| 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 | 34.2 | Very low | 34.8 | Very low | 249 Ų | 249 | 137.4 Ų | 137.4 | 100% | 1.227 | 85% | 0.854 | S | S | * | * | 0 | 133.2 | 0 | -61.3 | 172.3 | -179.9 | 0 | 0 | 106.9 | |||||
| 2 | A | 35 | Very low | 34.3 | Very low | 97 Ų | 97 | 139.6 Ų | 139.6 | 80% | 0.802 | 86% | 0.856 | S | S | * | * | cis | -153.6 | 168.5 | -12.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 3 | N | 32.4 | Very low | 34 | Very low | 166 Ų | 166 | 137.3 Ų | 137.3 | 89% | 0.888 | 84% | 0.841 | S | S | * | * | trans | -78.1 | 158.2 | 176.8 | -55.2 | -36.7 | 0 | 0 | 0 | 111.8 | ||||
| 4 | A | 37.7 | Very low | 33.8 | Very low | 101 Ų | 101 | 137.2 Ų | 137.2 | 84% | 0.835 | 84% | 0.84 | S | S | * | * | trans | -159.7 | 123.4 | 146.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 5 | E | 35.9 | Very low | 33.7 | Very low | 187 Ų | 187 | 135.6 Ų | 135.6 | 87% | 0.874 | 83% | 0.83 | S | S | * | * | trans | -109.1 | 133.9 | 168.6 | -58.1 | 163.2 | 108.9 | 0 | 0 | 108.8 | ||||
| 6 | V | 33.5 | Very low | 33.6 | Very low | 141 Ų | 141 | 135.1 Ų | 135.1 | 86% | 0.855 | 83% | 0.826 | S | S | * | * | trans | -160 | 143.9 | 166 | -179.4 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 7 | S | 28.3 | Very low | 34.1 | Very low | 103 Ų | 103 | 133.3 Ų | 133.3 | 72% | 0.72 | 82% | 0.818 | S | S | * | * | cis | -167.2 | 155.6 | -34.1 | -87.8 | 0 | 0 | 0 | 0 | 107 | ||||
| 8 | V | 32.5 | Very low | 34 | Very low | 137 Ų | 137 | 133.7 Ų | 133.7 | 83% | 0.83 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -99.3 | 137.2 | 173.8 | -179.7 | 0 | 0 | 0 | 0 | 110.6 | ||
| 9 | P | 48.4 | Very low | 33.9 | Very low | 117 Ų | 117 | 136.8 Ų | 136.8 | 76% | 0.76 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -99 | 142.6 | 161 | 35.1 | -28.7 | 0 | 0 | 0 | 112 | ||
| 10 | V | 32.9 | Very low | 33.7 | Very low | 139 Ų | 139 | 133.8 Ų | 133.8 | 84% | 0.842 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 151.6 | 173.8 | 175.1 | 0 | 0 | 0 | 0 | 110.1 | ||
| 11 | G | 31.7 | Very low | 33.5 | Very low | 74 Ų | 74 | 135 Ų | 135 | 76% | 0.763 | 82% | 0.823 | S | S | * | * | trans | -132.2 | 148.2 | 172 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 12 | D | 29.2 | Very low | 33.5 | Very low | 164 Ų | 164 | 131.7 Ų | 131.7 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | trans | -97.3 | 168.4 | -145.5 | -125.8 | -39.8 | 0 | 0 | 0 | 117.9 | ||||
| 13 | V | 30.2 | Very low | 33.3 | Very low | 110 Ų | 110 | 130.4 Ų | 130.4 | 67% | 0.667 | 80% | 0.801 | S | S | * | * | trans | -79.6 | 145.3 | -177.6 | 173.2 | 0 | 0 | 0 | 0 | 112.8 | V15 | V13-V15 HydrophobicContact CG1-CG2 3.79Š| ||
| 14 | V | 30.8 | Very low | 33.2 | Very low | 136 Ų | 136 | 132.3 Ų | 132.3 | 82% | 0.824 | 81% | 0.805 | S | S | * | * | trans | -130.8 | 125.6 | 153.9 | -179.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 15 | V | 33.1 | Very low | 33 | Very low | 113 Ų | 113 | 133 Ų | 133 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | trans | -113.2 | 138.1 | 172.6 | 172.8 | 0 | 0 | 0 | 0 | 108.9 | V13 | V13-V15 HydrophobicContact CG1-CG2 3.79Š| ||
| 16 | V | 32.2 | Very low | 33.1 | Very low | 128 Ų | 128 | 130.2 Ų | 130.2 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | trans | -132.4 | 117.2 | 160.6 | -179.4 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 17 | P | 41.4 | Very low | 33.2 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 68% | 0.675 | 79% | 0.786 | S | S | * | * | trans | -90.4 | 163.6 | 176.8 | 36.7 | -33.7 | 0 | 0 | 0 | 111.6 | ||||
| 18 | T | 33.4 | Very low | 33.8 | Very low | 140 Ų | 140 | 132.5 Ų | 132.5 | 86% | 0.859 | 79% | 0.787 | S | S | * | * | trans | -131 | 135.6 | 154.6 | 48.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 19 | E | 31.8 | Very low | 34 | Very low | 194 Ų | 194 | 132.3 Ų | 132.3 | 91% | 0.907 | 79% | 0.786 | S | S | * | * | trans | -67.4 | 160.3 | -179.7 | -62.4 | 159.3 | -172.3 | 0 | 0 | 110.6 | ||||
| 20 | G | 30.1 | Very low | 33.4 | Very low | 75 Ų | 75 | 134.9 Ų | 134.9 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | cis | 133.6 | 114.7 | 5.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 21 | N | 28.8 | Very low | 33.5 | Very low | 160 Ų | 160 | 134.1 Ų | 134.1 | 86% | 0.856 | 78% | 0.781 | S | S | * | * | trans | -151.7 | 153 | 166.7 | -168.8 | 45 | 0 | 0 | 0 | 110 | ||||
| 22 | E | 34.8 | Very low | 33.6 | Very low | 180 Ų | 180 | 137.8 Ų | 137.8 | 84% | 0.841 | 78% | 0.778 | S | S | * | * | trans | -95.8 | 157.4 | -164.2 | -55.8 | 170.2 | 113.9 | 0 | 0 | 112.7 | ||||
| 23 | G | 29.5 | Very low | 33.8 | Very low | 69 Ų | 69 | 135.9 Ų | 135.9 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | trans | 162.2 | 96.1 | 168.3 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 24 | E | 30.7 | Very low | 34 | Very low | 207 Ų | 207 | 137.1 Ų | 137.1 | 97% | 0.967 | 77% | 0.774 | S | S | * | * | trans | 72.6 | 174.5 | 144.4 | -54.7 | -165.1 | 109.2 | 0 | 0 | 121.4 | ||||
| 25 | N | 33.3 | Very low | 34 | Very low | 115 Ų | 115 | 138 Ų | 138 | 62% | 0.615 | 77% | 0.773 | S | S | * | * | trans | -104.4 | 135.9 | -146.8 | 179.6 | 40.8 | 0 | 0 | 0 | 113.7 | E27 | N25-E27 PolarHBondContact ND2-OE2 3.04Å; N25-E27 VanDerWaalsContact ND2-OE2 3.07Å; N25-E27 PolarHBondContact O-N 3.32Å | ||
| 26 | P | 38.1 | Very low | 33.9 | Very low | 129 Ų | 129 | 140.4 Ų | 140.4 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | trans | -85.1 | 87.5 | 173.9 | 34 | -34.5 | 0 | 0 | 0 | 112.2 | ||||
| 27 | E | 35.2 | Very low | 33.9 | Very low | 153 Ų | 153 | 142.3 Ų | 142.3 | 72% | 0.715 | 78% | 0.782 | S | S | * | * | trans | -119.7 | 141.7 | 174.5 | -154.8 | 160.9 | -170.6 | 0 | 0 | 111.7 | N25 | N25-E27 PolarHBondContact ND2-OE2 3.04Å; N25-E27 VanDerWaalsContact ND2-OE2 3.07Å; N25-E27 PolarHBondContact O-N 3.32Å | ||
| 28 | D | 41.7 | Very low | 33.5 | Very low | 139 Ų | 139 | 145.7 Ų | 145.7 | 74% | 0.743 | 79% | 0.789 | S | S | * | * | trans | 47.9 | 85.8 | 176.6 | -88.3 | -38.6 | 0 | 0 | 0 | 120.1 | ||||
| 29 | T | 37 | Very low | 33.4 | Very low | 132 Ų | 132 | 144.8 Ų | 144.8 | 81% | 0.81 | 79% | 0.785 | S | S | * | * | trans | -120.4 | 68.1 | 147.5 | 62.8 | 0 | 0 | 0 | 0 | 111.5 | T31 | T29-T31 VanDerWaalsContact C-N 3.32Å; T29-T31 PolarHBondContact O-N 3.23Å | ||
| 30 | K | 34.4 | Very low | 33.4 | Very low | 172 Ų | 172 | 142.4 Ų | 142.4 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | -78.2 | 72.9 | 178.5 | -171 | 178.6 | 178.8 | 175 | 0 | 112.2 | Q32 | K30-Q32 PolarHBondContact O-N 3.46Š| ||
| 31 | T | 36.8 | Very low | 33.4 | Very low | 122 Ų | 122 | 147.5 Ų | 147.5 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | trans | -67.1 | 103.8 | 180 | -42.1 | 0 | 0 | 0 | 0 | 111.4 | T29 V33 | T29-T31 VanDerWaalsContact C-N 3.32Å; T29-T31 PolarHBondContact O-N 3.23Å; T31-V33 PolarHBondContact O-N 3.12Å | ||
| 32 | Q | 32.9 | Very low | 33.5 | Very low | 152 Ų | 152 | 149 Ų | 149 | 71% | 0.71 | 79% | 0.789 | S | S | * | * | trans | -74.1 | 119.2 | 174.9 | -64.8 | -173.3 | 15.5 | 0 | 0 | 110.6 | K30 I34 | K30-Q32 PolarHBondContact O-N 3.46Å; Q32-I34 PolarHBondContact O-N 3.22Å | ||
| 33 | V | 34.3 | Very low | 33.4 | Very low | 124 Ų | 124 | 144 Ų | 144 | 75% | 0.752 | 79% | 0.786 | S | S | * | * | trans | -87.3 | 101.9 | 174.9 | -178.9 | 0 | 0 | 0 | 0 | 109.4 | T31 L35 | T31-V33 PolarHBondContact O-N 3.12Å; V33-L35 HydrophobicContact CG1-CG 4.45Å | ||
| 34 | I | 34.6 | Very low | 33.5 | Very low | 136 Ų | 136 | 148.9 Ų | 148.9 | 70% | 0.697 | 80% | 0.795 | S | S | * | * | trans | -90.6 | 107.1 | 173.7 | -59.7 | 177.5 | 0 | 0 | 0 | 108.7 | Q32 Q36 | Q32-I34 PolarHBondContact O-N 3.22Å; I34-Q36 PolarHBondContact O-N 3.2Å | ||
| 35 | L | 30.1 | Very low | 33.5 | Very low | 155 Ų | 155 | 147.3 Ų | 147.3 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | trans | -78.9 | 80.3 | 175.5 | -79.1 | 168.1 | 0 | 0 | 0 | 111.1 | V33 L37 | V33-L35 HydrophobicContact CG1-CG 4.45Å; L35-L37 PolarHBondContact O-N 3.42Å | ||
| 36 | Q | 30.7 | Very low | 33.7 | Very low | 163 Ų | 163 | 148 Ų | 148 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -84.5 | 98.2 | 174.4 | -168.9 | 169.3 | 7.2 | 0 | 0 | 110.7 | I34 Q38 | I34-Q36 PolarHBondContact O-N 3.2Å; Q36-Q38 PolarHBondContact O-N 3.03Å | ||
| 37 | L | 33.2 | Very low | 33.5 | Very low | 168 Ų | 168 | 148.9 Ų | 148.9 | 88% | 0.88 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 118.5 | 176.4 | -68.9 | 167.7 | 0 | 0 | 0 | 110.9 | L35 | L35-L37 PolarHBondContact O-N 3.42Š|
| 38 | Q | 31.5 | Very low | 33.8 | Very low | 175 Ų | 175 | 144.3 Ų | 144.3 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 144.3 | 166.5 | -72.3 | -171.8 | -37.2 | 0 | 0 | 110.8 | Q36 | Q36-Q38 PolarHBondContact O-N 3.03Š|
| 39 | P | 30.8 | Very low | 33.3 | Very low | 120 Ų | 120 | 144.8 Ų | 144.8 | 78% | 0.779 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 134.3 | 172.6 | 30 | -33.9 | 0 | 0 | 0 | 110.8 | Q41 | P39-Q41 PolarHBondContact O-N 3.23Š|
| 40 | V | 32.2 | Very low | 33.2 | Very low | 144 Ų | 144 | 147 Ų | 147 | 87% | 0.873 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 121.9 | 178.4 | 179.4 | 0 | 0 | 0 | 0 | 109.8 | ||
| 41 | Q | 31.6 | Very low | 33.1 | Very low | 182 Ų | 182 | 149 Ų | 149 | 85% | 0.85 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 142 | 172.6 | -67.7 | -177 | -7.6 | 0 | 0 | 110.8 | P39 | P39-Q41 PolarHBondContact O-N 3.23Š|
| 42 | Q | 30.9 | Very low | 32.9 | Very low | 192 Ų | 192 | 149.6 Ų | 149.6 | 90% | 0.897 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -74 | 140.1 | -179.5 | -68.3 | 159.9 | -36.7 | 0 | 0 | 111 | ||
| 43 | G | 32.5 | Very low | 32.8 | Very low | 76 Ų | 76 | 152.1 Ų | 152.1 | 78% | 0.784 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -70 | 136.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 44 | L | 31.3 | Very low | 32.7 | Very low | 171 Ų | 171 | 153.3 Ų | 153.3 | 90% | 0.895 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -74 | 141.3 | 175.5 | -82.7 | 161.6 | 0 | 0 | 0 | 111.7 | ||
| 45 | F | 30.2 | Very low | 32.5 | Very low | 173 Ų | 173 | 156.4 Ų | 156.4 | 76% | 0.759 | 79% | 0.786 | S | S | * | * | trans | -108.8 | 121.6 | -179.5 | -159.7 | -88.7 | 0 | 0 | 0 | 109.9 | ||||
| 46 | I | 37.5 | Very low | 32.5 | Very low | 130 Ų | 130 | 158 Ų | 158 | 67% | 0.667 | 79% | 0.79 | S | S | * | * | trans | -139.7 | 128.8 | 174.6 | -53.1 | 179.8 | 0 | 0 | 0 | 107.9 | G48 | I46-G48 VanDerWaalsContact C-N 3.34Å; I46-G48 PolarHBondContact O-N 3.38Å; I46-G48 VanDerWaalsContact O-N 3.1Å | ||
| 47 | D | 33.3 | Very low | 32.7 | Very low | 147 Ų | 147 | 155.3 Ų | 155.3 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 42 | 46.9 | 169.3 | -61.4 | -9.1 | 0 | 0 | 0 | 117 | H49 | D47-H49 PolarHBondContact O-CD2 3.38Å; D47-H49 PolarHBondContact O-N 2.95Å |
| 48 | G | 42.1 | Very low | 32.5 | Very low | 57 Ų | 57 | 150.7 Ų | 150.7 | 59% | 0.588 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.2 | -0.9 | 156 | 0 | 0 | 0 | 0 | 0 | 117.9 | I46 | I46-G48 VanDerWaalsContact C-N 3.34Å; I46-G48 PolarHBondContact O-N 3.38Å; I46-G48 VanDerWaalsContact O-N 3.1Å |
| 49 | H | 31.9 | Very low | 32.3 | Very low | 149 Ų | 149 | 147.9 Ų | 147.9 | 69% | 0.69 | 79% | 0.788 | S | S | * | * | trans | -121 | 116.7 | -176.7 | -71.8 | -73.8 | 0 | 0 | 0 | 113 | D47 Y51 | D47-H49 PolarHBondContact O-CD2 3.38Å; D47-H49 PolarHBondContact O-N 2.95Å; H49-Y51 HydrophobicContact CB-CE2 4.19Å; H49-Y51 PolarHBondContact O-N 2.86Å | ||
| 50 | F | 35.1 | Very low | 32.8 | Very low | 179 Ų | 179 | 151 Ų | 151 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | -85.5 | 100.2 | 179.9 | -153.8 | -85.4 | 0 | 0 | 0 | 111.3 | N52 | F50-N52 PolarHBondContact O-N 3.43Š| ||
| 51 | Y | 32.1 | Very low | 32.7 | Very low | 213 Ų | 213 | 151.1 Ų | 151.1 | 84% | 0.835 | 79% | 0.787 | S | S | * | * | trans | -79.5 | 97.6 | 179 | -80.5 | -86.2 | 0 | 0 | 0 | 112.2 | H49 R53 | H49-Y51 HydrophobicContact CB-CE2 4.19Å; H49-Y51 PolarHBondContact O-N 2.86Å; Y51-R53 PolarHBondContact O-N 2.89Å | ||
| 52 | N | 33.3 | Very low | 33 | Very low | 135 Ų | 135 | 150 Ų | 150 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | trans | -68.5 | 114.9 | 165.7 | -110.2 | -37.3 | 0 | 0 | 0 | 110.2 | F50 I54 | F50-N52 PolarHBondContact O-N 3.43Å; N52-I54 PolarHBondContact O-N 2.92Å | ||
| 53 | R | 29.7 | Very low | 33 | Very low | 206 Ų | 206 | 146.9 Ų | 146.9 | 78% | 0.777 | 78% | 0.782 | S | S | * | * | trans | -77.4 | 90.3 | 169.5 | -176.9 | 178.1 | -70.6 | -178.7 | -3.4 | 109.3 | Y51 Y55 | Y51-R53 PolarHBondContact O-N 2.89Å; R53-Y55 HydrophobicContact CG-CD2 4.25Å; R53-Y55 HydrophobicContact CG-CE2 4.23Å; R53-Y55 PolarHBondContact O-N 3.25Å | ||
| 54 | I | 33.2 | Very low | 33 | Very low | 148 Ų | 148 | 147.7 Ų | 147.7 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | trans | -59.2 | 125.5 | 167.9 | -57.9 | 173.7 | 0 | 0 | 0 | 108.3 | N52 | N52-I54 PolarHBondContact O-N 2.92Š| ||
| 55 | Y | 30.3 | Very low | 33.1 | Very low | 201 Ų | 201 | 146 Ų | 146 | 79% | 0.788 | 78% | 0.777 | S | S | * | * | trans | -114.6 | 142.4 | 155.2 | -95 | -65.6 | 0 | 0 | 0 | 108.6 | R53 | R53-Y55 HydrophobicContact CG-CD2 4.25Å; R53-Y55 HydrophobicContact CG-CE2 4.23Å; R53-Y55 PolarHBondContact O-N 3.25Å | ||
| 56 | E | 28.5 | Very low | 33.5 | Very low | 190 Ų | 190 | 142.6 Ų | 142.6 | 89% | 0.888 | 77% | 0.77 | S | S | * | * | trans | -79.3 | 156.5 | -171.2 | -159.4 | 165.8 | -169.9 | 0 | 0 | 111.7 | ||||
| 57 | A | 35.1 | Very low | 33.3 | Very low | 106 Ų | 106 | 140.6 Ų | 140.6 | 88% | 0.876 | 77% | 0.773 | S | S | * | * | trans | -73.4 | 137.4 | -169 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 58 | G | 29.7 | Very low | 33.6 | Very low | 70 Ų | 70 | 137.3 Ų | 137.3 | 72% | 0.722 | 76% | 0.758 | S | S | * | * | trans | -173 | 145.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 59 | S | 27.9 | Very low | 33.4 | Very low | 117 Ų | 117 | 141.5 Ų | 141.5 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | 76 | 149.1 | -178.7 | -155.2 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 60 | E | 40.5 | Very low | 33.7 | Very low | 186 Ų | 186 | 138.9 Ų | 138.9 | 87% | 0.869 | 76% | 0.757 | S | S | * | * | trans | -126 | 98.1 | -162.7 | -62.3 | 171.6 | -140.9 | 0 | 0 | 110.7 | ||||
| 61 | N | 30.9 | Very low | 34 | Very low | 145 Ų | 145 | 134.9 Ų | 134.9 | 78% | 0.775 | 74% | 0.741 | S | S | * | * | trans | -166.1 | 167.3 | 161.8 | 38.3 | 73.8 | 0 | 0 | 0 | 112.8 | ||||
| 62 | N | 37.2 | Very low | 34.4 | Very low | 160 Ų | 160 | 129.9 Ų | 129.9 | 86% | 0.856 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -81 | 118.7 | -167.5 | -59.3 | -52.1 | 0 | 0 | 0 | 113 | ||
| 63 | T | 32.1 | Very low | 34.8 | Very low | 126 Ų | 126 | 128.3 Ų | 128.3 | 77% | 0.773 | 72% | 0.723 | S | S | * | * | 175.6 | 97.8 | 126 | -72.7 | 0 | 0 | 0 | 0 | 109.6 | V65 | T63-V65 HydrophobicContact CG2-CG2 4.21Š| |||
| 64 | A | 30.8 | Very low | 35.3 | Very low | 92 Ų | 92 | 124.6 Ų | 124.6 | 76% | 0.76 | 71% | 0.714 | S | S | * | * | trans | -91.3 | 105.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | V66 | A64-V66 PolarHBondContact O-N 3.44Š| ||
| 65 | V | 34.2 | Very low | 35.6 | Very low | 137 Ų | 137 | 125.3 Ų | 125.3 | 83% | 0.83 | 71% | 0.712 | S | S | * | * | trans | -77.5 | 97.5 | 169.4 | -178.6 | 0 | 0 | 0 | 0 | 108.2 | T63 A67 | T63-V65 HydrophobicContact CG2-CG2 4.21Å; V65-A67 PolarHBondContact O-N 3.3Å | ||
| 66 | V | 37.8 | Very low | 35.9 | Very low | 100 Ų | 100 | 124.2 Ų | 124.2 | 61% | 0.606 | 72% | 0.718 | S | S | * | * | trans | -79.4 | 108 | 178.6 | -178.3 | 0 | 0 | 0 | 0 | 109.4 | A64 | A64-V66 PolarHBondContact O-N 3.44Š| ||
| 67 | A | 34.6 | Very low | 36.5 | Very low | 88 Ų | 88 | 121.5 Ų | 121.5 | 73% | 0.727 | 71% | 0.705 | S | S | * | * | trans | -66.2 | 135 | 166.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | V65 E69 | V65-A67 PolarHBondContact O-N 3.3Å; A67-E69 PolarHBondContact O-N 2.94Å | ||
| 68 | V | 39.2 | Very low | 36.6 | Very low | 79 Ų | 79 | 125.8 Ų | 125.8 | 48% | 0.479 | 71% | 0.707 | S | S | . | * | trans | -81.1 | 110.6 | 174.7 | 176.4 | 0 | 0 | 0 | 0 | 108.6 | T70 Y95 M159 | V68-T70 PolarHBondContact O-N 3.37Å; V68-Y95 HydrophobicContact CG1-CD1 4.32Å; V68-Y95 HydrophobicContact CG1-CE1 4.23Å; V68-M159 HydrophobicContact CG2-CE 4.27Å | ||
| 69 | E | 37.6 | Very low | 37.2 | Very low | 144 Ų | 144 | 125.9 Ų | 125.9 | 67% | 0.673 | 71% | 0.708 | S | S | * | * | trans | -77.4 | 86.2 | -176.5 | -164.3 | 176.1 | -151.8 | 0 | 0 | 111.5 | A67 H71 | A67-E69 PolarHBondContact O-N 2.94Å; E69-H71 VanDerWaalsContact CD-CE1 3.49Å; E69-H71 PolarHBondContact O-N 2.75Å; E69-H71 VanDerWaalsContact O-N 3.14Å; E69-H71 PolarHBondContact O-ND1 2.85Å; E69-H71 IonicContact OE2-CE1 3.14Å; E69-H71 PolarHBondContact OE2-CE1 3.35Å | ||
| 70 | T | 37.8 | Very low | 37.8 | Very low | 95 Ų | 95 | 128.5 Ų | 128.5 | 58% | 0.583 | 71% | 0.711 | S | S | * | * | trans | -67.4 | 105 | 174.6 | 50.7 | 0 | 0 | 0 | 0 | 110.6 | V68 T72 Y95 | V68-T70 PolarHBondContact O-N 3.37Å; T70-T72 PolarHBondContact O-N 2.93Å; T70-Y95 HydrophobicContact CG2-CE1 4.2Å | ||
| 71 | H | 42.7 | Very low | 37.3 | Very low | 94 Ų | 94 | 126.9 Ų | 126.9 | 44% | 0.435 | 71% | 0.709 | S | S | . | * | trans | -85.1 | 109.3 | 177.9 | -76 | 60.2 | 0 | 0 | 0 | 110.7 | E69 I73 | E69-H71 VanDerWaalsContact CD-CE1 3.49Å; E69-H71 PolarHBondContact O-N 2.75Å; E69-H71 VanDerWaalsContact O-N 3.14Å; E69-H71 PolarHBondContact O-ND1 2.85Å; E69-H71 IonicContact OE2-CE1 3.14Å; E69-H71 PolarHBondContact OE2-CE1 3.35Å; H71-I73 PolarHBondContact O-N 3.01Å | ||
| 72 | T | 39.8 | Very low | 38 | Very low | 109 Ų | 109 | 127.3 Ų | 127.3 | 67% | 0.669 | 72% | 0.717 | S | S | * | * | trans | -76.2 | 114.9 | 162.3 | 47.1 | 0 | 0 | 0 | 0 | 109.1 | T70 H74 | T70-T72 PolarHBondContact O-N 2.93Å; T72-H74 PolarHBondContact O-N 3.16Å; T72-H74 VanDerWaalsContact O-N 3.11Å | ||
| 73 | I | 41.3 | Very low | 38.1 | Very low | 101 Ų | 101 | 123.1 Ų | 123.1 | 52% | 0.518 | 71% | 0.711 | S | S | . | * | trans | -79.7 | 96.5 | -175.4 | -56.6 | 178.1 | 0 | 0 | 0 | 110.4 | H71 A94 I105 | H71-I73 PolarHBondContact O-N 3.01Å; I73-A94 HydrophobicContact CD1-CB 4.07Å; I73-I105 HydrophobicContact CD1-CD1 4.04Å; I73-I105 HydrophobicContact CD1-CG2 4.35Å | ||
| 74 | H | 40.5 | Very low | 38.7 | Very low | 129 Ų | 129 | 123.3 Ų | 123.3 | 60% | 0.597 | 71% | 0.712 | S | S | * | * | trans | -133.7 | 145.8 | 157.2 | -76 | -90.9 | 0 | 0 | 0 | 109.8 | T72 E89 | T72-H74 PolarHBondContact O-N 3.16Å; T72-H74 VanDerWaalsContact O-N 3.11Å; H74-E89 IonicContact CE1-OE1 2.79Å; H74-E89 PolarHBondContact CE1-OE1 2.87Å; H74-E89 IonicContact CE1-OE2 2.67Å; H74-E89 PolarHBondContact CE1-OE2 2.84Å | ||
| 75 | K | 39.7 | Very low | 39.2 | Very low | 163 Ų | 163 | 126.5 Ų | 126.5 | 71% | 0.709 | 72% | 0.715 | S | S | * | * | trans | 55.3 | 100.1 | -177.1 | -71.1 | -159.7 | 172.4 | -159 | 0 | 116.9 | E77 | K75-E77 HydrophobicContact CD-CG 4.46Å; K75-E77 WeakPolarHBondContact CE-OE1 3.41Å; K75-E77 IonicContact NZ-OE1 2.65Å; K75-E77 PolarHBondContact NZ-OE1 2.87Å | ||
| 76 | I | 36.7 | Very low | 39.3 | Very low | 178 Ų | 178 | 128.3 Ų | 128.3 | 91% | 0.913 | 71% | 0.714 | S | S | * | * | -116.8 | 140.7 | 113.1 | -60.7 | -178.2 | 0 | 0 | 0 | 106 | |||||
| 77 | E | 40.3 | Very low | 39.4 | Very low | 133 Ų | 133 | 128.5 Ų | 128.5 | 62% | 0.621 | 73% | 0.726 | S | S | * | * | trans | -80.9 | 164.3 | -174.9 | -73.7 | 167.3 | 162.3 | 0 | 0 | 110.3 | K75 | K75-E77 HydrophobicContact CD-CG 4.46Å; K75-E77 WeakPolarHBondContact CE-OE1 3.41Å; K75-E77 IonicContact NZ-OE1 2.65Å; K75-E77 PolarHBondContact NZ-OE1 2.87Å | ||
| 78 | E | 38.5 | Very low | 39.6 | Very low | 195 Ų | 195 | 131 Ų | 131 | 91% | 0.911 | 73% | 0.728 | S | S | * | * | cis | -144.8 | 143 | 42.8 | -58.3 | 176 | 124.8 | 0 | 0 | 115 | ||||
| 79 | G | 40.9 | Very low | 39.7 | Very low | 73 Ų | 73 | 134.4 Ų | 134.4 | 75% | 0.753 | 74% | 0.738 | S | S | * | * | trans | 68.4 | 97.2 | 139.6 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 80 | I | 40.1 | Very low | 40.2 | Very low | 171 Ų | 171 | 133 Ų | 133 | 88% | 0.877 | 74% | 0.735 | S | S | * | * | trans | -163.7 | 164.2 | 131.9 | -100.6 | 153.1 | 0 | 0 | 0 | 109.1 | ||||
| 81 | D | 31.6 | Very low | 40.9 | Very low | 153 Ų | 153 | 135 Ų | 135 | 82% | 0.818 | 74% | 0.74 | S | S | * | * | trans | -56.1 | 145.4 | -157.2 | -62.8 | -65.2 | 0 | 0 | 0 | 118.3 | G83 | D81-G83 PolarHBondContact O-N 2.96Š| ||
| 82 | T | 45.8 | Very low | 42.5 | Very low | 154 Ų | 154 | 134.4 Ų | 134.4 | 95% | 0.945 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -78.1 | 111.7 | 169.1 | -59.4 | 0 | 0 | 0 | 0 | 110.1 | ||
| 83 | G | 39.1 | Very low | 44.8 | Very low | 71 Ų | 71 | 132.3 Ų | 132.3 | 73% | 0.732 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -170.8 | -43.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | D81 | D81-G83 PolarHBondContact O-N 2.96Š|
| 84 | T | 43.3 | Very low | 47.2 | Very low | 131 Ų | 131 | 127.7 Ų | 127.7 | 80% | 0.804 | 70% | 0.698 | S | S | * | * | trans | -146.8 | 81.8 | -168 | -43.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 85 | I | 42.6 | Very low | 49.7 | Very low | 159 Ų | 159 | 123.1 Ų | 123.1 | 82% | 0.815 | 68% | 0.676 | S | S | * | * | trans | -130.4 | 125.2 | 157.6 | -62.4 | -177 | 0 | 0 | 0 | 107.4 | ||||
| 86 | E | 36.2 | Very low | 52.3 | Low | 174 Ų | 174 | 118.2 Ų | 118.2 | 81% | 0.813 | 66% | 0.661 | S | S | * | * | trans | -80.7 | 165.3 | -177.7 | -60.2 | 179.4 | 138.5 | 0 | 0 | 111.5 | N88 | E86-N88 PolarHBondContact O-N 3.19Š| ||
| 87 | A | 39.3 | Very low | 55.1 | Low | 104 Ų | 104 | 109.9 Ų | 109.9 | 86% | 0.86 | 62% | 0.618 | S | S | * | * | S | Bend | trans | -71.4 | 82.8 | -172.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 88 | N | 38.2 | Very low | 57.7 | Low | 142 Ų | 142 | 105.8 Ų | 105.8 | 76% | 0.759 | 60% | 0.602 | S | S | * | * | trans | -148.7 | 32.4 | 173.6 | -126.5 | -108.1 | 0 | 0 | 0 | 115.6 | E86 D90 | E86-N88 PolarHBondContact O-N 3.19Å; N88-D90 PolarHBondContact O-N 3.5Å | ||
| 89 | E | 42.8 | Very low | 60.4 | Low | 150 Ų | 150 | 96.5 Ų | 96.5 | 70% | 0.701 | 56% | 0.558 | S | S | * | * | trans | -76 | 75.1 | 166.8 | -69.6 | -167.6 | 125.3 | 0 | 0 | 110.8 | H74 M91 | H74-E89 IonicContact CE1-OE1 2.79Å; H74-E89 PolarHBondContact CE1-OE1 2.87Å; H74-E89 IonicContact CE1-OE2 2.67Å; H74-E89 PolarHBondContact CE1-OE2 2.84Å; E89-M91 VanDerWaalsContact C-N 3.3Å; E89-M91 PolarHBondContact O-N 3.43Å | ||
| 90 | D | 46.1 | Very low | 62.7 | Low | 114 Ų | 114 | 95.1 Ų | 95.1 | 61% | 0.61 | 54% | 0.544 | S | S | * | . | trans | -69.2 | 77.9 | -179 | 179.9 | 33.7 | 0 | 0 | 0 | 111.2 | N88 E92 K109 | N88-D90 PolarHBondContact O-N 3.5Å; D90-E92 PolarHBondContact O-N 2.88Å; D90-K109 VanDerWaalsContact C-NZ 3.31Å; D90-K109 PolarHBondContact O-NZ 3.45Å; D90-K109 IonicContact OD1-NZ 2.86Å; D90-K109 PolarHBondContact OD1-NZ 3.45Å; D90-K109 IonicContact OD2-NZ 2.7Å; D90-K109 PolarHBondContact OD2-NZ 2.64Å | ||
| 91 | M | 54.1 | Low | 65.1 | Low | 138 Ų | 138 | 95.6 Ų | 95.6 | 68% | 0.68 | 54% | 0.543 | S | S | * | . | trans | -17 | 94.9 | -174.4 | -169.4 | -176.8 | -66.8 | 0 | 0 | 114.7 | E89 I93 K109 | E89-M91 VanDerWaalsContact C-N 3.3Å; E89-M91 PolarHBondContact O-N 3.43Å; M91-I93 PolarHBondContact O-N 3.42Å; M91-I93 VanDerWaalsContact O-N 3.12Å; M91-K109 VanDerWaalsContact O-CE 3.24Å; M91-K109 WeakPolarHBondContact O-CE 3.36Å; M91-K109 PolarHBondContact O-NZ 2.65Å | ||
| 92 | E | 76.4 | Confident | 68.1 | Low | 81 Ų | 81 | 89.6 Ų | 89.6 | 38% | 0.379 | 51% | 0.513 | S | S | . | . | trans | -83.3 | 94.2 | -175.2 | -170.3 | 162.7 | -128.8 | 0 | 0 | 110.8 | D90 A94 L107 | D90-E92 PolarHBondContact O-N 2.88Å; E92-A94 PolarHBondContact O-N 3.41Å; E92-A94 VanDerWaalsContact O-N 3.13Å; E92-L107 HydrophobicContact CG-CD2 4.32Å | ||
| 93 | I | 87.3 | Confident | 70.4 | Confident | 64 Ų | 64 | 90.2 Ų | 90.2 | 33% | 0.328 | 50% | 0.502 | S | S | . | . | trans | -58.9 | 116.5 | 174.7 | -63.1 | 170.8 | 0 | 0 | 0 | 109.1 | M91 Y95 W108 | M91-I93 PolarHBondContact O-N 3.42Å; M91-I93 VanDerWaalsContact O-N 3.12Å; I93-Y95 HydrophobicContact CG2-CE2 3.82Å; I93-W108 HydrophobicContact CB-CB 4.38Å; I93-W108 HydrophobicContact CB-CE3 4.09Å; I93-W108 HydrophobicContact CD1-CE3 3.9Å; I93-W108 HydrophobicContact CD1-CZ3 3.94Å; I93-W108 HydrophobicContact CG2-CB 4.07Å; I93-W108 HydrophobicContact CG2-CD2 4.47Å; I93-W108 HydrophobicContact CG2-CE3 3.96Å; I93-W108 VanDerWaalsContact O-CB 3.31Å; I93-W108 WeakPolarHBondContact O-CB 3.41Å; I93-W108 PolarHBondContact O-N 2.84Å | ||
| 94 | A | 91.8 | Very high | 73 | Confident | 4 Ų | 4 | 87.3 Ų | 87.3 | 3% | 0.033 | 47% | 0.471 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 141.1 | -172.3 | 0 | 0 | 0 | 0 | 0 | 111 | I73 E92 I105 L106 L107 | I73-A94 HydrophobicContact CD1-CB 4.07Å; E92-A94 PolarHBondContact O-N 3.41Å; E92-A94 VanDerWaalsContact O-N 3.13Å; A94-I105 HydrophobicContact CB-CG2 3.7Å; A94-L106 WeakPolarHBondContact CA-O 3.44Å; A94-L107 HydrophobicContact CB-CD2 4.06Å |
| 95 | Y | 92.9 | Very high | 75.5 | Confident | 34 Ų | 34 | 83.8 Ų | 83.8 | 13% | 0.133 | 45% | 0.447 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 129.1 | -177.9 | -64.2 | -82.1 | 0 | 0 | 0 | 111.9 | V68 T70 I93 I97 L106 W108 L151 I165 | V68-Y95 HydrophobicContact CG1-CD1 4.32Å; V68-Y95 HydrophobicContact CG1-CE1 4.23Å; T70-Y95 HydrophobicContact CG2-CE1 4.2Å; I93-Y95 HydrophobicContact CG2-CE2 3.82Å; Y95-I97 PolarHBondContact O-N 2.85Å; Y95-L106 PolarHBondContact N-O 3.42Å; Y95-L106 PolarHBondContact O-N 2.66Å; Y95-W108 HydrophobicContact CD2-CB 4.02Å; Y95-W108 HydrophobicContact CE2-CB 3.75Å; Y95-W108 AromaticContact CE2-CG 3.87Å; Y95-W108 HydrophobicContact CE2-CG 3.87Å; Y95-L151 HydrophobicContact CG-CD2 4.4Å; Y95-I165 HydrophobicContact CD2-CD1 3.38Å; Y95-I165 HydrophobicContact CD2-CG1 4.34Å; Y95-I165 HydrophobicContact CE2-CD1 3.51Å; Y95-I165 HydrophobicContact CE2-CG1 3.97Å; Y95-I165 HydrophobicContact CG-CD1 3.98Å |
| 96 | P | 94 | Very high | 78 | Confident | 60 Ų | 60 | 76.3 Ų | 76.3 | 39% | 0.39 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.5 | 114.5 | 177.2 | 28 | -33.1 | 0 | 0 | 0 | 111.1 | ||
| 97 | I | 95.6 | Very high | 80.7 | Confident | 2 Ų | 2 | 68.7 Ų | 68.7 | 1% | 0.01 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.8 | 155.1 | 178.1 | 58.3 | 164.6 | 0 | 0 | 0 | 112.5 | Y95 A104 L106 V121 F133 I149 R150 L151 | Y95-I97 PolarHBondContact O-N 2.85Å; I97-A104 HydrophobicContact CD1-CB 4.19Å; I97-A104 HydrophobicContact CG1-CB 3.93Å; I97-A104 WeakPolarHBondContact CG1-O 3.47Å; I97-A104 PolarHBondContact N-O 3.39Å; I97-A104 PolarHBondContact O-N 2.63Å; I97-L106 HydrophobicContact CD1-CB 4.25Å; I97-L106 HydrophobicContact CG1-CB 4.35Å; I97-L106 HydrophobicContact CG2-CB 3.76Å; I97-L106 HydrophobicContact CG2-CD2 4.34Å; I97-V121 HydrophobicContact CD1-CB 4.44Å; I97-V121 HydrophobicContact CD1-CG1 3.81Å; I97-V121 HydrophobicContact CD1-CG2 3.77Å; I97-F133 HydrophobicContact CD1-CD1 3.84Å; I97-F133 HydrophobicContact CD1-CE1 3.6Å; I97-F133 HydrophobicContact CD1-CZ 4.41Å; I97-F133 HydrophobicContact CG1-CE1 4.14Å; I97-I149 HydrophobicContact CB-CG2 3.84Å; I97-I149 HydrophobicContact CD1-CD1 4.5Å; I97-I149 HydrophobicContact CD1-CG2 3.9Å; I97-I149 HydrophobicContact CG1-CG2 4.47Å; I97-I149 HydrophobicContact CG2-CG2 3.9Å; I97-R150 CarbonylContact C-O 3.43Å; I97-R150 VanDerWaalsContact CA-O 3.24Å; I97-R150 WeakPolarHBondContact CA-O 3.14Å; I97-L151 HydrophobicContact CG2-CD2 3.37Å; I97-L151 HydrophobicContact CG2-CG 3.86Å |
