| 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 | 30.1 | Very low | 27.3 | Very low | 249 Ų | 249 | 144.9 Ų | 144.9 | 100% | 1.227 | 84% | 0.841 | S | S | * | * | 0 | 121.6 | 0 | -92.1 | 169.9 | 154.7 | 0 | 0 | 108.3 | |||||
| 2 | A | 23.3 | Very low | 27.8 | Very low | 90 Ų | 90 | 146.7 Ų | 146.7 | 74% | 0.744 | 84% | 0.843 | S | S | * | * | trans | -4 | 152.1 | 153.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 3 | K | 25.4 | Very low | 28.4 | Very low | 186 Ų | 186 | 146.5 Ų | 146.5 | 81% | 0.809 | 84% | 0.837 | S | S | * | * | cis | -171.7 | 142.3 | 12.8 | -116.5 | 171.2 | -176.3 | -176.7 | 0 | 110.7 | ||||
| 4 | T | 26.9 | Very low | 28.4 | Very low | 124 Ų | 124 | 146.9 Ų | 146.9 | 76% | 0.761 | 84% | 0.835 | S | S | * | * | trans | 57.2 | 111.8 | 139.5 | 58 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 5 | G | 23.6 | Very low | 28.8 | Very low | 82 Ų | 82 | 147.3 Ų | 147.3 | 85% | 0.845 | 83% | 0.833 | S | S | * | * | trans | -92.1 | 152.3 | 155 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 6 | F | 24.7 | Very low | 29.2 | Very low | 211 Ų | 211 | 146.8 Ų | 146.8 | 93% | 0.925 | 82% | 0.821 | S | S | * | * | trans | -106.9 | 125.9 | 168.3 | -100.7 | -100.3 | 0 | 0 | 0 | 106.9 | ||||
| 7 | C | 26.8 | Very low | 29.4 | Very low | 114 Ų | 114 | 148.9 Ų | 148.9 | 77% | 0.77 | 82% | 0.819 | S | S | * | * | trans | -140.9 | 124.8 | 166.1 | -78.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 8 | D | 28.2 | Very low | 29.3 | Very low | 150 Ų | 150 | 151.9 Ų | 151.9 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | trans | 78.6 | 108.9 | 134.3 | -52.1 | -20.9 | 0 | 0 | 0 | 121.8 | ||||
| 9 | S | 28.5 | Very low | 29.6 | Very low | 123 Ų | 123 | 149.1 Ų | 149.1 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 134 | 168 | -4 | 0 | 0 | 0 | 0 | 111.7 | ||
| 10 | I | 31.3 | Very low | 29.6 | Very low | 158 Ų | 158 | 146.2 Ų | 146.2 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -95 | 138.7 | 170.9 | -59.5 | 171.4 | 0 | 0 | 0 | 108.8 | ||
| 11 | P | 31.1 | Very low | 29.6 | Very low | 107 Ų | 107 | 148.3 Ų | 148.3 | 70% | 0.695 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 119.1 | -175.6 | 8.3 | 8.4 | 0 | 0 | 0 | 113 | L13 | P11-L13 VanDerWaalsContact C-N 3.27Å; P11-L13 PolarHBondContact O-N 3.49Å; P11-L13 VanDerWaalsContact O-N 3.09Å |
| 12 | L | 34.1 | Very low | 29.6 | Very low | 166 Ų | 166 | 142.5 Ų | 142.5 | 87% | 0.869 | 78% | 0.782 | S | S | * | * | trans | -78.3 | 49.6 | 174.4 | -80.1 | 163.2 | 0 | 0 | 0 | 113.4 | ||||
| 13 | L | 34.7 | Very low | 29.9 | Very low | 145 Ų | 145 | 146.3 Ų | 146.3 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | -109.3 | -5.5 | -174.3 | -109.7 | 124.1 | 0 | 0 | 0 | 116.1 | P11 | P11-L13 VanDerWaalsContact C-N 3.27Å; P11-L13 PolarHBondContact O-N 3.49Å; P11-L13 VanDerWaalsContact O-N 3.09Å | ||
| 14 | D | 29.1 | Very low | 30.4 | Very low | 152 Ų | 152 | 147.5 Ų | 147.5 | 81% | 0.813 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -99.7 | -2.6 | -173.6 | -103.7 | -16.9 | 0 | 0 | 0 | 115.9 | ||
| 15 | L | 35 | Very low | 30.5 | Very low | 153 Ų | 153 | 145.1 Ų | 145.1 | 80% | 0.801 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -90.5 | -20.4 | 176.1 | -129.4 | 77 | 0 | 0 | 0 | 113.7 | K17 | L15-K17 VanDerWaalsContact C-N 3.33Å; L15-K17 PolarHBondContact O-N 3.38Å |
| 16 | H | 34.2 | Very low | 30.9 | Very low | 138 Ų | 138 | 146.3 Ų | 146.3 | 64% | 0.639 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | -13.5 | -171.1 | -84.2 | -137.2 | 0 | 0 | 0 | 114.8 | ||
| 17 | K | 33.7 | Very low | 31.4 | Very low | 183 Ų | 183 | 142.2 Ų | 142.2 | 80% | 0.796 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.1 | -18.1 | -175.7 | -87 | -178.3 | 176.8 | 174.2 | 0 | 115.1 | L15 | L15-K17 VanDerWaalsContact C-N 3.33Å; L15-K17 PolarHBondContact O-N 3.38Å |
| 18 | K | 26.4 | Very low | 31.8 | Very low | 203 Ų | 203 | 141.4 Ų | 141.4 | 88% | 0.883 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | -8.9 | -170.9 | -129.3 | 178.1 | -178.4 | -178.9 | 0 | 115.1 | ||
| 19 | V | 35.3 | Very low | 31.8 | Very low | 98 Ų | 98 | 136.4 Ų | 136.4 | 59% | 0.594 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.3 | -19.1 | -174.4 | -176.1 | 0 | 0 | 0 | 0 | 112.9 | E21 | V19-E21 VanDerWaalsContact C-N 3.28Å; V19-E21 PolarHBondContact O-N 3.32Å |
| 20 | A | 30.6 | Very low | 32 | Very low | 91 Ų | 91 | 136.7 Ų | 136.7 | 75% | 0.752 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | -9.3 | -172 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 21 | E | 28.6 | Very low | 32.1 | Very low | 191 Ų | 191 | 132.5 Ų | 132.5 | 89% | 0.893 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.8 | -8.9 | -176.3 | -78.7 | -177.2 | 157.5 | 0 | 0 | 115 | V19 | V19-E21 VanDerWaalsContact C-N 3.28Å; V19-E21 PolarHBondContact O-N 3.32Å |
| 22 | E | 29.8 | Very low | 32.1 | Very low | 128 Ų | 128 | 135.2 Ų | 135.2 | 60% | 0.598 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -109 | 108.4 | 177 | -78.1 | -168.6 | -176.6 | 0 | 0 | 112 | K37 | E22-K37 IonicContact OE2-NZ 3.68Å; E22-K37 PolarHBondContact OE2-NZ 2.94Å |
| 23 | R | 31 | Very low | 31.9 | Very low | 169 Ų | 169 | 130 Ų | 130 | 64% | 0.638 | 68% | 0.68 | S | S | * | * | trans | 92.5 | 87.4 | 151.3 | -54.3 | 166.2 | -176.6 | -144.7 | -5.4 | 118 | ||||
| 24 | R | 35.9 | Very low | 31.8 | Very low | 212 Ų | 212 | 128.1 Ų | 128.1 | 80% | 0.8 | 68% | 0.677 | S | S | * | * | trans | -90.5 | 116.3 | 147.6 | -91.7 | 176 | 171 | 171.2 | -8.2 | 109.3 | G375 | R24-G375 VanDerWaalsContact NH2-CA 3.31Å; R24-G375 PolarHBondContact NH2-O 3.14Å; R24-G375 VanDerWaalsContact NH2-O 3.13Å | ||
| 25 | A | 27.5 | Very low | 31.9 | Very low | 74 Ų | 74 | 123.7 Ų | 123.7 | 61% | 0.612 | 67% | 0.667 | S | S | * | * | trans | -146.1 | 159.9 | 166.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | A29 | A25-A29 HydrophobicContact CB-CB 3.93Š| ||
| 26 | P | 32.4 | Very low | 31.5 | Very low | 107 Ų | 107 | 122.9 Ų | 122.9 | 70% | 0.695 | 67% | 0.672 | S | S | * | * | trans | -63.6 | 159 | -168.8 | -16.2 | 28.4 | 0 | 0 | 0 | 113.6 | R28 A29 | P26-R28 PolarHBondContact O-N 3.1Å; P26-A29 WeakPolarHBondContact O-CB 3.35Å; P26-A29 PolarHBondContact O-N 3.34Å | ||
| 27 | L | 35.5 | Very low | 31.3 | Very low | 125 Ų | 125 | 123.5 Ų | 123.5 | 65% | 0.654 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49 | -15 | -169.1 | -70.2 | 166.2 | 0 | 0 | 0 | 117.4 | ||
| 28 | R | 36 | Very low | 31 | Very low | 96 Ų | 96 | 123.8 Ų | 123.8 | 36% | 0.362 | 68% | 0.677 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -113.8 | -5.8 | 174.4 | -83.8 | -171.8 | 175 | 160.5 | 7.1 | 115.9 | P26 L30 A31 G127 L128 I129 | P26-R28 PolarHBondContact O-N 3.1Å; R28-L30 PolarHBondContact O-N 3.23Å; R28-L30 VanDerWaalsContact O-N 3.13Å; R28-A31 PolarHBondContact O-N 3.34Å; R28-G127 WeakPolarHBondContact CD-O 3.46Å; R28-G127 PolarHBondContact NE-O 3.06Å; R28-G127 PolarHBondContact NH1-O 3.07Å; R28-G127 PolarHBondContact NH2-O 3.28Å; R28-L128 PolarHBondContact NH2-O 3.16Å; R28-I129 PolarHBondContact NH1-O 3.11Å; R28-I129 VanDerWaalsContact NH1-O 3.09Å |
| 29 | A | 27.8 | Very low | 31 | Very low | 46 Ų | 46 | 124.7 Ų | 124.7 | 38% | 0.38 | 67% | 0.674 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.5 | -12.8 | -171.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | A25 P26 A33 | A25-A29 HydrophobicContact CB-CB 3.93Å; P26-A29 WeakPolarHBondContact O-CB 3.35Å; P26-A29 PolarHBondContact O-N 3.34Å; A29-A33 WeakPolarHBondContact O-CB 3.45Å |
| 30 | L | 32.9 | Very low | 30.5 | Very low | 128 Ų | 128 | 131.9 Ų | 131.9 | 67% | 0.67 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | -22 | 176.6 | -77.5 | 164.4 | 0 | 0 | 0 | 113.8 | R28 N32 | R28-L30 PolarHBondContact O-N 3.23Å; R28-L30 VanDerWaalsContact O-N 3.13Å; L30-N32 PolarHBondContact O-N 3.22Å |
| 31 | A | 31.7 | Very low | 30.1 | Very low | 71 Ų | 71 | 135.4 Ų | 135.4 | 59% | 0.587 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | -26.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | R28 | R28-A31 PolarHBondContact O-N 3.34Š|
| 32 | N | 31.8 | Very low | 30 | Very low | 163 Ų | 163 | 131.9 Ų | 131.9 | 87% | 0.872 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | 9.5 | -175.3 | -68.3 | -22.1 | 0 | 0 | 0 | 114.1 | L30 | L30-N32 PolarHBondContact O-N 3.22Š|
| 33 | A | 30 | Very low | 29.7 | Very low | 58 Ų | 58 | 135.4 Ų | 135.4 | 48% | 0.479 | 70% | 0.702 | S | S | . | * | trans | -131 | 49.2 | -172.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | A29 | A29-A33 WeakPolarHBondContact O-CB 3.45Š| ||
| 34 | C | 31.8 | Very low | 29.5 | Very low | 104 Ų | 104 | 136.2 Ų | 136.2 | 70% | 0.703 | 71% | 0.713 | S | S | * | * | trans | -127 | 91.1 | 169.3 | -80.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 35 | G | 32.7 | Very low | 29 | Very low | 59 Ų | 59 | 129.7 Ų | 129.7 | 61% | 0.608 | 71% | 0.712 | S | S | * | * | trans | -70.7 | 163.5 | 148.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | K37 | G35-K37 PolarHBondContact O-N 3.08Å; G35-K37 VanDerWaalsContact O-N 3.08Å | ||
| 36 | P | 26.1 | Very low | 28.9 | Very low | 137 Ų | 137 | 134.7 Ų | 134.7 | 89% | 0.89 | 72% | 0.722 | S | S | * | * | trans | -67 | 111.6 | -169.3 | 27.8 | -33.5 | 0 | 0 | 0 | 110.6 | ||||
| 37 | K | 30.1 | Very low | 28.6 | Very low | 151 Ų | 151 | 135.5 Ų | 135.5 | 66% | 0.657 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 137.5 | 164.6 | -109 | -172.3 | 175.7 | -172.3 | 0 | 109.1 | E22 G35 | E22-K37 IonicContact OE2-NZ 3.68Å; E22-K37 PolarHBondContact OE2-NZ 2.94Å; G35-K37 PolarHBondContact O-N 3.08Å; G35-K37 VanDerWaalsContact O-N 3.08Å |
| 38 | E | 28.1 | Very low | 28.1 | Very low | 189 Ų | 189 | 139.2 Ų | 139.2 | 88% | 0.883 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 141.5 | -164.7 | -65 | 174.6 | 155.1 | 0 | 0 | 114 | ||
| 39 | R | 25.8 | Very low | 27.6 | Very low | 221 Ų | 221 | 138 Ų | 138 | 83% | 0.834 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 123.4 | -178.8 | -178.5 | -176.8 | -69.9 | -146.5 | -2.7 | 110.4 | Q41 | R39-Q41 PolarHBondContact O-N 3.03Š|
| 40 | W | 25.2 | Very low | 27.2 | Very low | 250 Ų | 250 | 141.8 Ų | 141.8 | 95% | 0.947 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 125.2 | 164.2 | -93 | 74.9 | 0 | 0 | 0 | 110 | ||
| 41 | Q | 22.1 | Very low | 26.7 | Very low | 165 Ų | 165 | 145.1 Ų | 145.1 | 77% | 0.771 | 78% | 0.782 | S | S | * | * | trans | -105.7 | 132.9 | 171.6 | -70.7 | -157.9 | -15 | 0 | 0 | 110.3 | R39 | R39-Q41 PolarHBondContact O-N 3.03Š| ||
| 42 | P | 25.3 | Very low | 26.2 | Very low | 116 Ų | 116 | 149 Ų | 149 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | trans | -69.2 | 137.6 | 167.9 | -11.9 | 27 | 0 | 0 | 0 | 110.6 | E44 | P42-E44 PolarHBondContact O-N 3.1Š| ||
| 43 | Q | 23.7 | Very low | 25.8 | Very low | 202 Ų | 202 | 150.2 Ų | 150.2 | 94% | 0.944 | 79% | 0.786 | S | S | * | * | trans | -67 | 112.3 | 168.1 | -83.2 | -171.2 | -38.9 | 0 | 0 | 109.9 | ||||
| 44 | E | 27 | Very low | 25.4 | Very low | 187 Ų | 187 | 153.9 Ų | 153.9 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 119.6 | 166.9 | -73.8 | -176.2 | 159.2 | 0 | 0 | 109.9 | P42 | P42-E44 PolarHBondContact O-N 3.1Š|
| 45 | G | 25.5 | Very low | 25 | Very low | 75 Ų | 75 | 157.3 Ų | 157.3 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 121.9 | 164.2 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 46 | E | 25.2 | Very low | 24.8 | Very low | 179 Ų | 179 | 160.2 Ų | 160.2 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 131.2 | -179.7 | -65.8 | -177.4 | 135 | 0 | 0 | 113.1 | ||
| 47 | S | 25.8 | Very low | 24.8 | Very low | 123 Ų | 123 | 161.3 Ų | 161.3 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | trans | -146.7 | 120.2 | 143.8 | 39.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 48 | K | 25.6 | Very low | 24.5 | Very low | 204 Ų | 204 | 158.2 Ų | 158.2 | 89% | 0.887 | 81% | 0.812 | S | S | * | * | trans | -74.6 | 141.2 | -173.9 | -72.1 | 173.9 | 175.1 | 171.8 | 0 | 112 | ||||
| 49 | G | 25 | Very low | 24.3 | Very low | 71 Ų | 71 | 160 Ų | 160 | 73% | 0.732 | 81% | 0.811 | S | S | * | * | trans | -171 | 75.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 50 | T | 20.7 | Very low | 24.2 | Very low | 125 Ų | 125 | 159.5 Ų | 159.5 | 77% | 0.767 | 81% | 0.809 | S | S | * | * | trans | 19 | 132.8 | 149.3 | 21.7 | 0 | 0 | 0 | 0 | 125.3 | ||||
| 51 | Y | 21.3 | Very low | 24.1 | Very low | 197 Ų | 197 | 151.9 Ų | 151.9 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | trans | 85.6 | 104.8 | 138.8 | -82.6 | -76.2 | 0 | 0 | 0 | 123.9 | ||||
| 52 | Q | 22 | Very low | 24.2 | Very low | 154 Ų | 154 | 154.3 Ų | 154.3 | 72% | 0.72 | 80% | 0.801 | S | S | * | * | 67.6 | 129.7 | 126.7 | -86.7 | -177.5 | 0.3 | 0 | 0 | 125.8 | |||||
| 53 | K | 22 | Very low | 24.1 | Very low | 187 Ų | 187 | 159.7 Ų | 159.7 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | trans | 66.4 | 126.1 | 147.4 | -89.4 | 178 | 171.8 | 177.3 | 0 | 117 | ||||
| 54 | T | 21.7 | Very low | 24.1 | Very low | 135 Ų | 135 | 158.2 Ų | 158.2 | 83% | 0.828 | 80% | 0.804 | S | S | * | * | -158.9 | 145 | 59.5 | 40.7 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 55 | E | 23.5 | Very low | 24 | Very low | 177 Ų | 177 | 155.2 Ų | 155.2 | 83% | 0.827 | 80% | 0.801 | S | S | * | * | trans | -71.6 | 160.3 | 161.1 | -119.7 | 177.1 | -165.2 | 0 | 0 | 110.8 | ||||
| 56 | P | 28.7 | Very low | 24 | Very low | 119 Ų | 119 | 158.2 Ų | 158.2 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | -147 | 155 | 72.7 | 35.6 | -14.7 | 0 | 0 | 0 | 118.3 | |||||
| 57 | E | 25.6 | Very low | 23.9 | Very low | 161 Ų | 161 | 154.5 Ų | 154.5 | 75% | 0.752 | 80% | 0.797 | S | S | * | * | trans | 20.2 | 129.4 | 146.5 | -58.2 | -167.5 | 139.3 | 0 | 0 | 122.2 | ||||
| 58 | A | 24.3 | Very low | 23.9 | Very low | 85 Ų | 85 | 154.5 Ų | 154.5 | 70% | 0.702 | 79% | 0.793 | S | S | * | * | -163.8 | 108.2 | 122.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 59 | R | 23.9 | Very low | 24 | Very low | 227 Ų | 227 | 151.8 Ų | 151.8 | 86% | 0.857 | 79% | 0.788 | S | S | * | * | trans | -64.2 | 133.1 | 167.8 | -67.6 | 174 | -166 | 165.8 | 6.2 | 110.7 | ||||
| 60 | W | 23.7 | Very low | 24.1 | Very low | 211 Ų | 211 | 156.1 Ų | 156.1 | 80% | 0.799 | 79% | 0.794 | S | S | * | * | trans | -126.4 | 76.8 | 155.2 | -68.9 | 85.9 | 0 | 0 | 0 | 109.9 | ||||
| 61 | A | 23.2 | Very low | 24.4 | Very low | 89 Ų | 89 | 153.3 Ų | 153.3 | 74% | 0.736 | 79% | 0.79 | S | S | * | * | trans | -95.5 | 113.3 | 153.2 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 62 | R | 24.8 | Very low | 24.8 | Very low | 216 Ų | 216 | 151.6 Ų | 151.6 | 82% | 0.815 | 79% | 0.792 | S | S | * | * | trans | -114.2 | 109.1 | 161.7 | -86.1 | -166.7 | -172.8 | -165.1 | 3.3 | 109.8 | ||||
| 63 | R | 23.6 | Very low | 25.1 | Very low | 230 Ų | 230 | 152 Ų | 152 | 87% | 0.868 | 80% | 0.798 | S | S | * | * | trans | -63.2 | 138.6 | 159 | -58.6 | 173.2 | -144.1 | -154.4 | 2.3 | 108.1 | ||||
| 64 | L | 23.8 | Very low | 25.4 | Very low | 170 Ų | 170 | 151 Ų | 151 | 89% | 0.89 | 80% | 0.798 | S | S | * | * | trans | -68.4 | 137.5 | 163.8 | -74.5 | 153.9 | 0 | 0 | 0 | 109.5 | ||||
| 65 | P | 24.5 | Very low | 25.6 | Very low | 124 Ų | 124 | 147.7 Ų | 147.7 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | trans | -106.6 | 142.5 | 154.1 | 18.5 | -0.1 | 0 | 0 | 0 | 111.4 | ||||
| 66 | V | 24.5 | Very low | 25.7 | Very low | 139 Ų | 139 | 148.8 Ų | 148.8 | 84% | 0.842 | 79% | 0.793 | S | S | * | * | trans | -87.6 | 151 | 174.2 | 166.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 67 | S | 23.8 | Very low | 25.6 | Very low | 100 Ų | 100 | 151.9 Ų | 151.9 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | trans | 78.7 | 143.2 | 169.9 | 113.4 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 68 | T | 25.5 | Very low | 25.8 | Very low | 124 Ų | 124 | 152.5 Ų | 152.5 | 76% | 0.761 | 80% | 0.8 | S | S | * | * | cis | -160.3 | 150.7 | 18.1 | 10 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 69 | D | 27.2 | Very low | 25.8 | Very low | 147 Ų | 147 | 156.3 Ų | 156.3 | 79% | 0.786 | 81% | 0.808 | S | S | * | * | trans | 24.7 | 112.2 | 144.7 | -133.1 | 14.8 | 0 | 0 | 0 | 118.9 | ||||
| 70 | D | 28.1 | Very low | 25.9 | Very low | 162 Ų | 162 | 152.5 Ų | 152.5 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | -173.8 | 127.7 | 128.7 | -101.2 | -24.5 | 0 | 0 | 0 | 110.1 | |||||
| 71 | G | 26.4 | Very low | 26 | Very low | 65 Ų | 65 | 147.6 Ų | 147.6 | 67% | 0.67 | 80% | 0.803 | S | S | * | * | trans | -74.7 | 150.6 | -167.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 72 | I | 29.5 | Very low | 26.4 | Very low | 161 Ų | 161 | 148.4 Ų | 148.4 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | -131 | 97 | 147.9 | -60.7 | -178.4 | 0 | 0 | 0 | 106.6 | M74 | I72-M74 PolarHBondContact O-N 3.22Š| ||
| 73 | I | 28.2 | Very low | 27.2 | Very low | 163 Ų | 163 | 143.3 Ų | 143.3 | 84% | 0.836 | 80% | 0.798 | S | S | * | * | trans | -75.8 | 112.1 | 168.9 | -63.2 | 171.6 | 0 | 0 | 0 | 106.6 | ||||
| 74 | M | 30 | Very low | 27.5 | Very low | 166 Ų | 166 | 140.3 Ų | 140.3 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -91.8 | 101.9 | 160.1 | -83.4 | -81.6 | -81.2 | 0 | 0 | 107 | I72 F76 | I72-M74 PolarHBondContact O-N 3.22Å; M74-F76 PolarHBondContact O-N 3.39Å | ||
| 75 | G | 25.5 | Very low | 28 | Very low | 66 Ų | 66 | 136.4 Ų | 136.4 | 68% | 0.68 | 78% | 0.781 | S | S | * | * | trans | -60.8 | 124.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 76 | F | 24.9 | Very low | 28.2 | Very low | 200 Ų | 200 | 133.1 Ų | 133.1 | 88% | 0.877 | 77% | 0.769 | S | S | * | * | trans | -80.7 | 121.5 | 159.4 | -91.9 | -99.5 | 0 | 0 | 0 | 107.3 | M74 E78 | M74-F76 PolarHBondContact O-N 3.39Å; F76-E78 PolarHBondContact O-N 3.05Å | ||
| 77 | H | 26.7 | Very low | 28.6 | Very low | 184 Ų | 184 | 129 Ų | 129 | 85% | 0.852 | 76% | 0.755 | S | S | * | * | trans | -68.8 | 115.4 | 164.6 | -106.2 | -84.8 | 0 | 0 | 0 | 107.8 | ||||
| 78 | E | 29.1 | Very low | 29.2 | Very low | 174 Ų | 174 | 128.2 Ų | 128.2 | 81% | 0.813 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -74 | 118.9 | 161.4 | -73 | 176.7 | 149.3 | 0 | 0 | 107.8 | F76 | F76-E78 PolarHBondContact O-N 3.05Š|
| 79 | D | 24.8 | Very low | 29.5 | Very low | 164 Ų | 164 | 128.4 Ų | 128.4 | 88% | 0.877 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -103.9 | 119.2 | 157.9 | -97 | -24.8 | 0 | 0 | 0 | 107.7 | ||
| 80 | D | 26.7 | Very low | 30.2 | Very low | 147 Ų | 147 | 128 Ų | 128 | 79% | 0.786 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 128.3 | -173.3 | -110.7 | -30.1 | 0 | 0 | 0 | 112.5 | ||
| 81 | S | 25.9 | Very low | 30.9 | Very low | 108 Ų | 108 | 124.9 Ų | 124.9 | 76% | 0.755 | 72% | 0.716 | S | S | * | * | trans | 82.2 | 155.4 | 144 | 75.7 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 82 | P | 31.5 | Very low | 31.4 | Very low | 106 Ų | 106 | 126.5 Ų | 126.5 | 69% | 0.688 | 71% | 0.706 | S | S | * | * | cis | -120.1 | 154 | -5 | 36.5 | -20.7 | 0 | 0 | 0 | 114.8 | H84 | P82-H84 PolarHBondContact O-N 3.28Š| ||
| 83 | S | 40.1 | Very low | 32 | Very low | 109 Ų | 109 | 121.4 Ų | 121.4 | 76% | 0.762 | 69% | 0.688 | S | S | * | * | trans | -48.4 | 123.7 | 166.8 | 51.9 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 84 | H | 30.5 | Very low | 32.9 | Very low | 168 Ų | 168 | 114.4 Ų | 114.4 | 78% | 0.778 | 65% | 0.652 | S | S | * | * | trans | -143.8 | 108.8 | 154.6 | -84.8 | -68.7 | 0 | 0 | 0 | 110.4 | P82 G86 | P82-H84 PolarHBondContact O-N 3.28Å; H84-G86 PolarHBondContact O-N 3.32Å | ||
| 85 | S | 34.9 | Very low | 33.6 | Very low | 88 Ų | 88 | 108.7 Ų | 108.7 | 62% | 0.615 | 63% | 0.625 | S | S | * | * | trans | 35 | 69.9 | 150.6 | 60.4 | 0 | 0 | 0 | 0 | 118.2 | G87 | S85-G87 VanDerWaalsContact C-N 3.34Å; S85-G87 PolarHBondContact O-N 3.11Å | ||
| 86 | G | 29.3 | Very low | 34.5 | Very low | 55 Ų | 55 | 111 Ų | 111 | 57% | 0.567 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -71.4 | -20.6 | 176 | 0 | 0 | 0 | 0 | 0 | 115.4 | H84 | H84-G86 PolarHBondContact O-N 3.32Å |
| 87 | G | 32.9 | Very low | 35.6 | Very low | 52 Ų | 52 | 105.3 Ų | 105.3 | 54% | 0.536 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -76.5 | -23.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115 | S85 | S85-G87 VanDerWaalsContact C-N 3.34Å; S85-G87 PolarHBondContact O-N 3.11Å |
| 88 | C | 34.5 | Very low | 36.4 | Very low | 83 Ų | 83 | 98.6 Ų | 98.6 | 56% | 0.561 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -79.9 | -29.8 | -174.1 | -162.6 | 0 | 0 | 0 | 0 | 112.7 | E92 | C88-E92 PolarHBondContact O-N 2.63Å |
| 89 | M | 32 | Very low | 37.1 | Very low | 128 Ų | 128 | 95.9 Ų | 95.9 | 63% | 0.631 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -82.1 | -22.7 | -177.3 | -59 | -66.1 | -76.1 | 0 | 0 | 112.5 | A93 | M89-A93 PolarHBondContact O-N 2.97Å |
| 90 | E | 43.3 | Very low | 38 | Very low | 140 Ų | 140 | 91.3 Ų | 91.3 | 65% | 0.654 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -81.6 | -38.1 | 179.9 | -69.9 | -175.6 | 156.2 | 0 | 0 | 112.5 | E92 A93 | E90-E92 VanDerWaalsContact C-N 3.27Å; E90-E92 PolarHBondContact O-N 3.37Å; E90-A93 PolarHBondContact O-N 3.09Å |
| 91 | E | 41.2 | Very low | 38.8 | Very low | 95 Ų | 95 | 86.8 Ų | 86.8 | 44% | 0.444 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.8 | -40.2 | 166 | -89.1 | -178.2 | 165.5 | 0 | 0 | 110.7 | A93 V94 L95 R116 | E91-A93 VanDerWaalsContact C-N 3.32Å; E91-A93 PolarHBondContact O-N 2.87Å; E91-V94 PolarHBondContact O-N 3.49Å; E91-L95 HydrophobicContact CB-CD1 4.17Å; E91-L95 WeakPolarHBondContact O-CB 3.19Å; E91-L95 WeakPolarHBondContact O-CD1 3.27Å; E91-L95 WeakPolarHBondContact O-CG 3.32Å; E91-L95 PolarHBondContact O-N 2.94Å; E91-R116 IonicContact OE1-NH1 2.88Å |
| 92 | E | 38.3 | Very low | 39.3 | Very low | 99 Ų | 99 | 91 Ų | 91 | 46% | 0.463 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.5 | -31.6 | -176.9 | -154.2 | 167.8 | -162.6 | 0 | 0 | 113 | C88 E90 L95 I96 | C88-E92 PolarHBondContact O-N 2.63Å; E90-E92 VanDerWaalsContact C-N 3.27Å; E90-E92 PolarHBondContact O-N 3.37Å; E92-L95 CarbonylContact O-C 3.58Å; E92-I96 HydrophobicContact CG-CD1 4.22Å; E92-I96 VanDerWaalsContact O-CB 3.25Å; E92-I96 WeakPolarHBondContact O-CB 3.39Å; E92-I96 VanDerWaalsContact O-CD1 3.25Å; E92-I96 WeakPolarHBondContact O-CD1 3.49Å; E92-I96 WeakPolarHBondContact O-CG1 3.49Å; E92-I96 PolarHBondContact O-N 3.48Å |
| 93 | A | 42.2 | Very low | 39.8 | Very low | 54 Ų | 54 | 88 Ų | 88 | 45% | 0.446 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -76.1 | -38.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | M89 E90 E91 I96 Y97 | M89-A93 PolarHBondContact O-N 2.97Å; E90-A93 PolarHBondContact O-N 3.09Å; E91-A93 VanDerWaalsContact C-N 3.32Å; E91-A93 PolarHBondContact O-N 2.87Å; A93-I96 PolarHBondContact O-N 3.37Å; A93-Y97 PolarHBondContact O-N 2.87Å; A93-Y97 VanDerWaalsContact O-N 3.09Å |
| 94 | V | 46 | Very low | 39.7 | Very low | 16 Ų | 16 | 89 Ų | 89 | 10% | 0.097 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -69.6 | -40.5 | 171.4 | 176.6 | 0 | 0 | 0 | 0 | 109.5 | E91 I96 Y97 L98 W136 | E91-V94 PolarHBondContact O-N 3.49Å; V94-I96 VanDerWaalsContact C-N 3.35Å; V94-I96 PolarHBondContact O-N 3.25Å; V94-Y97 WeakPolarHBondContact O-CB 3.45Å; V94-Y97 PolarHBondContact O-N 2.85Å; V94-L98 HydrophobicContact CG1-CD1 3.99Å; V94-L98 WeakPolarHBondContact O-CB 3.34Å; V94-L98 VanDerWaalsContact O-CG 3.28Å; V94-L98 WeakPolarHBondContact O-CG 3.18Å; V94-L98 PolarHBondContact O-N 3.06Å; V94-W136 HydrophobicContact CG1-CZ2 4.3Å |
| 95 | L | 45.7 | Very low | 40.2 | Very low | 47 Ų | 47 | 90.4 Ų | 90.4 | 25% | 0.246 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -60.5 | -41.3 | 170.5 | -75.3 | 168.8 | 0 | 0 | 0 | 110.6 | E91 E92 Y97 L98 H99 P112 | E91-L95 HydrophobicContact CB-CD1 4.17Å; E91-L95 WeakPolarHBondContact O-CB 3.19Å; E91-L95 WeakPolarHBondContact O-CD1 3.27Å; E91-L95 WeakPolarHBondContact O-CG 3.32Å; E91-L95 PolarHBondContact O-N 2.94Å; E92-L95 CarbonylContact O-C 3.58Å; L95-Y97 PolarHBondContact O-N 3.12Å; L95-L98 CarbonylContact O-C 3.53Å; L95-L98 VanDerWaalsContact O-C 3.25Å; L95-L98 WeakPolarHBondContact O-CA 3.3Å; L95-L98 WeakPolarHBondContact O-CB 3.48Å; L95-L98 PolarHBondContact O-N 3.08Å; L95-H99 VanDerWaalsContact O-CA 3.3Å; L95-H99 WeakPolarHBondContact O-CA 3.44Å; L95-H99 WeakPolarHBondContact O-CB 3.38Å; L95-H99 PolarHBondContact O-CD2 3.36Å; L95-H99 VanDerWaalsContact O-CD2 3.29Å; L95-H99 PolarHBondContact O-N 3.35Å; L95-P112 HydrophobicContact CD2-CB 4.32Å; L95-P112 HydrophobicContact CD2-CG 3.97Å |
| 96 | I | 45 | Very low | 40.6 | Very low | 115 Ų | 115 | 90.9 Ų | 90.9 | 59% | 0.59 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.9 | -38 | 176.3 | -76.8 | 159.2 | 0 | 0 | 0 | 111.8 | E92 A93 V94 L98 H99 G100 | E92-I96 HydrophobicContact CG-CD1 4.22Å; E92-I96 VanDerWaalsContact O-CB 3.25Å; E92-I96 WeakPolarHBondContact O-CB 3.39Å; E92-I96 VanDerWaalsContact O-CD1 3.25Å; E92-I96 WeakPolarHBondContact O-CD1 3.49Å; E92-I96 WeakPolarHBondContact O-CG1 3.49Å; E92-I96 PolarHBondContact O-N 3.48Å; A93-I96 PolarHBondContact O-N 3.37Å; V94-I96 VanDerWaalsContact C-N 3.35Å; V94-I96 PolarHBondContact O-N 3.25Å; I96-L98 VanDerWaalsContact C-N 3.27Å; I96-L98 PolarHBondContact O-N 2.96Å; I96-H99 PolarHBondContact O-N 2.99Å; I96-G100 PolarHBondContact O-N 3.47Å |
| 97 | Y | 46.7 | Very low | 41.1 | Very low | 80 Ų | 80 | 93.9 Ų | 93.9 | 31% | 0.314 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.3 | -34.3 | 170.1 | -177.5 | -92.1 | 0 | 0 | 0 | 111.8 | A93 V94 L95 M143 | A93-Y97 PolarHBondContact O-N 2.87Å; A93-Y97 VanDerWaalsContact O-N 3.09Å; V94-Y97 WeakPolarHBondContact O-CB 3.45Å; V94-Y97 PolarHBondContact O-N 2.85Å; L95-Y97 PolarHBondContact O-N 3.12Å; Y97-M143 HydrophobicContact CD1-CE 3.87Å; Y97-M143 HydrophobicContact CE1-CE 3.18Å |
| 98 | L | 44.7 | Very low | 41.7 | Very low | 42 Ų | 42 | 94.3 Ų | 94.3 | 22% | 0.22 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -85.7 | -21 | 175.6 | -64.7 | 167.8 | 0 | 0 | 0 | 114.2 | V94 L95 I96 | V94-L98 HydrophobicContact CG1-CD1 3.99Å; V94-L98 WeakPolarHBondContact O-CB 3.34Å; V94-L98 VanDerWaalsContact O-CG 3.28Å; V94-L98 WeakPolarHBondContact O-CG 3.18Å; V94-L98 PolarHBondContact O-N 3.06Å; L95-L98 CarbonylContact O-C 3.53Å; L95-L98 VanDerWaalsContact O-C 3.25Å; L95-L98 WeakPolarHBondContact O-CA 3.3Å; L95-L98 WeakPolarHBondContact O-CB 3.48Å; L95-L98 PolarHBondContact O-N 3.08Å; I96-L98 VanDerWaalsContact C-N 3.27Å; I96-L98 PolarHBondContact O-N 2.96Å |
| 99 | H | 43.4 | Very low | 42.3 | Very low | 118 Ų | 118 | 94 Ų | 94 | 55% | 0.546 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -100.5 | 2.5 | -169.1 | -98.5 | -90.1 | 0 | 0 | 0 | 113.3 | L95 I96 L101 | L95-H99 VanDerWaalsContact O-CA 3.3Å; L95-H99 WeakPolarHBondContact O-CA 3.44Å; L95-H99 WeakPolarHBondContact O-CB 3.38Å; L95-H99 PolarHBondContact O-CD2 3.36Å; L95-H99 VanDerWaalsContact O-CD2 3.29Å; L95-H99 PolarHBondContact O-N 3.35Å; I96-H99 PolarHBondContact O-N 2.99Å; H99-L101 PolarHBondContact O-N 2.94Å |
| 100 | G | 42.5 | Very low | 43.5 | Very low | 68 Ų | 68 | 93.9 Ų | 93.9 | 70% | 0.701 | 51% | 0.51 | S | S | * | . | S | Bend | trans | -62.5 | 11.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | I96 | I96-G100 PolarHBondContact O-N 3.47Š|
| 101 | L | 43.3 | Very low | 44.3 | Very low | 52 Ų | 52 | 89.1 Ų | 89.1 | 27% | 0.272 | 49% | 0.49 | S | S | . | . | trans | -135.4 | 96.1 | -162.3 | -64.8 | 163.2 | 0 | 0 | 0 | 110.8 | H99 Q108 V339 | H99-L101 PolarHBondContact O-N 2.94Å; L101-Q108 PolarHBondContact O-NE2 3.26Å; L101-Q108 VanDerWaalsContact O-NE2 3.12Å; L101-V339 VanDerWaalsContact CD1-C 3.43Å; L101-V339 HydrophobicContact CD1-CB 4.09Å; L101-V339 HydrophobicContact CD1-CG1 3.29Å; L101-V339 WeakPolarHBondContact CD1-O 3.25Å; L101-V339 HydrophobicContact CG-CG1 4.49Å | ||
| 102 | Q | 37.1 | Very low | 45.8 | Very low | 195 Ų | 195 | 86.3 Ų | 86.3 | 91% | 0.911 | 48% | 0.48 | S | S | * | . | trans | -66.4 | 129.8 | 173 | -72.8 | -178.9 | -19.2 | 0 | 0 | 111.1 | ||||
| 103 | G | 43.3 | Very low | 47.9 | Very low | 45 Ų | 45 | 84 Ų | 84 | 46% | 0.464 | 48% | 0.483 | S | S | . | . | trans | 116.6 | 82.3 | 157.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 104 | L | 36.3 | Very low | 50 | Low | 130 Ų | 130 | 85.6 Ų | 85.6 | 68% | 0.681 | 48% | 0.482 | S | S | * | . | trans | 165.5 | 88.3 | 134.4 | -85.7 | 165.8 | 0 | 0 | 0 | 108.6 | S106 Q108 | L104-S106 PolarHBondContact O-N 3.14Å; L104-S106 VanDerWaalsContact O-N 3.16Å; L104-Q108 WeakPolarHBondContact O-CG 3.35Å; L104-Q108 PolarHBondContact O-N 2.94Å; L104-Q108 PolarHBondContact O-OE1 3.12Å | ||
| 105 | Y | 42.6 | Very low | 51.9 | Low | 197 Ų | 197 | 85 Ų | 85 | 77% | 0.773 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -12.2 | -159.7 | -70.9 | -86.5 | 0 | 0 | 0 | 117.6 | ||
| 106 | S | 41.5 | Very low | 54.1 | Low | 97 Ų | 97 | 87 Ų | 87 | 68% | 0.678 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.6 | -31.8 | -178.2 | 73.6 | 0 | 0 | 0 | 0 | 115.1 | L104 | L104-S106 PolarHBondContact O-N 3.14Å; L104-S106 VanDerWaalsContact O-N 3.16Å |
| 107 | L | 39.8 | Very low | 56.3 | Low | 119 Ų | 119 | 86 Ų | 86 | 62% | 0.623 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | -32.4 | 175.7 | -79.6 | 163.4 | 0 | 0 | 0 | 111.6 | A109 L110 V111 | L107-A109 PolarHBondContact O-N 2.84Å; L107-L110 PolarHBondContact O-N 2.69Å; L107-V111 WeakPolarHBondContact O-CB 3.43Å; L107-V111 WeakPolarHBondContact O-CG2 3.28Å; L107-V111 PolarHBondContact O-N 3.08Å; L107-V111 VanDerWaalsContact O-N 3.09Å |
| 108 | Q | 45.8 | Very low | 58.5 | Low | 60 Ų | 60 | 84.3 Ų | 84.3 | 28% | 0.28 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -23.6 | 176 | -77.6 | 178.1 | -34.3 | 0 | 0 | 113.7 | L101 L104 P112 | L101-Q108 PolarHBondContact O-NE2 3.26Å; L101-Q108 VanDerWaalsContact O-NE2 3.12Å; L104-Q108 WeakPolarHBondContact O-CG 3.35Å; L104-Q108 PolarHBondContact O-N 2.94Å; L104-Q108 PolarHBondContact O-OE1 3.12Å; Q108-P112 WeakPolarHBondContact O-CD 3.15Å; Q108-P112 WeakPolarHBondContact O-CG 3.48Å |
| 109 | A | 48.5 | Very low | 60.8 | Low | 78 Ų | 78 | 82.3 Ų | 82.3 | 65% | 0.645 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.7 | -27 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114 | L107 | L107-A109 PolarHBondContact O-N 2.84Š|
| 110 | L | 56 | Low | 63.2 | Low | 125 Ų | 125 | 78.1 Ų | 78.1 | 65% | 0.654 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.6 | -29 | -179.5 | -77.7 | 158.4 | 0 | 0 | 0 | 112.9 | L107 P112 G113 M114 | L107-L110 PolarHBondContact O-N 2.69Å; L110-P112 VanDerWaalsContact C-CD 3.48Å; L110-G113 PolarHBondContact O-N 2.93Å; L110-M114 PolarHBondContact O-N 2.92Å; L110-M114 VanDerWaalsContact O-N 3.15Å |
| 111 | V | 60.8 | Low | 65.6 | Low | 40 Ų | 40 | 78 Ų | 78 | 24% | 0.242 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -57 | -39.4 | 179.4 | 168 | 0 | 0 | 0 | 0 | 113.2 | L107 G113 M114 L115 | L107-V111 WeakPolarHBondContact O-CB 3.43Å; L107-V111 WeakPolarHBondContact O-CG2 3.28Å; L107-V111 PolarHBondContact O-N 3.08Å; L107-V111 VanDerWaalsContact O-N 3.09Å; V111-G113 PolarHBondContact O-N 3.15Å; V111-M114 PolarHBondContact O-N 3.12Å; V111-L115 WeakPolarHBondContact O-CB 3.47Å; V111-L115 PolarHBondContact O-N 3.34Å |
