact O-SG 3.14Å |
| 252 | D | 37.8 | Very low | 34.6 | Very low | 63 Ų | 63 | 94.6 Ų | 94.6 | 34% | 0.337 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -76.3 | -34.9 | -180 | -80.9 | -7.4 | 0 | 0 | 0 | 112.6 | F248 N254 C255 V256 | F248-D252 VanDerWaalsContact CD1-OD2 3.26Å; F248-D252 WeakPolarHBondContact CD1-OD2 3.38Å; F248-D252 WeakPolarHBondContact CE1-OD2 3.31Å; F248-D252 WeakPolarHBondContact O-CB 3.09Å; F248-D252 PolarHBondContact O-N 3.28Å; D252-N254 VanDerWaalsContact C-N 3.26Å; D252-N254 PolarHBondContact O-N 3.31Å; D252-C255 CarbonylContact O-C 3.46Å; D252-C255 WeakPolarHBondContact O-CA 3.27Å; D252-C255 VanDerWaalsContact O-CB 3.27Å; D252-C255 WeakPolarHBondContact O-CB 3.38Å; D252-C255 PolarHBondContact O-N 3.43Å; D252-V256 WeakPolarHBondContact O-CG2 3.11Å; D252-V256 PolarHBondContact O-N 3.03Å |
| 253 | F | 36.3 | Very low | 34.4 | Very low | 62 Ų | 62 | 93.3 Ų | 93.3 | 27% | 0.272 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.3 | -35.1 | 171.9 | -103.4 | -95.8 | 0 | 0 | 0 | 111.6 | V221 V231 F249 C255 V256 L257 | V221-F253 HydrophobicContact CG2-CE2 4.42Å; V221-F253 HydrophobicContact CG2-CZ 4.39Å; V231-F253 HydrophobicContact CG1-CE1 4.04Å; V231-F253 HydrophobicContact CG1-CZ 4.41Å; F249-F253 HydrophobicContact CD1-CD2 4.17Å; F249-F253 HydrophobicContact CD1-CE2 4.14Å; F249-F253 WeakPolarHBondContact O-CA 3.29Å; F249-F253 WeakPolarHBondContact O-CB 3.34Å; F249-F253 PolarHBondContact O-N 2.98Å; F253-C255 PolarHBondContact O-N 2.74Å; F253-V256 PolarHBondContact O-N 2.97Å; F253-V256 VanDerWaalsContact O-N 3.13Å; F253-L257 WeakPolarHBondContact O-CB 3.45Å; F253-L257 PolarHBondContact O-N 3.46Å |
| 254 | N | 32.5 | Very low | 33.8 | Very low | 94 Ų | 94 | 87.1 Ų | 87.1 | 50% | 0.503 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -65.9 | -22 | 172 | -81.3 | -46.6 | 0 | 0 | 0 | 112.5 | Y250 N251 D252 P258 | Y250-N254 WeakPolarHBondContact O-CB 3.32Å; Y250-N254 PolarHBondContact O-N 3.27Å; Y250-N254 PolarHBondContact O-ND2 3.37Å; N251-N254 PolarHBondContact O-N 2.78Å; D252-N254 VanDerWaalsContact C-N 3.26Å; D252-N254 PolarHBondContact O-N 3.31Å; N254-P258 WeakPolarHBondContact O-CD 3.48Å; N254-P258 VanDerWaalsContact O-CG 3.28Å; N254-P258 WeakPolarHBondContact O-CG 3.4Å |
| 255 | C | 32.2 | Very low | 33.2 | Very low | 84 Ų | 84 | 81.5 Ų | 81.5 | 57% | 0.568 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -82.6 | -31.6 | 169.6 | -65.1 | 0 | 0 | 0 | 0 | 112.6 | N251 D252 F253 | N251-C255 PolarHBondContact O-N 3.39Å; N251-C255 PolarHBondContact O-SG 3.14Å; D252-C255 CarbonylContact O-C 3.46Å; D252-C255 WeakPolarHBondContact O-CA 3.27Å; D252-C255 VanDerWaalsContact O-CB 3.27Å; D252-C255 WeakPolarHBondContact O-CB 3.38Å; D252-C255 PolarHBondContact O-N 3.43Å; F253-C255 PolarHBondContact O-N 2.74Å |