| 98 | T | 94.8 | Very high | 83.2 | Confident | 47 Ų | 47 | 66.9 Ų | 66.9 | 29% | 0.288 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 151.7 | 170.8 | 63.6 | 0 | 0 | 0 | 0 | 111.6 | S102 K103 I149 R150 | T98-S102 CarbonylContact C-O 3.6Å; T98-S102 VanDerWaalsContact CA-O 3.27Å; T98-S102 WeakPolarHBondContact CA-O 3.39Å; T98-K103 HydrophobicContact CG2-CG 4.14Å; T98-I149 CarbonylContact O-C 3.53Å; T98-I149 WeakPolarHBondContact O-CA 3.5Å; T98-R150 PolarHBondContact N-O 3.32Å; T98-R150 PolarHBondContact O-N 3.37Å |
| 99 | C | 94.7 | Very high | 85.7 | Confident | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.7 | 114.8 | 169.2 | -171.1 | 0 | 0 | 0 | 0 | 108.5 | E101 S102 F133 A137 A148 | C99-E101 PolarHBondContact O-N 2.91Å; C99-E101 VanDerWaalsContact O-N 3.16Å; C99-S102 PolarHBondContact N-O 2.82Å; C99-S102 WeakPolarHBondContact O-CB 3.3Å; C99-S102 PolarHBondContact O-N 2.85Å; C99-F133 HydrophobicContact CB-CD1 4.07Å; C99-F133 HydrophobicContact CB-CE1 3.43Å; C99-F133 VanDerWaalsContact CB-CE1 3.43Å; C99-F133 HydrophobicContact CB-CZ 3.72Å; C99-A137 HydrophobicContact CB-CB 3.73Å; C99-A137 WeakPolarHBondContact O-CB 3.42Å; C99-A148 PolarHBondContact SG-O 2.82Å |
| 100 | G | 89.5 | Confident | 88 | Confident | 44 Ų | 44 | 60.1 Ų | 60.1 | 45% | 0.454 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.4 | -119.7 | -166.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 101 | E | 90.8 | Very high | 90.3 | Very high | 181 Ų | 181 | 54.7 Ų | 54.7 | 85% | 0.846 | 28% | 0.277 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.3 | -14.8 | 176.1 | -70.3 | 144.3 | -126.5 | 0 | 0 | 113 | C99 | C99-E101 PolarHBondContact O-N 2.91Å; C99-E101 VanDerWaalsContact O-N 3.16Å |
| 102 | S | 94.4 | Very high | 92.1 | Very high | 27 Ų | 27 | 50.3 Ų | 50.3 | 19% | 0.189 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75 | 134.3 | -179.7 | -53.1 | 0 | 0 | 0 | 0 | 111.4 | T98 C99 | T98-S102 CarbonylContact C-O 3.6Å; T98-S102 VanDerWaalsContact CA-O 3.27Å; T98-S102 WeakPolarHBondContact CA-O 3.39Å; C99-S102 PolarHBondContact N-O 2.82Å; C99-S102 WeakPolarHBondContact O-CB 3.3Å; C99-S102 PolarHBondContact O-N 2.85Å |
| 103 | K | 94.5 | Very high | 92.8 | Very high | 167 Ų | 167 | 47 Ų | 47 | 73% | 0.726 | 24% | 0.243 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -109 | 140.2 | 174.3 | -54 | -175.7 | -177.8 | 179.5 | 0 | 109.7 | T98 F123 | T98-K103 HydrophobicContact CG2-CG 4.14Å; K103-F123 VanDerWaalsContact O-CD2 3.24Å; K103-F123 WeakPolarHBondContact O-CD2 3.46Å; K103-F123 WeakPolarHBondContact O-CE2 3.29Å |
| 104 | A | 94.8 | Very high | 92.8 | Very high | 10 Ų | 10 | 45.8 Ų | 45.8 | 8% | 0.083 | 24% | 0.24 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.4 | 177.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | I97 V121 K122 F123 F133 | I97-A104 HydrophobicContact CD1-CB 4.19Å; I97-A104 HydrophobicContact CG1-CB 3.93Å; I97-A104 WeakPolarHBondContact CG1-O 3.47Å; I97-A104 PolarHBondContact N-O 3.39Å; I97-A104 PolarHBondContact O-N 2.63Å; A104-V121 HydrophobicContact CB-CG1 3.58Å; A104-K122 WeakPolarHBondContact CB-O 3.48Å; A104-F123 HydrophobicContact CB-CB 4.01Å; A104-F123 HydrophobicContact CB-CD2 3.93Å; A104-F123 HydrophobicContact CB-CG 4.4Å; A104-F133 HydrophobicContact CB-CD2 3.99Å; A104-F133 HydrophobicContact CB-CE1 4.15Å; A104-F133 HydrophobicContact CB-CE2 3.46Å; A104-F133 VanDerWaalsContact CB-CE2 3.46Å; A104-F133 HydrophobicContact CB-CZ 3.55Å |
| 105 | I | 94.9 | Very high | 92.7 | Very high | 58 Ų | 58 | 45.6 Ų | 45.6 | 30% | 0.297 | 24% | 0.238 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 126.7 | 178.9 | -57.7 | 178 | 0 | 0 | 0 | 109.1 | I73 A94 L107 V121 K122 | I73-I105 HydrophobicContact CD1-CD1 4.04Å; I73-I105 HydrophobicContact CD1-CG2 4.35Å; A94-I105 HydrophobicContact CB-CG2 3.7Å; I105-L107 HydrophobicContact CG2-CD2 4.09Å; I105-V121 CarbonylContact O-C 3.51Å; I105-V121 WeakPolarHBondContact O-CA 3.21Å; I105-K122 HydrophobicContact CB-CB 4.43Å; I105-K122 PolarHBondContact N-O 2.64Å; I105-K122 PolarHBondContact O-N 2.86Å |
| 106 | L | 94.5 | Very high | 92.6 | Very high | 2 Ų | 2 | 46.8 Ų | 46.8 | 1% | 0.01 | 25% | 0.246 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -91 | 115.9 | 174.3 | 179.5 | 66.1 | 0 | 0 | 0 | 109.4 | A94 Y95 I97 W108 F111 C120 V121 L156 I165 | A94-L106 WeakPolarHBondContact CA-O 3.44Å; Y95-L106 PolarHBondContact N-O 3.42Å; Y95-L106 PolarHBondContact O-N 2.66Å; I97-L106 HydrophobicContact CD1-CB 4.25Å; I97-L106 HydrophobicContact CG1-CB 4.35Å; I97-L106 HydrophobicContact CG2-CB 3.76Å; I97-L106 HydrophobicContact CG2-CD2 4.34Å; L106-W108 PolarHBondContact O-N 2.9Å; L106-F111 HydrophobicContact CD1-CB 4.31Å; L106-F111 HydrophobicContact CD1-CD2 3.84Å; L106-F111 HydrophobicContact CD1-CE2 4.41Å; L106-F111 HydrophobicContact CD1-CG 4.17Å; L106-F111 HydrophobicContact CD2-CG 4.44Å; L106-C120 HydrophobicContact CD1-CB 4.33Å; L106-V121 HydrophobicContact CD1-CG2 3.97Å; L106-L156 HydrophobicContact CD2-CD1 4.49Å; L106-I165 HydrophobicContact CD2-CD1 3.87Å |
| 107 | L | 94.2 | Very high | 92.5 | Very high | 13 Ų | 13 | 49 Ų | 49 | 7% | 0.068 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.4 | 106.1 | 177.3 | -52.9 | -179 | 0 | 0 | 0 | 108.7 | E92 A94 I105 K109 K110 F111 C120 L127 | E92-L107 HydrophobicContact CG-CD2 4.32Å; A94-L107 HydrophobicContact CB-CD2 4.06Å; I105-L107 HydrophobicContact CG2-CD2 4.09Å; L107-K109 PolarHBondContact O-N 3.05Å; L107-K110 HydrophobicContact CB-CB 4.32Å; L107-K110 HydrophobicContact CB-CG 4.06Å; L107-K110 PolarHBondContact O-N 3.5Å; L107-F111 PolarHBondContact O-N 3.49Å; L107-C120 PolarHBondContact N-O 3Å; L107-L127 HydrophobicContact CD1-CD1 3.63Å; L107-L127 HydrophobicContact CG-CD1 4.42Å |
| 108 | W | 92 | Very high | 92.4 | Very high | 67 Ų | 67 | 51.2 Ų | 51.2 | 25% | 0.254 | 27% | 0.268 | S | S | . | . | G | 310 helix | trans | -66.1 | -41.4 | -167.3 | -177.5 | 56.6 | 0 | 0 | 0 | 112.6 | I93 Y95 L106 K110 F111 D166 Y168 | I93-W108 HydrophobicContact CB-CB 4.38Å; I93-W108 HydrophobicContact CB-CE3 4.09Å; I93-W108 HydrophobicContact CD1-CE3 3.9Å; I93-W108 HydrophobicContact CD1-CZ3 3.94Å; I93-W108 HydrophobicContact CG2-CB 4.07Å; I93-W108 HydrophobicContact CG2-CD2 4.47Å; I93-W108 HydrophobicContact CG2-CE3 3.96Å; I93-W108 VanDerWaalsContact O-CB 3.31Å; I93-W108 WeakPolarHBondContact O-CB 3.41Å; I93-W108 PolarHBondContact O-N 2.84Å; Y95-W108 HydrophobicContact CD2-CB 4.02Å; Y95-W108 HydrophobicContact CE2-CB 3.75Å; Y95-W108 AromaticContact CE2-CG 3.87Å; Y95-W108 HydrophobicContact CE2-CG 3.87Å; L106-W108 PolarHBondContact O-N 2.9Å; W108-K110 PolarHBondContact O-N 2.89Å; W108-F111 WeakPolarHBondContact O-CB 3.44Å; W108-F111 PolarHBondContact O-N 2.8Å; W108-D166 PolarHBondContact NE1-O 3.23Å; W108-Y168 HydrophobicContact CE3-CD2 4.44Å; W108-Y168 HydrophobicContact CH2-CD2 4.33Å; W108-Y168 HydrophobicContact CZ2-CD2 4.42Å; W108-Y168 HydrophobicContact CZ3-CD2 4.34Å; W108-Y168 WeakPolarHBondContact O-CB 3.33Å |
| 109 | K | 90.7 | Very high | 92.4 | Very high | 46 Ų | 46 | 55.8 Ų | 55.8 | 20% | 0.2 | 28% | 0.284 | C | S | . | . | G | 310 helix | trans | -55.5 | -24 | 173.6 | -73 | -176.6 | 170.6 | -178.6 | 0 | 113.9 | D90 M91 L107 | D90-K109 VanDerWaalsContact C-NZ 3.31Å; D90-K109 PolarHBondContact O-NZ 3.45Å; D90-K109 IonicContact OD1-NZ 2.86Å; D90-K109 PolarHBondContact OD1-NZ 3.45Å; D90-K109 IonicContact OD2-NZ 2.7Å; D90-K109 PolarHBondContact OD2-NZ 2.64Å; M91-K109 VanDerWaalsContact O-CE 3.24Å; M91-K109 WeakPolarHBondContact O-CE 3.36Å; M91-K109 PolarHBondContact O-NZ 2.65Å; L107-K109 PolarHBondContact O-N 3.05Å |
| 110 | K | 90.8 | Very high | 92.3 | Very high | 104 Ų | 104 | 55.8 Ų | 55.8 | 45% | 0.452 | 28% | 0.284 | S | S | . | . | G | 310 helix | trans | -96.3 | -7.9 | 177.5 | -51.3 | -59.6 | -177 | -175.1 | 0 | 113.1 | L107 W108 V112 V118 C120 | L107-K110 HydrophobicContact CB-CB 4.32Å; L107-K110 HydrophobicContact CB-CG 4.06Å; L107-K110 PolarHBondContact O-N 3.5Å; W108-K110 PolarHBondContact O-N 2.89Å; K110-V112 VanDerWaalsContact C-N 3.29Å; K110-V112 PolarHBondContact O-N 3.42Å; K110-V118 VanDerWaalsContact O-CG1 3.3Å; K110-V118 WeakPolarHBondContact O-CG1 3.39Å; K110-C120 HydrophobicContact CB-CB 3.84Å; K110-C120 WeakPolarHBondContact O-CB 3.43Å |
| 111 | F | 93 | Very high | 92.6 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 26% | 0.263 | C | S | . | . | trans | -82.9 | 65.9 | -174.7 | -175.2 | -123.3 | 0 | 0 | 0 | 111.8 | L106 L107 W108 C120 W145 L156 M160 F167 Y168 | L106-F111 HydrophobicContact CD1-CB 4.31Å; L106-F111 HydrophobicContact CD1-CD2 3.84Å; L106-F111 HydrophobicContact CD1-CE2 4.41Å; L106-F111 HydrophobicContact CD1-CG 4.17Å; L106-F111 HydrophobicContact CD2-CG 4.44Å; L107-F111 PolarHBondContact O-N 3.49Å; W108-F111 WeakPolarHBondContact O-CB 3.44Å; W108-F111 PolarHBondContact O-N 2.8Å; F111-C120 HydrophobicContact CB-CB 4.45Å; F111-W145 AromaticContact CE2-CH2 3.8Å; F111-W145 HydrophobicContact CE2-CH2 3.8Å; F111-W145 HydrophobicContact CE2-CZ3 4Å; F111-W145 HydrophobicContact CZ-CH2 4.04Å; F111-W145 HydrophobicContact CZ-CZ3 4.33Å; F111-L156 HydrophobicContact CZ-CD2 4.33Å; F111-M160 HydrophobicContact CE1-CE 3.88Å; F111-M160 HydrophobicContact CE1-SD 4.47Å; F111-M160 HydrophobicContact CZ-CE 3.93Å; F111-M160 HydrophobicContact CZ-SD 4.19Å; F111-F167 AromaticContact CD1-CD1 3.89Å; F111-F167 HydrophobicContact CD1-CD1 3.89Å; F111-F167 HydrophobicContact CD2-CD1 4.2Å; F111-F167 HydrophobicContact CD2-CE1 4.46Å; F111-F167 AromaticContact CE1-CD1 3.6Å; F111-F167 HydrophobicContact CE1-CD1 3.6Å; F111-F167 HydrophobicContact CE1-CE1 4.03Å; F111-F167 HydrophobicContact CE1-CG 4.27Å; F111-F167 AromaticContact CE2-CD1 3.95Å; F111-F167 HydrophobicContact CE2-CD1 3.95Å; F111-F167 AromaticContact CE2-CE1 3.83Å; F111-F167 HydrophobicContact CE2-CE1 3.83Å; F111-F167 HydrophobicContact CG-CD1 4.19Å; F111-F167 AromaticContact CZ-CD1 3.64Å; F111-F167 HydrophobicContact CZ-CD1 3.64Å; F111-F167 AromaticContact CZ-CE1 3.59Å; F111-F167 HydrophobicContact CZ-CE1 3.59Å; F111-F167 CarbonylContact O-C 3.49Å; F111-F167 WeakPolarHBondContact O-CA 3.24Å; F111-F167 WeakPolarHBondContact O-CB 3.45Å; F111-Y168 PolarHBondContact O-N 3.45Å | ||
| 112 | V | 92.1 | Very high | 92.8 | Very high | 45 Ų | 45 | 48.6 Ų | 48.6 | 27% | 0.273 | 24% | 0.238 | S | C | . | . | trans | -86.2 | 146.5 | -178.8 | -176.4 | 0 | 0 | 0 | 0 | 111.4 | K110 G115 V173 | K110-V112 VanDerWaalsContact C-N 3.29Å; K110-V112 PolarHBondContact O-N 3.42Å; V112-G115 WeakPolarHBondContact O-CA 3.43Å; V112-G115 PolarHBondContact O-N 2.88Å; V112-V173 HydrophobicContact CG1-CB 4.41Å; V112-V173 HydrophobicContact CG1-CG1 3.66Å | ||
| 113 | C | 91.9 | Very high | 92.8 | Very high | 11 Ų | 11 | 48.7 Ų | 48.7 | 7% | 0.074 | 24% | 0.235 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | 137.4 | 178.2 | -171.7 | 0 | 0 | 0 | 0 | 112 | F167 V173 S175 C178 | C113-F167 HydrophobicContact CB-CB 4.07Å; C113-F167 HydrophobicContact CB-CD1 4.37Å; C113-F167 HydrophobicContact CB-CD2 3.78Å; C113-F167 HydrophobicContact CB-CE2 4.19Å; C113-F167 HydrophobicContact CB-CG 3.84Å; C113-V173 WeakPolarHBondContact CB-O 3.35Å; C113-S175 PolarHBondContact SG-N 2.76Å; C113-C178 WeakPolarHBondContact SG-CB 3.19Å; C113-C178 VanDerWaalsContact SG-SG 3.61Å |
| 114 | P | 87.2 | Confident | 92.6 | Very high | 40 Ų | 40 | 47.1 Ų | 47.1 | 26% | 0.26 | 23% | 0.234 | S | C | . | . | T | Hydrogen-bonded Turn | cis | -87 | 7.7 | 1.3 | 33.3 | -32.9 | 0 | 0 | 0 | 114.6 | I116 W145 F167 S175 C178 | P114-I116 HydrophobicContact CG-CG2 4.33Å; P114-I116 PolarHBondContact O-N 3.49Å; P114-W145 VanDerWaalsContact O-CZ2 3.32Å; P114-W145 WeakPolarHBondContact O-CZ2 3.3Å; P114-F167 VanDerWaalsContact C-CE1 3.43Å; P114-F167 WeakPolarHBondContact O-CE1 3.33Å; P114-F167 WeakPolarHBondContact O-CZ 3.36Å; P114-S175 WeakPolarHBondContact CB-OG 3.47Å; P114-S175 WeakPolarHBondContact CD-OG 3.42Å; P114-C178 HydrophobicContact CB-CB 3.96Å |
| 115 | G | 88.8 | Confident | 92.2 | Very high | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 26% | 0.264 | C | S | . | . | trans | 72.5 | -36 | 175.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | V112 N117 V118 P130 | V112-G115 WeakPolarHBondContact O-CA 3.43Å; V112-G115 PolarHBondContact O-N 2.88Å; G115-N117 VanDerWaalsContact C-N 3.28Å; G115-N117 PolarHBondContact O-N 3.14Å; G115-V118 PolarHBondContact O-N 2.92Å; G115-P130 VanDerWaalsContact O-CD 3.28Å; G115-P130 WeakPolarHBondContact O-CD 3.46Å; G115-P130 WeakPolarHBondContact O-CG 3.47Å | ||
| 116 | I | 91.1 | Very high | 92.1 | Very high | 59 Ų | 59 | 56 Ų | 56 | 30% | 0.303 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -48.1 | -43.6 | -168.8 | -172.4 | 170.6 | 0 | 0 | 0 | 114.8 | P114 K131 W145 | P114-I116 HydrophobicContact CG-CG2 4.33Å; P114-I116 PolarHBondContact O-N 3.49Å; I116-K131 HydrophobicContact CG1-CB 3.96Å; I116-K131 HydrophobicContact CG1-CD 4.31Å; I116-K131 WeakPolarHBondContact O-CB 3.36Å; I116-K131 PolarHBondContact O-N 2.74Å; I116-K131 VanDerWaalsContact O-N 3.12Å; I116-W145 HydrophobicContact CB-CZ2 4.26Å; I116-W145 HydrophobicContact CG1-CG 4.37Å |
| 117 | N | 91.7 | Very high | 92.1 | Very high | 106 Ų | 106 | 59.2 Ų | 59.2 | 57% | 0.567 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.1 | -5 | 179.8 | -62.1 | -29.5 | 0 | 0 | 0 | 113.1 | G115 S129 K131 | G115-N117 VanDerWaalsContact C-N 3.28Å; G115-N117 PolarHBondContact O-N 3.14Å; N117-S129 VanDerWaalsContact C-CB 3.49Å; N117-S129 WeakPolarHBondContact O-CB 3.3Å; N117-K131 WeakPolarHBondContact OD1-CD 3.4Å |
| 118 | V | 93.3 | Very high | 92.2 | Very high | 48 Ų | 48 | 59 Ų | 59 | 29% | 0.291 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -75.5 | 130.5 | -175.3 | -176.3 | 0 | 0 | 0 | 0 | 109.6 | K110 G115 C120 S129 P130 | K110-V118 VanDerWaalsContact O-CG1 3.3Å; K110-V118 WeakPolarHBondContact O-CG1 3.39Å; G115-V118 PolarHBondContact O-N 2.92Å; V118-C120 PolarHBondContact O-N 3.23Å; V118-C120 PolarHBondContact O-SG 3.36Å; V118-S129 WeakPolarHBondContact O-CA 3.49Å; V118-P130 WeakPolarHBondContact O-CD 3.44Å |
| 119 | K | 94.7 | Very high | 92.3 | Very high | 144 Ų | 144 | 56.7 Ų | 56.7 | 63% | 0.626 | 29% | 0.287 | S | S | * | . | S | Bend | trans | -73 | 96.7 | 177.4 | -70.1 | -176 | -179.2 | 179.5 | 0 | 109.9 | L127 I128 | K119-L127 HydrophobicContact CB-CD2 4.16Å; K119-L127 HydrophobicContact CB-CG 4.08Å; K119-I128 WeakPolarHBondContact CA-O 3.45Å |
| 120 | C | 94 | Very high | 92.5 | Very high | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 28% | 0.278 | C | S | . | . | trans | -140.7 | -2 | -174.6 | 58.2 | 0 | 0 | 0 | 0 | 113.8 | L106 L107 K110 F111 V118 I128 P130 | L106-C120 HydrophobicContact CD1-CB 4.33Å; L107-C120 PolarHBondContact N-O 3Å; K110-C120 HydrophobicContact CB-CB 3.84Å; K110-C120 WeakPolarHBondContact O-CB 3.43Å; F111-C120 HydrophobicContact CB-CB 4.45Å; V118-C120 PolarHBondContact O-N 3.23Å; V118-C120 PolarHBondContact O-SG 3.36Å; C120-I128 PolarHBondContact N-O 2.86Å; C120-I128 VanDerWaalsContact N-O 3.1Å; C120-P130 VanDerWaalsContact SG-CD 3.6Å | ||
| 121 | V | 95.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.1 | 116.6 | 178.7 | 173 | 0 | 0 | 0 | 0 | 109.1 | I97 A104 I105 L106 I128 P130 F133 | I97-V121 HydrophobicContact CD1-CB 4.44Å; I97-V121 HydrophobicContact CD1-CG1 3.81Å; I97-V121 HydrophobicContact CD1-CG2 3.77Å; A104-V121 HydrophobicContact CB-CG1 3.58Å; I105-V121 CarbonylContact O-C 3.51Å; I105-V121 WeakPolarHBondContact O-CA 3.21Å; L106-V121 HydrophobicContact CD1-CG2 3.97Å; V121-I128 HydrophobicContact CB-CG1 4.22Å; V121-I128 HydrophobicContact CG1-CG1 4.22Å; V121-I128 PolarHBondContact N-O 2.94Å; V121-I128 WeakPolarHBondContact O-CG1 3.22Å; V121-I128 PolarHBondContact O-N 3.41Å; V121-P130 HydrophobicContact CG2-CG 4.13Å; V121-F133 HydrophobicContact CG1-CB 4.04Å; V121-F133 HydrophobicContact CG1-CD1 4.16Å; V121-F133 HydrophobicContact CG1-CD2 4.27Å; V121-F133 HydrophobicContact CG1-CG 3.9Å |
| 122 | K | 94.4 | Very high | 92.7 | Very high | 74 Ų | 74 | 59.2 Ų | 59.2 | 32% | 0.322 | 30% | 0.299 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.9 | 115.4 | 170.9 | -172.5 | -179.9 | 178.1 | -172.4 | 0 | 109.3 | A104 I105 D125 Q126 | A104-K122 WeakPolarHBondContact CB-O 3.48Å; I105-K122 HydrophobicContact CB-CB 4.43Å; I105-K122 PolarHBondContact N-O 2.64Å; I105-K122 PolarHBondContact O-N 2.86Å; K122-D125 WeakPolarHBondContact CE-OD1 3.3Å; K122-D125 IonicContact NZ-OD1 3.72Å; K122-D125 PolarHBondContact NZ-OD1 3.1Å; K122-Q126 WeakPolarHBondContact CA-O 3.41Å |
| 123 | F | 93.9 | Very high | 92.8 | Very high | 29 Ų | 29 | 57 Ų | 57 | 13% | 0.127 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 125.1 | -179.8 | 178.9 | -117.4 | 0 | 0 | 0 | 109.5 | K103 A104 D125 Q126 I128 F133 L136 | K103-F123 VanDerWaalsContact O-CD2 3.24Å; K103-F123 WeakPolarHBondContact O-CD2 3.46Å; K103-F123 WeakPolarHBondContact O-CE2 3.29Å; A104-F123 HydrophobicContact CB-CB 4.01Å; A104-F123 HydrophobicContact CB-CD2 3.93Å; A104-F123 HydrophobicContact CB-CG 4.4Å; F123-D125 PolarHBondContact O-N 3.36Å; F123-Q126 PolarHBondContact N-O 2.92Å; F123-Q126 PolarHBondContact O-N 2.98Å; F123-I128 HydrophobicContact CB-CD1 3.7Å; F123-I128 HydrophobicContact CB-CG1 4.15Å; F123-I128 HydrophobicContact CD1-CD1 3.96Å; F123-I128 HydrophobicContact CG-CD1 4.19Å; F123-F133 HydrophobicContact CB-CD2 4.37Å; F123-F133 HydrophobicContact CD1-CD2 4.5Å; F123-F133 HydrophobicContact CD2-CD2 4.15Å; F123-F133 AromaticContact CD2-CE2 3.84Å; F123-F133 HydrophobicContact CD2-CE2 3.84Å; F123-F133 HydrophobicContact CE2-CE2 4.09Å; F123-F133 HydrophobicContact CG-CD2 4.09Å; F123-F133 HydrophobicContact CG-CE2 4.26Å; F123-L136 HydrophobicContact CD1-CD1 3.74Å; F123-L136 HydrophobicContact CE1-CB 4.17Å; F123-L136 HydrophobicContact CE1-CD1 3.75Å |
| 124 | N | 90.6 | Very high | 93 | Very high | 134 Ų | 134 | 56.8 Ų | 56.8 | 72% | 0.717 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 46.7 | 49.7 | -173.1 | -57.2 | -15.5 | 0 | 0 | 0 | 111.8 | Q126 | N124-Q126 PolarHBondContact O-N 2.72Š|
| 125 | D | 87.5 | Confident | 93.3 | Very high | 131 Ų | 131 | 60.5 Ų | 60.5 | 70% | 0.701 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.1 | -2.8 | -173.4 | -67.8 | -78.2 | 0 | 0 | 0 | 118.2 | K122 F123 | K122-D125 WeakPolarHBondContact CE-OD1 3.3Å; K122-D125 IonicContact NZ-OD1 3.72Å; K122-D125 PolarHBondContact NZ-OD1 3.1Å; F123-D125 PolarHBondContact O-N 3.36Å |
| 126 | Q | 92.5 | Very high | 93.4 | Very high | 124 Ų | 124 | 64.5 Ų | 64.5 | 58% | 0.579 | 32% | 0.319 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 136.9 | 173.4 | -168.8 | 177.8 | 74.7 | 0 | 0 | 112.1 | K122 F123 N124 I128 | K122-Q126 WeakPolarHBondContact CA-O 3.41Å; F123-Q126 PolarHBondContact N-O 2.92Å; F123-Q126 PolarHBondContact O-N 2.98Å; N124-Q126 PolarHBondContact O-N 2.72Å; Q126-I128 HydrophobicContact CB-CG2 4.32Å; Q126-I128 HydrophobicContact CG-CG2 3.87Å; Q126-I128 PolarHBondContact O-N 3.37Å; Q126-I128 VanDerWaalsContact OE1-CG2 3.31Å |
| 127 | L | 94 | Very high | 93.4 | Very high | 68 Ų | 68 | 62.3 Ų | 62.3 | 36% | 0.356 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87 | 107.4 | 173.8 | -168.5 | 70.9 | 0 | 0 | 0 | 111.2 | L107 K119 | L107-L127 HydrophobicContact CD1-CD1 3.63Å; L107-L127 HydrophobicContact CG-CD1 4.42Å; K119-L127 HydrophobicContact CB-CD2 4.16Å; K119-L127 HydrophobicContact CB-CG 4.08Å |
| 128 | I | 95.4 | Very high | 93.4 | Very high | 8 Ų | 8 | 59.9 Ų | 59.9 | 4% | 0.041 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.8 | 170.5 | -175 | 63.9 | 171.5 | 0 | 0 | 0 | 112 | K119 C120 V121 F123 Q126 H132 F133 L136 | K119-I128 WeakPolarHBondContact CA-O 3.45Å; C120-I128 PolarHBondContact N-O 2.86Å; C120-I128 VanDerWaalsContact N-O 3.1Å; V121-I128 HydrophobicContact CB-CG1 4.22Å; V121-I128 HydrophobicContact CG1-CG1 4.22Å; V121-I128 PolarHBondContact N-O 2.94Å; V121-I128 WeakPolarHBondContact O-CG1 3.22Å; V121-I128 PolarHBondContact O-N 3.41Å; F123-I128 HydrophobicContact CB-CD1 3.7Å; F123-I128 HydrophobicContact CB-CG1 4.15Å; F123-I128 HydrophobicContact CD1-CD1 3.96Å; F123-I128 HydrophobicContact CG-CD1 4.19Å; Q126-I128 HydrophobicContact CB-CG2 4.32Å; Q126-I128 HydrophobicContact CG-CG2 3.87Å; Q126-I128 PolarHBondContact O-N 3.37Å; Q126-I128 VanDerWaalsContact OE1-CG2 3.31Å; I128-H132 HydrophobicContact CB-CB 4.45Å; I128-F133 HydrophobicContact CD1-CB 3.77Å; I128-F133 HydrophobicContact CD1-CD2 4.36Å; I128-F133 HydrophobicContact CG1-CB 4.37Å; I128-L136 HydrophobicContact CD1-CD1 3.89Å |
| 129 | S | 95.1 | Very high | 93.2 | Very high | 20 Ų | 20 | 61.4 Ų | 61.4 | 14% | 0.14 | 31% | 0.312 | C | S | . | . | trans | -87.4 | 153.7 | 175.8 | 66.7 | 0 | 0 | 0 | 0 | 112.5 | N117 V118 K131 H132 F133 | N117-S129 VanDerWaalsContact C-CB 3.49Å; N117-S129 WeakPolarHBondContact O-CB 3.3Å; V118-S129 WeakPolarHBondContact O-CA 3.49Å; S129-K131 PolarHBondContact O-N 3.2Å; S129-H132 WeakPolarHBondContact O-CA 3.38Å; S129-H132 PolarHBondContact O-N 2.97Å; S129-H132 PolarHBondContact OG-N 2.86Å; S129-F133 PolarHBondContact O-N 2.66Å | ||
| 130 | P | 94.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -52.3 | -40 | 174.2 | -29.4 | 35.6 | 0 | 0 | 0 | 113.4 | G115 V118 C120 V121 H132 F133 V134 W145 I149 | G115-P130 VanDerWaalsContact O-CD 3.28Å; G115-P130 WeakPolarHBondContact O-CD 3.46Å; G115-P130 WeakPolarHBondContact O-CG 3.47Å; V118-P130 WeakPolarHBondContact O-CD 3.44Å; C120-P130 VanDerWaalsContact SG-CD 3.6Å; V121-P130 HydrophobicContact CG2-CG 4.13Å; P130-H132 PolarHBondContact O-N 3.45Å; P130-F133 PolarHBondContact O-N 3.33Å; P130-V134 WeakPolarHBondContact O-CB 3.25Å; P130-V134 VanDerWaalsContact O-CG2 3.28Å; P130-V134 WeakPolarHBondContact O-CG2 3.16Å; P130-V134 PolarHBondContact O-N 3.17Å; P130-W145 HydrophobicContact CB-CD2 4.14Å; P130-W145 HydrophobicContact CB-CE3 3.47Å; P130-W145 VanDerWaalsContact CB-CE3 3.47Å; P130-W145 HydrophobicContact CB-CZ3 3.7Å; P130-W145 HydrophobicContact CG-CE3 4.3Å; P130-W145 HydrophobicContact CG-CZ3 4.02Å; P130-I149 HydrophobicContact CB-CD1 3.84Å |
| 131 | K | 93.7 | Very high | 92.3 | Very high | 123 Ų | 123 | 63.5 Ų | 63.5 | 54% | 0.535 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.1 | -41.3 | 174 | 179.8 | -178.7 | 174.6 | -172.8 | 0 | 112.4 | I116 N117 S129 H135 | I116-K131 HydrophobicContact CG1-CB 3.96Å; I116-K131 HydrophobicContact CG1-CD 4.31Å; I116-K131 WeakPolarHBondContact O-CB 3.36Å; I116-K131 PolarHBondContact O-N 2.74Å; I116-K131 VanDerWaalsContact O-N 3.12Å; N117-K131 WeakPolarHBondContact OD1-CD 3.4Å; S129-K131 PolarHBondContact O-N 3.2Å; K131-H135 PolarHBondContact O-N 3.39Å |
| 132 | H | 94.1 | Very high | 91.7 | Very high | 79 Ų | 79 | 67.6 Ų | 67.6 | 37% | 0.366 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -73.5 | -39 | 178.5 | -165.6 | 75.1 | 0 | 0 | 0 | 111.8 | I128 S129 P130 V134 H135 L136 | I128-H132 HydrophobicContact CB-CB 4.45Å; S129-H132 WeakPolarHBondContact O-CA 3.38Å; S129-H132 PolarHBondContact O-N 2.97Å; S129-H132 PolarHBondContact OG-N 2.86Å; P130-H132 PolarHBondContact O-N 3.45Å; H132-V134 PolarHBondContact O-N 2.92Å; H132-H135 WeakPolarHBondContact O-CA 3.36Å; H132-H135 VanDerWaalsContact O-CB 3.3Å; H132-H135 WeakPolarHBondContact O-CB 3.48Å; H132-H135 PolarHBondContact O-N 3.15Å; H132-L136 WeakPolarHBondContact O-CG 3.35Å; H132-L136 PolarHBondContact O-N 3.44Å |
| 133 | F | 95.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 74.1 Ų | 74.1 | 0% | 0 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -59.3 | -46.3 | 173.7 | 177 | -125.6 | 0 | 0 | 0 | 112 | I97 C99 A104 V121 F123 I128 S129 P130 H135 L136 A137 I149 | I97-F133 HydrophobicContact CD1-CD1 3.84Å; I97-F133 HydrophobicContact CD1-CE1 3.6Å; I97-F133 HydrophobicContact CD1-CZ 4.41Å; I97-F133 HydrophobicContact CG1-CE1 4.14Å; C99-F133 HydrophobicContact CB-CD1 4.07Å; C99-F133 HydrophobicContact CB-CE1 3.43Å; C99-F133 VanDerWaalsContact CB-CE1 3.43Å; C99-F133 HydrophobicContact CB-CZ 3.72Å; A104-F133 HydrophobicContact CB-CD2 3.99Å; A104-F133 HydrophobicContact CB-CE1 4.15Å; A104-F133 HydrophobicContact CB-CE2 3.46Å; A104-F133 VanDerWaalsContact CB-CE2 3.46Å; A104-F133 HydrophobicContact CB-CZ 3.55Å; V121-F133 HydrophobicContact CG1-CB 4.04Å; V121-F133 HydrophobicContact CG1-CD1 4.16Å; V121-F133 HydrophobicContact CG1-CD2 4.27Å; V121-F133 HydrophobicContact CG1-CG 3.9Å; F123-F133 HydrophobicContact CB-CD2 4.37Å; F123-F133 HydrophobicContact CD1-CD2 4.5Å; F123-F133 HydrophobicContact CD2-CD2 4.15Å; F123-F133 AromaticContact CD2-CE2 3.84Å; F123-F133 HydrophobicContact CD2-CE2 3.84Å; F123-F133 HydrophobicContact CE2-CE2 4.09Å; F123-F133 HydrophobicContact CG-CD2 4.09Å; F123-F133 HydrophobicContact CG-CE2 4.26Å; I128-F133 HydrophobicContact CD1-CB 3.77Å; I128-F133 HydrophobicContact CD1-CD2 4.36Å; I128-F133 HydrophobicContact CG1-CB 4.37Å; S129-F133 PolarHBondContact O-N 2.66Å; P130-F133 PolarHBondContact O-N 3.33Å; F133-H135 PolarHBondContact O-N 2.83Å; F133-L136 PolarHBondContact O-N 3.21Å; F133-A137 VanDerWaalsContact O-CB 3.26Å; F133-A137 WeakPolarHBondContact O-CB 3.41Å; F133-A137 PolarHBondContact O-N 2.86Å; F133-I149 HydrophobicContact CD1-CD1 3.97Å; F133-I149 HydrophobicContact CD1-CG1 4.08Å; F133-I149 HydrophobicContact CE1-CG1 4.31Å |
| 134 | V | 94.6 | Very high | 91 | Very high | 6 Ų | 6 | 74 Ų | 74 | 4% | 0.036 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -62.5 | -25.9 | 173.9 | 169.6 | 0 | 0 | 0 | 0 | 112.3 | P130 H132 K139 S140 W145 A148 I149 | P130-V134 WeakPolarHBondContact O-CB 3.25Å; P130-V134 VanDerWaalsContact O-CG2 3.28Å; P130-V134 WeakPolarHBondContact O-CG2 3.16Å; P130-V134 PolarHBondContact O-N 3.17Å; H132-V134 PolarHBondContact O-N 2.92Å; V134-K139 HydrophobicContact CG1-CB 4.1Å; V134-K139 CarbonylContact O-C 3.51Å; V134-K139 PolarHBondContact O-N 3.29Å; V134-S140 PolarHBondContact O-N 2.8Å; V134-W145 HydrophobicContact CG2-CB 4.11Å; V134-A148 HydrophobicContact CB-CB 4.47Å; V134-A148 HydrophobicContact CG1-CB 3.83Å; V134-A148 HydrophobicContact CG2-CB 3.73Å; V134-I149 HydrophobicContact CG2-CD1 4.04Å; V134-I149 HydrophobicContact CG2-CG1 3.69Å |
| 135 | H | 93.3 | Very high | 91.1 | Very high | 117 Ų | 117 | 68.8 Ų | 68.8 | 54% | 0.542 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -74.5 | -51.3 | 173.9 | -165.3 | 85.6 | 0 | 0 | 0 | 112.4 | K131 H132 F133 A137 G138 S140 | K131-H135 PolarHBondContact O-N 3.39Å; H132-H135 WeakPolarHBondContact O-CA 3.36Å; H132-H135 VanDerWaalsContact O-CB 3.3Å; H132-H135 WeakPolarHBondContact O-CB 3.48Å; H132-H135 PolarHBondContact O-N 3.15Å; F133-H135 PolarHBondContact O-N 2.83Å; H135-A137 VanDerWaalsContact C-N 3.26Å; H135-A137 PolarHBondContact O-N 2.99Å; H135-G138 PolarHBondContact O-N 3.33Å; H135-S140 VanDerWaalsContact CA-OG 3.3Å; H135-S140 WeakPolarHBondContact CA-OG 3.5Å; H135-S140 PolarHBondContact ND1-OG 3.22Å |
| 136 | L | 91.9 | Very high | 91.3 | Very high | 85 Ų | 85 | 63 Ų | 63 | 45% | 0.445 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.7 | -35 | 175.9 | -62.8 | 177 | 0 | 0 | 0 | 112.2 | F123 I128 H132 F133 G138 | F123-L136 HydrophobicContact CD1-CD1 3.74Å; F123-L136 HydrophobicContact CE1-CB 4.17Å; F123-L136 HydrophobicContact CE1-CD1 3.75Å; I128-L136 HydrophobicContact CD1-CD1 3.89Å; H132-L136 WeakPolarHBondContact O-CG 3.35Å; H132-L136 PolarHBondContact O-N 3.44Å; F133-L136 PolarHBondContact O-N 3.21Å; L136-G138 PolarHBondContact O-N 3.04Å |