| 112 | P | 71.7 | Confident | 68 | Low | 35 Ų | 35 | 75.7 Ų | 75.7 | 23% | 0.227 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -61.6 | -42.7 | 178.1 | -25.4 | 34.9 | 0 | 0 | 0 | 113.4 | L95 Q108 L110 R116 | L95-P112 HydrophobicContact CD2-CB 4.32Å; L95-P112 HydrophobicContact CD2-CG 3.97Å; Q108-P112 WeakPolarHBondContact O-CD 3.15Å; Q108-P112 WeakPolarHBondContact O-CG 3.48Å; L110-P112 VanDerWaalsContact C-CD 3.48Å; P112-R116 WeakPolarHBondContact O-CB 3.49Å; P112-R116 PolarHBondContact O-N 3.27Å |
| 113 | G | 83.1 | Confident | 70.7 | Confident | 51 Ų | 51 | 66.5 Ų | 66.5 | 53% | 0.526 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -69.1 | -41.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L110 V111 H117 | L110-G113 PolarHBondContact O-N 2.93Å; V111-G113 PolarHBondContact O-N 3.15Å; G113-H117 PolarHBondContact O-N 3.49Å; G113-H117 VanDerWaalsContact O-N 3.11Å |
| 114 | M | 85.8 | Confident | 73 | Confident | 88 Ų | 88 | 69.1 Ų | 69.1 | 43% | 0.433 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -68.4 | -44.1 | 176.7 | -175.2 | 172.1 | 52.3 | 0 | 0 | 111.8 | L110 V111 R116 H117 E118 V333 | L110-M114 PolarHBondContact O-N 2.92Å; L110-M114 VanDerWaalsContact O-N 3.15Å; V111-M114 PolarHBondContact O-N 3.12Å; M114-R116 VanDerWaalsContact C-N 3.31Å; M114-R116 PolarHBondContact O-N 3.07Å; M114-H117 PolarHBondContact O-N 3.26Å; M114-E118 HydrophobicContact CG-CG 4.48Å; M114-E118 WeakPolarHBondContact O-CG 3.2Å; M114-E118 PolarHBondContact O-N 2.89Å; M114-V333 HydrophobicContact CE-CG2 3.43Å; M114-V333 VanDerWaalsContact CE-CG2 3.43Å; M114-V333 HydrophobicContact CG-CG1 4.45Å; M114-V333 HydrophobicContact CG-CG2 4.05Å; M114-V333 HydrophobicContact SD-CG2 3.77Å |
| 115 | L | 87.4 | Confident | 75.6 | Confident | 3 Ų | 3 | 67.7 Ų | 67.7 | 2% | 0.016 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -58.7 | -43.7 | 175.7 | 175.7 | 63.8 | 0 | 0 | 0 | 111.5 | V111 E118 T119 W136 I275 V333 S336 I337 | V111-L115 WeakPolarHBondContact O-CB 3.47Å; V111-L115 PolarHBondContact O-N 3.34Å; L115-E118 PolarHBondContact O-N 3.3Å; L115-T119 WeakPolarHBondContact O-CB 3.44Å; L115-T119 PolarHBondContact O-N 3.11Å; L115-T119 PolarHBondContact O-OG1 3.48Å; L115-W136 HydrophobicContact CD2-CH2 4.38Å; L115-W136 HydrophobicContact CG-CZ3 4.39Å; L115-I275 HydrophobicContact CD1-CD1 4.47Å; L115-V333 HydrophobicContact CB-CG1 4.18Å; L115-V333 HydrophobicContact CD1-CG1 4.03Å; L115-S336 WeakPolarHBondContact CD2-OG 3.45Å; L115-I337 HydrophobicContact CD1-CD1 4.34Å; L115-I337 HydrophobicContact CD1-CG1 3.96Å |
| 116 | R | 90.4 | Very high | 77.9 | Confident | 88 Ų | 88 | 60.3 Ų | 60.3 | 33% | 0.332 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -58.2 | -51.6 | 175.9 | 175.2 | 172.3 | -179.7 | 168.3 | 8.3 | 111.4 | E91 P112 M114 E118 T119 E120 W136 | E91-R116 IonicContact OE1-NH1 2.88Å; P112-R116 WeakPolarHBondContact O-CB 3.49Å; P112-R116 PolarHBondContact O-N 3.27Å; M114-R116 VanDerWaalsContact C-N 3.31Å; M114-R116 PolarHBondContact O-N 3.07Å; R116-E118 PolarHBondContact O-N 3.25Å; R116-T119 PolarHBondContact O-N 3.02Å; R116-E120 WeakPolarHBondContact CG-OE1 3.43Å; R116-E120 IonicContact NE-OE1 3.94Å; R116-E120 PolarHBondContact NE-OE1 2.81Å; R116-E120 VanDerWaalsContact NE-OE1 3.09Å; R116-E120 WeakPolarHBondContact O-CG 3.44Å; R116-E120 PolarHBondContact O-N 3.4Å; R116-W136 VanDerWaalsContact CA-CZ3 3.46Å; R116-W136 HydrophobicContact CB-CD2 4.01Å; R116-W136 HydrophobicContact CB-CE3 3.66Å; R116-W136 HydrophobicContact CB-CH2 4.16Å; R116-W136 HydrophobicContact CB-CZ2 4.49Å; R116-W136 HydrophobicContact CB-CZ3 3.75Å; R116-W136 HydrophobicContact CG-CB 4.19Å; R116-W136 HydrophobicContact CG-CD2 3.67Å; R116-W136 HydrophobicContact CG-CE3 3.65Å; R116-W136 HydrophobicContact CG-CG 3.92Å; R116-W136 HydrophobicContact CG-CZ3 4.27Å |
| 117 | H | 91.8 | Very high | 80.1 | Confident | 96 Ų | 96 | 57 Ų | 57 | 44% | 0.444 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -58.2 | -47.9 | 179.4 | -176.4 | 73.7 | 0 | 0 | 0 | 112.4 | G113 M114 T119 E120 L121 R132 | G113-H117 PolarHBondContact O-N 3.49Å; G113-H117 VanDerWaalsContact O-N 3.11Å; M114-H117 PolarHBondContact O-N 3.26Å; H117-T119 VanDerWaalsContact C-N 3.33Å; H117-T119 PolarHBondContact O-N 2.91Å; H117-E120 PolarHBondContact O-N 3.16Å; H117-L121 PolarHBondContact O-N 3.28Å; H117-R132 PolarHBondContact CE1-NH2 2.71Å; H117-R132 PolarHBondContact ND1-NH2 2.85Å |
| 118 | E | 93.3 | Very high | 82.2 | Confident | 44 Ų | 44 | 53.9 Ų | 53.9 | 21% | 0.206 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -66.6 | -35.5 | -179.5 | -70 | -57.2 | 151.3 | 0 | 0 | 112.3 | M114 L115 R116 L121 A122 I275 V333 | M114-E118 HydrophobicContact CG-CG 4.48Å; M114-E118 WeakPolarHBondContact O-CG 3.2Å; M114-E118 PolarHBondContact O-N 2.89Å; L115-E118 PolarHBondContact O-N 3.3Å; R116-E118 PolarHBondContact O-N 3.25Å; E118-L121 PolarHBondContact O-N 3.03Å; E118-A122 WeakPolarHBondContact O-CB 3.21Å; E118-A122 PolarHBondContact O-N 3.36Å; E118-I275 HydrophobicContact CB-CG1 4.18Å; E118-I275 HydrophobicContact CB-CG2 3.95Å; E118-I275 HydrophobicContact CG-CG2 4.5Å; E118-V333 HydrophobicContact CB-CG1 4.3Å; E118-V333 HydrophobicContact CG-CG1 4.17Å |
| 119 | T | 92.3 | Very high | 84.1 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.6 | -44.5 | 176.9 | -62.9 | 0 | 0 | 0 | 0 | 111.1 | L115 R116 H117 L121 A122 M123 F139 | L115-T119 WeakPolarHBondContact O-CB 3.44Å; L115-T119 PolarHBondContact O-N 3.11Å; L115-T119 PolarHBondContact O-OG1 3.48Å; R116-T119 PolarHBondContact O-N 3.02Å; H117-T119 VanDerWaalsContact C-N 3.33Å; H117-T119 PolarHBondContact O-N 2.91Å; T119-L121 VanDerWaalsContact C-N 3.32Å; T119-L121 PolarHBondContact O-N 3.05Å; T119-A122 PolarHBondContact O-N 3.1Å; T119-M123 HydrophobicContact CG2-CG 4.4Å; T119-M123 HydrophobicContact CG2-SD 4.12Å; T119-M123 WeakPolarHBondContact O-CB 3.38Å; T119-M123 VanDerWaalsContact O-CG 3.29Å; T119-M123 WeakPolarHBondContact O-CG 3.35Å; T119-M123 PolarHBondContact O-N 3.41Å; T119-F139 HydrophobicContact CG2-CB 3.73Å; T119-F139 HydrophobicContact CG2-CD1 4.03Å; T119-F139 HydrophobicContact CG2-CD2 3.76Å; T119-F139 HydrophobicContact CG2-CE2 4.38Å; T119-F139 HydrophobicContact CG2-CG 3.56Å |
| 120 | E | 93.4 | Very high | 85.7 | Confident | 30 Ų | 30 | 57.8 Ų | 57.8 | 14% | 0.14 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -56.8 | -47.1 | 174.2 | -73.4 | 170.5 | -171.9 | 0 | 0 | 111.1 | R116 H117 M123 E124 R132 A135 | R116-E120 WeakPolarHBondContact CG-OE1 3.43Å; R116-E120 IonicContact NE-OE1 3.94Å; R116-E120 PolarHBondContact NE-OE1 2.81Å; R116-E120 VanDerWaalsContact NE-OE1 3.09Å; R116-E120 WeakPolarHBondContact O-CG 3.44Å; R116-E120 PolarHBondContact O-N 3.4Å; H117-E120 PolarHBondContact O-N 3.16Å; E120-M123 PolarHBondContact O-N 3.1Å; E120-E124 WeakPolarHBondContact O-CB 3.38Å; E120-E124 PolarHBondContact O-N 2.88Å; E120-E124 VanDerWaalsContact O-N 3.1Å; E120-R132 HydrophobicContact CB-CG 4.06Å; E120-R132 HydrophobicContact CG-CG 4.48Å; E120-R132 IonicContact OE2-CZ 3.77Å; E120-R132 IonicContact OE2-NE 3.96Å; E120-R132 PolarHBondContact OE2-NE 2.99Å; E120-R132 IonicContact OE2-NH2 2.85Å; E120-A135 HydrophobicContact CB-CB 4.19Å; E120-A135 HydrophobicContact CG-CB 3.87Å |
| 121 | L | 93.3 | Very high | 87.2 | Confident | 65 Ų | 65 | 55.9 Ų | 55.9 | 34% | 0.34 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.7 | -42.8 | 178.1 | -177.2 | 65.5 | 0 | 0 | 0 | 112.3 | H117 E118 T119 E124 T125 | H117-L121 PolarHBondContact O-N 3.28Å; E118-L121 PolarHBondContact O-N 3.03Å; T119-L121 VanDerWaalsContact C-N 3.32Å; T119-L121 PolarHBondContact O-N 3.05Å; L121-E124 PolarHBondContact O-N 2.99Å; L121-T125 WeakPolarHBondContact O-CB 3.4Å; L121-T125 PolarHBondContact O-N 2.83Å; L121-T125 PolarHBondContact O-OG1 2.93Å |
| 122 | A | 93.7 | Very high | 88.5 | Confident | 3 Ų | 3 | 57.6 Ų | 57.6 | 3% | 0.025 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | E118 T119 E124 T125 L126 L271 I275 | E118-A122 WeakPolarHBondContact O-CB 3.21Å; E118-A122 PolarHBondContact O-N 3.36Å; T119-A122 PolarHBondContact O-N 3.1Å; A122-E124 VanDerWaalsContact C-N 3.34Å; A122-E124 PolarHBondContact O-N 2.9Å; A122-T125 PolarHBondContact O-N 3.48Å; A122-L126 WeakPolarHBondContact O-CB 3.4Å; A122-L126 WeakPolarHBondContact O-CG 3.36Å; A122-L126 PolarHBondContact O-N 3.37Å; A122-L271 HydrophobicContact CB-CD2 4.12Å; A122-I275 HydrophobicContact CB-CG1 3.8Å |
| 123 | M | 93.5 | Very high | 89.4 | Confident | 3 Ų | 3 | 59.1 Ų | 59.1 | 2% | 0.015 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.1 | -38.9 | 177.9 | -73.1 | -176.2 | 86.3 | 0 | 0 | 112.5 | T119 E120 G127 L128 I129 A135 I138 F139 L271 | T119-M123 HydrophobicContact CG2-CG 4.4Å; T119-M123 HydrophobicContact CG2-SD 4.12Å; T119-M123 WeakPolarHBondContact O-CB 3.38Å; T119-M123 VanDerWaalsContact O-CG 3.29Å; T119-M123 WeakPolarHBondContact O-CG 3.35Å; T119-M123 PolarHBondContact O-N 3.41Å; E120-M123 PolarHBondContact O-N 3.1Å; M123-G127 PolarHBondContact O-N 3.29Å; M123-L128 PolarHBondContact O-N 3.36Å; M123-I129 HydrophobicContact CB-CD1 3.76Å; M123-I129 HydrophobicContact CB-CG1 4.11Å; M123-I129 HydrophobicContact CB-CG2 4.17Å; M123-I129 HydrophobicContact CE-CG2 3.57Å; M123-I129 HydrophobicContact SD-CG2 4.43Å; M123-A135 HydrophobicContact CB-CB 4.26Å; M123-A135 HydrophobicContact SD-CB 3.75Å; M123-I138 HydrophobicContact CE-CB 3.93Å; M123-I138 HydrophobicContact CE-CG2 3.55Å; M123-F139 HydrophobicContact SD-CB 4.2Å; M123-L271 HydrophobicContact CB-CD2 4.39Å; M123-L271 HydrophobicContact CG-CD2 3.37Å |
| 124 | E | 91.6 | Very high | 89.7 | Confident | 100 Ų | 100 | 63.1 Ų | 63.1 | 47% | 0.467 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.5 | -49.5 | 173 | -176.9 | 174.1 | -165.4 | 0 | 0 | 110.9 | E120 L121 A122 L126 G127 I129 R132 | E120-E124 WeakPolarHBondContact O-CB 3.38Å; E120-E124 PolarHBondContact O-N 2.88Å; E120-E124 VanDerWaalsContact O-N 3.1Å; L121-E124 PolarHBondContact O-N 2.99Å; A122-E124 VanDerWaalsContact C-N 3.34Å; A122-E124 PolarHBondContact O-N 2.9Å; E124-L126 VanDerWaalsContact C-N 3.34Å; E124-L126 PolarHBondContact O-N 2.82Å; E124-G127 PolarHBondContact O-N 3.39Å; E124-I129 HydrophobicContact CB-CD1 4.44Å; E124-R132 IonicContact OE2-NH1 3.18Å; E124-R132 PolarHBondContact OE2-NH1 3.42Å |
| 125 | T | 91.9 | Very high | 90 | Very high | 100 Ų | 100 | 59 Ų | 59 | 61% | 0.613 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -61.8 | -39.6 | -179.4 | -57.9 | 0 | 0 | 0 | 0 | 112.5 | L121 A122 G127 | L121-T125 WeakPolarHBondContact O-CB 3.4Å; L121-T125 PolarHBondContact O-N 2.83Å; L121-T125 PolarHBondContact O-OG1 2.93Å; A122-T125 PolarHBondContact O-N 3.48Å; T125-G127 PolarHBondContact O-N 3.34Å |
| 126 | L | 90.4 | Very high | 90.1 | Very high | 42 Ų | 42 | 59.9 Ų | 59.9 | 22% | 0.22 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.8 | -7 | 176.8 | -67.7 | 170.3 | 0 | 0 | 0 | 112.8 | A122 E124 L128 L270 L271 | A122-L126 WeakPolarHBondContact O-CB 3.4Å; A122-L126 WeakPolarHBondContact O-CG 3.36Å; A122-L126 PolarHBondContact O-N 3.37Å; E124-L126 VanDerWaalsContact C-N 3.34Å; E124-L126 PolarHBondContact O-N 2.82Å; L126-L128 HydrophobicContact CB-CD1 4Å; L126-L128 HydrophobicContact CB-CG 3.8Å; L126-L128 HydrophobicContact CD1-CD1 3.95Å; L126-L128 PolarHBondContact O-N 2.97Å; L126-L270 HydrophobicContact CD1-CB 3.97Å; L126-L270 HydrophobicContact CD2-CB 4.31Å; L126-L271 HydrophobicContact CD1-CD2 3.94Å; L126-L271 HydrophobicContact CD1-CG 4.25Å |
| 127 | G | 88.2 | Confident | 90.1 | Very high | 26 Ų | 26 | 59.4 Ų | 59.4 | 27% | 0.268 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 63.6 | 29.9 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | R28 M123 E124 T125 | R28-G127 WeakPolarHBondContact CD-O 3.46Å; R28-G127 PolarHBondContact NE-O 3.06Å; R28-G127 PolarHBondContact NH1-O 3.07Å; R28-G127 PolarHBondContact NH2-O 3.28Å; M123-G127 PolarHBondContact O-N 3.29Å; E124-G127 PolarHBondContact O-N 3.39Å; T125-G127 PolarHBondContact O-N 3.34Å |
| 128 | L | 83.8 | Confident | 90.1 | Very high | 54 Ų | 54 | 58.3 Ų | 58.3 | 28% | 0.283 | 29% | 0.29 | S | S | . | . | trans | -79.6 | -24 | 179 | -66.8 | 175.5 | 0 | 0 | 0 | 111.9 | R28 M123 L126 L271 | R28-L128 PolarHBondContact NH2-O 3.16Å; M123-L128 PolarHBondContact O-N 3.36Å; L126-L128 HydrophobicContact CB-CD1 4Å; L126-L128 HydrophobicContact CB-CG 3.8Å; L126-L128 HydrophobicContact CD1-CD1 3.95Å; L126-L128 PolarHBondContact O-N 2.97Å; L128-L271 HydrophobicContact CD1-CD2 4.16Å; L128-L271 HydrophobicContact CD1-CG 4.3Å | ||
| 129 | I | 86.4 | Confident | 90.1 | Very high | 16 Ų | 16 | 56.4 Ų | 56.4 | 8% | 0.082 | 28% | 0.281 | C | S | . | . | trans | -121 | 158.5 | -177.7 | 61.1 | -179.7 | 0 | 0 | 0 | 110.9 | R28 M123 E124 A135 I138 | R28-I129 PolarHBondContact NH1-O 3.11Å; R28-I129 VanDerWaalsContact NH1-O 3.09Å; M123-I129 HydrophobicContact CB-CD1 3.76Å; M123-I129 HydrophobicContact CB-CG1 4.11Å; M123-I129 HydrophobicContact CB-CG2 4.17Å; M123-I129 HydrophobicContact CE-CG2 3.57Å; M123-I129 HydrophobicContact SD-CG2 4.43Å; E124-I129 HydrophobicContact CB-CD1 4.44Å; I129-A135 HydrophobicContact CD1-CB 3.39Å; I129-I138 HydrophobicContact CG2-CD1 3.78Å | ||
| 130 | Y | 80.7 | Confident | 90 | Very high | 204 Ų | 204 | 56.8 Ų | 56.8 | 80% | 0.8 | 28% | 0.283 | S | S | * | . | S | Bend | trans | -98.1 | -34.8 | 169.6 | -72 | -76.4 | 0 | 0 | 0 | 111.5 | ||
| 131 | D | 87.9 | Confident | 89.8 | Confident | 85 Ų | 85 | 58.7 Ų | 58.7 | 46% | 0.455 | 29% | 0.294 | S | S | . | . | trans | -125.3 | 126.7 | 179.9 | -173.8 | -13.9 | 0 | 0 | 0 | 109.2 | S133 Y134 | D131-S133 VanDerWaalsContact CG-OG 3.26Å; D131-S133 PolarHBondContact O-N 2.97Å; D131-S133 PolarHBondContact OD1-N 2.97Å; D131-S133 PolarHBondContact OD1-OG 2.85Å; D131-S133 VanDerWaalsContact OD1-OG 3.11Å; D131-S133 PolarHBondContact OD2-OG 3.24Å; D131-Y134 HydrophobicContact CB-CD2 3.95Å; D131-Y134 HydrophobicContact CB-CE2 4.33Å; D131-Y134 PolarHBondContact O-N 3.16Å | ||
| 132 | R | 89.1 | Confident | 89.7 | Confident | 76 Ų | 76 | 56.5 Ų | 56.5 | 29% | 0.287 | 28% | 0.283 | S | S | . | . | G | 310 helix | trans | -63.5 | -28.7 | -178.9 | -173.4 | 176.8 | 175.3 | 144.4 | 0.8 | 112.4 | H117 E120 E124 Y134 A135 | H117-R132 PolarHBondContact CE1-NH2 2.71Å; H117-R132 PolarHBondContact ND1-NH2 2.85Å; E120-R132 HydrophobicContact CB-CG 4.06Å; E120-R132 HydrophobicContact CG-CG 4.48Å; E120-R132 IonicContact OE2-CZ 3.77Å; E120-R132 IonicContact OE2-NE 3.96Å; E120-R132 PolarHBondContact OE2-NE 2.99Å; E120-R132 IonicContact OE2-NH2 2.85Å; E124-R132 IonicContact OE2-NH1 3.18Å; E124-R132 PolarHBondContact OE2-NH1 3.42Å; R132-Y134 PolarHBondContact O-N 3.26Å; R132-Y134 VanDerWaalsContact O-N 3.13Å; R132-A135 WeakPolarHBondContact O-CB 3.43Å; R132-A135 PolarHBondContact O-N 3.47Å |
| 133 | S | 89 | Confident | 89.5 | Confident | 68 Ų | 68 | 57 Ų | 57 | 48% | 0.476 | 29% | 0.285 | S | S | . | . | G | 310 helix | trans | -59.7 | -28.2 | -177.7 | 66.2 | 0 | 0 | 0 | 0 | 113.2 | D131 | D131-S133 VanDerWaalsContact CG-OG 3.26Å; D131-S133 PolarHBondContact O-N 2.97Å; D131-S133 PolarHBondContact OD1-N 2.97Å; D131-S133 PolarHBondContact OD1-OG 2.85Å; D131-S133 VanDerWaalsContact OD1-OG 3.11Å; D131-S133 PolarHBondContact OD2-OG 3.24Å |
| 134 | Y | 90.8 | Very high | 89.3 | Confident | 135 Ų | 135 | 62.6 Ų | 62.6 | 53% | 0.529 | 31% | 0.306 | S | S | . | . | G | 310 helix | trans | -92.9 | -5.1 | -179.4 | -63.3 | -80.4 | 0 | 0 | 0 | 113.8 | D131 R132 W136 D137 I138 | D131-Y134 HydrophobicContact CB-CD2 3.95Å; D131-Y134 HydrophobicContact CB-CE2 4.33Å; D131-Y134 PolarHBondContact O-N 3.16Å; R132-Y134 PolarHBondContact O-N 3.26Å; R132-Y134 VanDerWaalsContact O-N 3.13Å; Y134-W136 VanDerWaalsContact C-N 3.34Å; Y134-W136 PolarHBondContact O-N 3.13Å; Y134-D137 PolarHBondContact O-N 2.84Å; Y134-I138 WeakPolarHBondContact O-CB 3.29Å; Y134-I138 VanDerWaalsContact O-CG1 3.25Å; Y134-I138 WeakPolarHBondContact O-CG1 3.42Å; Y134-I138 PolarHBondContact O-N 2.82Å |
| 135 | A | 90.8 | Very high | 89.2 | Confident | 0 Ų | 0 | 58.9 Ų | 58.9 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61 | -45.5 | -171 | 0 | 0 | 0 | 0 | 0 | 111.6 | E120 M123 I129 R132 D137 I138 F139 | E120-A135 HydrophobicContact CB-CB 4.19Å; E120-A135 HydrophobicContact CG-CB 3.87Å; M123-A135 HydrophobicContact CB-CB 4.26Å; M123-A135 HydrophobicContact SD-CB 3.75Å; I129-A135 HydrophobicContact CD1-CB 3.39Å; R132-A135 WeakPolarHBondContact O-CB 3.43Å; R132-A135 PolarHBondContact O-N 3.47Å; A135-D137 PolarHBondContact O-N 3.27Å; A135-I138 PolarHBondContact O-N 2.88Å; A135-F139 WeakPolarHBondContact O-CB 3.34Å; A135-F139 PolarHBondContact O-N 3.2Å |
| 136 | W | 90.7 | Very high | 89.1 | Confident | 22 Ų | 22 | 54.8 Ų | 54.8 | 8% | 0.083 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65.1 | -38.9 | 178.5 | -174.7 | -109.3 | 0 | 0 | 0 | 112.5 | V94 L115 R116 Y134 F139 S140 | V94-W136 HydrophobicContact CG1-CZ2 4.3Å; L115-W136 HydrophobicContact CD2-CH2 4.38Å; L115-W136 HydrophobicContact CG-CZ3 4.39Å; R116-W136 VanDerWaalsContact CA-CZ3 3.46Å; R116-W136 HydrophobicContact CB-CD2 4.01Å; R116-W136 HydrophobicContact CB-CE3 3.66Å; R116-W136 HydrophobicContact CB-CH2 4.16Å; R116-W136 HydrophobicContact CB-CZ2 4.49Å; R116-W136 HydrophobicContact CB-CZ3 3.75Å; R116-W136 HydrophobicContact CG-CB 4.19Å; R116-W136 HydrophobicContact CG-CD2 3.67Å; R116-W136 HydrophobicContact CG-CE3 3.65Å; R116-W136 HydrophobicContact CG-CG 3.92Å; R116-W136 HydrophobicContact CG-CZ3 4.27Å; Y134-W136 VanDerWaalsContact C-N 3.34Å; Y134-W136 PolarHBondContact O-N 3.13Å; W136-F139 AromaticContact CE3-CD1 3.97Å; W136-F139 HydrophobicContact CE3-CD1 3.97Å; W136-F139 HydrophobicContact CH2-CD1 4.27Å; W136-F139 HydrophobicContact CH2-CE1 4.31Å; W136-F139 AromaticContact CZ3-CD1 3.68Å; W136-F139 HydrophobicContact CZ3-CD1 3.68Å; W136-F139 AromaticContact CZ3-CE1 3.95Å; W136-F139 HydrophobicContact CZ3-CE1 3.95Å; W136-F139 PolarHBondContact O-N 3.42Å; W136-S140 WeakPolarHBondContact O-CB 3.33Å; W136-S140 PolarHBondContact O-N 2.86Å; W136-S140 PolarHBondContact O-OG 2.8Å |
| 137 | D | 90.3 | Very high | 89 | Confident | 79 Ų | 79 | 57 Ų | 57 | 42% | 0.422 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66 | -43.1 | 178.7 | -59.4 | -27.9 | 0 | 0 | 0 | 111 | Y134 A135 S140 D141 | Y134-D137 PolarHBondContact O-N 2.84Å; A135-D137 PolarHBondContact O-N 3.27Å; D137-S140 PolarHBondContact O-N 3.14Å; D137-D141 WeakPolarHBondContact O-CB 3.42Å; D137-D141 PolarHBondContact O-N 3.16Å |
| 138 | I | 92 | Very high | 88.7 | Confident | 72 Ų | 72 | 63.7 Ų | 63.7 | 37% | 0.369 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -63.5 | -49 | 175.5 | -67 | 164.9 | 0 | 0 | 0 | 110 | M123 I129 Y134 A135 S140 D141 M142 | M123-I138 HydrophobicContact CE-CB 3.93Å; M123-I138 HydrophobicContact CE-CG2 3.55Å; I129-I138 HydrophobicContact CG2-CD1 3.78Å; Y134-I138 WeakPolarHBondContact O-CB 3.29Å; Y134-I138 VanDerWaalsContact O-CG1 3.25Å; Y134-I138 WeakPolarHBondContact O-CG1 3.42Å; Y134-I138 PolarHBondContact O-N 2.82Å; A135-I138 PolarHBondContact O-N 2.88Å; I138-S140 VanDerWaalsContact C-N 3.3Å; I138-S140 PolarHBondContact O-N 3.28Å; I138-D141 CarbonylContact O-C 3.59Å; I138-D141 PolarHBondContact O-N 3.4Å; I138-M142 HydrophobicContact CG2-CG 4.36Å; I138-M142 HydrophobicContact CG2-SD 4.06Å; I138-M142 VanDerWaalsContact O-CG 3.27Å; I138-M142 WeakPolarHBondContact O-CG 3.31Å; I138-M142 PolarHBondContact O-N 2.63Å |
| 139 | F | 91.9 | Very high | 88.2 | Confident | 5 Ų | 5 | 63 Ų | 63 | 2% | 0.022 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.6 | -42.9 | 177 | 175.8 | -104.1 | 0 | 0 | 0 | 111.6 | T119 M123 A135 W136 D141 M142 M143 F268 L271 I337 | T119-F139 HydrophobicContact CG2-CB 3.73Å; T119-F139 HydrophobicContact CG2-CD1 4.03Å; T119-F139 HydrophobicContact CG2-CD2 3.76Å; T119-F139 HydrophobicContact CG2-CE2 4.38Å; T119-F139 HydrophobicContact CG2-CG 3.56Å; M123-F139 HydrophobicContact SD-CB 4.2Å; A135-F139 WeakPolarHBondContact O-CB 3.34Å; A135-F139 PolarHBondContact O-N 3.2Å; W136-F139 AromaticContact CE3-CD1 3.97Å; W136-F139 HydrophobicContact CE3-CD1 3.97Å; W136-F139 HydrophobicContact CH2-CD1 4.27Å; W136-F139 HydrophobicContact CH2-CE1 4.31Å; W136-F139 AromaticContact CZ3-CD1 3.68Å; W136-F139 HydrophobicContact CZ3-CD1 3.68Å; W136-F139 AromaticContact CZ3-CE1 3.95Å; W136-F139 HydrophobicContact CZ3-CE1 3.95Å; W136-F139 PolarHBondContact O-N 3.42Å; F139-D141 VanDerWaalsContact C-N 3.33Å; F139-D141 PolarHBondContact O-N 3.48Å; F139-M142 WeakPolarHBondContact O-CB 3.45Å; F139-M142 PolarHBondContact O-N 3.31Å; F139-M143 HydrophobicContact CD1-CG 4.3Å; F139-M143 HydrophobicContact CE1-CG 3.85Å; F139-M143 HydrophobicContact CE2-CG 4.11Å; F139-M143 HydrophobicContact CE2-SD 4.27Å; F139-M143 HydrophobicContact CZ-CG 3.74Å; F139-M143 HydrophobicContact CZ-SD 4Å; F139-M143 WeakPolarHBondContact O-CG 3.47Å; F139-M143 PolarHBondContact O-N 3.09Å; F139-F268 HydrophobicContact CE2-CE1 4.46Å; F139-L271 HydrophobicContact CD2-CD1 4.32Å; F139-I337 HydrophobicContact CE2-CD1 4.46Å; F139-I337 HydrophobicContact CZ-CD1 4.31Å; F139-I337 HydrophobicContact CZ-CG1 4.2Å; F139-I337 HydrophobicContact CZ-CG2 4.36Å |
| 140 | S | 90.2 | Very high | 87.9 | Confident | 8 Ų | 8 | 64.7 Ų | 64.7 | 6% | 0.056 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.7 | -38.5 | 176.4 | -62.9 | 0 | 0 | 0 | 0 | 111.7 | W136 D137 I138 R144 | W136-S140 WeakPolarHBondContact O-CB 3.33Å; W136-S140 PolarHBondContact O-N 2.86Å; W136-S140 PolarHBondContact O-OG 2.8Å; D137-S140 PolarHBondContact O-N 3.14Å; I138-S140 VanDerWaalsContact C-N 3.3Å; I138-S140 PolarHBondContact O-N 3.28Å; S140-R144 WeakPolarHBondContact O-CG 3.47Å; S140-R144 PolarHBondContact O-N 3.38Å; S140-R144 VanDerWaalsContact O-N 3.13Å; S140-R144 PolarHBondContact O-NE 3.3Å |
| 141 | D | 90.4 | Very high | 88.1 | Confident | 69 Ų | 69 | 56.3 Ų | 56.3 | 37% | 0.369 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -68.9 | -39.4 | 172.4 | -172.5 | 69.6 | 0 | 0 | 0 | 112.4 | D137 I138 F139 M143 R144 S145 | D137-D141 WeakPolarHBondContact O-CB 3.42Å; D137-D141 PolarHBondContact O-N 3.16Å; I138-D141 CarbonylContact O-C 3.59Å; I138-D141 PolarHBondContact O-N 3.4Å; F139-D141 VanDerWaalsContact C-N 3.33Å; F139-D141 PolarHBondContact O-N 3.48Å; D141-M143 VanDerWaalsContact C-N 3.31Å; D141-M143 PolarHBondContact O-N 2.91Å; D141-R144 PolarHBondContact O-N 3.25Å; D141-R144 IonicContact OD1-NH2 3.8Å; D141-S145 WeakPolarHBondContact O-CB 3.39Å; D141-S145 PolarHBondContact O-N 2.72Å; D141-S145 PolarHBondContact O-OG 3.37Å |
| 142 | M | 91.2 | Very high | 88 | Confident | 20 Ų | 20 | 58.4 Ų | 58.4 | 10% | 0.099 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -57 | -46.3 | 172 | -71.5 | 170.7 | 60.6 | 0 | 0 | 110.8 | I138 F139 R144 S145 Q146 H267 F268 L271 | I138-M142 HydrophobicContact CG2-CG 4.36Å; I138-M142 HydrophobicContact CG2-SD 4.06Å; I138-M142 VanDerWaalsContact O-CG 3.27Å; I138-M142 WeakPolarHBondContact O-CG 3.31Å; I138-M142 PolarHBondContact O-N 2.63Å; F139-M142 WeakPolarHBondContact O-CB 3.45Å; F139-M142 PolarHBondContact O-N 3.31Å; M142-R144 VanDerWaalsContact C-N 3.31Å; M142-R144 PolarHBondContact O-N 3.49Å; M142-S145 WeakPolarHBondContact CA-OG 3.46Å; M142-S145 PolarHBondContact O-N 3.46Å; M142-S145 PolarHBondContact O-OG 3.37Å; M142-Q146 PolarHBondContact O-N 3.23Å; M142-Q146 VanDerWaalsContact O-N 3.14Å; M142-H267 HydrophobicContact CE-CB 3.58Å; M142-F268 HydrophobicContact CB-CE1 4.28Å; M142-F268 HydrophobicContact CB-CZ 3.98Å; M142-F268 HydrophobicContact CE-CD1 4.49Å; M142-F268 HydrophobicContact CE-CE1 4.23Å; M142-F268 HydrophobicContact CE-CZ 4.33Å; M142-L271 HydrophobicContact CE-CD1 3.79Å; M142-L271 HydrophobicContact SD-CD1 4.45Å |
| 143 | M | 89.4 | Confident | 88 | Confident | 13 Ų | 13 | 58 Ų | 58 | 6% | 0.064 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.8 | -34.2 | 179.3 | -72.6 | -61.1 | -66.8 | 0 | 0 | 113 | Y97 F139 D141 Q146 F268 I337 | Y97-M143 HydrophobicContact CD1-CE 3.87Å; Y97-M143 HydrophobicContact CE1-CE 3.18Å; F139-M143 HydrophobicContact CD1-CG 4.3Å; F139-M143 HydrophobicContact CE1-CG 3.85Å; F139-M143 HydrophobicContact CE2-CG 4.11Å; F139-M143 HydrophobicContact CE2-SD 4.27Å; F139-M143 HydrophobicContact CZ-CG 3.74Å; F139-M143 HydrophobicContact CZ-SD 4Å; F139-M143 WeakPolarHBondContact O-CG 3.47Å; F139-M143 PolarHBondContact O-N 3.09Å; D141-M143 VanDerWaalsContact C-N 3.31Å; D141-M143 PolarHBondContact O-N 2.91Å; M143-Q146 VanDerWaalsContact O-CG 3.28Å; M143-Q146 WeakPolarHBondContact O-CG 3.34Å; M143-Q146 PolarHBondContact O-NE2 2.9Å; M143-Q146 VanDerWaalsContact O-NE2 3.1Å; M143-Q146 PolarHBondContact SD-NE2 2.95Å; M143-Q146 VanDerWaalsContact SD-NE2 3.38Å; M143-F268 HydrophobicContact CG-CE1 4.32Å; M143-F268 HydrophobicContact SD-CD1 4.25Å; M143-F268 HydrophobicContact SD-CE1 3.43Å; M143-F268 WeakPolarHBondContact SD-CE1 3.29Å; M143-F268 HydrophobicContact SD-CZ 4.09Å; M143-I337 HydrophobicContact CE-CG2 4.31Å; M143-I337 HydrophobicContact SD-CG2 4.12Å |
| 144 | R | 88.9 | Confident | 88.1 | Confident | 121 Ų | 121 | 55.5 Ų | 55.5 | 46% | 0.457 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -80 | -45.5 | 176.4 | -72.5 | 175 | -72.9 | 147.6 | -4.6 | 112.4 | S140 D141 M142 Q146 L147 | S140-R144 WeakPolarHBondContact O-CG 3.47Å; S140-R144 PolarHBondContact O-N 3.38Å; S140-R144 VanDerWaalsContact O-N 3.13Å; S140-R144 PolarHBondContact O-NE 3.3Å; D141-R144 PolarHBondContact O-N 3.25Å; D141-R144 IonicContact OD1-NH2 3.8Å; M142-R144 VanDerWaalsContact C-N 3.31Å; M142-R144 PolarHBondContact O-N 3.49Å; R144-Q146 VanDerWaalsContact C-N 3.34Å; R144-Q146 PolarHBondContact O-N 2.65Å; R144-L147 WeakPolarHBondContact O-CB 3.48Å; R144-L147 PolarHBondContact O-N 3.06Å |
| 145 | S | 89.2 | Confident | 88.1 | Confident | 21 Ų | 21 | 54.1 Ų | 54.1 | 15% | 0.147 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -69.5 | -28.5 | -173.1 | 63.7 | 0 | 0 | 0 | 0 | 112.9 | D141 M142 L147 R148 | D141-S145 WeakPolarHBondContact O-CB 3.39Å; D141-S145 PolarHBondContact O-N 2.72Å; D141-S145 PolarHBondContact O-OG 3.37Å; M142-S145 WeakPolarHBondContact CA-OG 3.46Å; M142-S145 PolarHBondContact O-N 3.46Å; M142-S145 PolarHBondContact O-OG 3.37Å; S145-L147 PolarHBondContact O-N 3.03Å; S145-L147 VanDerWaalsContact O-N 3.08Å; S145-R148 WeakPolarHBondContact O-CB 3.39Å; S145-R148 PolarHBondContact O-N 2.93Å |
| 146 | Q | 89.9 | Confident | 88.1 | Confident | 15 Ų | 15 | 55.5 Ų | 55.5 | 7% | 0.07 | 28% | 0.281 | C | S | . | . | G | 310 helix | trans | -58.3 | -22.5 | 173.8 | 70.7 | -178.9 | -46.7 | 0 | 0 | 113.1 | M142 M143 R144 R148 T150 F268 A304 A305 | M142-Q146 PolarHBondContact O-N 3.23Å; M142-Q146 VanDerWaalsContact O-N 3.14Å; M143-Q146 VanDerWaalsContact O-CG 3.28Å; M143-Q146 WeakPolarHBondContact O-CG 3.34Å; M143-Q146 PolarHBondContact O-NE2 2.9Å; M143-Q146 VanDerWaalsContact O-NE2 3.1Å; M143-Q146 PolarHBondContact SD-NE2 2.95Å; M143-Q146 VanDerWaalsContact SD-NE2 3.38Å; R144-Q146 VanDerWaalsContact C-N 3.34Å; R144-Q146 PolarHBondContact O-N 2.65Å; Q146-R148 VanDerWaalsContact C-N 3.33Å; Q146-T150 PolarHBondContact O-OG1 3.33Å; Q146-F268 HydrophobicContact CB-CE2 4.38Å; Q146-A304 HydrophobicContact CB-CB 4.47Å; Q146-A305 VanDerWaalsContact OE1-CB 3.28Å; Q146-A305 VanDerWaalsContact OE1-N 3.09Å |
| 147 | L | 87.2 | Confident | 88.1 | Confident | 87 Ų | 87 | 56.7 Ų | 56.7 | 46% | 0.455 | 29% | 0.291 | S | S | . | . | G | 310 helix | trans | -76.8 | -17.9 | 178.4 | -56.7 | 177.6 | 0 | 0 | 0 | 113.2 | R144 S145 F149 L303 | R144-L147 WeakPolarHBondContact O-CB 3.48Å; R144-L147 PolarHBondContact O-N 3.06Å; S145-L147 PolarHBondContact O-N 3.03Å; S145-L147 VanDerWaalsContact O-N 3.08Å; L147-F149 VanDerWaalsContact C-N 3.31Å; L147-F149 PolarHBondContact O-N 2.96Å; L147-L303 HydrophobicContact CD2-CD1 3.81Å; L147-L303 HydrophobicContact CD2-CD2 3.76Å; L147-L303 HydrophobicContact CD2-CG 4.47Å |
| 148 | R | 82.2 | Confident | 87.9 | Confident | 167 Ų | 167 | 64.4 Ų | 64.4 | 63% | 0.63 | 32% | 0.315 | S | S | * | . | G | 310 helix | trans | -72.6 | -22.2 | -171 | -66.2 | -177.4 | 178.3 | -179 | 3 | 113.8 | S145 Q146 | S145-R148 WeakPolarHBondContact O-CB 3.39Å; S145-R148 PolarHBondContact O-N 2.93Å; Q146-R148 VanDerWaalsContact C-N 3.33Å |
| 149 | F | 74.1 | Confident | 87.7 | Confident | 39 Ų | 39 | 64.5 Ų | 64.5 | 17% | 0.171 | 32% | 0.32 | C | S | . | . | G | 310 helix | trans | -131.4 | 25.8 | -172.7 | -50.2 | -65.7 | 0 | 0 | 0 | 113.9 | L147 E259 S261 | L147-F149 VanDerWaalsContact C-N 3.31Å; L147-F149 PolarHBondContact O-N 2.96Å; F149-E259 HydrophobicContact CE1-CG 4.04Å; F149-E259 VanDerWaalsContact CE1-OE1 3.25Å; F149-E259 WeakPolarHBondContact CE1-OE1 3.37Å; F149-E259 VanDerWaalsContact CE1-OE2 3.31Å; F149-E259 WeakPolarHBondContact CE1-OE2 3.33Å; F149-E259 HydrophobicContact CZ-CG 3.73Å; F149-E259 WeakPolarHBondContact CZ-OE1 3.16Å; F149-S261 WeakPolarHBondContact CE2-O 3.38Å; F149-S261 WeakPolarHBondContact CE2-OG 3.29Å |
| 150 | T | 80.3 | Confident | 87.7 | Confident | 53 Ų | 53 | 65.1 Ų | 65.1 | 33% | 0.325 | 32% | 0.323 | S | S | . | . | trans | -69.8 | 129.4 | 171.2 | -48.6 | 0 | 0 | 0 | 0 | 109.5 | Q146 V301 L303 | Q146-T150 PolarHBondContact O-OG1 3.33Å; T150-V301 VanDerWaalsContact CG2-O 3.26Å; T150-V301 WeakPolarHBondContact CG2-O 3.46Å; T150-L303 HydrophobicContact CG2-CD2 4.22Å; T150-L303 VanDerWaalsContact OG1-CD2 3.31Å; T150-L303 WeakPolarHBondContact OG1-CD2 3.48Å | ||
| 151 | F | 85.4 | Confident | 87.8 | Confident | 28 Ų | 28 | 67.9 Ų | 67.9 | 12% | 0.123 | 34% | 0.339 | C | S | . | . | trans | -75.9 | 137.2 | 176.3 | -69.4 | -96.2 | 0 | 0 | 0 | 110.2 | N153 N194 R195 H198 V300 | F151-N153 WeakPolarHBondContact CB-O 3.37Å; F151-N153 PolarHBondContact O-N 3.49Å; F151-N194 HydrophobicContact CE2-CB 4.07Å; F151-N194 HydrophobicContact CZ-CB 3.77Å; F151-R195 HydrophobicContact CZ-CB 4.5Å; F151-R195 HydrophobicContact CZ-CG 3.8Å; F151-H198 AromaticContact CD1-CE1 3.85Å; F151-H198 AromaticContact CE1-CE1 3.73Å; F151-H198 AromaticContact CE1-ND1 3.5Å; F151-H198 WeakPolarHBondContact CE1-ND1 3.18Å; F151-V300 HydrophobicContact CB-CG2 4.18Å; F151-V300 HydrophobicContact CD2-CB 3.96Å; F151-V300 HydrophobicContact CD2-CG2 4.31Å; F151-V300 WeakPolarHBondContact CD2-O 3.31Å; F151-V300 HydrophobicContact CE2-CB 4.49Å; F151-V300 HydrophobicContact CG-CB 4.43Å; F151-V300 HydrophobicContact CG-CG2 4.28Å | ||
| 152 | P | 84.9 | Confident | 88 | Confident | 128 Ų | 128 | 69.2 Ų | 69.2 | 83% | 0.831 | 34% | 0.34 | S | S | * | . | S | Bend | trans | -67.3 | -27.1 | -179.5 | 27.5 | -35 | 0 | 0 | 0 | 112.5 | ||
| 153 | N | 89.6 | Confident | 88.1 | Confident | 69 Ų | 69 | 73 Ų | 73 | 37% | 0.369 | 36% | 0.364 | S | S | . | . | trans | -151 | 172.4 | 173.9 | 61.9 | 53.6 | 0 | 0 | 0 | 109.3 | F151 D155 | F151-N153 WeakPolarHBondContact CB-O 3.37Å; F151-N153 PolarHBondContact O-N 3.49Å; N153-D155 VanDerWaalsContact C-N 3.34Å; N153-D155 VanDerWaalsContact OD1-CB 3.29Å; N153-D155 WeakPolarHBondContact OD1-CB 3.19Å; N153-D155 PolarHBondContact OD1-N 3.38Å | ||