| 256 | V | 33.1 | Very low | 32.8 | Very low | 38 Ų | 38 | 88.4 Ų | 88.4 | 23% | 0.23 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -82 | -37.1 | -179.3 | 176.2 | 0 | 0 | 0 | 0 | 112.2 | D252 F253 L259 V260 | D252-V256 WeakPolarHBondContact O-CG2 3.11Å; D252-V256 PolarHBondContact O-N 3.03Å; F253-V256 PolarHBondContact O-N 2.97Å; F253-V256 VanDerWaalsContact O-N 3.13Å; V256-L259 CarbonylContact O-C 3.54Å; V256-L259 WeakPolarHBondContact O-CA 3.21Å; V256-L259 VanDerWaalsContact O-CB 3.28Å; V256-L259 WeakPolarHBondContact O-CB 3.36Å; V256-L259 PolarHBondContact O-N 3.43Å; V256-V260 HydrophobicContact CG1-CG2 3.67Å; V256-V260 WeakPolarHBondContact O-CG2 3.36Å; V256-V260 PolarHBondContact O-N 2.9Å |
| 257 | L | 30.3 | Very low | 32.4 | Very low | 85 Ų | 85 | 91.5 Ų | 91.5 | 45% | 0.445 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -52.7 | -46.7 | 177.7 | -103 | 140.2 | 0 | 0 | 0 | 113.1 | F253 L259 V260 N261 | F253-L257 WeakPolarHBondContact O-CB 3.45Å; F253-L257 PolarHBondContact O-N 3.46Å; L257-L259 VanDerWaalsContact C-N 3.28Å; L257-L259 PolarHBondContact O-N 3.33Å; L257-V260 PolarHBondContact O-N 2.79Å; L257-N261 WeakPolarHBondContact O-CB 3.37Å; L257-N261 PolarHBondContact O-N 3.18Å |
| 258 | P | 29.8 | Very low | 31.6 | Very low | 74 Ų | 74 | 86.8 Ų | 86.8 | 48% | 0.481 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.2 | -34 | 173.3 | -21.8 | 31.5 | 0 | 0 | 0 | 113.4 | N254 R262 | N254-P258 WeakPolarHBondContact O-CD 3.48Å; N254-P258 VanDerWaalsContact O-CG 3.28Å; N254-P258 WeakPolarHBondContact O-CG 3.4Å; P258-R262 WeakPolarHBondContact O-CB 3.34Å; P258-R262 PolarHBondContact O-N 2.99Å |
| 259 | L | 31.4 | Very low | 30.8 | Very low | 97 Ų | 97 | 89.3 Ų | 89.3 | 51% | 0.508 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -72.4 | -40 | -179.3 | -134.4 | 130.2 | 0 | 0 | 0 | 110.7 | V256 L257 R262 I263 | V256-L259 CarbonylContact O-C 3.54Å; V256-L259 WeakPolarHBondContact O-CA 3.21Å; V256-L259 VanDerWaalsContact O-CB 3.28Å; V256-L259 WeakPolarHBondContact O-CB 3.36Å; V256-L259 PolarHBondContact O-N 3.43Å; L257-L259 VanDerWaalsContact C-N 3.28Å; L257-L259 PolarHBondContact O-N 3.33Å; L259-R262 PolarHBondContact O-N 2.82Å; L259-I263 HydrophobicContact CD2-CD1 4.09Å; L259-I263 VanDerWaalsContact O-CG1 3.27Å; L259-I263 WeakPolarHBondContact O-CG1 3.27Å; L259-I263 PolarHBondContact O-N 3.18Å |
| 260 | V | 30.7 | Very low | 30.4 | Very low | 24 Ų | 24 | 94.6 Ų | 94.6 | 15% | 0.145 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -67.1 | -47.8 | 174.1 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | F228 V256 L257 R262 I263 E264 | F228-V260 HydrophobicContact CE1-CG1 3.96Å; F228-V260 HydrophobicContact CE2-CG1 4.02Å; F228-V260 HydrophobicContact CZ-CG1 3.21Å; V256-V260 HydrophobicContact CG1-CG2 3.67Å; V256-V260 WeakPolarHBondContact O-CG2 3.36Å; V256-V260 PolarHBondContact O-N 2.9Å; L257-V260 PolarHBondContact O-N 2.79Å; V260-R262 PolarHBondContact O-N 3.05Å; V260-I263 PolarHBondContact O-N 3.13Å; V260-I263 VanDerWaalsContact O-N 3.08Å; V260-E264 WeakPolarHBondContact O-CB 3.35Å; V260-E264 PolarHBondContact O-N 2.82Å |
| 261 | N | 27.4 | Very low | 29.8 | Very low | 91 Ų | 91 | 92.5 Ų | 92.5 | 49% | 0.487 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59 | -31.5 | 174.1 | -74.4 | -11.7 | 0 | 0 | 0 | 112.3 | L257 A265 | L257-N261 WeakPolarHBondContact O-CB 3.37Å; L257-N261 PolarHBondContact O-N 3.18Å; N261-A265 VanDerWaalsContact O-CB 3.32Å; N261-A265 WeakPolarHBondContact O-CB 3.13Å; N261-A265 PolarHBondContact O-N 2.98Å |