| 137 | A | 91.5 | Very high | 91.3 | Very high | 13 Ų | 13 | 63.4 Ų | 63.4 | 11% | 0.107 | 33% | 0.325 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | 2.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | C99 F133 H135 K139 | C99-A137 HydrophobicContact CB-CB 3.73Å; C99-A137 WeakPolarHBondContact O-CB 3.42Å; F133-A137 VanDerWaalsContact O-CB 3.26Å; F133-A137 WeakPolarHBondContact O-CB 3.41Å; F133-A137 PolarHBondContact O-N 2.86Å; H135-A137 VanDerWaalsContact C-N 3.26Å; H135-A137 PolarHBondContact O-N 2.99Å; A137-K139 PolarHBondContact O-N 3.19Å |
| 138 | G | 90.4 | Very high | 91.3 | Very high | 54 Ų | 54 | 60.6 Ų | 60.6 | 56% | 0.557 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.8 | 16.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | H135 L136 | H135-G138 PolarHBondContact O-N 3.33Å; L136-G138 PolarHBondContact O-N 3.04Å |
| 139 | K | 89.3 | Confident | 91.3 | Very high | 81 Ų | 81 | 60.3 Ų | 60.3 | 35% | 0.352 | 31% | 0.31 | S | S | . | . | trans | -101.9 | 14.3 | -178.6 | -56.4 | -49.3 | 177 | -163.7 | 0 | 113.9 | V134 A137 T141 L142 A148 | V134-K139 HydrophobicContact CG1-CB 4.1Å; V134-K139 CarbonylContact O-C 3.51Å; V134-K139 PolarHBondContact O-N 3.29Å; A137-K139 PolarHBondContact O-N 3.19Å; K139-T141 PolarHBondContact O-N 3.03Å; K139-T141 VanDerWaalsContact O-N 3.07Å; K139-L142 WeakPolarHBondContact O-CB 3.28Å; K139-L142 PolarHBondContact O-N 3.28Å; K139-A148 HydrophobicContact CB-CB 4.31Å | ||
| 140 | S | 86.3 | Confident | 91.3 | Very high | 56 Ų | 56 | 64.2 Ų | 64.2 | 39% | 0.392 | 32% | 0.322 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.8 | -26.3 | 175.8 | -73 | 0 | 0 | 0 | 0 | 115.9 | V134 H135 L142 | V134-S140 PolarHBondContact O-N 2.8Å; H135-S140 VanDerWaalsContact CA-OG 3.3Å; H135-S140 WeakPolarHBondContact CA-OG 3.5Å; H135-S140 PolarHBondContact ND1-OG 3.22Å; S140-L142 PolarHBondContact O-N 3.4Å |
| 141 | T | 84.5 | Confident | 91.2 | Very high | 132 Ų | 132 | 64.8 Ų | 64.8 | 81% | 0.81 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -26.8 | 175.4 | 49.9 | 0 | 0 | 0 | 0 | 111.9 | K139 K143 | K139-T141 PolarHBondContact O-N 3.03Å; K139-T141 VanDerWaalsContact O-N 3.07Å; T141-K143 PolarHBondContact O-N 3.16Å |
| 142 | L | 82.3 | Confident | 90.9 | Very high | 85 Ų | 85 | 62.3 Ų | 62.3 | 45% | 0.445 | 33% | 0.334 | S | S | . | . | S | Bend | trans | -83.2 | 99.1 | 172.3 | -151.6 | 77.5 | 0 | 0 | 0 | 109.5 | K139 S140 D144 R147 A148 | K139-L142 WeakPolarHBondContact O-CB 3.28Å; K139-L142 PolarHBondContact O-N 3.28Å; S140-L142 PolarHBondContact O-N 3.4Å; L142-D144 PolarHBondContact O-N 3.09Å; L142-R147 HydrophobicContact CD2-CB 3.95Å; L142-A148 HydrophobicContact CD2-CB 4Å |
| 143 | K | 85.8 | Confident | 90.7 | Very high | 212 Ų | 212 | 60.5 Ų | 60.5 | 92% | 0.922 | 34% | 0.337 | S | S | * | . | S | Bend | trans | -65.4 | 8 | 178.8 | -63.3 | -176.8 | 178.6 | -179.1 | 0 | 115 | T141 | T141-K143 PolarHBondContact O-N 3.16Š|
| 144 | D | 89.1 | Confident | 90.6 | Very high | 27 Ų | 27 | 63.7 Ų | 63.7 | 14% | 0.144 | 35% | 0.353 | C | S | . | . | trans | -121.6 | 95.6 | 175.6 | -176 | -22.4 | 0 | 0 | 0 | 109 | L142 K146 R147 A148 | L142-D144 PolarHBondContact O-N 3.09Å; D144-K146 PolarHBondContact O-N 2.87Å; D144-K146 WeakPolarHBondContact OD1-CA 3.41Å; D144-K146 WeakPolarHBondContact OD1-CB 3.01Å; D144-K146 PolarHBondContact OD1-N 3.03Å; D144-R147 HydrophobicContact CB-CB 4.19Å; D144-R147 HydrophobicContact CB-CG 4.27Å; D144-R147 PolarHBondContact O-N 3.08Å; D144-R147 PolarHBondContact OD1-N 3.49Å; D144-R147 WeakPolarHBondContact OD2-CD 3.25Å; D144-R147 VanDerWaalsContact OD2-CG 3.27Å; D144-R147 WeakPolarHBondContact OD2-CG 3.43Å; D144-R147 IonicContact OD2-NE 3.62Å; D144-R147 PolarHBondContact OD2-NE 2.92Å; D144-A148 PolarHBondContact O-N 3.44Å | ||
| 145 | W | 92.1 | Very high | 90.5 | Very high | 24 Ų | 24 | 66.5 Ų | 66.5 | 9% | 0.091 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -65.8 | -26.9 | 179.8 | 66.2 | -89.3 | 0 | 0 | 0 | 112.6 | F111 P114 I116 P130 V134 R147 A148 I149 L156 F167 | F111-W145 AromaticContact CE2-CH2 3.8Å; F111-W145 HydrophobicContact CE2-CH2 3.8Å; F111-W145 HydrophobicContact CE2-CZ3 4Å; F111-W145 HydrophobicContact CZ-CH2 4.04Å; F111-W145 HydrophobicContact CZ-CZ3 4.33Å; P114-W145 VanDerWaalsContact O-CZ2 3.32Å; P114-W145 WeakPolarHBondContact O-CZ2 3.3Å; I116-W145 HydrophobicContact CB-CZ2 4.26Å; I116-W145 HydrophobicContact CG1-CG 4.37Å; P130-W145 HydrophobicContact CB-CD2 4.14Å; P130-W145 HydrophobicContact CB-CE3 3.47Å; P130-W145 VanDerWaalsContact CB-CE3 3.47Å; P130-W145 HydrophobicContact CB-CZ3 3.7Å; P130-W145 HydrophobicContact CG-CE3 4.3Å; P130-W145 HydrophobicContact CG-CZ3 4.02Å; V134-W145 HydrophobicContact CG2-CB 4.11Å; W145-R147 VanDerWaalsContact C-N 3.3Å; W145-R147 PolarHBondContact O-N 3.11Å; W145-A148 PolarHBondContact O-N 3.4Å; W145-I149 HydrophobicContact CE3-CD1 4.14Å; W145-I149 WeakPolarHBondContact O-CG1 3.35Å; W145-I149 PolarHBondContact O-N 2.87Å; W145-I149 VanDerWaalsContact O-N 3.09Å; W145-L156 HydrophobicContact CE3-CD2 4.42Å; W145-L156 HydrophobicContact CZ3-CD2 3.84Å; W145-F167 HydrophobicContact CH2-CE1 4.24Å |
| 146 | K | 92.4 | Very high | 90.5 | Very high | 9 Ų | 9 | 61 Ų | 61 | 4% | 0.039 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -72.9 | -23 | 176.8 | -60.8 | -175.7 | 165.5 | -171.5 | 0 | 112 | D144 L156 R157 M160 C178 | D144-K146 PolarHBondContact O-N 2.87Å; D144-K146 WeakPolarHBondContact OD1-CA 3.41Å; D144-K146 WeakPolarHBondContact OD1-CB 3.01Å; D144-K146 PolarHBondContact OD1-N 3.03Å; K146-L156 PolarHBondContact O-N 3.02Å; K146-R157 HydrophobicContact CB-CB 3.78Å; K146-R157 HydrophobicContact CB-CG 4.47Å; K146-R157 PolarHBondContact O-N 3.06Å; K146-M160 HydrophobicContact CD-SD 3.76Å; K146-M160 VanDerWaalsContact CE-SD 3.54Å; K146-M160 HydrophobicContact CG-SD 4.32Å; K146-C178 PolarHBondContact NZ-O 2.98Å |
| 147 | R | 92.3 | Very high | 90.5 | Very high | 132 Ų | 132 | 58.1 Ų | 58.1 | 50% | 0.498 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -86.6 | -30.3 | 168.1 | -71 | 176.7 | -166.7 | -111.8 | -3.4 | 113.4 | L142 D144 W145 M155 | L142-R147 HydrophobicContact CD2-CB 3.95Å; D144-R147 HydrophobicContact CB-CB 4.19Å; D144-R147 HydrophobicContact CB-CG 4.27Å; D144-R147 PolarHBondContact O-N 3.08Å; D144-R147 PolarHBondContact OD1-N 3.49Å; D144-R147 WeakPolarHBondContact OD2-CD 3.25Å; D144-R147 VanDerWaalsContact OD2-CG 3.27Å; D144-R147 WeakPolarHBondContact OD2-CG 3.43Å; D144-R147 IonicContact OD2-NE 3.62Å; D144-R147 PolarHBondContact OD2-NE 2.92Å; W145-R147 VanDerWaalsContact C-N 3.3Å; W145-R147 PolarHBondContact O-N 3.11Å; R147-M155 HydrophobicContact CG-SD 4.47Å |
| 148 | A | 93.6 | Very high | 90.4 | Very high | 9 Ų | 9 | 64 Ų | 64 | 7% | 0.074 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -69.8 | -37.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | C99 V134 K139 L142 D144 W145 | C99-A148 PolarHBondContact SG-O 2.82Å; V134-A148 HydrophobicContact CB-CB 4.47Å; V134-A148 HydrophobicContact CG1-CB 3.83Å; V134-A148 HydrophobicContact CG2-CB 3.73Å; K139-A148 HydrophobicContact CB-CB 4.31Å; L142-A148 HydrophobicContact CD2-CB 4Å; D144-A148 PolarHBondContact O-N 3.44Å; W145-A148 PolarHBondContact O-N 3.4Å |
| 149 | I | 94.7 | Very high | 90.4 | Very high | 2 Ų | 2 | 61.9 Ų | 61.9 | 1% | 0.01 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.5 | 142.5 | 177.6 | -59.9 | 178 | 0 | 0 | 0 | 110.7 | I97 T98 P130 F133 V134 W145 L156 | I97-I149 HydrophobicContact CB-CG2 3.84Å; I97-I149 HydrophobicContact CD1-CD1 4.5Å; I97-I149 HydrophobicContact CD1-CG2 3.9Å; I97-I149 HydrophobicContact CG1-CG2 4.47Å; I97-I149 HydrophobicContact CG2-CG2 3.9Å; T98-I149 CarbonylContact O-C 3.53Å; T98-I149 WeakPolarHBondContact O-CA 3.5Å; P130-I149 HydrophobicContact CB-CD1 3.84Å; F133-I149 HydrophobicContact CD1-CD1 3.97Å; F133-I149 HydrophobicContact CD1-CG1 4.08Å; F133-I149 HydrophobicContact CE1-CG1 4.31Å; V134-I149 HydrophobicContact CG2-CD1 4.04Å; V134-I149 HydrophobicContact CG2-CG1 3.69Å; W145-I149 HydrophobicContact CE3-CD1 4.14Å; W145-I149 WeakPolarHBondContact O-CG1 3.35Å; W145-I149 PolarHBondContact O-N 2.87Å; W145-I149 VanDerWaalsContact O-N 3.09Å; I149-L156 HydrophobicContact CB-CB 4.24Å; I149-L156 HydrophobicContact CB-CD2 4.18Å; I149-L156 HydrophobicContact CG2-CB 4.24Å; I149-L156 HydrophobicContact CG2-CD2 4.07Å; I149-L156 WeakPolarHBondContact O-CB 3.35Å; I149-L156 PolarHBondContact O-N 2.9Å |
| 150 | R | 94.6 | Very high | 90.5 | Very high | 103 Ų | 103 | 58.7 Ų | 58.7 | 39% | 0.389 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.4 | 146.5 | 178.4 | -68.3 | 171.7 | 180 | -94.1 | -1 | 112.1 | I97 T98 G153 I154 | I97-R150 CarbonylContact C-O 3.43Å; I97-R150 VanDerWaalsContact CA-O 3.24Å; I97-R150 WeakPolarHBondContact CA-O 3.14Å; T98-R150 PolarHBondContact N-O 3.32Å; T98-R150 PolarHBondContact O-N 3.37Å; R150-G153 WeakPolarHBondContact CD-O 3.26Å; R150-G153 PolarHBondContact NH1-O 3.48Å; R150-I154 CarbonylContact C-O 3.51Å; R150-I154 WeakPolarHBondContact CA-O 3.34Å; R150-I154 WeakPolarHBondContact CB-O 3.39Å |
| 151 | L | 93.3 | Very high | 90.6 | Very high | 12 Ų | 12 | 61 Ų | 61 | 6% | 0.063 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 121 | 172.2 | -79.1 | 167.9 | 0 | 0 | 0 | 107.9 | Y95 I97 G153 I154 L156 M159 I165 | Y95-L151 HydrophobicContact CG-CD2 4.4Å; I97-L151 HydrophobicContact CG2-CD2 3.37Å; I97-L151 HydrophobicContact CG2-CG 3.86Å; L151-G153 PolarHBondContact O-N 3.3Å; L151-I154 PolarHBondContact N-O 2.87Å; L151-I154 WeakPolarHBondContact O-CA 3.43Å; L151-I154 WeakPolarHBondContact O-CB 3.39Å; L151-I154 PolarHBondContact O-N 2.79Å; L151-L156 HydrophobicContact CD1-CD1 3.61Å; L151-L156 HydrophobicContact CG-CD1 4.38Å; L151-M159 HydrophobicContact CB-CG 4.32Å; L151-M159 HydrophobicContact CD1-CB 4.29Å; L151-M159 HydrophobicContact CD1-CG 4.25Å; L151-I165 HydrophobicContact CD1-CD1 3.93Å; L151-I165 HydrophobicContact CD1-CG2 3.55Å |
| 152 | G | 88.4 | Confident | 90.7 | Very high | 70 Ų | 70 | 57.8 Ų | 57.8 | 72% | 0.722 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.6 | 29.3 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | I154 | G152-I154 VanDerWaalsContact C-N 3.27Å; G152-I154 PolarHBondContact O-N 3.28Å |
| 153 | G | 89.4 | Confident | 90.7 | Very high | 42 Ų | 42 | 56.5 Ų | 56.5 | 43% | 0.433 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 82.2 | -18.2 | -172.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | R150 L151 | R150-G153 WeakPolarHBondContact CD-O 3.26Å; R150-G153 PolarHBondContact NH1-O 3.48Å; L151-G153 PolarHBondContact O-N 3.3Å |
| 154 | I | 92 | Very high | 90.6 | Very high | 66 Ų | 66 | 52.3 Ų | 52.3 | 34% | 0.338 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.2 | 137.2 | 176.8 | -53.1 | 175.5 | 0 | 0 | 0 | 109.6 | R150 L151 G152 L156 K158 M159 | R150-I154 CarbonylContact C-O 3.51Å; R150-I154 WeakPolarHBondContact CA-O 3.34Å; R150-I154 WeakPolarHBondContact CB-O 3.39Å; L151-I154 PolarHBondContact N-O 2.87Å; L151-I154 WeakPolarHBondContact O-CA 3.43Å; L151-I154 WeakPolarHBondContact O-CB 3.39Å; L151-I154 PolarHBondContact O-N 2.79Å; G152-I154 VanDerWaalsContact C-N 3.27Å; G152-I154 PolarHBondContact O-N 3.28Å; I154-L156 PolarHBondContact O-N 3.44Å; I154-K158 HydrophobicContact CG2-CB 4.15Å; I154-K158 HydrophobicContact CG2-CD 4.16Å; I154-K158 HydrophobicContact CG2-CG 4.37Å; I154-M159 HydrophobicContact CB-CG 4.21Å; I154-M159 HydrophobicContact CB-SD 3.94Å; I154-M159 HydrophobicContact CD1-SD 3.82Å; I154-M159 HydrophobicContact CG1-SD 4.48Å; I154-M159 HydrophobicContact CG2-CG 3.9Å; I154-M159 HydrophobicContact CG2-SD 3.69Å |
| 155 | M | 92.9 | Very high | 90.6 | Very high | 66 Ų | 66 | 51.3 Ų | 51.3 | 33% | 0.325 | 29% | 0.286 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.2 | 132.4 | 176.7 | -68.6 | 174.1 | -73.3 | 0 | 0 | 111.1 | R147 R157 K158 M159 | R147-M155 HydrophobicContact CG-SD 4.47Å; M155-R157 PolarHBondContact O-N 3.25Å; M155-K158 WeakPolarHBondContact O-CB 3.46Å; M155-K158 PolarHBondContact O-N 2.99Å; M155-M159 PolarHBondContact O-N 3.4Å |
| 156 | L | 92.9 | Very high | 90.5 | Very high | 1 Ų | 1 | 52.5 Ų | 52.5 | 1% | 0.005 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -52.6 | -42.5 | -179 | 175 | 62.4 | 0 | 0 | 0 | 111.3 | L106 F111 W145 K146 I149 L151 I154 K158 M159 M160 I165 | L106-L156 HydrophobicContact CD2-CD1 4.49Å; F111-L156 HydrophobicContact CZ-CD2 4.33Å; W145-L156 HydrophobicContact CE3-CD2 4.42Å; W145-L156 HydrophobicContact CZ3-CD2 3.84Å; K146-L156 PolarHBondContact O-N 3.02Å; I149-L156 HydrophobicContact CB-CB 4.24Å; I149-L156 HydrophobicContact CB-CD2 4.18Å; I149-L156 HydrophobicContact CG2-CB 4.24Å; I149-L156 HydrophobicContact CG2-CD2 4.07Å; I149-L156 WeakPolarHBondContact O-CB 3.35Å; I149-L156 PolarHBondContact O-N 2.9Å; L151-L156 HydrophobicContact CD1-CD1 3.61Å; L151-L156 HydrophobicContact CG-CD1 4.38Å; I154-L156 PolarHBondContact O-N 3.44Å; L156-K158 VanDerWaalsContact C-N 3.29Å; L156-K158 PolarHBondContact O-N 2.95Å; L156-M159 WeakPolarHBondContact O-CB 3.37Å; L156-M159 PolarHBondContact O-N 3.42Å; L156-M160 HydrophobicContact CD1-CG 4.29Å; L156-M160 HydrophobicContact CG-CG 4.38Å; L156-M160 HydrophobicContact CG-SD 4.3Å; L156-M160 WeakPolarHBondContact O-CG 3.32Å; L156-M160 PolarHBondContact O-N 3.46Å; L156-I165 HydrophobicContact CD1-CG2 4.18Å |
| 157 | R | 91.8 | Very high | 90.5 | Very high | 24 Ų | 24 | 52.3 Ų | 52.3 | 9% | 0.091 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -50.1 | -45.5 | 174.7 | -175.9 | 61.4 | -160.3 | -111.4 | 3.4 | 112.6 | K146 M155 M159 M160 D161 S180 D184 | K146-R157 HydrophobicContact CB-CB 3.78Å; K146-R157 HydrophobicContact CB-CG 4.47Å; K146-R157 PolarHBondContact O-N 3.06Å; M155-R157 PolarHBondContact O-N 3.25Å; R157-M159 VanDerWaalsContact C-N 3.34Å; R157-M159 PolarHBondContact O-N 3.47Å; R157-M160 PolarHBondContact O-N 3.16Å; R157-D161 WeakPolarHBondContact CG-OD2 3.48Å; R157-D161 IonicContact CZ-OD1 3.18Å; R157-D161 IonicContact NE-OD1 2.69Å; R157-D161 PolarHBondContact NE-OD1 2.97Å; R157-D161 IonicContact NE-OD2 2.73Å; R157-D161 PolarHBondContact NE-OD2 3.18Å; R157-D161 VanDerWaalsContact NE-OD2 3.16Å; R157-D161 IonicContact NH2-OD1 2.89Å; R157-D161 PolarHBondContact NH2-OD1 2.94Å; R157-D161 WeakPolarHBondContact O-CB 3.43Å; R157-D161 PolarHBondContact O-N 3.39Å; R157-D161 VanDerWaalsContact O-OD2 3.08Å; R157-S180 PolarHBondContact NH1-O 2.9Å; R157-D184 IonicContact CZ-OD2 3.63Å; R157-D184 IonicContact NH1-OD2 3.51Å; R157-D184 IonicContact NH2-OD1 3.37Å; R157-D184 PolarHBondContact NH2-OD1 3.14Å; R157-D184 IonicContact NH2-OD2 2.76Å; R157-D184 PolarHBondContact NH2-OD2 3.06Å |
| 158 | K | 90.9 | Very high | 90.4 | Very high | 137 Ų | 137 | 49.4 Ų | 49.4 | 60% | 0.596 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -68.8 | -31.2 | 179.7 | -174.4 | 177.1 | 178.6 | -175.8 | 0 | 112.6 | I154 M155 L156 S162 | I154-K158 HydrophobicContact CG2-CB 4.15Å; I154-K158 HydrophobicContact CG2-CD 4.16Å; I154-K158 HydrophobicContact CG2-CG 4.37Å; M155-K158 WeakPolarHBondContact O-CB 3.46Å; M155-K158 PolarHBondContact O-N 2.99Å; L156-K158 VanDerWaalsContact C-N 3.29Å; L156-K158 PolarHBondContact O-N 2.95Å; K158-S162 WeakPolarHBondContact O-CB 3.27Å; K158-S162 PolarHBondContact O-N 3.14Å; K158-S162 VanDerWaalsContact O-N 3.1Å; K158-S162 PolarHBondContact O-OG 3.12Å |
| 159 | M | 90.5 | Very high | 90.1 | Very high | 10 Ų | 10 | 52.6 Ų | 52.6 | 5% | 0.049 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -74.8 | -28.6 | 175.6 | -57.7 | -67.8 | -68.5 | 0 | 0 | 112.3 | V68 L151 I154 M155 L156 R157 S162 Q164 I165 | V68-M159 HydrophobicContact CG2-CE 4.27Å; L151-M159 HydrophobicContact CB-CG 4.32Å; L151-M159 HydrophobicContact CD1-CB 4.29Å; L151-M159 HydrophobicContact CD1-CG 4.25Å; I154-M159 HydrophobicContact CB-CG 4.21Å; I154-M159 HydrophobicContact CB-SD 3.94Å; I154-M159 HydrophobicContact CD1-SD 3.82Å; I154-M159 HydrophobicContact CG1-SD 4.48Å; I154-M159 HydrophobicContact CG2-CG 3.9Å; I154-M159 HydrophobicContact CG2-SD 3.69Å; M155-M159 PolarHBondContact O-N 3.4Å; L156-M159 WeakPolarHBondContact O-CB 3.37Å; L156-M159 PolarHBondContact O-N 3.42Å; R157-M159 VanDerWaalsContact C-N 3.34Å; R157-M159 PolarHBondContact O-N 3.47Å; M159-S162 PolarHBondContact O-OG 3.13Å; M159-S162 VanDerWaalsContact O-OG 3.09Å; M159-Q164 HydrophobicContact CE-CB 4.11Å; M159-Q164 PolarHBondContact O-N 2.73Å; M159-Q164 VanDerWaalsContact O-N 3.12Å; M159-I165 HydrophobicContact CB-CG2 3.49Å; M159-I165 VanDerWaalsContact CB-CG2 3.49Å; M159-I165 PolarHBondContact O-N 3.01Å; M159-I165 VanDerWaalsContact O-N 3.13Å |
| 160 | M | 91.2 | Very high | 89.8 | Confident | 13 Ų | 13 | 53.8 Ų | 53.8 | 6% | 0.064 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -74 | -48.2 | 169.8 | -58 | -177.3 | 81.5 | 0 | 0 | 111.3 | F111 K146 L156 R157 S162 G163 I165 D166 F167 | F111-M160 HydrophobicContact CE1-CE 3.88Å; F111-M160 HydrophobicContact CE1-SD 4.47Å; F111-M160 HydrophobicContact CZ-CE 3.93Å; F111-M160 HydrophobicContact CZ-SD 4.19Å; K146-M160 HydrophobicContact CD-SD 3.76Å; K146-M160 VanDerWaalsContact CE-SD 3.54Å; K146-M160 HydrophobicContact CG-SD 4.32Å; L156-M160 HydrophobicContact CD1-CG 4.29Å; L156-M160 HydrophobicContact CG-CG 4.38Å; L156-M160 HydrophobicContact CG-SD 4.3Å; L156-M160 WeakPolarHBondContact O-CG 3.32Å; L156-M160 PolarHBondContact O-N 3.46Å; R157-M160 PolarHBondContact O-N 3.16Å; M160-S162 PolarHBondContact O-N 3.49Å; M160-G163 PolarHBondContact O-N 3Å; M160-I165 VanDerWaalsContact CA-O 3.23Å; M160-I165 WeakPolarHBondContact CA-O 3.41Å; M160-I165 VanDerWaalsContact CG-O 3.28Å; M160-I165 WeakPolarHBondContact CG-O 3.43Å; M160-D166 VanDerWaalsContact CE-OD1 3.28Å; M160-D166 WeakPolarHBondContact CE-OD1 3.25Å; M160-F167 HydrophobicContact CE-CD1 4.11Å; M160-F167 HydrophobicContact CE-CD2 3.68Å; M160-F167 HydrophobicContact CE-CE1 3.88Å; M160-F167 HydrophobicContact CE-CE2 3.45Å; M160-F167 VanDerWaalsContact CE-CE2 3.45Å; M160-F167 HydrophobicContact CE-CG 4.04Å; M160-F167 HydrophobicContact CE-CZ 3.59Å |
| 161 | D | 87.7 | Confident | 89.2 | Confident | 105 Ų | 105 | 55 Ų | 55 | 56% | 0.561 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.8 | -24.2 | 179.4 | -61.1 | -33 | 0 | 0 | 0 | 112.1 | R157 | R157-D161 WeakPolarHBondContact CG-OD2 3.48Å; R157-D161 IonicContact CZ-OD1 3.18Å; R157-D161 IonicContact NE-OD1 2.69Å; R157-D161 PolarHBondContact NE-OD1 2.97Å; R157-D161 IonicContact NE-OD2 2.73Å; R157-D161 PolarHBondContact NE-OD2 3.18Å; R157-D161 VanDerWaalsContact NE-OD2 3.16Å; R157-D161 IonicContact NH2-OD1 2.89Å; R157-D161 PolarHBondContact NH2-OD1 2.94Å; R157-D161 WeakPolarHBondContact O-CB 3.43Å; R157-D161 PolarHBondContact O-N 3.39Å; R157-D161 VanDerWaalsContact O-OD2 3.08Å |
| 162 | S | 86.4 | Confident | 88.8 | Confident | 65 Ų | 65 | 60.1 Ų | 60.1 | 46% | 0.455 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.8 | -6.1 | 173.3 | 69.8 | 0 | 0 | 0 | 0 | 114.8 | K158 M159 M160 Q164 | K158-S162 WeakPolarHBondContact O-CB 3.27Å; K158-S162 PolarHBondContact O-N 3.14Å; K158-S162 VanDerWaalsContact O-N 3.1Å; K158-S162 PolarHBondContact O-OG 3.12Å; M159-S162 PolarHBondContact O-OG 3.13Å; M159-S162 VanDerWaalsContact O-OG 3.09Å; M160-S162 PolarHBondContact O-N 3.49Å; S162-Q164 PolarHBondContact O-N 2.73Å |
| 163 | G | 83.1 | Confident | 88.6 | Confident | 57 Ų | 57 | 59.8 Ų | 59.8 | 59% | 0.588 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71 | 6.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | M160 | M160-G163 PolarHBondContact O-N 3Š|
| 164 | Q | 83.4 | Confident | 88.6 | Confident | 125 Ų | 125 | 60.3 Ų | 60.3 | 58% | 0.584 | 32% | 0.318 | S | S | * | . | S | Bend | trans | -74.6 | -26.1 | 178.8 | -70.8 | -178.2 | -7 | 0 | 0 | 113 | M159 S162 | M159-Q164 HydrophobicContact CE-CB 4.11Å; M159-Q164 PolarHBondContact O-N 2.73Å; M159-Q164 VanDerWaalsContact O-N 3.12Å; S162-Q164 PolarHBondContact O-N 2.73Å |
| 165 | I | 89.1 | Confident | 88.2 | Confident | 6 Ų | 6 | 59.3 Ų | 59.3 | 3% | 0.031 | 32% | 0.317 | C | S | . | . | S | Bend | trans | -151.3 | 105.8 | 167 | -172.1 | -175.8 | 0 | 0 | 0 | 108.8 | Y95 L106 L151 L156 M159 M160 | Y95-I165 HydrophobicContact CD2-CD1 3.38Å; Y95-I165 HydrophobicContact CD2-CG1 4.34Å; Y95-I165 HydrophobicContact CE2-CD1 3.51Å; Y95-I165 HydrophobicContact CE2-CG1 3.97Å; Y95-I165 HydrophobicContact CG-CD1 3.98Å; L106-I165 HydrophobicContact CD2-CD1 3.87Å; L151-I165 HydrophobicContact CD1-CD1 3.93Å; L151-I165 HydrophobicContact CD1-CG2 3.55Å; L156-I165 HydrophobicContact CD1-CG2 4.18Å; M159-I165 HydrophobicContact CB-CG2 3.49Å; M159-I165 VanDerWaalsContact CB-CG2 3.49Å; M159-I165 PolarHBondContact O-N 3.01Å; M159-I165 VanDerWaalsContact O-N 3.13Å; M160-I165 VanDerWaalsContact CA-O 3.23Å; M160-I165 WeakPolarHBondContact CA-O 3.41Å; M160-I165 VanDerWaalsContact CG-O 3.28Å; M160-I165 WeakPolarHBondContact CG-O 3.43Å |
| 166 | D | 90.3 | Very high | 87.8 | Confident | 48 Ų | 48 | 62.9 Ų | 62.9 | 26% | 0.257 | 34% | 0.337 | S | S | . | . | trans | -107.8 | -179.8 | 169.9 | -154.7 | -6.5 | 0 | 0 | 0 | 110.2 | W108 M160 H170 | W108-D166 PolarHBondContact NE1-O 3.23Å; M160-D166 VanDerWaalsContact CE-OD1 3.28Å; M160-D166 WeakPolarHBondContact CE-OD1 3.25Å; D166-H170 IonicContact OD1-CE1 3.16Å; D166-H170 IonicContact OD1-CG 3.44Å; D166-H170 IonicContact OD1-ND1 2.79Å; D166-H170 PolarHBondContact OD1-ND1 3.36Å; D166-H170 VanDerWaalsContact OD1-ND1 3.16Å; D166-H170 IonicContact OD2-CE1 3.74Å; D166-H170 IonicContact OD2-CG 3.98Å; D166-H170 IonicContact OD2-ND1 3.16Å; D166-H170 PolarHBondContact OD2-ND1 3.17Å | ||
| 167 | F | 92.1 | Very high | 87.4 | Confident | 6 Ų | 6 | 68 Ų | 68 | 3% | 0.026 | 37% | 0.369 | C | S | . | . | trans | -58.4 | 146.5 | 173 | -56.3 | -74 | 0 | 0 | 0 | 111.5 | F111 C113 P114 W145 M160 Q169 H170 C178 | F111-F167 AromaticContact CD1-CD1 3.89Å; F111-F167 HydrophobicContact CD1-CD1 3.89Å; F111-F167 HydrophobicContact CD2-CD1 4.2Å; F111-F167 HydrophobicContact CD2-CE1 4.46Å; F111-F167 AromaticContact CE1-CD1 3.6Å; F111-F167 HydrophobicContact CE1-CD1 3.6Å; F111-F167 HydrophobicContact CE1-CE1 4.03Å; F111-F167 HydrophobicContact CE1-CG 4.27Å; F111-F167 AromaticContact CE2-CD1 3.95Å; F111-F167 HydrophobicContact CE2-CD1 3.95Å; F111-F167 AromaticContact CE2-CE1 3.83Å; F111-F167 HydrophobicContact CE2-CE1 3.83Å; F111-F167 HydrophobicContact CG-CD1 4.19Å; F111-F167 AromaticContact CZ-CD1 3.64Å; F111-F167 HydrophobicContact CZ-CD1 3.64Å; F111-F167 AromaticContact CZ-CE1 3.59Å; F111-F167 HydrophobicContact CZ-CE1 3.59Å; F111-F167 CarbonylContact O-C 3.49Å; F111-F167 WeakPolarHBondContact O-CA 3.24Å; F111-F167 WeakPolarHBondContact O-CB 3.45Å; C113-F167 HydrophobicContact CB-CB 4.07Å; C113-F167 HydrophobicContact CB-CD1 4.37Å; C113-F167 HydrophobicContact CB-CD2 3.78Å; C113-F167 HydrophobicContact CB-CE2 4.19Å; C113-F167 HydrophobicContact CB-CG 3.84Å; P114-F167 VanDerWaalsContact C-CE1 3.43Å; P114-F167 WeakPolarHBondContact O-CE1 3.33Å; P114-F167 WeakPolarHBondContact O-CZ 3.36Å; W145-F167 HydrophobicContact CH2-CE1 4.24Å; M160-F167 HydrophobicContact CE-CD1 4.11Å; M160-F167 HydrophobicContact CE-CD2 3.68Å; M160-F167 HydrophobicContact CE-CE1 3.88Å; M160-F167 HydrophobicContact CE-CE2 3.45Å; M160-F167 VanDerWaalsContact CE-CE2 3.45Å; M160-F167 HydrophobicContact CE-CG 4.04Å; M160-F167 HydrophobicContact CE-CZ 3.59Å; F167-Q169 PolarHBondContact O-N 3.18Å; F167-H170 HydrophobicContact CB-CB 4.01Å; F167-H170 AromaticContact CD2-CD2 3.79Å; F167-H170 AromaticContact CD2-CE1 3.68Å; F167-H170 AromaticContact CD2-CG 3.87Å; F167-H170 AromaticContact CD2-ND1 3.82Å; F167-H170 AromaticContact CD2-NE2 3.64Å; F167-H170 PolarHBondContact O-N 2.69Å; F167-C178 HydrophobicContact CE2-CB 3.61Å; F167-C178 HydrophobicContact CZ-CB 3.98Å | ||
| 168 | Y | 90 | Very high | 87 | Confident | 70 Ų | 70 | 67.1 Ų | 67.1 | 28% | 0.275 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.1 | 123.5 | 173.8 | -174.4 | -106.8 | 0 | 0 | 0 | 110 | W108 F111 H170 | W108-Y168 HydrophobicContact CE3-CD2 4.44Å; W108-Y168 HydrophobicContact CH2-CD2 4.33Å; W108-Y168 HydrophobicContact CZ2-CD2 4.42Å; W108-Y168 HydrophobicContact CZ3-CD2 4.34Å; W108-Y168 WeakPolarHBondContact O-CB 3.33Å; F111-Y168 PolarHBondContact O-N 3.45Å; Y168-H170 VanDerWaalsContact C-N 3.33Å; Y168-H170 PolarHBondContact O-N 2.99Å |
| 169 | Q | 87.4 | Confident | 86.5 | Confident | 76 Ų | 76 | 67.2 Ų | 67.2 | 36% | 0.355 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.5 | 38 | -175.5 | -55 | -177.3 | 14.7 | 0 | 0 | 114.7 | F167 D171 K172 V173 | F167-Q169 PolarHBondContact O-N 3.18Å; Q169-D171 WeakPolarHBondContact CA-OD1 3.39Å; Q169-D171 PolarHBondContact O-N 2.98Å; Q169-D171 VanDerWaalsContact O-N 3.12Å; Q169-K172 PolarHBondContact O-N 2.8Å; Q169-V173 HydrophobicContact CB-CG2 4.42Å; Q169-V173 PolarHBondContact O-N 3.28Å |
| 170 | H | 88.6 | Confident | 85.1 | Confident | 28 Ų | 28 | 68.5 Ų | 68.5 | 13% | 0.13 | 37% | 0.373 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | -24 | -179.2 | -163.4 | -164.2 | 0 | 0 | 0 | 114.5 | D166 F167 Y168 K172 C178 | D166-H170 IonicContact OD1-CE1 3.16Å; D166-H170 IonicContact OD1-CG 3.44Å; D166-H170 IonicContact OD1-ND1 2.79Å; D166-H170 PolarHBondContact OD1-ND1 3.36Å; D166-H170 VanDerWaalsContact OD1-ND1 3.16Å; D166-H170 IonicContact OD2-CE1 3.74Å; D166-H170 IonicContact OD2-CG 3.98Å; D166-H170 IonicContact OD2-ND1 3.16Å; D166-H170 PolarHBondContact OD2-ND1 3.17Å; F167-H170 HydrophobicContact CB-CB 4.01Å; F167-H170 AromaticContact CD2-CD2 3.79Å; F167-H170 AromaticContact CD2-CE1 3.68Å; F167-H170 AromaticContact CD2-CG 3.87Å; F167-H170 AromaticContact CD2-ND1 3.82Å; F167-H170 AromaticContact CD2-NE2 3.64Å; F167-H170 PolarHBondContact O-N 2.69Å; Y168-H170 VanDerWaalsContact C-N 3.33Å; Y168-H170 PolarHBondContact O-N 2.99Å; H170-K172 VanDerWaalsContact C-N 3.29Å; H170-K172 PolarHBondContact O-N 2.72Å; H170-C178 PolarHBondContact NE2-SG 3.38Å |
| 171 | D | 82.4 | Confident | 83 | Confident | 128 Ų | 128 | 73.1 Ų | 73.1 | 68% | 0.684 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.4 | -29.7 | 173.8 | 60 | -47.5 | 0 | 0 | 0 | 113.2 | Q169 | Q169-D171 WeakPolarHBondContact CA-OD1 3.39Å; Q169-D171 PolarHBondContact O-N 2.98Å; Q169-D171 VanDerWaalsContact O-N 3.12Å |
| 172 | K | 84.3 | Confident | 81.1 | Confident | 119 Ų | 119 | 77.9 Ų | 77.9 | 52% | 0.517 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -111.9 | -31.4 | -176.9 | -65.9 | 166.9 | -169 | -177.5 | 0 | 112.7 | Q169 H170 | Q169-K172 PolarHBondContact O-N 2.8Å; H170-K172 VanDerWaalsContact C-N 3.29Å; H170-K172 PolarHBondContact O-N 2.72Å |
| 173 | V | 83.4 | Confident | 79.2 | Confident | 64 Ų | 64 | 81.4 Ų | 81.4 | 39% | 0.388 | 43% | 0.425 | S | S | . | . | trans | -119.7 | 82.1 | -175.1 | -170.5 | 0 | 0 | 0 | 0 | 108.4 | V112 C113 Q169 | V112-V173 HydrophobicContact CG1-CB 4.41Å; V112-V173 HydrophobicContact CG1-CG1 3.66Å; C113-V173 WeakPolarHBondContact CB-O 3.35Å; Q169-V173 HydrophobicContact CB-CG2 4.42Å; Q169-V173 PolarHBondContact O-N 3.28Å | ||
| 174 | C | 89.4 | Confident | 77.5 | Confident | 52 Ų | 52 | 79.8 Ų | 79.8 | 35% | 0.351 | 40% | 0.403 | S | S | . | . | trans | -118.5 | 126.8 | 174.2 | -174.9 | 0 | 0 | 0 | 0 | 110.8 | N176 | C174-N176 VanDerWaalsContact C-N 3.29Å; C174-N176 PolarHBondContact O-N 2.67Å; C174-N176 PolarHBondContact SG-N 3.33Å; C174-N176 VanDerWaalsContact SG-N 3.35Å; C174-N176 PolarHBondContact SG-OD1 3.31Å | ||