| 154 | A | 90.8 | Very high | 88.3 | Confident | 15 Ų | 15 | 74.3 Ų | 74.3 | 12% | 0.124 | 37% | 0.373 | C | S | . | . | trans | -90.7 | 1.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113 | L156 Y162 V300 V301 | A154-L156 PolarHBondContact O-N 3.16Å; A154-Y162 VanDerWaalsContact C-OH 3.27Å; A154-Y162 HydrophobicContact CB-CE1 4.46Å; A154-Y162 WeakPolarHBondContact CB-OH 3.39Å; A154-Y162 VanDerWaalsContact O-CE1 3.25Å; A154-Y162 WeakPolarHBondContact O-CE1 3.42Å; A154-Y162 PolarHBondContact O-OH 3.37Å; A154-V300 HydrophobicContact CB-CG2 4.21Å; A154-V301 HydrophobicContact CB-CG1 3.98Å | ||
| 155 | D | 91.4 | Very high | 88.6 | Confident | 106 Ų | 106 | 68.8 Ų | 68.8 | 57% | 0.567 | 35% | 0.352 | S | S | * | . | P | Polyproline II helix | trans | -68.1 | 126.3 | -167.3 | -62.4 | -29.6 | 0 | 0 | 0 | 111.2 | N153 H198 | N153-D155 VanDerWaalsContact C-N 3.34Å; N153-D155 VanDerWaalsContact OD1-CB 3.29Å; N153-D155 WeakPolarHBondContact OD1-CB 3.19Å; N153-D155 PolarHBondContact OD1-N 3.38Å; D155-H198 PolarHBondContact O-NE2 2.88Å; D155-H198 VanDerWaalsContact O-NE2 3.07Å |
| 156 | L | 90.5 | Very high | 88.9 | Confident | 29 Ų | 29 | 68 Ų | 68 | 15% | 0.152 | 35% | 0.347 | C | S | . | . | P | Polyproline II helix | trans | -87.1 | 136.4 | 175.9 | -70.7 | 170.8 | 0 | 0 | 0 | 110.8 | A154 F160 T161 Y162 R165 L197 | A154-L156 PolarHBondContact O-N 3.16Å; L156-F160 HydrophobicContact CB-CB 4.27Å; L156-T161 VanDerWaalsContact CD1-C 3.44Å; L156-Y162 HydrophobicContact CD1-CD1 3.56Å; L156-Y162 HydrophobicContact CD1-CE1 4.01Å; L156-Y162 HydrophobicContact CD1-CG 4.34Å; L156-Y162 HydrophobicContact CG-CD1 4.21Å; L156-Y162 HydrophobicContact CG-CE1 4.13Å; L156-R165 HydrophobicContact CD1-CB 4.12Å; L156-L197 HydrophobicContact CD2-CD1 3.97Å |
| 157 | P | 89.4 | Confident | 89.2 | Confident | 46 Ų | 46 | 72 Ų | 72 | 30% | 0.299 | 37% | 0.368 | S | S | . | . | P | Polyproline II helix | trans | -67.8 | 140.3 | 175.6 | 24.6 | -28.8 | 0 | 0 | 0 | 110.7 | F160 L197 | P157-F160 HydrophobicContact CG-CD2 4.07Å; P157-F160 HydrophobicContact CG-CE2 4.49Å; P157-F160 WeakPolarHBondContact O-CB 3.38Å; P157-F160 VanDerWaalsContact O-CD2 3.25Å; P157-F160 WeakPolarHBondContact O-CD2 3.42Å; P157-F160 PolarHBondContact O-N 2.76Å; P157-L197 WeakPolarHBondContact CG-O 3.29Å |
| 158 | R | 86.9 | Confident | 89.7 | Confident | 241 Ų | 241 | 68.5 Ų | 68.5 | 91% | 0.909 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | 139.5 | 175 | -67.2 | -172.5 | 179.9 | -169.5 | 0.6 | 110 | ||
| 159 | P | 88.3 | Confident | 90.4 | Very high | 75 Ų | 75 | 60.5 Ų | 60.5 | 49% | 0.487 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -93.9 | 12.9 | 11.1 | 38.3 | -37.5 | 0 | 0 | 0 | 114.9 | T204 | P159-T204 WeakPolarHBondContact CG-OG1 3.49Š|
| 160 | F | 91.1 | Very high | 91.6 | Very high | 17 Ų | 17 | 59.2 Ų | 59.2 | 8% | 0.075 | 31% | 0.314 | C | S | . | . | trans | -74.6 | 148.2 | -175 | -49 | -53.1 | 0 | 0 | 0 | 111.9 | L156 P157 L197 V202 L207 | L156-F160 HydrophobicContact CB-CB 4.27Å; P157-F160 HydrophobicContact CG-CD2 4.07Å; P157-F160 HydrophobicContact CG-CE2 4.49Å; P157-F160 WeakPolarHBondContact O-CB 3.38Å; P157-F160 VanDerWaalsContact O-CD2 3.25Å; P157-F160 WeakPolarHBondContact O-CD2 3.42Å; P157-F160 PolarHBondContact O-N 2.76Å; F160-L197 HydrophobicContact CD1-CD2 4.44Å; F160-L197 HydrophobicContact CD2-CB 4.47Å; F160-L197 HydrophobicContact CD2-CD2 3.86Å; F160-L197 HydrophobicContact CE1-CD2 4.42Å; F160-L197 HydrophobicContact CE2-CD2 3.82Å; F160-L197 HydrophobicContact CG-CD2 4.18Å; F160-L197 HydrophobicContact CZ-CD2 4.11Å; F160-V202 HydrophobicContact CZ-CB 4.45Å; F160-V202 VanDerWaalsContact CZ-O 3.3Å; F160-V202 WeakPolarHBondContact CZ-O 3.42Å; F160-L207 HydrophobicContact CD1-CD2 4.47Å; F160-L207 HydrophobicContact CE1-CD1 4.22Å | ||
| 161 | T | 93.4 | Very high | 92.4 | Very high | 66 Ų | 66 | 59.4 Ų | 59.4 | 41% | 0.405 | 31% | 0.309 | S | S | . | . | trans | -131.7 | 158.9 | 179.5 | 65.1 | 0 | 0 | 0 | 0 | 109.8 | L156 T163 T164 R165 | L156-T161 VanDerWaalsContact CD1-C 3.44Å; T161-T163 PolarHBondContact O-N 3.46Å; T161-T164 PolarHBondContact N-OG1 3.24Å; T161-T164 PolarHBondContact O-N 2.91Å; T161-T164 PolarHBondContact O-OG1 3.2Å; T161-T164 WeakPolarHBondContact OG1-CG2 3.27Å; T161-T164 PolarHBondContact OG1-N 3.3Å; T161-T164 VanDerWaalsContact OG1-N 3.15Å; T161-T164 PolarHBondContact OG1-OG1 3.41Å; T161-R165 PolarHBondContact O-N 2.87Å | ||
| 162 | Y | 93.6 | Very high | 93 | Very high | 98 Ų | 98 | 58 Ų | 58 | 38% | 0.384 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -57.8 | -35.6 | 175.1 | -66.1 | -49.8 | 0 | 0 | 0 | 112.3 | A154 L156 R165 A166 | A154-Y162 VanDerWaalsContact C-OH 3.27Å; A154-Y162 HydrophobicContact CB-CE1 4.46Å; A154-Y162 WeakPolarHBondContact CB-OH 3.39Å; A154-Y162 VanDerWaalsContact O-CE1 3.25Å; A154-Y162 WeakPolarHBondContact O-CE1 3.42Å; A154-Y162 PolarHBondContact O-OH 3.37Å; L156-Y162 HydrophobicContact CD1-CD1 3.56Å; L156-Y162 HydrophobicContact CD1-CE1 4.01Å; L156-Y162 HydrophobicContact CD1-CG 4.34Å; L156-Y162 HydrophobicContact CG-CD1 4.21Å; L156-Y162 HydrophobicContact CG-CE1 4.13Å; Y162-R165 PolarHBondContact O-N 3.22Å; Y162-A166 VanDerWaalsContact O-CB 3.28Å; Y162-A166 WeakPolarHBondContact O-CB 3.48Å; Y162-A166 PolarHBondContact O-N 3.32Å |
| 163 | T | 93.3 | Very high | 93.7 | Very high | 98 Ų | 98 | 52 Ų | 52 | 60% | 0.601 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -64 | -49.9 | 176.7 | -47.5 | 0 | 0 | 0 | 0 | 112 | T161 R165 A166 I167 | T161-T163 PolarHBondContact O-N 3.46Å; T163-R165 VanDerWaalsContact C-N 3.29Å; T163-R165 PolarHBondContact O-N 3.37Å; T163-A166 PolarHBondContact O-N 3.48Å; T163-I167 HydrophobicContact CG2-CD1 4.11Å; T163-I167 WeakPolarHBondContact O-CG1 3.42Å; T163-I167 PolarHBondContact O-N 3.16Å |
| 164 | T | 93.3 | Very high | 94.1 | Very high | 41 Ų | 41 | 53.1 Ų | 53.1 | 25% | 0.252 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.4 | -36.1 | 179.1 | 49.3 | 0 | 0 | 0 | 0 | 111.8 | T161 L168 | T161-T164 PolarHBondContact N-OG1 3.24Å; T161-T164 PolarHBondContact O-N 2.91Å; T161-T164 PolarHBondContact O-OG1 3.2Å; T161-T164 WeakPolarHBondContact OG1-CG2 3.27Å; T161-T164 PolarHBondContact OG1-N 3.3Å; T161-T164 VanDerWaalsContact OG1-N 3.15Å; T161-T164 PolarHBondContact OG1-OG1 3.41Å; T164-L168 PolarHBondContact O-N 2.93Å; T164-L168 VanDerWaalsContact O-N 3.14Å |
| 165 | R | 95.4 | Very high | 94.4 | Very high | 6 Ų | 6 | 52.7 Ų | 52.7 | 2% | 0.023 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.4 | -45.9 | 172.8 | -162 | -165.2 | 72 | 63 | -15.4 | 112.1 | L156 T161 Y162 T163 L168 V169 L197 L294 L295 E296 | L156-R165 HydrophobicContact CD1-CB 4.12Å; T161-R165 PolarHBondContact O-N 2.87Å; Y162-R165 PolarHBondContact O-N 3.22Å; T163-R165 VanDerWaalsContact C-N 3.29Å; T163-R165 PolarHBondContact O-N 3.37Å; R165-L168 PolarHBondContact O-N 2.99Å; R165-V169 PolarHBondContact O-N 3.06Å; R165-L197 HydrophobicContact CG-CD1 4.05Å; R165-L294 VanDerWaalsContact CZ-O 3.28Å; R165-L294 PolarHBondContact NH1-O 3.31Å; R165-L294 PolarHBondContact NH2-O 3.41Å; R165-L295 VanDerWaalsContact NH2-C 3.32Å; R165-L295 PolarHBondContact NH2-O 2.89Å; R165-E296 VanDerWaalsContact NH2-C 3.34Å |
| 166 | A | 96.1 | Very high | 94.7 | Very high | 5 Ų | 5 | 47.7 Ų | 47.7 | 4% | 0.041 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64 | -41.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y162 T163 V169 D170 | Y162-A166 VanDerWaalsContact O-CB 3.28Å; Y162-A166 WeakPolarHBondContact O-CB 3.48Å; Y162-A166 PolarHBondContact O-N 3.32Å; T163-A166 PolarHBondContact O-N 3.48Å; A166-V169 PolarHBondContact O-N 3.08Å; A166-D170 WeakPolarHBondContact O-CB 3.41Å; A166-D170 PolarHBondContact O-N 3.09Å |
| 167 | I | 96.4 | Very high | 95 | Very high | 98 Ų | 98 | 49.7 Ų | 49.7 | 50% | 0.503 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -60.8 | -45.7 | 174.5 | -67.3 | 165.1 | 0 | 0 | 0 | 110.6 | T163 W171 T364 | T163-I167 HydrophobicContact CG2-CD1 4.11Å; T163-I167 WeakPolarHBondContact O-CG1 3.42Å; T163-I167 PolarHBondContact O-N 3.16Å; I167-W171 PolarHBondContact O-N 2.82Å; I167-T364 HydrophobicContact CG1-CG2 4.25Å |
| 168 | L | 96.9 | Very high | 95.3 | Very high | 13 Ų | 13 | 51.2 Ų | 51.2 | 7% | 0.068 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62.5 | -46.5 | 177.7 | 178.4 | 65.3 | 0 | 0 | 0 | 111.5 | T164 R165 W171 L172 L193 L207 | T164-L168 PolarHBondContact O-N 2.93Å; T164-L168 VanDerWaalsContact O-N 3.14Å; R165-L168 PolarHBondContact O-N 2.99Å; L168-W171 HydrophobicContact CD1-CE3 4.06Å; L168-W171 HydrophobicContact CD1-CZ3 4.47Å; L168-W171 PolarHBondContact O-N 3.23Å; L168-L172 HydrophobicContact CD1-CG 4.4Å; L168-L172 HydrophobicContact CG-CD1 4.16Å; L168-L172 HydrophobicContact CG-CG 4.4Å; L168-L172 WeakPolarHBondContact O-CG 3.18Å; L168-L172 PolarHBondContact O-N 2.87Å; L168-L193 HydrophobicContact CD2-CD1 3.85Å; L168-L193 HydrophobicContact CD2-CD2 3.74Å; L168-L193 HydrophobicContact CD2-CG 4.44Å; L168-L193 HydrophobicContact CG-CD2 4.41Å; L168-L207 HydrophobicContact CD2-CD1 3.75Å; L168-L207 HydrophobicContact CD2-CD2 4.28Å; L168-L207 HydrophobicContact CD2-CG 3.58Å |
| 169 | V | 98.3 | Very high | 95.7 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -66.5 | -40.1 | -179 | 169 | 0 | 0 | 0 | 0 | 111.7 | R165 A166 W171 L172 I173 V190 L193 L294 | R165-V169 PolarHBondContact O-N 3.06Å; A166-V169 PolarHBondContact O-N 3.08Å; V169-W171 VanDerWaalsContact C-N 3.31Å; V169-W171 PolarHBondContact O-N 3.05Å; V169-L172 PolarHBondContact O-N 3.43Å; V169-L172 VanDerWaalsContact O-N 3.14Å; V169-I173 HydrophobicContact CG1-CD1 4.15Å; V169-I173 HydrophobicContact CG1-CG1 4.49Å; V169-I173 VanDerWaalsContact O-CG1 3.3Å; V169-I173 WeakPolarHBondContact O-CG1 3.48Å; V169-I173 PolarHBondContact O-N 3.36Å; V169-V190 HydrophobicContact CG1-CG2 3.96Å; V169-V190 HydrophobicContact CG2-CG1 4.22Å; V169-V190 HydrophobicContact CG2-CG2 4.19Å; V169-L193 HydrophobicContact CG2-CD2 3.81Å; V169-L294 HydrophobicContact CG1-CB 4.12Å |
| 170 | D | 98.1 | Very high | 96.1 | Very high | 12 Ų | 12 | 44.8 Ų | 44.8 | 6% | 0.064 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -57.2 | -45.5 | 173.1 | -174.5 | 87.2 | 0 | 0 | 0 | 111.8 | A166 I173 Q174 L295 T364 R365 A366 | A166-D170 WeakPolarHBondContact O-CB 3.41Å; A166-D170 PolarHBondContact O-N 3.09Å; D170-I173 WeakPolarHBondContact O-CB 3.37Å; D170-I173 PolarHBondContact O-N 3.41Å; D170-Q174 WeakPolarHBondContact O-CG 3.45Å; D170-Q174 PolarHBondContact O-N 3.48Å; D170-Q174 PolarHBondContact OD2-NE2 2.92Å; D170-L295 HydrophobicContact CB-CD2 4.05Å; D170-T364 HydrophobicContact CB-CG2 3.73Å; D170-T364 VanDerWaalsContact CG-CA 3.49Å; D170-T364 VanDerWaalsContact OD1-CA 3.22Å; D170-T364 WeakPolarHBondContact OD1-CA 3.48Å; D170-T364 WeakPolarHBondContact OD1-CB 3.1Å; D170-R365 PolarHBondContact OD1-N 3.25Å; D170-A366 WeakPolarHBondContact O-CB 3.35Å; D170-A366 VanDerWaalsContact OD1-CB 3.24Å; D170-A366 WeakPolarHBondContact OD1-CB 3.44Å; D170-A366 PolarHBondContact OD1-N 3.46Å |
| 171 | W | 97.5 | Very high | 96.4 | Very high | 56 Ų | 56 | 44.8 Ų | 44.8 | 21% | 0.212 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.6 | -39.7 | 174.9 | 178.1 | 77 | 0 | 0 | 0 | 112.6 | I167 L168 V169 I173 Q174 V175 Q208 V212 M236 | I167-W171 PolarHBondContact O-N 2.82Å; L168-W171 HydrophobicContact CD1-CE3 4.06Å; L168-W171 HydrophobicContact CD1-CZ3 4.47Å; L168-W171 PolarHBondContact O-N 3.23Å; V169-W171 VanDerWaalsContact C-N 3.31Å; V169-W171 PolarHBondContact O-N 3.05Å; W171-I173 VanDerWaalsContact C-N 3.27Å; W171-I173 PolarHBondContact O-N 3.06Å; W171-Q174 WeakPolarHBondContact O-CB 3.47Å; W171-Q174 PolarHBondContact O-N 3.13Å; W171-Q174 VanDerWaalsContact O-N 3.1Å; W171-V175 HydrophobicContact CD2-CG2 3.98Å; W171-V175 HydrophobicContact CE3-CG2 4.23Å; W171-V175 HydrophobicContact CH2-CG2 3.88Å; W171-V175 HydrophobicContact CZ2-CG2 3.58Å; W171-V175 HydrophobicContact CZ3-CG2 4.18Å; W171-V175 WeakPolarHBondContact O-CG2 3.34Å; W171-V175 PolarHBondContact O-N 3.21Å; W171-Q208 HydrophobicContact CE3-CG 4.2Å; W171-Q208 HydrophobicContact CH2-CG 3.56Å; W171-Q208 HydrophobicContact CZ2-CG 4.18Å; W171-Q208 HydrophobicContact CZ3-CG 3.57Å; W171-V212 HydrophobicContact CH2-CG2 3.31Å; W171-V212 HydrophobicContact CZ3-CG2 3.47Å; W171-V212 VanDerWaalsContact CZ3-CG2 3.47Å; W171-M236 HydrophobicContact CH2-CG 3.93Å; W171-M236 HydrophobicContact CZ2-CG 4.38Å |
| 172 | L | 98.5 | Very high | 96.5 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.2 | -33 | 175.3 | -72.1 | 174.2 | 0 | 0 | 0 | 112.5 | L168 V169 Q174 V175 H176 L193 L215 | L168-L172 HydrophobicContact CD1-CG 4.4Å; L168-L172 HydrophobicContact CG-CD1 4.16Å; L168-L172 HydrophobicContact CG-CG 4.4Å; L168-L172 WeakPolarHBondContact O-CG 3.18Å; L168-L172 PolarHBondContact O-N 2.87Å; V169-L172 PolarHBondContact O-N 3.43Å; V169-L172 VanDerWaalsContact O-N 3.14Å; L172-Q174 VanDerWaalsContact C-N 3.33Å; L172-V175 PolarHBondContact O-N 3.35Å; L172-H176 WeakPolarHBondContact O-CB 3.3Å; L172-H176 PolarHBondContact O-N 3.42Å; L172-L193 HydrophobicContact CD1-CD2 4Å; L172-L215 HydrophobicContact CD2-CB 4.42Å; L172-L215 HydrophobicContact CD2-CD2 4.42Å |
| 173 | I | 98.4 | Very high | 96.7 | Very high | 1 Ų | 1 | 40.3 Ų | 40.3 | 1% | 0.005 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64 | -41.1 | 173.1 | -67.1 | 169.2 | 0 | 0 | 0 | 110 | V169 D170 W171 H176 E177 L186 L295 A366 T367 | V169-I173 HydrophobicContact CG1-CD1 4.15Å; V169-I173 HydrophobicContact CG1-CG1 4.49Å; V169-I173 VanDerWaalsContact O-CG1 3.3Å; V169-I173 WeakPolarHBondContact O-CG1 3.48Å; V169-I173 PolarHBondContact O-N 3.36Å; D170-I173 WeakPolarHBondContact O-CB 3.37Å; D170-I173 PolarHBondContact O-N 3.41Å; W171-I173 VanDerWaalsContact C-N 3.27Å; W171-I173 PolarHBondContact O-N 3.06Å; I173-H176 WeakPolarHBondContact O-CB 3.2Å; I173-H176 PolarHBondContact O-N 3.42Å; I173-E177 WeakPolarHBondContact O-CG 3.25Å; I173-E177 PolarHBondContact O-N 3.29Å; I173-L186 HydrophobicContact CG1-CD1 3.83Å; I173-L186 HydrophobicContact CG1-CD2 3.93Å; I173-L186 HydrophobicContact CG1-CG 4.49Å; I173-L295 HydrophobicContact CD1-CD1 4.16Å; I173-A366 HydrophobicContact CB-CB 4.07Å; I173-A366 HydrophobicContact CG2-CB 3.9Å; I173-T367 VanDerWaalsContact CD1-OG1 3.25Å; I173-T367 WeakPolarHBondContact CD1-OG1 3.39Å |
| 174 | Q | 97.6 | Very high | 96.8 | Very high | 93 Ų | 93 | 37.2 Ų | 37.2 | 44% | 0.435 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -64.1 | -44.3 | 175.5 | -59.2 | 172.8 | 42.8 | 0 | 0 | 111.6 | D170 W171 L172 H176 E177 V178 A366 | D170-Q174 WeakPolarHBondContact O-CG 3.45Å; D170-Q174 PolarHBondContact O-N 3.48Å; D170-Q174 PolarHBondContact OD2-NE2 2.92Å; W171-Q174 WeakPolarHBondContact O-CB 3.47Å; W171-Q174 PolarHBondContact O-N 3.13Å; W171-Q174 VanDerWaalsContact O-N 3.1Å; L172-Q174 VanDerWaalsContact C-N 3.33Å; Q174-H176 VanDerWaalsContact C-N 3.34Å; Q174-H176 PolarHBondContact O-N 3.2Å; Q174-E177 PolarHBondContact O-N 3.12Å; Q174-V178 WeakPolarHBondContact O-CG2 3.44Å; Q174-V178 PolarHBondContact O-N 2.91Å; Q174-A366 HydrophobicContact CG-CB 3.58Å |
| 175 | V | 97.3 | Very high | 97.1 | Very high | 6 Ų | 6 | 35.2 Ų | 35.2 | 4% | 0.036 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.5 | -41.1 | 176.9 | 174.3 | 0 | 0 | 0 | 0 | 111.6 | W171 L172 E177 V178 F179 L215 L235 | W171-V175 HydrophobicContact CD2-CG2 3.98Å; W171-V175 HydrophobicContact CE3-CG2 4.23Å; W171-V175 HydrophobicContact CH2-CG2 3.88Å; W171-V175 HydrophobicContact CZ2-CG2 3.58Å; W171-V175 HydrophobicContact CZ3-CG2 4.18Å; W171-V175 WeakPolarHBondContact O-CG2 3.34Å; W171-V175 PolarHBondContact O-N 3.21Å; L172-V175 PolarHBondContact O-N 3.35Å; V175-E177 VanDerWaalsContact C-N 3.34Å; V175-E177 PolarHBondContact O-N 3.48Å; V175-V178 PolarHBondContact O-N 3.14Å; V175-F179 HydrophobicContact CG1-CD2 3.86Å; V175-F179 HydrophobicContact CG1-CE2 3.77Å; V175-F179 WeakPolarHBondContact O-CD2 3.48Å; V175-F179 PolarHBondContact O-N 3.35Å; V175-L215 HydrophobicContact CB-CD2 4.2Å; V175-L215 HydrophobicContact CG1-CD2 3.65Å; V175-L235 HydrophobicContact CG1-CD1 3.89Å |
| 176 | H | 97.9 | Very high | 97.2 | Very high | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.005 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -57.4 | -45.1 | 174.5 | 163.8 | -91.4 | 0 | 0 | 0 | 111.7 | L172 I173 Q174 F179 H180 F181 S182 L186 L215 | L172-H176 WeakPolarHBondContact O-CB 3.3Å; L172-H176 PolarHBondContact O-N 3.42Å; I173-H176 WeakPolarHBondContact O-CB 3.2Å; I173-H176 PolarHBondContact O-N 3.42Å; Q174-H176 VanDerWaalsContact C-N 3.34Å; Q174-H176 PolarHBondContact O-N 3.2Å; H176-F179 PolarHBondContact O-N 3.39Å; H176-H180 PolarHBondContact O-N 2.81Å; H176-H180 VanDerWaalsContact O-N 3.16Å; H176-F181 VanDerWaalsContact CD2-CB 3.48Å; H176-F181 WeakPolarHBondContact CD2-CB 3.15Å; H176-F181 PolarHBondContact CE1-O 3.4Å; H176-F181 VanDerWaalsContact CE1-O 3.26Å; H176-F181 PolarHBondContact NE2-O 2.81Å; H176-F181 PolarHBondContact O-N 3.45Å; H176-S182 PolarHBondContact NE2-O 2.86Å; H176-L186 HydrophobicContact CB-CD1 4.28Å; H176-L215 HydrophobicContact CB-CD1 4.5Å |
| 177 | E | 96.3 | Very high | 97.3 | Very high | 71 Ų | 71 | 34.9 Ų | 34.9 | 33% | 0.332 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -67.1 | -36.8 | 176.9 | -69.7 | -70.8 | 117.3 | 0 | 0 | 112.7 | I173 Q174 V175 F179 H180 K370 | I173-E177 WeakPolarHBondContact O-CG 3.25Å; I173-E177 PolarHBondContact O-N 3.29Å; Q174-E177 PolarHBondContact O-N 3.12Å; V175-E177 VanDerWaalsContact C-N 3.34Å; V175-E177 PolarHBondContact O-N 3.48Å; E177-F179 VanDerWaalsContact C-N 3.3Å; E177-F179 PolarHBondContact O-N 2.83Å; E177-H180 PolarHBondContact O-CE1 3.17Å; E177-H180 PolarHBondContact O-N 2.78Å; E177-H180 VanDerWaalsContact O-N 3.14Å; E177-H180 PolarHBondContact O-ND1 3.22Å; E177-K370 HydrophobicContact CG-CD 4.17Å; E177-K370 WeakPolarHBondContact OE1-CD 3.49Å; E177-K370 WeakPolarHBondContact OE1-CE 3.42Å; E177-K370 IonicContact OE1-NZ 3.96Å; E177-K370 PolarHBondContact OE1-NZ 3.22Å |
| 178 | V | 95.9 | Very high | 97.4 | Very high | 78 Ų | 78 | 30.4 Ų | 30.4 | 47% | 0.473 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -61.8 | -38.2 | 177.1 | 167 | 0 | 0 | 0 | 0 | 111.8 | Q174 V175 H180 L235 | Q174-V178 WeakPolarHBondContact O-CG2 3.44Å; Q174-V178 PolarHBondContact O-N 2.91Å; V175-V178 PolarHBondContact O-N 3.14Å; V178-H180 VanDerWaalsContact C-N 3.33Å; V178-L235 HydrophobicContact CG1-CD2 4.37Å |
| 179 | F | 95.8 | Very high | 97.5 | Very high | 44 Ų | 44 | 29.8 Ų | 29.8 | 19% | 0.193 | 15% | 0.146 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -4.7 | 176.9 | -71.5 | -58.5 | 0 | 0 | 0 | 114.1 | V175 H176 E177 F181 P227 L232 L235 | V175-F179 HydrophobicContact CG1-CD2 3.86Å; V175-F179 HydrophobicContact CG1-CE2 3.77Å; V175-F179 WeakPolarHBondContact O-CD2 3.48Å; V175-F179 PolarHBondContact O-N 3.35Å; H176-F179 PolarHBondContact O-N 3.39Å; E177-F179 VanDerWaalsContact C-N 3.3Å; E177-F179 PolarHBondContact O-N 2.83Å; F179-F181 HydrophobicContact CB-CD1 3.96Å; F179-F181 HydrophobicContact CB-CD2 3.81Å; F179-F181 HydrophobicContact CB-CE1 3.79Å; F179-F181 HydrophobicContact CB-CE2 3.62Å; F179-F181 HydrophobicContact CB-CG 3.98Å; F179-F181 HydrophobicContact CB-CZ 3.61Å; F179-F181 AromaticContact CD2-CE2 3.79Å; F179-F181 HydrophobicContact CD2-CE2 3.79Å; F179-F181 HydrophobicContact CD2-CZ 4.1Å; F179-F181 HydrophobicContact CG-CE1 4.46Å; F179-F181 AromaticContact CG-CE2 3.95Å; F179-F181 HydrophobicContact CG-CE2 3.95Å; F179-F181 AromaticContact CG-CZ 3.89Å; F179-F181 HydrophobicContact CG-CZ 3.89Å; F179-F181 PolarHBondContact O-N 2.77Å; F179-P227 HydrophobicContact CD1-CB 3.98Å; F179-P227 HydrophobicContact CD1-CG 4.18Å; F179-P227 HydrophobicContact CE1-CB 3.45Å; F179-P227 VanDerWaalsContact CE1-CB 3.45Å; F179-P227 HydrophobicContact CE1-CG 3.9Å; F179-P227 HydrophobicContact CE2-CG 4.35Å; F179-P227 HydrophobicContact CZ-CB 3.83Å; F179-P227 HydrophobicContact CZ-CG 3.97Å; F179-L232 HydrophobicContact CE2-CD2 3.6Å; F179-L232 HydrophobicContact CZ-CD2 3.75Å; F179-L235 HydrophobicContact CD2-CD1 4.17Å; F179-L235 HydrophobicContact CE1-CD1 4.22Å; F179-L235 HydrophobicContact CE2-CD1 3.14Å; F179-L235 HydrophobicContact CZ-CD1 3.17Å; F179-L235 HydrophobicContact CZ-CG 4.31Å |
| 180 | H | 96.1 | Very high | 97.4 | Very high | 137 Ų | 137 | 29.9 Ų | 29.9 | 63% | 0.634 | 15% | 0.146 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 54.1 | 36.9 | -176.4 | -53.9 | -57.1 | 0 | 0 | 0 | 113.4 | H176 E177 V178 | H176-H180 PolarHBondContact O-N 2.81Å; H176-H180 VanDerWaalsContact O-N 3.16Å; E177-H180 PolarHBondContact O-CE1 3.17Å; E177-H180 PolarHBondContact O-N 2.78Å; E177-H180 VanDerWaalsContact O-N 3.14Å; E177-H180 PolarHBondContact O-ND1 3.22Å; V178-H180 VanDerWaalsContact C-N 3.33Å |
| 181 | F | 97.7 | Very high | 97.4 | Very high | 17 Ų | 17 | 30 Ų | 30 | 8% | 0.075 | 15% | 0.146 | C | C | . | . | trans | -69.1 | 158.5 | 175.1 | -68.4 | -30.8 | 0 | 0 | 0 | 111.5 | H176 F179 T185 L215 A219 E223 P227 | H176-F181 VanDerWaalsContact CD2-CB 3.48Å; H176-F181 WeakPolarHBondContact CD2-CB 3.15Å; H176-F181 PolarHBondContact CE1-O 3.4Å; H176-F181 VanDerWaalsContact CE1-O 3.26Å; H176-F181 PolarHBondContact NE2-O 2.81Å; H176-F181 PolarHBondContact O-N 3.45Å; F179-F181 HydrophobicContact CB-CD1 3.96Å; F179-F181 HydrophobicContact CB-CD2 3.81Å; F179-F181 HydrophobicContact CB-CE1 3.79Å; F179-F181 HydrophobicContact CB-CE2 3.62Å; F179-F181 HydrophobicContact CB-CG 3.98Å; F179-F181 HydrophobicContact CB-CZ 3.61Å; F179-F181 AromaticContact CD2-CE2 3.79Å; F179-F181 HydrophobicContact CD2-CE2 3.79Å; F179-F181 HydrophobicContact CD2-CZ 4.1Å; F179-F181 HydrophobicContact CG-CE1 4.46Å; F179-F181 AromaticContact CG-CE2 3.95Å; F179-F181 HydrophobicContact CG-CE2 3.95Å; F179-F181 AromaticContact CG-CZ 3.89Å; F179-F181 HydrophobicContact CG-CZ 3.89Å; F179-F181 PolarHBondContact O-N 2.77Å; F181-T185 HydrophobicContact CB-CG2 3.93Å; F181-T185 HydrophobicContact CD2-CG2 3.96Å; F181-T185 HydrophobicContact CG-CG2 4.08Å; F181-L215 HydrophobicContact CD2-CD1 4.22Å; F181-L215 HydrophobicContact CD2-CG 4.4Å; F181-L215 HydrophobicContact CE2-CG 4.32Å; F181-A219 HydrophobicContact CD2-CB 4.29Å; F181-A219 HydrophobicContact CE1-CB 4.05Å; F181-A219 HydrophobicContact CE2-CB 3.8Å; F181-A219 HydrophobicContact CZ-CB 3.67Å; F181-E223 WeakPolarHBondContact CA-OE1 3.25Å; F181-E223 WeakPolarHBondContact CB-OE1 3.11Å; F181-E223 HydrophobicContact CD1-CG 3.62Å; F181-E223 HydrophobicContact CE1-CG 4.05Å; F181-E223 HydrophobicContact CG-CG 4.21Å; F181-P227 HydrophobicContact CZ-CG 3.95Å | ||
| 182 | S | 96.8 | Very high | 97.4 | Very high | 36 Ų | 36 | 27.3 Ų | 27.3 | 25% | 0.252 | 14% | 0.136 | S | C | . | . | trans | -65.5 | 157 | 176 | 97.4 | 0 | 0 | 0 | 0 | 111.7 | H176 E184 T185 E223 | H176-S182 PolarHBondContact NE2-O 2.86Å; S182-E184 WeakPolarHBondContact CB-OE2 3.32Å; S182-E184 PolarHBondContact O-N 3.01Å; S182-E184 PolarHBondContact OG-N 3.27Å; S182-E184 PolarHBondContact OG-OE2 2.73Å; S182-T185 WeakPolarHBondContact O-CB 3.25Å; S182-T185 PolarHBondContact O-N 3.22Å; S182-T185 PolarHBondContact OG-N 3.13Å; S182-E223 PolarHBondContact N-OE1 3.42Å | ||
| 183 | E | 96.9 | Very high | 97.3 | Very high | 33 Ų | 33 | 27.3 Ų | 27.3 | 15% | 0.154 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -62.1 | -35.5 | 178.1 | -60.6 | -176 | 110.9 | 0 | 0 | 110.8 | T185 L186 Y187 L266 R287 Y371 | E183-T185 VanDerWaalsContact C-N 3.3Å; E183-T185 PolarHBondContact O-N 3.37Å; E183-L186 WeakPolarHBondContact O-CB 3.1Å; E183-L186 PolarHBondContact O-N 3.41Å; E183-Y187 WeakPolarHBondContact O-CD2 3.39Å; E183-Y187 PolarHBondContact O-N 3.22Å; E183-Y187 VanDerWaalsContact O-N 3.09Å; E183-L266 HydrophobicContact CB-CD2 3.41Å; E183-L266 VanDerWaalsContact CB-CD2 3.41Å; E183-L266 HydrophobicContact CG-CD2 4.34Å; E183-R287 IonicContact OE1-NE 3.38Å; E183-R287 IonicContact OE2-NE 3.64Å; E183-R287 PolarHBondContact OE2-NE 3.1Å; E183-Y371 PolarHBondContact OE1-OH 3.08Å |
| 184 | E | 96.2 | Very high | 97.2 | Very high | 33 Ų | 33 | 28 Ų | 28 | 15% | 0.154 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -56.9 | -42.5 | 176.3 | -60.6 | 77.9 | -171.7 | 0 | 0 | 111.9 | S182 L186 Y187 L188 | S182-E184 WeakPolarHBondContact CB-OE2 3.32Å; S182-E184 PolarHBondContact O-N 3.01Å; S182-E184 PolarHBondContact OG-N 3.27Å; S182-E184 PolarHBondContact OG-OE2 2.73Å; E184-L186 VanDerWaalsContact C-N 3.3Å; E184-L186 PolarHBondContact O-N 2.95Å; E184-Y187 PolarHBondContact O-N 3.29Å; E184-L188 WeakPolarHBondContact O-CB 3.33Å; E184-L188 PolarHBondContact O-N 3.16Å |
| 185 | T | 98.3 | Very high | 97.1 | Very high | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -57.6 | -41.4 | 174.7 | -64.9 | 0 | 0 | 0 | 0 | 111.9 | F181 S182 E183 S189 L215 A218 A219 E222 E223 | F181-T185 HydrophobicContact CB-CG2 3.93Å; F181-T185 HydrophobicContact CD2-CG2 3.96Å; F181-T185 HydrophobicContact CG-CG2 4.08Å; S182-T185 WeakPolarHBondContact O-CB 3.25Å; S182-T185 PolarHBondContact O-N 3.22Å; S182-T185 PolarHBondContact OG-N 3.13Å; E183-T185 VanDerWaalsContact C-N 3.3Å; E183-T185 PolarHBondContact O-N 3.37Å; T185-S189 WeakPolarHBondContact O-CB 3.5Å; T185-S189 PolarHBondContact O-N 3.08Å; T185-L215 HydrophobicContact CG2-CD1 3.94Å; T185-A218 HydrophobicContact CG2-CB 4.06Å; T185-A218 VanDerWaalsContact O-CB 3.31Å; T185-A218 WeakPolarHBondContact O-CB 3.02Å; T185-A219 HydrophobicContact CG2-CB 4.01Å; T185-E222 WeakPolarHBondContact OG1-CB 3.38Å; T185-E223 WeakPolarHBondContact CB-OE1 3.45Å; T185-E223 PolarHBondContact OG1-OE1 3.49Å |
| 186 | L | 98.6 | Very high | 97 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -66.5 | -48.5 | 177.3 | 176.6 | 63 | 0 | 0 | 0 | 111.9 | I173 H176 E183 E184 L188 S189 V190 E291 L294 | I173-L186 HydrophobicContact CG1-CD1 3.83Å; I173-L186 HydrophobicContact CG1-CD2 3.93Å; I173-L186 HydrophobicContact CG1-CG 4.49Å; H176-L186 HydrophobicContact CB-CD1 4.28Å; E183-L186 WeakPolarHBondContact O-CB 3.1Å; E183-L186 PolarHBondContact O-N 3.41Å; E184-L186 VanDerWaalsContact C-N 3.3Å; E184-L186 PolarHBondContact O-N 2.95Å; L186-L188 VanDerWaalsContact C-N 3.34Å; L186-L188 PolarHBondContact O-N 3.49Å; L186-S189 WeakPolarHBondContact O-CB 3.48Å; L186-S189 PolarHBondContact O-N 3.45Å; L186-V190 HydrophobicContact CD1-CG2 4.2Å; L186-V190 WeakPolarHBondContact O-CG2 3.33Å; L186-V190 PolarHBondContact O-N 3.37Å; L186-E291 HydrophobicContact CD2-CG 4.1Å; L186-L294 HydrophobicContact CD2-CD1 4.03Å; L186-L294 HydrophobicContact CG-CD1 3.99Å |
| 187 | Y | 98.1 | Very high | 96.8 | Very high | 3 Ų | 3 | 24.1 Ų | 24.1 | 1% | 0.012 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -61 | -44.2 | 179.4 | -79.2 | -78.9 | 0 | 0 | 0 | 111.5 | E183 E184 H191 S264 P265 L266 L290 E291 L294 | E183-Y187 WeakPolarHBondContact O-CD2 3.39Å; E183-Y187 PolarHBondContact O-N 3.22Å; E183-Y187 VanDerWaalsContact O-N 3.09Å; E184-Y187 PolarHBondContact O-N 3.29Å; Y187-H191 WeakPolarHBondContact O-CB 3.36Å; Y187-H191 PolarHBondContact O-N 3.44Å; Y187-S264 WeakPolarHBondContact CB-OG 3.4Å; Y187-P265 HydrophobicContact CD1-CG 3.64Å; Y187-P265 HydrophobicContact CE1-CG 3.71Å; Y187-L266 HydrophobicContact CD2-CB 4.01Å; Y187-L266 HydrophobicContact CD2-CD2 4.32Å; Y187-L266 HydrophobicContact CE2-CB 3.89Å; Y187-L266 HydrophobicContact CE2-CD2 4.21Å; Y187-L266 HydrophobicContact CE2-CG 4.44Å; Y187-L290 HydrophobicContact CE1-CD2 4.19Å; Y187-L290 HydrophobicContact CE1-CG 4.05Å; Y187-L290 WeakPolarHBondContact OH-CD2 3.47Å; Y187-L290 VanDerWaalsContact OH-CG 3.29Å; Y187-L290 WeakPolarHBondContact OH-CG 3.47Å; Y187-E291 PolarHBondContact OH-N 3.49Å; Y187-L294 HydrophobicContact CD1-CD1 4.16Å; Y187-L294 HydrophobicContact CD1-CD2 3.72Å; Y187-L294 HydrophobicContact CD1-CG 4.33Å; Y187-L294 HydrophobicContact CE1-CD1 3.96Å; Y187-L294 HydrophobicContact CE1-CD2 3.78Å; Y187-L294 HydrophobicContact CE1-CG 4Å |
| 188 | L | 98 | Very high | 96.6 | Very high | 4 Ų | 4 | 24.3 Ų | 24.3 | 2% | 0.021 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -63 | -45.1 | 175 | 176 | 61.4 | 0 | 0 | 0 | 111.5 | E184 L186 V190 H191 L192 A218 K221 E222 L260 H262 | E184-L188 WeakPolarHBondContact O-CB 3.33Å; E184-L188 PolarHBondContact O-N 3.16Å; L186-L188 VanDerWaalsContact C-N 3.34Å; L186-L188 PolarHBondContact O-N 3.49Å; L188-V190 PolarHBondContact O-N 3.48Å; L188-H191 WeakPolarHBondContact O-CB 3.18Å; L188-H191 PolarHBondContact O-N 3.18Å; L188-L192 HydrophobicContact CD1-CD1 4.13Å; L188-L192 HydrophobicContact CD1-CD2 4.2Å; L188-L192 HydrophobicContact CD1-CG 3.93Å; L188-L192 HydrophobicContact CG-CD1 4.06Å; L188-L192 HydrophobicContact CG-CG 4.28Å; L188-L192 VanDerWaalsContact O-CG 3.27Å; L188-L192 WeakPolarHBondContact O-CG 3.35Å; L188-L192 PolarHBondContact O-N 3.32Å; L188-A218 HydrophobicContact CB-CB 3.96Å; L188-A218 HydrophobicContact CD2-CB 3.78Å; L188-A218 HydrophobicContact CG-CB 3.71Å; L188-K221 HydrophobicContact CD2-CB 4.13Å; L188-K221 HydrophobicContact CD2-CD 3.6Å; L188-K221 HydrophobicContact CD2-CG 4.43Å; L188-E222 HydrophobicContact CD2-CG 3.93Å; L188-L260 WeakPolarHBondContact CD1-O 3.2Å; L188-H262 HydrophobicContact CD1-CB 3.71Å |
| 189 | S | 98.5 | Very high | 96.4 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -54.9 | -50.1 | 177.5 | 174.9 | 0 | 0 | 0 | 0 | 112.4 | T185 L186 H191 L192 L193 L215 | T185-S189 WeakPolarHBondContact O-CB 3.5Å; T185-S189 PolarHBondContact O-N 3.08Å; L186-S189 WeakPolarHBondContact O-CB 3.48Å; L186-S189 PolarHBondContact O-N 3.45Å; S189-H191 VanDerWaalsContact C-N 3.34Å; S189-H191 PolarHBondContact O-N 3.06Å; S189-L192 PolarHBondContact O-N 3.03Å; S189-L193 WeakPolarHBondContact O-CB 3.4Å; S189-L193 PolarHBondContact O-N 3.28Å; S189-L215 WeakPolarHBondContact OG-CA 3.41Å; S189-L215 WeakPolarHBondContact OG-CB 3.44Å; S189-L215 PolarHBondContact OG-N 3.41Å |
| 190 | V | 97.9 | Very high | 96.2 | Very high | 2 Ų | 2 | 22.9 Ų | 22.9 | 1% | 0.012 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -67.8 | -36.1 | 179.9 | 177.1 | 0 | 0 | 0 | 0 | 111.2 | V169 L186 L188 L193 N194 L294 | V169-V190 HydrophobicContact CG1-CG2 3.96Å; V169-V190 HydrophobicContact CG2-CG1 4.22Å; V169-V190 HydrophobicContact CG2-CG2 4.19Å; L186-V190 HydrophobicContact CD1-CG2 4.2Å; L186-V190 WeakPolarHBondContact O-CG2 3.33Å; L186-V190 PolarHBondContact O-N 3.37Å; L188-V190 PolarHBondContact O-N 3.48Å; V190-L193 PolarHBondContact O-N 3.5Å; V190-N194 VanDerWaalsContact O-CG 3.25Å; V190-N194 PolarHBondContact O-N 3.1Å; V190-N194 PolarHBondContact O-ND2 3.38Å; V190-L294 HydrophobicContact CB-CD2 4.24Å; V190-L294 HydrophobicContact CG1-CB 4.43Å; V190-L294 HydrophobicContact CG1-CD2 4.06Å; V190-L294 HydrophobicContact CG2-CD1 4.35Å |