| 262 | R | 30.1 | Very low | 29.1 | Very low | 165 Ų | 165 | 94.2 Ų | 94.2 | 62% | 0.623 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -74.1 | -38.7 | 174.5 | -108.9 | -180 | 172.7 | 175.8 | -3.4 | 113.2 | P258 L259 V260 R266 | P258-R262 WeakPolarHBondContact O-CB 3.34Å; P258-R262 PolarHBondContact O-N 2.99Å; L259-R262 PolarHBondContact O-N 2.82Å; V260-R262 PolarHBondContact O-N 3.05Å; R262-R266 WeakPolarHBondContact O-CG 3.22Å; R262-R266 PolarHBondContact O-N 2.79Å |
| 263 | I | 33.2 | Very low | 28.9 | Very low | 79 Ų | 79 | 102.6 Ų | 102.6 | 41% | 0.405 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -69.3 | -41.6 | 176.3 | -68.5 | 164.5 | 0 | 0 | 0 | 109.5 | L259 V260 R266 S267 | L259-I263 HydrophobicContact CD2-CD1 4.09Å; L259-I263 VanDerWaalsContact O-CG1 3.27Å; L259-I263 WeakPolarHBondContact O-CG1 3.27Å; L259-I263 PolarHBondContact O-N 3.18Å; V260-I263 PolarHBondContact O-N 3.13Å; V260-I263 VanDerWaalsContact O-N 3.08Å; I263-R266 CarbonylContact O-C 3.6Å; I263-R266 PolarHBondContact O-N 3.02Å; I263-R266 VanDerWaalsContact O-N 3.15Å; I263-S267 WeakPolarHBondContact O-CB 3.49Å; I263-S267 PolarHBondContact O-N 3.42Å |
| 264 | E | 25.9 | Very low | 28.5 | Very low | 90 Ų | 90 | 104.6 Ų | 104.6 | 42% | 0.421 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63 | -43 | 175.5 | -158.3 | 177.7 | -160.7 | 0 | 0 | 111 | V260 R266 S267 I268 | V260-E264 WeakPolarHBondContact O-CB 3.35Å; V260-E264 PolarHBondContact O-N 2.82Å; E264-R266 VanDerWaalsContact C-N 3.31Å; E264-R266 PolarHBondContact O-N 3Å; E264-S267 PolarHBondContact O-N 2.77Å; E264-I268 HydrophobicContact CG-CD1 4.02Å; E264-I268 WeakPolarHBondContact O-CB 3.48Å; E264-I268 VanDerWaalsContact O-CG1 3.25Å; E264-I268 WeakPolarHBondContact O-CG1 3.45Å; E264-I268 PolarHBondContact O-N 3.29Å |
| 265 | A | 24.9 | Very low | 28.3 | Very low | 54 Ų | 54 | 105.2 Ų | 105.2 | 45% | 0.446 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.4 | -38.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | N261 Q269 | N261-A265 VanDerWaalsContact O-CB 3.32Å; N261-A265 WeakPolarHBondContact O-CB 3.13Å; N261-A265 PolarHBondContact O-N 2.98Å; A265-Q269 WeakPolarHBondContact O-CB 3.39Å; A265-Q269 VanDerWaalsContact O-CG 3.32Å; A265-Q269 WeakPolarHBondContact O-CG 3.44Å; A265-Q269 PolarHBondContact O-N 3.09Å |
| 266 | R | 28.2 | Very low | 28.1 | Very low | 192 Ų | 192 | 106.3 Ų | 106.3 | 73% | 0.725 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -72.3 | -37.1 | 175.1 | -76.9 | -176 | 176.8 | -174 | -0.1 | 112.5 | R262 I263 E264 Q269 H270 | R262-R266 WeakPolarHBondContact O-CG 3.22Å; R262-R266 PolarHBondContact O-N 2.79Å; I263-R266 CarbonylContact O-C 3.6Å; I263-R266 PolarHBondContact O-N 3.02Å; I263-R266 VanDerWaalsContact O-N 3.15Å; E264-R266 VanDerWaalsContact C-N 3.31Å; E264-R266 PolarHBondContact O-N 3Å; R266-Q269 PolarHBondContact O-N 2.91Å; R266-H270 WeakPolarHBondContact O-CB 3.42Å; R266-H270 PolarHBondContact O-N 3.29Å |