| 175 | S | 85 | Confident | 76 | Confident | 46 Ų | 46 | 80.4 Ų | 80.4 | 32% | 0.322 | 41% | 0.409 | S | S | . | . | trans | -87.5 | 5.7 | 176.3 | 70.1 | 0 | 0 | 0 | 0 | 113.9 | C113 P114 T177 | C113-S175 PolarHBondContact SG-N 2.76Å; P114-S175 WeakPolarHBondContact CB-OG 3.47Å; P114-S175 WeakPolarHBondContact CD-OG 3.42Å; S175-T177 PolarHBondContact O-N 2.79Å; S175-T177 PolarHBondContact O-OG1 3.13Å; S175-T177 PolarHBondContact OG-OG1 2.89Å | ||
| 176 | N | 83.3 | Confident | 74.2 | Confident | 141 Ų | 141 | 85.9 Ų | 85.9 | 75% | 0.754 | 44% | 0.438 | S | S | * | . | S | Bend | trans | 53.5 | -8.1 | -174.5 | -66.7 | -40.8 | 0 | 0 | 0 | 117.3 | C174 | C174-N176 VanDerWaalsContact C-N 3.29Å; C174-N176 PolarHBondContact O-N 2.67Å; C174-N176 PolarHBondContact SG-N 3.33Å; C174-N176 VanDerWaalsContact SG-N 3.35Å; C174-N176 PolarHBondContact SG-OD1 3.31Å |
| 177 | T | 84.6 | Confident | 72.4 | Confident | 108 Ų | 108 | 88 Ų | 88 | 66% | 0.663 | 45% | 0.449 | S | S | * | . | trans | -94.4 | 0.3 | 179.7 | 44 | 0 | 0 | 0 | 0 | 113.3 | S175 | S175-T177 PolarHBondContact O-N 2.79Å; S175-T177 PolarHBondContact O-OG1 3.13Å; S175-T177 PolarHBondContact OG-OG1 2.89Å | ||
| 178 | C | 83.8 | Confident | 70.2 | Confident | 6 Ų | 6 | 90.6 Ų | 90.6 | 4% | 0.041 | 47% | 0.467 | C | S | . | . | trans | -84.3 | -17.8 | -171.5 | 72.1 | 0 | 0 | 0 | 0 | 114.8 | C113 P114 K146 F167 H170 | C113-C178 WeakPolarHBondContact SG-CB 3.19Å; C113-C178 VanDerWaalsContact SG-SG 3.61Å; P114-C178 HydrophobicContact CB-CB 3.96Å; K146-C178 PolarHBondContact NZ-O 2.98Å; F167-C178 HydrophobicContact CE2-CB 3.61Å; F167-C178 HydrophobicContact CZ-CB 3.98Å; H170-C178 PolarHBondContact NE2-SG 3.38Å | ||
| 179 | R | 80.8 | Confident | 67.9 | Low | 139 Ų | 139 | 90.8 Ų | 90.8 | 53% | 0.525 | 48% | 0.479 | S | S | . | . | S | Bend | trans | -89.2 | 106.6 | 175.6 | -70.9 | -169.7 | 175.3 | -139 | -7 | 109.2 | S188 | R179-S188 PolarHBondContact NH1-OG 3.27Š|
| 180 | S | 60.3 | Low | 65.7 | Low | 37 Ų | 37 | 91.4 Ų | 91.4 | 26% | 0.259 | 50% | 0.497 | S | S | . | . | trans | -84.4 | 120.7 | -172.3 | -46.8 | 0 | 0 | 0 | 0 | 111.1 | R157 | R157-S180 PolarHBondContact NH1-O 2.9Š| ||
| 181 | T | 47.9 | Very low | 63.9 | Low | 110 Ų | 110 | 100.7 Ų | 100.7 | 68% | 0.675 | 53% | 0.531 | S | S | * | . | S | Bend | trans | 89.7 | 146.9 | 173 | 75.7 | 0 | 0 | 0 | 0 | 118.2 | F183 D184 | T181-F183 PolarHBondContact O-N 3.25Å; T181-D184 PolarHBondContact O-N 3.33Å |
| 182 | K | 48.3 | Very low | 61.5 | Low | 204 Ų | 204 | 99 Ų | 99 | 89% | 0.887 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.3 | -6.7 | -172.1 | -175.1 | 174 | 176.3 | 178.1 | 0 | 116.7 | ||
| 183 | F | 45.5 | Very low | 59.4 | Low | 140 Ų | 140 | 97.3 Ų | 97.3 | 61% | 0.614 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | -26.8 | -173.4 | -154.7 | -96.6 | 0 | 0 | 0 | 113.3 | T181 L185 L186 I187 | T181-F183 PolarHBondContact O-N 3.25Å; F183-L185 PolarHBondContact O-N 2.95Å; F183-L185 VanDerWaalsContact O-N 3.12Å; F183-L186 PolarHBondContact O-N 2.98Å; F183-L186 VanDerWaalsContact O-N 3.16Å; F183-I187 HydrophobicContact CD1-CD1 4.46Å |
| 184 | D | 48.1 | Very low | 57.4 | Low | 22 Ų | 22 | 100.7 Ų | 100.7 | 12% | 0.118 | 56% | 0.556 | C | S | . | * | H | α-helix | trans | -65 | -19.1 | -173.7 | -74.6 | -24.7 | 0 | 0 | 0 | 113.8 | R157 T181 L186 I187 S188 | R157-D184 IonicContact CZ-OD2 3.63Å; R157-D184 IonicContact NH1-OD2 3.51Å; R157-D184 IonicContact NH2-OD1 3.37Å; R157-D184 PolarHBondContact NH2-OD1 3.14Å; R157-D184 IonicContact NH2-OD2 2.76Å; R157-D184 PolarHBondContact NH2-OD2 3.06Å; T181-D184 PolarHBondContact O-N 3.33Å; D184-L186 PolarHBondContact O-N 3.33Å; D184-I187 PolarHBondContact O-N 3.2Å; D184-I187 VanDerWaalsContact O-N 3.08Å; D184-S188 PolarHBondContact O-N 3.03Å; D184-S188 PolarHBondContact O-OG 2.87Å |
| 185 | L | 51.2 | Low | 54.9 | Low | 139 Ų | 139 | 104.4 Ų | 104.4 | 73% | 0.728 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -59.7 | -31.8 | 174.9 | -65.9 | 175.5 | 0 | 0 | 0 | 112.6 | F183 S189 | F183-L185 PolarHBondContact O-N 2.95Å; F183-L185 VanDerWaalsContact O-N 3.12Å; L185-S189 PolarHBondContact O-N 3.4Å |
| 186 | L | 52.3 | Low | 52.7 | Low | 120 Ų | 120 | 105.4 Ų | 105.4 | 63% | 0.628 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -76.6 | -31 | 175.9 | -63.3 | 174.4 | 0 | 0 | 0 | 111.9 | F183 D184 S189 A190 | F183-L186 PolarHBondContact O-N 2.98Å; F183-L186 VanDerWaalsContact O-N 3.16Å; D184-L186 PolarHBondContact O-N 3.33Å; L186-S189 VanDerWaalsContact O-CB 3.32Å; L186-S189 WeakPolarHBondContact O-CB 3.48Å; L186-S189 PolarHBondContact O-N 2.86Å; L186-A190 PolarHBondContact O-N 2.7Å |
| 187 | I | 51.5 | Low | 50.6 | Low | 94 Ų | 94 | 106.9 Ų | 106.9 | 48% | 0.482 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -78.6 | -32.2 | 178.4 | -57.1 | 178.5 | 0 | 0 | 0 | 110.5 | F183 D184 S189 A190 R191 | F183-I187 HydrophobicContact CD1-CD1 4.46Å; D184-I187 PolarHBondContact O-N 3.2Å; D184-I187 VanDerWaalsContact O-N 3.08Å; I187-S189 PolarHBondContact O-N 2.81Å; I187-A190 WeakPolarHBondContact O-CB 3.33Å; I187-A190 PolarHBondContact O-N 3.25Å; I187-R191 PolarHBondContact O-N 2.9Å |
| 188 | S | 46.2 | Very low | 48.4 | Very low | 59 Ų | 59 | 111.2 Ų | 111.2 | 41% | 0.413 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -61.9 | -18.7 | 165.3 | -65.6 | 0 | 0 | 0 | 0 | 113.4 | R179 D184 | R179-S188 PolarHBondContact NH1-OG 3.27Å; D184-S188 PolarHBondContact O-N 3.03Å; D184-S188 PolarHBondContact O-OG 2.87Å |
| 189 | S | 41 | Very low | 46.2 | Very low | 75 Ų | 75 | 117 Ų | 117 | 52% | 0.524 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -86.6 | -19.5 | 171.6 | -158.3 | 0 | 0 | 0 | 0 | 112.9 | L185 L186 I187 P193 | L185-S189 PolarHBondContact O-N 3.4Å; L186-S189 VanDerWaalsContact O-CB 3.32Å; L186-S189 WeakPolarHBondContact O-CB 3.48Å; L186-S189 PolarHBondContact O-N 2.86Å; I187-S189 PolarHBondContact O-N 2.81Å; S189-P193 WeakPolarHBondContact O-CD 3.04Å |
| 190 | A | 42.8 | Very low | 43.9 | Very low | 88 Ų | 88 | 115.8 Ų | 115.8 | 73% | 0.727 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -83.2 | -13.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | L186 I187 | L186-A190 PolarHBondContact O-N 2.7Å; I187-A190 WeakPolarHBondContact O-CB 3.33Å; I187-A190 PolarHBondContact O-N 3.25Å |
| 191 | R | 49.7 | Very low | 43 | Very low | 223 Ų | 223 | 119.9 Ų | 119.9 | 84% | 0.842 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -95.1 | 107.4 | 161.8 | -169.1 | 168.8 | -173.2 | 145 | -0.2 | 107 | I187 | I187-R191 PolarHBondContact O-N 2.9Š|
| 192 | A | 32.8 | Very low | 42.2 | Very low | 93 Ų | 93 | 120.5 Ų | 120.5 | 77% | 0.769 | 69% | 0.687 | S | S | * | * | trans | -39.8 | 117.2 | -161.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 193 | P | 39 | Very low | 41.5 | Very low | 83 Ų | 83 | 119 Ų | 119 | 54% | 0.539 | 68% | 0.683 | S | S | . | * | trans | -64.3 | 138.3 | 165.5 | -19.8 | 32.7 | 0 | 0 | 0 | 110.8 | S189 | S189-P193 WeakPolarHBondContact O-CD 3.04Š| ||
| 194 | V | 42.6 | Very low | 40.7 | Very low | 136 Ų | 136 | 118 Ų | 118 | 82% | 0.824 | 69% | 0.689 | S | S | * | * | trans | -66 | 133.3 | 160.8 | 179.6 | 0 | 0 | 0 | 0 | 107.3 | G196 | V194-G196 PolarHBondContact O-N 2.68Å; V194-G196 VanDerWaalsContact O-N 3.16Å | ||
| 195 | P | 36.5 | Very low | 40.1 | Very low | 129 Ų | 129 | 123.1 Ų | 123.1 | 84% | 0.838 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -73.8 | 109 | -170.8 | 28.4 | -34.7 | 0 | 0 | 0 | 111.4 | ||
| 196 | G | 39.6 | Very low | 39.1 | Very low | 67 Ų | 67 | 123.1 Ų | 123.1 | 69% | 0.691 | 73% | 0.729 | S | S | * | * | trans | 178.5 | 27 | -177.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | V194 | V194-G196 PolarHBondContact O-N 2.68Å; V194-G196 VanDerWaalsContact O-N 3.16Å | ||
| 197 | Q | 38.7 | Very low | 38.1 | Very low | 172 Ų | 172 | 122.8 Ų | 122.8 | 80% | 0.804 | 74% | 0.737 | S | S | * | * | trans | -164.9 | 136.1 | 156.7 | -114.2 | 163.1 | 28.8 | 0 | 0 | 113.5 | ||||
| 198 | Q | 37.4 | Very low | 37.3 | Very low | 200 Ų | 200 | 123.1 Ų | 123.1 | 94% | 0.935 | 75% | 0.753 | S | S | * | * | trans | -114 | 103.4 | 174.4 | -59.8 | 178.7 | 28 | 0 | 0 | 108.8 | ||||
| 199 | T | 38.6 | Very low | 36.5 | Very low | 128 Ų | 128 | 128.5 Ų | 128.5 | 79% | 0.785 | 78% | 0.778 | S | S | * | * | trans | -94.3 | 118.1 | 177.5 | 38.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 200 | S | 31.6 | Very low | 35.9 | Very low | 113 Ų | 113 | 128.1 Ų | 128.1 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | trans | -69.8 | 142.5 | -176.9 | -171.3 | 0 | 0 | 0 | 0 | 112.5 | V202 | S200-V202 PolarHBondContact O-N 3.29Š| ||
| 201 | V | 41.5 | Very low | 35 | Very low | 122 Ų | 122 | 129.8 Ų | 129.8 | 74% | 0.739 | 79% | 0.792 | S | S | * | * | trans | -84.9 | 103 | -178.9 | -177.3 | 0 | 0 | 0 | 0 | 110.3 | Q203 | V201-Q203 HydrophobicContact CG1-CG 4.21Š| ||
| 202 | V | 32 | Very low | 34.2 | Very low | 124 Ų | 124 | 126.4 Ų | 126.4 | 75% | 0.752 | 79% | 0.789 | S | S | * | * | trans | -94.3 | 115.4 | 167.2 | -179.1 | 0 | 0 | 0 | 0 | 109.4 | S200 | S200-V202 PolarHBondContact O-N 3.29Š| ||
| 203 | Q | 32.1 | Very low | 34.1 | Very low | 172 Ų | 172 | 127.9 Ų | 127.9 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -93 | 135.2 | 170.7 | -62.7 | 179.3 | -7.4 | 0 | 0 | 109.8 | V201 | V201-Q203 HydrophobicContact CG1-CG 4.21Š| ||
| 204 | T | 29.6 | Very low | 33.6 | Very low | 120 Ų | 120 | 132.5 Ų | 132.5 | 74% | 0.736 | 80% | 0.803 | S | S | * | * | trans | -125.9 | 131.6 | 165.8 | 44 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 205 | P | 36.5 | Very low | 33.1 | Very low | 128 Ų | 128 | 133.4 Ų | 133.4 | 83% | 0.831 | 80% | 0.801 | S | S | * | * | trans | -84.2 | 137.8 | 177.4 | 32.9 | -32.8 | 0 | 0 | 0 | 111 | ||||
| 206 | T | 29.7 | Very low | 32.5 | Very low | 139 Ų | 139 | 132 Ų | 132 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | trans | -112.5 | 113.9 | 169.3 | -59.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 207 | S | 30.7 | Very low | 31.9 | Very low | 114 Ų | 114 | 135.6 Ų | 135.6 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | trans | -72.1 | 151.7 | 167.6 | -62 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 208 | A | 34.3 | Very low | 31.3 | Very low | 100 Ų | 100 | 133.4 Ų | 133.4 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | trans | -81.8 | 142.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 209 | D | 29 | Very low | 30.8 | Very low | 173 Ų | 173 | 132.6 Ų | 132.6 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | -151.2 | 166.1 | 122.2 | -137.3 | -27.2 | 0 | 0 | 0 | 110.2 | |||||
| 210 | G | 28.6 | Very low | 30.4 | Very low | 67 Ų | 67 | 136 Ų | 136 | 69% | 0.691 | 81% | 0.809 | S | S | * | * | trans | -122.7 | 157.5 | -168 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 211 | S | 25.3 | Very low | 30.1 | Very low | 122 Ų | 122 | 134.9 Ų | 134.9 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | -156 | 165.3 | 161.2 | -164.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 212 | I | 31.9 | Very low | 29.4 | Very low | 153 Ų | 153 | 136.7 Ų | 136.7 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | trans | -128.4 | 122.4 | -172 | -64.8 | 165.9 | 0 | 0 | 0 | 111 | ||||
| 213 | T | 30.5 | Very low | 29.3 | Very low | 123 Ų | 123 | 138.9 Ų | 138.9 | 76% | 0.755 | 81% | 0.805 | S | S | * | * | trans | -163 | 119.5 | 151.1 | 22.3 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 214 | Q | 28.4 | Very low | 29.4 | Very low | 181 Ų | 181 | 140.2 Ų | 140.2 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | 100.7 | 156 | 66.3 | -88.5 | -168.2 | -19.6 | 0 | 0 | 112.4 | |||||
| 215 | I | 31.6 | Very low | 29.3 | Very low | 155 Ų | 155 | 139.4 Ų | 139.4 | 80% | 0.795 | 82% | 0.817 | S | S | * | * | trans | -105.8 | 140.1 | -161.3 | -60.2 | 162.7 | 0 | 0 | 0 | 109.8 | I217 | I215-I217 HydrophobicContact CG2-CG1 4.06Š| ||
| 216 | A | 24.3 | Very low | 28.9 | Very low | 98 Ų | 98 | 136.5 Ų | 136.5 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | trans | -127.2 | 134.7 | 157.1 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 217 | I | 27.2 | Very low | 29.6 | Very low | 144 Ų | 144 | 138.6 Ų | 138.6 | 74% | 0.738 | 82% | 0.816 | S | S | * | * | trans | -115.5 | 132 | 170.2 | -59.4 | 170 | 0 | 0 | 0 | 105.3 | I215 | I215-I217 HydrophobicContact CG2-CG1 4.06Š| ||
| 218 | S | 25.8 | Very low | 29.9 | Very low | 125 Ų | 125 | 139.8 Ų | 139.8 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | trans | -122.5 | 137.7 | 165.2 | -66 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 219 | E | 27.7 | Very low | 30.3 | Very low | 184 Ų | 184 | 147 Ų | 147 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | -130.5 | 122.4 | -174.1 | -179.6 | 175.3 | -177.8 | 0 | 0 | 106.8 | ||||
| 220 | E | 29.3 | Very low | 31 | Very low | 200 Ų | 200 | 143.7 Ų | 143.7 | 94% | 0.935 | 80% | 0.797 | S | S | * | * | trans | -136 | 148.2 | 177.5 | -168.6 | 167.3 | 93.5 | 0 | 0 | 108.3 | ||||
| 221 | S | 25.3 | Very low | 31.6 | Very low | 88 Ų | 88 | 144 Ų | 144 | 62% | 0.615 | 79% | 0.789 | S | S | * | * | trans | -148.8 | 128.2 | -156 | 156.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 222 | M | 28.1 | Very low | 32.5 | Very low | 160 Ų | 160 | 142.7 Ų | 142.7 | 79% | 0.788 | 79% | 0.785 | S | S | * | * | trans | 64 | 157.6 | 176.1 | -109.3 | 67.1 | 78.7 | 0 | 0 | 113.8 | ||||
| 223 | E | 29.4 | Very low | 33.1 | Very low | 170 Ų | 170 | 141.6 Ų | 141.6 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | cis | -145.9 | 152.7 | 7.3 | 37.7 | -140.3 | 101.8 | 0 | 0 | 113.8 | ||||
| 224 | E | 33.5 | Very low | 33.7 | Very low | 200 Ų | 200 | 138.7 Ų | 138.7 | 94% | 0.935 | 76% | 0.762 | S | S | * | * | trans | 31 | 97.1 | 159.1 | -160.3 | 159.4 | -126.1 | 0 | 0 | 120.1 | ||||
| 225 | A | 28.5 | Very low | 34.3 | Very low | 103 Ų | 103 | 132.7 Ų | 132.7 | 85% | 0.851 | 74% | 0.744 | S | S | * | * | trans | -135.7 | 139 | 155.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 226 | G | 27.1 | Very low | 34.8 | Very low | 68 Ų | 68 | 128.7 Ų | 128.7 | 70% | 0.701 | 73% | 0.734 | S | S | * | * | trans | -95 | 148.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 227 | L | 45.4 | Very low | 35.9 | Very low | 182 Ų | 182 | 127.8 Ų | 127.8 | 95% | 0.953 | 72% | 0.718 | S | S | * | * | trans | 54.8 | 65.3 | 150.2 | -55.3 | 175.8 | 0 | 0 | 0 | 118.3 | ||||
| 228 | E | 36.3 | Very low | 36.3 | Very low | 139 Ų | 139 | 123.7 Ų | 123.7 | 65% | 0.65 | 70% | 0.7 | S | S | * | * | trans | -126.7 | 68.4 | 164.9 | -154.4 | -154.6 | 131.2 | 0 | 0 | 114.4 | N230 S231 | E228-N230 VanDerWaalsContact C-N 3.26Å; E228-N230 PolarHBondContact O-N 2.88Å; E228-N230 VanDerWaalsContact O-N 3.12Å; E228-S231 WeakPolarHBondContact OE1-CA 3.45Å; E228-S231 WeakPolarHBondContact OE1-CB 3.42Å; E228-S231 PolarHBondContact OE1-N 2.99Å; E228-S231 PolarHBondContact OE1-OG 2.89Å | ||
| 229 | W | 43.9 | Very low | 37 | Very low | 251 Ų | 251 | 125.8 Ų | 125.8 | 95% | 0.951 | 70% | 0.698 | S | S | * | * | trans | -80.9 | 67.5 | 163.5 | -91 | 96.2 | 0 | 0 | 0 | 111.1 | ||||
| 230 | N | 43.6 | Very low | 37.8 | Very low | 105 Ų | 105 | 121 Ų | 121 | 56% | 0.561 | 69% | 0.689 | S | S | * | * | trans | -151.5 | -31.4 | 169.6 | -99.7 | -44.8 | 0 | 0 | 0 | 116.3 | E228 A232 L233 T234 | E228-N230 VanDerWaalsContact C-N 3.26Å; E228-N230 PolarHBondContact O-N 2.88Å; E228-N230 VanDerWaalsContact O-N 3.12Å; N230-A232 VanDerWaalsContact C-N 3.28Å; N230-A232 PolarHBondContact O-N 3.31Å; N230-L233 PolarHBondContact O-N 3.33Å; N230-T234 PolarHBondContact O-N 3.18Å; N230-T234 PolarHBondContact O-OG1 2.88Å | ||
| 231 | S | 41.7 | Very low | 38.5 | Very low | 73 Ų | 73 | 116 Ų | 116 | 51% | 0.51 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -37.2 | -47.6 | -172.1 | -140.6 | 0 | 0 | 0 | 0 | 116.6 | E228 A235 | E228-S231 WeakPolarHBondContact OE1-CA 3.45Å; E228-S231 WeakPolarHBondContact OE1-CB 3.42Å; E228-S231 PolarHBondContact OE1-N 2.99Å; E228-S231 PolarHBondContact OE1-OG 2.89Å; S231-A235 WeakPolarHBondContact O-CB 2.87Å; S231-A235 PolarHBondContact O-N 3.45Å |
| 232 | A | 42.3 | Very low | 39.4 | Very low | 94 Ų | 94 | 119.5 Ų | 119.5 | 78% | 0.777 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -73.8 | -26.7 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | N230 | N230-A232 VanDerWaalsContact C-N 3.28Å; N230-A232 PolarHBondContact O-N 3.31Å |
| 233 | L | 45.8 | Very low | 39.8 | Very low | 130 Ų | 130 | 121.3 Ų | 121.3 | 68% | 0.681 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -87.5 | -39.2 | 172.4 | -100.9 | 166.9 | 0 | 0 | 0 | 110.5 | N230 A235 A236 V237 | N230-L233 PolarHBondContact O-N 3.33Å; L233-A235 PolarHBondContact O-N 3.46Å; L233-A236 PolarHBondContact O-N 2.95Å; L233-V237 WeakPolarHBondContact O-CG2 3.26Å; L233-V237 PolarHBondContact O-N 2.86Å |
| 234 | T | 43 | Very low | 39.9 | Very low | 63 Ų | 63 | 116.2 Ų | 116.2 | 39% | 0.387 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -60.2 | -43.3 | 174.2 | -54.4 | 0 | 0 | 0 | 0 | 111.4 | N230 A236 V237 T238 | N230-T234 PolarHBondContact O-N 3.18Å; N230-T234 PolarHBondContact O-OG1 2.88Å; T234-A236 PolarHBondContact O-N 3.33Å; T234-V237 CarbonylContact O-C 3.41Å; T234-V237 WeakPolarHBondContact O-CA 3.39Å; T234-V237 PolarHBondContact O-N 3.28Å; T234-T238 HydrophobicContact CG2-CG2 3.98Å; T234-T238 PolarHBondContact O-N 2.87Å; T234-T238 PolarHBondContact O-OG1 2.99Å; T234-T238 VanDerWaalsContact O-OG1 3.08Å |
| 235 | A | 41 | Very low | 40.6 | Very low | 55 Ų | 55 | 114 Ų | 114 | 46% | 0.455 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -62 | -27.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | S231 L233 V237 M239 | S231-A235 WeakPolarHBondContact O-CB 2.87Å; S231-A235 PolarHBondContact O-N 3.45Å; L233-A235 PolarHBondContact O-N 3.46Å; A235-V237 VanDerWaalsContact C-N 3.33Å; A235-M239 WeakPolarHBondContact O-CG 3.43Å |
| 236 | A | 42.8 | Very low | 41 | Very low | 71 Ų | 71 | 117.7 Ų | 117.7 | 59% | 0.587 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -77.6 | -19.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L233 T234 | L233-A236 PolarHBondContact O-N 2.95Å; T234-A236 PolarHBondContact O-N 3.33Å |
| 237 | V | 45.7 | Very low | 41.9 | Very low | 79 Ų | 79 | 124.2 Ų | 124.2 | 48% | 0.479 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -99.5 | -35.9 | -178.7 | 174.2 | 0 | 0 | 0 | 0 | 112.3 | L233 T234 A235 M239 A240 T241 | L233-V237 WeakPolarHBondContact O-CG2 3.26Å; L233-V237 PolarHBondContact O-N 2.86Å; T234-V237 CarbonylContact O-C 3.41Å; T234-V237 WeakPolarHBondContact O-CA 3.39Å; T234-V237 PolarHBondContact O-N 3.28Å; A235-V237 VanDerWaalsContact C-N 3.33Å; V237-M239 VanDerWaalsContact C-N 3.28Å; V237-M239 PolarHBondContact O-N 2.89Å; V237-A240 CarbonylContact O-C 3.53Å; V237-A240 VanDerWaalsContact O-CA 3.32Å; V237-A240 WeakPolarHBondContact O-CA 3.31Å; V237-A240 WeakPolarHBondContact O-CB 3.4Å; V237-A240 PolarHBondContact O-N 3.44Å; V237-T241 HydrophobicContact CG1-CG2 4.03Å; V237-T241 WeakPolarHBondContact O-CG2 3.4Å; V237-T241 PolarHBondContact O-N 2.83Å; V237-T241 VanDerWaalsContact O-N 3.14Å; V237-T241 PolarHBondContact O-OG1 3.4Å |
| 238 | T | 36.2 | Very low | 41.4 | Very low | 57 Ų | 57 | 122.4 Ų | 122.4 | 35% | 0.35 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -67.6 | -29.2 | 175.3 | 41.6 | 0 | 0 | 0 | 0 | 112.5 | T234 A240 T241 | T234-T238 HydrophobicContact CG2-CG2 3.98Å; T234-T238 PolarHBondContact O-N 2.87Å; T234-T238 PolarHBondContact O-OG1 2.99Å; T234-T238 VanDerWaalsContact O-OG1 3.08Å; T238-A240 PolarHBondContact O-N 3.38Å; T238-T241 PolarHBondContact O-N 3.41Å; T238-T241 VanDerWaalsContact O-N 3.15Å |
| 239 | M | 40.8 | Very low | 41.7 | Very low | 170 Ų | 170 | 119.9 Ų | 119.9 | 84% | 0.837 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.3 | -9.1 | 165.1 | -67.4 | -88.5 | 88.2 | 0 | 0 | 113.8 | A235 V237 | A235-M239 WeakPolarHBondContact O-CG 3.43Å; V237-M239 VanDerWaalsContact C-N 3.28Å; V237-M239 PolarHBondContact O-N 2.89Å |
| 240 | A | 44 | Very low | 42.2 | Very low | 82 Ų | 82 | 117.2 Ų | 117.2 | 68% | 0.678 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.8 | 1.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114 | V237 T238 | V237-A240 CarbonylContact O-C 3.53Å; V237-A240 VanDerWaalsContact O-CA 3.32Å; V237-A240 WeakPolarHBondContact O-CA 3.31Å; V237-A240 WeakPolarHBondContact O-CB 3.4Å; V237-A240 PolarHBondContact O-N 3.44Å; T238-A240 PolarHBondContact O-N 3.38Å |
| 241 | T | 44.7 | Very low | 42.8 | Very low | 96 Ų | 96 | 120.2 Ų | 120.2 | 59% | 0.589 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.4 | 24.1 | -173.6 | 69.5 | 0 | 0 | 0 | 0 | 116.2 | V237 T238 | V237-T241 HydrophobicContact CG1-CG2 4.03Å; V237-T241 WeakPolarHBondContact O-CG2 3.4Å; V237-T241 PolarHBondContact O-N 2.83Å; V237-T241 VanDerWaalsContact O-N 3.14Å; V237-T241 PolarHBondContact O-OG1 3.4Å; T238-T241 PolarHBondContact O-N 3.41Å; T238-T241 VanDerWaalsContact O-N 3.15Å |
| 242 | E | 44.2 | Very low | 44.2 | Very low | 162 Ų | 162 | 121.9 Ų | 121.9 | 76% | 0.757 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -148.5 | 62.5 | 165.4 | 58 | 173.6 | -169.7 | 0 | 0 | 116.4 | ||
| 243 | E | 36.4 | Very low | 46.1 | Very low | 198 Ų | 198 | 120.4 Ų | 120.4 | 93% | 0.925 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -148.3 | 128.8 | 139.5 | -88 | -137.8 | 138.6 | 0 | 0 | 112.9 | ||
| 244 | G | 31.1 | Very low | 48 | Very low | 62 Ų | 62 | 120.3 Ų | 120.3 | 64% | 0.639 | 66% | 0.664 | S | S | * | * | trans | 50.2 | 74.5 | 142.6 | 0 | 0 | 0 | 0 | 0 | 121.3 | K246 | G244-K246 PolarHBondContact O-N 3.07Š| ||
| 245 | V | 47.3 | Very low | 50.1 | Low | 155 Ų | 155 | 123.3 Ų | 123.3 | 94% | 0.939 | 68% | 0.678 | S | S | * | * | trans | 25.7 | 70.1 | 145.7 | -166.8 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 246 | K | 37.8 | Very low | 52.3 | Low | 180 Ų | 180 | 123.3 Ų | 123.3 | 78% | 0.783 | 67% | 0.672 | S | S | * | * | trans | -130.7 | 135.4 | 165 | -75.7 | -172.4 | -179.1 | 174.6 | 0 | 111.9 | G244 D248 | G244-K246 PolarHBondContact O-N 3.07Å; K246-D248 VanDerWaalsContact C-N 3.25Å; K246-D248 PolarHBondContact O-N 2.97Å; K246-D248 VanDerWaalsContact O-N 3.14Å | ||
| 247 | K | 46.6 | Very low | 54.4 | Low | 205 Ų | 205 | 123.6 Ų | 123.6 | 89% | 0.891 | 66% | 0.664 | S | S | * | * | trans | -85.5 | 69 | 180 | 178.7 | -150.3 | 170 | -173.7 | 0 | 108.1 | S249 | K247-S249 PolarHBondContact O-N 2.94Š| ||
| 248 | D | 34 | Very low | 56.4 | Low | 143 Ų | 143 | 124.7 Ų | 124.7 | 77% | 0.765 | 67% | 0.665 | S | S | * | * | trans | -81.8 | 112 | 171.8 | -72.5 | 3.8 | 0 | 0 | 0 | 107.2 | K246 | K246-D248 VanDerWaalsContact C-N 3.25Å; K246-D248 PolarHBondContact O-N 2.97Å; K246-D248 VanDerWaalsContact O-N 3.14Å | ||
| 249 | S | 42.8 | Very low | 59 | Low | 86 Ų | 86 | 127.9 Ų | 127.9 | 60% | 0.601 | 67% | 0.674 | S | S | * | * | trans | -64.6 | 137.7 | 173.4 | -174.1 | 0 | 0 | 0 | 0 | 108.2 | K247 E251 | K247-S249 PolarHBondContact O-N 2.94Å; S249-E251 PolarHBondContact O-N 3.38Å | ||
| 250 | E | 55.5 | Low | 61.4 | Low | 195 Ų | 195 | 124.4 Ų | 124.4 | 91% | 0.911 | 65% | 0.652 | S | S | * | * | trans | -74.8 | 76.7 | 168.4 | -162 | 162.4 | -154.5 | 0 | 0 | 107.5 | I252 | E250-I252 PolarHBondContact O-N 2.95Å; E250-I252 VanDerWaalsContact O-N 3.13Å | ||
| 251 | E | 54.8 | Low | 63.4 | Low | 169 Ų | 169 | 125.9 Ų | 125.9 | 79% | 0.79 | 64% | 0.643 | S | S | * | * | trans | -62.5 | 115 | -171.8 | -69 | -171.3 | 158.8 | 0 | 0 | 109.9 | S249 S253 | S249-E251 PolarHBondContact O-N 3.38Å; E251-S253 PolarHBondContact O-N 2.76Å | ||
| 252 | I | 71.8 | Confident | 65.6 | Low | 108 Ų | 108 | 122.8 Ų | 122.8 | 55% | 0.554 | 63% | 0.63 | S | S | * | * | trans | -51.9 | 116.9 | 173.7 | -57.6 | 170.6 | 0 | 0 | 0 | 107.2 | E250 E254 T256 L257 | E250-I252 PolarHBondContact O-N 2.95Å; E250-I252 VanDerWaalsContact O-N 3.13Å; I252-E254 PolarHBondContact O-N 3.49Å; I252-T256 HydrophobicContact CG2-CG2 3.71Å; I252-L257 HydrophobicContact CB-CD2 3.94Å; I252-L257 HydrophobicContact CB-CG 4.13Å; I252-L257 HydrophobicContact CD1-CD2 4.31Å; I252-L257 HydrophobicContact CG2-CD2 3.74Å; I252-L257 HydrophobicContact CG2-CG 3.91Å; I252-L257 WeakPolarHBondContact O-CD1 3.22Å | ||
| 253 | S | 81.6 | Confident | 67.7 | Low | 62 Ų | 62 | 116.3 Ų | 116.3 | 43% | 0.434 | 60% | 0.6 | S | S | . | * | trans | -50.4 | 139 | -173.6 | 60.5 | 0 | 0 | 0 | 0 | 112.1 | E251 D255 T256 L257 | E251-S253 PolarHBondContact O-N 2.76Å; S253-D255 PolarHBondContact O-N 3.03Å; S253-D255 VanDerWaalsContact O-N 3.13Å; S253-T256 WeakPolarHBondContact O-CA 3.23Å; S253-T256 VanDerWaalsContact O-CB 3.29Å; S253-T256 WeakPolarHBondContact O-CB 3.35Å; S253-T256 PolarHBondContact O-N 3.36Å; S253-T256 WeakPolarHBondContact OG-CB 3.43Å; S253-T256 PolarHBondContact OG-OG1 3.31Å; S253-L257 PolarHBondContact O-N 2.82Å | ||
| 254 | E | 86.6 | Confident | 70.2 | Confident | 128 Ų | 128 | 109.1 Ų | 109.1 | 60% | 0.598 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -54.3 | -36.5 | -177 | -177.6 | 62.5 | -165.6 | 0 | 0 | 111.9 | I252 T256 L257 M258 | I252-E254 PolarHBondContact O-N 3.49Å; E254-T256 VanDerWaalsContact C-N 3.3Å; E254-T256 PolarHBondContact O-N 3.36Å; E254-L257 PolarHBondContact O-N 3.48Å; E254-M258 HydrophobicContact CG-CG 4.34Å; E254-M258 VanDerWaalsContact O-CB 3.28Å; E254-M258 WeakPolarHBondContact O-CB 3.32Å; E254-M258 VanDerWaalsContact O-CG 3.32Å; E254-M258 WeakPolarHBondContact O-CG 3.19Å; E254-M258 PolarHBondContact O-N 3.43Å |
| 255 | D | 86.4 | Confident | 72.9 | Confident | 126 Ų | 126 | 112 Ų | 112 | 67% | 0.674 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -58.2 | -38.9 | 172.8 | -67.8 | -28 | 0 | 0 | 0 | 112.7 | S253 F259 | S253-D255 PolarHBondContact O-N 3.03Å; S253-D255 VanDerWaalsContact O-N 3.13Å; D255-F259 WeakPolarHBondContact O-CB 3.33Å; D255-F259 PolarHBondContact O-N 3.37Å |
| 256 | T | 87.4 | Confident | 74.9 | Confident | 55 Ų | 55 | 109.8 Ų | 109.8 | 34% | 0.337 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -73.5 | -41.5 | 177 | -59.3 | 0 | 0 | 0 | 0 | 111.3 | I252 S253 E254 F259 W260 | I252-T256 HydrophobicContact CG2-CG2 3.71Å; S253-T256 WeakPolarHBondContact O-CA 3.23Å; S253-T256 VanDerWaalsContact O-CB 3.29Å; S253-T256 WeakPolarHBondContact O-CB 3.35Å; S253-T256 PolarHBondContact O-N 3.36Å; S253-T256 WeakPolarHBondContact OG-CB 3.43Å; S253-T256 PolarHBondContact OG-OG1 3.31Å; E254-T256 VanDerWaalsContact C-N 3.3Å; E254-T256 PolarHBondContact O-N 3.36Å; T256-F259 WeakPolarHBondContact O-CB 3.49Å; T256-F259 PolarHBondContact O-N 2.91Å; T256-W260 PolarHBondContact O-N 3.08Å |
| 257 | L | 86.5 | Confident | 77.3 | Confident | 78 Ų | 78 | 103.9 Ų | 103.9 | 41% | 0.408 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.2 | -43.8 | 174.3 | -67.3 | 176.9 | 0 | 0 | 0 | 111.2 | I252 S253 E254 F259 W260 K261 | I252-L257 HydrophobicContact CB-CD2 3.94Å; I252-L257 HydrophobicContact CB-CG 4.13Å; I252-L257 HydrophobicContact CD1-CD2 4.31Å; I252-L257 HydrophobicContact CG2-CD2 3.74Å; I252-L257 HydrophobicContact CG2-CG 3.91Å; I252-L257 WeakPolarHBondContact O-CD1 3.22Å; S253-L257 PolarHBondContact O-N 2.82Å; E254-L257 PolarHBondContact O-N 3.48Å; L257-F259 VanDerWaalsContact C-N 3.35Å; L257-F259 PolarHBondContact O-N 2.94Å; L257-W260 PolarHBondContact O-N 2.92Å; L257-K261 WeakPolarHBondContact O-CB 3.22Å; L257-K261 PolarHBondContact O-N 2.89Å |