| 191 | H | 96.6 | Very high | 95.9 | Very high | 15 Ų | 15 | 25.5 Ų | 25.5 | 7% | 0.069 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -60.1 | -49.3 | 172.7 | 176.4 | 73.4 | 0 | 0 | 0 | 112.1 | Y187 L188 S189 L193 N194 R195 H262 | Y187-H191 WeakPolarHBondContact O-CB 3.36Å; Y187-H191 PolarHBondContact O-N 3.44Å; L188-H191 WeakPolarHBondContact O-CB 3.18Å; L188-H191 PolarHBondContact O-N 3.18Å; S189-H191 VanDerWaalsContact C-N 3.34Å; S189-H191 PolarHBondContact O-N 3.06Å; H191-L193 VanDerWaalsContact C-N 3.35Å; H191-L193 PolarHBondContact O-N 3.39Å; H191-N194 PolarHBondContact O-N 2.88Å; H191-R195 VanDerWaalsContact NE2-CD 3.33Å; H191-R195 WeakPolarHBondContact NE2-CD 3.34Å; H191-R195 PolarHBondContact O-N 3.26Å; H191-R195 VanDerWaalsContact O-N 3.12Å; H191-H262 HydrophobicContact CB-CB 4.47Å; H191-H262 AromaticContact CD2-CG 3.59Å; H191-H262 AromaticContact CD2-ND1 3.6Å; H191-H262 AromaticContact CE1-ND1 3.49Å; H191-H262 PolarHBondContact CE1-ND1 3.24Å; H191-H262 AromaticContact CG-CD2 3.88Å; H191-H262 AromaticContact CG-CE1 3.66Å; H191-H262 AromaticContact CG-CG 3.45Å; H191-H262 VanDerWaalsContact CG-CG 3.45Å; H191-H262 AromaticContact CG-ND1 3.3Å; H191-H262 VanDerWaalsContact CG-ND1 3.3Å; H191-H262 AromaticContact CG-NE2 3.99Å; H191-H262 AromaticContact ND1-CE1 3.43Å; H191-H262 PolarHBondContact ND1-CE1 3.15Å; H191-H262 AromaticContact ND1-CG 3.9Å; H191-H262 AromaticContact ND1-ND1 3.23Å; H191-H262 PolarHBondContact ND1-ND1 3.23Å; H191-H262 AromaticContact NE2-ND1 3.72Å |
| 192 | L | 97.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -61.1 | -44.1 | 177 | -65 | 177.4 | 0 | 0 | 0 | 111.1 | L188 S189 N194 R195 C196 C214 L217 A218 L256 L260 | L188-L192 HydrophobicContact CD1-CD1 4.13Å; L188-L192 HydrophobicContact CD1-CD2 4.2Å; L188-L192 HydrophobicContact CD1-CG 3.93Å; L188-L192 HydrophobicContact CG-CD1 4.06Å; L188-L192 HydrophobicContact CG-CG 4.28Å; L188-L192 VanDerWaalsContact O-CG 3.27Å; L188-L192 WeakPolarHBondContact O-CG 3.35Å; L188-L192 PolarHBondContact O-N 3.32Å; S189-L192 PolarHBondContact O-N 3.03Å; L192-N194 PolarHBondContact O-N 2.75Å; L192-R195 PolarHBondContact O-N 3.3Å; L192-C196 WeakPolarHBondContact O-CB 3.46Å; L192-C196 PolarHBondContact O-N 3.01Å; L192-C196 PolarHBondContact O-SG 3.17Å; L192-C214 HydrophobicContact CB-CB 4.13Å; L192-L217 HydrophobicContact CD1-CB 4.27Å; L192-A218 HydrophobicContact CD1-CB 4.47Å; L192-L256 HydrophobicContact CD2-CD1 3.74Å; L192-L260 HydrophobicContact CD1-CD2 4.2Å; L192-L260 HydrophobicContact CD2-CB 4.48Å; L192-L260 HydrophobicContact CD2-CD2 3.69Å |
| 193 | L | 97.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -55.7 | -50.2 | 175.4 | 174 | 64.6 | 0 | 0 | 0 | 111.3 | L168 V169 L172 S189 V190 H191 R195 C196 L197 L210 C214 | L168-L193 HydrophobicContact CD2-CD1 3.85Å; L168-L193 HydrophobicContact CD2-CD2 3.74Å; L168-L193 HydrophobicContact CD2-CG 4.44Å; L168-L193 HydrophobicContact CG-CD2 4.41Å; V169-L193 HydrophobicContact CG2-CD2 3.81Å; L172-L193 HydrophobicContact CD1-CD2 4Å; S189-L193 WeakPolarHBondContact O-CB 3.4Å; S189-L193 PolarHBondContact O-N 3.28Å; V190-L193 PolarHBondContact O-N 3.5Å; H191-L193 VanDerWaalsContact C-N 3.35Å; H191-L193 PolarHBondContact O-N 3.39Å; L193-R195 VanDerWaalsContact C-N 3.29Å; L193-R195 PolarHBondContact O-N 2.84Å; L193-C196 PolarHBondContact O-N 3.39Å; L193-C196 VanDerWaalsContact O-N 3.14Å; L193-L197 HydrophobicContact CD1-CD1 4.49Å; L193-L197 HydrophobicContact CD1-CD2 4.39Å; L193-L197 HydrophobicContact CD1-CG 4.23Å; L193-L197 HydrophobicContact CG-CD1 4.36Å; L193-L197 WeakPolarHBondContact O-CG 3.32Å; L193-L197 PolarHBondContact O-N 2.98Å; L193-L210 HydrophobicContact CD1-CD2 4.21Å; L193-L210 HydrophobicContact CD1-CG 4.25Å; L193-C214 HydrophobicContact CB-CB 4.29Å |
| 194 | N | 95.3 | Very high | 94.8 | Very high | 14 Ų | 14 | 30 Ų | 30 | 8% | 0.075 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -59.2 | -40.7 | 179.9 | -71.4 | -30.9 | 0 | 0 | 0 | 111.8 | F151 V190 H191 L192 H198 V300 | F151-N194 HydrophobicContact CE2-CB 4.07Å; F151-N194 HydrophobicContact CZ-CB 3.77Å; V190-N194 VanDerWaalsContact O-CG 3.25Å; V190-N194 PolarHBondContact O-N 3.1Å; V190-N194 PolarHBondContact O-ND2 3.38Å; H191-N194 PolarHBondContact O-N 2.88Å; L192-N194 PolarHBondContact O-N 2.75Å; N194-H198 PolarHBondContact O-ND1 3.38Å; N194-V300 WeakPolarHBondContact ND2-CG1 3.2Å |
| 195 | R | 95 | Very high | 94.6 | Very high | 15 Ų | 15 | 31.7 Ų | 31.7 | 6% | 0.057 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -65 | -45.3 | 174.5 | -69.9 | -179.7 | 63.7 | -170.9 | 2.7 | 111.6 | F151 H191 L192 L193 L197 H198 Q199 L256 E259 | F151-R195 HydrophobicContact CZ-CB 4.5Å; F151-R195 HydrophobicContact CZ-CG 3.8Å; H191-R195 VanDerWaalsContact NE2-CD 3.33Å; H191-R195 WeakPolarHBondContact NE2-CD 3.34Å; H191-R195 PolarHBondContact O-N 3.26Å; H191-R195 VanDerWaalsContact O-N 3.12Å; L192-R195 PolarHBondContact O-N 3.3Å; L193-R195 VanDerWaalsContact C-N 3.29Å; L193-R195 PolarHBondContact O-N 2.84Å; R195-L197 VanDerWaalsContact C-N 3.32Å; R195-L197 PolarHBondContact O-N 3.35Å; R195-H198 PolarHBondContact O-N 2.97Å; R195-H198 VanDerWaalsContact O-N 3.13Å; R195-Q199 WeakPolarHBondContact O-CG 3.39Å; R195-Q199 PolarHBondContact O-N 3.31Å; R195-Q199 VanDerWaalsContact O-N 3.16Å; R195-L256 HydrophobicContact CB-CD2 3.78Å; R195-E259 IonicContact CZ-OE2 3.89Å; R195-E259 PolarHBondContact NH1-O 2.93Å; R195-E259 IonicContact NH1-OE2 2.81Å; R195-E259 IonicContact NH2-OE2 3.04Å; R195-E259 PolarHBondContact NH2-OE2 2.93Å |
| 196 | C | 95.4 | Very high | 94.4 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.9 | -35.6 | -179.9 | -70.9 | 0 | 0 | 0 | 0 | 113.2 | L192 L193 H198 Q199 I200 L210 | L192-C196 WeakPolarHBondContact O-CB 3.46Å; L192-C196 PolarHBondContact O-N 3.01Å; L192-C196 PolarHBondContact O-SG 3.17Å; L193-C196 PolarHBondContact O-N 3.39Å; L193-C196 VanDerWaalsContact O-N 3.14Å; C196-H198 PolarHBondContact O-N 3.27Å; C196-Q199 PolarHBondContact O-N 2.9Å; C196-I200 HydrophobicContact CB-CD1 3.84Å; C196-I200 HydrophobicContact CB-CG1 4.16Å; C196-I200 WeakPolarHBondContact O-CA 3.43Å; C196-I200 VanDerWaalsContact O-CB 3.29Å; C196-I200 WeakPolarHBondContact O-CB 3.35Å; C196-I200 WeakPolarHBondContact O-CG1 3.31Å; C196-I200 PolarHBondContact O-N 3.35Å; C196-L210 HydrophobicContact CB-CD1 3.94Å; C196-L210 HydrophobicContact CB-CD2 4.08Å; C196-L210 HydrophobicContact CB-CG 4.35Å |
| 197 | L | 94.1 | Very high | 94.2 | Very high | 5 Ų | 5 | 37.5 Ų | 37.5 | 3% | 0.026 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59.4 | -30.8 | 176.6 | -69.4 | 175 | 0 | 0 | 0 | 112.3 | L156 P157 F160 R165 L193 R195 L207 L210 | L156-L197 HydrophobicContact CD2-CD1 3.97Å; P157-L197 WeakPolarHBondContact CG-O 3.29Å; F160-L197 HydrophobicContact CD1-CD2 4.44Å; F160-L197 HydrophobicContact CD2-CB 4.47Å; F160-L197 HydrophobicContact CD2-CD2 3.86Å; F160-L197 HydrophobicContact CE1-CD2 4.42Å; F160-L197 HydrophobicContact CE2-CD2 3.82Å; F160-L197 HydrophobicContact CG-CD2 4.18Å; F160-L197 HydrophobicContact CZ-CD2 4.11Å; R165-L197 HydrophobicContact CG-CD1 4.05Å; L193-L197 HydrophobicContact CD1-CD1 4.49Å; L193-L197 HydrophobicContact CD1-CD2 4.39Å; L193-L197 HydrophobicContact CD1-CG 4.23Å; L193-L197 HydrophobicContact CG-CD1 4.36Å; L193-L197 WeakPolarHBondContact O-CG 3.32Å; L193-L197 PolarHBondContact O-N 2.98Å; R195-L197 VanDerWaalsContact C-N 3.32Å; R195-L197 PolarHBondContact O-N 3.35Å; L197-L207 HydrophobicContact CD2-CD1 3.63Å; L197-L210 HydrophobicContact CD2-CD2 4.21Å |
| 198 | H | 91.1 | Very high | 94.1 | Very high | 75 Ų | 75 | 40.4 Ų | 40.4 | 35% | 0.347 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -87.1 | -30.8 | 179.5 | -66.4 | 84.5 | 0 | 0 | 0 | 113.7 | F151 D155 N194 R195 C196 | F151-H198 AromaticContact CD1-CE1 3.85Å; F151-H198 AromaticContact CE1-CE1 3.73Å; F151-H198 AromaticContact CE1-ND1 3.5Å; F151-H198 WeakPolarHBondContact CE1-ND1 3.18Å; D155-H198 PolarHBondContact O-NE2 2.88Å; D155-H198 VanDerWaalsContact O-NE2 3.07Å; N194-H198 PolarHBondContact O-ND1 3.38Å; R195-H198 PolarHBondContact O-N 2.97Å; R195-H198 VanDerWaalsContact O-N 3.13Å; C196-H198 PolarHBondContact O-N 3.27Å |
| 199 | Q | 92.1 | Very high | 94.1 | Very high | 88 Ų | 88 | 40.5 Ų | 40.5 | 41% | 0.411 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -99.4 | -27 | -172 | -63.2 | -179.8 | 6.6 | 0 | 0 | 112.8 | R195 C196 E255 | R195-Q199 WeakPolarHBondContact O-CG 3.39Å; R195-Q199 PolarHBondContact O-N 3.31Å; R195-Q199 VanDerWaalsContact O-N 3.16Å; C196-Q199 PolarHBondContact O-N 2.9Å; Q199-E255 PolarHBondContact OE1-O 2.74Å |
| 200 | I | 92.3 | Very high | 94 | Very high | 4 Ų | 4 | 40.5 Ų | 40.5 | 2% | 0.021 | 21% | 0.205 | C | C | . | . | S | Bend | trans | -110.4 | 116.4 | -170.9 | -47 | -171 | 0 | 0 | 0 | 110.2 | C196 V202 L210 R251 V252 E255 | C196-I200 HydrophobicContact CB-CD1 3.84Å; C196-I200 HydrophobicContact CB-CG1 4.16Å; C196-I200 WeakPolarHBondContact O-CA 3.43Å; C196-I200 VanDerWaalsContact O-CB 3.29Å; C196-I200 WeakPolarHBondContact O-CB 3.35Å; C196-I200 WeakPolarHBondContact O-CG1 3.31Å; C196-I200 PolarHBondContact O-N 3.35Å; I200-V202 HydrophobicContact CB-CG2 4.03Å; I200-V202 HydrophobicContact CG2-CG2 3.41Å; I200-V202 VanDerWaalsContact CG2-CG2 3.41Å; I200-V202 PolarHBondContact O-N 3.09Å; I200-V202 VanDerWaalsContact O-N 3.08Å; I200-L210 HydrophobicContact CD1-CD1 4.33Å; I200-R251 HydrophobicContact CG2-CG 4.41Å; I200-V252 HydrophobicContact CD1-CB 4.35Å; I200-V252 HydrophobicContact CD1-CG2 3.81Å; I200-E255 HydrophobicContact CD1-CB 3.98Å; I200-E255 HydrophobicContact CD1-CG 4.08Å; I200-E255 HydrophobicContact CG1-CB 3.85Å; I200-E255 HydrophobicContact CG1-CG 3.88Å |
| 201 | K | 90.6 | Very high | 94 | Very high | 192 Ų | 192 | 40.4 Ų | 40.4 | 84% | 0.835 | 21% | 0.205 | S | C | * | . | trans | -68.4 | 106.9 | 168.9 | -66.3 | -178.1 | -179 | 176.7 | 0 | 110 | R251 | K201-R251 PolarHBondContact O-NH1 3.23Å; K201-R251 PolarHBondContact O-NH2 3.28Å | ||
| 202 | V | 90.1 | Very high | 94.1 | Very high | 15 Ų | 15 | 39.9 Ų | 39.9 | 9% | 0.091 | 20% | 0.202 | C | C | . | . | trans | -131.6 | 141.9 | 179.7 | -173.6 | 0 | 0 | 0 | 0 | 109.2 | F160 I200 K206 L210 M248 | F160-V202 HydrophobicContact CZ-CB 4.45Å; F160-V202 VanDerWaalsContact CZ-O 3.3Å; F160-V202 WeakPolarHBondContact CZ-O 3.42Å; I200-V202 HydrophobicContact CB-CG2 4.03Å; I200-V202 HydrophobicContact CG2-CG2 3.41Å; I200-V202 VanDerWaalsContact CG2-CG2 3.41Å; I200-V202 PolarHBondContact O-N 3.09Å; I200-V202 VanDerWaalsContact O-N 3.08Å; V202-K206 HydrophobicContact CG1-CB 3.49Å; V202-K206 VanDerWaalsContact CG1-CB 3.49Å; V202-L210 HydrophobicContact CG2-CD2 4.3Å; V202-M248 HydrophobicContact CG1-CE 4.27Å; V202-M248 HydrophobicContact CG2-CE 4.45Å | ||
| 203 | N | 89.9 | Confident | 94.1 | Very high | 106 Ų | 106 | 39.9 Ų | 39.9 | 57% | 0.567 | 20% | 0.202 | S | C | * | . | trans | -77.3 | 148 | 172 | -172.8 | 1.5 | 0 | 0 | 0 | 109.4 | A205 K206 | N203-A205 PolarHBondContact O-N 3.07Å; N203-K206 PolarHBondContact O-N 3.37Å | ||
| 204 | T | 88.5 | Confident | 94.2 | Very high | 59 Ų | 59 | 39.9 Ų | 39.9 | 36% | 0.362 | 20% | 0.202 | S | C | . | . | G | 310 helix | trans | -49.7 | -35.6 | 175.9 | -46.4 | 0 | 0 | 0 | 0 | 112.4 | P159 K206 L207 | P159-T204 WeakPolarHBondContact CG-OG1 3.49Å; T204-K206 PolarHBondContact O-N 3.26Å; T204-K206 VanDerWaalsContact O-N 3.09Å; T204-L207 WeakPolarHBondContact O-CB 3.36Å; T204-L207 PolarHBondContact O-N 2.93Å; T204-L207 VanDerWaalsContact O-N 3.08Å |
| 205 | A | 90.6 | Very high | 94.4 | Very high | 69 Ų | 69 | 39.3 Ų | 39.3 | 57% | 0.57 | 20% | 0.199 | S | C | * | . | G | 310 helix | trans | -62.2 | -14.2 | 176 | 0 | 0 | 0 | 0 | 0 | 115 | N203 Y240 | N203-A205 PolarHBondContact O-N 3.07Å; A205-Y240 PolarHBondContact O-OH 3.07Å |
| 206 | K | 93.9 | Very high | 94.5 | Very high | 109 Ų | 109 | 39 Ų | 39 | 47% | 0.474 | 20% | 0.199 | S | C | . | . | G | 310 helix | trans | -113.1 | 9.7 | 178 | -68.9 | -178.7 | -179.2 | 177.2 | 0 | 112.4 | V202 N203 T204 L209 L210 M248 | V202-K206 HydrophobicContact CG1-CB 3.49Å; V202-K206 VanDerWaalsContact CG1-CB 3.49Å; N203-K206 PolarHBondContact O-N 3.37Å; T204-K206 PolarHBondContact O-N 3.26Å; T204-K206 VanDerWaalsContact O-N 3.09Å; K206-L209 PolarHBondContact O-N 3.31Å; K206-L210 PolarHBondContact O-N 3.44Å; K206-M248 HydrophobicContact CB-CE 4.44Å |
| 207 | L | 93.9 | Very high | 94.7 | Very high | 13 Ų | 13 | 39.3 Ų | 39.3 | 7% | 0.068 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -66.3 | -39.9 | -176.7 | -175.1 | 59.6 | 0 | 0 | 0 | 111.4 | F160 L168 L197 T204 L209 L210 G211 | F160-L207 HydrophobicContact CD1-CD2 4.47Å; F160-L207 HydrophobicContact CE1-CD1 4.22Å; L168-L207 HydrophobicContact CD2-CD1 3.75Å; L168-L207 HydrophobicContact CD2-CD2 4.28Å; L168-L207 HydrophobicContact CD2-CG 3.58Å; L197-L207 HydrophobicContact CD2-CD1 3.63Å; T204-L207 WeakPolarHBondContact O-CB 3.36Å; T204-L207 PolarHBondContact O-N 2.93Å; T204-L207 VanDerWaalsContact O-N 3.08Å; L207-L209 PolarHBondContact O-N 3.36Å; L207-L210 WeakPolarHBondContact O-CB 3.36Å; L207-L210 PolarHBondContact O-N 3.38Å; L207-G211 PolarHBondContact O-N 3.44Å |
| 208 | Q | 96.2 | Very high | 94.9 | Very high | 64 Ų | 64 | 39 Ų | 39 | 30% | 0.299 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -59.3 | -47.1 | 174.2 | -169 | -174.6 | 28.3 | 0 | 0 | 111.9 | W171 L210 G211 V212 M236 | W171-Q208 HydrophobicContact CE3-CG 4.2Å; W171-Q208 HydrophobicContact CH2-CG 3.56Å; W171-Q208 HydrophobicContact CZ2-CG 4.18Å; W171-Q208 HydrophobicContact CZ3-CG 3.57Å; Q208-L210 VanDerWaalsContact C-N 3.31Å; Q208-L210 PolarHBondContact O-N 2.87Å; Q208-G211 PolarHBondContact O-N 3.14Å; Q208-G211 VanDerWaalsContact O-N 3.16Å; Q208-V212 PolarHBondContact O-N 3.47Å; Q208-M236 HydrophobicContact CG-CG 4.22Å; Q208-M236 HydrophobicContact CG-SD 4.23Å |
| 209 | L | 97.8 | Very high | 95.2 | Very high | 6 Ų | 6 | 35.5 Ų | 35.5 | 3% | 0.031 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -59 | -42.3 | 176 | -178.1 | 63.4 | 0 | 0 | 0 | 111.9 | K206 L207 V213 M236 Y240 Q244 L245 M248 | K206-L209 PolarHBondContact O-N 3.31Å; L207-L209 PolarHBondContact O-N 3.36Å; L209-V213 HydrophobicContact CD1-CG2 4.49Å; L209-V213 WeakPolarHBondContact O-CB 3.33Å; L209-V213 VanDerWaalsContact O-CG2 3.29Å; L209-V213 WeakPolarHBondContact O-CG2 3.27Å; L209-V213 PolarHBondContact O-N 3.45Å; L209-M236 HydrophobicContact CD1-CE 4.07Å; L209-M236 HydrophobicContact CD1-SD 4.39Å; L209-Y240 HydrophobicContact CB-CD1 4.09Å; L209-Y240 HydrophobicContact CB-CD2 4.16Å; L209-Y240 HydrophobicContact CB-CE1 3.82Å; L209-Y240 HydrophobicContact CB-CE2 3.93Å; L209-Y240 HydrophobicContact CB-CG 4.23Å; L209-Y240 HydrophobicContact CD1-CD1 4.25Å; L209-Y240 HydrophobicContact CD1-CD2 4.16Å; L209-Y240 HydrophobicContact CD1-CG 3.88Å; L209-Y240 HydrophobicContact CD2-CD1 3.74Å; L209-Y240 HydrophobicContact CD2-CE1 4.02Å; L209-Y240 HydrophobicContact CD2-CG 4.23Å; L209-Y240 HydrophobicContact CG-CD1 4.25Å; L209-Y240 HydrophobicContact CG-CE1 4.42Å; L209-Y240 HydrophobicContact CG-CG 4.34Å; L209-Q244 HydrophobicContact CD2-CB 4.4Å; L209-L245 HydrophobicContact CD1-CB 4.14Å; L209-L245 HydrophobicContact CD1-CG 4.33Å; L209-M248 HydrophobicContact CD2-CB 3.99Å; L209-M248 HydrophobicContact CD2-CE 4.07Å; L209-M248 HydrophobicContact CD2-CG 4.4Å; L209-M248 HydrophobicContact CG-CB 4.1Å; L209-M248 HydrophobicContact CG-CE 4.4Å; L209-M248 HydrophobicContact CG-CG 4.2Å |
| 210 | L | 97.9 | Very high | 95.5 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.7 | -45.5 | 176.2 | 179.8 | 64.8 | 0 | 0 | 0 | 111.2 | L193 C196 L197 I200 V202 K206 L207 Q208 V213 C214 M248 V252 | L193-L210 HydrophobicContact CD1-CD2 4.21Å; L193-L210 HydrophobicContact CD1-CG 4.25Å; C196-L210 HydrophobicContact CB-CD1 3.94Å; C196-L210 HydrophobicContact CB-CD2 4.08Å; C196-L210 HydrophobicContact CB-CG 4.35Å; L197-L210 HydrophobicContact CD2-CD2 4.21Å; I200-L210 HydrophobicContact CD1-CD1 4.33Å; V202-L210 HydrophobicContact CG2-CD2 4.3Å; K206-L210 PolarHBondContact O-N 3.44Å; L207-L210 WeakPolarHBondContact O-CB 3.36Å; L207-L210 PolarHBondContact O-N 3.38Å; Q208-L210 VanDerWaalsContact C-N 3.31Å; Q208-L210 PolarHBondContact O-N 2.87Å; L210-V213 PolarHBondContact O-N 3.1Å; L210-C214 PolarHBondContact O-N 3.47Å; L210-C214 PolarHBondContact O-SG 3.31Å; L210-M248 HydrophobicContact CD1-SD 4.13Å; L210-V252 HydrophobicContact CD1-CG2 3.61Å |
| 211 | G | 98 | Very high | 95.7 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.2 | -49.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L207 Q208 V213 C214 L215 | L207-G211 PolarHBondContact O-N 3.44Å; Q208-G211 PolarHBondContact O-N 3.14Å; Q208-G211 VanDerWaalsContact O-N 3.16Å; G211-V213 VanDerWaalsContact C-N 3.3Å; G211-V213 PolarHBondContact O-N 3.49Å; G211-C214 WeakPolarHBondContact O-CB 3.39Å; G211-C214 PolarHBondContact O-N 2.89Å; G211-C214 VanDerWaalsContact O-N 3.16Å; G211-L215 PolarHBondContact O-N 3.2Å |
| 212 | V | 98.2 | Very high | 96 | Very high | 3 Ų | 3 | 34.4 Ų | 34.4 | 2% | 0.018 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.7 | -39.6 | 177.8 | 174.3 | 0 | 0 | 0 | 0 | 111.7 | W171 Q208 C214 L215 F216 L232 M236 L245 | W171-V212 HydrophobicContact CH2-CG2 3.31Å; W171-V212 HydrophobicContact CZ3-CG2 3.47Å; W171-V212 VanDerWaalsContact CZ3-CG2 3.47Å; Q208-V212 PolarHBondContact O-N 3.47Å; V212-C214 VanDerWaalsContact C-N 3.34Å; V212-L215 PolarHBondContact O-N 3.04Å; V212-F216 WeakPolarHBondContact O-CB 3.36Å; V212-F216 PolarHBondContact O-N 3.46Å; V212-L232 HydrophobicContact CG1-CB 4.04Å; V212-L232 HydrophobicContact CG1-CD1 4.4Å; V212-L232 HydrophobicContact CG1-CD2 4.04Å; V212-L232 HydrophobicContact CG1-CG 4.4Å; V212-M236 HydrophobicContact CB-CE 4.29Å; V212-M236 HydrophobicContact CB-SD 3.97Å; V212-M236 HydrophobicContact CG1-CE 4.11Å; V212-M236 HydrophobicContact CG1-SD 4.39Å; V212-M236 HydrophobicContact CG2-CE 4.31Å; V212-M236 HydrophobicContact CG2-CG 3.92Å; V212-M236 HydrophobicContact CG2-SD 3.53Å; V212-M236 VanDerWaalsContact CG2-SD 3.53Å; V212-L245 HydrophobicContact CG1-CD1 4.42Å |
| 213 | V | 98.6 | Very high | 96.3 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64.6 | -39.4 | 176.2 | 164.8 | 0 | 0 | 0 | 0 | 111.7 | L209 L210 G211 L215 F216 L217 L245 M248 E249 V252 | L209-V213 HydrophobicContact CD1-CG2 4.49Å; L209-V213 WeakPolarHBondContact O-CB 3.33Å; L209-V213 VanDerWaalsContact O-CG2 3.29Å; L209-V213 WeakPolarHBondContact O-CG2 3.27Å; L209-V213 PolarHBondContact O-N 3.45Å; L210-V213 PolarHBondContact O-N 3.1Å; G211-V213 VanDerWaalsContact C-N 3.3Å; G211-V213 PolarHBondContact O-N 3.49Å; V213-L215 VanDerWaalsContact C-N 3.33Å; V213-F216 PolarHBondContact O-N 2.99Å; V213-L217 HydrophobicContact CG1-CD1 4.12Å; V213-L217 HydrophobicContact CG1-CG 4.46Å; V213-L217 WeakPolarHBondContact O-CB 3.39Å; V213-L217 WeakPolarHBondContact O-CG 3.28Å; V213-L217 PolarHBondContact O-N 3Å; V213-L245 HydrophobicContact CG2-CD2 4.21Å; V213-L245 HydrophobicContact CG2-CG 4.04Å; V213-M248 HydrophobicContact CB-CG 4.19Å; V213-M248 HydrophobicContact CG1-CG 4.29Å; V213-M248 HydrophobicContact CG2-CB 3.96Å; V213-M248 HydrophobicContact CG2-CG 3.89Å; V213-E249 VanDerWaalsContact CG1-CA 3.47Å; V213-E249 HydrophobicContact CG1-CB 4.05Å; V213-V252 HydrophobicContact CG1-CB 4.11Å; V213-V252 HydrophobicContact CG1-CG2 3.75Å |
| 214 | C | 98.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.9 | -42.1 | 174.6 | -64.1 | 0 | 0 | 0 | 0 | 111.2 | L192 L193 L210 G211 V212 L217 A218 | L192-C214 HydrophobicContact CB-CB 4.13Å; L193-C214 HydrophobicContact CB-CB 4.29Å; L210-C214 PolarHBondContact O-N 3.47Å; L210-C214 PolarHBondContact O-SG 3.31Å; G211-C214 WeakPolarHBondContact O-CB 3.39Å; G211-C214 PolarHBondContact O-N 2.89Å; G211-C214 VanDerWaalsContact O-N 3.16Å; V212-C214 VanDerWaalsContact C-N 3.34Å; C214-L217 PolarHBondContact O-N 3.09Å; C214-A218 WeakPolarHBondContact O-CB 3.5Å; C214-A218 PolarHBondContact O-N 2.94Å |
| 215 | L | 98.6 | Very high | 96.8 | Very high | 2 Ų | 2 | 40.5 Ų | 40.5 | 1% | 0.01 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.4 | -42.8 | 175.5 | -176.3 | 61.8 | 0 | 0 | 0 | 112.2 | L172 V175 H176 F181 T185 S189 G211 V212 V213 A218 A219 | L172-L215 HydrophobicContact CD2-CB 4.42Å; L172-L215 HydrophobicContact CD2-CD2 4.42Å; V175-L215 HydrophobicContact CB-CD2 4.2Å; V175-L215 HydrophobicContact CG1-CD2 3.65Å; H176-L215 HydrophobicContact CB-CD1 4.5Å; F181-L215 HydrophobicContact CD2-CD1 4.22Å; F181-L215 HydrophobicContact CD2-CG 4.4Å; F181-L215 HydrophobicContact CE2-CG 4.32Å; T185-L215 HydrophobicContact CG2-CD1 3.94Å; S189-L215 WeakPolarHBondContact OG-CA 3.41Å; S189-L215 WeakPolarHBondContact OG-CB 3.44Å; S189-L215 PolarHBondContact OG-N 3.41Å; G211-L215 PolarHBondContact O-N 3.2Å; V212-L215 PolarHBondContact O-N 3.04Å; V213-L215 VanDerWaalsContact C-N 3.33Å; L215-A218 PolarHBondContact O-N 3.12Å; L215-A219 WeakPolarHBondContact O-CB 3.25Å; L215-A219 PolarHBondContact O-N 3.4Å |
| 216 | F | 98.6 | Very high | 97.1 | Very high | 9 Ų | 9 | 41.1 Ų | 41.1 | 4% | 0.039 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -67 | -38.3 | 179.3 | -174.5 | -135.9 | 0 | 0 | 0 | 112.5 | V212 V213 A219 K220 V229 L232 L245 | V212-F216 WeakPolarHBondContact O-CB 3.36Å; V212-F216 PolarHBondContact O-N 3.46Å; V213-F216 PolarHBondContact O-N 2.99Å; F216-A219 PolarHBondContact O-N 3.28Å; F216-K220 HydrophobicContact CE1-CD 4.4Å; F216-K220 VanDerWaalsContact CE1-NZ 3.34Å; F216-K220 HydrophobicContact CZ-CD 4.48Å; F216-K220 WeakPolarHBondContact O-CB 3.38Å; F216-K220 WeakPolarHBondContact O-CG 3.36Å; F216-K220 PolarHBondContact O-N 3.44Å; F216-V229 HydrophobicContact CE1-CG2 4.16Å; F216-V229 HydrophobicContact CZ-CG2 4.16Å; F216-L232 HydrophobicContact CB-CD1 3.9Å; F216-L232 HydrophobicContact CD1-CD1 3.9Å; F216-L232 HydrophobicContact CD2-CD1 3.53Å; F216-L232 HydrophobicContact CE1-CD1 4.21Å; F216-L232 HydrophobicContact CE2-CD1 3.87Å; F216-L232 HydrophobicContact CG-CD1 3.52Å; F216-L232 HydrophobicContact CZ-CD1 4.18Å; F216-L245 HydrophobicContact CD1-CD2 4.2Å; F216-L245 HydrophobicContact CE1-CD2 4.42Å |
| 217 | L | 98.7 | Very high | 97.1 | Very high | 6 Ų | 6 | 36.5 Ų | 36.5 | 3% | 0.031 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -67.1 | -38.4 | 173.5 | -74.8 | 176.2 | 0 | 0 | 0 | 112.1 | L192 V213 C214 K221 E249 V252 L253 | L192-L217 HydrophobicContact CD1-CB 4.27Å; V213-L217 HydrophobicContact CG1-CD1 4.12Å; V213-L217 HydrophobicContact CG1-CG 4.46Å; V213-L217 WeakPolarHBondContact O-CB 3.39Å; V213-L217 WeakPolarHBondContact O-CG 3.28Å; V213-L217 PolarHBondContact O-N 3Å; C214-L217 PolarHBondContact O-N 3.09Å; L217-K221 PolarHBondContact O-N 3.49Å; L217-E249 HydrophobicContact CD2-CG 3.81Å; L217-E249 HydrophobicContact CG-CG 4.28Å; L217-V252 HydrophobicContact CD1-CB 3.93Å; L217-V252 HydrophobicContact CD1-CG1 3.42Å; L217-V252 VanDerWaalsContact CD1-CG1 3.42Å; L217-L253 HydrophobicContact CD1-CD2 4.12Å; L217-L253 HydrophobicContact CD1-CG 4.1Å; L217-L253 HydrophobicContact CD2-CD1 4.03Å; L217-L253 HydrophobicContact CD2-CD2 3.82Å; L217-L253 HydrophobicContact CD2-CG 3.93Å |
| 218 | A | 98.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.4 | -46.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | T185 L188 L192 C214 L215 K220 K221 E222 | T185-A218 HydrophobicContact CG2-CB 4.06Å; T185-A218 VanDerWaalsContact O-CB 3.31Å; T185-A218 WeakPolarHBondContact O-CB 3.02Å; L188-A218 HydrophobicContact CB-CB 3.96Å; L188-A218 HydrophobicContact CD2-CB 3.78Å; L188-A218 HydrophobicContact CG-CB 3.71Å; L192-A218 HydrophobicContact CD1-CB 4.47Å; C214-A218 WeakPolarHBondContact O-CB 3.5Å; C214-A218 PolarHBondContact O-N 2.94Å; L215-A218 PolarHBondContact O-N 3.12Å; A218-K220 VanDerWaalsContact C-N 3.35Å; A218-K220 PolarHBondContact O-N 3.43Å; A218-K221 WeakPolarHBondContact O-CB 3.42Å; A218-K221 PolarHBondContact O-N 3.23Å; A218-E222 PolarHBondContact O-N 2.96Å |
| 219 | A | 98.3 | Very high | 97.3 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.3 | -44 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | F181 T185 L215 F216 K221 E222 E223 L226 | F181-A219 HydrophobicContact CD2-CB 4.29Å; F181-A219 HydrophobicContact CE1-CB 4.05Å; F181-A219 HydrophobicContact CE2-CB 3.8Å; F181-A219 HydrophobicContact CZ-CB 3.67Å; T185-A219 HydrophobicContact CG2-CB 4.01Å; L215-A219 WeakPolarHBondContact O-CB 3.25Å; L215-A219 PolarHBondContact O-N 3.4Å; F216-A219 PolarHBondContact O-N 3.28Å; A219-K221 PolarHBondContact O-N 3.17Å; A219-E222 PolarHBondContact O-N 2.88Å; A219-E223 HydrophobicContact CB-CG 3.96Å; A219-E223 WeakPolarHBondContact O-CA 3.25Å; A219-E223 WeakPolarHBondContact O-CB 3.01Å; A219-E223 PolarHBondContact O-N 3.14Å; A219-L226 HydrophobicContact CB-CD2 3.8Å; A219-L226 WeakPolarHBondContact O-CD2 3.12Å |
| 220 | K | 98 | Very high | 97.2 | Very high | 90 Ų | 90 | 42.6 Ų | 42.6 | 39% | 0.391 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -56.9 | -23.6 | 174.5 | -82.3 | 179.6 | 178.7 | -178.4 | 0 | 114.4 | F216 A218 L226 E249 | F216-K220 HydrophobicContact CE1-CD 4.4Å; F216-K220 VanDerWaalsContact CE1-NZ 3.34Å; F216-K220 HydrophobicContact CZ-CD 4.48Å; F216-K220 WeakPolarHBondContact O-CB 3.38Å; F216-K220 WeakPolarHBondContact O-CG 3.36Å; F216-K220 PolarHBondContact O-N 3.44Å; A218-K220 VanDerWaalsContact C-N 3.35Å; A218-K220 PolarHBondContact O-N 3.43Å; K220-L226 HydrophobicContact CB-CD1 4.46Å; K220-L226 HydrophobicContact CG-CD1 3.68Å; K220-L226 HydrophobicContact CG-CD2 4.18Å; K220-E249 IonicContact NZ-OE1 3.09Å; K220-E249 PolarHBondContact NZ-OE1 3.3Å; K220-E249 IonicContact NZ-OE2 2.63Å |
| 221 | K | 96.7 | Very high | 97.1 | Very high | 91 Ų | 91 | 47.1 Ų | 47.1 | 40% | 0.396 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -91.8 | -39.3 | -178.6 | -167.1 | -174.3 | 171.7 | -137.7 | 0 | 112.3 | L188 L217 A218 A219 L260 | L188-K221 HydrophobicContact CD2-CB 4.13Å; L188-K221 HydrophobicContact CD2-CD 3.6Å; L188-K221 HydrophobicContact CD2-CG 4.43Å; L217-K221 PolarHBondContact O-N 3.49Å; A218-K221 WeakPolarHBondContact O-CB 3.42Å; A218-K221 PolarHBondContact O-N 3.23Å; A219-K221 PolarHBondContact O-N 3.17Å; K221-L260 HydrophobicContact CD-CB 4.06Å; K221-L260 WeakPolarHBondContact CE-O 3.31Å; K221-L260 PolarHBondContact NZ-O 2.98Å |
| 222 | E | 95.6 | Very high | 97 | Very high | 80 Ų | 80 | 47.2 Ų | 47.2 | 37% | 0.374 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -106.1 | -23.2 | -169.7 | -54.3 | -60.2 | 156 | 0 | 0 | 113.1 | T185 L188 A218 A219 | T185-E222 WeakPolarHBondContact OG1-CB 3.38Å; L188-E222 HydrophobicContact CD2-CG 3.93Å; A218-E222 PolarHBondContact O-N 2.96Å; A219-E222 PolarHBondContact O-N 2.88Å |
| 223 | E | 97.1 | Very high | 96.9 | Very high | 45 Ų | 45 | 47.2 Ų | 47.2 | 21% | 0.21 | 25% | 0.245 | C | C | . | . | trans | -100.5 | 145.8 | -172.8 | -54.9 | -65.6 | 164.8 | 0 | 0 | 113.2 | F181 S182 T185 A219 L226 | F181-E223 WeakPolarHBondContact CA-OE1 3.25Å; F181-E223 WeakPolarHBondContact CB-OE1 3.11Å; F181-E223 HydrophobicContact CD1-CG 3.62Å; F181-E223 HydrophobicContact CE1-CG 4.05Å; F181-E223 HydrophobicContact CG-CG 4.21Å; S182-E223 PolarHBondContact N-OE1 3.42Å; T185-E223 WeakPolarHBondContact CB-OE1 3.45Å; T185-E223 PolarHBondContact OG1-OE1 3.49Å; A219-E223 HydrophobicContact CB-CG 3.96Å; A219-E223 WeakPolarHBondContact O-CA 3.25Å; A219-E223 WeakPolarHBondContact O-CB 3.01Å; A219-E223 PolarHBondContact O-N 3.14Å; E223-L226 HydrophobicContact CB-CD2 4.21Å | ||
| 224 | C | 95.2 | Very high | 96.7 | Very high | 119 Ų | 119 | 54.3 Ų | 54.3 | 80% | 0.804 | 28% | 0.276 | S | S | * | . | S | Bend | trans | -82.1 | -29.8 | 171.8 | -65.9 | 0 | 0 | 0 | 0 | 112.7 | ||
| 225 | L | 94.3 | Very high | 96.4 | Very high | 145 Ų | 145 | 56.8 Ų | 56.8 | 76% | 0.759 | 29% | 0.289 | S | S | * | . | S | Bend | trans | -117.1 | 128.9 | -177.3 | -61.7 | 178.8 | 0 | 0 | 0 | 109 | ||
| 226 | L | 96.1 | Very high | 96.1 | Very high | 82 Ų | 82 | 57 Ų | 57 | 43% | 0.429 | 29% | 0.289 | S | S | . | . | trans | -120.6 | 140 | -175.6 | -62.7 | 170.8 | 0 | 0 | 0 | 110 | A219 K220 E223 | A219-L226 HydrophobicContact CB-CD2 3.8Å; A219-L226 WeakPolarHBondContact O-CD2 3.12Å; K220-L226 HydrophobicContact CB-CD1 4.46Å; K220-L226 HydrophobicContact CG-CD1 3.68Å; K220-L226 HydrophobicContact CG-CD2 4.18Å; E223-L226 HydrophobicContact CB-CD2 4.21Å | ||
| 227 | P | 95 | Very high | 95.9 | Very high | 12 Ų | 12 | 65.1 Ų | 65.1 | 8% | 0.078 | 33% | 0.328 | C | S | . | . | trans | -68.5 | 157.3 | 171.1 | 30.3 | -35.3 | 0 | 0 | 0 | 110.7 | F179 F181 E231 L232 | F179-P227 HydrophobicContact CD1-CB 3.98Å; F179-P227 HydrophobicContact CD1-CG 4.18Å; F179-P227 HydrophobicContact CE1-CB 3.45Å; F179-P227 VanDerWaalsContact CE1-CB 3.45Å; F179-P227 HydrophobicContact CE1-CG 3.9Å; F179-P227 HydrophobicContact CE2-CG 4.35Å; F179-P227 HydrophobicContact CZ-CB 3.83Å; F179-P227 HydrophobicContact CZ-CG 3.97Å; F181-P227 HydrophobicContact CZ-CG 3.95Å; P227-E231 WeakPolarHBondContact CA-OE2 3.36Å; P227-E231 HydrophobicContact CB-CB 4.35Å; P227-E231 WeakPolarHBondContact CB-OE2 3.49Å; P227-L232 HydrophobicContact CG-CD2 3.96Å; P227-L232 HydrophobicContact CG-CG 4.27Å | ||
| 228 | E | 95.9 | Very high | 95.6 | Very high | 132 Ų | 132 | 69.9 Ų | 69.9 | 62% | 0.617 | 35% | 0.353 | S | S | * | . | trans | -71.4 | 153.5 | 171 | -64.8 | -168.6 | 168.8 | 0 | 0 | 111 | S230 E231 L232 | E228-S230 VanDerWaalsContact CB-OG 3.27Å; E228-S230 WeakPolarHBondContact CB-OG 2.97Å; E228-S230 PolarHBondContact O-N 3.13Å; E228-S230 PolarHBondContact OE2-OG 3.07Å; E228-S230 VanDerWaalsContact OE2-OG 3.1Å; E228-E231 HydrophobicContact CB-CG 4.22Å; E228-E231 PolarHBondContact N-OE2 3.39Å; E228-E231 WeakPolarHBondContact O-CB 3.34Å; E228-E231 PolarHBondContact O-N 2.77Å; E228-L232 PolarHBondContact O-N 3.46Å | ||
| 229 | V | 97.1 | Very high | 95.4 | Very high | 30 Ų | 30 | 72.4 Ų | 72.4 | 18% | 0.182 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -59.4 | -33.9 | 177.1 | 177.2 | 0 | 0 | 0 | 0 | 111.7 | F216 L232 C233 N242 L245 L246 | F216-V229 HydrophobicContact CE1-CG2 4.16Å; F216-V229 HydrophobicContact CZ-CG2 4.16Å; V229-L232 PolarHBondContact O-N 2.79Å; V229-C233 PolarHBondContact O-N 2.94Å; V229-N242 HydrophobicContact CG1-CB 3.8Å; V229-L245 HydrophobicContact CG1-CB 4.3Å; V229-L245 HydrophobicContact CG1-CD1 4.13Å; V229-L245 HydrophobicContact CG1-CD2 4.04Å; V229-L245 HydrophobicContact CG1-CG 4.38Å; V229-L246 HydrophobicContact CG2-CD2 4.16Å |
| 230 | S | 96.4 | Very high | 95.3 | Very high | 48 Ų | 48 | 73.8 Ų | 73.8 | 34% | 0.336 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -58.8 | -42.2 | 173.2 | 30.8 | 0 | 0 | 0 | 0 | 112.4 | E228 C233 F234 | E228-S230 VanDerWaalsContact CB-OG 3.27Å; E228-S230 WeakPolarHBondContact CB-OG 2.97Å; E228-S230 PolarHBondContact O-N 3.13Å; E228-S230 PolarHBondContact OE2-OG 3.07Å; E228-S230 VanDerWaalsContact OE2-OG 3.1Å; S230-C233 WeakPolarHBondContact O-CB 3.46Å; S230-C233 PolarHBondContact O-N 3.21Å; S230-F234 WeakPolarHBondContact O-CB 3.34Å; S230-F234 PolarHBondContact O-N 3.09Å |
| 231 | E | 96.1 | Very high | 95.2 | Very high | 95 Ų | 95 | 72.2 Ų | 72.2 | 44% | 0.444 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -67 | -39.8 | 179.4 | -63.7 | 175.5 | 152.7 | 0 | 0 | 111.2 | P227 E228 C233 F234 L235 | P227-E231 WeakPolarHBondContact CA-OE2 3.36Å; P227-E231 HydrophobicContact CB-CB 4.35Å; P227-E231 WeakPolarHBondContact CB-OE2 3.49Å; E228-E231 HydrophobicContact CB-CG 4.22Å; E228-E231 PolarHBondContact N-OE2 3.39Å; E228-E231 WeakPolarHBondContact O-CB 3.34Å; E228-E231 PolarHBondContact O-N 2.77Å; E231-C233 PolarHBondContact O-N 3.37Å; E231-F234 WeakPolarHBondContact O-CB 3.24Å; E231-F234 PolarHBondContact O-N 3.31Å; E231-L235 PolarHBondContact O-N 2.7Å |