| 267 | S | 26.6 | Very low | 27.8 | Very low | 75 Ų | 75 | 110.4 Ų | 110.4 | 52% | 0.524 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.5 | -43 | 177.8 | -167.6 | 0 | 0 | 0 | 0 | 111.2 | I263 E264 H270 A271 | I263-S267 WeakPolarHBondContact O-CB 3.49Å; I263-S267 PolarHBondContact O-N 3.42Å; E264-S267 PolarHBondContact O-N 2.77Å; S267-H270 PolarHBondContact O-N 2.99Å; S267-A271 WeakPolarHBondContact O-CB 3.28Å; S267-A271 PolarHBondContact O-N 2.81Å |
| 268 | I | 21.3 | Very low | 27.7 | Very low | 93 Ų | 93 | 111.9 Ų | 111.9 | 48% | 0.477 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.4 | -41.7 | 174 | -66.5 | 168 | 0 | 0 | 0 | 110.1 | E264 H270 A271 I272 | E264-I268 HydrophobicContact CG-CD1 4.02Å; E264-I268 WeakPolarHBondContact O-CB 3.48Å; E264-I268 VanDerWaalsContact O-CG1 3.25Å; E264-I268 WeakPolarHBondContact O-CG1 3.45Å; E264-I268 PolarHBondContact O-N 3.29Å; I268-H270 VanDerWaalsContact C-N 3.29Å; I268-H270 PolarHBondContact O-N 3.09Å; I268-A271 PolarHBondContact O-N 3.44Å; I268-I272 HydrophobicContact CG2-CD1 3.68Å; I268-I272 HydrophobicContact CG2-CG1 4.46Å; I268-I272 VanDerWaalsContact O-CG1 3.3Å; I268-I272 WeakPolarHBondContact O-CG1 3.32Å; I268-I272 PolarHBondContact O-N 3.28Å; I268-I272 VanDerWaalsContact O-N 3.13Å |
| 269 | Q | 21.7 | Very low | 27.5 | Very low | 146 Ų | 146 | 114.5 Ų | 114.5 | 68% | 0.682 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -64.8 | -31 | 175.2 | -82 | -166.6 | -15.9 | 0 | 0 | 113.8 | A265 R266 | A265-Q269 WeakPolarHBondContact O-CB 3.39Å; A265-Q269 VanDerWaalsContact O-CG 3.32Å; A265-Q269 WeakPolarHBondContact O-CG 3.44Å; A265-Q269 PolarHBondContact O-N 3.09Å; R266-Q269 PolarHBondContact O-N 2.91Å |
| 270 | H | 28.2 | Very low | 27.3 | Very low | 154 Ų | 154 | 115.7 Ų | 115.7 | 71% | 0.713 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -81.4 | -22.9 | 177.3 | -150.5 | -65.8 | 0 | 0 | 0 | 112.7 | R266 S267 I268 | R266-H270 WeakPolarHBondContact O-CB 3.42Å; R266-H270 PolarHBondContact O-N 3.29Å; S267-H270 PolarHBondContact O-N 2.99Å; I268-H270 VanDerWaalsContact C-N 3.29Å; I268-H270 PolarHBondContact O-N 3.09Å |
| 271 | A | 23.4 | Very low | 27 | Very low | 80 Ų | 80 | 122.8 Ų | 122.8 | 66% | 0.661 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -84.1 | -17 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | S267 I268 | S267-A271 WeakPolarHBondContact O-CB 3.28Å; S267-A271 PolarHBondContact O-N 2.81Å; I268-A271 PolarHBondContact O-N 3.44Å |
| 272 | I | 25.9 | Very low | 27 | Very low | 139 Ų | 139 | 125.4 Ų | 125.4 | 71% | 0.713 | 62% | 0.619 | S | S | * | * | trans | -89.2 | -7.1 | 176.5 | -67 | 170.1 | 0 | 0 | 0 | 112.2 | I268 | I268-I272 HydrophobicContact CG2-CD1 3.68Å; I268-I272 HydrophobicContact CG2-CG1 4.46Å; I268-I272 VanDerWaalsContact O-CG1 3.3Å; I268-I272 WeakPolarHBondContact O-CG1 3.32Å; I268-I272 PolarHBondContact O-N 3.28Å; I268-I272 VanDerWaalsContact O-N 3.13Å | ||
| 273 | K | 34.3 | Very low | 26.7 | Very low | 238 Ų | 238 | 121.8 Ų | 121.8 | 100% | 1.035 | 62% | 0.618 | S | S | * | * | trans | -96.2 | 0 | 170.1 | -78.6 | -172.6 | 177.2 | -177.5 | 0 | 110.9 |
Retrieved 273 of 273 residues in 60 ms
(Link to these results)