| 258 | M | 88.1 | Confident | 79.4 | Confident | 101 Ų | 101 | 97.6 Ų | 97.6 | 50% | 0.498 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.8 | -31 | 176.7 | -74.6 | -69.6 | -73.3 | 0 | 0 | 112.9 | E254 K261 G262 | E254-M258 HydrophobicContact CG-CG 4.34Å; E254-M258 VanDerWaalsContact O-CB 3.28Å; E254-M258 WeakPolarHBondContact O-CB 3.32Å; E254-M258 VanDerWaalsContact O-CG 3.32Å; E254-M258 WeakPolarHBondContact O-CG 3.19Å; E254-M258 PolarHBondContact O-N 3.43Å; M258-K261 HydrophobicContact SD-CD 4.07Å; M258-G262 PolarHBondContact O-N 2.89Å |
| 259 | F | 90.3 | Very high | 82.1 | Confident | 125 Ų | 125 | 93.7 Ų | 93.7 | 55% | 0.548 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65 | -52 | 170.2 | 170.7 | -99.4 | 0 | 0 | 0 | 112.2 | D255 T256 L257 K261 G262 I263 | D255-F259 WeakPolarHBondContact O-CB 3.33Å; D255-F259 PolarHBondContact O-N 3.37Å; T256-F259 WeakPolarHBondContact O-CB 3.49Å; T256-F259 PolarHBondContact O-N 2.91Å; L257-F259 VanDerWaalsContact C-N 3.35Å; L257-F259 PolarHBondContact O-N 2.94Å; F259-K261 VanDerWaalsContact C-N 3.3Å; F259-K261 PolarHBondContact O-N 2.78Å; F259-G262 PolarHBondContact O-N 3.49Å; F259-G262 VanDerWaalsContact O-N 3.13Å; F259-I263 HydrophobicContact CD1-CD1 4.13Å; F259-I263 HydrophobicContact CE1-CD1 3.53Å; F259-I263 HydrophobicContact CE2-CD1 4.17Å; F259-I263 HydrophobicContact CZ-CD1 3.57Å; F259-I263 PolarHBondContact O-N 2.92Å |
| 260 | W | 91.6 | Very high | 84.3 | Confident | 96 Ų | 96 | 97.1 Ų | 97.1 | 36% | 0.364 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.9 | -36.7 | 177.5 | -75.9 | 112 | 0 | 0 | 0 | 112.4 | T256 L257 I263 A264 M269 V272 I276 | T256-W260 PolarHBondContact O-N 3.08Å; L257-W260 PolarHBondContact O-N 2.92Å; W260-I263 HydrophobicContact CE3-CD1 4.13Å; W260-I263 HydrophobicContact CZ3-CD1 4.34Å; W260-I263 PolarHBondContact O-N 2.79Å; W260-A264 PolarHBondContact O-N 2.99Å; W260-M269 HydrophobicContact CE3-CE 3.99Å; W260-M269 HydrophobicContact CE3-SD 4.02Å; W260-M269 HydrophobicContact CZ3-SD 4.21Å; W260-M269 VanDerWaalsContact O-CE 3.26Å; W260-M269 WeakPolarHBondContact O-CE 3.43Å; W260-V272 HydrophobicContact CH2-CG1 4.08Å; W260-V272 HydrophobicContact CZ3-CG1 3.7Å; W260-I276 HydrophobicContact CH2-CD1 3.81Å |
| 261 | K | 86.7 | Confident | 85.9 | Confident | 113 Ų | 113 | 93.8 Ų | 93.8 | 49% | 0.491 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 171.4 | -175.4 | -178.5 | 174 | -175.8 | 0 | 111.7 | L257 M258 F259 I263 A264 D265 | L257-K261 WeakPolarHBondContact O-CB 3.22Å; L257-K261 PolarHBondContact O-N 2.89Å; M258-K261 HydrophobicContact SD-CD 4.07Å; F259-K261 VanDerWaalsContact C-N 3.3Å; F259-K261 PolarHBondContact O-N 2.78Å; K261-I263 VanDerWaalsContact C-N 3.28Å; K261-I263 PolarHBondContact O-N 2.85Å; K261-A264 CarbonylContact O-C 3.58Å; K261-A264 WeakPolarHBondContact O-CB 3.46Å; K261-A264 PolarHBondContact O-N 3.25Å; K261-A264 VanDerWaalsContact O-N 3.07Å; K261-D265 WeakPolarHBondContact O-CB 3.4Å; K261-D265 VanDerWaalsContact O-CG 3.3Å; K261-D265 PolarHBondContact O-N 2.83Å |
| 262 | G | 89.6 | Confident | 87.7 | Confident | 32 Ų | 32 | 87.7 Ų | 87.7 | 33% | 0.33 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -59.7 | -35.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | M258 F259 V266 | M258-G262 PolarHBondContact O-N 2.89Å; F259-G262 PolarHBondContact O-N 3.49Å; F259-G262 VanDerWaalsContact O-N 3.13Å; G262-V266 WeakPolarHBondContact O-CB 3.42Å; G262-V266 VanDerWaalsContact O-CG2 3.26Å; G262-V266 WeakPolarHBondContact O-CG2 3.42Å; G262-V266 PolarHBondContact O-N 2.77Å |
| 263 | I | 89.4 | Confident | 88.5 | Confident | 25 Ų | 25 | 86.1 Ų | 86.1 | 13% | 0.128 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -66.7 | -40.8 | 172.3 | -70.3 | 171 | 0 | 0 | 0 | 111.3 | F259 W260 K261 G267 L268 M269 V272 | F259-I263 HydrophobicContact CD1-CD1 4.13Å; F259-I263 HydrophobicContact CE1-CD1 3.53Å; F259-I263 HydrophobicContact CE2-CD1 4.17Å; F259-I263 HydrophobicContact CZ-CD1 3.57Å; F259-I263 PolarHBondContact O-N 2.92Å; W260-I263 HydrophobicContact CE3-CD1 4.13Å; W260-I263 HydrophobicContact CZ3-CD1 4.34Å; W260-I263 PolarHBondContact O-N 2.79Å; K261-I263 VanDerWaalsContact C-N 3.28Å; K261-I263 PolarHBondContact O-N 2.85Å; I263-G267 PolarHBondContact O-N 2.97Å; I263-L268 HydrophobicContact CG2-CB 4.17Å; I263-L268 PolarHBondContact O-N 3.34Å; I263-M269 HydrophobicContact CB-CE 4.45Å; I263-M269 HydrophobicContact CG2-CB 4.38Å; I263-M269 HydrophobicContact CG2-CE 4.15Å; I263-M269 HydrophobicContact CG2-SD 4.34Å; I263-V272 HydrophobicContact CG2-CB 4.3Å; I263-V272 HydrophobicContact CG2-CG2 3.95Å |
| 264 | A | 88.6 | Confident | 88.7 | Confident | 47 Ų | 47 | 86.4 Ų | 86.4 | 39% | 0.388 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -68 | -45.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | W260 K261 V266 G267 M269 | W260-A264 PolarHBondContact O-N 2.99Å; K261-A264 CarbonylContact O-C 3.58Å; K261-A264 WeakPolarHBondContact O-CB 3.46Å; K261-A264 PolarHBondContact O-N 3.25Å; K261-A264 VanDerWaalsContact O-N 3.07Å; A264-V266 PolarHBondContact O-N 2.84Å; A264-G267 WeakPolarHBondContact O-CA 3.19Å; A264-G267 PolarHBondContact O-N 2.87Å; A264-M269 HydrophobicContact CB-CE 3.84Å |
| 265 | D | 88.6 | Confident | 88.8 | Confident | 123 Ų | 123 | 84.8 Ų | 84.8 | 66% | 0.658 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.2 | -24.7 | -179.2 | -71.2 | -15.6 | 0 | 0 | 0 | 112.2 | K261 | K261-D265 WeakPolarHBondContact O-CB 3.4Å; K261-D265 VanDerWaalsContact O-CG 3.3Å; K261-D265 PolarHBondContact O-N 2.83Å |
| 266 | V | 89.3 | Confident | 88.9 | Confident | 108 Ų | 108 | 82.3 Ų | 82.3 | 66% | 0.655 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.2 | -5.7 | 172.7 | -179.6 | 0 | 0 | 0 | 0 | 112.3 | G262 A264 L268 | G262-V266 WeakPolarHBondContact O-CB 3.42Å; G262-V266 VanDerWaalsContact O-CG2 3.26Å; G262-V266 WeakPolarHBondContact O-CG2 3.42Å; G262-V266 PolarHBondContact O-N 2.77Å; A264-V266 PolarHBondContact O-N 2.84Å; V266-L268 HydrophobicContact CG1-CD1 3.87Å; V266-L268 HydrophobicContact CG1-CG 4.07Å |
| 267 | G | 88.5 | Confident | 88.9 | Confident | 57 Ų | 57 | 84.8 Ų | 84.8 | 59% | 0.588 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.5 | 5.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | I263 A264 M269 | I263-G267 PolarHBondContact O-N 2.97Å; A264-G267 WeakPolarHBondContact O-CA 3.19Å; A264-G267 PolarHBondContact O-N 2.87Å; G267-M269 VanDerWaalsContact C-N 3.3Å; G267-M269 PolarHBondContact O-N 2.84Å |
| 268 | L | 90.6 | Very high | 89.1 | Confident | 73 Ų | 73 | 86.1 Ų | 86.1 | 38% | 0.382 | 46% | 0.46 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85 | 2 | -173.9 | -65.1 | 172.7 | 0 | 0 | 0 | 114 | I263 V266 E270 E271 V272 | I263-L268 HydrophobicContact CG2-CB 4.17Å; I263-L268 PolarHBondContact O-N 3.34Å; V266-L268 HydrophobicContact CG1-CD1 3.87Å; V266-L268 HydrophobicContact CG1-CG 4.07Å; L268-E270 VanDerWaalsContact C-N 3.34Å; L268-E270 PolarHBondContact O-N 3.05Å; L268-E271 PolarHBondContact O-N 2.8Å; L268-V272 WeakPolarHBondContact O-CG2 3.34Å; L268-V272 PolarHBondContact O-N 3.42Å |
| 269 | M | 89.6 | Confident | 89 | Confident | 60 Ų | 60 | 88.3 Ų | 88.3 | 30% | 0.296 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59.7 | -40.4 | -175.8 | -171.7 | 63.9 | 70.8 | 0 | 0 | 112.9 | W260 I263 A264 G267 V272 V273 | W260-M269 HydrophobicContact CE3-CE 3.99Å; W260-M269 HydrophobicContact CE3-SD 4.02Å; W260-M269 HydrophobicContact CZ3-SD 4.21Å; W260-M269 VanDerWaalsContact O-CE 3.26Å; W260-M269 WeakPolarHBondContact O-CE 3.43Å; I263-M269 HydrophobicContact CB-CE 4.45Å; I263-M269 HydrophobicContact CG2-CB 4.38Å; I263-M269 HydrophobicContact CG2-CE 4.15Å; I263-M269 HydrophobicContact CG2-SD 4.34Å; A264-M269 HydrophobicContact CB-CE 3.84Å; G267-M269 VanDerWaalsContact C-N 3.3Å; G267-M269 PolarHBondContact O-N 2.84Å; M269-V272 PolarHBondContact O-N 3.3Å; M269-V273 HydrophobicContact CG-CG2 4.28Å; M269-V273 WeakPolarHBondContact O-CB 3.24Å; M269-V273 VanDerWaalsContact O-CG2 3.28Å; M269-V273 WeakPolarHBondContact O-CG2 3.4Å; M269-V273 PolarHBondContact O-N 3.44Å; M269-V273 HydrophobicContact SD-CG2 4.04Å |
| 270 | E | 88.3 | Confident | 88.8 | Confident | 158 Ų | 158 | 84.6 Ų | 84.6 | 74% | 0.738 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -63.4 | -47.9 | 177.8 | -173.1 | 173.5 | -177 | 0 | 0 | 111.1 | L268 V272 V273 C274 | L268-E270 VanDerWaalsContact C-N 3.34Å; L268-E270 PolarHBondContact O-N 3.05Å; E270-V272 PolarHBondContact O-N 3.07Å; E270-V273 PolarHBondContact O-N 2.91Å; E270-C274 VanDerWaalsContact O-CB 3.31Å; E270-C274 WeakPolarHBondContact O-CB 3.24Å; E270-C274 PolarHBondContact O-N 3.05Å; E270-C274 PolarHBondContact O-SG 2.9Å; E270-C274 VanDerWaalsContact O-SG 3.37Å |
| 271 | E | 90.1 | Very high | 88.5 | Confident | 125 Ų | 125 | 84.8 Ų | 84.8 | 58% | 0.584 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -60.9 | -43.3 | 176.1 | -63.6 | -171.9 | -174.3 | 0 | 0 | 112.1 | L268 N275 | L268-E271 PolarHBondContact O-N 2.8Å; E271-N275 VanDerWaalsContact O-CB 3.27Å; E271-N275 WeakPolarHBondContact O-CB 3.34Å; E271-N275 VanDerWaalsContact O-CG 3.24Å; E271-N275 PolarHBondContact O-N 3.13Å; E271-N275 PolarHBondContact O-ND2 3.24Å |
| 272 | V | 91.6 | Very high | 88.5 | Confident | 41 Ų | 41 | 83.3 Ų | 83.3 | 25% | 0.248 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -67.6 | -44.8 | -179.4 | 172.3 | 0 | 0 | 0 | 0 | 111.3 | W260 I263 L268 M269 E270 N275 I276 | W260-V272 HydrophobicContact CH2-CG1 4.08Å; W260-V272 HydrophobicContact CZ3-CG1 3.7Å; I263-V272 HydrophobicContact CG2-CB 4.3Å; I263-V272 HydrophobicContact CG2-CG2 3.95Å; L268-V272 WeakPolarHBondContact O-CG2 3.34Å; L268-V272 PolarHBondContact O-N 3.42Å; M269-V272 PolarHBondContact O-N 3.3Å; E270-V272 PolarHBondContact O-N 3.07Å; V272-N275 PolarHBondContact O-N 3.12Å; V272-I276 HydrophobicContact CG1-CD1 3.75Å; V272-I276 WeakPolarHBondContact O-CB 3.38Å; V272-I276 VanDerWaalsContact O-CG1 3.29Å; V272-I276 WeakPolarHBondContact O-CG1 3.43Å; V272-I276 PolarHBondContact O-N 3.19Å |
| 273 | V | 88.6 | Confident | 88.2 | Confident | 76 Ų | 76 | 85.3 Ų | 85.3 | 46% | 0.461 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -65.2 | -44.2 | 177.5 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | M269 E270 N275 I276 Q277 | M269-V273 HydrophobicContact CG-CG2 4.28Å; M269-V273 WeakPolarHBondContact O-CB 3.24Å; M269-V273 VanDerWaalsContact O-CG2 3.28Å; M269-V273 WeakPolarHBondContact O-CG2 3.4Å; M269-V273 PolarHBondContact O-N 3.44Å; M269-V273 HydrophobicContact SD-CG2 4.04Å; E270-V273 PolarHBondContact O-N 2.91Å; V273-N275 VanDerWaalsContact C-N 3.35Å; V273-N275 PolarHBondContact O-N 3.31Å; V273-I276 PolarHBondContact O-N 3.31Å; V273-Q277 WeakPolarHBondContact O-CB 3.5Å; V273-Q277 PolarHBondContact O-N 3Å |
| 274 | C | 86.6 | Confident | 87.9 | Confident | 67 Ų | 67 | 87.3 Ų | 87.3 | 45% | 0.453 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.2 | -37 | 175.7 | -73.1 | 0 | 0 | 0 | 0 | 112.7 | E270 K278 | E270-C274 VanDerWaalsContact O-CB 3.31Å; E270-C274 WeakPolarHBondContact O-CB 3.24Å; E270-C274 PolarHBondContact O-N 3.05Å; E270-C274 PolarHBondContact O-SG 2.9Å; E270-C274 VanDerWaalsContact O-SG 3.37Å; C274-K278 WeakPolarHBondContact O-CB 3.47Å; C274-K278 PolarHBondContact O-N 2.99Å |
| 275 | N | 88 | Confident | 87.7 | Confident | 95 Ų | 95 | 90.5 Ų | 90.5 | 51% | 0.508 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -67.6 | -41.9 | 174.6 | -78.7 | -47.8 | 0 | 0 | 0 | 111.9 | E271 V272 V273 K278 E279 | E271-N275 VanDerWaalsContact O-CB 3.27Å; E271-N275 WeakPolarHBondContact O-CB 3.34Å; E271-N275 VanDerWaalsContact O-CG 3.24Å; E271-N275 PolarHBondContact O-N 3.13Å; E271-N275 PolarHBondContact O-ND2 3.24Å; V272-N275 PolarHBondContact O-N 3.12Å; V273-N275 VanDerWaalsContact C-N 3.35Å; V273-N275 PolarHBondContact O-N 3.31Å; N275-K278 PolarHBondContact O-N 3.2Å; N275-E279 WeakPolarHBondContact O-CB 3.38Å; N275-E279 PolarHBondContact O-N 3.32Å |
| 276 | I | 88.8 | Confident | 87.2 | Confident | 74 Ų | 74 | 85.3 Ų | 85.3 | 38% | 0.379 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -63.5 | -48.1 | 176 | -71.2 | 166.1 | 0 | 0 | 0 | 110.9 | W260 V272 V273 K278 E279 I280 | W260-I276 HydrophobicContact CH2-CD1 3.81Å; V272-I276 HydrophobicContact CG1-CD1 3.75Å; V272-I276 WeakPolarHBondContact O-CB 3.38Å; V272-I276 VanDerWaalsContact O-CG1 3.29Å; V272-I276 WeakPolarHBondContact O-CG1 3.43Å; V272-I276 PolarHBondContact O-N 3.19Å; V273-I276 PolarHBondContact O-N 3.31Å; I276-K278 VanDerWaalsContact C-N 3.32Å; I276-K278 PolarHBondContact O-N 2.91Å; I276-E279 PolarHBondContact O-N 2.86Å; I276-I280 HydrophobicContact CG2-CD1 3.76Å; I276-I280 WeakPolarHBondContact O-CD1 3.49Å; I276-I280 VanDerWaalsContact O-CG1 3.28Å; I276-I280 WeakPolarHBondContact O-CG1 3.38Å; I276-I280 PolarHBondContact O-N 3.08Å |
| 277 | Q | 87.7 | Confident | 86.9 | Confident | 107 Ų | 107 | 80.5 Ų | 80.5 | 50% | 0.5 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -55.3 | -50.7 | 174.7 | 177.6 | -175.5 | -14.8 | 0 | 0 | 110.4 | V273 E279 I280 E281 | V273-Q277 WeakPolarHBondContact O-CB 3.5Å; V273-Q277 PolarHBondContact O-N 3Å; Q277-E279 PolarHBondContact O-N 3.46Å; Q277-I280 PolarHBondContact O-N 3.37Å; Q277-E281 WeakPolarHBondContact CG-OE1 3.38Å; Q277-E281 PolarHBondContact NE2-OE1 3.24Å; Q277-E281 WeakPolarHBondContact O-CG 3.32Å; Q277-E281 PolarHBondContact O-N 3.42Å |
| 278 | K | 90.4 | Very high | 86.4 | Confident | 106 Ų | 106 | 84 Ų | 84 | 46% | 0.461 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58.8 | -49 | 179 | 179.4 | -178.9 | 172.7 | -167.1 | 0 | 111.3 | C274 N275 I276 I280 E281 E282 | C274-K278 WeakPolarHBondContact O-CB 3.47Å; C274-K278 PolarHBondContact O-N 2.99Å; N275-K278 PolarHBondContact O-N 3.2Å; I276-K278 VanDerWaalsContact C-N 3.32Å; I276-K278 PolarHBondContact O-N 2.91Å; K278-I280 VanDerWaalsContact C-N 3.3Å; K278-I280 PolarHBondContact O-N 3.28Å; K278-E281 CarbonylContact O-C 3.57Å; K278-E281 WeakPolarHBondContact O-CA 3.36Å; K278-E281 WeakPolarHBondContact O-CB 3.47Å; K278-E281 PolarHBondContact O-N 3.3Å; K278-E281 VanDerWaalsContact O-N 3.08Å; K278-E282 WeakPolarHBondContact CE-OE1 3.28Å; K278-E282 HydrophobicContact CG-CG 3.98Å; K278-E282 VanDerWaalsContact O-CG 3.22Å; K278-E282 WeakPolarHBondContact O-CG 3.39Å; K278-E282 PolarHBondContact O-N 3Å |
| 279 | E | 85.4 | Confident | 85.8 | Confident | 147 Ų | 147 | 85.8 Ų | 85.8 | 69% | 0.687 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -63.7 | -35.9 | -177 | -168.5 | 162.2 | -163.7 | 0 | 0 | 112.1 | N275 I276 Q277 E282 L283 | N275-E279 WeakPolarHBondContact O-CB 3.38Å; N275-E279 PolarHBondContact O-N 3.32Å; I276-E279 PolarHBondContact O-N 2.86Å; Q277-E279 PolarHBondContact O-N 3.46Å; E279-E282 PolarHBondContact O-N 3.06Å; E279-L283 VanDerWaalsContact O-CB 3.23Å; E279-L283 WeakPolarHBondContact O-CB 3.45Å; E279-L283 PolarHBondContact O-N 3.11Å |
| 280 | I | 86.8 | Confident | 84.9 | Confident | 47 Ų | 47 | 87.6 Ų | 87.6 | 24% | 0.241 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -64 | -46.4 | 169.9 | -65.1 | 160.5 | 0 | 0 | 0 | 111.1 | I276 Q277 K278 L283 L284 F311 | I276-I280 HydrophobicContact CG2-CD1 3.76Å; I276-I280 WeakPolarHBondContact O-CD1 3.49Å; I276-I280 VanDerWaalsContact O-CG1 3.28Å; I276-I280 WeakPolarHBondContact O-CG1 3.38Å; I276-I280 PolarHBondContact O-N 3.08Å; Q277-I280 PolarHBondContact O-N 3.37Å; K278-I280 VanDerWaalsContact C-N 3.3Å; K278-I280 PolarHBondContact O-N 3.28Å; I280-L283 PolarHBondContact O-N 2.82Å; I280-L284 HydrophobicContact CG2-CD1 3.95Å; I280-L284 HydrophobicContact CG2-CG 4.48Å; I280-L284 WeakPolarHBondContact O-CB 3.27Å; I280-L284 WeakPolarHBondContact O-CG 3.31Å; I280-L284 PolarHBondContact O-N 3.27Å; I280-F311 HydrophobicContact CD1-CE2 4.09Å; I280-F311 HydrophobicContact CD1-CZ 3.65Å |
| 281 | E | 85.3 | Confident | 84 | Confident | 100 Ų | 100 | 85 Ų | 85 | 47% | 0.467 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -62.3 | -40.9 | 176.4 | -75.3 | 179 | -162.5 | 0 | 0 | 112.3 | Q277 K278 R285 | Q277-E281 WeakPolarHBondContact CG-OE1 3.38Å; Q277-E281 PolarHBondContact NE2-OE1 3.24Å; Q277-E281 WeakPolarHBondContact O-CG 3.32Å; Q277-E281 PolarHBondContact O-N 3.42Å; K278-E281 CarbonylContact O-C 3.57Å; K278-E281 WeakPolarHBondContact O-CA 3.36Å; K278-E281 WeakPolarHBondContact O-CB 3.47Å; K278-E281 PolarHBondContact O-N 3.3Å; K278-E281 VanDerWaalsContact O-N 3.08Å; E281-R285 WeakPolarHBondContact O-CB 3.27Å; E281-R285 PolarHBondContact O-N 2.92Å |
| 282 | E | 86 | Confident | 82.8 | Confident | 81 Ų | 81 | 85.8 Ų | 85.8 | 38% | 0.379 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -70.5 | -34.8 | 178.6 | -57.7 | -148.3 | 138.6 | 0 | 0 | 111.7 | K278 E279 R285 G286 | K278-E282 WeakPolarHBondContact CE-OE1 3.28Å; K278-E282 HydrophobicContact CG-CG 3.98Å; K278-E282 VanDerWaalsContact O-CG 3.22Å; K278-E282 WeakPolarHBondContact O-CG 3.39Å; K278-E282 PolarHBondContact O-N 3Å; E279-E282 PolarHBondContact O-N 3.06Å; E282-R285 IonicContact OE1-CZ 3.68Å; E282-R285 IonicContact OE1-NH1 2.75Å; E282-R285 PolarHBondContact OE1-NH1 3.34Å; E282-R285 IonicContact OE1-NH2 3.4Å; E282-R285 PolarHBondContact OE1-NH2 2.89Å; E282-R285 IonicContact OE2-NH2 3.42Å; E282-G286 PolarHBondContact O-N 2.84Å |
| 283 | L | 84.1 | Confident | 81.1 | Confident | 75 Ų | 75 | 91.9 Ų | 91.9 | 39% | 0.393 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.3 | -49.8 | 172.8 | -175.3 | 65.7 | 0 | 0 | 0 | 111.5 | E279 I280 G286 V287 V303 V307 | E279-L283 VanDerWaalsContact O-CB 3.23Å; E279-L283 WeakPolarHBondContact O-CB 3.45Å; E279-L283 PolarHBondContact O-N 3.11Å; I280-L283 PolarHBondContact O-N 2.82Å; L283-G286 PolarHBondContact O-N 2.91Å; L283-V287 PolarHBondContact O-N 3.46Å; L283-V303 HydrophobicContact CD1-CG1 3.85Å; L283-V303 HydrophobicContact CD2-CG1 3.86Å; L283-V303 HydrophobicContact CG-CG1 3.74Å; L283-V307 HydrophobicContact CD2-CG2 4.2Å |
| 284 | L | 82.6 | Confident | 79.6 | Confident | 67 Ų | 67 | 90.2 Ų | 90.2 | 35% | 0.351 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.5 | -43.8 | 176.8 | -70.7 | 173.1 | 0 | 0 | 0 | 111.8 | I280 G286 V287 Q288 L304 | I280-L284 HydrophobicContact CG2-CD1 3.95Å; I280-L284 HydrophobicContact CG2-CG 4.48Å; I280-L284 WeakPolarHBondContact O-CB 3.27Å; I280-L284 WeakPolarHBondContact O-CG 3.31Å; I280-L284 PolarHBondContact O-N 3.27Å; L284-G286 VanDerWaalsContact C-N 3.28Å; L284-G286 PolarHBondContact O-N 3.35Å; L284-V287 PolarHBondContact O-N 2.92Å; L284-Q288 WeakPolarHBondContact O-CB 3.49Å; L284-Q288 PolarHBondContact O-N 2.87Å; L284-L304 HydrophobicContact CD2-CD2 3.76Å |
| 285 | R | 84.8 | Confident | 78.4 | Confident | 114 Ų | 114 | 92.7 Ų | 92.7 | 43% | 0.43 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -59.7 | -38.6 | 173.7 | -175.1 | 178.5 | 75.1 | -153.2 | 5.1 | 111.4 | E281 E282 Q288 Q289 | E281-R285 WeakPolarHBondContact O-CB 3.27Å; E281-R285 PolarHBondContact O-N 2.92Å; E282-R285 IonicContact OE1-CZ 3.68Å; E282-R285 IonicContact OE1-NH1 2.75Å; E282-R285 PolarHBondContact OE1-NH1 3.34Å; E282-R285 IonicContact OE1-NH2 3.4Å; E282-R285 PolarHBondContact OE1-NH2 2.89Å; E282-R285 IonicContact OE2-NH2 3.42Å; R285-Q288 PolarHBondContact O-N 3.32Å; R285-Q289 WeakPolarHBondContact O-CB 3.38Å; R285-Q289 VanDerWaalsContact O-CG 3.27Å; R285-Q289 WeakPolarHBondContact O-CG 3.45Å; R285-Q289 PolarHBondContact O-N 3Å |
| 286 | G | 79.3 | Confident | 77.7 | Confident | 14 Ų | 14 | 93.4 Ų | 93.4 | 14% | 0.144 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -62.3 | -45.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | E282 L283 L284 R290 | E282-G286 PolarHBondContact O-N 2.84Å; L283-G286 PolarHBondContact O-N 2.91Å; L284-G286 VanDerWaalsContact C-N 3.28Å; L284-G286 PolarHBondContact O-N 3.35Å; G286-R290 WeakPolarHBondContact O-CG 3.48Å; G286-R290 VanDerWaalsContact O-CZ 3.32Å; G286-R290 PolarHBondContact O-N 2.81Å; G286-R290 PolarHBondContact O-NH1 3.1Å; G286-R290 VanDerWaalsContact O-NH1 3.14Å |
| 287 | V | 81.7 | Confident | 77.1 | Confident | 7 Ų | 7 | 94.3 Ų | 94.3 | 4% | 0.042 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -62.5 | -46.6 | 173.8 | 174.2 | 0 | 0 | 0 | 0 | 110.7 | L283 L284 Q289 R290 L291 D300 V303 L304 | L283-V287 PolarHBondContact O-N 3.46Å; L284-V287 PolarHBondContact O-N 2.92Å; V287-Q289 VanDerWaalsContact C-N 3.34Å; V287-Q289 PolarHBondContact O-N 3.37Å; V287-R290 PolarHBondContact O-N 3.16Å; V287-R290 VanDerWaalsContact O-N 3.16Å; V287-L291 PolarHBondContact O-N 3.04Å; V287-D300 HydrophobicContact CG1-CB 4.08Å; V287-D300 HydrophobicContact CG2-CB 4.39Å; V287-V303 HydrophobicContact CG2-CG1 4.14Å; V287-L304 HydrophobicContact CG1-CD1 3.92Å; V287-L304 HydrophobicContact CG1-CD2 4.29Å; V287-L304 HydrophobicContact CG1-CG 4.1Å |
| 288 | Q | 78.3 | Confident | 76.4 | Confident | 129 Ų | 129 | 94.6 Ų | 94.6 | 60% | 0.603 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62.2 | -37.9 | -179.7 | -169.4 | 180 | 11.9 | 0 | 0 | 112.6 | L284 R285 L291 | L284-Q288 WeakPolarHBondContact O-CB 3.49Å; L284-Q288 PolarHBondContact O-N 2.87Å; R285-Q288 PolarHBondContact O-N 3.32Å; Q288-L291 WeakPolarHBondContact O-CB 3.28Å; Q288-L291 PolarHBondContact O-N 3.26Å |
| 289 | Q | 77.2 | Confident | 75.6 | Confident | 111 Ų | 111 | 93.6 Ų | 93.6 | 52% | 0.519 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -67.3 | -37.3 | 174.8 | -75.8 | 175.7 | 1.5 | 0 | 0 | 112.5 | R285 V287 I292 | R285-Q289 WeakPolarHBondContact O-CB 3.38Å; R285-Q289 VanDerWaalsContact O-CG 3.27Å; R285-Q289 WeakPolarHBondContact O-CG 3.45Å; R285-Q289 PolarHBondContact O-N 3Å; V287-Q289 VanDerWaalsContact C-N 3.34Å; V287-Q289 PolarHBondContact O-N 3.37Å; Q289-I292 PolarHBondContact O-N 3.42Å |
| 290 | R | 71.7 | Confident | 75.4 | Confident | 98 Ų | 98 | 86.8 Ų | 86.8 | 37% | 0.37 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -68.6 | -37.6 | 174.9 | -72.9 | -173.2 | -67.1 | -83.9 | 7 | 112.3 | G286 V287 I292 Q293 A294 D300 | G286-R290 WeakPolarHBondContact O-CG 3.48Å; G286-R290 VanDerWaalsContact O-CZ 3.32Å; G286-R290 PolarHBondContact O-N 2.81Å; G286-R290 PolarHBondContact O-NH1 3.1Å; G286-R290 VanDerWaalsContact O-NH1 3.14Å; V287-R290 PolarHBondContact O-N 3.16Å; V287-R290 VanDerWaalsContact O-N 3.16Å; R290-I292 PolarHBondContact O-N 2.78Å; R290-I292 VanDerWaalsContact O-N 3.08Å; R290-Q293 PolarHBondContact O-N 2.91Å; R290-A294 PolarHBondContact O-N 3.37Å; R290-D300 IonicContact CZ-OD1 3.41Å; R290-D300 IonicContact NE-OD1 2.68Å; R290-D300 PolarHBondContact NE-OD1 3.39Å; R290-D300 IonicContact NE-OD2 3.85Å; R290-D300 PolarHBondContact NE-OD2 3.18Å; R290-D300 IonicContact NH2-OD1 3.25Å; R290-D300 PolarHBondContact NH2-OD1 2.88Å |
| 291 | L | 69.5 | Low | 75.1 | Confident | 104 Ų | 104 | 86.3 Ų | 86.3 | 55% | 0.545 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -57.1 | -23.8 | 177.2 | -154.1 | 80.8 | 0 | 0 | 0 | 113.8 | V287 Q288 F296 | V287-L291 PolarHBondContact O-N 3.04Å; Q288-L291 WeakPolarHBondContact O-CB 3.28Å; Q288-L291 PolarHBondContact O-N 3.26Å; L291-F296 HydrophobicContact CD1-CB 4.34Å; L291-F296 HydrophobicContact CD1-CD2 3.59Å; L291-F296 HydrophobicContact CD1-CE2 4.23Å; L291-F296 HydrophobicContact CD1-CG 4.27Å |
| 292 | I | 64 | Low | 74.9 | Confident | 141 Ų | 141 | 82.7 Ų | 82.7 | 72% | 0.723 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.6 | -18 | -180 | -64.2 | 166.4 | 0 | 0 | 0 | 112 | Q289 R290 | Q289-I292 PolarHBondContact O-N 3.42Å; R290-I292 PolarHBondContact O-N 2.78Å; R290-I292 VanDerWaalsContact O-N 3.08Å |
| 293 | Q | 57.6 | Low | 74.8 | Confident | 169 Ų | 169 | 80.9 Ų | 80.9 | 79% | 0.79 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -122.6 | -12.9 | -167.4 | -62.6 | -173.7 | 48.9 | 0 | 0 | 115.2 | R290 | R290-Q293 PolarHBondContact O-N 2.91Š|
| 294 | A | 56.1 | Low | 74.8 | Confident | 42 Ų | 42 | 80.3 Ų | 80.3 | 35% | 0.347 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -147.6 | 159.2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | R290 F296 | R290-A294 PolarHBondContact O-N 3.37Å; A294-F296 PolarHBondContact O-N 2.98Å |
| 295 | P | 61.7 | Low | 74.9 | Confident | 119 Ų | 119 | 81 Ų | 81 | 77% | 0.773 | 43% | 0.426 | S | S | * | . | S | Bend | trans | -56.7 | 138.2 | 163.2 | 25.9 | -34.4 | 0 | 0 | 0 | 110.4 | Q297 | P295-Q297 PolarHBondContact O-N 2.99Š|
| 296 | F | 72.3 | Confident | 75 | Confident | 109 Ų | 109 | 79.6 Ų | 79.6 | 48% | 0.478 | 43% | 0.428 | S | S | . | . | P | Polyproline II helix | trans | -57.9 | 122.3 | -175.5 | 178.5 | -119.5 | 0 | 0 | 0 | 111.6 | L291 A294 D300 A301 L304 | L291-F296 HydrophobicContact CD1-CB 4.34Å; L291-F296 HydrophobicContact CD1-CD2 3.59Å; L291-F296 HydrophobicContact CD1-CE2 4.23Å; L291-F296 HydrophobicContact CD1-CG 4.27Å; A294-F296 PolarHBondContact O-N 2.98Å; F296-D300 HydrophobicContact CD2-CB 4.01Å; F296-D300 HydrophobicContact CE2-CB 3.7Å; F296-A301 HydrophobicContact CE1-CB 3.65Å; F296-A301 HydrophobicContact CZ-CB 3.75Å; F296-L304 HydrophobicContact CE2-CD1 4Å; F296-L304 HydrophobicContact CZ-CD1 4.06Å |
| 297 | Q | 75.9 | Confident | 75.3 | Confident | 94 Ų | 94 | 80.2 Ų | 80.2 | 44% | 0.439 | 43% | 0.428 | S | S | . | . | P | Polyproline II helix | trans | -90 | 150.5 | -172.1 | -60.3 | -171.5 | 36.6 | 0 | 0 | 112.5 | P295 T299 D300 A301 | P295-Q297 PolarHBondContact O-N 2.99Å; Q297-T299 WeakPolarHBondContact CB-OG1 3.18Å; Q297-T299 PolarHBondContact O-N 3.35Å; Q297-D300 WeakPolarHBondContact O-CB 3.46Å; Q297-D300 PolarHBondContact O-N 3.46Å; Q297-A301 PolarHBondContact O-N 3.23Å |
| 298 | V | 73.5 | Confident | 75.5 | Confident | 113 Ų | 113 | 80.4 Ų | 80.4 | 69% | 0.685 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -59.3 | -28 | 175.5 | -176.7 | 0 | 0 | 0 | 0 | 112.1 | A302 | V298-A302 WeakPolarHBondContact O-CB 3.35Å; V298-A302 PolarHBondContact O-N 2.97Å |
| 299 | T | 73.8 | Confident | 75.7 | Confident | 85 Ų | 85 | 80.8 Ų | 80.8 | 52% | 0.521 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -65.2 | -45.8 | 171.5 | 42 | 0 | 0 | 0 | 0 | 112.4 | Q297 A302 V303 | Q297-T299 WeakPolarHBondContact CB-OG1 3.18Å; Q297-T299 PolarHBondContact O-N 3.35Å; T299-A302 PolarHBondContact O-N 2.91Å; T299-V303 WeakPolarHBondContact O-CG2 3.46Å; T299-V303 PolarHBondContact O-N 3.18Å |
| 300 | D | 81 | Confident | 75.9 | Confident | 4 Ų | 4 | 80.9 Ų | 80.9 | 2% | 0.021 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -66.3 | -40.2 | 176.5 | -66.7 | -40.7 | 0 | 0 | 0 | 111.4 | V287 R290 F296 Q297 V303 L304 | V287-D300 HydrophobicContact CG1-CB 4.08Å; V287-D300 HydrophobicContact CG2-CB 4.39Å; R290-D300 IonicContact CZ-OD1 3.41Å; R290-D300 IonicContact NE-OD1 2.68Å; R290-D300 PolarHBondContact NE-OD1 3.39Å; R290-D300 IonicContact NE-OD2 3.85Å; R290-D300 PolarHBondContact NE-OD2 3.18Å; R290-D300 IonicContact NH2-OD1 3.25Å; R290-D300 PolarHBondContact NH2-OD1 2.88Å; F296-D300 HydrophobicContact CD2-CB 4.01Å; F296-D300 HydrophobicContact CE2-CB 3.7Å; Q297-D300 WeakPolarHBondContact O-CB 3.46Å; Q297-D300 PolarHBondContact O-N 3.46Å; D300-V303 PolarHBondContact O-N 3.2Å; D300-L304 WeakPolarHBondContact O-CG 3.48Å; D300-L304 PolarHBondContact O-N 3.23Å |
| 301 | A | 80.8 | Confident | 76.4 | Confident | 36 Ų | 36 | 81.6 Ų | 81.6 | 30% | 0.298 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59 | -45.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | F296 Q297 L304 N305 | F296-A301 HydrophobicContact CE1-CB 3.65Å; F296-A301 HydrophobicContact CZ-CB 3.75Å; Q297-A301 PolarHBondContact O-N 3.23Å; A301-L304 PolarHBondContact O-N 3.09Å; A301-N305 VanDerWaalsContact O-CB 3.26Å; A301-N305 WeakPolarHBondContact O-CB 3.41Å; A301-N305 PolarHBondContact O-N 3.1Å |