| 232 | L | 95.6 | Very high | 95.3 | Very high | 3 Ų | 3 | 71.3 Ų | 71.3 | 2% | 0.016 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63.2 | -41.1 | 173.6 | -62.3 | 174 | 0 | 0 | 0 | 112 | F179 V212 F216 P227 E228 V229 L235 M236 L245 | F179-L232 HydrophobicContact CE2-CD2 3.6Å; F179-L232 HydrophobicContact CZ-CD2 3.75Å; V212-L232 HydrophobicContact CG1-CB 4.04Å; V212-L232 HydrophobicContact CG1-CD1 4.4Å; V212-L232 HydrophobicContact CG1-CD2 4.04Å; V212-L232 HydrophobicContact CG1-CG 4.4Å; F216-L232 HydrophobicContact CB-CD1 3.9Å; F216-L232 HydrophobicContact CD1-CD1 3.9Å; F216-L232 HydrophobicContact CD2-CD1 3.53Å; F216-L232 HydrophobicContact CE1-CD1 4.21Å; F216-L232 HydrophobicContact CE2-CD1 3.87Å; F216-L232 HydrophobicContact CG-CD1 3.52Å; F216-L232 HydrophobicContact CZ-CD1 4.18Å; P227-L232 HydrophobicContact CG-CD2 3.96Å; P227-L232 HydrophobicContact CG-CG 4.27Å; E228-L232 PolarHBondContact O-N 3.46Å; V229-L232 PolarHBondContact O-N 2.79Å; L232-L235 PolarHBondContact O-N 3.23Å; L232-M236 WeakPolarHBondContact O-CE 3.34Å; L232-M236 PolarHBondContact O-N 3.09Å; L232-L245 HydrophobicContact CB-CD1 3.73Å; L232-L245 HydrophobicContact CD1-CD1 4.07Å |
| 233 | C | 95.4 | Very high | 95.4 | Very high | 3 Ų | 3 | 75.5 Ų | 75.5 | 2% | 0.02 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -64.3 | -40.6 | 174.6 | -79 | 0 | 0 | 0 | 0 | 111.9 | V229 S230 E231 M236 N238 Y240 S241 N242 | V229-C233 PolarHBondContact O-N 2.94Å; S230-C233 WeakPolarHBondContact O-CB 3.46Å; S230-C233 PolarHBondContact O-N 3.21Å; E231-C233 PolarHBondContact O-N 3.37Å; C233-M236 CarbonylContact O-C 3.52Å; C233-M236 PolarHBondContact O-N 3.38Å; C233-M236 VanDerWaalsContact O-N 3.16Å; C233-N238 WeakPolarHBondContact O-CA 3.2Å; C233-N238 PolarHBondContact O-N 3.18Å; C233-Y240 PolarHBondContact SG-O 3.41Å; C233-S241 VanDerWaalsContact SG-C 3.6Å; C233-N242 PolarHBondContact SG-OD1 2.87Å; C233-N242 VanDerWaalsContact SG-OD1 3.32Å |
| 234 | F | 94.1 | Very high | 95.5 | Very high | 148 Ų | 148 | 77.1 Ų | 77.1 | 65% | 0.649 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -61.6 | -42.2 | 176.7 | 178.1 | -97.7 | 0 | 0 | 0 | 112.1 | S230 E231 M236 E237 | S230-F234 WeakPolarHBondContact O-CB 3.34Å; S230-F234 PolarHBondContact O-N 3.09Å; E231-F234 WeakPolarHBondContact O-CB 3.24Å; E231-F234 PolarHBondContact O-N 3.31Å; F234-M236 PolarHBondContact O-N 3.04Å; F234-E237 WeakPolarHBondContact O-CA 3.45Å; F234-E237 PolarHBondContact O-N 2.81Å |
| 235 | L | 92.6 | Very high | 95.6 | Very high | 53 Ų | 53 | 71.4 Ų | 71.4 | 28% | 0.277 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62.5 | -25.5 | 175.2 | -77.4 | 176.5 | 0 | 0 | 0 | 114.3 | V175 V178 F179 E231 L232 E237 | V175-L235 HydrophobicContact CG1-CD1 3.89Å; V178-L235 HydrophobicContact CG1-CD2 4.37Å; F179-L235 HydrophobicContact CD2-CD1 4.17Å; F179-L235 HydrophobicContact CE1-CD1 4.22Å; F179-L235 HydrophobicContact CE2-CD1 3.14Å; F179-L235 HydrophobicContact CZ-CD1 3.17Å; F179-L235 HydrophobicContact CZ-CG 4.31Å; E231-L235 PolarHBondContact O-N 2.7Å; L232-L235 PolarHBondContact O-N 3.23Å; L235-E237 PolarHBondContact O-N 2.95Å |
| 236 | M | 93.7 | Very high | 95.8 | Very high | 5 Ų | 5 | 67.5 Ų | 67.5 | 3% | 0.025 | 35% | 0.346 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.2 | 24.6 | 172.3 | -63.5 | -177.5 | -73.8 | 0 | 0 | 111.8 | W171 Q208 L209 V212 L232 C233 F234 N238 G239 Y240 L245 | W171-M236 HydrophobicContact CH2-CG 3.93Å; W171-M236 HydrophobicContact CZ2-CG 4.38Å; Q208-M236 HydrophobicContact CG-CG 4.22Å; Q208-M236 HydrophobicContact CG-SD 4.23Å; L209-M236 HydrophobicContact CD1-CE 4.07Å; L209-M236 HydrophobicContact CD1-SD 4.39Å; V212-M236 HydrophobicContact CB-CE 4.29Å; V212-M236 HydrophobicContact CB-SD 3.97Å; V212-M236 HydrophobicContact CG1-CE 4.11Å; V212-M236 HydrophobicContact CG1-SD 4.39Å; V212-M236 HydrophobicContact CG2-CE 4.31Å; V212-M236 HydrophobicContact CG2-CG 3.92Å; V212-M236 HydrophobicContact CG2-SD 3.53Å; V212-M236 VanDerWaalsContact CG2-SD 3.53Å; L232-M236 WeakPolarHBondContact O-CE 3.34Å; L232-M236 PolarHBondContact O-N 3.09Å; C233-M236 CarbonylContact O-C 3.52Å; C233-M236 PolarHBondContact O-N 3.38Å; C233-M236 VanDerWaalsContact O-N 3.16Å; F234-M236 PolarHBondContact O-N 3.04Å; M236-N238 PolarHBondContact O-N 3.33Å; M236-N238 VanDerWaalsContact O-N 3.11Å; M236-G239 PolarHBondContact O-N 3.08Å; M236-Y240 HydrophobicContact CB-CD2 4.14Å; M236-Y240 HydrophobicContact CE-CD2 3.98Å; M236-Y240 HydrophobicContact SD-CD2 3.58Å; M236-Y240 VanDerWaalsContact SD-CD2 3.58Å; M236-Y240 HydrophobicContact SD-CE2 3.91Å; M236-L245 HydrophobicContact CE-CD1 4.06Å |
| 237 | E | 93.6 | Very high | 95.9 | Very high | 180 Ų | 180 | 69.6 Ų | 69.6 | 84% | 0.841 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.9 | 33 | -178.8 | -60.6 | 176.8 | -172.2 | 0 | 0 | 113 | F234 L235 G239 | F234-E237 WeakPolarHBondContact O-CA 3.45Å; F234-E237 PolarHBondContact O-N 2.81Å; L235-E237 PolarHBondContact O-N 2.95Å; E237-G239 PolarHBondContact O-N 2.75Å; E237-G239 VanDerWaalsContact O-N 3.1Å |
| 238 | N | 92.3 | Very high | 96.1 | Very high | 107 Ų | 107 | 69.6 Ų | 69.6 | 57% | 0.572 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.1 | 23.5 | -173.7 | -58.8 | -57.1 | 0 | 0 | 0 | 114.3 | C233 M236 Y240 | C233-N238 WeakPolarHBondContact O-CA 3.2Å; C233-N238 PolarHBondContact O-N 3.18Å; M236-N238 PolarHBondContact O-N 3.33Å; M236-N238 VanDerWaalsContact O-N 3.11Å; N238-Y240 PolarHBondContact O-N 3.15Å; N238-Y240 VanDerWaalsContact O-N 3.1Å |
| 239 | G | 93.7 | Very high | 96.2 | Very high | 53 Ų | 53 | 64.1 Ų | 64.1 | 55% | 0.546 | 32% | 0.321 | S | S | . | . | S | Bend | trans | -62 | -15.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | M236 E237 | M236-G239 PolarHBondContact O-N 3.08Å; E237-G239 PolarHBondContact O-N 2.75Å; E237-G239 VanDerWaalsContact O-N 3.1Å |
| 240 | Y | 96.4 | Very high | 96.3 | Very high | 28 Ų | 28 | 69.7 Ų | 69.7 | 11% | 0.11 | 34% | 0.339 | C | S | . | . | S | Bend | trans | -136.2 | 142.4 | 175.3 | -51.5 | -82.4 | 0 | 0 | 0 | 111.4 | A205 L209 C233 M236 N238 | A205-Y240 PolarHBondContact O-OH 3.07Å; L209-Y240 HydrophobicContact CB-CD1 4.09Å; L209-Y240 HydrophobicContact CB-CD2 4.16Å; L209-Y240 HydrophobicContact CB-CE1 3.82Å; L209-Y240 HydrophobicContact CB-CE2 3.93Å; L209-Y240 HydrophobicContact CB-CG 4.23Å; L209-Y240 HydrophobicContact CD1-CD1 4.25Å; L209-Y240 HydrophobicContact CD1-CD2 4.16Å; L209-Y240 HydrophobicContact CD1-CG 3.88Å; L209-Y240 HydrophobicContact CD2-CD1 3.74Å; L209-Y240 HydrophobicContact CD2-CE1 4.02Å; L209-Y240 HydrophobicContact CD2-CG 4.23Å; L209-Y240 HydrophobicContact CG-CD1 4.25Å; L209-Y240 HydrophobicContact CG-CE1 4.42Å; L209-Y240 HydrophobicContact CG-CG 4.34Å; C233-Y240 PolarHBondContact SG-O 3.41Å; M236-Y240 HydrophobicContact CB-CD2 4.14Å; M236-Y240 HydrophobicContact CE-CD2 3.98Å; M236-Y240 HydrophobicContact SD-CD2 3.58Å; M236-Y240 VanDerWaalsContact SD-CD2 3.58Å; M236-Y240 HydrophobicContact SD-CE2 3.91Å; N238-Y240 PolarHBondContact O-N 3.15Å; N238-Y240 VanDerWaalsContact O-N 3.1Å |
| 241 | S | 97.6 | Very high | 96.3 | Very high | 57 Ų | 57 | 71.6 Ų | 71.6 | 40% | 0.399 | 34% | 0.339 | S | S | . | . | trans | -79.3 | 156.5 | 171.9 | 60.9 | 0 | 0 | 0 | 0 | 112.6 | C233 R243 Q244 L245 | C233-S241 VanDerWaalsContact SG-C 3.6Å; S241-R243 PolarHBondContact O-N 2.84Å; S241-R243 VanDerWaalsContact O-N 3.07Å; S241-Q244 WeakPolarHBondContact O-CA 3.2Å; S241-Q244 WeakPolarHBondContact O-CB 3.25Å; S241-Q244 PolarHBondContact O-N 3.12Å; S241-Q244 WeakPolarHBondContact OG-CG 3.28Å; S241-Q244 PolarHBondContact OG-N 3.3Å; S241-Q244 PolarHBondContact OG-OE1 2.96Å; S241-L245 PolarHBondContact O-N 2.9Å; S241-L245 VanDerWaalsContact O-N 3.09Å | ||
| 242 | N | 97.9 | Very high | 96.5 | Very high | 73 Ų | 73 | 67.1 Ų | 67.1 | 39% | 0.39 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -49.2 | -38.9 | 172.3 | -64 | -3.4 | 0 | 0 | 0 | 112 | V229 C233 Q244 L245 L246 | V229-N242 HydrophobicContact CG1-CB 3.8Å; C233-N242 PolarHBondContact SG-OD1 2.87Å; C233-N242 VanDerWaalsContact SG-OD1 3.32Å; N242-Q244 PolarHBondContact O-N 2.88Å; N242-L245 PolarHBondContact O-N 3.5Å; N242-L246 WeakPolarHBondContact O-CG 3.32Å; N242-L246 PolarHBondContact O-N 3.41Å |
| 243 | R | 98.1 | Very high | 96.6 | Very high | 167 Ų | 167 | 68.2 Ų | 68.2 | 63% | 0.63 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -65.8 | -36.7 | 178.3 | -170.4 | 180 | -175.6 | -172.1 | 4.7 | 112.6 | S241 R247 | S241-R243 PolarHBondContact O-N 2.84Å; S241-R243 VanDerWaalsContact O-N 3.07Å; R243-R247 VanDerWaalsContact O-CB 3.32Å; R243-R247 WeakPolarHBondContact O-CB 3.3Å; R243-R247 WeakPolarHBondContact O-CD 3.33Å; R243-R247 WeakPolarHBondContact O-CG 3.45Å; R243-R247 PolarHBondContact O-N 2.91Å; R243-R247 VanDerWaalsContact O-N 3.1Å |
| 244 | Q | 97.9 | Very high | 96.7 | Very high | 79 Ų | 79 | 72.6 Ų | 72.6 | 37% | 0.369 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -70.4 | -41.2 | 176.5 | -75.4 | 163.7 | -57.8 | 0 | 0 | 111.1 | L209 S241 N242 R247 M248 | L209-Q244 HydrophobicContact CD2-CB 4.4Å; S241-Q244 WeakPolarHBondContact O-CA 3.2Å; S241-Q244 WeakPolarHBondContact O-CB 3.25Å; S241-Q244 PolarHBondContact O-N 3.12Å; S241-Q244 WeakPolarHBondContact OG-CG 3.28Å; S241-Q244 PolarHBondContact OG-N 3.3Å; S241-Q244 PolarHBondContact OG-OE1 2.96Å; N242-Q244 PolarHBondContact O-N 2.88Å; Q244-R247 PolarHBondContact O-N 3.12Å; Q244-M248 PolarHBondContact O-N 3.35Å |
| 245 | L | 98.3 | Very high | 96.9 | Very high | 0 Ų | 0 | 69.3 Ų | 69.3 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.8 | -54.3 | 175.5 | -168.4 | 157.6 | 0 | 0 | 0 | 111.2 | L209 V212 V213 F216 V229 L232 M236 S241 N242 R247 M248 E249 | L209-L245 HydrophobicContact CD1-CB 4.14Å; L209-L245 HydrophobicContact CD1-CG 4.33Å; V212-L245 HydrophobicContact CG1-CD1 4.42Å; V213-L245 HydrophobicContact CG2-CD2 4.21Å; V213-L245 HydrophobicContact CG2-CG 4.04Å; F216-L245 HydrophobicContact CD1-CD2 4.2Å; F216-L245 HydrophobicContact CE1-CD2 4.42Å; V229-L245 HydrophobicContact CG1-CB 4.3Å; V229-L245 HydrophobicContact CG1-CD1 4.13Å; V229-L245 HydrophobicContact CG1-CD2 4.04Å; V229-L245 HydrophobicContact CG1-CG 4.38Å; L232-L245 HydrophobicContact CB-CD1 3.73Å; L232-L245 HydrophobicContact CD1-CD1 4.07Å; M236-L245 HydrophobicContact CE-CD1 4.06Å; S241-L245 PolarHBondContact O-N 2.9Å; S241-L245 VanDerWaalsContact O-N 3.09Å; N242-L245 PolarHBondContact O-N 3.5Å; L245-R247 PolarHBondContact O-N 3Å; L245-M248 PolarHBondContact O-N 3.38Å; L245-E249 PolarHBondContact O-N 3.2Å |
| 246 | L | 98.4 | Very high | 97 | Very high | 63 Ų | 63 | 66.8 Ų | 66.8 | 33% | 0.33 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -63.4 | -28.5 | 178.8 | -66.4 | 174.1 | 0 | 0 | 0 | 113.4 | V229 N242 E249 R250 | V229-L246 HydrophobicContact CG2-CD2 4.16Å; N242-L246 WeakPolarHBondContact O-CG 3.32Å; N242-L246 PolarHBondContact O-N 3.41Å; L246-E249 WeakPolarHBondContact CD2-OE2 3.25Å; L246-R250 PolarHBondContact O-N 2.94Å; L246-R250 VanDerWaalsContact O-N 3.16Å |
| 247 | R | 98.3 | Very high | 97.2 | Very high | 125 Ų | 125 | 75.1 Ų | 75.1 | 47% | 0.472 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -70.2 | -43.3 | 172.1 | -83 | 172.4 | 170.6 | 169.7 | -8.6 | 111.9 | R243 Q244 L245 E249 R251 | R243-R247 VanDerWaalsContact O-CB 3.32Å; R243-R247 WeakPolarHBondContact O-CB 3.3Å; R243-R247 WeakPolarHBondContact O-CD 3.33Å; R243-R247 WeakPolarHBondContact O-CG 3.45Å; R243-R247 PolarHBondContact O-N 2.91Å; R243-R247 VanDerWaalsContact O-N 3.1Å; Q244-R247 PolarHBondContact O-N 3.12Å; L245-R247 PolarHBondContact O-N 3Å; R247-E249 VanDerWaalsContact C-N 3.34Å; R247-R251 PolarHBondContact O-N 3.44Å; R247-R251 VanDerWaalsContact O-N 3.12Å |
| 248 | M | 98.3 | Very high | 97.3 | Very high | 12 Ų | 12 | 73.4 Ų | 73.4 | 6% | 0.059 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -65.7 | -40.8 | 176.3 | -177.9 | 66.8 | 84.3 | 0 | 0 | 110.5 | V202 K206 L209 L210 V213 Q244 L245 R250 R251 V252 | V202-M248 HydrophobicContact CG1-CE 4.27Å; V202-M248 HydrophobicContact CG2-CE 4.45Å; K206-M248 HydrophobicContact CB-CE 4.44Å; L209-M248 HydrophobicContact CD2-CB 3.99Å; L209-M248 HydrophobicContact CD2-CE 4.07Å; L209-M248 HydrophobicContact CD2-CG 4.4Å; L209-M248 HydrophobicContact CG-CB 4.1Å; L209-M248 HydrophobicContact CG-CE 4.4Å; L209-M248 HydrophobicContact CG-CG 4.2Å; L210-M248 HydrophobicContact CD1-SD 4.13Å; V213-M248 HydrophobicContact CB-CG 4.19Å; V213-M248 HydrophobicContact CG1-CG 4.29Å; V213-M248 HydrophobicContact CG2-CB 3.96Å; V213-M248 HydrophobicContact CG2-CG 3.89Å; Q244-M248 PolarHBondContact O-N 3.35Å; L245-M248 PolarHBondContact O-N 3.38Å; M248-R250 PolarHBondContact O-N 2.73Å; M248-R251 WeakPolarHBondContact O-CB 3.43Å; M248-R251 PolarHBondContact O-N 3.38Å; M248-R251 VanDerWaalsContact O-N 3.12Å; M248-V252 HydrophobicContact CG-CG2 4.4Å; M248-V252 WeakPolarHBondContact O-CG2 3.36Å; M248-V252 PolarHBondContact O-N 3.14Å |
| 249 | E | 98.5 | Very high | 97.4 | Very high | 17 Ų | 17 | 72 Ų | 72 | 8% | 0.079 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -54.1 | -54.3 | 173.7 | -178.9 | -177.9 | -122.7 | 0 | 0 | 112.6 | V213 L217 K220 L245 L246 R247 R251 V252 L253 | V213-E249 VanDerWaalsContact CG1-CA 3.47Å; V213-E249 HydrophobicContact CG1-CB 4.05Å; L217-E249 HydrophobicContact CD2-CG 3.81Å; L217-E249 HydrophobicContact CG-CG 4.28Å; K220-E249 IonicContact NZ-OE1 3.09Å; K220-E249 PolarHBondContact NZ-OE1 3.3Å; K220-E249 IonicContact NZ-OE2 2.63Å; L245-E249 PolarHBondContact O-N 3.2Å; L246-E249 WeakPolarHBondContact CD2-OE2 3.25Å; R247-E249 VanDerWaalsContact C-N 3.34Å; E249-R251 PolarHBondContact O-N 2.9Å; E249-V252 PolarHBondContact O-N 2.99Å; E249-V252 VanDerWaalsContact O-N 3.14Å; E249-L253 HydrophobicContact CG-CD1 4.23Å; E249-L253 PolarHBondContact O-N 2.88Å |
| 250 | R | 98.4 | Very high | 97.5 | Very high | 147 Ų | 147 | 70.9 Ų | 70.9 | 56% | 0.555 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -57.4 | -39 | 176.6 | -75.9 | -171.8 | -66.2 | -115.8 | -6.5 | 112.2 | L246 M248 T254 | L246-R250 PolarHBondContact O-N 2.94Å; L246-R250 VanDerWaalsContact O-N 3.16Å; M248-R250 PolarHBondContact O-N 2.73Å; R250-T254 WeakPolarHBondContact O-CB 3.45Å; R250-T254 PolarHBondContact O-N 2.95Å; R250-T254 PolarHBondContact O-OG1 2.87Å |
| 251 | R | 98.2 | Very high | 97.1 | Very high | 89 Ų | 89 | 72.1 Ų | 72.1 | 34% | 0.336 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.8 | -47.9 | 177 | -172.9 | -179.6 | -176.3 | -160.8 | -2.5 | 111 | I200 K201 R247 M248 E249 L253 T254 E255 | I200-R251 HydrophobicContact CG2-CG 4.41Å; K201-R251 PolarHBondContact O-NH1 3.23Å; K201-R251 PolarHBondContact O-NH2 3.28Å; R247-R251 PolarHBondContact O-N 3.44Å; R247-R251 VanDerWaalsContact O-N 3.12Å; M248-R251 WeakPolarHBondContact O-CB 3.43Å; M248-R251 PolarHBondContact O-N 3.38Å; M248-R251 VanDerWaalsContact O-N 3.12Å; E249-R251 PolarHBondContact O-N 2.9Å; R251-L253 PolarHBondContact O-N 3.47Å; R251-T254 PolarHBondContact O-N 3.26Å; R251-E255 HydrophobicContact CG-CG 4.17Å; R251-E255 WeakPolarHBondContact O-CB 3.42Å; R251-E255 WeakPolarHBondContact O-CG 3.47Å; R251-E255 PolarHBondContact O-N 2.86Å |
| 252 | V | 98.4 | Very high | 96.8 | Very high | 0 Ų | 0 | 71.9 Ų | 71.9 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.7 | -49.9 | 177.6 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | I200 L210 V213 L217 M248 E249 T254 E255 L256 | I200-V252 HydrophobicContact CD1-CB 4.35Å; I200-V252 HydrophobicContact CD1-CG2 3.81Å; L210-V252 HydrophobicContact CD1-CG2 3.61Å; V213-V252 HydrophobicContact CG1-CB 4.11Å; V213-V252 HydrophobicContact CG1-CG2 3.75Å; L217-V252 HydrophobicContact CD1-CB 3.93Å; L217-V252 HydrophobicContact CD1-CG1 3.42Å; L217-V252 VanDerWaalsContact CD1-CG1 3.42Å; M248-V252 HydrophobicContact CG-CG2 4.4Å; M248-V252 WeakPolarHBondContact O-CG2 3.36Å; M248-V252 PolarHBondContact O-N 3.14Å; E249-V252 PolarHBondContact O-N 2.99Å; E249-V252 VanDerWaalsContact O-N 3.14Å; V252-T254 VanDerWaalsContact C-N 3.3Å; V252-T254 PolarHBondContact O-N 3.11Å; V252-E255 PolarHBondContact O-N 3.4Å; V252-L256 HydrophobicContact CG1-CD1 3.71Å; V252-L256 HydrophobicContact CG1-CG 4.24Å; V252-L256 WeakPolarHBondContact O-CB 3.29Å; V252-L256 VanDerWaalsContact O-CG 3.3Å; V252-L256 WeakPolarHBondContact O-CG 3.39Å; V252-L256 PolarHBondContact O-N 3.46Å |
| 253 | L | 98.4 | Very high | 96.4 | Very high | 27 Ų | 27 | 69 Ų | 69 | 14% | 0.141 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59.8 | -40.2 | 178.4 | -72.6 | 171.5 | 0 | 0 | 0 | 112.8 | L217 E249 R251 K257 F258 L260 | L217-L253 HydrophobicContact CD1-CD2 4.12Å; L217-L253 HydrophobicContact CD1-CG 4.1Å; L217-L253 HydrophobicContact CD2-CD1 4.03Å; L217-L253 HydrophobicContact CD2-CD2 3.82Å; L217-L253 HydrophobicContact CD2-CG 3.93Å; E249-L253 HydrophobicContact CG-CD1 4.23Å; E249-L253 PolarHBondContact O-N 2.88Å; R251-L253 PolarHBondContact O-N 3.47Å; L253-K257 PolarHBondContact O-N 3.4Å; L253-F258 HydrophobicContact CB-CD1 4.34Å; L253-F258 HydrophobicContact CB-CE1 4Å; L253-F258 HydrophobicContact CB-CE2 4.28Å; L253-F258 HydrophobicContact CB-CZ 3.96Å; L253-F258 HydrophobicContact CD1-CE1 3.97Å; L253-F258 HydrophobicContact CD1-CZ 4.43Å; L253-F258 HydrophobicContact CD2-CD1 3.98Å; L253-F258 HydrophobicContact CD2-CE1 4.16Å; L253-F258 HydrophobicContact CG-CE1 4.28Å; L253-F258 PolarHBondContact O-N 3.36Å; L253-L260 HydrophobicContact CD2-CD1 4.03Å; L253-L260 HydrophobicContact CD2-CD2 4.33Å |
| 254 | T | 97.9 | Very high | 96.2 | Very high | 94 Ų | 94 | 61.3 Ų | 61.3 | 58% | 0.577 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -67 | -47.1 | 179.6 | -56.2 | 0 | 0 | 0 | 0 | 111.4 | R250 R251 V252 K257 | R250-T254 WeakPolarHBondContact O-CB 3.45Å; R250-T254 PolarHBondContact O-N 2.95Å; R250-T254 PolarHBondContact O-OG1 2.87Å; R251-T254 PolarHBondContact O-N 3.26Å; V252-T254 VanDerWaalsContact C-N 3.3Å; V252-T254 PolarHBondContact O-N 3.11Å; T254-K257 PolarHBondContact O-N 3.03Å; T254-K257 VanDerWaalsContact O-N 3.12Å |
| 255 | E | 97.2 | Very high | 96.1 | Very high | 79 Ų | 79 | 57.9 Ų | 57.9 | 37% | 0.369 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -68.2 | -39.1 | -177.8 | -63.4 | -75.9 | -177.1 | 0 | 0 | 111.2 | Q199 I200 R251 V252 K257 | Q199-E255 PolarHBondContact OE1-O 2.74Å; I200-E255 HydrophobicContact CD1-CB 3.98Å; I200-E255 HydrophobicContact CD1-CG 4.08Å; I200-E255 HydrophobicContact CG1-CB 3.85Å; I200-E255 HydrophobicContact CG1-CG 3.88Å; R251-E255 HydrophobicContact CG-CG 4.17Å; R251-E255 WeakPolarHBondContact O-CB 3.42Å; R251-E255 WeakPolarHBondContact O-CG 3.47Å; R251-E255 PolarHBondContact O-N 2.86Å; V252-E255 PolarHBondContact O-N 3.4Å; E255-K257 PolarHBondContact O-N 3.09Å |
| 256 | L | 96 | Very high | 96 | Very high | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.005 | 27% | 0.268 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -1 | 174 | -62.2 | -176.4 | 0 | 0 | 0 | 113.5 | L192 R195 V252 F258 E259 L260 | L192-L256 HydrophobicContact CD2-CD1 3.74Å; R195-L256 HydrophobicContact CB-CD2 3.78Å; V252-L256 HydrophobicContact CG1-CD1 3.71Å; V252-L256 HydrophobicContact CG1-CG 4.24Å; V252-L256 WeakPolarHBondContact O-CB 3.29Å; V252-L256 VanDerWaalsContact O-CG 3.3Å; V252-L256 WeakPolarHBondContact O-CG 3.39Å; V252-L256 PolarHBondContact O-N 3.46Å; L256-F258 PolarHBondContact O-N 3.45Å; L256-F258 VanDerWaalsContact O-N 3.15Å; L256-E259 VanDerWaalsContact O-CB 3.28Å; L256-E259 WeakPolarHBondContact O-CB 3.19Å; L256-E259 PolarHBondContact O-N 2.98Å; L256-L260 HydrophobicContact CD1-CD2 3.99Å |
| 257 | K | 96.4 | Very high | 95.8 | Very high | 179 Ų | 179 | 57 Ų | 57 | 78% | 0.778 | 26% | 0.263 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.6 | 38 | -176.9 | -54.5 | 178 | -176.5 | 176.6 | 0 | 113.1 | L253 T254 E255 E259 | L253-K257 PolarHBondContact O-N 3.4Å; T254-K257 PolarHBondContact O-N 3.03Å; T254-K257 VanDerWaalsContact O-N 3.12Å; E255-K257 PolarHBondContact O-N 3.09Å; K257-E259 PolarHBondContact O-N 3.46Å; K257-E259 VanDerWaalsContact O-N 3.08Å |
| 258 | F | 96.8 | Very high | 95.7 | Very high | 144 Ų | 144 | 51.1 Ų | 51.1 | 63% | 0.632 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 58.2 | 13.7 | -175.8 | -67.2 | -100.8 | 0 | 0 | 0 | 115.2 | L253 L256 L260 | L253-F258 HydrophobicContact CB-CD1 4.34Å; L253-F258 HydrophobicContact CB-CE1 4Å; L253-F258 HydrophobicContact CB-CE2 4.28Å; L253-F258 HydrophobicContact CB-CZ 3.96Å; L253-F258 HydrophobicContact CD1-CE1 3.97Å; L253-F258 HydrophobicContact CD1-CZ 4.43Å; L253-F258 HydrophobicContact CD2-CD1 3.98Å; L253-F258 HydrophobicContact CD2-CE1 4.16Å; L253-F258 HydrophobicContact CG-CE1 4.28Å; L253-F258 PolarHBondContact O-N 3.36Å; L256-F258 PolarHBondContact O-N 3.45Å; L256-F258 VanDerWaalsContact O-N 3.15Å; F258-L260 PolarHBondContact O-N 3.33Å; F258-L260 VanDerWaalsContact O-N 3.08Å |
| 259 | E | 94.3 | Very high | 95.7 | Very high | 79 Ų | 79 | 50.5 Ų | 50.5 | 37% | 0.369 | 24% | 0.238 | S | C | . | . | trans | -83.7 | 88.3 | 178.7 | -171.4 | 179.9 | -141.9 | 0 | 0 | 109.9 | F149 R195 L256 K257 | F149-E259 HydrophobicContact CE1-CG 4.04Å; F149-E259 VanDerWaalsContact CE1-OE1 3.25Å; F149-E259 WeakPolarHBondContact CE1-OE1 3.37Å; F149-E259 VanDerWaalsContact CE1-OE2 3.31Å; F149-E259 WeakPolarHBondContact CE1-OE2 3.33Å; F149-E259 HydrophobicContact CZ-CG 3.73Å; F149-E259 WeakPolarHBondContact CZ-OE1 3.16Å; R195-E259 IonicContact CZ-OE2 3.89Å; R195-E259 PolarHBondContact NH1-O 2.93Å; R195-E259 IonicContact NH1-OE2 2.81Å; R195-E259 IonicContact NH2-OE2 3.04Å; R195-E259 PolarHBondContact NH2-OE2 2.93Å; L256-E259 VanDerWaalsContact O-CB 3.28Å; L256-E259 WeakPolarHBondContact O-CB 3.19Å; L256-E259 PolarHBondContact O-N 2.98Å; K257-E259 PolarHBondContact O-N 3.46Å; K257-E259 VanDerWaalsContact O-N 3.08Å | ||
| 260 | L | 94.8 | Very high | 95.6 | Very high | 29 Ų | 29 | 50.1 Ų | 50.1 | 15% | 0.152 | 24% | 0.236 | C | C | . | . | trans | -102.5 | 13.5 | -179.6 | -50.5 | -178.3 | 0 | 0 | 0 | 112.8 | L188 L192 K221 L253 L256 F258 | L188-L260 WeakPolarHBondContact CD1-O 3.2Å; L192-L260 HydrophobicContact CD1-CD2 4.2Å; L192-L260 HydrophobicContact CD2-CB 4.48Å; L192-L260 HydrophobicContact CD2-CD2 3.69Å; K221-L260 HydrophobicContact CD-CB 4.06Å; K221-L260 WeakPolarHBondContact CE-O 3.31Å; K221-L260 PolarHBondContact NZ-O 2.98Å; L253-L260 HydrophobicContact CD2-CD1 4.03Å; L253-L260 HydrophobicContact CD2-CD2 4.33Å; L256-L260 HydrophobicContact CD1-CD2 3.99Å; F258-L260 PolarHBondContact O-N 3.33Å; F258-L260 VanDerWaalsContact O-N 3.08Å | ||
| 261 | S | 89.2 | Confident | 95.5 | Very high | 54 Ų | 54 | 43.1 Ų | 43.1 | 38% | 0.378 | 21% | 0.21 | S | C | . | . | trans | -71.7 | 128.2 | 178 | 54 | 0 | 0 | 0 | 0 | 110.8 | F149 | F149-S261 WeakPolarHBondContact CE2-O 3.38Å; F149-S261 WeakPolarHBondContact CE2-OG 3.29Å | ||
| 262 | H | 91.1 | Very high | 95.4 | Very high | 51 Ų | 51 | 39 Ų | 39 | 24% | 0.236 | 19% | 0.194 | C | C | . | . | trans | -147.3 | 125.6 | 173.2 | -178.3 | 53.3 | 0 | 0 | 0 | 109.1 | L188 H191 S264 | L188-H262 HydrophobicContact CD1-CB 3.71Å; H191-H262 HydrophobicContact CB-CB 4.47Å; H191-H262 AromaticContact CD2-CG 3.59Å; H191-H262 AromaticContact CD2-ND1 3.6Å; H191-H262 AromaticContact CE1-ND1 3.49Å; H191-H262 PolarHBondContact CE1-ND1 3.24Å; H191-H262 AromaticContact CG-CD2 3.88Å; H191-H262 AromaticContact CG-CE1 3.66Å; H191-H262 AromaticContact CG-CG 3.45Å; H191-H262 VanDerWaalsContact CG-CG 3.45Å; H191-H262 AromaticContact CG-ND1 3.3Å; H191-H262 VanDerWaalsContact CG-ND1 3.3Å; H191-H262 AromaticContact CG-NE2 3.99Å; H191-H262 AromaticContact ND1-CE1 3.43Å; H191-H262 PolarHBondContact ND1-CE1 3.15Å; H191-H262 AromaticContact ND1-CG 3.9Å; H191-H262 AromaticContact ND1-ND1 3.23Å; H191-H262 PolarHBondContact ND1-ND1 3.23Å; H191-H262 AromaticContact NE2-ND1 3.72Å; H262-S264 PolarHBondContact O-N 3.15Å | ||
| 263 | C | 90.4 | Very high | 95.3 | Very high | 14 Ų | 14 | 39.2 Ų | 39.2 | 10% | 0.095 | 20% | 0.196 | C | C | . | . | trans | -84.2 | 102.3 | 169.1 | -170.2 | 0 | 0 | 0 | 0 | 108.5 | F268 | C263-F268 HydrophobicContact CB-CE2 4.43Å; C263-F268 WeakPolarHBondContact SG-CE2 3.43Å | ||
| 264 | S | 92.6 | Very high | 95.1 | Very high | 4 Ų | 4 | 39.3 Ų | 39.3 | 3% | 0.028 | 20% | 0.199 | C | C | . | . | trans | -61.2 | 138.1 | -177.7 | 178.3 | 0 | 0 | 0 | 0 | 111.6 | Y187 H262 L266 H267 | Y187-S264 WeakPolarHBondContact CB-OG 3.4Å; H262-S264 PolarHBondContact O-N 3.15Å; S264-L266 PolarHBondContact O-N 2.8Å; S264-L266 VanDerWaalsContact OG-CB 3.31Å; S264-L266 WeakPolarHBondContact OG-CB 3.49Å; S264-L266 PolarHBondContact OG-N 3.44Å; S264-L266 VanDerWaalsContact OG-N 3.12Å; S264-H267 PolarHBondContact O-N 3.32Å | ||
| 265 | P | 95.9 | Very high | 95 | Very high | 7 Ų | 7 | 34.9 Ų | 34.9 | 5% | 0.045 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.1 | -21.8 | 169.9 | 27.7 | -35.5 | 0 | 0 | 0 | 112.6 | Y187 H267 F268 L269 L290 A304 L307 A308 | Y187-P265 HydrophobicContact CD1-CG 3.64Å; Y187-P265 HydrophobicContact CE1-CG 3.71Å; P265-H267 VanDerWaalsContact C-N 3.31Å; P265-H267 PolarHBondContact O-N 3.38Å; P265-F268 PolarHBondContact O-N 3.02Å; P265-L269 PolarHBondContact O-N 3.06Å; P265-L290 HydrophobicContact CB-CD1 3.9Å; P265-L290 HydrophobicContact CB-CD2 3.98Å; P265-L290 HydrophobicContact CB-CG 4.44Å; P265-L290 HydrophobicContact CG-CD1 4.17Å; P265-L290 HydrophobicContact CG-CD2 4.16Å; P265-L290 HydrophobicContact CG-CG 4.44Å; P265-A304 HydrophobicContact CB-CB 3.96Å; P265-A304 WeakPolarHBondContact CB-O 3.43Å; P265-L307 HydrophobicContact CB-CB 4.25Å; P265-A308 WeakPolarHBondContact O-CB 3.47Å |
| 266 | L | 96.7 | Very high | 94.8 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59.5 | -41.7 | 175.2 | -176.9 | 63.5 | 0 | 0 | 0 | 111.7 | E183 Y187 S264 F268 L269 L270 R287 | E183-L266 HydrophobicContact CB-CD2 3.41Å; E183-L266 VanDerWaalsContact CB-CD2 3.41Å; E183-L266 HydrophobicContact CG-CD2 4.34Å; Y187-L266 HydrophobicContact CD2-CB 4.01Å; Y187-L266 HydrophobicContact CD2-CD2 4.32Å; Y187-L266 HydrophobicContact CE2-CB 3.89Å; Y187-L266 HydrophobicContact CE2-CD2 4.21Å; Y187-L266 HydrophobicContact CE2-CG 4.44Å; S264-L266 PolarHBondContact O-N 2.8Å; S264-L266 VanDerWaalsContact OG-CB 3.31Å; S264-L266 WeakPolarHBondContact OG-CB 3.49Å; S264-L266 PolarHBondContact OG-N 3.44Å; S264-L266 VanDerWaalsContact OG-N 3.12Å; L266-F268 PolarHBondContact O-N 3.46Å; L266-L269 WeakPolarHBondContact O-CB 3.33Å; L266-L269 PolarHBondContact O-N 3.17Å; L266-L269 VanDerWaalsContact O-N 3.12Å; L266-L270 HydrophobicContact CD1-CD1 4.33Å; L266-L270 HydrophobicContact CD1-CD2 4.35Å; L266-L270 HydrophobicContact CD1-CG 4.17Å; L266-L270 HydrophobicContact CG-CD1 4.14Å; L266-L270 HydrophobicContact CG-CG 4.32Å; L266-L270 WeakPolarHBondContact O-CG 3.25Å; L266-L270 PolarHBondContact O-N 3.15Å; L266-R287 HydrophobicContact CD1-CG 4.12Å |
| 267 | H | 95 | Very high | 94.6 | Very high | 45 Ų | 45 | 37.4 Ų | 37.4 | 21% | 0.208 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62 | -45.2 | 179.9 | -60.7 | 147.1 | 0 | 0 | 0 | 111.6 | M142 S264 P265 L269 L270 L271 | M142-H267 HydrophobicContact CE-CB 3.58Å; S264-H267 PolarHBondContact O-N 3.32Å; P265-H267 VanDerWaalsContact C-N 3.31Å; P265-H267 PolarHBondContact O-N 3.38Å; H267-L269 VanDerWaalsContact C-N 3.29Å; H267-L269 PolarHBondContact O-N 3.35Å; H267-L270 PolarHBondContact O-N 3.1Å; H267-L271 WeakPolarHBondContact O-CB 3.47Å; H267-L271 WeakPolarHBondContact O-CD1 3.11Å; H267-L271 VanDerWaalsContact O-CG 3.25Å; H267-L271 WeakPolarHBondContact O-CG 3.46Å; H267-L271 PolarHBondContact O-N 3.34Å |
| 268 | F | 96.1 | Very high | 94.5 | Very high | 1 Ų | 1 | 30 Ų | 30 | 0% | 0.004 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.2 | -39.3 | 174.6 | -68.7 | -69.3 | 0 | 0 | 0 | 111.8 | F139 M142 M143 Q146 C263 P265 L266 S272 A304 A305 A308 | F139-F268 HydrophobicContact CE2-CE1 4.46Å; M142-F268 HydrophobicContact CB-CE1 4.28Å; M142-F268 HydrophobicContact CB-CZ 3.98Å; M142-F268 HydrophobicContact CE-CD1 4.49Å; M142-F268 HydrophobicContact CE-CE1 4.23Å; M142-F268 HydrophobicContact CE-CZ 4.33Å; M143-F268 HydrophobicContact CG-CE1 4.32Å; M143-F268 HydrophobicContact SD-CD1 4.25Å; M143-F268 HydrophobicContact SD-CE1 3.43Å; M143-F268 WeakPolarHBondContact SD-CE1 3.29Å; M143-F268 HydrophobicContact SD-CZ 4.09Å; Q146-F268 HydrophobicContact CB-CE2 4.38Å; C263-F268 HydrophobicContact CB-CE2 4.43Å; C263-F268 WeakPolarHBondContact SG-CE2 3.43Å; P265-F268 PolarHBondContact O-N 3.02Å; L266-F268 PolarHBondContact O-N 3.46Å; F268-S272 VanDerWaalsContact O-CB 3.29Å; F268-S272 WeakPolarHBondContact O-CB 3.45Å; F268-S272 PolarHBondContact O-N 3.29Å; F268-S272 PolarHBondContact O-OG 3.01Å; F268-A304 HydrophobicContact CD2-CB 3.78Å; F268-A304 HydrophobicContact CE2-CB 3.76Å; F268-A305 HydrophobicContact CD1-CB 3.97Å; F268-A305 HydrophobicContact CD2-CB 4.25Å; F268-A305 HydrophobicContact CE1-CB 4.2Å; F268-A305 HydrophobicContact CE2-CB 4.42Å; F268-A305 HydrophobicContact CG-CB 4Å; F268-A305 HydrophobicContact CZ-CB 4.4Å; F268-A308 HydrophobicContact CB-CB 3.62Å |
| 269 | L | 97.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -63.1 | -48.1 | 178.6 | -177 | 155.7 | 0 | 0 | 0 | 111.3 | P265 L266 H267 A273 V283 A286 R287 L290 A308 A311 | P265-L269 PolarHBondContact O-N 3.06Å; L266-L269 WeakPolarHBondContact O-CB 3.33Å; L266-L269 PolarHBondContact O-N 3.17Å; L266-L269 VanDerWaalsContact O-N 3.12Å; H267-L269 VanDerWaalsContact C-N 3.29Å; H267-L269 PolarHBondContact O-N 3.35Å; L269-A273 WeakPolarHBondContact O-CB 3.49Å; L269-A273 PolarHBondContact O-N 3.49Å; L269-V283 HydrophobicContact CD2-CG1 3.99Å; L269-A286 HydrophobicContact CD1-CB 3.74Å; L269-A286 HydrophobicContact CD2-CB 4.17Å; L269-A286 HydrophobicContact CG-CB 4.13Å; L269-R287 HydrophobicContact CD2-CG 4.24Å; L269-L290 HydrophobicContact CB-CD2 4.17Å; L269-L290 HydrophobicContact CD1-CB 3.85Å; L269-L290 HydrophobicContact CD1-CD2 3.58Å; L269-L290 HydrophobicContact CD1-CG 4.28Å; L269-A308 HydrophobicContact CB-CB 3.82Å; L269-A311 HydrophobicContact CD1-CB 4.19Å |
| 270 | L | 96.9 | Very high | 94.4 | Very high | 9 Ų | 9 | 23.9 Ų | 23.9 | 5% | 0.047 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -67.1 | -40.1 | -179.2 | -60.2 | -177.5 | 0 | 0 | 0 | 111.8 | L126 L266 H267 A273 S274 V283 | L126-L270 HydrophobicContact CD1-CB 3.97Å; L126-L270 HydrophobicContact CD2-CB 4.31Å; L266-L270 HydrophobicContact CD1-CD1 4.33Å; L266-L270 HydrophobicContact CD1-CD2 4.35Å; L266-L270 HydrophobicContact CD1-CG 4.17Å; L266-L270 HydrophobicContact CG-CD1 4.14Å; L266-L270 HydrophobicContact CG-CG 4.32Å; L266-L270 WeakPolarHBondContact O-CG 3.25Å; L266-L270 PolarHBondContact O-N 3.15Å; H267-L270 PolarHBondContact O-N 3.1Å; L270-A273 PolarHBondContact O-N 3.42Å; L270-S274 VanDerWaalsContact O-CB 3.28Å; L270-S274 WeakPolarHBondContact O-CB 3.26Å; L270-S274 PolarHBondContact O-N 3.28Å; L270-V283 HydrophobicContact CD2-CG1 3.84Å |