| 302 | A | 81.3 | Confident | 77.1 | Confident | 25 Ų | 25 | 79.3 Ų | 79.3 | 21% | 0.207 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -67.3 | -36.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | V298 T299 N306 | V298-A302 WeakPolarHBondContact O-CB 3.35Å; V298-A302 PolarHBondContact O-N 2.97Å; T299-A302 PolarHBondContact O-N 2.91Å; A302-N306 WeakPolarHBondContact O-CB 3.3Å; A302-N306 PolarHBondContact O-N 2.98Å; A302-N306 PolarHBondContact O-OD1 2.9Å |
| 303 | V | 83.5 | Confident | 78.2 | Confident | 42 Ų | 42 | 76.4 Ų | 76.4 | 26% | 0.255 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64 | -50.1 | 173.8 | 166 | 0 | 0 | 0 | 0 | 110.7 | L283 V287 T299 D300 N305 N306 V307 | L283-V303 HydrophobicContact CD1-CG1 3.85Å; L283-V303 HydrophobicContact CD2-CG1 3.86Å; L283-V303 HydrophobicContact CG-CG1 3.74Å; V287-V303 HydrophobicContact CG2-CG1 4.14Å; T299-V303 WeakPolarHBondContact O-CG2 3.46Å; T299-V303 PolarHBondContact O-N 3.18Å; D300-V303 PolarHBondContact O-N 3.2Å; V303-N305 PolarHBondContact O-N 3.16Å; V303-N306 PolarHBondContact O-N 2.81Å; V303-V307 WeakPolarHBondContact O-CG2 3.1Å; V303-V307 PolarHBondContact O-N 2.96Å |
| 304 | L | 84.3 | Confident | 79.4 | Confident | 64 Ų | 64 | 71.8 Ų | 71.8 | 34% | 0.335 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -63.3 | -39.9 | 178.3 | -70.9 | 177.6 | 0 | 0 | 0 | 112.3 | L284 V287 F296 D300 A301 A308 | L284-L304 HydrophobicContact CD2-CD2 3.76Å; V287-L304 HydrophobicContact CG1-CD1 3.92Å; V287-L304 HydrophobicContact CG1-CD2 4.29Å; V287-L304 HydrophobicContact CG1-CG 4.1Å; F296-L304 HydrophobicContact CE2-CD1 4Å; F296-L304 HydrophobicContact CZ-CD1 4.06Å; D300-L304 WeakPolarHBondContact O-CG 3.48Å; D300-L304 PolarHBondContact O-N 3.23Å; A301-L304 PolarHBondContact O-N 3.09Å; L304-A308 WeakPolarHBondContact O-CB 3.38Å; L304-A308 PolarHBondContact O-N 2.75Å |
| 305 | N | 85.7 | Confident | 80.7 | Confident | 80 Ų | 80 | 75.4 Ų | 75.4 | 43% | 0.428 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.2 | -46.4 | 175.3 | -179.2 | 85.7 | 0 | 0 | 0 | 111.7 | A301 V303 A308 H309 M314 | A301-N305 VanDerWaalsContact O-CB 3.26Å; A301-N305 WeakPolarHBondContact O-CB 3.41Å; A301-N305 PolarHBondContact O-N 3.1Å; V303-N305 PolarHBondContact O-N 3.16Å; N305-A308 PolarHBondContact O-N 3.12Å; N305-H309 WeakPolarHBondContact O-CB 3.37Å; N305-H309 PolarHBondContact O-N 3.44Å; N305-M314 WeakPolarHBondContact OD1-CE 3.44Å |
| 306 | N | 85.4 | Confident | 81.8 | Confident | 86 Ų | 86 | 73.8 Ų | 73.8 | 46% | 0.46 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.2 | -47.7 | 179 | -73.4 | 11.6 | 0 | 0 | 0 | 111.2 | A302 V303 A308 H309 T310 | A302-N306 WeakPolarHBondContact O-CB 3.3Å; A302-N306 PolarHBondContact O-N 2.98Å; A302-N306 PolarHBondContact O-OD1 2.9Å; V303-N306 PolarHBondContact O-N 2.81Å; N306-A308 PolarHBondContact O-N 3.46Å; N306-H309 PolarHBondContact O-N 3.28Å; N306-T310 WeakPolarHBondContact O-CB 3.49Å; N306-T310 PolarHBondContact O-N 3.39Å; N306-T310 PolarHBondContact O-OG1 3.07Å; N306-T310 VanDerWaalsContact O-OG1 3.08Å |
| 307 | V | 86.6 | Confident | 82.6 | Confident | 26 Ų | 26 | 71.8 Ų | 71.8 | 16% | 0.158 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -59.2 | -46.7 | 175.5 | 173.1 | 0 | 0 | 0 | 0 | 110.9 | L283 V303 H309 T310 F311 | L283-V307 HydrophobicContact CD2-CG2 4.2Å; V303-V307 WeakPolarHBondContact O-CG2 3.1Å; V303-V307 PolarHBondContact O-N 2.96Å; V307-H309 VanDerWaalsContact C-N 3.27Å; V307-H309 PolarHBondContact O-N 3.35Å; V307-T310 PolarHBondContact O-N 3.45Å; V307-F311 HydrophobicContact CG1-CD2 3.86Å; V307-F311 HydrophobicContact CG1-CE2 4.19Å; V307-F311 WeakPolarHBondContact O-CD2 3.49Å; V307-F311 PolarHBondContact O-N 3.42Å |
| 308 | A | 84.5 | Confident | 83.1 | Confident | 11 Ų | 11 | 73.2 Ų | 73.2 | 9% | 0.091 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -63.2 | -31.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113 | L304 N305 N306 G312 L313 M314 V317 | L304-A308 WeakPolarHBondContact O-CB 3.38Å; L304-A308 PolarHBondContact O-N 2.75Å; N305-A308 PolarHBondContact O-N 3.12Å; N306-A308 PolarHBondContact O-N 3.46Å; A308-G312 CarbonylContact O-C 3.54Å; A308-G312 PolarHBondContact O-N 2.93Å; A308-L313 HydrophobicContact CB-CB 4.44Å; A308-L313 PolarHBondContact O-N 2.92Å; A308-M314 HydrophobicContact CB-CE 4.07Å; A308-M314 PolarHBondContact O-N 2.92Å; A308-V317 HydrophobicContact CB-CG2 4.36Å |
| 309 | H | 82.6 | Confident | 83.9 | Confident | 138 Ų | 138 | 75.3 Ų | 75.3 | 64% | 0.639 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -79.3 | -39.3 | 176.5 | -160.3 | -46.9 | 0 | 0 | 0 | 112.5 | N305 N306 V307 F311 G312 | N305-H309 WeakPolarHBondContact O-CB 3.37Å; N305-H309 PolarHBondContact O-N 3.44Å; N306-H309 PolarHBondContact O-N 3.28Å; V307-H309 VanDerWaalsContact C-N 3.27Å; V307-H309 PolarHBondContact O-N 3.35Å; H309-F311 VanDerWaalsContact C-N 3.32Å; H309-F311 PolarHBondContact O-N 3Å; H309-G312 PolarHBondContact O-N 3.22Å |
| 310 | T | 81.6 | Confident | 84.7 | Confident | 113 Ų | 113 | 75.6 Ų | 75.6 | 69% | 0.693 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -65.7 | -32.8 | 176.8 | -61.7 | 0 | 0 | 0 | 0 | 112.4 | N306 V307 | N306-T310 WeakPolarHBondContact O-CB 3.49Å; N306-T310 PolarHBondContact O-N 3.39Å; N306-T310 PolarHBondContact O-OG1 3.07Å; N306-T310 VanDerWaalsContact O-OG1 3.08Å; V307-T310 PolarHBondContact O-N 3.45Å |
| 311 | F | 82.2 | Confident | 85.2 | Confident | 113 Ų | 113 | 80.8 Ų | 80.8 | 50% | 0.496 | 44% | 0.444 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.3 | 8.2 | 178.1 | -68.8 | -71.5 | 0 | 0 | 0 | 114.5 | I280 V307 H309 L313 | I280-F311 HydrophobicContact CD1-CE2 4.09Å; I280-F311 HydrophobicContact CD1-CZ 3.65Å; V307-F311 HydrophobicContact CG1-CD2 3.86Å; V307-F311 HydrophobicContact CG1-CE2 4.19Å; V307-F311 WeakPolarHBondContact O-CD2 3.49Å; V307-F311 PolarHBondContact O-N 3.42Å; H309-F311 VanDerWaalsContact C-N 3.32Å; H309-F311 PolarHBondContact O-N 3Å; F311-L313 HydrophobicContact CB-CD1 3.86Å; F311-L313 HydrophobicContact CB-CG 3.78Å; F311-L313 PolarHBondContact O-N 3.34Å; F311-L313 VanDerWaalsContact O-N 3.11Å |
| 312 | G | 84.5 | Confident | 85.6 | Confident | 55 Ų | 55 | 81.5 Ų | 81.5 | 57% | 0.567 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.8 | 16 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | A308 H309 M314 | A308-G312 CarbonylContact O-C 3.54Å; A308-G312 PolarHBondContact O-N 2.93Å; H309-G312 PolarHBondContact O-N 3.22Å; G312-M314 PolarHBondContact O-N 3.2Å |
| 313 | L | 87.1 | Confident | 86.1 | Confident | 80 Ų | 80 | 85.6 Ų | 85.6 | 42% | 0.419 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.8 | -2.6 | -175.1 | -60.4 | 174.5 | 0 | 0 | 0 | 113.5 | A308 F311 D315 T316 V317 | A308-L313 HydrophobicContact CB-CB 4.44Å; A308-L313 PolarHBondContact O-N 2.92Å; F311-L313 HydrophobicContact CB-CD1 3.86Å; F311-L313 HydrophobicContact CB-CG 3.78Å; F311-L313 PolarHBondContact O-N 3.34Å; F311-L313 VanDerWaalsContact O-N 3.11Å; L313-D315 VanDerWaalsContact C-N 3.32Å; L313-D315 PolarHBondContact O-N 3.02Å; L313-T316 CarbonylContact O-C 3.57Å; L313-T316 WeakPolarHBondContact O-CA 3.39Å; L313-T316 WeakPolarHBondContact O-CB 3.28Å; L313-T316 PolarHBondContact O-N 3.32Å; L313-V317 PolarHBondContact O-N 3.18Å |
| 314 | M | 82.8 | Confident | 86.5 | Confident | 72 Ų | 72 | 92 Ų | 92 | 36% | 0.355 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -57.3 | -41.1 | -174.4 | -167.6 | 59.3 | 69.2 | 0 | 0 | 112.9 | N305 A308 G312 T316 V317 K318 | N305-M314 WeakPolarHBondContact OD1-CE 3.44Å; A308-M314 HydrophobicContact CB-CE 4.07Å; A308-M314 PolarHBondContact O-N 2.92Å; G312-M314 PolarHBondContact O-N 3.2Å; M314-T316 VanDerWaalsContact C-N 3.32Å; M314-T316 PolarHBondContact O-N 2.97Å; M314-V317 PolarHBondContact O-N 3.31Å; M314-K318 VanDerWaalsContact O-CB 3.32Å; M314-K318 WeakPolarHBondContact O-CB 3.23Å; M314-K318 PolarHBondContact O-N 3.26Å |
| 315 | D | 83.8 | Confident | 86.9 | Confident | 119 Ų | 119 | 95.7 Ų | 95.7 | 64% | 0.636 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -67.4 | -31.3 | 175.3 | -70.9 | -57.4 | 0 | 0 | 0 | 113 | L313 K319 | L313-D315 VanDerWaalsContact C-N 3.32Å; L313-D315 PolarHBondContact O-N 3.02Å; D315-K319 WeakPolarHBondContact O-CB 3.34Å; D315-K319 PolarHBondContact O-N 3.47Å |
| 316 | T | 85.4 | Confident | 87.2 | Confident | 84 Ų | 84 | 95.2 Ų | 95.2 | 52% | 0.515 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -69.6 | -43.3 | 172.7 | -62 | 0 | 0 | 0 | 0 | 110.9 | L313 M314 K319 V320 | L313-T316 CarbonylContact O-C 3.57Å; L313-T316 WeakPolarHBondContact O-CA 3.39Å; L313-T316 WeakPolarHBondContact O-CB 3.28Å; L313-T316 PolarHBondContact O-N 3.32Å; M314-T316 VanDerWaalsContact C-N 3.32Å; M314-T316 PolarHBondContact O-N 2.97Å; T316-K319 PolarHBondContact O-N 2.99Å; T316-V320 WeakPolarHBondContact O-CG2 3.18Å; T316-V320 PolarHBondContact O-N 3.43Å |
| 317 | V | 88 | Confident | 87.5 | Confident | 67 Ų | 67 | 97.3 Ų | 97.3 | 41% | 0.406 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.5 | -46.5 | 174.9 | 173.6 | 0 | 0 | 0 | 0 | 110.5 | A308 L313 M314 V320 L321 | A308-V317 HydrophobicContact CB-CG2 4.36Å; L313-V317 PolarHBondContact O-N 3.18Å; M314-V317 PolarHBondContact O-N 3.31Å; V317-V320 PolarHBondContact O-N 3.35Å; V317-L321 HydrophobicContact CG1-CD1 4.03Å; V317-L321 WeakPolarHBondContact O-CG 3.32Å; V317-L321 PolarHBondContact O-N 3.49Å |
| 318 | K | 86.7 | Confident | 87.8 | Confident | 124 Ų | 124 | 100.3 Ų | 100.3 | 54% | 0.539 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.5 | -49.1 | 174.9 | -177.9 | -179.9 | 174.8 | -173.6 | 0 | 111.6 | M314 V320 L321 D322 | M314-K318 VanDerWaalsContact O-CB 3.32Å; M314-K318 WeakPolarHBondContact O-CB 3.23Å; M314-K318 PolarHBondContact O-N 3.26Å; K318-V320 VanDerWaalsContact C-N 3.3Å; K318-V320 PolarHBondContact O-N 2.95Å; K318-L321 WeakPolarHBondContact O-CB 3.38Å; K318-L321 PolarHBondContact O-N 3.24Å; K318-L321 VanDerWaalsContact O-N 3.13Å; K318-D322 WeakPolarHBondContact O-CB 3.29Å; K318-D322 PolarHBondContact O-N 3.19Å |
| 319 | K | 90.4 | Very high | 88.2 | Confident | 157 Ų | 157 | 104.3 Ų | 104.3 | 68% | 0.683 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -59.6 | -36.4 | 176.5 | -176.9 | 177.3 | -178.8 | 178 | 0 | 112.9 | D315 T316 N323 | D315-K319 WeakPolarHBondContact O-CB 3.34Å; D315-K319 PolarHBondContact O-N 3.47Å; T316-K319 PolarHBondContact O-N 2.99Å; K319-N323 VanDerWaalsContact O-CB 3.25Å; K319-N323 WeakPolarHBondContact O-CB 3.49Å; K319-N323 PolarHBondContact O-N 2.87Å |
| 320 | V | 91.5 | Very high | 88.6 | Confident | 91 Ų | 91 | 103.1 Ų | 103.1 | 55% | 0.552 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -71.7 | -39.5 | 174.9 | 169.6 | 0 | 0 | 0 | 0 | 111.5 | T316 V317 K318 R324 | T316-V320 WeakPolarHBondContact O-CG2 3.18Å; T316-V320 PolarHBondContact O-N 3.43Å; V317-V320 PolarHBondContact O-N 3.35Å; K318-V320 VanDerWaalsContact C-N 3.3Å; K318-V320 PolarHBondContact O-N 2.95Å; V320-R324 WeakPolarHBondContact O-CB 3.35Å; V320-R324 PolarHBondContact O-N 2.93Å |
| 321 | L | 89.6 | Confident | 89.1 | Confident | 114 Ų | 114 | 98.7 Ų | 98.7 | 60% | 0.597 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64 | -45.8 | 173.6 | -74.5 | 167.9 | 0 | 0 | 0 | 111.8 | V317 K318 R324 R325 | V317-L321 HydrophobicContact CG1-CD1 4.03Å; V317-L321 WeakPolarHBondContact O-CG 3.32Å; V317-L321 PolarHBondContact O-N 3.49Å; K318-L321 WeakPolarHBondContact O-CB 3.38Å; K318-L321 PolarHBondContact O-N 3.24Å; K318-L321 VanDerWaalsContact O-N 3.13Å; L321-R324 PolarHBondContact O-N 3.09Å; L321-R325 VanDerWaalsContact O-CB 3.32Å; L321-R325 WeakPolarHBondContact O-CB 3.28Å; L321-R325 PolarHBondContact O-N 3.07Å |
| 322 | D | 89.6 | Confident | 89.6 | Confident | 51 Ų | 51 | 99 Ų | 99 | 27% | 0.273 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.2 | -45.2 | 176.8 | -75.2 | -36.7 | 0 | 0 | 0 | 111.4 | K318 R324 R325 N326 | K318-D322 WeakPolarHBondContact O-CB 3.29Å; K318-D322 PolarHBondContact O-N 3.19Å; D322-R324 VanDerWaalsContact C-N 3.32Å; D322-R324 PolarHBondContact O-N 3.12Å; D322-R325 PolarHBondContact O-N 3.31Å; D322-R325 IonicContact OD1-CZ 2.64Å; D322-R325 IonicContact OD1-NE 2.66Å; D322-R325 PolarHBondContact OD1-NE 2.98Å; D322-R325 IonicContact OD1-NH2 3.44Å; D322-R325 PolarHBondContact OD1-NH2 3.2Å; D322-N326 WeakPolarHBondContact O-CB 3.38Å; D322-N326 PolarHBondContact O-N 3.49Å; D322-N326 PolarHBondContact O-OD1 2.85Å |
| 323 | N | 92.4 | Very high | 89.9 | Confident | 110 Ų | 110 | 102.2 Ų | 102.2 | 59% | 0.588 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.9 | -40.2 | 175 | -170.8 | 20.7 | 0 | 0 | 0 | 112 | K319 Q327 | K319-N323 VanDerWaalsContact O-CB 3.25Å; K319-N323 WeakPolarHBondContact O-CB 3.49Å; K319-N323 PolarHBondContact O-N 2.87Å; N323-Q327 WeakPolarHBondContact O-CB 3.3Å; N323-Q327 PolarHBondContact O-N 3.02Å |
| 324 | R | 91.9 | Very high | 90.2 | Very high | 177 Ų | 177 | 104.4 Ų | 104.4 | 67% | 0.668 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -72.6 | -34.3 | 177.4 | -170.2 | 167.6 | -175.3 | 162.4 | 2.3 | 112.9 | V320 L321 D322 Q327 V328 | V320-R324 WeakPolarHBondContact O-CB 3.35Å; V320-R324 PolarHBondContact O-N 2.93Å; L321-R324 PolarHBondContact O-N 3.09Å; D322-R324 VanDerWaalsContact C-N 3.32Å; D322-R324 PolarHBondContact O-N 3.12Å; R324-Q327 PolarHBondContact O-N 3.05Å; R324-V328 WeakPolarHBondContact O-CG2 3.41Å; R324-V328 PolarHBondContact O-N 2.86Å |
| 325 | R | 91.7 | Very high | 90.7 | Very high | 141 Ų | 141 | 108.4 Ų | 108.4 | 53% | 0.532 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.5 | -54.5 | 171.5 | 174.9 | 166 | 63.1 | 97.9 | -7.2 | 110 | L321 D322 Q327 V328 E329 | L321-R325 VanDerWaalsContact O-CB 3.32Å; L321-R325 WeakPolarHBondContact O-CB 3.28Å; L321-R325 PolarHBondContact O-N 3.07Å; D322-R325 PolarHBondContact O-N 3.31Å; D322-R325 IonicContact OD1-CZ 2.64Å; D322-R325 IonicContact OD1-NE 2.66Å; D322-R325 PolarHBondContact OD1-NE 2.98Å; D322-R325 IonicContact OD1-NH2 3.44Å; D322-R325 PolarHBondContact OD1-NH2 3.2Å; R325-Q327 VanDerWaalsContact C-N 3.25Å; R325-Q327 PolarHBondContact O-N 3.37Å; R325-V328 PolarHBondContact O-N 2.8Å; R325-E329 WeakPolarHBondContact O-CB 3.3Å; R325-E329 PolarHBondContact O-N 3.23Å |
| 326 | N | 91.9 | Very high | 91.2 | Very high | 70 Ų | 70 | 107.4 Ų | 107.4 | 37% | 0.374 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.4 | -35 | 178.4 | -62.6 | 10.5 | 0 | 0 | 0 | 112.1 | D322 Q330 | D322-N326 WeakPolarHBondContact O-CB 3.38Å; D322-N326 PolarHBondContact O-N 3.49Å; D322-N326 PolarHBondContact O-OD1 2.85Å; N326-Q330 WeakPolarHBondContact O-CB 3.48Å; N326-Q330 VanDerWaalsContact O-CG 3.26Å; N326-Q330 WeakPolarHBondContact O-CG 3.26Å; N326-Q330 PolarHBondContact O-N 3.24Å |
| 327 | Q | 92.8 | Very high | 91.7 | Very high | 131 Ų | 131 | 111.4 Ų | 111.4 | 61% | 0.612 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66.9 | -40 | 174.2 | 178.6 | 178.5 | 99.3 | 0 | 0 | 113 | N323 R324 R325 G331 | N323-Q327 WeakPolarHBondContact O-CB 3.3Å; N323-Q327 PolarHBondContact O-N 3.02Å; R324-Q327 PolarHBondContact O-N 3.05Å; R325-Q327 VanDerWaalsContact C-N 3.25Å; R325-Q327 PolarHBondContact O-N 3.37Å; Q327-G331 PolarHBondContact O-N 2.85Å; Q327-G331 VanDerWaalsContact O-N 3.16Å |
| 328 | V | 92.8 | Very high | 92.1 | Very high | 88 Ų | 88 | 111.5 Ų | 111.5 | 53% | 0.533 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -69 | -44.3 | 175.7 | 170.6 | 0 | 0 | 0 | 0 | 110.3 | R324 R325 G331 E332 | R324-V328 WeakPolarHBondContact O-CG2 3.41Å; R324-V328 PolarHBondContact O-N 2.86Å; R325-V328 PolarHBondContact O-N 2.8Å; V328-G331 CarbonylContact O-C 3.54Å; V328-G331 WeakPolarHBondContact O-CA 3.28Å; V328-G331 PolarHBondContact O-N 3.26Å; V328-G331 VanDerWaalsContact O-N 3.09Å; V328-E332 PolarHBondContact O-N 2.79Å |
| 329 | E | 93 | Very high | 92.5 | Very high | 96 Ų | 96 | 110 Ų | 110 | 45% | 0.449 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.9 | -49.6 | 178.4 | -168.4 | 165.7 | -159.3 | 0 | 0 | 111.5 | R325 G331 E332 E333 | R325-E329 WeakPolarHBondContact O-CB 3.3Å; R325-E329 PolarHBondContact O-N 3.23Å; E329-G331 PolarHBondContact O-N 3.12Å; E329-E332 PolarHBondContact O-N 2.84Å; E329-E332 VanDerWaalsContact O-N 3.15Å; E329-E333 WeakPolarHBondContact O-CG 3.5Å; E329-E333 PolarHBondContact O-N 3.31Å |
| 330 | Q | 91.6 | Very high | 92.8 | Very high | 113 Ų | 113 | 106.5 Ų | 106.5 | 53% | 0.528 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.3 | -29.5 | 172.9 | -74.4 | 176.7 | 7.4 | 0 | 0 | 113.6 | N326 Q334 | N326-Q330 WeakPolarHBondContact O-CB 3.48Å; N326-Q330 VanDerWaalsContact O-CG 3.26Å; N326-Q330 WeakPolarHBondContact O-CG 3.26Å; N326-Q330 PolarHBondContact O-N 3.24Å; Q330-Q334 WeakPolarHBondContact O-CB 3.44Å; Q330-Q334 VanDerWaalsContact O-CG 3.25Å; Q330-Q334 WeakPolarHBondContact O-CG 3.14Å; Q330-Q334 PolarHBondContact O-N 2.98Å; Q330-Q334 PolarHBondContact O-NE2 2.93Å |
| 331 | G | 91.1 | Very high | 93 | Very high | 19 Ų | 19 | 104 Ų | 104 | 20% | 0.196 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -70 | -46.2 | 173 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q327 V328 E329 Q334 F335 | Q327-G331 PolarHBondContact O-N 2.85Å; Q327-G331 VanDerWaalsContact O-N 3.16Å; V328-G331 CarbonylContact O-C 3.54Å; V328-G331 WeakPolarHBondContact O-CA 3.28Å; V328-G331 PolarHBondContact O-N 3.26Å; V328-G331 VanDerWaalsContact O-N 3.09Å; E329-G331 PolarHBondContact O-N 3.12Å; G331-Q334 PolarHBondContact O-N 3.16Å; G331-F335 WeakPolarHBondContact O-CD2 3.46Å; G331-F335 WeakPolarHBondContact O-CG 3.43Å; G331-F335 PolarHBondContact O-N 3.18Å |
| 332 | E | 92.1 | Very high | 93.4 | Very high | 119 Ų | 119 | 103.4 Ų | 103.4 | 56% | 0.556 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.5 | -43.8 | 176.6 | -172.1 | 168.9 | 178.1 | 0 | 0 | 111.6 | V328 E329 Q334 F335 L336 | V328-E332 PolarHBondContact O-N 2.79Å; E329-E332 PolarHBondContact O-N 2.84Å; E329-E332 VanDerWaalsContact O-N 3.15Å; E332-Q334 VanDerWaalsContact C-N 3.32Å; E332-Q334 PolarHBondContact O-N 3.46Å; E332-F335 PolarHBondContact O-N 3.25Å; E332-F335 VanDerWaalsContact O-N 3.17Å; E332-L336 HydrophobicContact CG-CD1 4.05Å; E332-L336 HydrophobicContact CG-CG 4.45Å; E332-L336 WeakPolarHBondContact O-CB 3.32Å; E332-L336 VanDerWaalsContact O-CG 3.3Å; E332-L336 WeakPolarHBondContact O-CG 3.35Å; E332-L336 PolarHBondContact O-N 2.94Å |
| 333 | E | 92.5 | Very high | 93.7 | Very high | 123 Ų | 123 | 106.6 Ų | 106.6 | 58% | 0.575 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -57.4 | -42.1 | 171.9 | -72.8 | -175.6 | 142.9 | 0 | 0 | 112.3 | E329 L336 Y337 | E329-E333 WeakPolarHBondContact O-CG 3.5Å; E329-E333 PolarHBondContact O-N 3.31Å; E333-L336 PolarHBondContact O-N 3.35Å; E333-Y337 VanDerWaalsContact O-CB 3.28Å; E333-Y337 WeakPolarHBondContact O-CB 3.46Å; E333-Y337 PolarHBondContact O-N 3.5Å |
| 334 | Q | 92.7 | Very high | 93.8 | Very high | 127 Ų | 127 | 109.3 Ų | 109.3 | 59% | 0.593 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.2 | -38.1 | 175.9 | -76.2 | 169.3 | 60.4 | 0 | 0 | 112.3 | Q330 G331 E332 T338 | Q330-Q334 WeakPolarHBondContact O-CB 3.44Å; Q330-Q334 VanDerWaalsContact O-CG 3.25Å; Q330-Q334 WeakPolarHBondContact O-CG 3.14Å; Q330-Q334 PolarHBondContact O-N 2.98Å; Q330-Q334 PolarHBondContact O-NE2 2.93Å; G331-Q334 PolarHBondContact O-N 3.16Å; E332-Q334 VanDerWaalsContact C-N 3.32Å; E332-Q334 PolarHBondContact O-N 3.46Å; Q334-T338 WeakPolarHBondContact O-CB 3.08Å; Q334-T338 WeakPolarHBondContact O-CG2 3.37Å; Q334-T338 PolarHBondContact O-N 3.4Å; Q334-T338 PolarHBondContact O-OG1 2.98Å |
| 335 | F | 94.1 | Very high | 94 | Very high | 156 Ų | 156 | 105.7 Ų | 105.7 | 68% | 0.684 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -68.2 | -40.9 | 173.8 | -70.3 | -56.2 | 0 | 0 | 0 | 112.1 | G331 E332 T338 L339 | G331-F335 WeakPolarHBondContact O-CD2 3.46Å; G331-F335 WeakPolarHBondContact O-CG 3.43Å; G331-F335 PolarHBondContact O-N 3.18Å; E332-F335 PolarHBondContact O-N 3.25Å; E332-F335 VanDerWaalsContact O-N 3.17Å; F335-T338 WeakPolarHBondContact CA-OG1 3.4Å; F335-T338 PolarHBondContact O-OG1 3.43Å; F335-L339 WeakPolarHBondContact O-CB 3.41Å; F335-L339 PolarHBondContact O-N 2.91Å |
| 336 | L | 94.3 | Very high | 94.2 | Very high | 98 Ų | 98 | 104.9 Ų | 104.9 | 51% | 0.513 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.3 | -44.3 | 175.3 | -73 | 167.2 | 0 | 0 | 0 | 111.6 | E332 E333 T340 | E332-L336 HydrophobicContact CG-CD1 4.05Å; E332-L336 HydrophobicContact CG-CG 4.45Å; E332-L336 WeakPolarHBondContact O-CB 3.32Å; E332-L336 VanDerWaalsContact O-CG 3.3Å; E332-L336 WeakPolarHBondContact O-CG 3.35Å; E332-L336 PolarHBondContact O-N 2.94Å; E333-L336 PolarHBondContact O-N 3.35Å; L336-T340 WeakPolarHBondContact O-CB 3.17Å; L336-T340 PolarHBondContact O-N 3.28Å; L336-T340 PolarHBondContact O-OG1 3.07Å |
| 337 | Y | 95.5 | Very high | 94.3 | Very high | 168 Ų | 168 | 106.2 Ų | 106.2 | 66% | 0.659 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.9 | -47.1 | 176.4 | -179 | -93.7 | 0 | 0 | 0 | 112 | E333 T340 D341 | E333-Y337 VanDerWaalsContact O-CB 3.28Å; E333-Y337 WeakPolarHBondContact O-CB 3.46Å; E333-Y337 PolarHBondContact O-N 3.5Å; Y337-T340 PolarHBondContact O-N 2.79Å; Y337-D341 PolarHBondContact O-N 2.91Å |
| 338 | T | 95.8 | Very high | 94.4 | Very high | 68 Ų | 68 | 103.4 Ų | 103.4 | 42% | 0.417 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -69.6 | -35.1 | 179.5 | 50.7 | 0 | 0 | 0 | 0 | 112.6 | Q334 F335 D341 L342 | Q334-T338 WeakPolarHBondContact O-CB 3.08Å; Q334-T338 WeakPolarHBondContact O-CG2 3.37Å; Q334-T338 PolarHBondContact O-N 3.4Å; Q334-T338 PolarHBondContact O-OG1 2.98Å; F335-T338 WeakPolarHBondContact CA-OG1 3.4Å; F335-T338 PolarHBondContact O-OG1 3.43Å; T338-D341 PolarHBondContact O-N 2.89Å; T338-L342 WeakPolarHBondContact O-CB 3.47Å; T338-L342 VanDerWaalsContact O-CG 3.25Å; T338-L342 WeakPolarHBondContact O-CG 3.28Å; T338-L342 PolarHBondContact O-N 3.25Å |
| 339 | L | 96.1 | Very high | 94.4 | Very high | 92 Ų | 92 | 105 Ų | 105 | 48% | 0.482 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.9 | -47.4 | 171.3 | -174.5 | 150.9 | 0 | 0 | 0 | 110.9 | F335 D341 L342 E343 | F335-L339 WeakPolarHBondContact O-CB 3.41Å; F335-L339 PolarHBondContact O-N 2.91Å; L339-D341 VanDerWaalsContact C-N 3.3Å; L339-D341 PolarHBondContact O-N 3.26Å; L339-L342 PolarHBondContact O-N 2.89Å; L339-L342 VanDerWaalsContact O-N 3.14Å; L339-E343 HydrophobicContact CD2-CG 4.15Å; L339-E343 WeakPolarHBondContact O-CG 3.4Å; L339-E343 PolarHBondContact O-N 2.85Å |
| 340 | T | 95.8 | Very high | 94.5 | Very high | 84 Ų | 84 | 106 Ų | 106 | 52% | 0.515 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.4 | -38.5 | 177 | -54.4 | 0 | 0 | 0 | 0 | 111.8 | L336 Y337 R344 | L336-T340 WeakPolarHBondContact O-CB 3.17Å; L336-T340 PolarHBondContact O-N 3.28Å; L336-T340 PolarHBondContact O-OG1 3.07Å; Y337-T340 PolarHBondContact O-N 2.79Å; T340-R344 WeakPolarHBondContact O-CB 3.33Å; T340-R344 PolarHBondContact O-N 3.5Å |
| 341 | D | 96.5 | Very high | 94.7 | Very high | 38 Ų | 38 | 105.6 Ų | 105.6 | 20% | 0.203 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -69.8 | -39.4 | 174.4 | -172.4 | 50.2 | 0 | 0 | 0 | 112.7 | Y337 T338 L339 E343 R344 Q345 | Y337-D341 PolarHBondContact O-N 2.91Å; T338-D341 PolarHBondContact O-N 2.89Å; L339-D341 VanDerWaalsContact C-N 3.3Å; L339-D341 PolarHBondContact O-N 3.26Å; D341-E343 VanDerWaalsContact C-N 3.34Å; D341-E343 PolarHBondContact O-N 3.46Å; D341-R344 WeakPolarHBondContact O-CB 3.13Å; D341-R344 PolarHBondContact O-N 2.76Å; D341-R344 IonicContact OD1-CZ 2.63Å; D341-R344 IonicContact OD1-NE 2.66Å; D341-R344 PolarHBondContact OD1-NE 2.88Å; D341-R344 IonicContact OD1-NH2 3.14Å; D341-R344 PolarHBondContact OD1-NH2 2.89Å; D341-Q345 WeakPolarHBondContact O-CB 3.45Å; D341-Q345 VanDerWaalsContact O-CG 3.3Å; D341-Q345 WeakPolarHBondContact O-CG 3.36Å; D341-Q345 PolarHBondContact O-N 3.32Å; D341-Q345 PolarHBondContact OD2-NE2 3.22Å |
| 342 | L | 96.5 | Very high | 94.7 | Very high | 102 Ų | 102 | 109.3 Ų | 109.3 | 53% | 0.534 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.7 | -36.5 | 175.8 | -72.5 | 169 | 0 | 0 | 0 | 112.1 | T338 L339 Q345 L346 | T338-L342 WeakPolarHBondContact O-CB 3.47Å; T338-L342 VanDerWaalsContact O-CG 3.25Å; T338-L342 WeakPolarHBondContact O-CG 3.28Å; T338-L342 PolarHBondContact O-N 3.25Å; L339-L342 PolarHBondContact O-N 2.89Å; L339-L342 VanDerWaalsContact O-N 3.14Å; L342-Q345 PolarHBondContact O-N 3.01Å; L342-L346 WeakPolarHBondContact O-CB 3.46Å; L342-L346 PolarHBondContact O-N 2.73Å |
| 343 | E | 95.8 | Very high | 94.6 | Very high | 119 Ų | 119 | 106.3 Ų | 106.3 | 56% | 0.556 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.6 | -44.6 | 170.2 | -72.3 | -173.2 | 155.1 | 0 | 0 | 111.6 | L339 D341 Q345 L346 E347 | L339-E343 HydrophobicContact CD2-CG 4.15Å; L339-E343 WeakPolarHBondContact O-CG 3.4Å; L339-E343 PolarHBondContact O-N 2.85Å; D341-E343 VanDerWaalsContact C-N 3.34Å; D341-E343 PolarHBondContact O-N 3.46Å; E343-Q345 VanDerWaalsContact C-N 3.34Å; E343-Q345 PolarHBondContact O-N 3.37Å; E343-L346 PolarHBondContact O-N 2.76Å; E343-E347 PolarHBondContact O-N 3.24Å |
| 344 | R | 96.3 | Very high | 94.4 | Very high | 167 Ų | 167 | 106.1 Ų | 106.1 | 63% | 0.63 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -58.9 | -43.3 | 173.7 | 179.7 | 177.1 | 74.1 | 154 | 1.3 | 112 | T340 D341 E347 E348 | T340-R344 WeakPolarHBondContact O-CB 3.33Å; T340-R344 PolarHBondContact O-N 3.5Å; D341-R344 WeakPolarHBondContact O-CB 3.13Å; D341-R344 PolarHBondContact O-N 2.76Å; D341-R344 IonicContact OD1-CZ 2.63Å; D341-R344 IonicContact OD1-NE 2.66Å; D341-R344 PolarHBondContact OD1-NE 2.88Å; D341-R344 IonicContact OD1-NH2 3.14Å; D341-R344 PolarHBondContact OD1-NH2 2.89Å; R344-E347 PolarHBondContact O-N 3.08Å; R344-E348 WeakPolarHBondContact O-CB 3.26Å; R344-E348 PolarHBondContact O-N 3.37Å |
| 345 | Q | 96.1 | Very high | 94.2 | Very high | 101 Ų | 101 | 103.1 Ų | 103.1 | 47% | 0.472 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 176 | -71.9 | -176.2 | 42.8 | 0 | 0 | 111.7 | D341 L342 E343 E348 Q349 | D341-Q345 WeakPolarHBondContact O-CB 3.45Å; D341-Q345 VanDerWaalsContact O-CG 3.3Å; D341-Q345 WeakPolarHBondContact O-CG 3.36Å; D341-Q345 PolarHBondContact O-N 3.32Å; D341-Q345 PolarHBondContact OD2-NE2 3.22Å; L342-Q345 PolarHBondContact O-N 3.01Å; E343-Q345 VanDerWaalsContact C-N 3.34Å; E343-Q345 PolarHBondContact O-N 3.37Å; Q345-E348 PolarHBondContact O-N 3.14Å; Q345-Q349 WeakPolarHBondContact O-CB 3.11Å; Q345-Q349 VanDerWaalsContact O-CG 3.3Å; Q345-Q349 WeakPolarHBondContact O-CG 3.27Å; Q345-Q349 PolarHBondContact O-N 3.08Å |
| 346 | L | 94.6 | Very high | 93.7 | Very high | 124 Ų | 124 | 102 Ų | 102 | 65% | 0.649 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.7 | -43 | 175.2 | -86.2 | 175.3 | 0 | 0 | 0 | 112.4 | L342 E343 Q349 K350 | L342-L346 WeakPolarHBondContact O-CB 3.46Å; L342-L346 PolarHBondContact O-N 2.73Å; E343-L346 PolarHBondContact O-N 2.76Å; L346-Q349 PolarHBondContact O-N 3.36Å; L346-K350 WeakPolarHBondContact O-CB 3.36Å; L346-K350 PolarHBondContact O-N 3.29Å |