| 271 | L | 95.7 | Very high | 94.4 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.1 | -55.2 | 174.9 | -74.1 | 166.1 | 0 | 0 | 0 | 111.3 | A122 M123 L126 L128 F139 M142 H267 A273 S274 I275 | A122-L271 HydrophobicContact CB-CD2 4.12Å; M123-L271 HydrophobicContact CB-CD2 4.39Å; M123-L271 HydrophobicContact CG-CD2 3.37Å; L126-L271 HydrophobicContact CD1-CD2 3.94Å; L126-L271 HydrophobicContact CD1-CG 4.25Å; L128-L271 HydrophobicContact CD1-CD2 4.16Å; L128-L271 HydrophobicContact CD1-CG 4.3Å; F139-L271 HydrophobicContact CD2-CD1 4.32Å; M142-L271 HydrophobicContact CE-CD1 3.79Å; M142-L271 HydrophobicContact SD-CD1 4.45Å; H267-L271 WeakPolarHBondContact O-CB 3.47Å; H267-L271 WeakPolarHBondContact O-CD1 3.11Å; H267-L271 VanDerWaalsContact O-CG 3.25Å; H267-L271 WeakPolarHBondContact O-CG 3.46Å; H267-L271 PolarHBondContact O-N 3.34Å; L271-A273 VanDerWaalsContact C-N 3.27Å; L271-A273 PolarHBondContact O-N 2.86Å; L271-S274 PolarHBondContact O-N 3.34Å; L271-S274 VanDerWaalsContact O-N 3.12Å; L271-I275 WeakPolarHBondContact O-CG1 3.25Å; L271-I275 PolarHBondContact O-N 2.94Å |
| 272 | S | 95.4 | Very high | 94.8 | Very high | 2 Ų | 2 | 23.8 Ų | 23.8 | 1% | 0.014 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -59.7 | -38.6 | 179.1 | -62.8 | 0 | 0 | 0 | 0 | 111.8 | F268 A276 A334 | F268-S272 VanDerWaalsContact O-CB 3.29Å; F268-S272 WeakPolarHBondContact O-CB 3.45Å; F268-S272 PolarHBondContact O-N 3.29Å; F268-S272 PolarHBondContact O-OG 3.01Å; S272-A276 WeakPolarHBondContact O-CB 3.28Å; S272-A276 PolarHBondContact O-N 2.97Å; S272-A334 WeakPolarHBondContact O-CB 3.47Å |
| 273 | A | 95.9 | Very high | 95.1 | Very high | 4 Ų | 4 | 22.2 Ų | 22.2 | 3% | 0.033 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -67.6 | -38.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L269 L270 L271 H277 C278 V283 L312 | L269-A273 WeakPolarHBondContact O-CB 3.49Å; L269-A273 PolarHBondContact O-N 3.49Å; L270-A273 PolarHBondContact O-N 3.42Å; L271-A273 VanDerWaalsContact C-N 3.27Å; L271-A273 PolarHBondContact O-N 2.86Å; A273-H277 PolarHBondContact O-N 2.57Å; A273-H277 VanDerWaalsContact O-N 3.15Å; A273-C278 HydrophobicContact CB-CB 4.13Å; A273-C278 PolarHBondContact O-N 3.41Å; A273-V283 HydrophobicContact CB-CG1 4.25Å; A273-V283 HydrophobicContact CB-CG2 3.86Å; A273-L312 HydrophobicContact CB-CD1 3.9Å; A273-L312 HydrophobicContact CB-CD2 4.29Å |
| 274 | S | 95.5 | Very high | 95.5 | Very high | 30 Ų | 30 | 24.8 Ų | 24.8 | 21% | 0.21 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -67 | -47.6 | 176.7 | -174.4 | 0 | 0 | 0 | 0 | 111.3 | L270 L271 A276 H277 | L270-S274 VanDerWaalsContact O-CB 3.28Å; L270-S274 WeakPolarHBondContact O-CB 3.26Å; L270-S274 PolarHBondContact O-N 3.28Å; L271-S274 PolarHBondContact O-N 3.34Å; L271-S274 VanDerWaalsContact O-N 3.12Å; S274-A276 VanDerWaalsContact C-N 3.31Å; S274-A276 PolarHBondContact O-N 3.28Å; S274-H277 PolarHBondContact O-N 2.99Å; S274-H277 VanDerWaalsContact O-N 3.11Å; S274-H277 PolarHBondContact O-ND1 3.48Å; S274-H277 VanDerWaalsContact O-ND1 3.12Å |
| 275 | I | 94.5 | Very high | 95.7 | Very high | 1 Ų | 1 | 24.6 Ų | 24.6 | 1% | 0.005 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.8 | -42.7 | 176.4 | -65.4 | 168.5 | 0 | 0 | 0 | 110.1 | L115 E118 A122 L271 H277 A330 V333 A334 I337 | L115-I275 HydrophobicContact CD1-CD1 4.47Å; E118-I275 HydrophobicContact CB-CG1 4.18Å; E118-I275 HydrophobicContact CB-CG2 3.95Å; E118-I275 HydrophobicContact CG-CG2 4.5Å; A122-I275 HydrophobicContact CB-CG1 3.8Å; L271-I275 WeakPolarHBondContact O-CG1 3.25Å; L271-I275 PolarHBondContact O-N 2.94Å; I275-H277 PolarHBondContact O-N 3.45Å; I275-A330 WeakPolarHBondContact O-CB 3.29Å; I275-V333 HydrophobicContact CG2-CB 4.05Å; I275-V333 HydrophobicContact CG2-CG1 3.97Å; I275-A334 HydrophobicContact CB-CB 4.13Å; I275-A334 HydrophobicContact CG2-CB 3.86Å; I275-I337 HydrophobicContact CD1-CD1 4.15Å |
| 276 | A | 93.3 | Very high | 95.9 | Very high | 7 Ų | 7 | 24.2 Ų | 24.2 | 6% | 0.058 | 13% | 0.132 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -0.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | S272 S274 C278 W331 A334 | S272-A276 WeakPolarHBondContact O-CB 3.28Å; S272-A276 PolarHBondContact O-N 2.97Å; S274-A276 VanDerWaalsContact C-N 3.31Å; S274-A276 PolarHBondContact O-N 3.28Å; A276-C278 PolarHBondContact O-N 3.39Å; A276-W331 HydrophobicContact CB-CE3 3.71Å; A276-W331 HydrophobicContact CB-CZ3 4.26Å; A276-A334 HydrophobicContact CB-CB 3.81Å |
| 277 | H | 92.8 | Very high | 96 | Very high | 125 Ų | 125 | 25.8 Ų | 25.8 | 58% | 0.579 | 14% | 0.138 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 49.8 | 40.6 | -174.6 | -54.3 | -41 | 0 | 0 | 0 | 113.5 | A273 S274 I275 | A273-H277 PolarHBondContact O-N 2.57Å; A273-H277 VanDerWaalsContact O-N 3.15Å; S274-H277 PolarHBondContact O-N 2.99Å; S274-H277 VanDerWaalsContact O-N 3.11Å; S274-H277 PolarHBondContact O-ND1 3.48Å; S274-H277 VanDerWaalsContact O-ND1 3.12Å; I275-H277 PolarHBondContact O-N 3.45Å |
| 278 | C | 93.2 | Very high | 96.1 | Very high | 23 Ų | 23 | 23.6 Ų | 23.6 | 16% | 0.155 | 13% | 0.128 | C | C | . | . | trans | -65.6 | 143.5 | -178.7 | -73.1 | 0 | 0 | 0 | 0 | 111.5 | A273 A276 V282 V283 | A273-C278 HydrophobicContact CB-CB 4.13Å; A273-C278 PolarHBondContact O-N 3.41Å; A276-C278 PolarHBondContact O-N 3.39Å; C278-V282 HydrophobicContact CB-CB 4.15Å; C278-V282 HydrophobicContact CB-CG1 3.85Å; C278-V283 HydrophobicContact CB-CG2 4.11Å | ||
| 279 | S | 94.1 | Very high | 96.2 | Very high | 39 Ų | 39 | 23.6 Ų | 23.6 | 27% | 0.273 | 13% | 0.128 | S | C | . | . | trans | -63.1 | 154.8 | 173.7 | 89.6 | 0 | 0 | 0 | 0 | 111.4 | K281 V282 V283 E321 | S279-K281 PolarHBondContact O-N 3.32Å; S279-K281 VanDerWaalsContact O-N 3.11Å; S279-K281 PolarHBondContact OG-N 3.25Å; S279-V282 WeakPolarHBondContact O-CB 3.3Å; S279-V282 PolarHBondContact O-N 3.13Å; S279-V282 PolarHBondContact OG-N 3.02Å; S279-V283 VanDerWaalsContact O-CG2 3.32Å; S279-V283 WeakPolarHBondContact O-CG2 3.24Å; S279-V283 PolarHBondContact O-N 3.22Å; S279-E321 WeakPolarHBondContact CB-OE1 3Å; S279-E321 PolarHBondContact OG-OE1 3.38Å | ||
| 280 | A | 95.4 | Very high | 96.3 | Very high | 56 Ų | 56 | 23.6 Ų | 23.6 | 46% | 0.463 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -53.9 | -34.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | V283 W284 M377 | A280-V283 PolarHBondContact O-N 2.85Å; A280-W284 PolarHBondContact O-N 3.46Å; A280-M377 HydrophobicContact CB-CE 3.82Å; A280-M377 HydrophobicContact CB-SD 4.35Å |
| 281 | K | 96.2 | Very high | 96.4 | Very high | 81 Ų | 81 | 23.1 Ų | 23.1 | 35% | 0.352 | 13% | 0.125 | S | C | . | . | H | α-helix | trans | -68.6 | -39.8 | 179 | -166.2 | 178.7 | -179 | -172.6 | 0 | 111.6 | S279 W284 M285 L319 M377 V379 | S279-K281 PolarHBondContact O-N 3.32Å; S279-K281 VanDerWaalsContact O-N 3.11Å; S279-K281 PolarHBondContact OG-N 3.25Å; K281-W284 PolarHBondContact O-N 3.43Å; K281-M285 WeakPolarHBondContact O-CB 3.34Å; K281-M285 PolarHBondContact O-N 3.33Å; K281-L319 HydrophobicContact CB-CD1 4.46Å; K281-L319 HydrophobicContact CD-CD2 4.07Å; K281-L319 HydrophobicContact CG-CD1 4.08Å; K281-L319 HydrophobicContact CG-CD2 4.28Å; K281-M377 HydrophobicContact CB-SD 3.81Å; K281-M377 HydrophobicContact CG-SD 4.22Å; K281-V379 HydrophobicContact CG-CG1 4.39Å |
| 282 | V | 96.5 | Very high | 96.5 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -62.5 | -44.7 | 172.2 | 169.5 | 0 | 0 | 0 | 0 | 110.7 | C278 S279 W284 M285 A286 L312 R316 L319 E321 | C278-V282 HydrophobicContact CB-CB 4.15Å; C278-V282 HydrophobicContact CB-CG1 3.85Å; S279-V282 WeakPolarHBondContact O-CB 3.3Å; S279-V282 PolarHBondContact O-N 3.13Å; S279-V282 PolarHBondContact OG-N 3.02Å; V282-W284 PolarHBondContact O-N 3.3Å; V282-M285 PolarHBondContact O-N 3.46Å; V282-A286 WeakPolarHBondContact O-CB 3.49Å; V282-A286 PolarHBondContact O-N 3.48Å; V282-L312 HydrophobicContact CG1-CD1 3.81Å; V282-R316 HydrophobicContact CG1-CG 3.97Å; V282-R316 HydrophobicContact CG2-CG 4.47Å; V282-L319 HydrophobicContact CB-CD1 4.26Å; V282-L319 HydrophobicContact CG2-CD1 3.64Å; V282-E321 HydrophobicContact CG2-CG 4.11Å; V282-E321 WeakPolarHBondContact CG2-OE1 3.44Å; V282-E321 VanDerWaalsContact CG2-OE2 3.24Å; V282-E321 WeakPolarHBondContact CG2-OE2 3.37Å |
| 283 | V | 97.6 | Very high | 96.6 | Very high | 19 Ų | 19 | 23.9 Ų | 23.9 | 12% | 0.115 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -64.7 | -41.9 | 179.9 | -164.3 | 0 | 0 | 0 | 0 | 111.4 | L269 L270 A273 C278 S279 A280 A286 R287 | L269-V283 HydrophobicContact CD2-CG1 3.99Å; L270-V283 HydrophobicContact CD2-CG1 3.84Å; A273-V283 HydrophobicContact CB-CG1 4.25Å; A273-V283 HydrophobicContact CB-CG2 3.86Å; C278-V283 HydrophobicContact CB-CG2 4.11Å; S279-V283 VanDerWaalsContact O-CG2 3.32Å; S279-V283 WeakPolarHBondContact O-CG2 3.24Å; S279-V283 PolarHBondContact O-N 3.22Å; A280-V283 PolarHBondContact O-N 2.85Å; V283-A286 PolarHBondContact O-N 2.64Å; V283-R287 WeakPolarHBondContact O-CG 3.42Å; V283-R287 PolarHBondContact O-N 3.09Å |
| 284 | W | 98.2 | Very high | 96.6 | Very high | 67 Ų | 67 | 24.6 Ų | 24.6 | 25% | 0.254 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -64.2 | -41.3 | 175.2 | -79.5 | 119.4 | 0 | 0 | 0 | 112.8 | A280 K281 V282 A286 R287 Y288 Y371 T376 V379 | A280-W284 PolarHBondContact O-N 3.46Å; K281-W284 PolarHBondContact O-N 3.43Å; V282-W284 PolarHBondContact O-N 3.3Å; W284-A286 VanDerWaalsContact C-N 3.3Å; W284-A286 PolarHBondContact O-N 3.16Å; W284-R287 PolarHBondContact O-N 2.92Å; W284-Y288 PolarHBondContact O-N 3.37Å; W284-Y371 HydrophobicContact CE3-CD1 4.45Å; W284-Y371 HydrophobicContact CE3-CE1 4.05Å; W284-Y371 HydrophobicContact CZ3-CE1 4.35Å; W284-T376 HydrophobicContact CE3-CG2 4.08Å; W284-T376 HydrophobicContact CZ3-CG2 4.02Å; W284-V379 HydrophobicContact CB-CG1 3.84Å; W284-V379 HydrophobicContact CB-CG2 4.32Å |
| 285 | M | 98.3 | Very high | 96.7 | Very high | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61.8 | -41.6 | 174.5 | -177 | 65.7 | 74.7 | 0 | 0 | 111.1 | K281 V282 Y288 L289 S315 V318 L319 V379 H382 L385 | K281-M285 WeakPolarHBondContact O-CB 3.34Å; K281-M285 PolarHBondContact O-N 3.33Å; V282-M285 PolarHBondContact O-N 3.46Å; M285-Y288 WeakPolarHBondContact O-CB 3.47Å; M285-Y288 PolarHBondContact O-N 2.84Å; M285-Y288 HydrophobicContact SD-CD1 4.28Å; M285-L289 HydrophobicContact CG-CD1 4.16Å; M285-L289 WeakPolarHBondContact O-CG 3.45Å; M285-L289 PolarHBondContact O-N 3.3Å; M285-S315 VanDerWaalsContact C-OG 3.3Å; M285-S315 WeakPolarHBondContact CG-OG 3.4Å; M285-V318 HydrophobicContact CE-CG1 4.11Å; M285-L319 HydrophobicContact CB-CD1 3.96Å; M285-L319 HydrophobicContact CE-CD2 3.95Å; M285-L319 HydrophobicContact CE-CG 4.3Å; M285-L319 HydrophobicContact CG-CD1 4.34Å; M285-V379 HydrophobicContact CB-CB 4.37Å; M285-V379 HydrophobicContact CB-CG1 4.23Å; M285-V379 HydrophobicContact CE-CB 3.93Å; M285-V379 HydrophobicContact CE-CG1 4.31Å; M285-V379 WeakPolarHBondContact CE-O 3.15Å; M285-V379 HydrophobicContact SD-CB 4.14Å; M285-H382 HydrophobicContact CE-CB 3.66Å; M285-L385 HydrophobicContact CE-CD1 4.35Å; M285-L385 HydrophobicContact CE-CG 4.43Å; M285-L385 HydrophobicContact SD-CD1 4.08Å; M285-L385 HydrophobicContact SD-CD2 3.84Å; M285-L385 HydrophobicContact SD-CG 4.25Å |
| 286 | A | 98.4 | Very high | 96.8 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -67.8 | -42.7 | -180 | 0 | 0 | 0 | 0 | 0 | 110.9 | L269 V282 V283 W284 Y288 L289 L290 A311 L312 S315 | L269-A286 HydrophobicContact CD1-CB 3.74Å; L269-A286 HydrophobicContact CD2-CB 4.17Å; L269-A286 HydrophobicContact CG-CB 4.13Å; V282-A286 WeakPolarHBondContact O-CB 3.49Å; V282-A286 PolarHBondContact O-N 3.48Å; V283-A286 PolarHBondContact O-N 2.64Å; W284-A286 VanDerWaalsContact C-N 3.3Å; W284-A286 PolarHBondContact O-N 3.16Å; A286-Y288 VanDerWaalsContact C-N 3.33Å; A286-Y288 PolarHBondContact O-N 3.02Å; A286-L289 PolarHBondContact O-N 2.9Å; A286-L290 VanDerWaalsContact O-CB 3.26Å; A286-L290 WeakPolarHBondContact O-CB 3.47Å; A286-L290 PolarHBondContact O-N 3.01Å; A286-A311 HydrophobicContact CB-CB 4.4Å; A286-L312 HydrophobicContact CB-CD1 3.96Å; A286-S315 WeakPolarHBondContact CA-OG 3.35Å; A286-S315 WeakPolarHBondContact CB-OG 3.46Å; A286-S315 PolarHBondContact N-OG 3.42Å |
| 287 | R | 98.6 | Very high | 96.7 | Very high | 32 Ų | 32 | 24.7 Ų | 24.7 | 12% | 0.121 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -56 | -47.1 | 172.5 | -78.1 | -176.9 | 168.6 | 99 | -4.3 | 111.6 | E183 L266 L269 V283 W284 L289 L290 E291 Y371 | E183-R287 IonicContact OE1-NE 3.38Å; E183-R287 IonicContact OE2-NE 3.64Å; E183-R287 PolarHBondContact OE2-NE 3.1Å; L266-R287 HydrophobicContact CD1-CG 4.12Å; L269-R287 HydrophobicContact CD2-CG 4.24Å; V283-R287 WeakPolarHBondContact O-CG 3.42Å; V283-R287 PolarHBondContact O-N 3.09Å; W284-R287 PolarHBondContact O-N 2.92Å; R287-L289 PolarHBondContact O-N 3.27Å; R287-L290 PolarHBondContact O-N 2.97Å; R287-E291 WeakPolarHBondContact O-CB 3.32Å; R287-E291 PolarHBondContact O-N 3.42Å; R287-Y371 HydrophobicContact CB-CE1 3.8Å |
| 288 | Y | 98.6 | Very high | 96.7 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -57.6 | -51.4 | 176.6 | 169.4 | -118.7 | 0 | 0 | 0 | 112.4 | W284 M285 A286 L290 E291 L292 A356 A359 T367 Y371 V379 L385 | W284-Y288 PolarHBondContact O-N 3.37Å; M285-Y288 WeakPolarHBondContact O-CB 3.47Å; M285-Y288 PolarHBondContact O-N 2.84Å; M285-Y288 HydrophobicContact SD-CD1 4.28Å; A286-Y288 VanDerWaalsContact C-N 3.33Å; A286-Y288 PolarHBondContact O-N 3.02Å; Y288-L290 VanDerWaalsContact C-N 3.29Å; Y288-L290 PolarHBondContact O-N 3.19Å; Y288-E291 PolarHBondContact O-N 3.12Å; Y288-L292 HydrophobicContact CD1-CD1 4.34Å; Y288-L292 HydrophobicContact CD2-CD1 4.35Å; Y288-L292 HydrophobicContact CD2-CG 4.26Å; Y288-L292 HydrophobicContact CE1-CD1 3.74Å; Y288-L292 HydrophobicContact CE2-CD1 3.75Å; Y288-L292 HydrophobicContact CE2-CD2 4.13Å; Y288-L292 HydrophobicContact CE2-CG 3.84Å; Y288-L292 VanDerWaalsContact CZ-CD1 3.43Å; Y288-L292 WeakPolarHBondContact O-CG 3.32Å; Y288-L292 PolarHBondContact O-N 3.47Å; Y288-A356 HydrophobicContact CE1-CB 4.21Å; Y288-A359 VanDerWaalsContact OH-CB 3.25Å; Y288-A359 WeakPolarHBondContact OH-CB 3.41Å; Y288-T367 HydrophobicContact CD2-CG2 3.89Å; Y288-T367 HydrophobicContact CE2-CG2 4.01Å; Y288-Y371 HydrophobicContact CD2-CD1 4.4Å; Y288-Y371 AromaticContact CD2-CD2 3.84Å; Y288-Y371 HydrophobicContact CD2-CD2 3.84Å; Y288-Y371 AromaticContact CD2-CG 3.71Å; Y288-Y371 HydrophobicContact CD2-CG 3.71Å; Y288-Y371 HydrophobicContact CG-CD1 4.4Å; Y288-Y371 HydrophobicContact CG-CG 4.13Å; Y288-V379 HydrophobicContact CG-CG2 4.43Å; Y288-L385 HydrophobicContact CD1-CD1 4.32Å; Y288-L385 HydrophobicContact CE1-CD1 3.72Å |
| 289 | L | 98.6 | Very high | 96.8 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -64 | -36 | 179.6 | -68.7 | 169.3 | 0 | 0 | 0 | 112.2 | M285 A286 R287 S293 A311 L314 S315 Q352 A356 L385 | M285-L289 HydrophobicContact CG-CD1 4.16Å; M285-L289 WeakPolarHBondContact O-CG 3.45Å; M285-L289 PolarHBondContact O-N 3.3Å; A286-L289 PolarHBondContact O-N 2.9Å; R287-L289 PolarHBondContact O-N 3.27Å; L289-S293 PolarHBondContact O-N 3.28Å; L289-A311 HydrophobicContact CB-CB 4.22Å; L289-L314 HydrophobicContact CD1-CB 4.01Å; L289-L314 HydrophobicContact CD1-CD2 3.81Å; L289-L314 HydrophobicContact CD1-CG 3.76Å; L289-L314 HydrophobicContact CD2-CD2 4.05Å; L289-S315 WeakPolarHBondContact CD1-OG 3.19Å; L289-Q352 HydrophobicContact CB-CB 4.48Å; L289-Q352 HydrophobicContact CD2-CB 4.39Å; L289-A356 HydrophobicContact CD2-CB 3.78Å; L289-L385 HydrophobicContact CD2-CD2 4.21Å |
| 290 | L | 98.6 | Very high | 96.8 | Very high | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -69.6 | -42.6 | 176.4 | -174.6 | 65.3 | 0 | 0 | 0 | 111.4 | Y187 P265 L269 A286 R287 Y288 S293 L307 A311 | Y187-L290 HydrophobicContact CE1-CD2 4.19Å; Y187-L290 HydrophobicContact CE1-CG 4.05Å; Y187-L290 WeakPolarHBondContact OH-CD2 3.47Å; Y187-L290 VanDerWaalsContact OH-CG 3.29Å; Y187-L290 WeakPolarHBondContact OH-CG 3.47Å; P265-L290 HydrophobicContact CB-CD1 3.9Å; P265-L290 HydrophobicContact CB-CD2 3.98Å; P265-L290 HydrophobicContact CB-CG 4.44Å; P265-L290 HydrophobicContact CG-CD1 4.17Å; P265-L290 HydrophobicContact CG-CD2 4.16Å; P265-L290 HydrophobicContact CG-CG 4.44Å; L269-L290 HydrophobicContact CB-CD2 4.17Å; L269-L290 HydrophobicContact CD1-CB 3.85Å; L269-L290 HydrophobicContact CD1-CD2 3.58Å; L269-L290 HydrophobicContact CD1-CG 4.28Å; A286-L290 VanDerWaalsContact O-CB 3.26Å; A286-L290 WeakPolarHBondContact O-CB 3.47Å; A286-L290 PolarHBondContact O-N 3.01Å; R287-L290 PolarHBondContact O-N 2.97Å; Y288-L290 VanDerWaalsContact C-N 3.29Å; Y288-L290 PolarHBondContact O-N 3.19Å; L290-S293 VanDerWaalsContact O-CB 3.31Å; L290-S293 WeakPolarHBondContact O-CB 3.43Å; L290-S293 PolarHBondContact O-N 2.84Å; L290-S293 VanDerWaalsContact O-N 3.15Å; L290-S293 PolarHBondContact O-OG 3.33Å; L290-L307 HydrophobicContact CD1-CB 3.74Å; L290-A311 HydrophobicContact CB-CB 4.1Å |
| 291 | E | 98.6 | Very high | 96.7 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66.8 | -37.2 | 177.9 | -162.3 | -177.9 | 109.1 | 0 | 0 | 111.5 | L186 Y187 R287 Y288 S293 L294 T367 K370 Y371 | L186-E291 HydrophobicContact CD2-CG 4.1Å; Y187-E291 PolarHBondContact OH-N 3.49Å; R287-E291 WeakPolarHBondContact O-CB 3.32Å; R287-E291 PolarHBondContact O-N 3.42Å; Y288-E291 PolarHBondContact O-N 3.12Å; E291-S293 PolarHBondContact O-N 3.42Å; E291-L294 HydrophobicContact CG-CD1 3.99Å; E291-L294 WeakPolarHBondContact O-CB 3.23Å; E291-L294 WeakPolarHBondContact O-CG 3.37Å; E291-L294 PolarHBondContact O-N 3.48Å; E291-T367 HydrophobicContact CB-CG2 3.95Å; E291-T367 HydrophobicContact CG-CG2 4.08Å; E291-T367 WeakPolarHBondContact OE1-CG2 3.25Å; E291-T367 PolarHBondContact OE1-OG1 3.45Å; E291-K370 IonicContact OE1-NZ 3.99Å; E291-K370 WeakPolarHBondContact OE2-CE 3.48Å; E291-K370 IonicContact OE2-NZ 3.17Å; E291-K370 PolarHBondContact OE2-NZ 3.18Å; E291-Y371 HydrophobicContact CB-CE2 4.22Å; E291-Y371 WeakPolarHBondContact OE2-CE2 3.2Å; E291-Y371 PolarHBondContact OE2-OH 3.5Å; E291-Y371 VanDerWaalsContact OE2-OH 3.08Å |
| 292 | L | 97.9 | Very high | 96.6 | Very high | 11 Ų | 11 | 17.4 Ų | 17.4 | 6% | 0.058 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -56.8 | -32.6 | 172 | -77.4 | 177.6 | 0 | 0 | 0 | 112.8 | Y288 L294 L295 A355 A356 A359 T367 | Y288-L292 HydrophobicContact CD1-CD1 4.34Å; Y288-L292 HydrophobicContact CD2-CD1 4.35Å; Y288-L292 HydrophobicContact CD2-CG 4.26Å; Y288-L292 HydrophobicContact CE1-CD1 3.74Å; Y288-L292 HydrophobicContact CE2-CD1 3.75Å; Y288-L292 HydrophobicContact CE2-CD2 4.13Å; Y288-L292 HydrophobicContact CE2-CG 3.84Å; Y288-L292 VanDerWaalsContact CZ-CD1 3.43Å; Y288-L292 WeakPolarHBondContact O-CG 3.32Å; Y288-L292 PolarHBondContact O-N 3.47Å; L292-L294 PolarHBondContact O-N 2.99Å; L292-L295 HydrophobicContact CD2-CD1 4.49Å; L292-L295 PolarHBondContact O-N 3.49Å; L292-L295 VanDerWaalsContact O-N 3.09Å; L292-A355 HydrophobicContact CB-CB 4.33Å; L292-A355 HydrophobicContact CD1-CB 4.46Å; L292-A356 HydrophobicContact CD1-CB 3.8Å; L292-A359 HydrophobicContact CD1-CB 4.5Å; L292-A359 HydrophobicContact CD2-CB 4.14Å; L292-T367 HydrophobicContact CD2-CG2 3.85Å; L292-T367 HydrophobicContact CG-CG2 3.99Å |
| 293 | S | 97.4 | Very high | 96.5 | Very high | 6 Ų | 6 | 18.5 Ų | 18.5 | 4% | 0.042 | 9% | 0.092 | C | C | . | . | G | 310 helix | trans | -63.4 | -21.6 | 177 | 81.9 | 0 | 0 | 0 | 0 | 113.1 | L289 L290 E291 L295 E296 | L289-S293 PolarHBondContact O-N 3.28Å; L290-S293 VanDerWaalsContact O-CB 3.31Å; L290-S293 WeakPolarHBondContact O-CB 3.43Å; L290-S293 PolarHBondContact O-N 2.84Å; L290-S293 VanDerWaalsContact O-N 3.15Å; L290-S293 PolarHBondContact O-OG 3.33Å; E291-S293 PolarHBondContact O-N 3.42Å; S293-L295 PolarHBondContact O-N 3.46Å; S293-E296 PolarHBondContact O-N 2.92Å; S293-E296 VanDerWaalsContact O-N 3.13Å |
| 294 | L | 97.5 | Very high | 96.4 | Very high | 19 Ų | 19 | 18.1 Ų | 18.1 | 10% | 0.099 | 9% | 0.09 | C | C | . | . | G | 310 helix | trans | -65.5 | -25.3 | 174.5 | -61 | 179.5 | 0 | 0 | 0 | 112.5 | R165 V169 L186 Y187 V190 E291 L292 | R165-L294 VanDerWaalsContact CZ-O 3.28Å; R165-L294 PolarHBondContact NH1-O 3.31Å; R165-L294 PolarHBondContact NH2-O 3.41Å; V169-L294 HydrophobicContact CG1-CB 4.12Å; L186-L294 HydrophobicContact CD2-CD1 4.03Å; L186-L294 HydrophobicContact CG-CD1 3.99Å; Y187-L294 HydrophobicContact CD1-CD1 4.16Å; Y187-L294 HydrophobicContact CD1-CD2 3.72Å; Y187-L294 HydrophobicContact CD1-CG 4.33Å; Y187-L294 HydrophobicContact CE1-CD1 3.96Å; Y187-L294 HydrophobicContact CE1-CD2 3.78Å; Y187-L294 HydrophobicContact CE1-CG 4Å; V190-L294 HydrophobicContact CB-CD2 4.24Å; V190-L294 HydrophobicContact CG1-CB 4.43Å; V190-L294 HydrophobicContact CG1-CD2 4.06Å; V190-L294 HydrophobicContact CG2-CD1 4.35Å; E291-L294 HydrophobicContact CG-CD1 3.99Å; E291-L294 WeakPolarHBondContact O-CB 3.23Å; E291-L294 WeakPolarHBondContact O-CG 3.37Å; E291-L294 PolarHBondContact O-N 3.48Å; L292-L294 PolarHBondContact O-N 2.99Å |
| 295 | L | 96.6 | Very high | 96.2 | Very high | 9 Ų | 9 | 14.9 Ų | 14.9 | 5% | 0.047 | 8% | 0.078 | C | C | . | . | G | 310 helix | trans | -83.3 | -20.9 | 175.7 | -64.8 | 98.3 | 0 | 0 | 0 | 112.4 | R165 D170 I173 L292 S293 G297 T364 | R165-L295 VanDerWaalsContact NH2-C 3.32Å; R165-L295 PolarHBondContact NH2-O 2.89Å; D170-L295 HydrophobicContact CB-CD2 4.05Å; I173-L295 HydrophobicContact CD1-CD1 4.16Å; L292-L295 HydrophobicContact CD2-CD1 4.49Å; L292-L295 PolarHBondContact O-N 3.49Å; L292-L295 VanDerWaalsContact O-N 3.09Å; S293-L295 PolarHBondContact O-N 3.46Å; L295-G297 PolarHBondContact O-N 3.15Å; L295-T364 HydrophobicContact CD2-CG2 4.43Å |
| 296 | E | 95.8 | Very high | 96.1 | Very high | 26 Ų | 26 | 16.1 Ų | 16.1 | 12% | 0.121 | 8% | 0.084 | C | C | . | . | trans | -89.3 | 103 | -176.2 | -64.8 | -61.3 | 140.2 | 0 | 0 | 110.1 | R165 S293 Q298 C299 I351 A355 K362 | R165-E296 VanDerWaalsContact NH2-C 3.34Å; S293-E296 PolarHBondContact O-N 2.92Å; S293-E296 VanDerWaalsContact O-N 3.13Å; E296-Q298 HydrophobicContact CB-CG 4.43Å; E296-Q298 PolarHBondContact O-N 3.27Å; E296-Q298 VanDerWaalsContact O-N 3.13Å; E296-C299 WeakPolarHBondContact O-CB 3.4Å; E296-C299 PolarHBondContact O-N 3.11Å; E296-I351 HydrophobicContact CB-CG2 3.97Å; E296-I351 HydrophobicContact CG-CG2 3.92Å; E296-A355 HydrophobicContact CG-CB 4.06Å; E296-K362 IonicContact OE1-NZ 3.8Å | ||
| 297 | G | 92.4 | Very high | 96 | Very high | 5 Ų | 5 | 16.9 Ų | 16.9 | 5% | 0.052 | 9% | 0.088 | C | C | . | . | G | 310 helix | trans | -57.6 | -28.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | L295 C299 V300 | L295-G297 PolarHBondContact O-N 3.15Å; G297-C299 PolarHBondContact O-N 2.89Å; G297-V300 WeakPolarHBondContact O-CG1 3.13Å; G297-V300 VanDerWaalsContact O-CG2 3.25Å; G297-V300 WeakPolarHBondContact O-CG2 3.11Å |
| 298 | Q | 93.3 | Very high | 96 | Very high | 74 Ų | 74 | 15.3 Ų | 15.3 | 35% | 0.346 | 8% | 0.082 | S | C | . | . | G | 310 helix | trans | -67.7 | -15.3 | 174.8 | 60 | -175.1 | -10.7 | 0 | 0 | 114.3 | E296 V300 V301 I351 | E296-Q298 HydrophobicContact CB-CG 4.43Å; E296-Q298 PolarHBondContact O-N 3.27Å; E296-Q298 VanDerWaalsContact O-N 3.13Å; Q298-V300 VanDerWaalsContact C-N 3.28Å; Q298-V300 PolarHBondContact O-N 2.85Å; Q298-V301 WeakPolarHBondContact O-CG2 3.22Å; Q298-I351 HydrophobicContact CG-CD1 3.93Å; Q298-I351 HydrophobicContact CG-CG2 4.28Å |
| 299 | C | 95.1 | Very high | 95.9 | Very high | 5 Ų | 5 | 15.4 Ų | 15.4 | 3% | 0.034 | 8% | 0.083 | C | C | . | . | G | 310 helix | trans | -76 | -14.8 | -178.4 | -72.6 | 0 | 0 | 0 | 0 | 113.8 | E296 G297 V301 F302 L307 | E296-C299 WeakPolarHBondContact O-CB 3.4Å; E296-C299 PolarHBondContact O-N 3.11Å; G297-C299 PolarHBondContact O-N 2.89Å; C299-V301 PolarHBondContact O-N 2.95Å; C299-V301 VanDerWaalsContact O-N 3.15Å; C299-F302 HydrophobicContact CB-CD2 4.45Å; C299-F302 PolarHBondContact O-N 3.21Å; C299-L307 HydrophobicContact CB-CD2 4.11Å |
| 300 | V | 92.8 | Very high | 95.9 | Very high | 27 Ų | 27 | 15.4 Ų | 15.4 | 16% | 0.164 | 8% | 0.083 | C | C | . | . | G | 310 helix | trans | -65.9 | -17.1 | -176.1 | -56.1 | 0 | 0 | 0 | 0 | 114.2 | F151 A154 N194 G297 Q298 | F151-V300 HydrophobicContact CB-CG2 4.18Å; F151-V300 HydrophobicContact CD2-CB 3.96Å; F151-V300 HydrophobicContact CD2-CG2 4.31Å; F151-V300 WeakPolarHBondContact CD2-O 3.31Å; F151-V300 HydrophobicContact CE2-CB 4.49Å; F151-V300 HydrophobicContact CG-CB 4.43Å; F151-V300 HydrophobicContact CG-CG2 4.28Å; A154-V300 HydrophobicContact CB-CG2 4.21Å; N194-V300 WeakPolarHBondContact ND2-CG1 3.2Å; G297-V300 WeakPolarHBondContact O-CG1 3.13Å; G297-V300 VanDerWaalsContact O-CG2 3.25Å; G297-V300 WeakPolarHBondContact O-CG2 3.11Å; Q298-V300 VanDerWaalsContact C-N 3.28Å; Q298-V300 PolarHBondContact O-N 2.85Å |
| 301 | V | 93.6 | Very high | 95.8 | Very high | 40 Ų | 40 | 15.4 Ų | 15.4 | 24% | 0.242 | 8% | 0.083 | C | C | . | . | G | 310 helix | trans | -86.9 | -13.5 | 179.6 | -54.6 | 0 | 0 | 0 | 0 | 113.1 | T150 A154 Q298 C299 | T150-V301 VanDerWaalsContact CG2-O 3.26Å; T150-V301 WeakPolarHBondContact CG2-O 3.46Å; A154-V301 HydrophobicContact CB-CG1 3.98Å; Q298-V301 WeakPolarHBondContact O-CG2 3.22Å; C299-V301 PolarHBondContact O-N 2.95Å; C299-V301 VanDerWaalsContact O-N 3.15Å |
| 302 | F | 94.4 | Very high | 95.8 | Very high | 25 Ų | 25 | 15.6 Ų | 15.6 | 11% | 0.11 | 8% | 0.084 | C | C | . | . | S | Bend | trans | -88.7 | 147.8 | -177.3 | -59.4 | -61 | 0 | 0 | 0 | 111.2 | C299 L307 T344 R347 I348 I351 | C299-F302 HydrophobicContact CB-CD2 4.45Å; C299-F302 PolarHBondContact O-N 3.21Å; F302-L307 HydrophobicContact CB-CD2 3.97Å; F302-L307 HydrophobicContact CB-CG 3.98Å; F302-L307 HydrophobicContact CD2-CD2 4.12Å; F302-L307 HydrophobicContact CG-CD2 4.47Å; F302-T344 HydrophobicContact CD1-CG2 3.8Å; F302-T344 HydrophobicContact CE1-CG2 4.1Å; F302-R347 HydrophobicContact CZ-CG 4.14Å; F302-I348 HydrophobicContact CB-CD1 3.85Å; F302-I348 HydrophobicContact CB-CG1 4.32Å; F302-I348 HydrophobicContact CD1-CD1 3.9Å; F302-I348 HydrophobicContact CD1-CG1 3.89Å; F302-I348 HydrophobicContact CD2-CD1 4.09Å; F302-I348 HydrophobicContact CD2-CG1 3.59Å; F302-I348 HydrophobicContact CE1-CD1 4.49Å; F302-I348 HydrophobicContact CE1-CG1 4.06Å; F302-I348 HydrophobicContact CE2-CG1 3.79Å; F302-I348 HydrophobicContact CG-CD1 3.68Å; F302-I348 HydrophobicContact CG-CG1 3.66Å; F302-I348 HydrophobicContact CZ-CG1 4.02Å; F302-I351 HydrophobicContact CE2-CD1 3.75Å; F302-I351 HydrophobicContact CZ-CD1 4.15Å |
| 303 | L | 94.1 | Very high | 95.6 | Very high | 23 Ų | 23 | 16.2 Ų | 16.2 | 12% | 0.12 | 9% | 0.089 | C | C | . | . | trans | -65.2 | 147.1 | 173.2 | -60.3 | -174.8 | 0 | 0 | 0 | 110.9 | L147 T150 A305 H306 L307 | L147-L303 HydrophobicContact CD2-CD1 3.81Å; L147-L303 HydrophobicContact CD2-CD2 3.76Å; L147-L303 HydrophobicContact CD2-CG 4.47Å; T150-L303 HydrophobicContact CG2-CD2 4.22Å; T150-L303 VanDerWaalsContact OG1-CD2 3.31Å; T150-L303 WeakPolarHBondContact OG1-CD2 3.48Å; L303-A305 VanDerWaalsContact C-N 3.29Å; L303-A305 PolarHBondContact O-N 3.31Å; L303-H306 HydrophobicContact CB-CB 4.45Å; L303-H306 PolarHBondContact O-N 3.18Å; L303-L307 PolarHBondContact O-N 3.15Å | ||
| 304 | A | 94.9 | Very high | 95.6 | Very high | 11 Ų | 11 | 15.9 Ų | 15.9 | 9% | 0.091 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -57.1 | -43.2 | 179 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q146 P265 F268 H306 L307 A308 | Q146-A304 HydrophobicContact CB-CB 4.47Å; P265-A304 HydrophobicContact CB-CB 3.96Å; P265-A304 WeakPolarHBondContact CB-O 3.43Å; F268-A304 HydrophobicContact CD2-CB 3.78Å; F268-A304 HydrophobicContact CE2-CB 3.76Å; A304-H306 PolarHBondContact O-N 3.38Å; A304-L307 PolarHBondContact O-N 2.58Å; A304-A308 WeakPolarHBondContact O-CB 3.26Å; A304-A308 PolarHBondContact O-N 3.09Å; A304-A308 VanDerWaalsContact O-N 3.09Å |
| 305 | A | 94.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -60.3 | -42.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q146 F268 L303 A308 G309 H338 | Q146-A305 VanDerWaalsContact OE1-CB 3.28Å; Q146-A305 VanDerWaalsContact OE1-N 3.09Å; F268-A305 HydrophobicContact CD1-CB 3.97Å; F268-A305 HydrophobicContact CD2-CB 4.25Å; F268-A305 HydrophobicContact CE1-CB 4.2Å; F268-A305 HydrophobicContact CE2-CB 4.42Å; F268-A305 HydrophobicContact CG-CB 4Å; F268-A305 HydrophobicContact CZ-CB 4.4Å; L303-A305 VanDerWaalsContact C-N 3.29Å; L303-A305 PolarHBondContact O-N 3.31Å; A305-A308 WeakPolarHBondContact O-CB 3.28Å; A305-A308 PolarHBondContact O-N 2.95Å; A305-G309 PolarHBondContact O-N 3.43Å; A305-H338 PolarHBondContact O-CE1 3.44Å; A305-H338 PolarHBondContact O-ND1 3.25Å |
| 306 | H | 96.2 | Very high | 95.4 | Very high | 26 Ų | 26 | 17.1 Ų | 17.1 | 12% | 0.12 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -68.3 | -38.1 | 179 | -62 | 158.7 | 0 | 0 | 0 | 112.7 | L303 A304 A308 A310 S341 T344 L345 I348 | L303-H306 HydrophobicContact CB-CB 4.45Å; L303-H306 PolarHBondContact O-N 3.18Å; A304-H306 PolarHBondContact O-N 3.38Å; H306-A308 VanDerWaalsContact C-N 3.32Å; H306-A308 PolarHBondContact O-N 3.24Å; H306-A310 VanDerWaalsContact O-CB 3.23Å; H306-A310 WeakPolarHBondContact O-CB 3.5Å; H306-A310 PolarHBondContact O-N 3.32Å; H306-S341 WeakPolarHBondContact NE2-CB 3.38Å; H306-T344 HydrophobicContact CB-CG2 4.36Å; H306-L345 HydrophobicContact CB-CD2 4.19Å; H306-L345 WeakPolarHBondContact O-CD2 3.31Å; H306-I348 HydrophobicContact CB-CD1 3.67Å |
| 307 | L | 97.3 | Very high | 95.2 | Very high | 15 Ų | 15 | 21.8 Ų | 21.8 | 8% | 0.079 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.8 | -43.7 | 174.6 | -71.1 | 172.4 | 0 | 0 | 0 | 111.5 | P265 L290 C299 F302 L303 A304 A311 I348 Q352 | P265-L307 HydrophobicContact CB-CB 4.25Å; L290-L307 HydrophobicContact CD1-CB 3.74Å; C299-L307 HydrophobicContact CB-CD2 4.11Å; F302-L307 HydrophobicContact CB-CD2 3.97Å; F302-L307 HydrophobicContact CB-CG 3.98Å; F302-L307 HydrophobicContact CD2-CD2 4.12Å; F302-L307 HydrophobicContact CG-CD2 4.47Å; L303-L307 PolarHBondContact O-N 3.15Å; A304-L307 PolarHBondContact O-N 2.58Å; L307-A311 WeakPolarHBondContact O-CB 3.33Å; L307-A311 PolarHBondContact O-N 3.36Å; L307-A311 VanDerWaalsContact O-N 3.09Å; L307-I348 HydrophobicContact CD2-CD1 4.29Å; L307-I348 HydrophobicContact CD2-CG1 4.39Å; L307-I348 HydrophobicContact CD2-CG2 3.78Å; L307-Q352 PolarHBondContact O-NE2 3.4Å |
| 308 | A | 97.4 | Very high | 95.3 | Very high | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -63.6 | -51.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | P265 F268 L269 A304 A305 H306 A310 A311 L312 | P265-A308 WeakPolarHBondContact O-CB 3.47Å; F268-A308 HydrophobicContact CB-CB 3.62Å; L269-A308 HydrophobicContact CB-CB 3.82Å; A304-A308 WeakPolarHBondContact O-CB 3.26Å; A304-A308 PolarHBondContact O-N 3.09Å; A304-A308 VanDerWaalsContact O-N 3.09Å; A305-A308 WeakPolarHBondContact O-CB 3.28Å; A305-A308 PolarHBondContact O-N 2.95Å; H306-A308 VanDerWaalsContact C-N 3.32Å; H306-A308 PolarHBondContact O-N 3.24Å; A308-A310 VanDerWaalsContact C-N 3.35Å; A308-A310 PolarHBondContact O-N 3.23Å; A308-A311 PolarHBondContact O-N 2.89Å; A308-L312 PolarHBondContact O-N 3.09Å |
| 309 | G | 96.8 | Very high | 95.3 | Very high | 2 Ų | 2 | 19.3 Ų | 19.3 | 2% | 0.021 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -58.4 | -45.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | A305 A311 L312 C313 H338 | A305-G309 PolarHBondContact O-N 3.43Å; G309-A311 PolarHBondContact O-N 3.24Å; G309-L312 PolarHBondContact O-N 3.41Å; G309-C313 VanDerWaalsContact O-CB 3.3Å; G309-C313 WeakPolarHBondContact O-CB 3.39Å; G309-C313 PolarHBondContact O-N 3.06Å; G309-C313 PolarHBondContact O-SG 2.96Å; G309-H338 VanDerWaalsContact CA-CD2 3.43Å; G309-H338 WeakPolarHBondContact CA-CD2 3.39Å; G309-H338 WeakPolarHBondContact CA-NE2 3.37Å |