| 347 | E | 94.9 | Very high | 93.2 | Very high | 98 Ų | 98 | 106.9 Ų | 106.9 | 46% | 0.458 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.8 | -37.8 | 179.3 | -169.3 | 56.4 | -144.3 | 0 | 0 | 111.7 | E343 R344 K350 K351 | E343-E347 PolarHBondContact O-N 3.24Å; R344-E347 PolarHBondContact O-N 3.08Å; E347-K350 PolarHBondContact O-N 2.89Å; E347-K350 IonicContact OE1-NZ 3.61Å; E347-K350 PolarHBondContact OE1-NZ 3.02Å; E347-K350 IonicContact OE2-NZ 2.64Å; E347-K350 PolarHBondContact OE2-NZ 3.33Å; E347-K351 WeakPolarHBondContact O-CB 3.21Å; E347-K351 PolarHBondContact O-N 3.25Å |
| 348 | E | 94.6 | Very high | 92.6 | Very high | 71 Ų | 71 | 103 Ų | 103 | 33% | 0.332 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.1 | -39.4 | 173 | -178 | 57 | -149.9 | 0 | 0 | 112 | R344 Q345 K351 Q352 | R344-E348 WeakPolarHBondContact O-CB 3.26Å; R344-E348 PolarHBondContact O-N 3.37Å; Q345-E348 PolarHBondContact O-N 3.14Å; E348-K351 PolarHBondContact O-N 3.48Å; E348-K351 IonicContact OE1-NZ 2.72Å; E348-K351 IonicContact OE2-NZ 3.31Å; E348-K351 PolarHBondContact OE2-NZ 2.84Å; E348-Q352 WeakPolarHBondContact O-CB 3.5Å; E348-Q352 VanDerWaalsContact O-CG 3.29Å; E348-Q352 WeakPolarHBondContact O-CG 3.43Å; E348-Q352 PolarHBondContact O-N 3.16Å; E348-Q352 WeakPolarHBondContact OE1-CG 3.32Å; E348-Q352 PolarHBondContact OE1-NE2 3.4Å |
| 349 | Q | 93.6 | Very high | 92 | Very high | 121 Ų | 121 | 105.5 Ų | 105.5 | 57% | 0.565 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.2 | -44.3 | 171.7 | -77.1 | -66.3 | -34.2 | 0 | 0 | 112.2 | Q345 L346 Q352 A353 | Q345-Q349 WeakPolarHBondContact O-CB 3.11Å; Q345-Q349 VanDerWaalsContact O-CG 3.3Å; Q345-Q349 WeakPolarHBondContact O-CG 3.27Å; Q345-Q349 PolarHBondContact O-N 3.08Å; L346-Q349 PolarHBondContact O-N 3.36Å; Q349-Q352 PolarHBondContact O-N 3.27Å; Q349-A353 WeakPolarHBondContact O-CB 3.49Å; Q349-A353 PolarHBondContact O-N 2.85Å |
| 350 | K | 94.6 | Very high | 90.8 | Very high | 117 Ų | 117 | 104 Ų | 104 | 51% | 0.509 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.9 | -43.9 | 176.1 | 167.4 | 164.6 | 159.8 | -89.1 | 0 | 111.6 | L346 E347 A353 Q354 | L346-K350 WeakPolarHBondContact O-CB 3.36Å; L346-K350 PolarHBondContact O-N 3.29Å; E347-K350 PolarHBondContact O-N 2.89Å; E347-K350 IonicContact OE1-NZ 3.61Å; E347-K350 PolarHBondContact OE1-NZ 3.02Å; E347-K350 IonicContact OE2-NZ 2.64Å; E347-K350 PolarHBondContact OE2-NZ 3.33Å; K350-A353 PolarHBondContact O-N 3.37Å; K350-Q354 PolarHBondContact O-N 3.31Å |
| 351 | K | 94.5 | Very high | 89.5 | Confident | 106 Ų | 106 | 105.4 Ų | 105.4 | 46% | 0.461 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.9 | -46.8 | 173.3 | 173.9 | 179.6 | 151.7 | -139.6 | 0 | 111.9 | E347 E348 A353 Q354 D355 | E347-K351 WeakPolarHBondContact O-CB 3.21Å; E347-K351 PolarHBondContact O-N 3.25Å; E348-K351 PolarHBondContact O-N 3.48Å; E348-K351 IonicContact OE1-NZ 2.72Å; E348-K351 IonicContact OE2-NZ 3.31Å; E348-K351 PolarHBondContact OE2-NZ 2.84Å; K351-A353 VanDerWaalsContact C-N 3.33Å; K351-A353 PolarHBondContact O-N 3.19Å; K351-Q354 PolarHBondContact O-N 3.03Å; K351-D355 WeakPolarHBondContact O-CB 3.39Å; K351-D355 PolarHBondContact O-N 3.04Å |
| 352 | Q | 91.5 | Very high | 87.9 | Confident | 97 Ų | 97 | 107.8 Ų | 107.8 | 45% | 0.453 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.4 | -38.1 | 176.1 | -73.3 | 177.6 | 23.1 | 0 | 0 | 112.4 | E348 Q349 D355 H356 | E348-Q352 WeakPolarHBondContact O-CB 3.5Å; E348-Q352 VanDerWaalsContact O-CG 3.29Å; E348-Q352 WeakPolarHBondContact O-CG 3.43Å; E348-Q352 PolarHBondContact O-N 3.16Å; E348-Q352 WeakPolarHBondContact OE1-CG 3.32Å; E348-Q352 PolarHBondContact OE1-NE2 3.4Å; Q349-Q352 PolarHBondContact O-N 3.27Å; Q352-D355 PolarHBondContact O-N 3.35Å; Q352-H356 WeakPolarHBondContact O-CB 3.5Å; Q352-H356 PolarHBondContact O-N 3.13Å |
| 353 | A | 89.9 | Confident | 86.1 | Confident | 56 Ų | 56 | 107.5 Ų | 107.5 | 46% | 0.463 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.3 | -38.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q349 K350 K351 H356 R357 | Q349-A353 WeakPolarHBondContact O-CB 3.49Å; Q349-A353 PolarHBondContact O-N 2.85Å; K350-A353 PolarHBondContact O-N 3.37Å; K351-A353 VanDerWaalsContact C-N 3.33Å; K351-A353 PolarHBondContact O-N 3.19Å; A353-H356 PolarHBondContact O-N 3.13Å; A353-R357 WeakPolarHBondContact O-CG 3.49Å; A353-R357 PolarHBondContact O-N 3.4Å |
| 354 | Q | 88.6 | Confident | 84.2 | Confident | 118 Ų | 118 | 108.1 Ų | 108.1 | 55% | 0.551 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.5 | -45.8 | 173 | 178.6 | 171.6 | -19.7 | 0 | 0 | 111.5 | K350 K351 H356 R357 L358 | K350-Q354 PolarHBondContact O-N 3.31Å; K351-Q354 PolarHBondContact O-N 3.03Å; Q354-H356 VanDerWaalsContact C-N 3.32Å; Q354-H356 PolarHBondContact O-N 2.88Å; Q354-R357 WeakPolarHBondContact O-CB 3.5Å; Q354-R357 PolarHBondContact O-N 3.42Å; Q354-R357 VanDerWaalsContact O-N 3.16Å; Q354-L358 HydrophobicContact CG-CD1 4.25Å; Q354-L358 WeakPolarHBondContact O-CG 3.29Å; Q354-L358 PolarHBondContact O-N 2.85Å |
| 355 | D | 88.8 | Confident | 82.3 | Confident | 65 Ų | 65 | 105 Ų | 105 | 35% | 0.348 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -58.4 | -43.3 | 174.7 | -111.2 | 35 | 0 | 0 | 0 | 111.7 | K351 Q352 L358 K359 | K351-D355 WeakPolarHBondContact O-CB 3.39Å; K351-D355 PolarHBondContact O-N 3.04Å; Q352-D355 PolarHBondContact O-N 3.35Å; D355-L358 PolarHBondContact O-N 3Å; D355-K359 WeakPolarHBondContact O-CB 3.35Å; D355-K359 WeakPolarHBondContact O-CD 3.35Å; D355-K359 WeakPolarHBondContact O-CG 3.49Å; D355-K359 PolarHBondContact O-N 3.24Å; D355-K359 WeakPolarHBondContact OD2-CE 3.21Å; D355-K359 IonicContact OD2-NZ 3.45Å; D355-K359 PolarHBondContact OD2-NZ 3.29Å |
| 356 | H | 83.1 | Confident | 80.3 | Confident | 133 Ų | 133 | 105.2 Ų | 105.2 | 62% | 0.616 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.4 | -38.3 | 176.2 | -174 | -98.7 | 0 | 0 | 0 | 111.9 | Q352 A353 Q354 S360 | Q352-H356 WeakPolarHBondContact O-CB 3.5Å; Q352-H356 PolarHBondContact O-N 3.13Å; A353-H356 PolarHBondContact O-N 3.13Å; Q354-H356 VanDerWaalsContact C-N 3.32Å; Q354-H356 PolarHBondContact O-N 2.88Å; H356-S360 WeakPolarHBondContact O-CB 3.26Å; H356-S360 PolarHBondContact O-N 2.78Å |
| 357 | R | 83.8 | Confident | 78.3 | Confident | 200 Ų | 200 | 104.9 Ų | 104.9 | 76% | 0.755 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.4 | -47.5 | 171.5 | -77.8 | -175.8 | 175.5 | -153.2 | 0.7 | 111.9 | A353 Q354 S360 Q361 | A353-R357 WeakPolarHBondContact O-CG 3.49Å; A353-R357 PolarHBondContact O-N 3.4Å; Q354-R357 WeakPolarHBondContact O-CB 3.5Å; Q354-R357 PolarHBondContact O-N 3.42Å; Q354-R357 VanDerWaalsContact O-N 3.16Å; R357-S360 PolarHBondContact O-N 3.07Å; R357-Q361 VanDerWaalsContact O-CB 3.3Å; R357-Q361 WeakPolarHBondContact O-CB 3.49Å; R357-Q361 PolarHBondContact O-N 3.32Å |
| 358 | L | 83.7 | Confident | 76 | Confident | 85 Ų | 85 | 106.2 Ų | 106.2 | 45% | 0.445 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 179.3 | -68.7 | 170.7 | 0 | 0 | 0 | 112.1 | Q354 D355 T362 | Q354-L358 HydrophobicContact CG-CD1 4.25Å; Q354-L358 WeakPolarHBondContact O-CG 3.29Å; Q354-L358 PolarHBondContact O-N 2.85Å; D355-L358 PolarHBondContact O-N 3Å; L358-T362 WeakPolarHBondContact O-CB 3.4Å; L358-T362 PolarHBondContact O-N 3.43Å; L358-T362 PolarHBondContact O-OG1 3.16Å |
| 359 | K | 81.6 | Confident | 73.3 | Confident | 122 Ų | 122 | 109.8 Ų | 109.8 | 53% | 0.53 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66.1 | -44.3 | 175.6 | -70.2 | 161.5 | -166.7 | 166.6 | 0 | 111.1 | D355 T362 V363 | D355-K359 WeakPolarHBondContact O-CB 3.35Å; D355-K359 WeakPolarHBondContact O-CD 3.35Å; D355-K359 WeakPolarHBondContact O-CG 3.49Å; D355-K359 PolarHBondContact O-N 3.24Å; D355-K359 WeakPolarHBondContact OD2-CE 3.21Å; D355-K359 IonicContact OD2-NZ 3.45Å; D355-K359 PolarHBondContact OD2-NZ 3.29Å; K359-T362 WeakPolarHBondContact O-CB 3.46Å; K359-T362 PolarHBondContact O-N 3.15Å; K359-V363 WeakPolarHBondContact O-CG2 3.43Å; K359-V363 PolarHBondContact O-N 3.12Å |
| 360 | S | 72.5 | Confident | 71 | Confident | 59 Ų | 59 | 109.3 Ų | 109.3 | 41% | 0.413 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.3 | -45.6 | 175.6 | -176.3 | 0 | 0 | 0 | 0 | 112.1 | H356 R357 T362 V363 Q364 | H356-S360 WeakPolarHBondContact O-CB 3.26Å; H356-S360 PolarHBondContact O-N 2.78Å; R357-S360 PolarHBondContact O-N 3.07Å; S360-T362 VanDerWaalsContact C-N 3.33Å; S360-T362 PolarHBondContact O-N 3.04Å; S360-V363 PolarHBondContact O-N 3.33Å; S360-Q364 WeakPolarHBondContact O-CB 3.32Å; S360-Q364 PolarHBondContact O-N 3.02Å |
| 361 | Q | 66.9 | Low | 68.5 | Low | 115 Ų | 115 | 109.8 Ų | 109.8 | 54% | 0.537 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63 | -37.8 | 175.4 | -168.8 | 173.3 | 35.3 | 0 | 0 | 112 | R357 Q364 N365 | R357-Q361 VanDerWaalsContact O-CB 3.3Å; R357-Q361 WeakPolarHBondContact O-CB 3.49Å; R357-Q361 PolarHBondContact O-N 3.32Å; Q361-Q364 PolarHBondContact O-N 2.9Å; Q361-N365 VanDerWaalsContact O-CG 3.24Å; Q361-N365 PolarHBondContact O-N 3.04Å; Q361-N365 PolarHBondContact O-ND2 3.49Å |
| 362 | T | 64 | Low | 66.3 | Low | 87 Ų | 87 | 110.2 Ų | 110.2 | 53% | 0.534 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -63.9 | -46.9 | 174.1 | -57.7 | 0 | 0 | 0 | 0 | 111.7 | L358 K359 S360 Q364 N365 V366 | L358-T362 WeakPolarHBondContact O-CB 3.4Å; L358-T362 PolarHBondContact O-N 3.43Å; L358-T362 PolarHBondContact O-OG1 3.16Å; K359-T362 WeakPolarHBondContact O-CB 3.46Å; K359-T362 PolarHBondContact O-N 3.15Å; S360-T362 VanDerWaalsContact C-N 3.33Å; S360-T362 PolarHBondContact O-N 3.04Å; T362-Q364 VanDerWaalsContact C-N 3.31Å; T362-Q364 PolarHBondContact O-N 3.14Å; T362-N365 PolarHBondContact O-N 3.42Å; T362-V366 WeakPolarHBondContact O-CG2 3.21Å; T362-V366 PolarHBondContact O-N 2.81Å |
| 363 | V | 58.6 | Low | 64 | Low | 96 Ų | 96 | 111.4 Ų | 111.4 | 58% | 0.582 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -61.2 | -41.2 | 175.2 | 172.3 | 0 | 0 | 0 | 0 | 111 | K359 S360 N365 V366 V367 | K359-V363 WeakPolarHBondContact O-CG2 3.43Å; K359-V363 PolarHBondContact O-N 3.12Å; S360-V363 PolarHBondContact O-N 3.33Å; V363-N365 VanDerWaalsContact C-N 3.31Å; V363-N365 PolarHBondContact O-N 2.8Å; V363-V366 PolarHBondContact O-N 3.27Å; V363-V367 WeakPolarHBondContact O-CG2 3.32Å; V363-V367 PolarHBondContact O-N 3.01Å; V363-V367 VanDerWaalsContact O-N 3.12Å |
| 364 | Q | 56.3 | Low | 61.6 | Low | 132 Ų | 132 | 115 Ų | 115 | 62% | 0.617 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.3 | -33.3 | 178.2 | -166.8 | 154.4 | 81.3 | 0 | 0 | 112.5 | S360 Q361 T362 | S360-Q364 WeakPolarHBondContact O-CB 3.32Å; S360-Q364 PolarHBondContact O-N 3.02Å; Q361-Q364 PolarHBondContact O-N 2.9Å; T362-Q364 VanDerWaalsContact C-N 3.31Å; T362-Q364 PolarHBondContact O-N 3.14Å |
| 365 | N | 56 | Low | 59.3 | Low | 103 Ų | 103 | 119 Ų | 119 | 55% | 0.551 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -71.2 | -36.8 | 172 | -71.3 | -20.9 | 0 | 0 | 0 | 112.8 | Q361 T362 V363 V367 L368 | Q361-N365 VanDerWaalsContact O-CG 3.24Å; Q361-N365 PolarHBondContact O-N 3.04Å; Q361-N365 PolarHBondContact O-ND2 3.49Å; T362-N365 PolarHBondContact O-N 3.42Å; V363-N365 VanDerWaalsContact C-N 3.31Å; V363-N365 PolarHBondContact O-N 2.8Å; N365-V367 VanDerWaalsContact C-N 3.31Å; N365-V367 PolarHBondContact O-N 3.38Å; N365-L368 PolarHBondContact O-N 2.96Å |
| 366 | V | 54.8 | Low | 57.1 | Low | 105 Ų | 105 | 121.4 Ų | 121.4 | 64% | 0.636 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -66.9 | -32.1 | 176.8 | 171.8 | 0 | 0 | 0 | 0 | 112 | T362 V363 L368 | T362-V366 WeakPolarHBondContact O-CG2 3.21Å; T362-V366 PolarHBondContact O-N 2.81Å; V363-V366 PolarHBondContact O-N 3.27Å; V366-L368 PolarHBondContact O-N 3.36Å |
| 367 | V | 51.8 | Low | 55.4 | Low | 116 Ų | 116 | 121.3 Ų | 121.3 | 70% | 0.703 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | -10.2 | 176.1 | 170.6 | 0 | 0 | 0 | 0 | 113.2 | V363 N365 | V363-V367 WeakPolarHBondContact O-CG2 3.32Å; V363-V367 PolarHBondContact O-N 3.01Å; V363-V367 VanDerWaalsContact O-N 3.12Å; N365-V367 VanDerWaalsContact C-N 3.31Å; N365-V367 PolarHBondContact O-N 3.38Å |
| 368 | L | 45.8 | Very low | 53.2 | Low | 126 Ų | 126 | 120.7 Ų | 120.7 | 66% | 0.66 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.8 | 17.4 | -177.1 | -69.9 | 170.2 | 0 | 0 | 0 | 115 | N365 V366 P370 | N365-L368 PolarHBondContact O-N 2.96Å; V366-L368 PolarHBondContact O-N 3.36Å; L368-P370 WeakPolarHBondContact O-CD 3.28Å |
| 369 | M | 39.7 | Very low | 51.4 | Low | 146 Ų | 146 | 127.8 Ų | 127.8 | 72% | 0.719 | 69% | 0.693 | S | S | * | * | trans | -76.8 | 117.2 | 168.8 | -77.6 | -70.2 | 106.2 | 0 | 0 | 111.8 | V371 | M369-V371 PolarHBondContact O-N 2.79Š| ||
| 370 | P | 43.8 | Very low | 49.7 | Very low | 112 Ų | 112 | 127.4 Ų | 127.4 | 73% | 0.727 | 70% | 0.703 | S | S | * | * | trans | -84.2 | 82.3 | -169.1 | 33.6 | -36.2 | 0 | 0 | 0 | 113.7 | L368 S372 | L368-P370 WeakPolarHBondContact O-CD 3.28Å; P370-S372 PolarHBondContact O-N 3.13Å | ||
| 371 | V | 42.6 | Very low | 48.4 | Very low | 126 Ų | 126 | 134.1 Ų | 134.1 | 76% | 0.764 | 72% | 0.719 | S | S | * | * | trans | -75.5 | 111.7 | 170.9 | -178.6 | 0 | 0 | 0 | 0 | 110.4 | M369 | M369-V371 PolarHBondContact O-N 2.79Š| ||
| 372 | S | 48.8 | Very low | 46.8 | Very low | 115 Ų | 115 | 137 Ų | 137 | 80% | 0.804 | 74% | 0.738 | S | S | * | * | trans | -87.6 | 116.3 | -177.3 | -65.2 | 0 | 0 | 0 | 0 | 112.7 | P370 | P370-S372 PolarHBondContact O-N 3.13Š| ||
| 373 | T | 42.7 | Very low | 45.4 | Very low | 123 Ų | 123 | 138.5 Ų | 138.5 | 76% | 0.755 | 74% | 0.738 | S | S | * | * | trans | -138.4 | 158.2 | 171.4 | 55.9 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 374 | P | 40 | Very low | 44.6 | Very low | 130 Ų | 130 | 143.8 Ų | 143.8 | 84% | 0.844 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -92 | 172.5 | -162.6 | -9.3 | 30.1 | 0 | 0 | 0 | 116.6 | ||
| 375 | K | 41 | Very low | 44.2 | Very low | 204 Ų | 204 | 143.4 Ų | 143.4 | 89% | 0.887 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -75 | 147.6 | -172.8 | -63.9 | 173.2 | -179.2 | 170.6 | 0 | 114.7 | ||
| 376 | P | 42.7 | Very low | 43.1 | Very low | 115 Ų | 115 | 141.8 Ų | 141.8 | 75% | 0.747 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 159.7 | 174.9 | 34.7 | -36.3 | 0 | 0 | 0 | 114.7 | ||
| 377 | P | 46.3 | Very low | 42.3 | Very low | 130 Ų | 130 | 142.5 Ų | 142.5 | 84% | 0.844 | 77% | 0.767 | S | S | * | * | trans | -80.5 | -174.8 | 172.6 | 34.2 | -35.3 | 0 | 0 | 0 | 113.6 | ||||
| 378 | K | 38.1 | Very low | 41.6 | Very low | 188 Ų | 188 | 143.1 Ų | 143.1 | 82% | 0.817 | 77% | 0.772 | S | S | * | * | trans | -129.6 | 159.5 | -157.9 | -57.1 | 173.8 | 177.7 | 171.6 | 0 | 115.5 | ||||
| 379 | R | 45.7 | Very low | 41.2 | Very low | 233 Ų | 233 | 142.3 Ų | 142.3 | 88% | 0.879 | 77% | 0.772 | S | S | * | * | trans | 81.1 | 160.8 | 156.8 | -70.4 | 177.3 | 177.3 | 179.1 | 0.1 | 118 | ||||
| 380 | P | 46.6 | Very low | 41.2 | Very low | 115 Ų | 115 | 141 Ų | 141 | 75% | 0.747 | 77% | 0.772 | S | S | * | * | cis | -133 | 134.7 | -7.3 | 25 | -2.2 | 0 | 0 | 0 | 117.9 | ||||
| 381 | R | 45 | Very low | 40.7 | Very low | 200 Ų | 200 | 143.2 Ų | 143.2 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | 33.9 | 130.1 | 120.5 | -171.9 | -164.1 | -164.5 | 167.7 | 7.7 | 121.2 | Q383 | R381-Q383 VanDerWaalsContact NE-OE1 3.08Š| |||
| 382 | L | 33.1 | Very low | 40.2 | Very low | 176 Ų | 176 | 142 Ų | 142 | 92% | 0.921 | 77% | 0.774 | S | S | * | * | trans | -128.7 | 171.4 | 133.8 | -140.6 | 78.1 | 0 | 0 | 0 | 111 | ||||
| 383 | Q | 34.3 | Very low | 40.1 | Very low | 117 Ų | 117 | 142 Ų | 142 | 55% | 0.547 | 77% | 0.772 | S | S | . | * | trans | -113.8 | 153.3 | -175.4 | -87.5 | 178.8 | -126.7 | 0 | 0 | 111.7 | R381 | R381-Q383 VanDerWaalsContact NE-OE1 3.08Š| ||
| 384 | R | 41.9 | Very low | 39.7 | Very low | 208 Ų | 208 | 141.7 Ų | 141.7 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | 58.9 | 140.1 | 68 | -104.6 | -168.9 | -169.9 | 173.3 | 3.9 | 112.5 | A386 | R384-A386 HydrophobicContact CG-CB 4.09Š| |||
| 385 | P | 46.7 | Very low | 40.2 | Very low | 124 Ų | 124 | 141.1 Ų | 141.1 | 81% | 0.805 | 77% | 0.771 | S | S | * | * | cis | -122.3 | 171.1 | 46 | 28.6 | -9.9 | 0 | 0 | 0 | 114.5 | ||||
| 386 | A | 34.4 | Very low | 40.5 | Very low | 68 Ų | 68 | 136.7 Ų | 136.7 | 56% | 0.562 | 76% | 0.763 | S | S | * | * | cis | 100.5 | 118.3 | 5.9 | 0 | 0 | 0 | 0 | 0 | 118.7 | R384 | R384-A386 HydrophobicContact CG-CB 4.09Š| ||
| 387 | S | 36.8 | Very low | 40 | Very low | 120 Ų | 120 | 137.4 Ų | 137.4 | 84% | 0.839 | 77% | 0.765 | S | S | * | * | trans | 169.9 | 145.2 | 166.1 | -84.4 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 388 | T | 37.5 | Very low | 39.4 | Very low | 130 Ų | 130 | 140.2 Ų | 140.2 | 80% | 0.798 | 77% | 0.766 | S | S | * | * | cis | -141.7 | -165.9 | -18.2 | 63.6 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 389 | T | 37.6 | Very low | 39.2 | Very low | 109 Ų | 109 | 139.8 Ų | 139.8 | 67% | 0.669 | 77% | 0.767 | S | S | * | * | cis | -160.7 | 133.9 | -13.5 | -120.5 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 390 | V | 39.5 | Very low | 39.3 | Very low | 119 Ų | 119 | 133.2 Ų | 133.2 | 72% | 0.721 | 76% | 0.755 | S | S | * | * | 66.7 | 125.8 | 80.7 | 156.3 | 0 | 0 | 0 | 0 | 113 | |||||
| 391 | L | 32.6 | Very low | 38.5 | Very low | 157 Ų | 157 | 135.6 Ų | 135.6 | 82% | 0.822 | 76% | 0.756 | S | S | * | * | cis | -155.4 | 174.9 | 8.3 | -121.7 | 173.6 | 0 | 0 | 0 | 113 | ||||
| 392 | S | 32.6 | Very low | 37.8 | Very low | 101 Ų | 101 | 135 Ų | 135 | 71% | 0.706 | 76% | 0.759 | S | S | * | * | trans | -99.3 | -173.3 | 169.8 | -38.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 393 | P | 47.7 | Very low | 37.8 | Very low | 116 Ų | 116 | 132.8 Ų | 132.8 | 75% | 0.753 | 75% | 0.753 | S | S | * | * | -158.6 | 144.3 | 55.7 | 39.8 | -15.2 | 0 | 0 | 0 | 121.7 | |||||
| 394 | S | 32.7 | Very low | 37.7 | Very low | 116 Ų | 116 | 134 Ų | 134 | 81% | 0.811 | 77% | 0.768 | S | S | * | * | trans | 70.4 | -177.4 | 140.3 | -50.3 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 395 | P | 51.8 | Low | 37.4 | Very low | 118 Ų | 118 | 131.3 Ų | 131.3 | 77% | 0.766 | 77% | 0.768 | S | S | * | * | -127.3 | -155.4 | -98.1 | 43.1 | -23.3 | 0 | 0 | 0 | 112.5 | |||||
| 396 | P | 47.3 | Very low | 36.9 | Very low | 111 Ų | 111 | 129.9 Ų | 129.9 | 72% | 0.721 | 76% | 0.761 | S | S | * | * | cis | -141 | -177.6 | -3.5 | 44.9 | -25.7 | 0 | 0 | 0 | 118 | ||||
| 397 | V | 31.1 | Very low | 37 | Very low | 130 Ų | 130 | 132.7 Ų | 132.7 | 79% | 0.788 | 77% | 0.773 | S | S | * | * | trans | 47.1 | 108.6 | 147.8 | 173.4 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 398 | Q | 34.1 | Very low | 36.9 | Very low | 189 Ų | 189 | 134.5 Ų | 134.5 | 88% | 0.883 | 77% | 0.772 | S | S | * | * | -167 | 179.8 | 100 | -128.7 | 168.9 | 16.1 | 0 | 0 | 111.7 | |||||
| 399 | Q | 33.5 | Very low | 36.6 | Very low | 178 Ų | 178 | 134.2 Ų | 134.2 | 83% | 0.832 | 77% | 0.77 | S | S | * | * | trans | -152.3 | 173 | -169 | -105.1 | -166.3 | -3.3 | 0 | 0 | 110.3 | ||||
| 400 | P | 48.7 | Very low | 36.4 | Very low | 96 Ų | 96 | 136 Ų | 136 | 62% | 0.623 | 77% | 0.774 | S | S | * | * | cis | -137.1 | 168.8 | -25.5 | 33 | -13.7 | 0 | 0 | 0 | 114.5 | ||||
| 401 | Q | 29.8 | Very low | 36.1 | Very low | 165 Ų | 165 | 136 Ų | 136 | 77% | 0.771 | 77% | 0.774 | S | S | * | * | 164.4 | 123.3 | 114.1 | -83.6 | -155 | -11 | 0 | 0 | 114.4 | |||||
| 402 | F | 30.8 | Very low | 36.5 | Very low | 188 Ų | 188 | 134.1 Ų | 134.1 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | trans | 33.6 | 136.6 | 155.2 | -55.8 | -72.7 | 0 | 0 | 0 | 124.1 | ||||
| 403 | T | 31.6 | Very low | 36.5 | Very low | 128 Ų | 128 | 136.6 Ų | 136.6 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | trans | -141 | 147.6 | 170.2 | -49.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 404 | V | 32.9 | Very low | 35.9 | Very low | 144 Ų | 144 | 134.3 Ų | 134.3 | 87% | 0.873 | 78% | 0.779 | S | S | * | * | trans | -119.1 | 147.9 | 174.5 | -179.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 405 | I | 34.6 | Very low | 36 | Very low | 151 Ų | 151 | 137.4 Ų | 137.4 | 77% | 0.774 | 78% | 0.781 | S | S | * | * | trans | -118 | 152.5 | -158.1 | -64.2 | 174.3 | 0 | 0 | 0 | 112.9 | ||||
| 406 | S | 36.4 | Very low | 35.1 | Very low | 94 Ų | 94 | 136.6 Ų | 136.6 | 66% | 0.657 | 78% | 0.779 | S | S | * | * | trans | -53 | 163.9 | -177.3 | -30.4 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 407 | P | 36.8 | Very low | 34.3 | Very low | 127 Ų | 127 | 141.4 Ų | 141.4 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | trans | -96.3 | 157.6 | 151.5 | 37.3 | -30.7 | 0 | 0 | 0 | 112.9 | ||||
| 408 | I | 35.3 | Very low | 34.4 | Very low | 157 Ų | 157 | 140.9 Ų | 140.9 | 81% | 0.805 | 79% | 0.79 | S | S | * | * | trans | -142.6 | 152.5 | -179.2 | -69.1 | -176.1 | 0 | 0 | 0 | 111.7 | ||||
| 409 | T | 31.3 | Very low | 34.3 | Very low | 124 Ų | 124 | 141.3 Ų | 141.3 | 76% | 0.761 | 80% | 0.795 | S | S | * | * | trans | -56.1 | 173.7 | 179.3 | 11.9 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 410 | I | 34.1 | Very low | 34.1 | Very low | 147 Ų | 147 | 135.9 Ų | 135.9 | 75% | 0.754 | 79% | 0.786 | S | S | * | * | cis | -162.3 | 177 | 37.4 | -3.7 | 168 | 0 | 0 | 0 | 108.7 | ||||
| 411 | T | 31.4 | Very low | 33.2 | Very low | 118 Ų | 118 | 138.9 Ų | 138.9 | 72% | 0.724 | 80% | 0.797 | S | S | * | * | cis | -159.3 | 156.7 | 5.2 | -21.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 412 | P | 42.4 | Very low | 33.2 | Very low | 119 Ų | 119 | 138.2 Ų | 138.2 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | trans | -109.6 | 169.5 | 167.8 | 39.4 | -33.2 | 0 | 0 | 0 | 115.3 | ||||
| 413 | V | 32.9 | Very low | 33.5 | Very low | 153 Ų | 153 | 134.7 Ų | 134.7 | 93% | 0.927 | 79% | 0.794 | S | S | * | * | trans | -145.3 | 135.7 | 177.4 | 172.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 414 | G | 34.7 | Very low | 33.5 | Very low | 67 Ų | 67 | 134.9 Ų | 134.9 | 69% | 0.691 | 79% | 0.794 | S | S | * | * | trans | 97.2 | 107 | 143.6 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 415 | Q | 35.2 | Very low | 33.4 | Very low | 181 Ų | 181 | 132.8 Ų | 132.8 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | 62.4 | 83.8 | 140.6 | -62.3 | -173 | -56.2 | 0 | 0 | 122.9 | ||||
| 416 | S | 32.6 | Very low | 33.3 | Very low | 102 Ų | 102 | 131.7 Ų | 131.7 | 71% | 0.713 | 79% | 0.792 | S | S | * | * | 45.9 | 116.2 | 116.2 | 63.8 | 0 | 0 | 0 | 0 | 124 | |||||
| 417 | F | 29.1 | Very low | 33 | Very low | 212 Ų | 212 | 135 Ų | 135 | 93% | 0.93 | 80% | 0.802 | S | S | * | * | -145.2 | 169.8 | 126.3 | 4.3 | -96.6 | 0 | 0 | 0 | 109.9 | |||||
| 418 | S | 33.2 | Very low | 32.6 | Very low | 118 Ų | 118 | 134.2 Ų | 134.2 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -150.1 | 113.3 | -167.7 | 168.5 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 419 | M | 32.3 | Very low | 32.4 | Very low | 199 Ų | 199 | 136.2 Ų | 136.2 | 98% | 0.98 | 81% | 0.805 | S | S | * | * | trans | -172.2 | 142.6 | 146.2 | -112 | -179.8 | 172.6 | 0 | 0 | 109.1 | ||||
| 420 | G | 30.5 | Very low | 32.3 | Very low | 63 Ų | 63 | 133.5 Ų | 133.5 | 65% | 0.649 | 80% | 0.802 | S | S | * | * | cis | 176.3 | 55.5 | -3.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 421 | N | 28.3 | Very low | 32.1 | Very low | 159 Ų | 159 | 133 Ų | 133 | 85% | 0.85 | 81% | 0.811 | S | S | * | * | trans | 65.3 | 165.1 | 161.3 | -59.2 | -10.2 | 0 | 0 | 0 | 117 | ||||
| 422 | I | 31.1 | Very low | 31.9 | Very low | 151 Ų | 151 | 132.5 Ų | 132.5 | 77% | 0.774 | 81% | 0.812 | S | S | * | * | cis | -137.7 | 159.3 | 16.1 | -21 | 176.4 | 0 | 0 | 0 | 110.3 | ||||
| 423 | P | 37.3 | Very low | 32 | Very low | 115 Ų | 115 | 132.1 Ų | 132.1 | 75% | 0.747 | 81% | 0.81 | S | S | * | * | -145.8 | 158.4 | 104.8 | 38.2 | -24 | 0 | 0 | 0 | 116.5 | |||||
| 424 | V | 31.7 | Very low | 31.6 | Very low | 132 Ų | 132 | 131.4 Ų | 131.4 | 80% | 0.8 | 81% | 0.806 | S | S | * | * | trans | 37.1 | 130.3 | 145.4 | -176.3 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 425 | A | 30.4 | Very low | 31.4 | Very low | 99 Ų | 99 | 133.7 Ų | 133.7 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -135.5 | 144.9 | 158.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 426 | T | 32.3 | Very low | 30.9 | Very low | 128 Ų | 128 | 131.2 Ų | 131.2 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -114 | 172.8 | 175.7 | 50.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 427 | L | 30.2 | Very low | 30.6 | Very low | 164 Ų | 164 | 134.4 Ų | 134.4 | 86% | 0.859 | 81% | 0.807 | S | S | * | * | trans | -74.7 | 144.5 | -163.1 | -68.5 | 67.9 | 0 | 0 | 0 | 114.1 | ||||
| 428 | S | 27.6 | Very low | 30.6 | Very low | 110 Ų | 110 | 131.2 Ų | 131.2 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | -178.8 | 133.8 | 105.3 | 56.2 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 429 | Q | 32 | Very low | 30.6 | Very low | 200 Ų | 200 | 133 Ų | 133 | 94% | 0.935 | 81% | 0.805 | S | S | * | * | trans | 16.2 | 137.4 | 151.4 | -53.8 | -179 | 5.4 | 0 | 0 | 121.7 | ||||
| 430 | G | 28.6 | Very low | 30.9 | Very low | 67 Ų | 67 | 129.1 Ų | 129.1 | 69% | 0.691 | 79% | 0.794 | S | S | * | * | trans | 176 | 45.9 | 166.3 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 431 | S | 29.6 | Very low | 30.9 | Very low | 136 Ų | 136 | 131.9 Ų | 131.9 | 95% | 0.951 | 80% | 0.804 | S | S | * | * | trans | 64.8 | 167.7 | 165.4 | 67.9 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 432 | S | 28.6 | Very low | 30.8 | Very low | 107 Ų | 107 | 127.8 Ų | 127.8 | 75% | 0.748 | 80% | 0.799 | S | S | * | * | trans | -123.1 | 175.3 | -172.1 | 74.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 433 | P | 44.2 | Very low | 31.2 | Very low | 112 Ų | 112 | 126.9 Ų | 126.9 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | -152.7 | 169.3 | 57 | 42.3 | -21.2 | 0 | 0 | 0 | 119.5 | |||||
| 434 | V | 25.2 | Very low | 31.1 | Very low | 138 Ų | 138 | 128.7 Ų | 128.7 | 84% | 0.836 | 80% | 0.801 | S | S | * | * | trans | 77.8 | 146.6 | 148.5 | 162.1 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 435 | T | 29 | Very low | 31.1 | Very low | 115 Ų | 115 | 130.4 Ų | 130.4 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | -66.1 | 172.7 | -179.2 | 40.7 | 0 | 0 | 0 | 0 | 114 | ||||
| 436 | V | 26.3 | Very low | 30.9 | Very low | 129 Ų | 129 | 133.1 Ų | 133.1 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | cis | -154.1 | 166.5 | 40.8 | -148.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 437 | H | 26.1 | Very low | 30.7 | Very low | 168 Ų | 168 | 139 Ų | 139 | 78% | 0.778 | 81% | 0.806 | S | S | * | * | trans | -58.6 | 150 | -179.3 | -60.3 | -103.7 | 0 | 0 | 0 | 117 | ||||
| 438 | T | 28.9 | Very low | 30.5 | Very low | 145 Ų | 145 | 141.3 Ų | 141.3 | 89% | 0.89 | 81% | 0.805 | S | S | * | * | trans | -139.1 | 118.7 | 136.1 | 54 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 439 | L | 31.8 | Very low | 30.4 | Very low | 157 Ų | 157 | 140.7 Ų | 140.7 | 82% | 0.822 | 81% | 0.806 | S | S | * | * | trans | -120.7 | 147.4 | 163.2 | -144.9 | 85.2 | 0 | 0 | 0 | 105.8 | ||||
| 440 | P | 39.6 | Very low | 30.1 | Very low | 116 Ų | 116 | 137.1 Ų | 137.1 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | -155.1 | 153.1 | 84.1 | 39 | -20.3 | 0 | 0 | 0 | 116.6 | |||||