| 310 | A | 97.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.3 | -44.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | H306 A308 L312 C313 L314 L345 I348 M349 | H306-A310 VanDerWaalsContact O-CB 3.23Å; H306-A310 WeakPolarHBondContact O-CB 3.5Å; H306-A310 PolarHBondContact O-N 3.32Å; A308-A310 VanDerWaalsContact C-N 3.35Å; A308-A310 PolarHBondContact O-N 3.23Å; A310-L312 VanDerWaalsContact C-N 3.32Å; A310-L312 PolarHBondContact O-N 2.94Å; A310-C313 PolarHBondContact O-N 3.26Å; A310-L314 VanDerWaalsContact O-CB 3.3Å; A310-L314 WeakPolarHBondContact O-CB 3.48Å; A310-L314 PolarHBondContact O-N 3.5Å; A310-L345 HydrophobicContact CB-CD2 4.13Å; A310-I348 HydrophobicContact CB-CB 3.57Å; A310-I348 HydrophobicContact CB-CD1 4.43Å; A310-I348 HydrophobicContact CB-CG2 3.34Å; A310-M349 HydrophobicContact CB-CG 3.77Å; A310-M349 WeakPolarHBondContact O-CG 3.24Å |
| 311 | A | 98.2 | Very high | 94.6 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.2 | -42.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L269 A286 L289 L290 L307 A308 G309 S315 Q352 | L269-A311 HydrophobicContact CD1-CB 4.19Å; A286-A311 HydrophobicContact CB-CB 4.4Å; L289-A311 HydrophobicContact CB-CB 4.22Å; L290-A311 HydrophobicContact CB-CB 4.1Å; L307-A311 WeakPolarHBondContact O-CB 3.33Å; L307-A311 PolarHBondContact O-N 3.36Å; L307-A311 VanDerWaalsContact O-N 3.09Å; A308-A311 PolarHBondContact O-N 2.89Å; G309-A311 PolarHBondContact O-N 3.24Å; A311-S315 WeakPolarHBondContact O-CB 3.21Å; A311-S315 PolarHBondContact O-N 3.37Å; A311-S315 PolarHBondContact O-OG 3.33Å; A311-Q352 VanDerWaalsContact CA-OE1 3.27Å |
| 312 | L | 96.6 | Very high | 94 | Very high | 3 Ų | 3 | 31 Ų | 31 | 2% | 0.016 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -69.1 | -45.7 | 179.6 | -164.5 | 66.6 | 0 | 0 | 0 | 111.8 | A273 V282 A286 A308 G309 A310 L314 S315 R316 W331 | A273-L312 HydrophobicContact CB-CD1 3.9Å; A273-L312 HydrophobicContact CB-CD2 4.29Å; V282-L312 HydrophobicContact CG1-CD1 3.81Å; A286-L312 HydrophobicContact CB-CD1 3.96Å; A308-L312 PolarHBondContact O-N 3.09Å; G309-L312 PolarHBondContact O-N 3.41Å; A310-L312 VanDerWaalsContact C-N 3.32Å; A310-L312 PolarHBondContact O-N 2.94Å; L312-L314 VanDerWaalsContact C-N 3.35Å; L312-L314 PolarHBondContact O-N 3.13Å; L312-S315 WeakPolarHBondContact O-CB 3.35Å; L312-S315 PolarHBondContact O-N 3.13Å; L312-R316 PolarHBondContact O-N 2.57Å; L312-W331 HydrophobicContact CB-CH2 4.45Å; L312-W331 HydrophobicContact CD2-CH2 4.21Å; L312-W331 HydrophobicContact CD2-CZ3 3.69Å; L312-W331 HydrophobicContact CG-CH2 4.08Å; L312-W331 HydrophobicContact CG-CZ3 3.82Å |
| 313 | C | 95 | Very high | 93.4 | Very high | 24 Ų | 24 | 34.4 Ų | 34.4 | 16% | 0.162 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -55.9 | -48 | 173.8 | -74.6 | 0 | 0 | 0 | 0 | 111.6 | G309 A310 R316 R317 W331 M349 | G309-C313 VanDerWaalsContact O-CB 3.3Å; G309-C313 WeakPolarHBondContact O-CB 3.39Å; G309-C313 PolarHBondContact O-N 3.06Å; G309-C313 PolarHBondContact O-SG 2.96Å; A310-C313 PolarHBondContact O-N 3.26Å; C313-R316 PolarHBondContact O-N 3.25Å; C313-R317 WeakPolarHBondContact O-CG 3.43Å; C313-R317 PolarHBondContact O-N 3.48Å; C313-W331 HydrophobicContact CB-CZ2 4.48Å; C313-W331 WeakPolarHBondContact SG-CZ2 2.87Å; C313-M349 HydrophobicContact CB-CE 4.01Å; C313-M349 HydrophobicContact CB-SD 3.84Å |
| 314 | L | 96.4 | Very high | 93 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.2 | -40.9 | 179.5 | -178.7 | 55.6 | 0 | 0 | 0 | 111.3 | L289 A310 L312 R316 R317 V318 M349 Q352 A353 L392 | L289-L314 HydrophobicContact CD1-CB 4.01Å; L289-L314 HydrophobicContact CD1-CD2 3.81Å; L289-L314 HydrophobicContact CD1-CG 3.76Å; L289-L314 HydrophobicContact CD2-CD2 4.05Å; A310-L314 VanDerWaalsContact O-CB 3.3Å; A310-L314 WeakPolarHBondContact O-CB 3.48Å; A310-L314 PolarHBondContact O-N 3.5Å; L312-L314 VanDerWaalsContact C-N 3.35Å; L312-L314 PolarHBondContact O-N 3.13Å; L314-R316 PolarHBondContact O-N 3.09Å; L314-R317 PolarHBondContact O-N 3.33Å; L314-V318 HydrophobicContact CD1-CG2 3.94Å; L314-V318 HydrophobicContact CG-CG2 4.23Å; L314-V318 WeakPolarHBondContact O-CB 3.08Å; L314-V318 VanDerWaalsContact O-CG2 3.29Å; L314-V318 WeakPolarHBondContact O-CG2 3.36Å; L314-V318 PolarHBondContact O-N 3.16Å; L314-M349 HydrophobicContact CB-CB 4.49Å; L314-M349 HydrophobicContact CB-CE 4.07Å; L314-M349 HydrophobicContact CB-CG 4.18Å; L314-M349 HydrophobicContact CD1-CE 4.37Å; L314-Q352 HydrophobicContact CD2-CB 3.84Å; L314-A353 HydrophobicContact CD1-CB 4.45Å; L314-A353 HydrophobicContact CD2-CB 3.92Å; L314-L392 HydrophobicContact CD1-CD1 4.07Å; L314-L392 HydrophobicContact CD1-CD2 4.31Å; L314-L392 HydrophobicContact CD1-CG 4.41Å |
| 315 | S | 96.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.3 | -46.4 | 178 | -61.7 | 0 | 0 | 0 | 0 | 112.5 | M285 A286 L289 A311 L312 R317 V318 L319 | M285-S315 VanDerWaalsContact C-OG 3.3Å; M285-S315 WeakPolarHBondContact CG-OG 3.4Å; A286-S315 WeakPolarHBondContact CA-OG 3.35Å; A286-S315 WeakPolarHBondContact CB-OG 3.46Å; A286-S315 PolarHBondContact N-OG 3.42Å; L289-S315 WeakPolarHBondContact CD1-OG 3.19Å; A311-S315 WeakPolarHBondContact O-CB 3.21Å; A311-S315 PolarHBondContact O-N 3.37Å; A311-S315 PolarHBondContact O-OG 3.33Å; L312-S315 WeakPolarHBondContact O-CB 3.35Å; L312-S315 PolarHBondContact O-N 3.13Å; S315-R317 VanDerWaalsContact C-N 3.33Å; S315-R317 PolarHBondContact O-N 3.19Å; S315-V318 PolarHBondContact O-N 2.91Å; S315-L319 WeakPolarHBondContact O-CB 3.39Å; S315-L319 WeakPolarHBondContact O-CG 3.36Å; S315-L319 PolarHBondContact O-N 2.83Å |
| 316 | R | 93.1 | Very high | 92.1 | Very high | 53 Ų | 53 | 49 Ų | 49 | 20% | 0.2 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61 | -41.3 | 176 | -71.4 | -173.3 | 73.5 | -149.3 | 2.3 | 111.8 | V282 L312 C313 L314 Q320 E328 W331 | V282-R316 HydrophobicContact CG1-CG 3.97Å; V282-R316 HydrophobicContact CG2-CG 4.47Å; L312-R316 PolarHBondContact O-N 2.57Å; C313-R316 PolarHBondContact O-N 3.25Å; L314-R316 PolarHBondContact O-N 3.09Å; R316-Q320 WeakPolarHBondContact O-CA 3.45Å; R316-Q320 PolarHBondContact O-N 3.31Å; R316-E328 IonicContact CZ-OE1 3.92Å; R316-E328 IonicContact NH2-OE1 2.84Å; R316-E328 PolarHBondContact NH2-OE1 3.35Å; R316-W331 HydrophobicContact CG-CH2 4.43Å; R316-W331 HydrophobicContact CG-CZ3 4.27Å; R316-W331 VanDerWaalsContact NH1-CE3 3.25Å |
| 317 | R | 92.8 | Very high | 91.6 | Very high | 124 Ų | 124 | 48.4 Ų | 48.4 | 47% | 0.468 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -66.5 | -39.5 | 177.4 | -70.3 | -175.9 | -174.9 | -166 | 2.4 | 113.1 | C313 L314 S315 Q320 | C313-R317 WeakPolarHBondContact O-CG 3.43Å; C313-R317 PolarHBondContact O-N 3.48Å; L314-R317 PolarHBondContact O-N 3.33Å; S315-R317 VanDerWaalsContact C-N 3.33Å; S315-R317 PolarHBondContact O-N 3.19Å; R317-Q320 VanDerWaalsContact O-CG 3.32Å; R317-Q320 WeakPolarHBondContact O-CG 3.37Å |
| 318 | V | 94.6 | Very high | 91.1 | Very high | 2 Ų | 2 | 51.1 Ų | 51.1 | 1% | 0.012 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -69.3 | -38.8 | 179.3 | 168.8 | 0 | 0 | 0 | 0 | 111.3 | M285 L314 S315 S384 L385 A388 L391 | M285-V318 HydrophobicContact CE-CG1 4.11Å; L314-V318 HydrophobicContact CD1-CG2 3.94Å; L314-V318 HydrophobicContact CG-CG2 4.23Å; L314-V318 WeakPolarHBondContact O-CB 3.08Å; L314-V318 VanDerWaalsContact O-CG2 3.29Å; L314-V318 WeakPolarHBondContact O-CG2 3.36Å; L314-V318 PolarHBondContact O-N 3.16Å; S315-V318 PolarHBondContact O-N 2.91Å; V318-S384 WeakPolarHBondContact O-CB 3.48Å; V318-L385 HydrophobicContact CG1-CD2 3.97Å; V318-L385 HydrophobicContact CG1-CG 4.23Å; V318-L385 HydrophobicContact CG2-CD2 4.29Å; V318-A388 HydrophobicContact CG2-CB 3.96Å; V318-L391 HydrophobicContact CG2-CD1 4.39Å |
| 319 | L | 93.7 | Very high | 90.6 | Very high | 26 Ų | 26 | 55.5 Ų | 55.5 | 14% | 0.136 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -88.5 | -20.4 | -176.4 | -67.5 | 172.6 | 0 | 0 | 0 | 114 | K281 V282 M285 S315 E321 | K281-L319 HydrophobicContact CB-CD1 4.46Å; K281-L319 HydrophobicContact CD-CD2 4.07Å; K281-L319 HydrophobicContact CG-CD1 4.08Å; K281-L319 HydrophobicContact CG-CD2 4.28Å; V282-L319 HydrophobicContact CB-CD1 4.26Å; V282-L319 HydrophobicContact CG2-CD1 3.64Å; M285-L319 HydrophobicContact CB-CD1 3.96Å; M285-L319 HydrophobicContact CE-CD2 3.95Å; M285-L319 HydrophobicContact CE-CG 4.3Å; M285-L319 HydrophobicContact CG-CD1 4.34Å; S315-L319 WeakPolarHBondContact O-CB 3.39Å; S315-L319 WeakPolarHBondContact O-CG 3.36Å; S315-L319 PolarHBondContact O-N 2.83Å; L319-E321 VanDerWaalsContact C-N 3.32Å; L319-E321 HydrophobicContact CB-CG 4.38Å; L319-E321 PolarHBondContact O-N 3.48Å |
| 320 | Q | 89.8 | Confident | 90.3 | Very high | 144 Ų | 144 | 55.8 Ų | 55.8 | 67% | 0.673 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.8 | 48.2 | 178.9 | -58.1 | -176.3 | 15.5 | 0 | 0 | 113.2 | R316 R317 | R316-Q320 WeakPolarHBondContact O-CA 3.45Å; R316-Q320 PolarHBondContact O-N 3.31Å; R317-Q320 VanDerWaalsContact O-CG 3.32Å; R317-Q320 WeakPolarHBondContact O-CG 3.37Å |
| 321 | E | 81.9 | Confident | 89.9 | Confident | 64 Ų | 64 | 57.6 Ų | 57.6 | 30% | 0.299 | 31% | 0.308 | S | S | . | . | P | Polyproline II helix | trans | -63.6 | 137 | 175.2 | -65.2 | -168 | 155.8 | 0 | 0 | 110.5 | S279 V282 L319 | S279-E321 WeakPolarHBondContact CB-OE1 3Å; S279-E321 PolarHBondContact OG-OE1 3.38Å; V282-E321 HydrophobicContact CG2-CG 4.11Å; V282-E321 WeakPolarHBondContact CG2-OE1 3.44Å; V282-E321 VanDerWaalsContact CG2-OE2 3.24Å; V282-E321 WeakPolarHBondContact CG2-OE2 3.37Å; L319-E321 VanDerWaalsContact C-N 3.32Å; L319-E321 HydrophobicContact CB-CG 4.38Å; L319-E321 PolarHBondContact O-N 3.48Å |
| 322 | P | 81 | Confident | 89.5 | Confident | 110 Ų | 110 | 61.8 Ų | 61.8 | 71% | 0.714 | 34% | 0.336 | S | S | * | . | P | Polyproline II helix | trans | -62.7 | 130.6 | -177.5 | 25.5 | -33 | 0 | 0 | 0 | 109.7 | T324 | P322-T324 PolarHBondContact O-N 2.94Š|
| 323 | P | 82 | Confident | 89.1 | Confident | 95 Ų | 95 | 61.9 Ų | 61.9 | 62% | 0.617 | 34% | 0.336 | S | S | * | . | P | Polyproline II helix | trans | -67.5 | 131.5 | 179.3 | 27.9 | -33.6 | 0 | 0 | 0 | 109.7 | E328 | P323-E328 HydrophobicContact CB-CG 3.88Å; P323-E328 WeakPolarHBondContact CB-OE1 3.39Å |
| 324 | T | 86.8 | Confident | 88.9 | Confident | 73 Ų | 73 | 60.9 Ų | 60.9 | 45% | 0.448 | 33% | 0.33 | S | S | . | . | trans | -104.7 | 147.9 | 166.7 | 62.3 | 0 | 0 | 0 | 0 | 108.7 | P322 E326 G327 E328 | P322-T324 PolarHBondContact O-N 2.94Å; T324-E326 VanDerWaalsContact C-N 3.26Å; T324-E326 PolarHBondContact O-N 3.37Å; T324-G327 PolarHBondContact O-N 3.11Å; T324-G327 VanDerWaalsContact O-N 3.11Å; T324-G327 WeakPolarHBondContact OG1-CA 3.14Å; T324-G327 PolarHBondContact OG1-N 3.12Å; T324-E328 WeakPolarHBondContact O-CG 3.22Å; T324-E328 PolarHBondContact O-N 3.22Å | ||
| 325 | P | 85.1 | Confident | 88.5 | Confident | 114 Ų | 114 | 62.5 Ų | 62.5 | 74% | 0.74 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -55.3 | -43.1 | 178.3 | -25.9 | 34.3 | 0 | 0 | 0 | 112.6 | E328 T329 | P325-E328 PolarHBondContact O-N 2.96Å; P325-T329 PolarHBondContact O-N 3.06Å; P325-T329 PolarHBondContact O-OG1 3.12Å |
| 326 | E | 84.9 | Confident | 88 | Confident | 155 Ų | 155 | 62.9 Ų | 62.9 | 72% | 0.724 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -63.2 | -44.7 | 175.9 | -66.4 | 165.3 | -172.1 | 0 | 0 | 111.6 | T324 E328 T329 A330 | T324-E326 VanDerWaalsContact C-N 3.26Å; T324-E326 PolarHBondContact O-N 3.37Å; E326-E328 PolarHBondContact O-N 2.72Å; E326-T329 WeakPolarHBondContact CA-OG1 3.35Å; E326-T329 PolarHBondContact O-N 3.12Å; E326-T329 PolarHBondContact O-OG1 3.15Å; E326-A330 VanDerWaalsContact O-CB 3.3Å; E326-A330 WeakPolarHBondContact O-CB 3.37Å; E326-A330 PolarHBondContact O-N 3.28Å |
| 327 | G | 85.3 | Confident | 87.7 | Confident | 13 Ų | 13 | 60.5 Ų | 60.5 | 13% | 0.134 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -65.8 | -35.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | T324 W331 | T324-G327 PolarHBondContact O-N 3.11Å; T324-G327 VanDerWaalsContact O-N 3.11Å; T324-G327 WeakPolarHBondContact OG1-CA 3.14Å; T324-G327 PolarHBondContact OG1-N 3.12Å; G327-W331 WeakPolarHBondContact O-CB 3.38Å; G327-W331 PolarHBondContact O-N 2.49Å |
| 328 | E | 87.1 | Confident | 87.3 | Confident | 71 Ų | 71 | 55.2 Ų | 55.2 | 33% | 0.332 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -69.8 | -40.2 | 174.7 | -70.9 | -56 | 132.3 | 0 | 0 | 111.5 | R316 P323 T324 P325 E326 W331 C332 | R316-E328 IonicContact CZ-OE1 3.92Å; R316-E328 IonicContact NH2-OE1 2.84Å; R316-E328 PolarHBondContact NH2-OE1 3.35Å; P323-E328 HydrophobicContact CB-CG 3.88Å; P323-E328 WeakPolarHBondContact CB-OE1 3.39Å; T324-E328 WeakPolarHBondContact O-CG 3.22Å; T324-E328 PolarHBondContact O-N 3.22Å; P325-E328 PolarHBondContact O-N 2.96Å; E326-E328 PolarHBondContact O-N 2.72Å; E328-W331 PolarHBondContact O-N 3.27Å; E328-C332 PolarHBondContact O-N 3.39Å; E328-C332 PolarHBondContact O-SG 3.5Å |
| 329 | T | 87.4 | Confident | 86.5 | Confident | 92 Ų | 92 | 59 Ų | 59 | 56% | 0.564 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -62.8 | -46.5 | 173.1 | 50.2 | 0 | 0 | 0 | 0 | 112.1 | P325 E326 W331 C332 V333 | P325-T329 PolarHBondContact O-N 3.06Å; P325-T329 PolarHBondContact O-OG1 3.12Å; E326-T329 WeakPolarHBondContact CA-OG1 3.35Å; E326-T329 PolarHBondContact O-N 3.12Å; E326-T329 PolarHBondContact O-OG1 3.15Å; T329-W331 VanDerWaalsContact C-N 3.3Å; T329-W331 PolarHBondContact O-N 2.94Å; T329-C332 WeakPolarHBondContact O-CB 3.43Å; T329-C332 PolarHBondContact O-N 3.34Å; T329-C332 VanDerWaalsContact O-N 3.14Å; T329-V333 WeakPolarHBondContact O-CG2 3.34Å; T329-V333 PolarHBondContact O-N 3.38Å; T329-V333 VanDerWaalsContact O-N 3.15Å |
| 330 | A | 89.6 | Confident | 85.7 | Confident | 9 Ų | 9 | 60.2 Ų | 60.2 | 7% | 0.074 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -59.8 | -41.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | I275 E326 V333 A334 | I275-A330 WeakPolarHBondContact O-CB 3.29Å; E326-A330 VanDerWaalsContact O-CB 3.3Å; E326-A330 WeakPolarHBondContact O-CB 3.37Å; E326-A330 PolarHBondContact O-N 3.28Å; A330-V333 WeakPolarHBondContact O-CB 3.48Å; A330-V333 PolarHBondContact O-N 3.2Å; A330-A334 PolarHBondContact O-N 3.18Å |
| 331 | W | 90.2 | Very high | 85.5 | Confident | 38 Ų | 38 | 53.7 Ų | 53.7 | 14% | 0.144 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 174.3 | -178.8 | -103.5 | 0 | 0 | 0 | 113 | A276 L312 C313 R316 G327 E328 T329 V333 A334 S335 | A276-W331 HydrophobicContact CB-CE3 3.71Å; A276-W331 HydrophobicContact CB-CZ3 4.26Å; L312-W331 HydrophobicContact CB-CH2 4.45Å; L312-W331 HydrophobicContact CD2-CH2 4.21Å; L312-W331 HydrophobicContact CD2-CZ3 3.69Å; L312-W331 HydrophobicContact CG-CH2 4.08Å; L312-W331 HydrophobicContact CG-CZ3 3.82Å; C313-W331 HydrophobicContact CB-CZ2 4.48Å; C313-W331 WeakPolarHBondContact SG-CZ2 2.87Å; R316-W331 HydrophobicContact CG-CH2 4.43Å; R316-W331 HydrophobicContact CG-CZ3 4.27Å; R316-W331 VanDerWaalsContact NH1-CE3 3.25Å; G327-W331 WeakPolarHBondContact O-CB 3.38Å; G327-W331 PolarHBondContact O-N 2.49Å; E328-W331 PolarHBondContact O-N 3.27Å; T329-W331 VanDerWaalsContact C-N 3.3Å; T329-W331 PolarHBondContact O-N 2.94Å; W331-V333 VanDerWaalsContact C-N 3.27Å; W331-V333 PolarHBondContact O-N 3.35Å; W331-A334 PolarHBondContact O-N 2.92Å; W331-S335 PolarHBondContact NE1-OG 3.33Å; W331-S335 WeakPolarHBondContact O-CB 3.24Å; W331-S335 PolarHBondContact O-N 3.3Å; W331-S335 PolarHBondContact O-OG 2.81Å |
| 332 | C | 88.8 | Confident | 85.9 | Confident | 87 Ų | 87 | 58.3 Ų | 58.3 | 59% | 0.588 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -59.4 | -40.5 | 173.9 | -72.5 | 0 | 0 | 0 | 0 | 111.3 | E328 T329 S336 | E328-C332 PolarHBondContact O-N 3.39Å; E328-C332 PolarHBondContact O-SG 3.5Å; T329-C332 WeakPolarHBondContact O-CB 3.43Å; T329-C332 PolarHBondContact O-N 3.34Å; T329-C332 VanDerWaalsContact O-N 3.14Å; C332-S336 PolarHBondContact O-N 2.97Å |
| 333 | V | 89.3 | Confident | 86.4 | Confident | 5 Ų | 5 | 58.5 Ų | 58.5 | 3% | 0.03 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -64.7 | -51.7 | 175.1 | -170.8 | 0 | 0 | 0 | 0 | 110.9 | M114 L115 E118 I275 T329 A330 W331 S335 S336 | M114-V333 HydrophobicContact CE-CG2 3.43Å; M114-V333 VanDerWaalsContact CE-CG2 3.43Å; M114-V333 HydrophobicContact CG-CG1 4.45Å; M114-V333 HydrophobicContact CG-CG2 4.05Å; M114-V333 HydrophobicContact SD-CG2 3.77Å; L115-V333 HydrophobicContact CB-CG1 4.18Å; L115-V333 HydrophobicContact CD1-CG1 4.03Å; E118-V333 HydrophobicContact CB-CG1 4.3Å; E118-V333 HydrophobicContact CG-CG1 4.17Å; I275-V333 HydrophobicContact CG2-CB 4.05Å; I275-V333 HydrophobicContact CG2-CG1 3.97Å; T329-V333 WeakPolarHBondContact O-CG2 3.34Å; T329-V333 PolarHBondContact O-N 3.38Å; T329-V333 VanDerWaalsContact O-N 3.15Å; A330-V333 WeakPolarHBondContact O-CB 3.48Å; A330-V333 PolarHBondContact O-N 3.2Å; W331-V333 VanDerWaalsContact C-N 3.27Å; W331-V333 PolarHBondContact O-N 3.35Å; V333-S335 VanDerWaalsContact C-N 3.29Å; V333-S335 PolarHBondContact O-N 2.86Å; V333-S336 WeakPolarHBondContact O-CB 3.39Å; V333-S336 PolarHBondContact O-N 3.01Å; V333-S336 PolarHBondContact O-OG 3.47Å |
| 334 | A | 90.1 | Very high | 87 | Confident | 3 Ų | 3 | 56 Ų | 56 | 3% | 0.025 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.6 | -39.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S272 I275 A276 A330 W331 S336 I337 | S272-A334 WeakPolarHBondContact O-CB 3.47Å; I275-A334 HydrophobicContact CB-CB 4.13Å; I275-A334 HydrophobicContact CG2-CB 3.86Å; A276-A334 HydrophobicContact CB-CB 3.81Å; A330-A334 PolarHBondContact O-N 3.18Å; W331-A334 PolarHBondContact O-N 2.92Å; A334-S336 PolarHBondContact O-N 3.01Å; A334-I337 WeakPolarHBondContact O-CB 3.44Å; A334-I337 WeakPolarHBondContact O-CG1 3.07Å; A334-I337 PolarHBondContact O-N 3.02Å |
| 335 | S | 87.9 | Confident | 87.3 | Confident | 34 Ų | 34 | 53.5 Ų | 53.5 | 24% | 0.238 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -64.7 | -22.6 | 178.6 | -61.6 | 0 | 0 | 0 | 0 | 112.4 | W331 V333 I337 H338 V339 | W331-S335 PolarHBondContact NE1-OG 3.33Å; W331-S335 WeakPolarHBondContact O-CB 3.24Å; W331-S335 PolarHBondContact O-N 3.3Å; W331-S335 PolarHBondContact O-OG 2.81Å; V333-S335 VanDerWaalsContact C-N 3.29Å; V333-S335 PolarHBondContact O-N 2.86Å; S335-I337 PolarHBondContact O-N 3.31Å; S335-H338 CarbonylContact O-C 3.25Å; S335-H338 PolarHBondContact O-N 2.91Å; S335-V339 PolarHBondContact O-N 3Å |
| 336 | S | 87.3 | Confident | 87.8 | Confident | 8 Ų | 8 | 51.7 Ų | 51.7 | 6% | 0.056 | 30% | 0.299 | C | S | . | . | G | 310 helix | trans | -57.4 | -29.2 | 176 | 76.6 | 0 | 0 | 0 | 0 | 113.4 | L115 C332 V333 A334 H338 V339 | L115-S336 WeakPolarHBondContact CD2-OG 3.45Å; C332-S336 PolarHBondContact O-N 2.97Å; V333-S336 WeakPolarHBondContact O-CB 3.39Å; V333-S336 PolarHBondContact O-N 3.01Å; V333-S336 PolarHBondContact O-OG 3.47Å; A334-S336 PolarHBondContact O-N 3.01Å; S336-H338 PolarHBondContact O-N 2.71Å; S336-H338 VanDerWaalsContact O-N 3.16Å; S336-V339 VanDerWaalsContact CA-CG2 3.47Å; S336-V339 PolarHBondContact O-N 3.31Å |
| 337 | I | 86.6 | Confident | 88.3 | Confident | 3 Ų | 3 | 51.2 Ų | 51.2 | 2% | 0.015 | 29% | 0.291 | C | S | . | . | G | 310 helix | trans | -62 | -23.4 | 176.3 | -56.4 | 172.5 | 0 | 0 | 0 | 111.7 | L115 F139 M143 I275 A334 S335 | L115-I337 HydrophobicContact CD1-CD1 4.34Å; L115-I337 HydrophobicContact CD1-CG1 3.96Å; F139-I337 HydrophobicContact CE2-CD1 4.46Å; F139-I337 HydrophobicContact CZ-CD1 4.31Å; F139-I337 HydrophobicContact CZ-CG1 4.2Å; F139-I337 HydrophobicContact CZ-CG2 4.36Å; M143-I337 HydrophobicContact CE-CG2 4.31Å; M143-I337 HydrophobicContact SD-CG2 4.12Å; I275-I337 HydrophobicContact CD1-CD1 4.15Å; A334-I337 WeakPolarHBondContact O-CB 3.44Å; A334-I337 WeakPolarHBondContact O-CG1 3.07Å; A334-I337 PolarHBondContact O-N 3.02Å; S335-I337 PolarHBondContact O-N 3.31Å |
| 338 | H | 84.6 | Confident | 88.9 | Confident | 14 Ų | 14 | 50.6 Ų | 50.6 | 7% | 0.065 | 28% | 0.284 | C | S | . | . | G | 310 helix | trans | -120.5 | 16.9 | -174.5 | -46.8 | -44.9 | 0 | 0 | 0 | 112.7 | A305 G309 S335 S336 G340 S341 L345 | A305-H338 PolarHBondContact O-CE1 3.44Å; A305-H338 PolarHBondContact O-ND1 3.25Å; G309-H338 VanDerWaalsContact CA-CD2 3.43Å; G309-H338 WeakPolarHBondContact CA-CD2 3.39Å; G309-H338 WeakPolarHBondContact CA-NE2 3.37Å; S335-H338 CarbonylContact O-C 3.25Å; S335-H338 PolarHBondContact O-N 2.91Å; S336-H338 PolarHBondContact O-N 2.71Å; S336-H338 VanDerWaalsContact O-N 3.16Å; H338-G340 PolarHBondContact O-N 3.43Å; H338-S341 WeakPolarHBondContact O-CB 3.47Å; H338-S341 PolarHBondContact O-N 2.68Å; H338-S341 PolarHBondContact O-OG 3.06Å; H338-L345 HydrophobicContact CB-CD1 4.03Å |
| 339 | V | 77.8 | Confident | 89.3 | Confident | 81 Ų | 81 | 47.5 Ų | 47.5 | 49% | 0.491 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.5 | 138 | -177.7 | 168.6 | 0 | 0 | 0 | 0 | 110.7 | L101 S335 S336 S341 | L101-V339 VanDerWaalsContact CD1-C 3.43Å; L101-V339 HydrophobicContact CD1-CB 4.09Å; L101-V339 HydrophobicContact CD1-CG1 3.29Å; L101-V339 WeakPolarHBondContact CD1-O 3.25Å; L101-V339 HydrophobicContact CG-CG1 4.49Å; S335-V339 PolarHBondContact O-N 3Å; S336-V339 VanDerWaalsContact CA-CG2 3.47Å; S336-V339 PolarHBondContact O-N 3.31Å; V339-S341 VanDerWaalsContact C-N 3.34Å; V339-S341 PolarHBondContact O-N 2.99Å |
| 340 | G | 76.4 | Confident | 89.8 | Confident | 52 Ų | 52 | 45.1 Ų | 45.1 | 54% | 0.536 | 25% | 0.253 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84 | -2.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 116 | H338 | H338-G340 PolarHBondContact O-N 3.43Š|
| 341 | S | 85.9 | Confident | 90.1 | Very high | 6 Ų | 6 | 45.5 Ų | 45.5 | 4% | 0.042 | 25% | 0.254 | C | S | . | . | trans | -104.7 | 14.9 | -175 | 73.3 | 0 | 0 | 0 | 0 | 114.7 | H306 H338 V339 T343 T344 L345 | H306-S341 WeakPolarHBondContact NE2-CB 3.38Å; H338-S341 WeakPolarHBondContact O-CB 3.47Å; H338-S341 PolarHBondContact O-N 2.68Å; H338-S341 PolarHBondContact O-OG 3.06Å; V339-S341 VanDerWaalsContact C-N 3.34Å; V339-S341 PolarHBondContact O-N 2.99Å; S341-T343 VanDerWaalsContact C-N 3.32Å; S341-T343 PolarHBondContact O-N 2.96Å; S341-T343 VanDerWaalsContact O-N 3.14Å; S341-T344 CarbonylContact O-C 3.54Å; S341-T344 WeakPolarHBondContact O-CA 3.38Å; S341-T344 VanDerWaalsContact O-CB 3.31Å; S341-T344 WeakPolarHBondContact O-CB 3.3Å; S341-T344 PolarHBondContact O-N 2.87Å; S341-L345 PolarHBondContact O-N 3.14Å; S341-L345 WeakPolarHBondContact OG-CG 3.46Å | ||
| 342 | E | 89.1 | Confident | 90.4 | Very high | 161 Ų | 161 | 43.7 Ų | 43.7 | 75% | 0.752 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -50.5 | -45.5 | -170.7 | -64.4 | -177.8 | 176.5 | 0 | 0 | 114.2 | T344 L345 L346 | E342-T344 VanDerWaalsContact C-N 3.32Å; E342-T344 PolarHBondContact O-N 3.33Å; E342-L345 PolarHBondContact O-N 3.41Å; E342-L346 WeakPolarHBondContact O-CB 3.48Å; E342-L346 PolarHBondContact O-N 3.43Å |
| 343 | T | 92.3 | Very high | 90.8 | Very high | 115 Ų | 115 | 39.6 Ų | 39.6 | 71% | 0.706 | 22% | 0.219 | S | C | * | . | H | α-helix | trans | -65.4 | -36.4 | 178.1 | 56.1 | 0 | 0 | 0 | 0 | 112.2 | S341 R347 | S341-T343 VanDerWaalsContact C-N 3.32Å; S341-T343 PolarHBondContact O-N 2.96Å; S341-T343 VanDerWaalsContact O-N 3.14Å; T343-R347 WeakPolarHBondContact O-CB 3.36Å; T343-R347 PolarHBondContact O-N 3.21Å; T343-R347 VanDerWaalsContact O-N 3.09Å |
| 344 | T | 93.9 | Very high | 91 | Very high | 42 Ų | 42 | 40 Ų | 40 | 26% | 0.258 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -71.1 | -45 | 176.8 | -62.2 | 0 | 0 | 0 | 0 | 110.6 | F302 H306 S341 E342 L346 R347 I348 | F302-T344 HydrophobicContact CD1-CG2 3.8Å; F302-T344 HydrophobicContact CE1-CG2 4.1Å; H306-T344 HydrophobicContact CB-CG2 4.36Å; S341-T344 CarbonylContact O-C 3.54Å; S341-T344 WeakPolarHBondContact O-CA 3.38Å; S341-T344 VanDerWaalsContact O-CB 3.31Å; S341-T344 WeakPolarHBondContact O-CB 3.3Å; S341-T344 PolarHBondContact O-N 2.87Å; E342-T344 VanDerWaalsContact C-N 3.32Å; E342-T344 PolarHBondContact O-N 3.33Å; T344-L346 PolarHBondContact O-N 3.38Å; T344-R347 WeakPolarHBondContact O-CB 3.35Å; T344-R347 PolarHBondContact O-N 2.86Å; T344-I348 HydrophobicContact CG2-CD1 3.89Å; T344-I348 VanDerWaalsContact O-CG1 3.3Å; T344-I348 WeakPolarHBondContact O-CG1 3.38Å; T344-I348 PolarHBondContact O-N 3.15Å |
| 345 | L | 94.8 | Very high | 91.3 | Very high | 20 Ų | 20 | 40.1 Ų | 40.1 | 11% | 0.105 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -59.6 | -47.7 | 175.5 | -64.7 | 179.7 | 0 | 0 | 0 | 110.8 | H306 A310 H338 S341 E342 R347 I348 M349 | H306-L345 HydrophobicContact CB-CD2 4.19Å; H306-L345 WeakPolarHBondContact O-CD2 3.31Å; A310-L345 HydrophobicContact CB-CD2 4.13Å; H338-L345 HydrophobicContact CB-CD1 4.03Å; S341-L345 PolarHBondContact O-N 3.14Å; S341-L345 WeakPolarHBondContact OG-CG 3.46Å; E342-L345 PolarHBondContact O-N 3.41Å; L345-R347 VanDerWaalsContact C-N 3.31Å; L345-R347 PolarHBondContact O-N 2.8Å; L345-I348 PolarHBondContact O-N 3.34Å; L345-M349 WeakPolarHBondContact O-CB 3.19Å; L345-M349 WeakPolarHBondContact O-CG 3.48Å; L345-M349 PolarHBondContact O-N 3.36Å |
| 346 | L | 94.7 | Very high | 91.7 | Very high | 76 Ų | 76 | 38.9 Ų | 38.9 | 40% | 0.398 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -55.4 | -48.1 | 175.9 | -170.5 | 96.6 | 0 | 0 | 0 | 110.7 | E342 T344 I348 M349 L350 | E342-L346 WeakPolarHBondContact O-CB 3.48Å; E342-L346 PolarHBondContact O-N 3.43Å; T344-L346 PolarHBondContact O-N 3.38Å; L346-I348 VanDerWaalsContact C-N 3.35Å; L346-I348 PolarHBondContact O-N 2.92Å; L346-M349 PolarHBondContact O-N 3.07Å; L346-L350 HydrophobicContact CD2-CD1 4.14Å; L346-L350 HydrophobicContact CG-CD1 4.21Å; L346-L350 WeakPolarHBondContact O-CG 3.35Å; L346-L350 PolarHBondContact O-N 3.17Å |
| 347 | R | 95.8 | Very high | 91.9 | Very high | 146 Ų | 146 | 39.9 Ų | 39.9 | 55% | 0.551 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -58.2 | -45.3 | 178.1 | -174.5 | 176.1 | -179.8 | -176.1 | -0 | 112.2 | F302 T343 T344 L345 L350 I351 | F302-R347 HydrophobicContact CZ-CG 4.14Å; T343-R347 WeakPolarHBondContact O-CB 3.36Å; T343-R347 PolarHBondContact O-N 3.21Å; T343-R347 VanDerWaalsContact O-N 3.09Å; T344-R347 WeakPolarHBondContact O-CB 3.35Å; T344-R347 PolarHBondContact O-N 2.86Å; L345-R347 VanDerWaalsContact C-N 3.31Å; L345-R347 PolarHBondContact O-N 2.8Å; R347-L350 PolarHBondContact O-N 2.86Å; R347-I351 HydrophobicContact CG-CD1 4.35Å; R347-I351 VanDerWaalsContact O-CG1 3.3Å; R347-I351 WeakPolarHBondContact O-CG1 3.38Å; R347-I351 PolarHBondContact O-N 3.44Å |
| 348 | I | 97.2 | Very high | 92.2 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.7 | -44.1 | 178.3 | -63.9 | 164 | 0 | 0 | 0 | 110.8 | F302 H306 L307 A310 T344 L345 L346 L350 I351 Q352 | F302-I348 HydrophobicContact CB-CD1 3.85Å; F302-I348 HydrophobicContact CB-CG1 4.32Å; F302-I348 HydrophobicContact CD1-CD1 3.9Å; F302-I348 HydrophobicContact CD1-CG1 3.89Å; F302-I348 HydrophobicContact CD2-CD1 4.09Å; F302-I348 HydrophobicContact CD2-CG1 3.59Å; F302-I348 HydrophobicContact CE1-CD1 4.49Å; F302-I348 HydrophobicContact CE1-CG1 4.06Å; F302-I348 HydrophobicContact CE2-CG1 3.79Å; F302-I348 HydrophobicContact CG-CD1 3.68Å; F302-I348 HydrophobicContact CG-CG1 3.66Å; F302-I348 HydrophobicContact CZ-CG1 4.02Å; H306-I348 HydrophobicContact CB-CD1 3.67Å; L307-I348 HydrophobicContact CD2-CD1 4.29Å; L307-I348 HydrophobicContact CD2-CG1 4.39Å; L307-I348 HydrophobicContact CD2-CG2 3.78Å; A310-I348 HydrophobicContact CB-CB 3.57Å; A310-I348 HydrophobicContact CB-CD1 4.43Å; A310-I348 HydrophobicContact CB-CG2 3.34Å; T344-I348 HydrophobicContact CG2-CD1 3.89Å; T344-I348 VanDerWaalsContact O-CG1 3.3Å; T344-I348 WeakPolarHBondContact O-CG1 3.38Å; T344-I348 PolarHBondContact O-N 3.15Å; L345-I348 PolarHBondContact O-N 3.34Å; L346-I348 VanDerWaalsContact C-N 3.35Å; L346-I348 PolarHBondContact O-N 2.92Å; I348-L350 VanDerWaalsContact C-N 3.27Å; I348-L350 PolarHBondContact O-N 2.75Å; I348-I351 WeakPolarHBondContact O-CB 3.3Å; I348-I351 PolarHBondContact O-N 2.95Å; I348-I351 VanDerWaalsContact O-N 3.09Å; I348-Q352 HydrophobicContact CG2-CG 4.23Å; I348-Q352 WeakPolarHBondContact O-CG 3.23Å; I348-Q352 PolarHBondContact O-N 3.25Å |
| 349 | M | 97.1 | Very high | 92.6 | Very high | 5 Ų | 5 | 45.2 Ų | 45.2 | 3% | 0.025 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59.3 | -39.6 | 177.8 | -68.6 | 169 | 67.9 | 0 | 0 | 111.2 | A310 C313 L314 L345 L346 I351 Q352 A353 L392 | A310-M349 HydrophobicContact CB-CG 3.77Å; A310-M349 WeakPolarHBondContact O-CG 3.24Å; C313-M349 HydrophobicContact CB-CE 4.01Å; C313-M349 HydrophobicContact CB-SD 3.84Å; L314-M349 HydrophobicContact CB-CB 4.49Å; L314-M349 HydrophobicContact CB-CE 4.07Å; L314-M349 HydrophobicContact CB-CG 4.18Å; L314-M349 HydrophobicContact CD1-CE 4.37Å; L345-M349 WeakPolarHBondContact O-CB 3.19Å; L345-M349 WeakPolarHBondContact O-CG 3.48Å; L345-M349 PolarHBondContact O-N 3.36Å; L346-M349 PolarHBondContact O-N 3.07Å; M349-I351 VanDerWaalsContact C-N 3.34Å; M349-I351 PolarHBondContact O-N 3.48Å; M349-Q352 PolarHBondContact O-N 2.82Å; M349-A353 WeakPolarHBondContact O-CB 3.45Å; M349-A353 PolarHBondContact O-N 3.09Å; M349-L392 HydrophobicContact CB-CD1 3.68Å; M349-L392 HydrophobicContact CE-CD2 3.53Å |
| 350 | L | 96.3 | Very high | 93.2 | Very high | 42 Ų | 42 | 47 Ų | 47 | 22% | 0.22 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.4 | -40.7 | 175.7 | -66.9 | 166.7 | 0 | 0 | 0 | 111.8 | L346 R347 I348 G354 L392 L394 | L346-L350 HydrophobicContact CD2-CD1 4.14Å; L346-L350 HydrophobicContact CG-CD1 4.21Å; L346-L350 WeakPolarHBondContact O-CG 3.35Å; L346-L350 PolarHBondContact O-N 3.17Å; R347-L350 PolarHBondContact O-N 2.86Å; I348-L350 VanDerWaalsContact C-N 3.27Å; I348-L350 PolarHBondContact O-N 2.75Å; L350-G354 PolarHBondContact O-N 3.2Å; L350-L392 HydrophobicContact CD2-CB 3.59Å; L350-L392 HydrophobicContact CD2-CD1 3.93Å; L350-L392 HydrophobicContact CD2-CG 4.44Å; L350-L392 HydrophobicContact CG-CD1 4.28Å; L350-L394 HydrophobicContact CB-CD1 4.4Å; L350-L394 HydrophobicContact CD2-CD1 3.37Å; L350-L394 HydrophobicContact CD2-CD2 4.17Å; L350-L394 HydrophobicContact CD2-CG 3.46Å; L350-L394 VanDerWaalsContact CD2-CG 3.46Å; L350-L394 HydrophobicContact CG-CD1 4.4Å |
| 351 | I | 96.2 | Very high | 93.7 | Very high | 17 Ų | 17 | 49.2 Ų | 49.2 | 9% | 0.087 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -64.5 | -49.1 | 176.2 | -63.7 | 165 | 0 | 0 | 0 | 110.3 | E296 Q298 F302 R347 I348 M349 G354 A355 | E296-I351 HydrophobicContact CB-CG2 3.97Å; E296-I351 HydrophobicContact CG-CG2 3.92Å; Q298-I351 HydrophobicContact CG-CD1 3.93Å; Q298-I351 HydrophobicContact CG-CG2 4.28Å; F302-I351 HydrophobicContact CE2-CD1 3.75Å; F302-I351 HydrophobicContact CZ-CD1 4.15Å; R347-I351 HydrophobicContact CG-CD1 4.35Å; R347-I351 VanDerWaalsContact O-CG1 3.3Å; R347-I351 WeakPolarHBondContact O-CG1 3.38Å; R347-I351 PolarHBondContact O-N 3.44Å; I348-I351 WeakPolarHBondContact O-CB 3.3Å; I348-I351 PolarHBondContact O-N 2.95Å; I348-I351 VanDerWaalsContact O-N 3.09Å; M349-I351 VanDerWaalsContact C-N 3.34Å; M349-I351 PolarHBondContact O-N 3.48Å; I351-G354 PolarHBondContact O-N 3.35Å; I351-A355 WeakPolarHBondContact O-CB 3.39Å; I351-A355 PolarHBondContact O-N 3.36Å |