| 441 | S | 29.6 | Very low | 29.9 | Very low | 122 Ų | 122 | 140.3 Ų | 140.3 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | -174.9 | 139.8 | 128.8 | -81.7 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 442 | G | 26.9 | Very low | 29.8 | Very low | 73 Ų | 73 | 140.1 Ų | 140.1 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | trans | -132.6 | -146.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 443 | P | 39.5 | Very low | 29.7 | Very low | 131 Ų | 131 | 140.1 Ų | 140.1 | 85% | 0.851 | 80% | 0.797 | S | S | * | * | cis | -132.4 | 175.4 | 7 | 40.7 | -23.8 | 0 | 0 | 0 | 116 | ||||
| 444 | Q | 34.7 | Very low | 28.7 | Very low | 153 Ų | 153 | 140.6 Ų | 140.6 | 72% | 0.715 | 80% | 0.803 | S | S | * | * | trans | -67.6 | 165.6 | 169.9 | -69.9 | -79.5 | 7.5 | 0 | 0 | 113.6 | ||||
| 445 | L | 31.8 | Very low | 28.8 | Very low | 169 Ų | 169 | 138.9 Ų | 138.9 | 89% | 0.885 | 80% | 0.804 | S | S | * | * | trans | -145 | 94.9 | 147.9 | -113.5 | 178.2 | 0 | 0 | 0 | 113.3 | ||||
| 446 | F | 27.4 | Very low | 28.7 | Very low | 155 Ų | 155 | 142.6 Ų | 142.6 | 68% | 0.68 | 81% | 0.81 | S | S | * | * | trans | -78.2 | 161.1 | 155.9 | -87 | -109.9 | 0 | 0 | 0 | 110 | ||||
| 447 | R | 26.7 | Very low | 28.8 | Very low | 252 Ų | 252 | 141.4 Ų | 141.4 | 95% | 0.951 | 81% | 0.807 | S | S | * | * | trans | -95.5 | 143.8 | 161.6 | -80.9 | -174.1 | 173.8 | 164.2 | -0.1 | 111.2 | ||||
| 448 | Y | 26.7 | Very low | 28.9 | Very low | 213 Ų | 213 | 138.1 Ų | 138.1 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | trans | -110.6 | 159.3 | -175.4 | -78.2 | -100.4 | 0 | 0 | 0 | 112.1 | ||||
| 449 | A | 24.4 | Very low | 29.1 | Very low | 96 Ų | 96 | 136.8 Ų | 136.8 | 79% | 0.793 | 80% | 0.8 | S | S | * | * | trans | -145.9 | 79.7 | 149.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 450 | T | 26.7 | Very low | 29.5 | Very low | 126 Ų | 126 | 134.4 Ų | 134.4 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | 27.3 | 128.8 | 154.1 | 28 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 451 | V | 24.9 | Very low | 28.9 | Very low | 134 Ų | 134 | 135.7 Ų | 135.7 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | -96.2 | 139.7 | 150 | -176.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 452 | V | 26.5 | Very low | 28.7 | Very low | 131 Ų | 131 | 136 Ų | 136 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | -108.6 | 127.7 | 167.5 | 172.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 453 | S | 26.1 | Very low | 28.8 | Very low | 107 Ų | 107 | 138.2 Ų | 138.2 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | trans | -100.2 | 140.3 | 173.2 | -68.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 454 | S | 24.2 | Very low | 28.2 | Very low | 123 Ų | 123 | 137.9 Ų | 137.9 | 86% | 0.86 | 79% | 0.785 | S | S | * | * | trans | -148.9 | 142.8 | 156.6 | -80.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 455 | A | 26.5 | Very low | 27.9 | Very low | 102 Ų | 102 | 138.5 Ų | 138.5 | 84% | 0.843 | 79% | 0.792 | S | S | * | * | trans | -91.6 | 166.2 | -162.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 456 | K | 27.3 | Very low | 27.8 | Very low | 192 Ų | 192 | 138.2 Ų | 138.2 | 84% | 0.835 | 79% | 0.786 | S | S | * | * | 164.6 | 142.3 | 107.2 | -170.4 | 173.8 | -176.7 | 179.6 | 0 | 112.8 | |||||
| 457 | S | 28.3 | Very low | 28.3 | Very low | 104 Ų | 104 | 136.4 Ų | 136.4 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | 63.1 | 146.4 | 165.7 | 33.7 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 458 | S | 28.3 | Very low | 28.4 | Very low | 100 Ų | 100 | 129.9 Ų | 129.9 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | cis | -169.9 | 146.5 | -12.7 | 43.6 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 459 | S | 33.1 | Very low | 28.7 | Very low | 116 Ų | 116 | 125.8 Ų | 125.8 | 81% | 0.811 | 79% | 0.785 | S | S | * | * | trans | 66.3 | 156.4 | 162.3 | 35.5 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 460 | P | 40.2 | Very low | 29 | Very low | 107 Ų | 107 | 127 Ų | 127 | 70% | 0.695 | 79% | 0.788 | S | S | * | * | trans | -113.5 | 166.4 | -164.6 | 42.8 | -33.2 | 0 | 0 | 0 | 114.6 | ||||
| 461 | D | 26.1 | Very low | 29.3 | Very low | 143 Ų | 143 | 128.8 Ų | 128.8 | 77% | 0.765 | 79% | 0.792 | S | S | * | * | -179.5 | 127.6 | 106.6 | -104.7 | -32.2 | 0 | 0 | 0 | 115.1 | |||||
| 462 | T | 26.5 | Very low | 29.6 | Very low | 128 Ų | 128 | 127.2 Ų | 127.2 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | trans | 47.9 | -177 | 141.4 | -150.7 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 463 | V | 28.2 | Very low | 29.6 | Very low | 121 Ų | 121 | 129.4 Ų | 129.4 | 73% | 0.733 | 80% | 0.8 | S | S | * | * | trans | 81.8 | 121.3 | 176.9 | -163.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 464 | T | 28.1 | Very low | 29.8 | Very low | 123 Ų | 123 | 132.2 Ų | 132.2 | 76% | 0.755 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 147.8 | 171.7 | 45.6 | 0 | 0 | 0 | 0 | 115.3 | ||
| 465 | I | 28 | Very low | 29.8 | Very low | 166 Ų | 166 | 131.5 Ų | 131.5 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -96.7 | 124.2 | 170.6 | -59.3 | 174.2 | 0 | 0 | 0 | 110.4 | ||
| 466 | H | 30.5 | Very low | 30 | Very low | 163 Ų | 163 | 132 Ų | 132 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -101.3 | 139.1 | 160.4 | -106.9 | -101.4 | 0 | 0 | 0 | 109 | ||
| 467 | P | 37.3 | Very low | 30.1 | Very low | 117 Ų | 117 | 128.7 Ų | 128.7 | 76% | 0.76 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 137.7 | 165.7 | 31.5 | -32 | 0 | 0 | 0 | 109.9 | ||
| 468 | S | 28.7 | Very low | 30.2 | Very low | 116 Ų | 116 | 128.2 Ų | 128.2 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -150.8 | 133.3 | 168.4 | -73.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 469 | S | 33 | Very low | 30.3 | Very low | 127 Ų | 127 | 131.6 Ų | 131.6 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | trans | -71.1 | 152.6 | -173.9 | -46.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 470 | S | 29.7 | Very low | 30.2 | Very low | 121 Ų | 121 | 135.8 Ų | 135.8 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | -153.6 | 146.9 | 146.8 | -151.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 471 | L | 33.3 | Very low | 29.7 | Very low | 163 Ų | 163 | 138.7 Ų | 138.7 | 85% | 0.853 | 82% | 0.819 | S | S | * | * | trans | -98.7 | 160.4 | 169 | -72 | 164.6 | 0 | 0 | 0 | 109 | ||||
| 472 | A | 31.9 | Very low | 29.7 | Very low | 102 Ų | 102 | 134.9 Ų | 134.9 | 84% | 0.843 | 81% | 0.813 | S | S | * | * | trans | -129.5 | 139.1 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 473 | L | 25.4 | Very low | 29.9 | Very low | 177 Ų | 177 | 134.1 Ų | 134.1 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | trans | -100 | 160.3 | -176.9 | -72.1 | 163.6 | 0 | 0 | 0 | 111.5 | ||||
| 474 | L | 30.5 | Very low | 30.2 | Very low | 165 Ų | 165 | 134.3 Ų | 134.3 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | trans | -84.5 | 140.4 | 170.5 | -65.3 | 170 | 0 | 0 | 0 | 111.2 | ||||
| 475 | S | 25.3 | Very low | 30.4 | Very low | 108 Ų | 108 | 137 Ų | 137 | 76% | 0.755 | 82% | 0.824 | S | S | * | * | 168.2 | 155.8 | 125.6 | -78.3 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 476 | S | 30 | Very low | 30.6 | Very low | 113 Ų | 113 | 132.6 Ų | 132.6 | 79% | 0.79 | 82% | 0.819 | S | S | * | * | trans | 77 | 148.7 | 154.4 | 90.2 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 477 | T | 30.4 | Very low | 30.7 | Very low | 122 Ų | 122 | 132.7 Ų | 132.7 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | cis | -151.5 | 154.2 | -1.6 | 48 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 478 | A | 29.1 | Very low | 30.4 | Very low | 94 Ų | 94 | 135.6 Ų | 135.6 | 78% | 0.777 | 83% | 0.831 | S | S | * | * | trans | 173.1 | 116.3 | 137.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 479 | M | 30.2 | Very low | 30.5 | Very low | 171 Ų | 171 | 135.2 Ų | 135.2 | 84% | 0.842 | 82% | 0.824 | S | S | * | * | 88.4 | 99.6 | 58.1 | -74.9 | -71.8 | 156.8 | 0 | 0 | 115.2 | |||||
| 480 | Q | 31.9 | Very low | 30.4 | Very low | 204 Ų | 204 | 134.8 Ų | 134.8 | 95% | 0.953 | 82% | 0.816 | S | S | * | * | trans | -171 | 176.1 | 132.3 | -104.2 | 171.6 | 28.8 | 0 | 0 | 112.3 | ||||
| 481 | D | 28.8 | Very low | 30.4 | Very low | 169 Ų | 169 | 137.2 Ų | 137.2 | 90% | 0.904 | 82% | 0.816 | S | S | * | * | trans | -134.3 | 166.5 | -151 | 178 | 27.9 | 0 | 0 | 0 | 112.4 | ||||
| 482 | G | 27.9 | Very low | 30.2 | Very low | 62 Ų | 62 | 135.8 Ų | 135.8 | 64% | 0.639 | 81% | 0.814 | S | S | * | * | trans | 150.2 | 38.3 | 163.5 | 0 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 483 | S | 30.7 | Very low | 30.3 | Very low | 113 Ų | 113 | 135.4 Ų | 135.4 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | 68 | 165.4 | 144.2 | -152.6 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 484 | T | 33.5 | Very low | 30.9 | Very low | 124 Ų | 124 | 132.1 Ų | 132.1 | 76% | 0.761 | 79% | 0.794 | S | S | * | * | trans | 79.4 | 93.6 | 163.4 | 59.4 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 485 | L | 33.2 | Very low | 30.7 | Very low | 181 Ų | 181 | 129.8 Ų | 129.8 | 95% | 0.948 | 79% | 0.786 | S | S | * | * | 49.4 | 125.6 | 115.2 | -150.3 | 83.9 | 0 | 0 | 0 | 121.7 | |||||
| 486 | G | 30.5 | Very low | 30.9 | Very low | 73 Ų | 73 | 132 Ų | 132 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | trans | 170.1 | 127.4 | 159.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 487 | N | 32.4 | Very low | 30.6 | Very low | 164 Ų | 164 | 132.9 Ų | 132.9 | 88% | 0.877 | 78% | 0.78 | S | S | * | * | trans | -86.9 | 164.6 | -177.6 | -64.5 | -16.1 | 0 | 0 | 0 | 114.2 | ||||
| 488 | M | 31.1 | Very low | 30.4 | Very low | 179 Ų | 179 | 132.1 Ų | 132.1 | 88% | 0.882 | 78% | 0.775 | S | S | * | * | trans | 103.8 | 149.4 | 138.5 | -155.9 | 157.7 | 179.3 | 0 | 0 | 119.7 | ||||
| 489 | T | 31.2 | Very low | 30.2 | Very low | 107 Ų | 107 | 132.7 Ų | 132.7 | 66% | 0.656 | 78% | 0.779 | S | S | * | * | trans | -60.5 | 156.8 | -175.3 | 52.4 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 490 | T | 31.3 | Very low | 30 | Very low | 118 Ų | 118 | 132.7 Ų | 132.7 | 72% | 0.724 | 78% | 0.78 | S | S | * | * | 147.6 | 127.1 | 120.2 | -72.3 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 491 | M | 30.3 | Very low | 29.9 | Very low | 173 Ų | 173 | 132 Ų | 132 | 85% | 0.852 | 78% | 0.776 | S | S | * | * | trans | 34.6 | 149.6 | 149.6 | -70.2 | -172.2 | 173.5 | 0 | 0 | 125.2 | ||||
| 492 | V | 28.5 | Very low | 30 | Very low | 133 Ų | 133 | 129.4 Ų | 129.4 | 81% | 0.806 | 77% | 0.772 | S | S | * | * | trans | 87.9 | 144.7 | 137.7 | 154.3 | 0 | 0 | 0 | 0 | 120 | ||||
| 493 | S | 33.7 | Very low | 30 | Very low | 94 Ų | 94 | 129.2 Ų | 129.2 | 66% | 0.657 | 77% | 0.77 | S | S | * | * | trans | -91.5 | 146.4 | 177.7 | 170.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 494 | P | 37.6 | Very low | 29.8 | Very low | 108 Ų | 108 | 131.8 Ų | 131.8 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | -136.3 | 156.3 | 124.4 | 42.3 | -31.5 | 0 | 0 | 0 | 111 | |||||
| 495 | V | 27.2 | Very low | 29.5 | Very low | 115 Ų | 115 | 131.4 Ų | 131.4 | 70% | 0.697 | 77% | 0.771 | S | S | * | * | 62.7 | 118.5 | 51.3 | -173.8 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 496 | E | 28.4 | Very low | 29.3 | Very low | 156 Ų | 156 | 128.5 Ų | 128.5 | 73% | 0.729 | 77% | 0.766 | S | S | * | * | cis | -164.3 | -178.5 | 25.3 | -139.1 | -176.7 | 141.2 | 0 | 0 | 113.4 | ||||
| 497 | L | 24.2 | Very low | 29.2 | Very low | 130 Ų | 130 | 128.9 Ų | 128.9 | 68% | 0.681 | 76% | 0.762 | S | S | * | * | trans | 58.2 | 104.7 | 150.2 | -66.3 | 173.2 | 0 | 0 | 0 | 124.1 | ||||
| 498 | V | 26.5 | Very low | 28.9 | Very low | 107 Ų | 107 | 128.1 Ų | 128.1 | 65% | 0.648 | 76% | 0.756 | S | S | * | * | 56.2 | 134.5 | 99.4 | 172.8 | 0 | 0 | 0 | 0 | 121.8 | M500 | V498-M500 HydrophobicContact CG1-CB 4.37Å; V498-M500 HydrophobicContact CG1-CG 3.7Å; V498-M500 HydrophobicContact CG1-SD 4.1Å | |||
| 499 | A | 25 | Very low | 28.7 | Very low | 105 Ų | 105 | 128 Ų | 128 | 87% | 0.868 | 75% | 0.754 | S | S | * | * | trans | -126.2 | 143.7 | 138.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 500 | M | 27 | Very low | 28.4 | Very low | 172 Ų | 172 | 127 Ų | 127 | 85% | 0.847 | 76% | 0.756 | S | S | * | * | trans | -134 | 142.4 | -175.8 | -82 | 169.9 | 68.1 | 0 | 0 | 112.2 | V498 | V498-M500 HydrophobicContact CG1-CB 4.37Å; V498-M500 HydrophobicContact CG1-CG 3.7Å; V498-M500 HydrophobicContact CG1-SD 4.1Å | ||
| 501 | E | 28.1 | Very low | 28.1 | Very low | 189 Ų | 189 | 127.6 Ų | 127.6 | 88% | 0.883 | 76% | 0.759 | S | S | * | * | trans | -176.5 | 142.6 | 150.2 | -175.7 | 165.7 | -117.1 | 0 | 0 | 107.1 | ||||
| 502 | S | 31.5 | Very low | 27.9 | Very low | 115 Ų | 115 | 129 Ų | 129 | 80% | 0.804 | 76% | 0.764 | S | S | * | * | cis | -162 | 169 | -29.3 | -94.8 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 503 | G | 27.6 | Very low | 27.8 | Very low | 58 Ų | 58 | 126.7 Ų | 126.7 | 60% | 0.598 | 75% | 0.754 | S | S | * | * | cis | 159.2 | 164.4 | 2.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 504 | L | 27.4 | Very low | 27.4 | Very low | 167 Ų | 167 | 128.2 Ų | 128.2 | 87% | 0.874 | 76% | 0.759 | S | S | * | * | trans | 71.1 | 119.7 | -175.6 | -56.1 | 152.1 | 0 | 0 | 0 | 114.7 | ||||
| 505 | T | 27.2 | Very low | 27 | Very low | 116 Ų | 116 | 127.4 Ų | 127.4 | 71% | 0.712 | 76% | 0.756 | S | S | * | * | cis | 97.6 | 114.9 | 10.3 | 80 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 506 | S | 29.1 | Very low | 27.2 | Very low | 120 Ų | 120 | 129.5 Ų | 129.5 | 84% | 0.839 | 76% | 0.758 | S | S | * | * | trans | 72.4 | 150.1 | 146.5 | -59.8 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 507 | A | 27.8 | Very low | 27.2 | Very low | 80 Ų | 80 | 129.7 Ų | 129.7 | 66% | 0.661 | 76% | 0.764 | S | S | * | * | cis | -172.3 | 167.3 | -19 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 508 | I | 26.6 | Very low | 27.4 | Very low | 149 Ų | 149 | 126.8 Ų | 126.8 | 76% | 0.764 | 77% | 0.765 | S | S | * | * | trans | 80.3 | 125.7 | 149.7 | -74.9 | 157.9 | 0 | 0 | 0 | 121.4 | ||||
| 509 | Q | 26.2 | Very low | 27.5 | Very low | 176 Ų | 176 | 130.6 Ų | 130.6 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | trans | 52.9 | 112.1 | 149.9 | -73.9 | 179.6 | -85.9 | 0 | 0 | 124.5 | ||||
| 510 | A | 25.4 | Very low | 27.8 | Very low | 85 Ų | 85 | 131.6 Ų | 131.6 | 70% | 0.702 | 77% | 0.771 | S | S | * | * | 81.2 | 158.9 | 109.4 | 0 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 511 | V | 25.9 | Very low | 27.9 | Very low | 131 Ų | 131 | 131.7 Ų | 131.7 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | trans | 67.2 | 104 | 176.2 | -168.5 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 512 | E | 26.1 | Very low | 28 | Very low | 203 Ų | 203 | 130.3 Ų | 130.3 | 95% | 0.949 | 77% | 0.771 | S | S | * | * | trans | -112.3 | 120 | 162 | -174.2 | 164.8 | -142.4 | 0 | 0 | 108.7 | ||||
| 513 | S | 26 | Very low | 27.8 | Very low | 85 Ų | 85 | 133.2 Ų | 133.2 | 59% | 0.594 | 77% | 0.771 | S | S | * | * | trans | -158.7 | 146.7 | 177.7 | 62 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 514 | T | 25.8 | Very low | 27.9 | Very low | 125 Ų | 125 | 138.1 Ų | 138.1 | 77% | 0.767 | 78% | 0.782 | S | S | * | * | trans | 64.9 | 108.9 | 171.7 | 64 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 515 | S | 28.9 | Very low | 28.2 | Very low | 91 Ų | 91 | 135.7 Ų | 135.7 | 64% | 0.636 | 77% | 0.77 | S | S | * | * | 85.7 | 151.8 | 121.9 | -68.6 | 0 | 0 | 0 | 0 | 122 | |||||
| 516 | E | 30 | Very low | 28.5 | Very low | 159 Ų | 159 | 136 Ų | 136 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | cis | -164.5 | -179 | -29.8 | 58.1 | -155.5 | 105.4 | 0 | 0 | 110 | ||||
| 517 | D | 29.8 | Very low | 28.6 | Very low | 161 Ų | 161 | 133.8 Ų | 133.8 | 86% | 0.861 | 76% | 0.764 | S | S | * | * | trans | 63.2 | 124.6 | 176.2 | -71.6 | -30.9 | 0 | 0 | 0 | 119.5 | ||||
| 518 | G | 28.7 | Very low | 29.5 | Very low | 68 Ų | 68 | 136 Ų | 136 | 70% | 0.701 | 77% | 0.771 | S | S | * | * | cis | 148.2 | 129.7 | -14.2 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 519 | Q | 28 | Very low | 29.8 | Very low | 187 Ų | 187 | 136 Ų | 136 | 87% | 0.874 | 77% | 0.773 | S | S | * | * | trans | -164 | 102.4 | 152.3 | -118.9 | 173.5 | 5.2 | 0 | 0 | 114.8 | ||||
| 520 | T | 30.5 | Very low | 30.8 | Very low | 126 Ų | 126 | 133.2 Ų | 133.2 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | trans | 40.9 | 123.5 | 142.6 | 59.9 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 521 | I | 30.2 | Very low | 31.2 | Very low | 175 Ų | 175 | 138.4 Ų | 138.4 | 90% | 0.897 | 78% | 0.779 | S | S | * | * | trans | -153.2 | 164.8 | 132.1 | -102.6 | 153.4 | 0 | 0 | 0 | 108.2 | ||||
| 522 | I | 30.4 | Very low | 31.5 | Very low | 159 Ų | 159 | 136.8 Ų | 136.8 | 82% | 0.815 | 78% | 0.779 | S | S | * | * | trans | -107.3 | 144.9 | -161.6 | -62.2 | 165.3 | 0 | 0 | 0 | 112.4 | ||||
| 523 | E | 26.2 | Very low | 31.7 | Very low | 176 Ų | 176 | 135.8 Ų | 135.8 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | trans | -115.5 | 146 | 175.6 | 178.3 | 175.7 | -154.4 | 0 | 0 | 111.2 | ||||
| 524 | I | 30.2 | Very low | 32 | Very low | 161 Ų | 161 | 138.9 Ų | 138.9 | 83% | 0.826 | 79% | 0.785 | S | S | * | * | trans | -144.9 | 123.3 | 167.5 | -59.3 | -178.5 | 0 | 0 | 0 | 108.6 | ||||
| 525 | D | 33.1 | Very low | 32.3 | Very low | 117 Ų | 117 | 139.4 Ų | 139.4 | 63% | 0.626 | 79% | 0.788 | S | S | * | * | trans | -101.4 | 159.5 | 171.1 | 178.6 | 55.7 | 0 | 0 | 0 | 111 | A527 | D525-A527 PolarHBondContact OD2-N 3.34Š| ||
| 526 | P | 34.3 | Very low | 32.4 | Very low | 121 Ų | 121 | 144.2 Ų | 144.2 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | -145.4 | 124.9 | 119.6 | 34.7 | -18 | 0 | 0 | 0 | 116.6 | |||||
| 527 | A | 30.6 | Very low | 32.3 | Very low | 75 Ų | 75 | 140 Ų | 140 | 62% | 0.62 | 80% | 0.8 | S | S | * | * | trans | -63.7 | -172 | 155.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | D525 | D525-A527 PolarHBondContact OD2-N 3.34Š| ||
| 528 | P | 47.6 | Very low | 32.2 | Very low | 125 Ų | 125 | 141.9 Ų | 141.9 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | cis | -140 | -179.1 | 5.5 | 44.3 | -25.7 | 0 | 0 | 0 | 117.6 | ||||
| 529 | D | 31.1 | Very low | 32.3 | Very low | 151 Ų | 151 | 143.5 Ų | 143.5 | 81% | 0.807 | 81% | 0.807 | S | S | * | * | trans | -105.4 | 143.7 | 165.7 | -164.9 | 32 | 0 | 0 | 0 | 109.2 | ||||
| 530 | P | 48.9 | Very low | 32.3 | Very low | 116 Ų | 116 | 140.1 Ų | 140.1 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | -97.1 | 126.5 | -176.4 | 34.2 | -30.2 | 0 | 0 | 0 | 114.5 | ||||
| 531 | E | 33.6 | Very low | 32.3 | Very low | 195 Ų | 195 | 141.1 Ų | 141.1 | 91% | 0.911 | 80% | 0.798 | S | S | * | * | trans | -73.8 | 155.9 | 175.3 | -58.4 | -179.5 | 123.2 | 0 | 0 | 114.2 | ||||
| 532 | A | 32.1 | Very low | 32.2 | Very low | 96 Ų | 96 | 139.9 Ų | 139.9 | 79% | 0.793 | 79% | 0.793 | S | S | * | * | trans | -157.7 | 97.2 | 155.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 533 | E | 30.5 | Very low | 32.2 | Very low | 182 Ų | 182 | 140.6 Ų | 140.6 | 85% | 0.85 | 79% | 0.792 | S | S | * | * | trans | 40.5 | 126.3 | 146.5 | -60 | -177 | 141.2 | 0 | 0 | 123 | ||||
| 534 | D | 31.2 | Very low | 32.5 | Very low | 150 Ų | 150 | 139 Ų | 139 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | trans | 43.5 | 129.6 | 134.9 | -66 | -0.6 | 0 | 0 | 0 | 123.1 | ||||
| 535 | T | 32.6 | Very low | 32.5 | Very low | 137 Ų | 137 | 139.4 Ų | 139.4 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | -174.3 | 152.1 | 97.8 | -65.2 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 536 | E | 30.3 | Very low | 32.2 | Very low | 191 Ų | 191 | 140.1 Ų | 140.1 | 89% | 0.893 | 80% | 0.796 | S | S | * | * | trans | -62.9 | 154.7 | 173.8 | -55.8 | 175.1 | 94.1 | 0 | 0 | 114.4 | ||||
| 537 | G | 27.7 | Very low | 32 | Very low | 72 Ų | 72 | 144.3 Ų | 144.3 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | trans | 148.1 | 122.2 | 137.8 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 538 | K | 28.6 | Very low | 32 | Very low | 199 Ų | 199 | 145.5 Ų | 145.5 | 87% | 0.865 | 80% | 0.797 | S | S | * | * | trans | 56.1 | 110.8 | 152.2 | -68 | -179.1 | 175.9 | 176.4 | 0 | 119.4 | ||||
| 539 | A | 29.9 | Very low | 31.2 | Very low | 102 Ų | 102 | 147.6 Ų | 147.6 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | trans | -64.4 | 142.8 | 143.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 540 | V | 27.9 | Very low | 31.2 | Very low | 116 Ų | 116 | 147.6 Ų | 147.6 | 70% | 0.703 | 79% | 0.79 | S | S | * | * | trans | -132.9 | 113.3 | 163.9 | 176.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 541 | I | 31.8 | Very low | 30.3 | Very low | 148 Ų | 148 | 150.3 Ų | 150.3 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | trans | -77.4 | 135.7 | 165.2 | -59.8 | 163.6 | 0 | 0 | 0 | 107.1 | ||||
| 542 | L | 28.6 | Very low | 30.2 | Very low | 148 Ų | 148 | 147.5 Ų | 147.5 | 78% | 0.775 | 79% | 0.786 | S | S | * | * | trans | -151.7 | 104.4 | 158.8 | -112.6 | 168.9 | 0 | 0 | 0 | 110.5 | ||||
| 543 | E | 30.3 | Very low | 30 | Very low | 174 Ų | 174 | 149.1 Ų | 149.1 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | trans | -75.5 | 142.6 | 164 | -58.4 | 163.6 | 131.6 | 0 | 0 | 108.9 | ||||
| 544 | T | 31 | Very low | 29.9 | Very low | 143 Ų | 143 | 144.8 Ų | 144.8 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | trans | -148.6 | 133.1 | 156.8 | 2.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 545 | E | 29.9 | Very low | 29.8 | Very low | 170 Ų | 170 | 146.7 Ų | 146.7 | 79% | 0.794 | 79% | 0.785 | S | S | * | * | trans | -127.8 | 154.5 | -168.9 | -154.9 | -174.5 | 124.9 | 0 | 0 | 111.8 | ||||
| 546 | L | 28.6 | Very low | 29.7 | Very low | 131 Ų | 131 | 149 Ų | 149 | 69% | 0.686 | 79% | 0.789 | S | S | * | * | trans | 61.8 | 113.9 | 154.8 | -94.7 | 170.6 | 0 | 0 | 0 | 121.6 | ||||
| 547 | R | 29.1 | Very low | 29.7 | Very low | 210 Ų | 210 | 149.1 Ų | 149.1 | 79% | 0.792 | 79% | 0.789 | S | S | * | * | 170.7 | 122.6 | 114.9 | -91.4 | 175 | 175.8 | -110.3 | -3.1 | 110 | |||||
| 548 | T | 30.2 | Very low | 29.8 | Very low | 100 Ų | 100 | 153.2 Ų | 153.2 | 61% | 0.613 | 79% | 0.789 | S | S | * | * | 53.7 | 133.7 | 88.2 | 71.5 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 549 | E | 31.7 | Very low | 29.9 | Very low | 168 Ų | 168 | 150.7 Ų | 150.7 | 79% | 0.785 | 78% | 0.78 | S | S | * | * | cis | -155 | 143.1 | 44.3 | -70.5 | 155.8 | -178.5 | 0 | 0 | 114.5 | ||||
| 550 | E | 30.9 | Very low | 29.8 | Very low | 151 Ų | 151 | 153 Ų | 153 | 71% | 0.706 | 77% | 0.773 | S | S | * | * | trans | 45.6 | 132.2 | 132.4 | -136.4 | -163.3 | 123 | 0 | 0 | 127.2 | ||||
| 551 | K | 29.3 | Very low | 30 | Very low | 174 Ų | 174 | 154 Ų | 154 | 76% | 0.757 | 77% | 0.77 | S | S | * | * | trans | 63.4 | 159 | 158.7 | -85.9 | -171.7 | -173.3 | 93 | 0 | 117.5 | ||||
| 552 | V | 31.4 | Very low | 30 | Very low | 135 Ų | 135 | 154.8 Ų | 154.8 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | cis | -130.5 | 164.5 | 23.5 | 173.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 553 | V | 29.2 | Very low | 30.4 | Very low | 131 Ų | 131 | 153.8 Ų | 153.8 | 79% | 0.794 | 77% | 0.77 | S | S | * | * | trans | -115.9 | 147.5 | -178.1 | 165.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 554 | A | 28.2 | Very low | 30.5 | Very low | 90 Ų | 90 | 153.2 Ų | 153.2 | 74% | 0.744 | 77% | 0.767 | S | S | * | * | trans | 64 | 127.1 | 163.9 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 555 | E | 27.8 | Very low | 30.8 | Very low | 191 Ų | 191 | 153.3 Ų | 153.3 | 89% | 0.893 | 76% | 0.762 | S | S | * | * | -171.4 | 179.1 | 112.4 | -104.2 | -174.7 | 155.6 | 0 | 0 | 110.4 | |||||
| 556 | M | 30.8 | Very low | 31.1 | Very low | 185 Ų | 185 | 150.7 Ų | 150.7 | 91% | 0.911 | 76% | 0.758 | S | S | * | * | trans | 70.3 | 65.8 | 174.1 | -62.1 | 179 | 58.7 | 0 | 0 | 118.2 | ||||
| 557 | E | 31.3 | Very low | 31.3 | Very low | 193 Ų | 193 | 152.2 Ų | 152.2 | 90% | 0.902 | 76% | 0.762 | S | S | * | * | -89.5 | 163.2 | 124.7 | -171.8 | 165.1 | -168.1 | 0 | 0 | 108.6 | |||||
| 558 | E | 29.8 | Very low | 31.8 | Very low | 159 Ų | 159 | 149.3 Ų | 149.3 | 74% | 0.743 | 76% | 0.76 | S | S | * | * | trans | 65.1 | 98.3 | 176 | -151.7 | -173 | -137.7 | 0 | 0 | 117.3 | ||||
| 559 | H | 30.3 | Very low | 32.3 | Very low | 146 Ų | 146 | 150.7 Ų | 150.7 | 68% | 0.676 | 77% | 0.768 | S | S | * | * | 166.4 | 93.5 | 122.5 | -89.6 | 81.4 | 0 | 0 | 0 | 108.6 | |||||
| 560 | Q | 28.8 | Very low | 32.8 | Very low | 149 Ų | 149 | 148.3 Ų | 148.3 | 70% | 0.696 | 77% | 0.765 | S | S | * | * | 94.6 | 134.5 | 74.5 | -171.4 | -171.9 | 69.7 | 0 | 0 | 113.1 | |||||
| 561 | H | 31.5 | Very low | 33.3 | Very low | 137 Ų | 137 | 149 Ų | 149 | 63% | 0.634 | 77% | 0.772 | S | S | * | * | trans | 75.6 | 117.7 | 166.2 | -75.2 | -38.7 | 0 | 0 | 0 | 122.2 | ||||
| 562 | Q | 30.5 | Very low | 33.7 | Very low | 165 Ų | 165 | 149.2 Ų | 149.2 | 77% | 0.771 | 78% | 0.776 | S | S | * | * | trans | 72 | 148.7 | 137.1 | -58.5 | 174.3 | 43.5 | 0 | 0 | 117.2 | ||||
| 563 | V | 36.8 | Very low | 34.3 | Very low | 127 Ų | 127 | 154.5 Ų | 154.5 | 77% | 0.77 | 80% | 0.8 | S | S | * | * | cis | -135 | 153.3 | 13.6 | -90.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 564 | H | 32.8 | Very low | 34.5 | Very low | 163 Ų | 163 | 155.7 Ų | 155.7 | 76% | 0.755 | 80% | 0.8 | S | S | * | * | trans | -8.2 | 133.4 | 144.1 | -101.3 | 52.7 | 0 | 0 | 0 | 119.8 | ||||
| 565 | N | 38.3 | Very low | 34.9 | Very low | 144 Ų | 144 | 159.1 Ų | 159.1 | 77% | 0.77 | 80% | 0.803 | S | S | * | * | 158.3 | 109.9 | 123.6 | -79 | -22.5 | 0 | 0 | 0 | 109.3 | |||||
| 566 | V | 34.8 | Very low | 35.3 | Very low | 115 Ų | 115 | 157.3 Ų | 157.3 | 70% | 0.697 | 80% | 0.798 | S | S | * | * | 95.9 | 119.5 | 67 | 161.7 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 567 | E | 32.9 | Very low | 35.5 | Very low | 164 Ų | 164 | 155.7 Ų | 155.7 | 77% | 0.766 | 79% | 0.791 | S | S | * | * | trans | 60.1 | 101.2 | 157.8 | -136.4 | 155.7 | -164.3 | 0 | 0 | 117.9 | ||||
| 568 | I | 41.4 | Very low | 35.8 | Very low | 148 Ų | 148 | 153.4 Ų | 153.4 | 76% | 0.759 | 78% | 0.784 | S | S | * | * | 54.8 | 105.4 | 81.1 | -53.3 | 168.3 | 0 | 0 | 0 | 113.9 | |||||
| 569 | V | 39.3 | Very low | 36.2 | Very low | 129 Ų | 129 | 153 Ų | 153 | 78% | 0.782 | 79% | 0.787 | S | S | * | * | trans | -140.2 | 131.9 | 144.4 | 177.7 | 0 | 0 | 0 | 0 | 108 | L571 | V569-L571 HydrophobicContact CG1-CG 4.37Š| ||
| 570 | V | 43.2 | Very low | 36.6 | Very low | 119 Ų | 119 | 153.5 Ų | 153.5 | 72% | 0.721 | 80% | 0.795 | S | S | * | * | trans | -91 | 136.3 | 166.3 | 173.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 571 | L | 40 | Very low | 37.2 | Very low | 164 Ų | 164 | 153.8 Ų | 153.8 | 86% | 0.859 | 80% | 0.803 | S | S | * | * | trans | -132.2 | 135.8 | 160.2 | -78.6 | 174.2 | 0 | 0 | 0 | 109.3 | V569 | V569-L571 HydrophobicContact CG1-CG 4.37Š| ||
| 572 | E | 38.3 | Very low | 37.7 | Very low | 180 Ų | 180 | 155.3 Ų | 155.3 | 84% | 0.841 | 82% | 0.817 | S | S | * | * | trans | -92.7 | 148.7 | 174 | -59.7 | 165.1 | 114.2 | 0 | 0 | 109.5 | ||||
| 573 | D | 44 | Very low | 38.4 | Very low | 245 Ų | 245 | 154.4 Ų | 154.4 | 100% | 1.31 | 82% | 0.821 | S | S | * | * | trans | -157.5 | 0 | 147.7 | -103.3 | -30.4 | 0 | 0 | 0 | 107.8 |
Retrieved 573 of 573 residues in 182.3 ms
(Link to these results)