| 352 | Q | 97 | Very high | 93.8 | Very high | 1 Ų | 1 | 52.2 Ų | 52.2 | 1% | 0.005 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.3 | -44 | 179.5 | -72.1 | 172.4 | -21.5 | 0 | 0 | 112 | L289 L307 A311 L314 I348 M349 A355 A356 | L289-Q352 HydrophobicContact CB-CB 4.48Å; L289-Q352 HydrophobicContact CD2-CB 4.39Å; L307-Q352 PolarHBondContact O-NE2 3.4Å; A311-Q352 VanDerWaalsContact CA-OE1 3.27Å; L314-Q352 HydrophobicContact CD2-CB 3.84Å; I348-Q352 HydrophobicContact CG2-CG 4.23Å; I348-Q352 WeakPolarHBondContact O-CG 3.23Å; I348-Q352 PolarHBondContact O-N 3.25Å; M349-Q352 PolarHBondContact O-N 2.82Å; Q352-A355 PolarHBondContact O-N 2.89Å; Q352-A356 WeakPolarHBondContact O-CB 3.4Å; Q352-A356 PolarHBondContact O-N 2.88Å |
| 353 | A | 96.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.6 | -44.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | L314 M349 A356 A357 A388 P389 L392 | L314-A353 HydrophobicContact CD1-CB 4.45Å; L314-A353 HydrophobicContact CD2-CB 3.92Å; M349-A353 WeakPolarHBondContact O-CB 3.45Å; M349-A353 PolarHBondContact O-N 3.09Å; A353-A356 PolarHBondContact O-N 3.17Å; A353-A357 WeakPolarHBondContact O-CB 3.44Å; A353-A357 PolarHBondContact O-N 3.49Å; A353-A388 HydrophobicContact CB-CB 3.91Å; A353-P389 HydrophobicContact CB-CG 4.19Å; A353-L392 HydrophobicContact CB-CD1 4Å |
| 354 | G | 94.8 | Very high | 93.7 | Very high | 13 Ų | 13 | 47.6 Ų | 47.6 | 13% | 0.134 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.3 | -39.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L350 I351 R358 | L350-G354 PolarHBondContact O-N 3.2Å; I351-G354 PolarHBondContact O-N 3.35Å; G354-R358 VanDerWaalsContact O-CZ 3.31Å; G354-R358 PolarHBondContact O-N 3.4Å; G354-R358 PolarHBondContact O-NH1 3.38Å; G354-R358 VanDerWaalsContact O-NH1 3.12Å |
| 355 | A | 95.3 | Very high | 93.8 | Very high | 7 Ų | 7 | 50.6 Ų | 50.6 | 6% | 0.058 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.1 | -46.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | L292 E296 I351 Q352 R358 A359 | L292-A355 HydrophobicContact CB-CB 4.33Å; L292-A355 HydrophobicContact CD1-CB 4.46Å; E296-A355 HydrophobicContact CG-CB 4.06Å; I351-A355 WeakPolarHBondContact O-CB 3.39Å; I351-A355 PolarHBondContact O-N 3.36Å; Q352-A355 PolarHBondContact O-N 2.89Å; A355-R358 PolarHBondContact O-N 2.82Å; A355-A359 WeakPolarHBondContact O-CB 3.3Å; A355-A359 PolarHBondContact O-N 3.5Å |
| 356 | A | 95.7 | Very high | 93.9 | Very high | 8 Ų | 8 | 50.1 Ų | 50.1 | 7% | 0.066 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.3 | -42.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y288 L289 L292 Q352 A353 R358 A359 L385 | Y288-A356 HydrophobicContact CE1-CB 4.21Å; L289-A356 HydrophobicContact CD2-CB 3.78Å; L292-A356 HydrophobicContact CD1-CB 3.8Å; Q352-A356 WeakPolarHBondContact O-CB 3.4Å; Q352-A356 PolarHBondContact O-N 2.88Å; A353-A356 PolarHBondContact O-N 3.17Å; A356-R358 PolarHBondContact O-N 3.22Å; A356-A359 WeakPolarHBondContact O-CB 3.49Å; A356-A359 PolarHBondContact O-N 2.95Å; A356-L385 HydrophobicContact CB-CD2 4.03Å |
| 357 | A | 93.2 | Very high | 94 | Very high | 28 Ų | 28 | 46.6 Ų | 46.6 | 23% | 0.231 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.2 | -29.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | A353 P389 | A353-A357 WeakPolarHBondContact O-CB 3.44Å; A353-A357 PolarHBondContact O-N 3.49Å; A357-P389 HydrophobicContact CB-CG 4.22Å |
| 358 | R | 92.4 | Very high | 94.1 | Very high | 124 Ų | 124 | 40.4 Ų | 40.4 | 47% | 0.468 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -97.8 | -5.3 | 177.9 | -60.8 | -170.5 | -55.9 | -86.3 | -2.9 | 113.9 | G354 A355 A356 Q360 S361 K362 | G354-R358 VanDerWaalsContact O-CZ 3.31Å; G354-R358 PolarHBondContact O-N 3.4Å; G354-R358 PolarHBondContact O-NH1 3.38Å; G354-R358 VanDerWaalsContact O-NH1 3.12Å; A355-R358 PolarHBondContact O-N 2.82Å; A356-R358 PolarHBondContact O-N 3.22Å; R358-Q360 VanDerWaalsContact C-N 3.25Å; R358-Q360 PolarHBondContact O-N 3.4Å; R358-S361 PolarHBondContact O-N 3.44Å; R358-S361 VanDerWaalsContact O-N 3.14Å; R358-S361 PolarHBondContact O-OG 3.19Å; R358-K362 WeakPolarHBondContact O-CB 3.3Å; R358-K362 PolarHBondContact O-N 3.49Å |
| 359 | A | 92.6 | Very high | 94.1 | Very high | 5 Ų | 5 | 44.7 Ų | 44.7 | 4% | 0.041 | 23% | 0.233 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -32 | -169.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y288 L292 A355 A356 F368 | Y288-A359 VanDerWaalsContact OH-CB 3.25Å; Y288-A359 WeakPolarHBondContact OH-CB 3.41Å; L292-A359 HydrophobicContact CD1-CB 4.5Å; L292-A359 HydrophobicContact CD2-CB 4.14Å; A355-A359 WeakPolarHBondContact O-CB 3.3Å; A355-A359 PolarHBondContact O-N 3.5Å; A356-A359 WeakPolarHBondContact O-CB 3.49Å; A356-A359 PolarHBondContact O-N 2.95Å; A359-F368 HydrophobicContact CB-CB 4.25Å; A359-F368 HydrophobicContact CB-CD2 4.16Å |
| 360 | Q | 90.4 | Very high | 94.1 | Very high | 118 Ų | 118 | 45.8 Ų | 45.8 | 55% | 0.551 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -74.9 | -33.4 | 178.3 | -170.7 | 176.8 | 16.9 | 0 | 0 | 113.1 | R358 R365 F368 | R358-Q360 VanDerWaalsContact C-N 3.25Å; R358-Q360 PolarHBondContact O-N 3.4Å; Q360-R365 PolarHBondContact O-NE 2.86Å; Q360-F368 HydrophobicContact CB-CD2 4.25Å; Q360-F368 HydrophobicContact CB-CE2 3.85Å; Q360-F368 HydrophobicContact CB-CZ 4.03Å; Q360-F368 HydrophobicContact CG-CE1 4.19Å; Q360-F368 HydrophobicContact CG-CE2 4.18Å; Q360-F368 HydrophobicContact CG-CZ 3.82Å |
| 361 | S | 87.1 | Confident | 94.1 | Very high | 99 Ų | 99 | 43.9 Ų | 43.9 | 69% | 0.692 | 23% | 0.227 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -97.4 | -17.7 | -171.4 | 57.1 | 0 | 0 | 0 | 0 | 114.4 | R358 | R358-S361 PolarHBondContact O-N 3.44Å; R358-S361 VanDerWaalsContact O-N 3.14Å; R358-S361 PolarHBondContact O-OG 3.19Å |
| 362 | K | 86.8 | Confident | 94.1 | Very high | 70 Ų | 70 | 44.7 Ų | 44.7 | 30% | 0.304 | 23% | 0.234 | S | C | . | . | S | Bend | trans | -72.9 | 155.3 | 176.8 | -163.3 | 174.1 | 177.1 | -170.4 | 0 | 110.6 | E296 R358 T364 R365 | E296-K362 IonicContact OE1-NZ 3.8Å; R358-K362 WeakPolarHBondContact O-CB 3.3Å; R358-K362 PolarHBondContact O-N 3.49Å; K362-T364 VanDerWaalsContact C-N 3.33Å; K362-T364 VanDerWaalsContact CD-OG1 3.23Å; K362-T364 WeakPolarHBondContact CD-OG1 3.36Å; K362-T364 VanDerWaalsContact CE-OG1 3.25Å; K362-T364 WeakPolarHBondContact CE-OG1 3.4Å; K362-T364 WeakPolarHBondContact CG-OG1 3.31Å; K362-T364 PolarHBondContact O-N 2.62Å; K362-R365 VanDerWaalsContact O-CD 3.24Å; K362-R365 WeakPolarHBondContact O-CD 3.23Å; K362-R365 WeakPolarHBondContact O-CG 3.43Å |
| 363 | D | 88.3 | Confident | 94 | Very high | 160 Ų | 160 | 47.7 Ų | 47.7 | 86% | 0.856 | 25% | 0.253 | S | S | * | . | S | Bend | trans | -69.3 | -30.4 | 176.7 | -62.1 | -36.7 | 0 | 0 | 0 | 113 | R365 | D363-R365 PolarHBondContact O-N 3.14Š|
| 364 | T | 92.6 | Very high | 93.9 | Very high | 18 Ų | 18 | 51.2 Ų | 51.2 | 11% | 0.11 | 28% | 0.282 | C | S | . | . | trans | -81.8 | 90.1 | 175.7 | 56.7 | 0 | 0 | 0 | 0 | 110.2 | I167 D170 L295 K362 | I167-T364 HydrophobicContact CG1-CG2 4.25Å; D170-T364 HydrophobicContact CB-CG2 3.73Å; D170-T364 VanDerWaalsContact CG-CA 3.49Å; D170-T364 VanDerWaalsContact OD1-CA 3.22Å; D170-T364 WeakPolarHBondContact OD1-CA 3.48Å; D170-T364 WeakPolarHBondContact OD1-CB 3.1Å; L295-T364 HydrophobicContact CD2-CG2 4.43Å; K362-T364 VanDerWaalsContact C-N 3.33Å; K362-T364 VanDerWaalsContact CD-OG1 3.23Å; K362-T364 WeakPolarHBondContact CD-OG1 3.36Å; K362-T364 VanDerWaalsContact CE-OG1 3.25Å; K362-T364 WeakPolarHBondContact CE-OG1 3.4Å; K362-T364 WeakPolarHBondContact CG-OG1 3.31Å; K362-T364 PolarHBondContact O-N 2.62Å | ||
| 365 | R | 95.3 | Very high | 93.8 | Very high | 105 Ų | 105 | 51.9 Ų | 51.9 | 40% | 0.396 | 29% | 0.289 | S | S | . | . | trans | -112.2 | 2.5 | -169.6 | -60.8 | 176.6 | 62.7 | -164.1 | -3.4 | 114.4 | D170 Q360 K362 D363 T367 F368 L369 | D170-R365 PolarHBondContact OD1-N 3.25Å; Q360-R365 PolarHBondContact O-NE 2.86Å; K362-R365 VanDerWaalsContact O-CD 3.24Å; K362-R365 WeakPolarHBondContact O-CD 3.23Å; K362-R365 WeakPolarHBondContact O-CG 3.43Å; D363-R365 PolarHBondContact O-N 3.14Å; R365-T367 PolarHBondContact O-N 3.16Å; R365-F368 WeakPolarHBondContact O-CB 3.35Å; R365-F368 PolarHBondContact O-N 3.24Å; R365-F368 VanDerWaalsContact O-N 3.1Å; R365-L369 HydrophobicContact CB-CD1 4.33Å; R365-L369 HydrophobicContact CB-CG 4.41Å; R365-L369 WeakPolarHBondContact O-CG 3.42Å; R365-L369 PolarHBondContact O-N 3.02Å | ||
| 366 | A | 96.8 | Very high | 93.8 | Very high | 11 Ų | 11 | 52.2 Ų | 52.2 | 9% | 0.091 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -55.6 | -51.8 | -172.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | D170 I173 Q174 F368 L369 K370 | D170-A366 WeakPolarHBondContact O-CB 3.35Å; D170-A366 VanDerWaalsContact OD1-CB 3.24Å; D170-A366 WeakPolarHBondContact OD1-CB 3.44Å; D170-A366 PolarHBondContact OD1-N 3.46Å; I173-A366 HydrophobicContact CB-CB 4.07Å; I173-A366 HydrophobicContact CG2-CB 3.9Å; Q174-A366 HydrophobicContact CG-CB 3.58Å; A366-F368 PolarHBondContact O-N 3.27Å; A366-L369 PolarHBondContact O-N 3.07Å; A366-K370 WeakPolarHBondContact O-CB 3.39Å; A366-K370 PolarHBondContact O-N 3.33Å |
| 367 | T | 97.4 | Very high | 93.8 | Very high | 2 Ų | 2 | 55.8 Ų | 55.8 | 1% | 0.012 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62 | -40.3 | 176.8 | -55.9 | 0 | 0 | 0 | 0 | 112.3 | I173 Y288 E291 L292 R365 L369 K370 Y371 | I173-T367 VanDerWaalsContact CD1-OG1 3.25Å; I173-T367 WeakPolarHBondContact CD1-OG1 3.39Å; Y288-T367 HydrophobicContact CD2-CG2 3.89Å; Y288-T367 HydrophobicContact CE2-CG2 4.01Å; E291-T367 HydrophobicContact CB-CG2 3.95Å; E291-T367 HydrophobicContact CG-CG2 4.08Å; E291-T367 WeakPolarHBondContact OE1-CG2 3.25Å; E291-T367 PolarHBondContact OE1-OG1 3.45Å; L292-T367 HydrophobicContact CD2-CG2 3.85Å; L292-T367 HydrophobicContact CG-CG2 3.99Å; R365-T367 PolarHBondContact O-N 3.16Å; T367-L369 VanDerWaalsContact C-N 3.34Å; T367-L369 PolarHBondContact O-N 3.4Å; T367-K370 PolarHBondContact O-N 3.12Å; T367-Y371 HydrophobicContact CG2-CD2 3.99Å; T367-Y371 HydrophobicContact CG2-CE2 4.11Å; T367-Y371 VanDerWaalsContact O-CD2 3.32Å; T367-Y371 WeakPolarHBondContact O-CD2 3.43Å; T367-Y371 PolarHBondContact O-N 2.99Å; T367-Y371 VanDerWaalsContact O-N 3.16Å |
| 368 | F | 97.4 | Very high | 94 | Very high | 16 Ų | 16 | 59.2 Ų | 59.2 | 7% | 0.07 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.3 | -46.7 | 177.1 | 174.8 | -91 | 0 | 0 | 0 | 111.4 | A359 Q360 R365 A366 S372 S380 | A359-F368 HydrophobicContact CB-CB 4.25Å; A359-F368 HydrophobicContact CB-CD2 4.16Å; Q360-F368 HydrophobicContact CB-CD2 4.25Å; Q360-F368 HydrophobicContact CB-CE2 3.85Å; Q360-F368 HydrophobicContact CB-CZ 4.03Å; Q360-F368 HydrophobicContact CG-CE1 4.19Å; Q360-F368 HydrophobicContact CG-CE2 4.18Å; Q360-F368 HydrophobicContact CG-CZ 3.82Å; R365-F368 WeakPolarHBondContact O-CB 3.35Å; R365-F368 PolarHBondContact O-N 3.24Å; R365-F368 VanDerWaalsContact O-N 3.1Å; A366-F368 PolarHBondContact O-N 3.27Å; F368-S372 WeakPolarHBondContact O-CB 3.44Å; F368-S372 PolarHBondContact O-N 3.26Å; F368-S372 VanDerWaalsContact O-N 3.15Å; F368-S380 WeakPolarHBondContact CE2-O 3.24Å; F368-S380 WeakPolarHBondContact O-CB 3.5Å; F368-S380 PolarHBondContact O-OG 2.9Å |
| 369 | L | 97 | Very high | 94.2 | Very high | 90 Ų | 90 | 53.3 Ų | 53.3 | 47% | 0.471 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -66.7 | -45.5 | -179.5 | -66.5 | 172.1 | 0 | 0 | 0 | 111.5 | R365 A366 T367 Y371 S372 | R365-L369 HydrophobicContact CB-CD1 4.33Å; R365-L369 HydrophobicContact CB-CG 4.41Å; R365-L369 WeakPolarHBondContact O-CG 3.42Å; R365-L369 PolarHBondContact O-N 3.02Å; A366-L369 PolarHBondContact O-N 3.07Å; T367-L369 VanDerWaalsContact C-N 3.34Å; T367-L369 PolarHBondContact O-N 3.4Å; L369-Y371 VanDerWaalsContact C-N 3.29Å; L369-Y371 PolarHBondContact O-N 3.22Å; L369-S372 WeakPolarHBondContact O-CB 3.48Å; L369-S372 PolarHBondContact O-N 3.01Å; L369-S372 VanDerWaalsContact O-N 3.09Å; L369-S372 PolarHBondContact O-OG 2.98Å |
| 370 | K | 96.4 | Very high | 94.4 | Very high | 28 Ų | 28 | 53.3 Ų | 53.3 | 12% | 0.122 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -51.4 | -47.3 | 175.9 | 177 | 178.4 | 174.8 | 174.8 | 0 | 112 | E177 E291 A366 T367 S372 | E177-K370 HydrophobicContact CG-CD 4.17Å; E177-K370 WeakPolarHBondContact OE1-CD 3.49Å; E177-K370 WeakPolarHBondContact OE1-CE 3.42Å; E177-K370 IonicContact OE1-NZ 3.96Å; E177-K370 PolarHBondContact OE1-NZ 3.22Å; E291-K370 IonicContact OE1-NZ 3.99Å; E291-K370 WeakPolarHBondContact OE2-CE 3.48Å; E291-K370 IonicContact OE2-NZ 3.17Å; E291-K370 PolarHBondContact OE2-NZ 3.18Å; A366-K370 WeakPolarHBondContact O-CB 3.39Å; A366-K370 PolarHBondContact O-N 3.33Å; T367-K370 PolarHBondContact O-N 3.12Å; K370-S372 PolarHBondContact O-N 3.44Å |
| 371 | Y | 97.8 | Very high | 94.6 | Very high | 1 Ų | 1 | 51 Ų | 51 | 0% | 0.004 | 29% | 0.292 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | 4.3 | -177.5 | -72.1 | -96.8 | 0 | 0 | 0 | 115 | E183 W284 R287 Y288 E291 T367 L369 T373 T376 V379 S380 | E183-Y371 PolarHBondContact OE1-OH 3.08Å; W284-Y371 HydrophobicContact CE3-CD1 4.45Å; W284-Y371 HydrophobicContact CE3-CE1 4.05Å; W284-Y371 HydrophobicContact CZ3-CE1 4.35Å; R287-Y371 HydrophobicContact CB-CE1 3.8Å; Y288-Y371 HydrophobicContact CD2-CD1 4.4Å; Y288-Y371 AromaticContact CD2-CD2 3.84Å; Y288-Y371 HydrophobicContact CD2-CD2 3.84Å; Y288-Y371 AromaticContact CD2-CG 3.71Å; Y288-Y371 HydrophobicContact CD2-CG 3.71Å; Y288-Y371 HydrophobicContact CG-CD1 4.4Å; Y288-Y371 HydrophobicContact CG-CG 4.13Å; E291-Y371 HydrophobicContact CB-CE2 4.22Å; E291-Y371 WeakPolarHBondContact OE2-CE2 3.2Å; E291-Y371 PolarHBondContact OE2-OH 3.5Å; E291-Y371 VanDerWaalsContact OE2-OH 3.08Å; T367-Y371 HydrophobicContact CG2-CD2 3.99Å; T367-Y371 HydrophobicContact CG2-CE2 4.11Å; T367-Y371 VanDerWaalsContact O-CD2 3.32Å; T367-Y371 WeakPolarHBondContact O-CD2 3.43Å; T367-Y371 PolarHBondContact O-N 2.99Å; T367-Y371 VanDerWaalsContact O-N 3.16Å; L369-Y371 VanDerWaalsContact C-N 3.29Å; L369-Y371 PolarHBondContact O-N 3.22Å; Y371-T373 VanDerWaalsContact C-N 3.31Å; Y371-T376 VanDerWaalsContact CA-OG1 3.24Å; Y371-T376 WeakPolarHBondContact CA-OG1 3.41Å; Y371-T376 HydrophobicContact CD1-CG2 4.08Å; Y371-T376 PolarHBondContact O-OG1 3.3Å; Y371-V379 HydrophobicContact CD1-CG2 3.9Å; Y371-V379 HydrophobicContact CG-CG2 4.43Å; Y371-V379 PolarHBondContact O-N 3.36Å; Y371-S380 PolarHBondContact O-N 2.94Å; Y371-S380 PolarHBondContact O-OG 3.29Å |
| 372 | S | 96.3 | Very high | 94.9 | Very high | 34 Ų | 34 | 48 Ų | 48 | 24% | 0.238 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | -1.9 | 177.6 | 72.9 | 0 | 0 | 0 | 0 | 113.6 | F368 L369 K370 H378 S380 | F368-S372 WeakPolarHBondContact O-CB 3.44Å; F368-S372 PolarHBondContact O-N 3.26Å; F368-S372 VanDerWaalsContact O-N 3.15Å; L369-S372 WeakPolarHBondContact O-CB 3.48Å; L369-S372 PolarHBondContact O-N 3.01Å; L369-S372 VanDerWaalsContact O-N 3.09Å; L369-S372 PolarHBondContact O-OG 2.98Å; K370-S372 PolarHBondContact O-N 3.44Å; S372-H378 PolarHBondContact O-CE1 2.81Å; S372-H378 PolarHBondContact O-ND1 2.96Å; S372-S380 WeakPolarHBondContact CA-OG 3.29Å; S372-S380 WeakPolarHBondContact CB-OG 3.3Å; S372-S380 PolarHBondContact N-OG 3.4Å; S372-S380 VanDerWaalsContact N-OG 3.12Å |
| 373 | T | 95.2 | Very high | 95.1 | Very high | 65 Ų | 65 | 49.2 Ų | 49.2 | 40% | 0.399 | 28% | 0.282 | S | S | . | . | S | Bend | trans | -85.1 | 161.9 | -174.7 | 71.8 | 0 | 0 | 0 | 0 | 112.4 | Y371 G375 T376 M377 H378 | Y371-T373 VanDerWaalsContact C-N 3.31Å; T373-G375 PolarHBondContact O-N 3.27Å; T373-G375 PolarHBondContact OG1-N 3.21Å; T373-T376 PolarHBondContact N-OG1 3.06Å; T373-T376 PolarHBondContact O-N 3.43Å; T373-T376 PolarHBondContact O-OG1 3.26Å; T373-T376 PolarHBondContact OG1-N 2.85Å; T373-T376 PolarHBondContact OG1-OG1 2.84Å; T373-M377 PolarHBondContact O-N 2.84Å; T373-H378 PolarHBondContact O-N 3.46Å |
| 374 | A | 93.8 | Very high | 95.3 | Very high | 74 Ų | 74 | 43.2 Ų | 43.2 | 61% | 0.612 | 25% | 0.253 | S | S | * | . | G | 310 helix | trans | -62.8 | -29.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | T376 M377 H378 | A374-T376 PolarHBondContact O-N 3.11Å; A374-M377 PolarHBondContact O-N 3.19Å; A374-M377 VanDerWaalsContact O-N 3.12Å; A374-H378 WeakPolarHBondContact CA-NE2 3.18Å; A374-H378 PolarHBondContact N-CE1 3.12Å; A374-H378 VanDerWaalsContact N-CE1 3.31Å |
| 375 | G | 92.6 | Very high | 95.2 | Very high | 27 Ų | 27 | 42.6 Ų | 42.6 | 28% | 0.278 | 25% | 0.249 | S | C | . | . | G | 310 helix | trans | -61.3 | -33 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | R24 T373 | R24-G375 VanDerWaalsContact NH2-CA 3.31Å; R24-G375 PolarHBondContact NH2-O 3.14Å; R24-G375 VanDerWaalsContact NH2-O 3.13Å; T373-G375 PolarHBondContact O-N 3.27Å; T373-G375 PolarHBondContact OG1-N 3.21Å |
| 376 | T | 94.8 | Very high | 94.7 | Very high | 13 Ų | 13 | 43.3 Ų | 43.3 | 8% | 0.08 | 26% | 0.26 | C | S | . | . | G | 310 helix | trans | -102.6 | 19.8 | 177.9 | 57.2 | 0 | 0 | 0 | 0 | 112.4 | W284 Y371 T373 A374 H378 V379 | W284-T376 HydrophobicContact CE3-CG2 4.08Å; W284-T376 HydrophobicContact CZ3-CG2 4.02Å; Y371-T376 VanDerWaalsContact CA-OG1 3.24Å; Y371-T376 WeakPolarHBondContact CA-OG1 3.41Å; Y371-T376 HydrophobicContact CD1-CG2 4.08Å; Y371-T376 PolarHBondContact O-OG1 3.3Å; T373-T376 PolarHBondContact N-OG1 3.06Å; T373-T376 PolarHBondContact O-N 3.43Å; T373-T376 PolarHBondContact O-OG1 3.26Å; T373-T376 PolarHBondContact OG1-N 2.85Å; T373-T376 PolarHBondContact OG1-OG1 2.84Å; A374-T376 PolarHBondContact O-N 3.11Å; T376-H378 PolarHBondContact O-N 3.49Å; T376-H378 VanDerWaalsContact O-N 3.12Å; T376-V379 WeakPolarHBondContact O-CG1 3.18Å; T376-V379 WeakPolarHBondContact O-CG2 3.43Å; T376-V379 PolarHBondContact O-N 2.96Å |
| 377 | M | 96.5 | Very high | 94.2 | Very high | 84 Ų | 84 | 45.2 Ų | 45.2 | 41% | 0.414 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 56.1 | 27.6 | 179.5 | -57.4 | -174.4 | 162.7 | 0 | 0 | 114.7 | A280 K281 T373 A374 V379 | A280-M377 HydrophobicContact CB-CE 3.82Å; A280-M377 HydrophobicContact CB-SD 4.35Å; K281-M377 HydrophobicContact CB-SD 3.81Å; K281-M377 HydrophobicContact CG-SD 4.22Å; T373-M377 PolarHBondContact O-N 2.84Å; A374-M377 PolarHBondContact O-N 3.19Å; A374-M377 VanDerWaalsContact O-N 3.12Å; M377-V379 HydrophobicContact CB-CG1 4.21Å; M377-V379 PolarHBondContact O-N 3.2Å |
| 378 | H | 96.3 | Very high | 93.4 | Very high | 99 Ų | 99 | 45.1 Ų | 45.1 | 46% | 0.458 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.7 | 28.2 | -179.2 | -55.9 | -76.2 | 0 | 0 | 0 | 114.2 | S372 T373 A374 T376 S380 S381 | S372-H378 PolarHBondContact O-CE1 2.81Å; S372-H378 PolarHBondContact O-ND1 2.96Å; T373-H378 PolarHBondContact O-N 3.46Å; A374-H378 WeakPolarHBondContact CA-NE2 3.18Å; A374-H378 PolarHBondContact N-CE1 3.12Å; A374-H378 VanDerWaalsContact N-CE1 3.31Å; T376-H378 PolarHBondContact O-N 3.49Å; T376-H378 VanDerWaalsContact O-N 3.12Å; H378-S380 VanDerWaalsContact C-N 3.25Å; H378-S380 PolarHBondContact O-N 3.09Å; H378-S381 PolarHBondContact O-N 2.89Å |
| 379 | V | 96.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 28% | 0.275 | C | S | . | . | G | 310 helix | trans | -60.2 | -32.5 | -171.9 | -68.9 | 0 | 0 | 0 | 0 | 113.1 | K281 W284 M285 Y288 Y371 T376 M377 S381 H382 L385 | K281-V379 HydrophobicContact CG-CG1 4.39Å; W284-V379 HydrophobicContact CB-CG1 3.84Å; W284-V379 HydrophobicContact CB-CG2 4.32Å; M285-V379 HydrophobicContact CB-CB 4.37Å; M285-V379 HydrophobicContact CB-CG1 4.23Å; M285-V379 HydrophobicContact CE-CB 3.93Å; M285-V379 HydrophobicContact CE-CG1 4.31Å; M285-V379 WeakPolarHBondContact CE-O 3.15Å; M285-V379 HydrophobicContact SD-CB 4.14Å; Y288-V379 HydrophobicContact CG-CG2 4.43Å; Y371-V379 HydrophobicContact CD1-CG2 3.9Å; Y371-V379 HydrophobicContact CG-CG2 4.43Å; Y371-V379 PolarHBondContact O-N 3.36Å; T376-V379 WeakPolarHBondContact O-CG1 3.18Å; T376-V379 WeakPolarHBondContact O-CG2 3.43Å; T376-V379 PolarHBondContact O-N 2.96Å; M377-V379 HydrophobicContact CB-CG1 4.21Å; M377-V379 PolarHBondContact O-N 3.2Å; V379-S381 PolarHBondContact O-N 3.3Å; V379-H382 WeakPolarHBondContact O-CB 3.32Å; V379-H382 PolarHBondContact O-N 3.41Å; V379-L385 VanDerWaalsContact O-CD1 3.23Å; V379-L385 WeakPolarHBondContact O-CD1 3.42Å |
| 380 | S | 96.6 | Very high | 91.7 | Very high | 6 Ų | 6 | 43.8 Ų | 43.8 | 4% | 0.042 | 27% | 0.27 | C | S | . | . | G | 310 helix | trans | -67.2 | -22.6 | 178.5 | 67.2 | 0 | 0 | 0 | 0 | 113.5 | F368 Y371 S372 H378 | F368-S380 WeakPolarHBondContact CE2-O 3.24Å; F368-S380 WeakPolarHBondContact O-CB 3.5Å; F368-S380 PolarHBondContact O-OG 2.9Å; Y371-S380 PolarHBondContact O-N 2.94Å; Y371-S380 PolarHBondContact O-OG 3.29Å; S372-S380 WeakPolarHBondContact CA-OG 3.29Å; S372-S380 WeakPolarHBondContact CB-OG 3.3Å; S372-S380 PolarHBondContact N-OG 3.4Å; S372-S380 VanDerWaalsContact N-OG 3.12Å; H378-S380 VanDerWaalsContact C-N 3.25Å; H378-S380 PolarHBondContact O-N 3.09Å |
| 381 | S | 94.8 | Very high | 90.7 | Very high | 68 Ų | 68 | 45.7 Ų | 45.7 | 48% | 0.476 | 28% | 0.281 | S | S | . | . | G | 310 helix | trans | -96.7 | 9.3 | -179.4 | -57.9 | 0 | 0 | 0 | 0 | 112.9 | H378 V379 | H378-S381 PolarHBondContact O-N 2.89Å; V379-S381 PolarHBondContact O-N 3.3Å |
| 382 | H | 94.8 | Very high | 89.8 | Confident | 38 Ų | 38 | 46.6 Ų | 46.6 | 18% | 0.176 | 29% | 0.286 | C | S | . | . | trans | -66.9 | 127 | -178.7 | -165.4 | -84.3 | 0 | 0 | 0 | 111.4 | M285 V379 S384 L385 | M285-H382 HydrophobicContact CE-CB 3.66Å; V379-H382 WeakPolarHBondContact O-CB 3.32Å; V379-H382 PolarHBondContact O-N 3.41Å; H382-S384 VanDerWaalsContact C-N 3.3Å; H382-S384 PolarHBondContact CE1-OG 2.88Å; H382-S384 VanDerWaalsContact CE1-OG 3.29Å; H382-S384 WeakPolarHBondContact ND1-CB 3.49Å; H382-S384 PolarHBondContact ND1-N 3.34Å; H382-S384 PolarHBondContact O-N 3.38Å; H382-L385 HydrophobicContact CB-CD1 4.14Å; H382-L385 HydrophobicContact CB-CG 4.28Å; H382-L385 WeakPolarHBondContact O-CB 3.5Å; H382-L385 PolarHBondContact O-N 3.4Å | ||
| 383 | P | 90.8 | Very high | 88.3 | Confident | 95 Ų | 95 | 48.1 Ų | 48.1 | 62% | 0.617 | 31% | 0.307 | S | S | * | . | G | 310 helix | trans | -62.5 | -34.4 | -171.1 | 23.1 | -33.9 | 0 | 0 | 0 | 113.3 | L385 L386 | P383-L385 PolarHBondContact O-N 3.32Å; P383-L385 VanDerWaalsContact O-N 3.09Å; P383-L386 PolarHBondContact O-N 3.26Å |
| 384 | S | 90.8 | Very high | 86.3 | Confident | 34 Ų | 34 | 48.7 Ų | 48.7 | 24% | 0.238 | 31% | 0.308 | C | S | . | . | G | 310 helix | trans | -65.7 | -9.2 | 178.7 | -47.5 | 0 | 0 | 0 | 0 | 114.4 | V318 H382 L386 S387 A388 | V318-S384 WeakPolarHBondContact O-CB 3.48Å; H382-S384 VanDerWaalsContact C-N 3.3Å; H382-S384 PolarHBondContact CE1-OG 2.88Å; H382-S384 VanDerWaalsContact CE1-OG 3.29Å; H382-S384 WeakPolarHBondContact ND1-CB 3.49Å; H382-S384 PolarHBondContact ND1-N 3.34Å; H382-S384 PolarHBondContact O-N 3.38Å; S384-L386 VanDerWaalsContact C-N 3.33Å; S384-S387 PolarHBondContact O-OG 3.5Å; S384-A388 PolarHBondContact O-N 3.17Å |
| 385 | L | 91.1 | Very high | 83.9 | Confident | 5 Ų | 5 | 50.5 Ų | 50.5 | 3% | 0.026 | 31% | 0.313 | C | S | . | . | G | 310 helix | trans | -70.9 | -29.2 | 173.6 | -72.4 | 171.1 | 0 | 0 | 0 | 112.5 | M285 Y288 L289 V318 A356 V379 H382 P383 S387 A388 | M285-L385 HydrophobicContact CE-CD1 4.35Å; M285-L385 HydrophobicContact CE-CG 4.43Å; M285-L385 HydrophobicContact SD-CD1 4.08Å; M285-L385 HydrophobicContact SD-CD2 3.84Å; M285-L385 HydrophobicContact SD-CG 4.25Å; Y288-L385 HydrophobicContact CD1-CD1 4.32Å; Y288-L385 HydrophobicContact CE1-CD1 3.72Å; L289-L385 HydrophobicContact CD2-CD2 4.21Å; V318-L385 HydrophobicContact CG1-CD2 3.97Å; V318-L385 HydrophobicContact CG1-CG 4.23Å; V318-L385 HydrophobicContact CG2-CD2 4.29Å; A356-L385 HydrophobicContact CB-CD2 4.03Å; V379-L385 VanDerWaalsContact O-CD1 3.23Å; V379-L385 WeakPolarHBondContact O-CD1 3.42Å; H382-L385 HydrophobicContact CB-CD1 4.14Å; H382-L385 HydrophobicContact CB-CG 4.28Å; H382-L385 WeakPolarHBondContact O-CB 3.5Å; H382-L385 PolarHBondContact O-N 3.4Å; P383-L385 PolarHBondContact O-N 3.32Å; P383-L385 VanDerWaalsContact O-N 3.09Å; L385-S387 VanDerWaalsContact C-N 3.31Å; L385-S387 PolarHBondContact O-N 3.07Å; L385-A388 WeakPolarHBondContact O-CB 3.35Å; L385-A388 PolarHBondContact O-N 3.09Å |
| 386 | L | 85.8 | Confident | 81.6 | Confident | 120 Ų | 120 | 53 Ų | 53 | 63% | 0.628 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.5 | -35.3 | 176.8 | -65.2 | 173 | 0 | 0 | 0 | 111.6 | P383 S384 | P383-L386 PolarHBondContact O-N 3.26Å; S384-L386 VanDerWaalsContact C-N 3.33Å |
| 387 | S | 85.2 | Confident | 78.9 | Confident | 50 Ų | 50 | 58.9 Ų | 58.9 | 35% | 0.35 | 36% | 0.359 | S | S | . | . | S | Bend | trans | -93.3 | 0.3 | 176.9 | 57.1 | 0 | 0 | 0 | 0 | 113.5 | S384 L385 P389 C390 L391 | S384-S387 PolarHBondContact O-OG 3.5Å; L385-S387 VanDerWaalsContact C-N 3.31Å; L385-S387 PolarHBondContact O-N 3.07Å; S387-P389 VanDerWaalsContact C-CD 3.46Å; S387-P389 VanDerWaalsContact C-N 3.35Å; S387-C390 WeakPolarHBondContact O-CA 3.43Å; S387-C390 WeakPolarHBondContact O-CB 3.19Å; S387-C390 PolarHBondContact O-N 3.33Å; S387-L391 PolarHBondContact O-N 3.5Å; S387-L391 VanDerWaalsContact O-N 3.13Å |
| 388 | A | 80.8 | Confident | 76 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -56.2 | -38.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114 | V318 A353 S384 L385 C390 L391 L392 | V318-A388 HydrophobicContact CG2-CB 3.96Å; A353-A388 HydrophobicContact CB-CB 3.91Å; S384-A388 PolarHBondContact O-N 3.17Å; L385-A388 WeakPolarHBondContact O-CB 3.35Å; L385-A388 PolarHBondContact O-N 3.09Å; A388-C390 PolarHBondContact O-N 3.21Å; A388-L391 WeakPolarHBondContact O-CB 3.49Å; A388-L391 PolarHBondContact O-N 2.92Å; A388-L392 PolarHBondContact O-N 3.13Å |
| 389 | P | 80.7 | Confident | 73 | Confident | 23 Ų | 23 | 67.8 Ų | 67.8 | 15% | 0.149 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -59.3 | -36 | 172.9 | -25.6 | 36.2 | 0 | 0 | 0 | 113 | A353 A357 S387 L392 G393 L394 | A353-P389 HydrophobicContact CB-CG 4.19Å; A357-P389 HydrophobicContact CB-CG 4.22Å; S387-P389 VanDerWaalsContact C-CD 3.46Å; S387-P389 VanDerWaalsContact C-N 3.35Å; P389-L392 PolarHBondContact O-N 3.21Å; P389-G393 PolarHBondContact O-N 3.01Å; P389-L394 HydrophobicContact CB-CB 4.33Å; P389-L394 HydrophobicContact CB-CD1 4.19Å; P389-L394 WeakPolarHBondContact O-CB 3.15Å; P389-L394 PolarHBondContact O-N 3.09Å; P389-L394 VanDerWaalsContact O-N 3.11Å |
| 390 | C | 77.6 | Confident | 71.8 | Confident | 55 Ų | 55 | 71.2 Ų | 71.2 | 37% | 0.372 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -68.7 | -37.2 | 178 | -44.3 | 0 | 0 | 0 | 0 | 111.6 | S387 A388 L392 G393 T396 | S387-C390 WeakPolarHBondContact O-CA 3.43Å; S387-C390 WeakPolarHBondContact O-CB 3.19Å; S387-C390 PolarHBondContact O-N 3.33Å; A388-C390 PolarHBondContact O-N 3.21Å; C390-L392 PolarHBondContact O-N 3.48Å; C390-L392 VanDerWaalsContact O-N 3.09Å; C390-G393 PolarHBondContact O-N 3.11Å; C390-T396 WeakPolarHBondContact SG-CG2 3.42Å |
| 391 | L | 76.6 | Confident | 70.5 | Confident | 68 Ų | 68 | 74.6 Ų | 74.6 | 36% | 0.356 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.8 | -17.8 | 174.9 | -61.2 | 178.1 | 0 | 0 | 0 | 112.7 | V318 S387 A388 | V318-L391 HydrophobicContact CG2-CD1 4.39Å; S387-L391 PolarHBondContact O-N 3.5Å; S387-L391 VanDerWaalsContact O-N 3.13Å; A388-L391 WeakPolarHBondContact O-CB 3.49Å; A388-L391 PolarHBondContact O-N 2.92Å |
| 392 | L | 78.2 | Confident | 69.1 | Low | 20 Ų | 20 | 74.9 Ų | 74.9 | 11% | 0.105 | 46% | 0.455 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.4 | 6.6 | 178.5 | -54.3 | 179.7 | 0 | 0 | 0 | 113.2 | L314 M349 L350 A353 A388 P389 C390 | L314-L392 HydrophobicContact CD1-CD1 4.07Å; L314-L392 HydrophobicContact CD1-CD2 4.31Å; L314-L392 HydrophobicContact CD1-CG 4.41Å; M349-L392 HydrophobicContact CB-CD1 3.68Å; M349-L392 HydrophobicContact CE-CD2 3.53Å; L350-L392 HydrophobicContact CD2-CB 3.59Å; L350-L392 HydrophobicContact CD2-CD1 3.93Å; L350-L392 HydrophobicContact CD2-CG 4.44Å; L350-L392 HydrophobicContact CG-CD1 4.28Å; A353-L392 HydrophobicContact CB-CD1 4Å; A388-L392 PolarHBondContact O-N 3.13Å; P389-L392 PolarHBondContact O-N 3.21Å; C390-L392 PolarHBondContact O-N 3.48Å; C390-L392 VanDerWaalsContact O-N 3.09Å |
| 393 | G | 64.8 | Low | 67.6 | Low | 66 Ų | 66 | 77.1 Ų | 77.1 | 68% | 0.68 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.8 | 16.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | P389 C390 | P389-G393 PolarHBondContact O-N 3.01Å; C390-G393 PolarHBondContact O-N 3.11Å |
| 394 | L | 53.6 | Low | 66.2 | Low | 78 Ų | 78 | 76 Ų | 76 | 41% | 0.408 | 46% | 0.462 | S | S | . | . | trans | -82 | 134.5 | 168.7 | -70.7 | 173.6 | 0 | 0 | 0 | 111 | L350 P389 T396 | L350-L394 HydrophobicContact CB-CD1 4.4Å; L350-L394 HydrophobicContact CD2-CD1 3.37Å; L350-L394 HydrophobicContact CD2-CD2 4.17Å; L350-L394 HydrophobicContact CD2-CG 3.46Å; L350-L394 VanDerWaalsContact CD2-CG 3.46Å; L350-L394 HydrophobicContact CG-CD1 4.4Å; P389-L394 HydrophobicContact CB-CB 4.33Å; P389-L394 HydrophobicContact CB-CD1 4.19Å; P389-L394 WeakPolarHBondContact O-CB 3.15Å; P389-L394 PolarHBondContact O-N 3.09Å; P389-L394 VanDerWaalsContact O-N 3.11Å; L394-T396 PolarHBondContact O-N 3.4Å | ||
| 395 | P | 44.1 | Very low | 64.5 | Low | 112 Ų | 112 | 78.8 Ų | 78.8 | 73% | 0.727 | 48% | 0.477 | S | S | * | . | trans | -64.1 | 132.2 | 169.1 | 25.7 | -30.1 | 0 | 0 | 0 | 109.4 | T397 | P395-T397 PolarHBondContact O-N 2.9Š| ||
| 396 | T | 43.2 | Very low | 62.6 | Low | 79 Ų | 79 | 84.1 Ų | 84.1 | 49% | 0.485 | 51% | 0.509 | S | S | . | . | trans | -59.7 | 108.8 | 169.3 | 46.2 | 0 | 0 | 0 | 0 | 108.8 | C390 L394 H398 | C390-T396 WeakPolarHBondContact SG-CG2 3.42Å; L394-T396 PolarHBondContact O-N 3.4Å; T396-H398 VanDerWaalsContact CB-CD2 3.48Å; T396-H398 WeakPolarHBondContact CB-CD2 3.48Å; T396-H398 PolarHBondContact O-N 3.42Å; T396-H398 PolarHBondContact OG1-CD2 3.05Å | ||
| 397 | T | 38.4 | Very low | 60.8 | Low | 137 Ų | 137 | 81.3 Ų | 81.3 | 84% | 0.84 | 50% | 0.5 | S | S | * | . | trans | -72 | 82.1 | 157.2 | 54.3 | 0 | 0 | 0 | 0 | 106.8 | P395 T399 | P395-T397 PolarHBondContact O-N 2.9Å; T397-T399 PolarHBondContact O-N 3.4Å | ||
| 398 | H | 35.2 | Very low | 58.8 | Low | 159 Ų | 159 | 83.9 Ų | 83.9 | 74% | 0.736 | 51% | 0.512 | S | S | * | . | trans | -67.3 | 120.3 | 158.7 | -81 | -73.2 | 0 | 0 | 0 | 106.7 | T396 | T396-H398 VanDerWaalsContact CB-CD2 3.48Å; T396-H398 WeakPolarHBondContact CB-CD2 3.48Å; T396-H398 PolarHBondContact O-N 3.42Å; T396-H398 PolarHBondContact OG1-CD2 3.05Å | ||
| 399 | T | 32.7 | Very low | 56.8 | Low | 210 Ų | 210 | 91.5 Ų | 91.5 | 100% | 1.288 | 56% | 0.559 | S | S | * | * | trans | -54.6 | 0 | 163.7 | 46.7 | 0 | 0 | 0 | 0 | 111.4 | T397 | T397-T399 PolarHBondContact O-N 3.4Š|
Retrieved 399 of 399 residues in 101.6 ms
(Link to these results)